USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=20 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= 0.992 USER MOD Set 1.2: A 513 LYS NZ :NH3+ -106:sc= 1.18 (180deg=0) USER MOD Set 2.1: A 475 THR OG1 : rot -150:sc= 0 USER MOD Set 2.2: A 491 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 467 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 468 TYR OH : rot 175:sc= 0 USER MOD Set 4.1: A 461 LYS NZ :NH3+ -126:sc= 0.452 (180deg=0) USER MOD Set 4.2: A 466 HIS : no HD1:sc= 0.129 K(o=0.58,f=-1) USER MOD Set 5.1: A 446 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 462 SER OG : rot 180:sc= 0 USER MOD Single : A 443 MET CE :methyl -177:sc= 0 (180deg=-0.00603) USER MOD Single : A 445 LYS NZ :NH3+ -162:sc= 3.01 (180deg=2.19) USER MOD Single : A 448 THR OG1 : rot 180:sc= -0.139 USER MOD Single : A 451 LYS NZ :NH3+ -165:sc= 1.16 (180deg=0.676) USER MOD Single : A 454 LYS NZ :NH3+ 150:sc= 1.2 (180deg=0.706) USER MOD Single : A 455 ASN : amide:sc= -0.156 X(o=-0.16,f=-0.23) USER MOD Single : A 458 MET CE :methyl -166:sc= -0.909 (180deg=-1.77) USER MOD Single : A 469 SER OG : rot 180:sc= 0.091 USER MOD Single : A 473 SER OG : rot 88:sc= 1.02 USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 LYS NZ :NH3+ 173:sc= 1.04 (180deg=1) USER MOD Single : A 501 LYS NZ :NH3+ 180:sc= 0 (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 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 443 4.807 -4.954 15.614 1.00 0.00 N ATOM 2 CA MET A 443 4.441 -5.997 14.618 1.00 0.00 C ATOM 3 C MET A 443 4.200 -5.350 13.245 1.00 0.00 C ATOM 4 O MET A 443 3.298 -4.518 13.131 1.00 0.00 O ATOM 5 CB MET A 443 3.208 -6.800 15.093 1.00 0.00 C ATOM 6 CG MET A 443 2.941 -8.065 14.264 1.00 0.00 C ATOM 7 SD MET A 443 4.273 -9.299 14.323 1.00 0.00 S ATOM 8 CE MET A 443 3.529 -10.623 13.334 1.00 0.00 C ATOM 0 HA MET A 443 5.268 -6.701 14.521 1.00 0.00 H new ATOM 0 HB2 MET A 443 3.349 -7.083 16.136 1.00 0.00 H new ATOM 0 HB3 MET A 443 2.329 -6.157 15.053 1.00 0.00 H new ATOM 0 HG2 MET A 443 2.019 -8.527 14.616 1.00 0.00 H new ATOM 0 HG3 MET A 443 2.776 -7.776 13.226 1.00 0.00 H new ATOM 0 HE1 MET A 443 4.198 -11.483 13.315 1.00 0.00 H new ATOM 0 HE2 MET A 443 2.576 -10.915 13.775 1.00 0.00 H new ATOM 0 HE3 MET A 443 3.365 -10.269 12.316 1.00 0.00 H new ATOM 18 N PRO A 444 4.975 -5.691 12.192 1.00 0.00 N ATOM 19 CA PRO A 444 4.884 -5.043 10.871 1.00 0.00 C ATOM 20 C PRO A 444 3.658 -5.458 10.031 1.00 0.00 C ATOM 21 O PRO A 444 3.399 -4.870 8.978 1.00 0.00 O ATOM 22 CB PRO A 444 6.191 -5.419 10.163 1.00 0.00 C ATOM 23 CG PRO A 444 6.520 -6.791 10.742 1.00 0.00 C ATOM 24 CD PRO A 444 6.068 -6.660 12.195 1.00 0.00 C ATOM 0 HA PRO A 444 4.749 -3.968 10.995 1.00 0.00 H new ATOM 0 HB2 PRO A 444 6.066 -5.458 9.081 1.00 0.00 H new ATOM 0 HB3 PRO A 444 6.981 -4.696 10.366 1.00 0.00 H new ATOM 0 HG2 PRO A 444 5.988 -7.588 10.223 1.00 0.00 H new ATOM 0 HG3 PRO A 444 7.584 -7.017 10.668 1.00 0.00 H new ATOM 0 HD2 PRO A 444 5.736 -7.621 12.588 1.00 0.00 H new ATOM 0 HD3 PRO A 444 6.887 -6.322 12.829 1.00 0.00 H new ATOM 32 N LYS A 445 2.882 -6.457 10.479 1.00 0.00 N ATOM 33 CA LYS A 445 1.739 -7.047 9.756 1.00 0.00 C ATOM 34 C LYS A 445 0.579 -6.112 9.450 1.00 0.00 C ATOM 35 O LYS A 445 -0.239 -6.428 8.590 1.00 0.00 O ATOM 36 CB LYS A 445 1.285 -8.343 10.452 1.00 0.00 C ATOM 37 CG LYS A 445 0.763 -9.372 9.438 1.00 0.00 C ATOM 38 CD LYS A 445 0.138 -10.587 10.130 1.00 0.00 C ATOM 39 CE LYS A 445 -0.353 -11.627 9.114 1.00 0.00 C ATOM 40 NZ LYS A 445 -1.411 -11.085 8.228 1.00 0.00 N ATOM 0 H LYS A 445 3.037 -6.894 11.388 1.00 0.00 H new ATOM 0 HA LYS A 445 2.119 -7.279 8.761 1.00 0.00 H new ATOM 0 HB2 LYS A 445 2.119 -8.770 11.009 1.00 0.00 H new ATOM 0 HB3 LYS A 445 0.503 -8.114 11.176 1.00 0.00 H new ATOM 0 HG2 LYS A 445 0.022 -8.901 8.791 1.00 0.00 H new ATOM 0 HG3 LYS A 445 1.582 -9.700 8.798 1.00 0.00 H new ATOM 0 HD2 LYS A 445 0.871 -11.045 10.794 1.00 0.00 H new ATOM 0 HD3 LYS A 445 -0.697 -10.263 10.751 1.00 0.00 H new ATOM 0 HE2 LYS A 445 0.487 -11.967 8.509 1.00 0.00 H new ATOM 0 HE3 LYS A 445 -0.736 -12.499 9.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -1.922 -11.870 7.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -2.076 -10.516 8.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 -0.978 -10.488 7.495 1.00 0.00 H new ATOM 54 N SER A 446 0.562 -4.904 10.003 1.00 0.00 N ATOM 55 CA SER A 446 -0.403 -3.887 9.585 1.00 0.00 C ATOM 56 C SER A 446 -0.166 -3.307 8.175 1.00 0.00 C ATOM 57 O SER A 446 -0.952 -2.495 7.685 1.00 0.00 O ATOM 58 CB SER A 446 -0.526 -2.786 10.644 1.00 0.00 C ATOM 59 OG SER A 446 0.744 -2.212 10.909 1.00 0.00 O ATOM 0 H SER A 446 1.201 -4.604 10.739 1.00 0.00 H new ATOM 0 HA SER A 446 -1.358 -4.407 9.503 1.00 0.00 H new ATOM 0 HB2 SER A 446 -1.216 -2.016 10.299 1.00 0.00 H new ATOM 0 HB3 SER A 446 -0.944 -3.200 11.562 1.00 0.00 H new ATOM 0 HG SER A 446 0.651 -1.509 11.586 1.00 0.00 H new ATOM 65 N LEU A 447 0.870 -3.773 7.475 1.00 0.00 N ATOM 66 CA LEU A 447 1.142 -3.537 6.065 1.00 0.00 C ATOM 67 C LEU A 447 0.759 -4.766 5.202 1.00 0.00 C ATOM 68 O LEU A 447 0.811 -4.701 3.977 1.00 0.00 O ATOM 69 CB LEU A 447 2.635 -3.183 5.981 1.00 0.00 C ATOM 70 CG LEU A 447 3.090 -2.502 4.684 1.00 0.00 C ATOM 71 CD1 LEU A 447 2.601 -1.058 4.590 1.00 0.00 C ATOM 72 CD2 LEU A 447 4.615 -2.451 4.662 1.00 0.00 C ATOM 0 H LEU A 447 1.582 -4.361 7.909 1.00 0.00 H new ATOM 0 HA LEU A 447 0.538 -2.723 5.664 1.00 0.00 H new ATOM 0 HB2 LEU A 447 2.881 -2.529 6.818 1.00 0.00 H new ATOM 0 HB3 LEU A 447 3.213 -4.098 6.111 1.00 0.00 H new ATOM 0 HG LEU A 447 2.678 -3.078 3.855 1.00 0.00 H new ATOM 0 HD11 LEU A 447 2.947 -0.617 3.655 1.00 0.00 H new ATOM 0 HD12 LEU A 447 1.511 -1.040 4.618 1.00 0.00 H new ATOM 0 HD13 LEU A 447 2.995 -0.485 5.430 1.00 0.00 H new ATOM 0 HD21 LEU A 447 4.950 -1.969 3.744 1.00 0.00 H new ATOM 0 HD22 LEU A 447 4.973 -1.883 5.521 1.00 0.00 H new ATOM 0 HD23 LEU A 447 5.014 -3.465 4.705 1.00 0.00 H new ATOM 84 N THR A 448 0.360 -5.884 5.824 1.00 0.00 N ATOM 85 CA THR A 448 0.157 -7.214 5.212 1.00 0.00 C ATOM 86 C THR A 448 -1.021 -7.987 5.860 1.00 0.00 C ATOM 87 O THR A 448 -1.010 -9.214 5.986 1.00 0.00 O ATOM 88 CB THR A 448 1.475 -8.025 5.231 1.00 0.00 C ATOM 89 OG1 THR A 448 1.888 -8.294 6.548 1.00 0.00 O ATOM 90 CG2 THR A 448 2.653 -7.285 4.578 1.00 0.00 C ATOM 0 H THR A 448 0.158 -5.890 6.824 1.00 0.00 H new ATOM 0 HA THR A 448 -0.126 -7.063 4.170 1.00 0.00 H new ATOM 0 HB THR A 448 1.242 -8.933 4.674 1.00 0.00 H new ATOM 0 HG1 THR A 448 2.722 -8.809 6.531 1.00 0.00 H new ATOM 0 HG21 THR A 448 3.546 -7.909 4.625 1.00 0.00 H new ATOM 0 HG22 THR A 448 2.415 -7.070 3.536 1.00 0.00 H new ATOM 0 HG23 THR A 448 2.835 -6.351 5.109 1.00 0.00 H new ATOM 98 N ASP A 449 -2.071 -7.264 6.273 1.00 0.00 N ATOM 99 CA ASP A 449 -3.303 -7.767 6.911 1.00 0.00 C ATOM 100 C ASP A 449 -4.558 -7.436 6.073 1.00 0.00 C ATOM 101 O ASP A 449 -4.781 -6.259 5.786 1.00 0.00 O ATOM 102 CB ASP A 449 -3.466 -7.152 8.311 1.00 0.00 C ATOM 103 CG ASP A 449 -2.927 -8.017 9.459 1.00 0.00 C ATOM 104 OD1 ASP A 449 -3.114 -9.258 9.396 1.00 0.00 O ATOM 105 OD2 ASP A 449 -2.466 -7.470 10.484 1.00 0.00 O ATOM 0 H ASP A 449 -2.087 -6.250 6.166 1.00 0.00 H new ATOM 0 HA ASP A 449 -3.208 -8.850 6.984 1.00 0.00 H new ATOM 0 HB2 ASP A 449 -2.957 -6.188 8.331 1.00 0.00 H new ATOM 0 HB3 ASP A 449 -4.524 -6.958 8.487 1.00 0.00 H new ATOM 110 N PRO A 450 -5.438 -8.413 5.760 1.00 0.00 N ATOM 111 CA PRO A 450 -6.711 -8.211 5.042 1.00 0.00 C ATOM 112 C PRO A 450 -7.515 -6.996 5.534 1.00 0.00 C ATOM 113 O PRO A 450 -7.990 -6.180 4.745 1.00 0.00 O ATOM 114 CB PRO A 450 -7.506 -9.511 5.247 1.00 0.00 C ATOM 115 CG PRO A 450 -6.470 -10.576 5.598 1.00 0.00 C ATOM 116 CD PRO A 450 -5.276 -9.806 6.148 1.00 0.00 C ATOM 0 HA PRO A 450 -6.513 -7.996 3.992 1.00 0.00 H new ATOM 0 HB2 PRO A 450 -8.240 -9.400 6.045 1.00 0.00 H new ATOM 0 HB3 PRO A 450 -8.055 -9.781 4.345 1.00 0.00 H new ATOM 0 HG2 PRO A 450 -6.860 -11.277 6.336 1.00 0.00 H new ATOM 0 HG3 PRO A 450 -6.192 -11.159 4.720 1.00 0.00 H new ATOM 0 HD2 PRO A 450 -5.227 -9.899 7.233 1.00 0.00 H new ATOM 0 HD3 PRO A 450 -4.344 -10.209 5.751 1.00 0.00 H new ATOM 124 N LYS A 451 -7.596 -6.857 6.862 1.00 0.00 N ATOM 125 CA LYS A 451 -8.263 -5.797 7.635 1.00 0.00 C ATOM 126 C LYS A 451 -7.788 -4.380 7.274 1.00 0.00 C ATOM 127 O LYS A 451 -8.563 -3.429 7.334 1.00 0.00 O ATOM 128 CB LYS A 451 -8.009 -6.085 9.129 1.00 0.00 C ATOM 129 CG LYS A 451 -8.581 -7.435 9.621 1.00 0.00 C ATOM 130 CD LYS A 451 -7.620 -8.206 10.544 1.00 0.00 C ATOM 131 CE LYS A 451 -6.421 -8.808 9.804 1.00 0.00 C ATOM 132 NZ LYS A 451 -5.533 -9.565 10.728 1.00 0.00 N ATOM 0 H LYS A 451 -7.159 -7.542 7.479 1.00 0.00 H new ATOM 0 HA LYS A 451 -9.326 -5.814 7.396 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.935 -6.070 9.313 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -8.445 -5.281 9.722 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -9.515 -7.253 10.152 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.820 -8.056 8.758 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -7.258 -7.534 11.322 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -8.169 -9.005 11.043 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -6.775 -9.470 9.014 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -5.853 -8.012 9.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -4.619 -9.740 10.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -5.381 -9.011 11.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -5.978 -10.473 10.971 1.00 0.00 H new ATOM 146 N LEU A 452 -6.516 -4.233 6.903 1.00 0.00 N ATOM 147 CA LEU A 452 -5.865 -2.973 6.526 1.00 0.00 C ATOM 148 C LEU A 452 -5.918 -2.796 5.008 1.00 0.00 C ATOM 149 O LEU A 452 -6.311 -1.739 4.512 1.00 0.00 O ATOM 150 CB LEU A 452 -4.389 -2.978 6.988 1.00 0.00 C ATOM 151 CG LEU A 452 -4.089 -2.948 8.501 1.00 0.00 C ATOM 152 CD1 LEU A 452 -4.207 -1.519 9.005 1.00 0.00 C ATOM 153 CD2 LEU A 452 -4.920 -3.868 9.384 1.00 0.00 C ATOM 0 H LEU A 452 -5.878 -5.027 6.854 1.00 0.00 H new ATOM 0 HA LEU A 452 -6.391 -2.149 7.009 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -3.916 -3.868 6.574 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -3.898 -2.116 6.536 1.00 0.00 H new ATOM 0 HG LEU A 452 -3.075 -3.340 8.586 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -3.996 -1.492 10.074 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -3.492 -0.887 8.478 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -5.217 -1.152 8.825 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -4.611 -3.752 10.423 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -5.975 -3.610 9.288 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -4.770 -4.902 9.075 1.00 0.00 H new ATOM 165 N LEU A 453 -5.565 -3.859 4.279 1.00 0.00 N ATOM 166 CA LEU A 453 -5.372 -3.916 2.828 1.00 0.00 C ATOM 167 C LEU A 453 -6.640 -3.571 2.034 1.00 0.00 C ATOM 168 O LEU A 453 -6.577 -3.228 0.852 1.00 0.00 O ATOM 169 CB LEU A 453 -4.897 -5.347 2.505 1.00 0.00 C ATOM 170 CG LEU A 453 -3.453 -5.664 2.956 1.00 0.00 C ATOM 171 CD1 LEU A 453 -3.139 -7.142 2.739 1.00 0.00 C ATOM 172 CD2 LEU A 453 -2.371 -4.867 2.243 1.00 0.00 C ATOM 0 H LEU A 453 -5.395 -4.764 4.718 1.00 0.00 H new ATOM 0 HA LEU A 453 -4.639 -3.166 2.530 1.00 0.00 H new ATOM 0 HB2 LEU A 453 -5.575 -6.056 2.979 1.00 0.00 H new ATOM 0 HB3 LEU A 453 -4.971 -5.506 1.429 1.00 0.00 H new ATOM 0 HG LEU A 453 -3.433 -5.385 4.009 1.00 0.00 H new ATOM 0 HD11 LEU A 453 -2.119 -7.348 3.062 1.00 0.00 H new ATOM 0 HD12 LEU A 453 -3.833 -7.750 3.319 1.00 0.00 H new ATOM 0 HD13 LEU A 453 -3.241 -7.384 1.681 1.00 0.00 H new ATOM 0 HD21 LEU A 453 -1.393 -5.158 2.626 1.00 0.00 H new ATOM 0 HD22 LEU A 453 -2.416 -5.068 1.173 1.00 0.00 H new ATOM 0 HD23 LEU A 453 -2.528 -3.803 2.419 1.00 0.00 H new ATOM 184 N LYS A 454 -7.792 -3.634 2.704 1.00 0.00 N ATOM 185 CA LYS A 454 -9.128 -3.397 2.162 1.00 0.00 C ATOM 186 C LYS A 454 -9.769 -2.131 2.737 1.00 0.00 C ATOM 187 O LYS A 454 -10.820 -1.711 2.254 1.00 0.00 O ATOM 188 CB LYS A 454 -9.965 -4.652 2.417 1.00 0.00 C ATOM 189 CG LYS A 454 -9.343 -5.802 1.640 1.00 0.00 C ATOM 190 CD LYS A 454 -10.144 -7.070 1.857 1.00 0.00 C ATOM 191 CE LYS A 454 -9.376 -8.074 1.034 1.00 0.00 C ATOM 192 NZ LYS A 454 -10.176 -9.234 0.553 1.00 0.00 N ATOM 0 H LYS A 454 -7.817 -3.865 3.697 1.00 0.00 H new ATOM 0 HA LYS A 454 -9.068 -3.214 1.089 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -9.991 -4.882 3.482 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -10.996 -4.493 2.101 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -9.312 -5.559 0.578 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -8.313 -5.954 1.962 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -10.185 -7.351 2.909 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -11.174 -6.965 1.515 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -8.948 -7.563 0.171 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.542 -8.448 1.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.788 -9.573 -0.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -10.136 -9.999 1.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -11.165 -8.941 0.417 1.00 0.00 H new ATOM 206 N ASN A 455 -9.137 -1.514 3.744 1.00 0.00 N ATOM 207 CA ASN A 455 -9.487 -0.178 4.196 1.00 0.00 C ATOM 208 C ASN A 455 -8.895 0.836 3.215 1.00 0.00 C ATOM 209 O ASN A 455 -9.637 1.493 2.489 1.00 0.00 O ATOM 210 CB ASN A 455 -9.009 0.086 5.634 1.00 0.00 C ATOM 211 CG ASN A 455 -10.160 -0.065 6.614 1.00 0.00 C ATOM 212 OD1 ASN A 455 -11.112 0.701 6.604 1.00 0.00 O ATOM 213 ND2 ASN A 455 -10.119 -1.028 7.491 1.00 0.00 N ATOM 0 H ASN A 455 -8.368 -1.936 4.264 1.00 0.00 H new ATOM 0 HA ASN A 455 -10.572 -0.080 4.216 1.00 0.00 H new ATOM 0 HB2 ASN A 455 -8.211 -0.610 5.892 1.00 0.00 H new ATOM 0 HB3 ASN A 455 -8.592 1.090 5.706 1.00 0.00 H new ATOM 0 HD21 ASN A 455 -10.878 -1.138 8.163 1.00 0.00 H new ATOM 0 HD22 ASN A 455 -9.328 -1.671 7.505 1.00 0.00 H new ATOM 220 N ILE A 456 -7.557 0.933 3.250 1.00 0.00 N ATOM 221 CA ILE A 456 -6.628 1.909 2.656 1.00 0.00 C ATOM 222 C ILE A 456 -6.197 2.991 3.677 1.00 0.00 C ATOM 223 O ILE A 456 -4.992 3.067 3.918 1.00 0.00 O ATOM 224 CB ILE A 456 -7.052 2.450 1.264 1.00 0.00 C ATOM 225 CG1 ILE A 456 -7.234 1.353 0.182 1.00 0.00 C ATOM 226 CG2 ILE A 456 -6.040 3.479 0.739 1.00 0.00 C ATOM 227 CD1 ILE A 456 -6.102 0.320 0.064 1.00 0.00 C ATOM 0 H ILE A 456 -7.029 0.231 3.768 1.00 0.00 H new ATOM 0 HA ILE A 456 -5.722 1.353 2.416 1.00 0.00 H new ATOM 0 HB ILE A 456 -8.025 2.910 1.434 1.00 0.00 H new ATOM 0 HG12 ILE A 456 -8.163 0.821 0.387 1.00 0.00 H new ATOM 0 HG13 ILE A 456 -7.353 1.842 -0.785 1.00 0.00 H new ATOM 0 HG21 ILE A 456 -6.362 3.841 -0.237 1.00 0.00 H new ATOM 0 HG22 ILE A 456 -5.979 4.316 1.434 1.00 0.00 H new ATOM 0 HG23 ILE A 456 -5.060 3.011 0.647 1.00 0.00 H new ATOM 0 HD11 ILE A 456 -6.342 -0.394 -0.724 1.00 0.00 H new ATOM 0 HD12 ILE A 456 -5.169 0.829 -0.179 1.00 0.00 H new ATOM 0 HD13 ILE A 456 -5.991 -0.208 1.011 1.00 0.00 H new ATOM 239 N PRO A 457 -7.072 3.783 4.350 1.00 0.00 N ATOM 240 CA PRO A 457 -6.644 4.822 5.299 1.00 0.00 C ATOM 241 C PRO A 457 -5.766 4.282 6.434 1.00 0.00 C ATOM 242 O PRO A 457 -4.687 4.811 6.694 1.00 0.00 O ATOM 243 CB PRO A 457 -7.924 5.465 5.860 1.00 0.00 C ATOM 244 CG PRO A 457 -9.013 5.093 4.862 1.00 0.00 C ATOM 245 CD PRO A 457 -8.526 3.763 4.301 1.00 0.00 C ATOM 0 HA PRO A 457 -6.020 5.548 4.778 1.00 0.00 H new ATOM 0 HB2 PRO A 457 -8.154 5.086 6.856 1.00 0.00 H new ATOM 0 HB3 PRO A 457 -7.819 6.546 5.947 1.00 0.00 H new ATOM 0 HG2 PRO A 457 -9.986 4.995 5.344 1.00 0.00 H new ATOM 0 HG3 PRO A 457 -9.119 5.846 4.081 1.00 0.00 H new ATOM 0 HD2 PRO A 457 -8.919 2.931 4.886 1.00 0.00 H new ATOM 0 HD3 PRO A 457 -8.875 3.626 3.277 1.00 0.00 H new ATOM 253 N MET A 458 -6.200 3.201 7.095 1.00 0.00 N ATOM 254 CA MET A 458 -5.443 2.577 8.188 1.00 0.00 C ATOM 255 C MET A 458 -4.243 1.757 7.695 1.00 0.00 C ATOM 256 O MET A 458 -3.298 1.560 8.455 1.00 0.00 O ATOM 257 CB MET A 458 -6.380 1.791 9.118 1.00 0.00 C ATOM 258 CG MET A 458 -7.413 0.877 8.490 1.00 0.00 C ATOM 259 SD MET A 458 -8.459 0.165 9.785 1.00 0.00 S ATOM 260 CE MET A 458 -7.585 -1.397 9.944 1.00 0.00 C ATOM 0 H MET A 458 -7.084 2.735 6.888 1.00 0.00 H new ATOM 0 HA MET A 458 -5.000 3.377 8.781 1.00 0.00 H new ATOM 0 HB2 MET A 458 -5.761 1.187 9.781 1.00 0.00 H new ATOM 0 HB3 MET A 458 -6.909 2.511 9.743 1.00 0.00 H new ATOM 0 HG2 MET A 458 -8.024 1.435 7.780 1.00 0.00 H new ATOM 0 HG3 MET A 458 -6.919 0.083 7.930 1.00 0.00 H new ATOM 0 HE1 MET A 458 -8.196 -2.100 10.510 1.00 0.00 H new ATOM 0 HE2 MET A 458 -7.386 -1.805 8.953 1.00 0.00 H new ATOM 0 HE3 MET A 458 -6.642 -1.235 10.466 1.00 0.00 H new ATOM 270 N TRP A 459 -4.205 1.360 6.416 1.00 0.00 N ATOM 271 CA TRP A 459 -3.000 0.773 5.819 1.00 0.00 C ATOM 272 C TRP A 459 -1.905 1.838 5.620 1.00 0.00 C ATOM 273 O TRP A 459 -0.801 1.721 6.152 1.00 0.00 O ATOM 274 CB TRP A 459 -3.337 0.019 4.534 1.00 0.00 C ATOM 275 CG TRP A 459 -2.198 -0.741 3.925 1.00 0.00 C ATOM 276 CD1 TRP A 459 -1.806 -1.977 4.305 1.00 0.00 C ATOM 277 CD2 TRP A 459 -1.279 -0.342 2.854 1.00 0.00 C ATOM 278 NE1 TRP A 459 -0.742 -2.379 3.525 1.00 0.00 N ATOM 279 CE2 TRP A 459 -0.403 -1.436 2.591 1.00 0.00 C ATOM 280 CE3 TRP A 459 -1.074 0.827 2.087 1.00 0.00 C ATOM 281 CZ2 TRP A 459 0.574 -1.416 1.589 1.00 0.00 C ATOM 282 CZ3 TRP A 459 -0.064 0.876 1.103 1.00 0.00 C ATOM 283 CH2 TRP A 459 0.729 -0.251 0.828 1.00 0.00 C ATOM 0 H TRP A 459 -4.995 1.435 5.776 1.00 0.00 H new ATOM 0 HA TRP A 459 -2.593 0.037 6.513 1.00 0.00 H new ATOM 0 HB2 TRP A 459 -4.148 -0.678 4.743 1.00 0.00 H new ATOM 0 HB3 TRP A 459 -3.711 0.733 3.800 1.00 0.00 H new ATOM 0 HD1 TRP A 459 -2.256 -2.559 5.096 1.00 0.00 H new ATOM 0 HE1 TRP A 459 -0.264 -3.274 3.631 1.00 0.00 H new ATOM 0 HE3 TRP A 459 -1.697 1.693 2.256 1.00 0.00 H new ATOM 0 HZ2 TRP A 459 1.195 -2.281 1.407 1.00 0.00 H new ATOM 0 HZ3 TRP A 459 0.102 1.791 0.554 1.00 0.00 H new ATOM 0 HH2 TRP A 459 1.457 -0.219 0.031 1.00 0.00 H new ATOM 294 N LEU A 460 -2.254 2.943 4.946 1.00 0.00 N ATOM 295 CA LEU A 460 -1.464 4.180 4.817 1.00 0.00 C ATOM 296 C LEU A 460 -1.045 4.792 6.166 1.00 0.00 C ATOM 297 O LEU A 460 -0.074 5.550 6.227 1.00 0.00 O ATOM 298 CB LEU A 460 -2.308 5.218 4.055 1.00 0.00 C ATOM 299 CG LEU A 460 -2.634 4.896 2.593 1.00 0.00 C ATOM 300 CD1 LEU A 460 -3.721 5.858 2.105 1.00 0.00 C ATOM 301 CD2 LEU A 460 -1.420 5.110 1.702 1.00 0.00 C ATOM 0 H LEU A 460 -3.143 3.003 4.449 1.00 0.00 H new ATOM 0 HA LEU A 460 -0.548 3.918 4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 460 -3.247 5.354 4.592 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.783 6.173 4.085 1.00 0.00 H new ATOM 0 HG LEU A 460 -2.954 3.855 2.540 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -3.961 5.638 1.065 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -4.615 5.738 2.717 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -3.362 6.884 2.185 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -1.680 4.874 0.670 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -1.100 6.150 1.767 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.609 4.460 2.030 1.00 0.00 H new ATOM 313 N LYS A 461 -1.756 4.491 7.257 1.00 0.00 N ATOM 314 CA LYS A 461 -1.406 4.927 8.616 1.00 0.00 C ATOM 315 C LYS A 461 -0.147 4.287 9.164 1.00 0.00 C ATOM 316 O LYS A 461 0.594 4.951 9.888 1.00 0.00 O ATOM 317 CB LYS A 461 -2.624 4.719 9.520 1.00 0.00 C ATOM 318 CG LYS A 461 -2.396 5.370 10.877 1.00 0.00 C ATOM 319 CD LYS A 461 -3.651 5.365 11.734 1.00 0.00 C ATOM 320 CE LYS A 461 -4.578 6.496 11.272 1.00 0.00 C ATOM 321 NZ LYS A 461 -4.486 7.698 12.145 1.00 0.00 N ATOM 0 H LYS A 461 -2.606 3.928 7.222 1.00 0.00 H new ATOM 0 HA LYS A 461 -1.155 5.987 8.582 1.00 0.00 H new ATOM 0 HB2 LYS A 461 -3.511 5.145 9.050 1.00 0.00 H new ATOM 0 HB3 LYS A 461 -2.812 3.653 9.648 1.00 0.00 H new ATOM 0 HG2 LYS A 461 -1.598 4.844 11.401 1.00 0.00 H new ATOM 0 HG3 LYS A 461 -2.060 6.397 10.734 1.00 0.00 H new ATOM 0 HD2 LYS A 461 -4.159 4.404 11.651 1.00 0.00 H new ATOM 0 HD3 LYS A 461 -3.390 5.498 12.784 1.00 0.00 H new ATOM 0 HE2 LYS A 461 -4.326 6.774 10.249 1.00 0.00 H new ATOM 0 HE3 LYS A 461 -5.607 6.137 11.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 461 -5.436 7.958 12.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 461 -3.877 7.488 12.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 461 -4.081 8.489 11.605 1.00 0.00 H new ATOM 335 N SER A 462 0.178 3.077 8.721 1.00 0.00 N ATOM 336 CA SER A 462 1.481 2.484 9.024 1.00 0.00 C ATOM 337 C SER A 462 2.645 3.325 8.450 1.00 0.00 C ATOM 338 O SER A 462 3.753 3.305 8.990 1.00 0.00 O ATOM 339 CB SER A 462 1.540 1.045 8.492 1.00 0.00 C ATOM 340 OG SER A 462 2.691 0.366 8.972 1.00 0.00 O ATOM 0 H SER A 462 -0.435 2.490 8.156 1.00 0.00 H new ATOM 0 HA SER A 462 1.597 2.470 10.108 1.00 0.00 H new ATOM 0 HB2 SER A 462 0.643 0.505 8.796 1.00 0.00 H new ATOM 0 HB3 SER A 462 1.550 1.058 7.402 1.00 0.00 H new ATOM 0 HG SER A 462 2.702 -0.548 8.619 1.00 0.00 H new ATOM 346 N LEU A 463 2.402 4.123 7.397 1.00 0.00 N ATOM 347 CA LEU A 463 3.366 5.021 6.748 1.00 0.00 C ATOM 348 C LEU A 463 3.416 6.409 7.413 1.00 0.00 C ATOM 349 O LEU A 463 4.203 7.258 6.994 1.00 0.00 O ATOM 350 CB LEU A 463 3.018 5.193 5.251 1.00 0.00 C ATOM 351 CG LEU A 463 2.402 3.970 4.559 1.00 0.00 C ATOM 352 CD1 LEU A 463 2.139 4.249 3.089 1.00 0.00 C ATOM 353 CD2 LEU A 463 3.307 2.734 4.625 1.00 0.00 C ATOM 0 H LEU A 463 1.483 4.160 6.956 1.00 0.00 H new ATOM 0 HA LEU A 463 4.347 4.558 6.857 1.00 0.00 H new ATOM 0 HB2 LEU A 463 2.325 6.029 5.153 1.00 0.00 H new ATOM 0 HB3 LEU A 463 3.927 5.469 4.716 1.00 0.00 H new ATOM 0 HG LEU A 463 1.474 3.772 5.096 1.00 0.00 H new ATOM 0 HD11 LEU A 463 1.702 3.365 2.623 1.00 0.00 H new ATOM 0 HD12 LEU A 463 1.448 5.087 2.996 1.00 0.00 H new ATOM 0 HD13 LEU A 463 3.077 4.495 2.592 1.00 0.00 H new ATOM 0 HD21 LEU A 463 2.821 1.900 4.120 1.00 0.00 H new ATOM 0 HD22 LEU A 463 4.256 2.951 4.135 1.00 0.00 H new ATOM 0 HD23 LEU A 463 3.488 2.471 5.667 1.00 0.00 H new ATOM 365 N ARG A 464 2.547 6.658 8.411 1.00 0.00 N ATOM 366 CA ARG A 464 2.248 7.963 9.030 1.00 0.00 C ATOM 367 C ARG A 464 1.637 8.978 8.040 1.00 0.00 C ATOM 368 O ARG A 464 1.540 10.164 8.348 1.00 0.00 O ATOM 369 CB ARG A 464 3.464 8.497 9.821 1.00 0.00 C ATOM 370 CG ARG A 464 3.909 7.604 10.997 1.00 0.00 C ATOM 371 CD ARG A 464 4.736 6.367 10.610 1.00 0.00 C ATOM 372 NE ARG A 464 5.441 5.811 11.783 1.00 0.00 N ATOM 373 CZ ARG A 464 5.835 4.567 11.989 1.00 0.00 C ATOM 374 NH1 ARG A 464 5.575 3.591 11.164 1.00 0.00 N ATOM 375 NH2 ARG A 464 6.518 4.270 13.058 1.00 0.00 N ATOM 0 H ARG A 464 2.001 5.906 8.833 1.00 0.00 H new ATOM 0 HA ARG A 464 1.456 7.805 9.762 1.00 0.00 H new ATOM 0 HB2 ARG A 464 4.303 8.616 9.135 1.00 0.00 H new ATOM 0 HB3 ARG A 464 3.223 9.488 10.206 1.00 0.00 H new ATOM 0 HG2 ARG A 464 4.494 8.209 11.689 1.00 0.00 H new ATOM 0 HG3 ARG A 464 3.021 7.272 11.535 1.00 0.00 H new ATOM 0 HD2 ARG A 464 4.082 5.608 10.181 1.00 0.00 H new ATOM 0 HD3 ARG A 464 5.460 6.636 9.840 1.00 0.00 H new ATOM 0 HE ARG A 464 5.651 6.473 12.530 1.00 0.00 H new ATOM 0 HH11 ARG A 464 5.044 3.771 10.312 1.00 0.00 H new ATOM 0 HH12 ARG A 464 5.903 2.648 11.371 1.00 0.00 H new ATOM 0 HH21 ARG A 464 6.748 4.998 13.735 1.00 0.00 H new ATOM 0 HH22 ARG A 464 6.823 3.310 13.218 1.00 0.00 H new ATOM 389 N LEU A 465 1.179 8.502 6.873 1.00 0.00 N ATOM 390 CA LEU A 465 0.504 9.284 5.831 1.00 0.00 C ATOM 391 C LEU A 465 -1.011 9.341 6.063 1.00 0.00 C ATOM 392 O LEU A 465 -1.535 10.414 6.353 1.00 0.00 O ATOM 393 CB LEU A 465 0.839 8.712 4.439 1.00 0.00 C ATOM 394 CG LEU A 465 2.318 8.864 4.035 1.00 0.00 C ATOM 395 CD1 LEU A 465 2.538 8.132 2.716 1.00 0.00 C ATOM 396 CD2 LEU A 465 2.732 10.329 3.880 1.00 0.00 C ATOM 0 H LEU A 465 1.274 7.518 6.620 1.00 0.00 H new ATOM 0 HA LEU A 465 0.871 10.309 5.880 1.00 0.00 H new ATOM 0 HB2 LEU A 465 0.575 7.655 4.420 1.00 0.00 H new ATOM 0 HB3 LEU A 465 0.217 9.209 3.695 1.00 0.00 H new ATOM 0 HG LEU A 465 2.932 8.438 4.828 1.00 0.00 H new ATOM 0 HD11 LEU A 465 3.581 8.230 2.415 1.00 0.00 H new ATOM 0 HD12 LEU A 465 2.293 7.077 2.840 1.00 0.00 H new ATOM 0 HD13 LEU A 465 1.897 8.565 1.948 1.00 0.00 H new ATOM 0 HD21 LEU A 465 3.783 10.382 3.595 1.00 0.00 H new ATOM 0 HD22 LEU A 465 2.122 10.800 3.109 1.00 0.00 H new ATOM 0 HD23 LEU A 465 2.586 10.850 4.826 1.00 0.00 H new ATOM 408 N HIS A 466 -1.708 8.199 5.928 1.00 0.00 N ATOM 409 CA HIS A 466 -3.169 8.049 6.171 1.00 0.00 C ATOM 410 C HIS A 466 -4.104 9.168 5.650 1.00 0.00 C ATOM 411 O HIS A 466 -5.130 9.474 6.265 1.00 0.00 O ATOM 412 CB HIS A 466 -3.384 7.665 7.638 1.00 0.00 C ATOM 413 CG HIS A 466 -3.015 8.659 8.704 1.00 0.00 C ATOM 414 ND1 HIS A 466 -1.841 8.652 9.422 1.00 0.00 N ATOM 415 CD2 HIS A 466 -3.871 9.533 9.316 1.00 0.00 C ATOM 416 CE1 HIS A 466 -1.992 9.478 10.466 1.00 0.00 C ATOM 417 NE2 HIS A 466 -3.213 10.040 10.445 1.00 0.00 N ATOM 0 H HIS A 466 -1.266 7.326 5.639 1.00 0.00 H new ATOM 0 HA HIS A 466 -3.504 7.239 5.523 1.00 0.00 H new ATOM 0 HB2 HIS A 466 -4.438 7.420 7.765 1.00 0.00 H new ATOM 0 HB3 HIS A 466 -2.820 6.752 7.827 1.00 0.00 H new ATOM 0 HD2 HIS A 466 -4.869 9.786 8.990 1.00 0.00 H new ATOM 0 HE1 HIS A 466 -1.240 9.666 11.218 1.00 0.00 H new ATOM 0 HE2 HIS A 466 -3.588 10.706 11.120 1.00 0.00 H new ATOM 425 N LYS A 467 -3.763 9.750 4.491 1.00 0.00 N ATOM 426 CA LYS A 467 -4.442 10.903 3.861 1.00 0.00 C ATOM 427 C LYS A 467 -4.884 10.672 2.415 1.00 0.00 C ATOM 428 O LYS A 467 -5.951 11.134 2.010 1.00 0.00 O ATOM 429 CB LYS A 467 -3.545 12.152 3.977 1.00 0.00 C ATOM 430 CG LYS A 467 -2.286 12.010 3.106 1.00 0.00 C ATOM 431 CD LYS A 467 -1.286 13.146 3.189 1.00 0.00 C ATOM 432 CE LYS A 467 -1.816 14.444 2.573 1.00 0.00 C ATOM 433 NZ LYS A 467 -0.751 15.478 2.508 1.00 0.00 N ATOM 0 H LYS A 467 -2.972 9.419 3.939 1.00 0.00 H new ATOM 0 HA LYS A 467 -5.372 11.052 4.410 1.00 0.00 H new ATOM 0 HB2 LYS A 467 -4.105 13.036 3.671 1.00 0.00 H new ATOM 0 HB3 LYS A 467 -3.257 12.301 5.017 1.00 0.00 H new ATOM 0 HG2 LYS A 467 -1.779 11.086 3.384 1.00 0.00 H new ATOM 0 HG3 LYS A 467 -2.598 11.903 2.067 1.00 0.00 H new ATOM 0 HD2 LYS A 467 -1.028 13.323 4.233 1.00 0.00 H new ATOM 0 HD3 LYS A 467 -0.368 12.855 2.679 1.00 0.00 H new ATOM 0 HE2 LYS A 467 -2.197 14.246 1.571 1.00 0.00 H new ATOM 0 HE3 LYS A 467 -2.653 14.816 3.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 467 -1.136 16.347 2.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 467 -0.406 15.682 3.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 467 0.036 15.130 1.924 1.00 0.00 H new ATOM 447 N TYR A 468 -4.066 9.971 1.628 1.00 0.00 N ATOM 448 CA TYR A 468 -4.241 9.858 0.178 1.00 0.00 C ATOM 449 C TYR A 468 -5.422 8.969 -0.213 1.00 0.00 C ATOM 450 O TYR A 468 -5.928 9.049 -1.330 1.00 0.00 O ATOM 451 CB TYR A 468 -2.918 9.468 -0.470 1.00 0.00 C ATOM 452 CG TYR A 468 -1.866 10.519 -0.224 1.00 0.00 C ATOM 453 CD1 TYR A 468 -2.075 11.801 -0.770 1.00 0.00 C ATOM 454 CD2 TYR A 468 -0.722 10.250 0.543 1.00 0.00 C ATOM 455 CE1 TYR A 468 -1.120 12.813 -0.588 1.00 0.00 C ATOM 456 CE2 TYR A 468 0.245 11.259 0.706 1.00 0.00 C ATOM 457 CZ TYR A 468 0.063 12.534 0.124 1.00 0.00 C ATOM 458 OH TYR A 468 0.987 13.515 0.309 1.00 0.00 O ATOM 0 H TYR A 468 -3.256 9.461 1.982 1.00 0.00 H new ATOM 0 HA TYR A 468 -4.518 10.835 -0.219 1.00 0.00 H new ATOM 0 HB2 TYR A 468 -2.582 8.511 -0.071 1.00 0.00 H new ATOM 0 HB3 TYR A 468 -3.060 9.334 -1.542 1.00 0.00 H new ATOM 0 HD1 TYR A 468 -2.975 12.006 -1.331 1.00 0.00 H new ATOM 0 HD2 TYR A 468 -0.586 9.282 1.002 1.00 0.00 H new ATOM 0 HE1 TYR A 468 -1.291 13.800 -0.992 1.00 0.00 H new ATOM 0 HE2 TYR A 468 1.136 11.057 1.282 1.00 0.00 H new ATOM 0 HH TYR A 468 1.705 13.183 0.888 1.00 0.00 H new ATOM 468 N SER A 469 -5.946 8.222 0.756 1.00 0.00 N ATOM 469 CA SER A 469 -7.187 7.459 0.764 1.00 0.00 C ATOM 470 C SER A 469 -8.387 8.265 0.267 1.00 0.00 C ATOM 471 O SER A 469 -9.302 7.684 -0.313 1.00 0.00 O ATOM 472 CB SER A 469 -7.473 7.021 2.209 1.00 0.00 C ATOM 473 OG SER A 469 -6.960 7.952 3.159 1.00 0.00 O ATOM 0 H SER A 469 -5.459 8.128 1.647 1.00 0.00 H new ATOM 0 HA SER A 469 -7.055 6.612 0.090 1.00 0.00 H new ATOM 0 HB2 SER A 469 -8.549 6.914 2.350 1.00 0.00 H new ATOM 0 HB3 SER A 469 -7.030 6.041 2.386 1.00 0.00 H new ATOM 0 HG SER A 469 -7.163 7.640 4.065 1.00 0.00 H new ATOM 479 N ASP A 470 -8.361 9.592 0.412 1.00 0.00 N ATOM 480 CA ASP A 470 -9.354 10.514 -0.140 1.00 0.00 C ATOM 481 C ASP A 470 -9.560 10.347 -1.661 1.00 0.00 C ATOM 482 O ASP A 470 -10.658 10.566 -2.179 1.00 0.00 O ATOM 483 CB ASP A 470 -8.901 11.943 0.178 1.00 0.00 C ATOM 484 CG ASP A 470 -9.940 12.995 -0.248 1.00 0.00 C ATOM 485 OD1 ASP A 470 -11.011 13.085 0.400 1.00 0.00 O ATOM 486 OD2 ASP A 470 -9.678 13.751 -1.214 1.00 0.00 O ATOM 0 H ASP A 470 -7.625 10.068 0.933 1.00 0.00 H new ATOM 0 HA ASP A 470 -10.317 10.292 0.319 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -8.715 12.033 1.248 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -7.957 12.143 -0.328 1.00 0.00 H new ATOM 491 N ALA A 471 -8.505 9.911 -2.358 1.00 0.00 N ATOM 492 CA ALA A 471 -8.449 9.655 -3.796 1.00 0.00 C ATOM 493 C ALA A 471 -8.005 8.222 -4.169 1.00 0.00 C ATOM 494 O ALA A 471 -8.059 7.836 -5.340 1.00 0.00 O ATOM 495 CB ALA A 471 -7.531 10.725 -4.393 1.00 0.00 C ATOM 0 H ALA A 471 -7.614 9.716 -1.902 1.00 0.00 H new ATOM 0 HA ALA A 471 -9.454 9.718 -4.214 1.00 0.00 H new ATOM 0 HB1 ALA A 471 -7.454 10.579 -5.470 1.00 0.00 H new ATOM 0 HB2 ALA A 471 -7.944 11.713 -4.189 1.00 0.00 H new ATOM 0 HB3 ALA A 471 -6.541 10.646 -3.945 1.00 0.00 H new ATOM 501 N LEU A 472 -7.597 7.422 -3.178 1.00 0.00 N ATOM 502 CA LEU A 472 -6.916 6.138 -3.321 1.00 0.00 C ATOM 503 C LEU A 472 -7.671 4.941 -2.706 1.00 0.00 C ATOM 504 O LEU A 472 -7.418 3.809 -3.107 1.00 0.00 O ATOM 505 CB LEU A 472 -5.525 6.389 -2.711 1.00 0.00 C ATOM 506 CG LEU A 472 -4.383 5.501 -3.203 1.00 0.00 C ATOM 507 CD1 LEU A 472 -3.124 6.354 -3.342 1.00 0.00 C ATOM 508 CD2 LEU A 472 -4.149 4.302 -2.287 1.00 0.00 C ATOM 0 H LEU A 472 -7.743 7.671 -2.200 1.00 0.00 H new ATOM 0 HA LEU A 472 -6.855 5.827 -4.364 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -5.253 7.427 -2.902 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -5.603 6.273 -1.630 1.00 0.00 H new ATOM 0 HG LEU A 472 -4.652 5.087 -4.174 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -2.300 5.732 -3.693 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -3.305 7.155 -4.059 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -2.867 6.784 -2.374 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -3.328 3.701 -2.678 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -3.898 4.652 -1.286 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -5.054 3.696 -2.243 1.00 0.00 H new ATOM 520 N SER A 473 -8.657 5.154 -1.819 1.00 0.00 N ATOM 521 CA SER A 473 -9.511 4.077 -1.261 1.00 0.00 C ATOM 522 C SER A 473 -10.352 3.342 -2.312 1.00 0.00 C ATOM 523 O SER A 473 -10.732 2.189 -2.105 1.00 0.00 O ATOM 524 CB SER A 473 -10.468 4.578 -0.175 1.00 0.00 C ATOM 525 OG SER A 473 -9.768 5.231 0.861 1.00 0.00 O ATOM 0 H SER A 473 -8.890 6.081 -1.463 1.00 0.00 H new ATOM 0 HA SER A 473 -8.788 3.382 -0.834 1.00 0.00 H new ATOM 0 HB2 SER A 473 -11.194 5.262 -0.614 1.00 0.00 H new ATOM 0 HB3 SER A 473 -11.029 3.738 0.235 1.00 0.00 H new ATOM 0 HG SER A 473 -9.657 6.178 0.634 1.00 0.00 H new ATOM 531 N GLY A 474 -10.599 3.974 -3.464 1.00 0.00 N ATOM 532 CA GLY A 474 -11.198 3.339 -4.644 1.00 0.00 C ATOM 533 C GLY A 474 -10.284 2.313 -5.334 1.00 0.00 C ATOM 534 O GLY A 474 -10.738 1.623 -6.249 1.00 0.00 O ATOM 0 H GLY A 474 -10.384 4.961 -3.606 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -12.123 2.845 -4.348 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -11.466 4.113 -5.363 1.00 0.00 H new ATOM 538 N THR A 475 -9.017 2.193 -4.909 1.00 0.00 N ATOM 539 CA THR A 475 -8.027 1.251 -5.459 1.00 0.00 C ATOM 540 C THR A 475 -7.616 0.214 -4.400 1.00 0.00 C ATOM 541 O THR A 475 -6.859 0.555 -3.486 1.00 0.00 O ATOM 542 CB THR A 475 -6.806 1.989 -6.041 1.00 0.00 C ATOM 543 OG1 THR A 475 -7.220 3.034 -6.904 1.00 0.00 O ATOM 544 CG2 THR A 475 -5.944 1.054 -6.886 1.00 0.00 C ATOM 0 H THR A 475 -8.641 2.764 -4.152 1.00 0.00 H new ATOM 0 HA THR A 475 -8.495 0.715 -6.285 1.00 0.00 H new ATOM 0 HB THR A 475 -6.242 2.373 -5.191 1.00 0.00 H new ATOM 0 HG1 THR A 475 -6.543 3.172 -7.599 1.00 0.00 H new ATOM 0 HG21 THR A 475 -5.091 1.605 -7.282 1.00 0.00 H new ATOM 0 HG22 THR A 475 -5.588 0.229 -6.268 1.00 0.00 H new ATOM 0 HG23 THR A 475 -6.537 0.660 -7.712 1.00 0.00 H new ATOM 552 N PRO A 476 -8.098 -1.047 -4.475 1.00 0.00 N ATOM 553 CA PRO A 476 -7.725 -2.100 -3.526 1.00 0.00 C ATOM 554 C PRO A 476 -6.250 -2.434 -3.657 1.00 0.00 C ATOM 555 O PRO A 476 -5.724 -2.413 -4.768 1.00 0.00 O ATOM 556 CB PRO A 476 -8.567 -3.326 -3.893 1.00 0.00 C ATOM 557 CG PRO A 476 -8.875 -3.117 -5.373 1.00 0.00 C ATOM 558 CD PRO A 476 -8.933 -1.601 -5.532 1.00 0.00 C ATOM 0 HA PRO A 476 -7.902 -1.781 -2.499 1.00 0.00 H new ATOM 0 HB2 PRO A 476 -8.020 -4.254 -3.724 1.00 0.00 H new ATOM 0 HB3 PRO A 476 -9.478 -3.380 -3.297 1.00 0.00 H new ATOM 0 HG2 PRO A 476 -8.103 -3.555 -6.006 1.00 0.00 H new ATOM 0 HG3 PRO A 476 -9.820 -3.583 -5.653 1.00 0.00 H new ATOM 0 HD2 PRO A 476 -8.569 -1.299 -6.514 1.00 0.00 H new ATOM 0 HD3 PRO A 476 -9.958 -1.240 -5.447 1.00 0.00 H new ATOM 566 N TRP A 477 -5.605 -2.853 -2.565 1.00 0.00 N ATOM 567 CA TRP A 477 -4.159 -3.122 -2.484 1.00 0.00 C ATOM 568 C TRP A 477 -3.578 -3.995 -3.602 1.00 0.00 C ATOM 569 O TRP A 477 -2.394 -3.924 -3.910 1.00 0.00 O ATOM 570 CB TRP A 477 -3.848 -3.832 -1.170 1.00 0.00 C ATOM 571 CG TRP A 477 -4.250 -5.279 -1.122 1.00 0.00 C ATOM 572 CD1 TRP A 477 -5.505 -5.777 -1.012 1.00 0.00 C ATOM 573 CD2 TRP A 477 -3.378 -6.445 -1.231 1.00 0.00 C ATOM 574 NE1 TRP A 477 -5.453 -7.146 -0.970 1.00 0.00 N ATOM 575 CE2 TRP A 477 -4.173 -7.626 -1.135 1.00 0.00 C ATOM 576 CE3 TRP A 477 -1.991 -6.622 -1.409 1.00 0.00 C ATOM 577 CZ2 TRP A 477 -3.622 -8.916 -1.210 1.00 0.00 C ATOM 578 CZ3 TRP A 477 -1.431 -7.905 -1.454 1.00 0.00 C ATOM 579 CH2 TRP A 477 -2.234 -9.055 -1.373 1.00 0.00 C ATOM 0 H TRP A 477 -6.087 -3.021 -1.682 1.00 0.00 H new ATOM 0 HA TRP A 477 -3.699 -2.138 -2.573 1.00 0.00 H new ATOM 0 HB2 TRP A 477 -2.777 -3.761 -0.980 1.00 0.00 H new ATOM 0 HB3 TRP A 477 -4.351 -3.303 -0.360 1.00 0.00 H new ATOM 0 HD1 TRP A 477 -6.408 -5.186 -0.965 1.00 0.00 H new ATOM 0 HE1 TRP A 477 -6.270 -7.741 -0.832 1.00 0.00 H new ATOM 0 HE3 TRP A 477 -1.352 -5.757 -1.512 1.00 0.00 H new ATOM 0 HZ2 TRP A 477 -4.256 -9.788 -1.143 1.00 0.00 H new ATOM 0 HZ3 TRP A 477 -0.361 -8.012 -1.553 1.00 0.00 H new ATOM 0 HH2 TRP A 477 -1.788 -10.037 -1.435 1.00 0.00 H new ATOM 590 N ILE A 478 -4.422 -4.811 -4.218 1.00 0.00 N ATOM 591 CA ILE A 478 -4.033 -5.816 -5.205 1.00 0.00 C ATOM 592 C ILE A 478 -4.052 -5.226 -6.616 1.00 0.00 C ATOM 593 O ILE A 478 -3.235 -5.608 -7.452 1.00 0.00 O ATOM 594 CB ILE A 478 -4.867 -7.103 -5.043 1.00 0.00 C ATOM 595 CG1 ILE A 478 -4.112 -8.288 -5.683 1.00 0.00 C ATOM 596 CG2 ILE A 478 -6.297 -6.961 -5.597 1.00 0.00 C ATOM 597 CD1 ILE A 478 -4.609 -9.657 -5.206 1.00 0.00 C ATOM 0 H ILE A 478 -5.426 -4.794 -4.042 1.00 0.00 H new ATOM 0 HA ILE A 478 -3.001 -6.117 -5.026 1.00 0.00 H new ATOM 0 HB ILE A 478 -4.990 -7.296 -3.977 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -4.213 -8.231 -6.767 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -3.050 -8.197 -5.457 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -6.837 -7.897 -5.456 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -6.814 -6.161 -5.068 1.00 0.00 H new ATOM 0 HG23 ILE A 478 -6.254 -6.724 -6.660 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -4.035 -10.443 -5.696 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -4.482 -9.734 -4.126 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -5.664 -9.769 -5.456 1.00 0.00 H new ATOM 609 N GLU A 479 -4.940 -4.256 -6.876 1.00 0.00 N ATOM 610 CA GLU A 479 -4.825 -3.415 -8.079 1.00 0.00 C ATOM 611 C GLU A 479 -3.803 -2.287 -7.823 1.00 0.00 C ATOM 612 O GLU A 479 -3.238 -1.719 -8.758 1.00 0.00 O ATOM 613 CB GLU A 479 -6.190 -2.822 -8.461 1.00 0.00 C ATOM 614 CG GLU A 479 -7.158 -3.899 -8.970 1.00 0.00 C ATOM 615 CD GLU A 479 -8.443 -3.271 -9.545 1.00 0.00 C ATOM 616 OE1 GLU A 479 -8.437 -2.844 -10.726 1.00 0.00 O ATOM 617 OE2 GLU A 479 -9.473 -3.213 -8.831 1.00 0.00 O ATOM 0 H GLU A 479 -5.737 -4.035 -6.279 1.00 0.00 H new ATOM 0 HA GLU A 479 -4.481 -4.032 -8.909 1.00 0.00 H new ATOM 0 HB2 GLU A 479 -6.625 -2.323 -7.595 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -6.054 -2.063 -9.231 1.00 0.00 H new ATOM 0 HG2 GLU A 479 -6.668 -4.498 -9.738 1.00 0.00 H new ATOM 0 HG3 GLU A 479 -7.415 -4.575 -8.154 1.00 0.00 H new ATOM 624 N LEU A 480 -3.557 -1.978 -6.543 1.00 0.00 N ATOM 625 CA LEU A 480 -2.789 -0.842 -6.064 1.00 0.00 C ATOM 626 C LEU A 480 -1.292 -0.990 -6.182 1.00 0.00 C ATOM 627 O LEU A 480 -0.635 -0.171 -6.809 1.00 0.00 O ATOM 628 CB LEU A 480 -3.080 -0.596 -4.582 1.00 0.00 C ATOM 629 CG LEU A 480 -2.560 0.724 -4.033 1.00 0.00 C ATOM 630 CD1 LEU A 480 -3.337 1.816 -4.727 1.00 0.00 C ATOM 631 CD2 LEU A 480 -2.800 0.770 -2.527 1.00 0.00 C ATOM 0 H LEU A 480 -3.912 -2.552 -5.778 1.00 0.00 H new ATOM 0 HA LEU A 480 -3.102 -0.018 -6.706 1.00 0.00 H new ATOM 0 HB2 LEU A 480 -4.158 -0.636 -4.428 1.00 0.00 H new ATOM 0 HB3 LEU A 480 -2.644 -1.410 -4.002 1.00 0.00 H new ATOM 0 HG LEU A 480 -1.491 0.844 -4.208 1.00 0.00 H new ATOM 0 HD11 LEU A 480 -3.000 2.788 -4.366 1.00 0.00 H new ATOM 0 HD12 LEU A 480 -3.174 1.752 -5.803 1.00 0.00 H new ATOM 0 HD13 LEU A 480 -4.399 1.698 -4.514 1.00 0.00 H new ATOM 0 HD21 LEU A 480 -2.429 1.714 -2.128 1.00 0.00 H new ATOM 0 HD22 LEU A 480 -3.868 0.686 -2.326 1.00 0.00 H new ATOM 0 HD23 LEU A 480 -2.275 -0.057 -2.049 1.00 0.00 H new ATOM 643 N ILE A 481 -0.740 -2.006 -5.518 1.00 0.00 N ATOM 644 CA ILE A 481 0.702 -2.126 -5.311 1.00 0.00 C ATOM 645 C ILE A 481 1.494 -2.196 -6.630 1.00 0.00 C ATOM 646 O ILE A 481 2.701 -1.970 -6.680 1.00 0.00 O ATOM 647 CB ILE A 481 0.996 -3.342 -4.405 1.00 0.00 C ATOM 648 CG1 ILE A 481 0.548 -4.630 -5.135 1.00 0.00 C ATOM 649 CG2 ILE A 481 0.402 -3.085 -3.003 1.00 0.00 C ATOM 650 CD1 ILE A 481 0.628 -5.887 -4.290 1.00 0.00 C ATOM 0 H ILE A 481 -1.280 -2.768 -5.109 1.00 0.00 H new ATOM 0 HA ILE A 481 1.043 -1.218 -4.813 1.00 0.00 H new ATOM 0 HB ILE A 481 2.060 -3.491 -4.220 1.00 0.00 H new ATOM 0 HG12 ILE A 481 -0.479 -4.501 -5.477 1.00 0.00 H new ATOM 0 HG13 ILE A 481 1.165 -4.764 -6.023 1.00 0.00 H new ATOM 0 HG21 ILE A 481 0.606 -3.940 -2.359 1.00 0.00 H new ATOM 0 HG22 ILE A 481 0.855 -2.191 -2.574 1.00 0.00 H new ATOM 0 HG23 ILE A 481 -0.675 -2.942 -3.085 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.296 -6.743 -4.878 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.658 -6.045 -3.969 1.00 0.00 H new ATOM 0 HD13 ILE A 481 -0.012 -5.778 -3.415 1.00 0.00 H new ATOM 662 N TYR A 482 0.770 -2.511 -7.702 1.00 0.00 N ATOM 663 CA TYR A 482 1.196 -2.621 -9.092 1.00 0.00 C ATOM 664 C TYR A 482 1.427 -1.266 -9.781 1.00 0.00 C ATOM 665 O TYR A 482 2.120 -1.231 -10.803 1.00 0.00 O ATOM 666 CB TYR A 482 0.092 -3.368 -9.850 1.00 0.00 C ATOM 667 CG TYR A 482 -0.097 -4.852 -9.584 1.00 0.00 C ATOM 668 CD1 TYR A 482 0.781 -5.601 -8.769 1.00 0.00 C ATOM 669 CD2 TYR A 482 -1.193 -5.488 -10.197 1.00 0.00 C ATOM 670 CE1 TYR A 482 0.562 -6.978 -8.571 1.00 0.00 C ATOM 671 CE2 TYR A 482 -1.415 -6.864 -10.009 1.00 0.00 C ATOM 672 CZ TYR A 482 -0.533 -7.612 -9.200 1.00 0.00 C ATOM 673 OH TYR A 482 -0.732 -8.947 -9.048 1.00 0.00 O ATOM 0 H TYR A 482 -0.225 -2.715 -7.608 1.00 0.00 H new ATOM 0 HA TYR A 482 2.153 -3.142 -9.104 1.00 0.00 H new ATOM 0 HB2 TYR A 482 -0.853 -2.870 -9.634 1.00 0.00 H new ATOM 0 HB3 TYR A 482 0.281 -3.244 -10.916 1.00 0.00 H new ATOM 0 HD1 TYR A 482 1.622 -5.116 -8.297 1.00 0.00 H new ATOM 0 HD2 TYR A 482 -1.868 -4.915 -10.816 1.00 0.00 H new ATOM 0 HE1 TYR A 482 1.229 -7.548 -7.941 1.00 0.00 H new ATOM 0 HE2 TYR A 482 -2.257 -7.347 -10.482 1.00 0.00 H new ATOM 0 HH TYR A 482 -1.531 -9.218 -9.547 1.00 0.00 H new ATOM 683 N LEU A 483 0.870 -0.167 -9.251 1.00 0.00 N ATOM 684 CA LEU A 483 1.226 1.185 -9.726 1.00 0.00 C ATOM 685 C LEU A 483 2.585 1.661 -9.165 1.00 0.00 C ATOM 686 O LEU A 483 3.260 0.934 -8.436 1.00 0.00 O ATOM 687 CB LEU A 483 0.043 2.195 -9.765 1.00 0.00 C ATOM 688 CG LEU A 483 -1.070 2.322 -8.717 1.00 0.00 C ATOM 689 CD1 LEU A 483 -0.501 2.887 -7.450 1.00 0.00 C ATOM 690 CD2 LEU A 483 -2.150 3.319 -9.157 1.00 0.00 C ATOM 0 H LEU A 483 0.178 -0.183 -8.501 1.00 0.00 H new ATOM 0 HA LEU A 483 1.424 1.118 -10.796 1.00 0.00 H new ATOM 0 HB2 LEU A 483 0.501 3.182 -9.829 1.00 0.00 H new ATOM 0 HB3 LEU A 483 -0.465 2.017 -10.713 1.00 0.00 H new ATOM 0 HG LEU A 483 -1.493 1.326 -8.585 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -1.291 2.978 -6.705 1.00 0.00 H new ATOM 0 HD12 LEU A 483 0.278 2.224 -7.074 1.00 0.00 H new ATOM 0 HD13 LEU A 483 -0.076 3.871 -7.649 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -2.921 3.382 -8.389 1.00 0.00 H new ATOM 0 HD22 LEU A 483 -1.701 4.302 -9.302 1.00 0.00 H new ATOM 0 HD23 LEU A 483 -2.596 2.983 -10.093 1.00 0.00 H new ATOM 702 N ASP A 484 3.058 2.832 -9.594 1.00 0.00 N ATOM 703 CA ASP A 484 4.430 3.308 -9.355 1.00 0.00 C ATOM 704 C ASP A 484 4.496 4.840 -9.224 1.00 0.00 C ATOM 705 O ASP A 484 3.462 5.507 -9.173 1.00 0.00 O ATOM 706 CB ASP A 484 5.343 2.818 -10.497 1.00 0.00 C ATOM 707 CG ASP A 484 6.717 2.352 -9.986 1.00 0.00 C ATOM 708 OD1 ASP A 484 7.501 3.209 -9.517 1.00 0.00 O ATOM 709 OD2 ASP A 484 7.023 1.138 -10.071 1.00 0.00 O ATOM 0 H ASP A 484 2.492 3.491 -10.127 1.00 0.00 H new ATOM 0 HA ASP A 484 4.775 2.897 -8.406 1.00 0.00 H new ATOM 0 HB2 ASP A 484 4.855 1.997 -11.022 1.00 0.00 H new ATOM 0 HB3 ASP A 484 5.480 3.622 -11.220 1.00 0.00 H new ATOM 714 N ASP A 485 5.715 5.383 -9.189 1.00 0.00 N ATOM 715 CA ASP A 485 6.098 6.760 -8.877 1.00 0.00 C ATOM 716 C ASP A 485 5.092 7.826 -9.345 1.00 0.00 C ATOM 717 O ASP A 485 4.338 8.365 -8.537 1.00 0.00 O ATOM 718 CB ASP A 485 7.524 7.009 -9.400 1.00 0.00 C ATOM 719 CG ASP A 485 8.046 8.398 -9.011 1.00 0.00 C ATOM 720 OD1 ASP A 485 8.186 8.680 -7.801 1.00 0.00 O ATOM 721 OD2 ASP A 485 8.293 9.243 -9.901 1.00 0.00 O ATOM 0 H ASP A 485 6.536 4.815 -9.398 1.00 0.00 H new ATOM 0 HA ASP A 485 6.084 6.870 -7.793 1.00 0.00 H new ATOM 0 HB2 ASP A 485 8.194 6.246 -9.003 1.00 0.00 H new ATOM 0 HB3 ASP A 485 7.534 6.909 -10.485 1.00 0.00 H new ATOM 726 N GLU A 486 5.036 8.133 -10.644 1.00 0.00 N ATOM 727 CA GLU A 486 4.135 9.136 -11.190 1.00 0.00 C ATOM 728 C GLU A 486 2.678 8.668 -11.301 1.00 0.00 C ATOM 729 O GLU A 486 1.797 9.489 -11.526 1.00 0.00 O ATOM 730 CB GLU A 486 4.668 9.567 -12.564 1.00 0.00 C ATOM 731 CG GLU A 486 4.283 11.026 -12.802 1.00 0.00 C ATOM 732 CD GLU A 486 4.566 11.529 -14.232 1.00 0.00 C ATOM 733 OE1 GLU A 486 5.702 11.361 -14.738 1.00 0.00 O ATOM 734 OE2 GLU A 486 3.643 12.119 -14.850 1.00 0.00 O ATOM 0 H GLU A 486 5.623 7.685 -11.348 1.00 0.00 H new ATOM 0 HA GLU A 486 4.115 9.975 -10.494 1.00 0.00 H new ATOM 0 HB2 GLU A 486 5.751 9.451 -12.603 1.00 0.00 H new ATOM 0 HB3 GLU A 486 4.251 8.933 -13.347 1.00 0.00 H new ATOM 0 HG2 GLU A 486 3.221 11.149 -12.589 1.00 0.00 H new ATOM 0 HG3 GLU A 486 4.825 11.653 -12.094 1.00 0.00 H new ATOM 741 N THR A 487 2.377 7.380 -11.125 1.00 0.00 N ATOM 742 CA THR A 487 0.987 6.889 -11.235 1.00 0.00 C ATOM 743 C THR A 487 0.209 6.947 -9.924 1.00 0.00 C ATOM 744 O THR A 487 -0.996 7.206 -9.930 1.00 0.00 O ATOM 745 CB THR A 487 0.902 5.513 -11.917 1.00 0.00 C ATOM 746 OG1 THR A 487 1.608 5.531 -13.142 1.00 0.00 O ATOM 747 CG2 THR A 487 -0.531 5.108 -12.273 1.00 0.00 C ATOM 0 H THR A 487 3.064 6.658 -10.908 1.00 0.00 H new ATOM 0 HA THR A 487 0.482 7.595 -11.895 1.00 0.00 H new ATOM 0 HB THR A 487 1.320 4.808 -11.198 1.00 0.00 H new ATOM 0 HG1 THR A 487 1.549 4.650 -13.567 1.00 0.00 H new ATOM 0 HG21 THR A 487 -0.524 4.128 -12.751 1.00 0.00 H new ATOM 0 HG22 THR A 487 -1.133 5.065 -11.365 1.00 0.00 H new ATOM 0 HG23 THR A 487 -0.957 5.842 -12.956 1.00 0.00 H new ATOM 755 N LEU A 488 0.897 6.859 -8.789 1.00 0.00 N ATOM 756 CA LEU A 488 0.362 7.201 -7.466 1.00 0.00 C ATOM 757 C LEU A 488 -0.117 8.660 -7.449 1.00 0.00 C ATOM 758 O LEU A 488 -1.056 9.056 -6.760 1.00 0.00 O ATOM 759 CB LEU A 488 1.528 7.018 -6.485 1.00 0.00 C ATOM 760 CG LEU A 488 1.716 5.542 -6.115 1.00 0.00 C ATOM 761 CD1 LEU A 488 3.121 5.314 -5.594 1.00 0.00 C ATOM 762 CD2 LEU A 488 0.677 5.125 -5.072 1.00 0.00 C ATOM 0 H LEU A 488 1.866 6.541 -8.758 1.00 0.00 H new ATOM 0 HA LEU A 488 -0.490 6.574 -7.203 1.00 0.00 H new ATOM 0 HB2 LEU A 488 2.445 7.403 -6.930 1.00 0.00 H new ATOM 0 HB3 LEU A 488 1.342 7.601 -5.583 1.00 0.00 H new ATOM 0 HG LEU A 488 1.574 4.929 -7.005 1.00 0.00 H new ATOM 0 HD11 LEU A 488 3.246 4.263 -5.333 1.00 0.00 H new ATOM 0 HD12 LEU A 488 3.843 5.586 -6.364 1.00 0.00 H new ATOM 0 HD13 LEU A 488 3.285 5.929 -4.709 1.00 0.00 H new ATOM 0 HD21 LEU A 488 0.819 4.075 -4.816 1.00 0.00 H new ATOM 0 HD22 LEU A 488 0.795 5.736 -4.177 1.00 0.00 H new ATOM 0 HD23 LEU A 488 -0.324 5.267 -5.479 1.00 0.00 H new ATOM 774 N GLU A 489 0.529 9.487 -8.259 1.00 0.00 N ATOM 775 CA GLU A 489 0.309 10.896 -8.410 1.00 0.00 C ATOM 776 C GLU A 489 -0.867 11.203 -9.356 1.00 0.00 C ATOM 777 O GLU A 489 -1.520 12.232 -9.200 1.00 0.00 O ATOM 778 CB GLU A 489 1.689 11.376 -8.840 1.00 0.00 C ATOM 779 CG GLU A 489 1.743 12.816 -9.291 1.00 0.00 C ATOM 780 CD GLU A 489 3.123 13.451 -9.065 1.00 0.00 C ATOM 781 OE1 GLU A 489 3.604 13.441 -7.905 1.00 0.00 O ATOM 782 OE2 GLU A 489 3.727 13.971 -10.031 1.00 0.00 O ATOM 0 H GLU A 489 1.275 9.152 -8.869 1.00 0.00 H new ATOM 0 HA GLU A 489 -0.025 11.424 -7.517 1.00 0.00 H new ATOM 0 HB2 GLU A 489 2.380 11.244 -8.008 1.00 0.00 H new ATOM 0 HB3 GLU A 489 2.043 10.741 -9.652 1.00 0.00 H new ATOM 0 HG2 GLU A 489 1.490 12.872 -10.350 1.00 0.00 H new ATOM 0 HG3 GLU A 489 0.989 13.391 -8.752 1.00 0.00 H new ATOM 789 N LYS A 490 -1.245 10.282 -10.255 1.00 0.00 N ATOM 790 CA LYS A 490 -2.490 10.351 -11.021 1.00 0.00 C ATOM 791 C LYS A 490 -3.718 9.969 -10.180 1.00 0.00 C ATOM 792 O LYS A 490 -4.832 10.373 -10.518 1.00 0.00 O ATOM 793 CB LYS A 490 -2.367 9.492 -12.279 1.00 0.00 C ATOM 794 CG LYS A 490 -1.130 9.741 -13.136 1.00 0.00 C ATOM 795 CD LYS A 490 -0.909 11.188 -13.549 1.00 0.00 C ATOM 796 CE LYS A 490 0.543 11.312 -14.026 1.00 0.00 C ATOM 797 NZ LYS A 490 0.883 12.654 -14.554 1.00 0.00 N ATOM 0 H LYS A 490 -0.684 9.458 -10.470 1.00 0.00 H new ATOM 0 HA LYS A 490 -2.650 11.387 -11.320 1.00 0.00 H new ATOM 0 HB2 LYS A 490 -2.375 8.443 -11.982 1.00 0.00 H new ATOM 0 HB3 LYS A 490 -3.251 9.655 -12.895 1.00 0.00 H new ATOM 0 HG2 LYS A 490 -0.253 9.398 -12.587 1.00 0.00 H new ATOM 0 HG3 LYS A 490 -1.202 9.130 -14.036 1.00 0.00 H new ATOM 0 HD2 LYS A 490 -1.600 11.470 -14.344 1.00 0.00 H new ATOM 0 HD3 LYS A 490 -1.096 11.859 -12.711 1.00 0.00 H new ATOM 0 HE2 LYS A 490 1.210 11.078 -13.196 1.00 0.00 H new ATOM 0 HE3 LYS A 490 0.726 10.569 -14.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 1.904 12.703 -14.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 0.356 12.825 -15.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 0.628 13.378 -13.852 1.00 0.00 H new ATOM 811 N LYS A 491 -3.523 9.237 -9.069 1.00 0.00 N ATOM 812 CA LYS A 491 -4.526 9.009 -8.018 1.00 0.00 C ATOM 813 C LYS A 491 -4.683 10.299 -7.232 1.00 0.00 C ATOM 814 O LYS A 491 -5.750 10.908 -7.213 1.00 0.00 O ATOM 815 CB LYS A 491 -4.156 7.778 -7.157 1.00 0.00 C ATOM 816 CG LYS A 491 -3.988 6.441 -7.903 1.00 0.00 C ATOM 817 CD LYS A 491 -5.288 5.645 -8.077 1.00 0.00 C ATOM 818 CE LYS A 491 -6.168 6.158 -9.219 1.00 0.00 C ATOM 819 NZ LYS A 491 -7.389 5.321 -9.358 1.00 0.00 N ATOM 0 H LYS A 491 -2.635 8.774 -8.873 1.00 0.00 H new ATOM 0 HA LYS A 491 -5.498 8.761 -8.445 1.00 0.00 H new ATOM 0 HB2 LYS A 491 -3.225 7.996 -6.634 1.00 0.00 H new ATOM 0 HB3 LYS A 491 -4.927 7.650 -6.397 1.00 0.00 H new ATOM 0 HG2 LYS A 491 -3.563 6.639 -8.887 1.00 0.00 H new ATOM 0 HG3 LYS A 491 -3.269 5.825 -7.363 1.00 0.00 H new ATOM 0 HD2 LYS A 491 -5.043 4.599 -8.259 1.00 0.00 H new ATOM 0 HD3 LYS A 491 -5.855 5.682 -7.147 1.00 0.00 H new ATOM 0 HE2 LYS A 491 -6.451 7.194 -9.030 1.00 0.00 H new ATOM 0 HE3 LYS A 491 -5.605 6.146 -10.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 491 -7.973 5.685 -10.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 491 -7.115 4.338 -9.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 491 -7.934 5.353 -8.473 1.00 0.00 H new ATOM 833 N GLY A 492 -3.573 10.743 -6.671 1.00 0.00 N ATOM 834 CA GLY A 492 -3.381 12.070 -6.142 1.00 0.00 C ATOM 835 C GLY A 492 -2.623 12.140 -4.844 1.00 0.00 C ATOM 836 O GLY A 492 -2.888 12.963 -3.969 1.00 0.00 O ATOM 0 H GLY A 492 -2.745 10.156 -6.570 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -2.852 12.667 -6.885 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -4.358 12.531 -5.999 1.00 0.00 H new ATOM 840 N VAL A 493 -1.618 11.282 -4.783 1.00 0.00 N ATOM 841 CA VAL A 493 -0.559 11.335 -3.801 1.00 0.00 C ATOM 842 C VAL A 493 0.218 12.647 -3.970 1.00 0.00 C ATOM 843 O VAL A 493 0.523 13.354 -3.015 1.00 0.00 O ATOM 844 CB VAL A 493 0.270 10.067 -3.982 1.00 0.00 C ATOM 845 CG1 VAL A 493 1.524 10.212 -3.180 1.00 0.00 C ATOM 846 CG2 VAL A 493 -0.596 8.885 -3.534 1.00 0.00 C ATOM 0 H VAL A 493 -1.518 10.507 -5.438 1.00 0.00 H new ATOM 0 HA VAL A 493 -0.918 11.349 -2.772 1.00 0.00 H new ATOM 0 HB VAL A 493 0.565 9.896 -5.017 1.00 0.00 H new ATOM 0 HG11 VAL A 493 2.134 9.316 -3.294 1.00 0.00 H new ATOM 0 HG12 VAL A 493 2.083 11.079 -3.532 1.00 0.00 H new ATOM 0 HG13 VAL A 493 1.270 10.347 -2.129 1.00 0.00 H new ATOM 0 HG21 VAL A 493 -0.034 7.958 -3.650 1.00 0.00 H new ATOM 0 HG22 VAL A 493 -0.873 9.013 -2.488 1.00 0.00 H new ATOM 0 HG23 VAL A 493 -1.497 8.842 -4.146 1.00 0.00 H new ATOM 856 N LEU A 494 0.460 12.991 -5.234 1.00 0.00 N ATOM 857 CA LEU A 494 0.950 14.262 -5.771 1.00 0.00 C ATOM 858 C LEU A 494 2.195 14.878 -5.128 1.00 0.00 C ATOM 859 O LEU A 494 2.411 16.093 -5.101 1.00 0.00 O ATOM 860 CB LEU A 494 -0.222 15.223 -5.910 1.00 0.00 C ATOM 861 CG LEU A 494 -0.921 14.837 -7.216 1.00 0.00 C ATOM 862 CD1 LEU A 494 -2.399 14.922 -7.025 1.00 0.00 C ATOM 863 CD2 LEU A 494 -0.407 15.672 -8.375 1.00 0.00 C ATOM 0 H LEU A 494 0.302 12.319 -5.984 1.00 0.00 H new ATOM 0 HA LEU A 494 1.361 14.028 -6.753 1.00 0.00 H new ATOM 0 HB2 LEU A 494 -0.901 15.137 -5.062 1.00 0.00 H new ATOM 0 HB3 LEU A 494 0.121 16.257 -5.940 1.00 0.00 H new ATOM 0 HG LEU A 494 -0.687 13.805 -7.477 1.00 0.00 H new ATOM 0 HD11 LEU A 494 -2.902 14.648 -7.952 1.00 0.00 H new ATOM 0 HD12 LEU A 494 -2.703 14.239 -6.232 1.00 0.00 H new ATOM 0 HD13 LEU A 494 -2.672 15.941 -6.751 1.00 0.00 H new ATOM 0 HD21 LEU A 494 -0.920 15.378 -9.291 1.00 0.00 H new ATOM 0 HD22 LEU A 494 -0.596 16.727 -8.176 1.00 0.00 H new ATOM 0 HD23 LEU A 494 0.665 15.512 -8.492 1.00 0.00 H new ATOM 875 N ALA A 495 3.000 13.986 -4.593 1.00 0.00 N ATOM 876 CA ALA A 495 4.164 14.281 -3.774 1.00 0.00 C ATOM 877 C ALA A 495 5.179 13.170 -3.930 1.00 0.00 C ATOM 878 O ALA A 495 4.893 12.035 -3.559 1.00 0.00 O ATOM 879 CB ALA A 495 3.736 14.376 -2.309 1.00 0.00 C ATOM 0 H ALA A 495 2.856 12.984 -4.722 1.00 0.00 H new ATOM 0 HA ALA A 495 4.607 15.226 -4.089 1.00 0.00 H new ATOM 0 HB1 ALA A 495 4.605 14.597 -1.690 1.00 0.00 H new ATOM 0 HB2 ALA A 495 2.998 15.171 -2.196 1.00 0.00 H new ATOM 0 HB3 ALA A 495 3.299 13.428 -1.995 1.00 0.00 H new ATOM 885 N LEU A 496 6.373 13.490 -4.420 1.00 0.00 N ATOM 886 CA LEU A 496 7.498 12.564 -4.505 1.00 0.00 C ATOM 887 C LEU A 496 7.759 11.830 -3.204 1.00 0.00 C ATOM 888 O LEU A 496 7.888 10.610 -3.206 1.00 0.00 O ATOM 889 CB LEU A 496 8.703 13.334 -5.002 1.00 0.00 C ATOM 890 CG LEU A 496 10.065 12.616 -4.849 1.00 0.00 C ATOM 891 CD1 LEU A 496 11.000 13.093 -5.949 1.00 0.00 C ATOM 892 CD2 LEU A 496 10.799 12.925 -3.536 1.00 0.00 C ATOM 0 H LEU A 496 6.590 14.421 -4.777 1.00 0.00 H new ATOM 0 HA LEU A 496 7.260 11.770 -5.213 1.00 0.00 H new ATOM 0 HB2 LEU A 496 8.553 13.568 -6.056 1.00 0.00 H new ATOM 0 HB3 LEU A 496 8.751 14.283 -4.468 1.00 0.00 H new ATOM 0 HG LEU A 496 9.834 11.551 -4.885 1.00 0.00 H new ATOM 0 HD11 LEU A 496 11.963 12.593 -5.850 1.00 0.00 H new ATOM 0 HD12 LEU A 496 10.567 12.858 -6.922 1.00 0.00 H new ATOM 0 HD13 LEU A 496 11.141 14.171 -5.865 1.00 0.00 H new ATOM 0 HD21 LEU A 496 11.743 12.381 -3.511 1.00 0.00 H new ATOM 0 HD22 LEU A 496 10.994 13.995 -3.472 1.00 0.00 H new ATOM 0 HD23 LEU A 496 10.181 12.618 -2.693 1.00 0.00 H new ATOM 904 N GLY A 497 7.799 12.546 -2.084 1.00 0.00 N ATOM 905 CA GLY A 497 8.115 11.884 -0.827 1.00 0.00 C ATOM 906 C GLY A 497 6.960 11.132 -0.189 1.00 0.00 C ATOM 907 O GLY A 497 7.163 10.380 0.762 1.00 0.00 O ATOM 0 H GLY A 497 7.623 13.549 -2.021 1.00 0.00 H new ATOM 0 HA2 GLY A 497 8.934 11.185 -0.998 1.00 0.00 H new ATOM 0 HA3 GLY A 497 8.476 12.632 -0.121 1.00 0.00 H new ATOM 911 N ALA A 498 5.771 11.265 -0.769 1.00 0.00 N ATOM 912 CA ALA A 498 4.630 10.418 -0.439 1.00 0.00 C ATOM 913 C ALA A 498 4.609 9.185 -1.349 1.00 0.00 C ATOM 914 O ALA A 498 4.601 8.052 -0.879 1.00 0.00 O ATOM 915 CB ALA A 498 3.357 11.229 -0.598 1.00 0.00 C ATOM 0 H ALA A 498 5.571 11.965 -1.483 1.00 0.00 H new ATOM 0 HA ALA A 498 4.708 10.072 0.592 1.00 0.00 H new ATOM 0 HB1 ALA A 498 2.496 10.606 -0.354 1.00 0.00 H new ATOM 0 HB2 ALA A 498 3.386 12.087 0.073 1.00 0.00 H new ATOM 0 HB3 ALA A 498 3.273 11.577 -1.628 1.00 0.00 H new ATOM 921 N ARG A 499 4.663 9.389 -2.668 1.00 0.00 N ATOM 922 CA ARG A 499 4.661 8.328 -3.680 1.00 0.00 C ATOM 923 C ARG A 499 5.876 7.380 -3.539 1.00 0.00 C ATOM 924 O ARG A 499 5.752 6.200 -3.811 1.00 0.00 O ATOM 925 CB ARG A 499 4.465 8.931 -5.089 1.00 0.00 C ATOM 926 CG ARG A 499 5.658 9.755 -5.563 1.00 0.00 C ATOM 927 CD ARG A 499 5.383 10.779 -6.674 1.00 0.00 C ATOM 928 NE ARG A 499 6.565 10.956 -7.534 1.00 0.00 N ATOM 929 CZ ARG A 499 6.947 11.994 -8.249 1.00 0.00 C ATOM 930 NH1 ARG A 499 6.321 13.133 -8.243 1.00 0.00 N ATOM 931 NH2 ARG A 499 7.994 11.883 -9.008 1.00 0.00 N ATOM 0 H ARG A 499 4.711 10.324 -3.073 1.00 0.00 H new ATOM 0 HA ARG A 499 3.804 7.677 -3.510 1.00 0.00 H new ATOM 0 HB2 ARG A 499 4.283 8.125 -5.800 1.00 0.00 H new ATOM 0 HB3 ARG A 499 3.575 9.560 -5.087 1.00 0.00 H new ATOM 0 HG2 ARG A 499 6.070 10.285 -4.704 1.00 0.00 H new ATOM 0 HG3 ARG A 499 6.429 9.069 -5.914 1.00 0.00 H new ATOM 0 HD2 ARG A 499 4.537 10.449 -7.276 1.00 0.00 H new ATOM 0 HD3 ARG A 499 5.105 11.735 -6.231 1.00 0.00 H new ATOM 0 HE ARG A 499 7.185 10.148 -7.584 1.00 0.00 H new ATOM 0 HH11 ARG A 499 5.490 13.255 -7.664 1.00 0.00 H new ATOM 0 HH12 ARG A 499 6.661 13.905 -8.817 1.00 0.00 H new ATOM 0 HH21 ARG A 499 8.507 11.002 -9.044 1.00 0.00 H new ATOM 0 HH22 ARG A 499 8.304 12.677 -9.569 1.00 0.00 H new ATOM 945 N ARG A 500 7.018 7.818 -2.990 1.00 0.00 N ATOM 946 CA ARG A 500 8.230 7.029 -2.691 1.00 0.00 C ATOM 947 C ARG A 500 8.046 6.240 -1.399 1.00 0.00 C ATOM 948 O ARG A 500 8.414 5.070 -1.319 1.00 0.00 O ATOM 949 CB ARG A 500 9.376 8.035 -2.605 1.00 0.00 C ATOM 950 CG ARG A 500 10.639 7.410 -2.047 1.00 0.00 C ATOM 951 CD ARG A 500 11.774 8.420 -2.160 1.00 0.00 C ATOM 952 NE ARG A 500 13.039 7.884 -1.620 1.00 0.00 N ATOM 953 CZ ARG A 500 14.192 8.520 -1.506 1.00 0.00 C ATOM 954 NH1 ARG A 500 14.341 9.759 -1.882 1.00 0.00 N ATOM 955 NH2 ARG A 500 15.232 7.916 -1.006 1.00 0.00 N ATOM 0 H ARG A 500 7.131 8.796 -2.724 1.00 0.00 H new ATOM 0 HA ARG A 500 8.440 6.287 -3.461 1.00 0.00 H new ATOM 0 HB2 ARG A 500 9.579 8.439 -3.597 1.00 0.00 H new ATOM 0 HB3 ARG A 500 9.077 8.872 -1.975 1.00 0.00 H new ATOM 0 HG2 ARG A 500 10.491 7.123 -1.006 1.00 0.00 H new ATOM 0 HG3 ARG A 500 10.886 6.501 -2.596 1.00 0.00 H new ATOM 0 HD2 ARG A 500 11.913 8.696 -3.205 1.00 0.00 H new ATOM 0 HD3 ARG A 500 11.506 9.330 -1.623 1.00 0.00 H new ATOM 0 HE ARG A 500 13.021 6.916 -1.299 1.00 0.00 H new ATOM 0 HH11 ARG A 500 13.553 10.270 -2.279 1.00 0.00 H new ATOM 0 HH12 ARG A 500 15.246 10.218 -1.779 1.00 0.00 H new ATOM 0 HH21 ARG A 500 15.160 6.946 -0.699 1.00 0.00 H new ATOM 0 HH22 ARG A 500 16.119 8.413 -0.921 1.00 0.00 H new ATOM 969 N LYS A 501 7.412 6.853 -0.398 1.00 0.00 N ATOM 970 CA LYS A 501 6.905 6.109 0.773 1.00 0.00 C ATOM 971 C LYS A 501 5.992 4.985 0.342 1.00 0.00 C ATOM 972 O LYS A 501 5.986 3.910 0.937 1.00 0.00 O ATOM 973 CB LYS A 501 6.038 7.025 1.634 1.00 0.00 C ATOM 974 CG LYS A 501 6.366 7.079 3.136 1.00 0.00 C ATOM 975 CD LYS A 501 7.835 7.358 3.502 1.00 0.00 C ATOM 976 CE LYS A 501 8.387 8.636 2.855 1.00 0.00 C ATOM 977 NZ LYS A 501 9.726 8.990 3.396 1.00 0.00 N ATOM 0 H LYS A 501 7.234 7.857 -0.367 1.00 0.00 H new ATOM 0 HA LYS A 501 7.774 5.732 1.312 1.00 0.00 H new ATOM 0 HB2 LYS A 501 6.110 8.036 1.234 1.00 0.00 H new ATOM 0 HB3 LYS A 501 5.000 6.712 1.524 1.00 0.00 H new ATOM 0 HG2 LYS A 501 5.747 7.850 3.594 1.00 0.00 H new ATOM 0 HG3 LYS A 501 6.076 6.129 3.584 1.00 0.00 H new ATOM 0 HD2 LYS A 501 7.924 7.439 4.585 1.00 0.00 H new ATOM 0 HD3 LYS A 501 8.447 6.510 3.195 1.00 0.00 H new ATOM 0 HE2 LYS A 501 8.455 8.498 1.776 1.00 0.00 H new ATOM 0 HE3 LYS A 501 7.695 9.460 3.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 10.068 9.858 2.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 9.656 9.146 4.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 10.392 8.214 3.209 1.00 0.00 H new ATOM 991 N LEU A 502 5.199 5.245 -0.693 1.00 0.00 N ATOM 992 CA LEU A 502 4.301 4.244 -1.170 1.00 0.00 C ATOM 993 C LEU A 502 5.060 3.120 -1.887 1.00 0.00 C ATOM 994 O LEU A 502 4.666 1.969 -1.771 1.00 0.00 O ATOM 995 CB LEU A 502 3.264 4.863 -2.105 1.00 0.00 C ATOM 996 CG LEU A 502 1.905 5.305 -1.523 1.00 0.00 C ATOM 997 CD1 LEU A 502 1.747 5.219 -0.010 1.00 0.00 C ATOM 998 CD2 LEU A 502 1.593 6.753 -1.889 1.00 0.00 C ATOM 0 H LEU A 502 5.172 6.130 -1.199 1.00 0.00 H new ATOM 0 HA LEU A 502 3.788 3.813 -0.311 1.00 0.00 H new ATOM 0 HB2 LEU A 502 3.721 5.735 -2.573 1.00 0.00 H new ATOM 0 HB3 LEU A 502 3.064 4.143 -2.899 1.00 0.00 H new ATOM 0 HG LEU A 502 1.223 4.583 -1.971 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.750 5.557 0.271 1.00 0.00 H new ATOM 0 HD12 LEU A 502 1.884 4.187 0.312 1.00 0.00 H new ATOM 0 HD13 LEU A 502 2.494 5.851 0.470 1.00 0.00 H new ATOM 0 HD21 LEU A 502 0.629 7.036 -1.465 1.00 0.00 H new ATOM 0 HD22 LEU A 502 2.370 7.405 -1.490 1.00 0.00 H new ATOM 0 HD23 LEU A 502 1.556 6.854 -2.974 1.00 0.00 H new ATOM 1010 N LEU A 503 6.171 3.413 -2.579 1.00 0.00 N ATOM 1011 CA LEU A 503 7.005 2.442 -3.260 1.00 0.00 C ATOM 1012 C LEU A 503 7.614 1.468 -2.246 1.00 0.00 C ATOM 1013 O LEU A 503 7.695 0.266 -2.508 1.00 0.00 O ATOM 1014 CB LEU A 503 8.098 3.206 -4.041 1.00 0.00 C ATOM 1015 CG LEU A 503 7.691 3.854 -5.378 1.00 0.00 C ATOM 1016 CD1 LEU A 503 6.215 3.793 -5.766 1.00 0.00 C ATOM 1017 CD2 LEU A 503 8.284 5.219 -5.724 1.00 0.00 C ATOM 0 H LEU A 503 6.515 4.368 -2.676 1.00 0.00 H new ATOM 0 HA LEU A 503 6.413 1.852 -3.960 1.00 0.00 H new ATOM 0 HB2 LEU A 503 8.490 3.989 -3.392 1.00 0.00 H new ATOM 0 HB3 LEU A 503 8.917 2.515 -4.237 1.00 0.00 H new ATOM 0 HG LEU A 503 8.209 3.140 -6.018 1.00 0.00 H new ATOM 0 HD11 LEU A 503 6.071 4.286 -6.727 1.00 0.00 H new ATOM 0 HD12 LEU A 503 5.901 2.752 -5.842 1.00 0.00 H new ATOM 0 HD13 LEU A 503 5.618 4.297 -5.006 1.00 0.00 H new ATOM 0 HD21 LEU A 503 7.906 5.545 -6.693 1.00 0.00 H new ATOM 0 HD22 LEU A 503 8.000 5.943 -4.961 1.00 0.00 H new ATOM 0 HD23 LEU A 503 9.371 5.144 -5.766 1.00 0.00 H new ATOM 1029 N LYS A 504 7.968 1.985 -1.060 1.00 0.00 N ATOM 1030 CA LYS A 504 8.337 1.182 0.108 1.00 0.00 C ATOM 1031 C LYS A 504 7.194 0.242 0.495 1.00 0.00 C ATOM 1032 O LYS A 504 7.355 -0.974 0.496 1.00 0.00 O ATOM 1033 CB LYS A 504 8.749 2.098 1.278 1.00 0.00 C ATOM 1034 CG LYS A 504 9.088 1.398 2.609 1.00 0.00 C ATOM 1035 CD LYS A 504 8.538 2.172 3.823 1.00 0.00 C ATOM 1036 CE LYS A 504 7.062 1.825 4.107 1.00 0.00 C ATOM 1037 NZ LYS A 504 6.943 0.670 5.041 1.00 0.00 N ATOM 0 H LYS A 504 8.005 2.989 -0.886 1.00 0.00 H new ATOM 0 HA LYS A 504 9.197 0.562 -0.144 1.00 0.00 H new ATOM 0 HB2 LYS A 504 9.617 2.680 0.967 1.00 0.00 H new ATOM 0 HB3 LYS A 504 7.940 2.805 1.460 1.00 0.00 H new ATOM 0 HG2 LYS A 504 8.675 0.389 2.604 1.00 0.00 H new ATOM 0 HG3 LYS A 504 10.170 1.299 2.702 1.00 0.00 H new ATOM 0 HD2 LYS A 504 9.140 1.943 4.702 1.00 0.00 H new ATOM 0 HD3 LYS A 504 8.631 3.243 3.643 1.00 0.00 H new ATOM 0 HE2 LYS A 504 6.559 2.693 4.534 1.00 0.00 H new ATOM 0 HE3 LYS A 504 6.555 1.591 3.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 504 5.938 0.463 5.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 504 7.402 -0.164 4.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 504 7.405 0.904 5.943 1.00 0.00 H new ATOM 1051 N ALA A 505 6.033 0.818 0.813 1.00 0.00 N ATOM 1052 CA ALA A 505 4.826 0.129 1.263 1.00 0.00 C ATOM 1053 C ALA A 505 4.478 -1.024 0.309 1.00 0.00 C ATOM 1054 O ALA A 505 4.326 -2.183 0.718 1.00 0.00 O ATOM 1055 CB ALA A 505 3.716 1.183 1.380 1.00 0.00 C ATOM 0 H ALA A 505 5.905 1.829 0.760 1.00 0.00 H new ATOM 0 HA ALA A 505 4.967 -0.337 2.238 1.00 0.00 H new ATOM 0 HB1 ALA A 505 2.795 0.706 1.715 1.00 0.00 H new ATOM 0 HB2 ALA A 505 4.012 1.945 2.101 1.00 0.00 H new ATOM 0 HB3 ALA A 505 3.551 1.647 0.408 1.00 0.00 H new ATOM 1061 N PHE A 506 4.476 -0.686 -0.983 1.00 0.00 N ATOM 1062 CA PHE A 506 4.254 -1.563 -2.108 1.00 0.00 C ATOM 1063 C PHE A 506 5.222 -2.710 -2.081 1.00 0.00 C ATOM 1064 O PHE A 506 4.788 -3.826 -1.846 1.00 0.00 O ATOM 1065 CB PHE A 506 4.364 -0.829 -3.451 1.00 0.00 C ATOM 1066 CG PHE A 506 3.231 0.094 -3.820 1.00 0.00 C ATOM 1067 CD1 PHE A 506 2.091 0.229 -3.005 1.00 0.00 C ATOM 1068 CD2 PHE A 506 3.310 0.781 -5.042 1.00 0.00 C ATOM 1069 CE1 PHE A 506 1.031 1.049 -3.418 1.00 0.00 C ATOM 1070 CE2 PHE A 506 2.237 1.575 -5.471 1.00 0.00 C ATOM 1071 CZ PHE A 506 1.090 1.683 -4.672 1.00 0.00 C ATOM 0 H PHE A 506 4.642 0.276 -1.278 1.00 0.00 H new ATOM 0 HA PHE A 506 3.235 -1.940 -2.017 1.00 0.00 H new ATOM 0 HB2 PHE A 506 5.286 -0.248 -3.445 1.00 0.00 H new ATOM 0 HB3 PHE A 506 4.463 -1.576 -4.239 1.00 0.00 H new ATOM 0 HD1 PHE A 506 2.033 -0.298 -2.064 1.00 0.00 H new ATOM 0 HD2 PHE A 506 4.198 0.698 -5.652 1.00 0.00 H new ATOM 0 HE1 PHE A 506 0.174 1.193 -2.777 1.00 0.00 H new ATOM 0 HE2 PHE A 506 2.294 2.101 -6.413 1.00 0.00 H new ATOM 0 HZ PHE A 506 0.245 2.258 -5.022 1.00 0.00 H new ATOM 1081 N GLY A 507 6.517 -2.499 -2.315 1.00 0.00 N ATOM 1082 CA GLY A 507 7.352 -3.661 -2.514 1.00 0.00 C ATOM 1083 C GLY A 507 7.678 -4.499 -1.288 1.00 0.00 C ATOM 1084 O GLY A 507 8.190 -5.601 -1.460 1.00 0.00 O ATOM 0 H GLY A 507 6.980 -1.592 -2.368 1.00 0.00 H new ATOM 0 HA2 GLY A 507 6.865 -4.306 -3.245 1.00 0.00 H new ATOM 0 HA3 GLY A 507 8.291 -3.330 -2.957 1.00 0.00 H new ATOM 1088 N ILE A 508 7.335 -4.044 -0.076 1.00 0.00 N ATOM 1089 CA ILE A 508 7.303 -4.950 1.076 1.00 0.00 C ATOM 1090 C ILE A 508 6.113 -5.885 0.854 1.00 0.00 C ATOM 1091 O ILE A 508 6.316 -7.088 0.833 1.00 0.00 O ATOM 1092 CB ILE A 508 7.226 -4.245 2.449 1.00 0.00 C ATOM 1093 CG1 ILE A 508 8.613 -3.829 2.987 1.00 0.00 C ATOM 1094 CG2 ILE A 508 6.659 -5.206 3.522 1.00 0.00 C ATOM 1095 CD1 ILE A 508 9.278 -2.649 2.280 1.00 0.00 C ATOM 0 H ILE A 508 7.082 -3.077 0.129 1.00 0.00 H new ATOM 0 HA ILE A 508 8.247 -5.492 1.126 1.00 0.00 H new ATOM 0 HB ILE A 508 6.597 -3.371 2.283 1.00 0.00 H new ATOM 0 HG12 ILE A 508 8.512 -3.584 4.044 1.00 0.00 H new ATOM 0 HG13 ILE A 508 9.279 -4.689 2.921 1.00 0.00 H new ATOM 0 HG21 ILE A 508 6.612 -4.692 4.482 1.00 0.00 H new ATOM 0 HG22 ILE A 508 5.658 -5.525 3.232 1.00 0.00 H new ATOM 0 HG23 ILE A 508 7.307 -6.078 3.608 1.00 0.00 H new ATOM 0 HD11 ILE A 508 10.245 -2.446 2.741 1.00 0.00 H new ATOM 0 HD12 ILE A 508 9.422 -2.890 1.227 1.00 0.00 H new ATOM 0 HD13 ILE A 508 8.643 -1.768 2.367 1.00 0.00 H new ATOM 1107 N VAL A 509 4.887 -5.390 0.632 1.00 0.00 N ATOM 1108 CA VAL A 509 3.730 -6.276 0.456 1.00 0.00 C ATOM 1109 C VAL A 509 3.870 -7.080 -0.837 1.00 0.00 C ATOM 1110 O VAL A 509 3.496 -8.241 -0.856 1.00 0.00 O ATOM 1111 CB VAL A 509 2.403 -5.513 0.593 1.00 0.00 C ATOM 1112 CG1 VAL A 509 2.151 -4.548 -0.534 1.00 0.00 C ATOM 1113 CG2 VAL A 509 1.184 -6.422 0.671 1.00 0.00 C ATOM 0 H VAL A 509 4.673 -4.395 0.571 1.00 0.00 H new ATOM 0 HA VAL A 509 3.709 -7.006 1.265 1.00 0.00 H new ATOM 0 HB VAL A 509 2.528 -4.973 1.532 1.00 0.00 H new ATOM 0 HG11 VAL A 509 1.198 -4.043 -0.375 1.00 0.00 H new ATOM 0 HG12 VAL A 509 2.952 -3.809 -0.566 1.00 0.00 H new ATOM 0 HG13 VAL A 509 2.120 -5.091 -1.478 1.00 0.00 H new ATOM 0 HG21 VAL A 509 0.283 -5.815 0.767 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.121 -7.025 -0.235 1.00 0.00 H new ATOM 0 HG23 VAL A 509 1.274 -7.077 1.537 1.00 0.00 H new ATOM 1123 N ILE A 510 4.503 -6.550 -1.891 1.00 0.00 N ATOM 1124 CA ILE A 510 4.920 -7.318 -3.071 1.00 0.00 C ATOM 1125 C ILE A 510 5.798 -8.512 -2.708 1.00 0.00 C ATOM 1126 O ILE A 510 5.558 -9.607 -3.204 1.00 0.00 O ATOM 1127 CB ILE A 510 5.506 -6.456 -4.180 1.00 0.00 C ATOM 1128 CG1 ILE A 510 4.352 -5.554 -4.686 1.00 0.00 C ATOM 1129 CG2 ILE A 510 6.121 -7.280 -5.329 1.00 0.00 C ATOM 1130 CD1 ILE A 510 4.739 -4.624 -5.825 1.00 0.00 C ATOM 0 H ILE A 510 4.744 -5.560 -1.949 1.00 0.00 H new ATOM 0 HA ILE A 510 4.005 -7.733 -3.494 1.00 0.00 H new ATOM 0 HB ILE A 510 6.336 -5.867 -3.790 1.00 0.00 H new ATOM 0 HG12 ILE A 510 3.528 -6.188 -5.014 1.00 0.00 H new ATOM 0 HG13 ILE A 510 3.982 -4.956 -3.853 1.00 0.00 H new ATOM 0 HG21 ILE A 510 6.521 -6.606 -6.087 1.00 0.00 H new ATOM 0 HG22 ILE A 510 6.924 -7.905 -4.939 1.00 0.00 H new ATOM 0 HG23 ILE A 510 5.353 -7.912 -5.775 1.00 0.00 H new ATOM 0 HD11 ILE A 510 3.874 -4.029 -6.119 1.00 0.00 H new ATOM 0 HD12 ILE A 510 5.541 -3.962 -5.498 1.00 0.00 H new ATOM 0 HD13 ILE A 510 5.080 -5.213 -6.676 1.00 0.00 H new ATOM 1142 N ASP A 511 6.723 -8.374 -1.760 1.00 0.00 N ATOM 1143 CA ASP A 511 7.653 -9.423 -1.299 1.00 0.00 C ATOM 1144 C ASP A 511 7.072 -10.469 -0.390 1.00 0.00 C ATOM 1145 O ASP A 511 7.741 -11.220 0.318 1.00 0.00 O ATOM 1146 CB ASP A 511 8.813 -8.760 -0.584 1.00 0.00 C ATOM 1147 CG ASP A 511 10.109 -9.589 -0.518 1.00 0.00 C ATOM 1148 OD1 ASP A 511 10.426 -10.305 -1.498 1.00 0.00 O ATOM 1149 OD2 ASP A 511 10.842 -9.488 0.495 1.00 0.00 O ATOM 0 H ASP A 511 6.857 -7.492 -1.266 1.00 0.00 H new ATOM 0 HA ASP A 511 7.950 -9.957 -2.202 1.00 0.00 H new ATOM 0 HB2 ASP A 511 9.031 -7.815 -1.081 1.00 0.00 H new ATOM 0 HB3 ASP A 511 8.502 -8.521 0.433 1.00 0.00 H new ATOM 1154 N TYR A 512 5.770 -10.478 -0.468 1.00 0.00 N ATOM 1155 CA TYR A 512 4.874 -11.111 0.428 1.00 0.00 C ATOM 1156 C TYR A 512 3.615 -11.544 -0.320 1.00 0.00 C ATOM 1157 O TYR A 512 2.957 -12.498 0.059 1.00 0.00 O ATOM 1158 CB TYR A 512 4.522 -10.059 1.468 1.00 0.00 C ATOM 1159 CG TYR A 512 5.160 -9.976 2.837 1.00 0.00 C ATOM 1160 CD1 TYR A 512 6.389 -9.305 2.954 1.00 0.00 C ATOM 1161 CD2 TYR A 512 4.466 -10.357 3.996 1.00 0.00 C ATOM 1162 CE1 TYR A 512 6.962 -9.047 4.209 1.00 0.00 C ATOM 1163 CE2 TYR A 512 5.054 -10.157 5.263 1.00 0.00 C ATOM 1164 CZ TYR A 512 6.304 -9.504 5.375 1.00 0.00 C ATOM 1165 OH TYR A 512 6.845 -9.280 6.604 1.00 0.00 O ATOM 0 H TYR A 512 5.280 -10.001 -1.225 1.00 0.00 H new ATOM 0 HA TYR A 512 5.313 -11.999 0.883 1.00 0.00 H new ATOM 0 HB2 TYR A 512 4.693 -9.093 0.993 1.00 0.00 H new ATOM 0 HB3 TYR A 512 3.449 -10.145 1.637 1.00 0.00 H new ATOM 0 HD1 TYR A 512 6.903 -8.981 2.061 1.00 0.00 H new ATOM 0 HD2 TYR A 512 3.485 -10.802 3.918 1.00 0.00 H new ATOM 0 HE1 TYR A 512 7.894 -8.506 4.284 1.00 0.00 H new ATOM 0 HE2 TYR A 512 4.547 -10.504 6.151 1.00 0.00 H new ATOM 0 HH TYR A 512 6.261 -9.660 7.293 1.00 0.00 H new ATOM 1175 N LYS A 513 3.275 -10.876 -1.418 1.00 0.00 N ATOM 1176 CA LYS A 513 2.144 -11.155 -2.283 1.00 0.00 C ATOM 1177 C LYS A 513 2.625 -12.027 -3.425 1.00 0.00 C ATOM 1178 O LYS A 513 2.074 -13.090 -3.687 1.00 0.00 O ATOM 1179 CB LYS A 513 1.634 -9.771 -2.690 1.00 0.00 C ATOM 1180 CG LYS A 513 0.484 -9.739 -3.677 1.00 0.00 C ATOM 1181 CD LYS A 513 0.951 -9.920 -5.121 1.00 0.00 C ATOM 1182 CE LYS A 513 -0.266 -10.365 -5.935 1.00 0.00 C ATOM 1183 NZ LYS A 513 0.114 -10.946 -7.246 1.00 0.00 N ATOM 0 H LYS A 513 3.819 -10.077 -1.744 1.00 0.00 H new ATOM 0 HA LYS A 513 1.326 -11.714 -1.829 1.00 0.00 H new ATOM 0 HB2 LYS A 513 1.325 -9.242 -1.788 1.00 0.00 H new ATOM 0 HB3 LYS A 513 2.467 -9.212 -3.118 1.00 0.00 H new ATOM 0 HG2 LYS A 513 -0.228 -10.526 -3.427 1.00 0.00 H new ATOM 0 HG3 LYS A 513 -0.044 -8.790 -3.585 1.00 0.00 H new ATOM 0 HD2 LYS A 513 1.357 -8.988 -5.514 1.00 0.00 H new ATOM 0 HD3 LYS A 513 1.746 -10.664 -5.178 1.00 0.00 H new ATOM 0 HE2 LYS A 513 -0.832 -11.101 -5.364 1.00 0.00 H new ATOM 0 HE3 LYS A 513 -0.924 -9.511 -6.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 -0.107 -10.268 -8.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 1.134 -11.151 -7.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 -0.417 -11.826 -7.403 1.00 0.00 H new ATOM 1197 N GLU A 514 3.719 -11.591 -4.058 1.00 0.00 N ATOM 1198 CA GLU A 514 4.514 -12.366 -5.010 1.00 0.00 C ATOM 1199 C GLU A 514 5.273 -13.515 -4.307 1.00 0.00 C ATOM 1200 O GLU A 514 6.030 -14.254 -4.938 1.00 0.00 O ATOM 1201 CB GLU A 514 5.486 -11.398 -5.703 1.00 0.00 C ATOM 1202 CG GLU A 514 5.890 -11.866 -7.111 1.00 0.00 C ATOM 1203 CD GLU A 514 7.415 -11.905 -7.307 1.00 0.00 C ATOM 1204 OE1 GLU A 514 8.033 -10.837 -7.533 1.00 0.00 O ATOM 1205 OE2 GLU A 514 8.007 -13.010 -7.248 1.00 0.00 O ATOM 0 H GLU A 514 4.088 -10.651 -3.914 1.00 0.00 H new ATOM 0 HA GLU A 514 3.862 -12.835 -5.747 1.00 0.00 H new ATOM 0 HB2 GLU A 514 5.024 -10.413 -5.771 1.00 0.00 H new ATOM 0 HB3 GLU A 514 6.381 -11.289 -5.091 1.00 0.00 H new ATOM 0 HG2 GLU A 514 5.479 -12.859 -7.292 1.00 0.00 H new ATOM 0 HG3 GLU A 514 5.449 -11.199 -7.852 1.00 0.00 H new ATOM 1212 N ARG A 515 5.078 -13.659 -2.985 1.00 0.00 N ATOM 1213 CA ARG A 515 5.592 -14.795 -2.176 1.00 0.00 C ATOM 1214 C ARG A 515 4.526 -15.633 -1.484 1.00 0.00 C ATOM 1215 O ARG A 515 4.725 -16.838 -1.351 1.00 0.00 O ATOM 1216 CB ARG A 515 6.606 -14.346 -1.121 1.00 0.00 C ATOM 1217 CG ARG A 515 8.022 -14.055 -1.626 1.00 0.00 C ATOM 1218 CD ARG A 515 8.128 -12.741 -2.398 1.00 0.00 C ATOM 1219 NE ARG A 515 8.604 -12.963 -3.766 1.00 0.00 N ATOM 1220 CZ ARG A 515 9.803 -12.704 -4.264 1.00 0.00 C ATOM 1221 NH1 ARG A 515 10.738 -12.088 -3.598 1.00 0.00 N ATOM 1222 NH2 ARG A 515 10.099 -13.064 -5.476 1.00 0.00 N ATOM 0 H ARG A 515 4.551 -12.982 -2.433 1.00 0.00 H new ATOM 0 HA ARG A 515 6.070 -15.428 -2.924 1.00 0.00 H new ATOM 0 HB2 ARG A 515 6.223 -13.447 -0.638 1.00 0.00 H new ATOM 0 HB3 ARG A 515 6.668 -15.118 -0.354 1.00 0.00 H new ATOM 0 HG2 ARG A 515 8.705 -14.026 -0.777 1.00 0.00 H new ATOM 0 HG3 ARG A 515 8.347 -14.873 -2.268 1.00 0.00 H new ATOM 0 HD2 ARG A 515 7.154 -12.253 -2.425 1.00 0.00 H new ATOM 0 HD3 ARG A 515 8.809 -12.066 -1.879 1.00 0.00 H new ATOM 0 HE ARG A 515 7.928 -13.367 -4.415 1.00 0.00 H new ATOM 0 HH11 ARG A 515 10.564 -11.779 -2.642 1.00 0.00 H new ATOM 0 HH12 ARG A 515 11.644 -11.915 -4.033 1.00 0.00 H new ATOM 0 HH21 ARG A 515 9.407 -13.548 -6.048 1.00 0.00 H new ATOM 0 HH22 ARG A 515 11.024 -12.863 -5.856 1.00 0.00 H new ATOM 1236 N ASP A 516 3.430 -15.007 -1.051 1.00 0.00 N ATOM 1237 CA ASP A 516 2.226 -15.642 -0.472 1.00 0.00 C ATOM 1238 C ASP A 516 2.350 -15.812 1.060 1.00 0.00 C ATOM 1239 O ASP A 516 2.215 -16.884 1.655 1.00 0.00 O ATOM 1240 CB ASP A 516 1.808 -16.906 -1.240 1.00 0.00 C ATOM 1241 CG ASP A 516 0.339 -17.313 -1.029 1.00 0.00 C ATOM 1242 OD1 ASP A 516 -0.369 -16.721 -0.183 1.00 0.00 O ATOM 1243 OD2 ASP A 516 -0.105 -18.273 -1.703 1.00 0.00 O ATOM 0 H ASP A 516 3.346 -13.991 -1.093 1.00 0.00 H new ATOM 0 HA ASP A 516 1.385 -14.962 -0.607 1.00 0.00 H new ATOM 0 HB2 ASP A 516 1.980 -16.745 -2.304 1.00 0.00 H new ATOM 0 HB3 ASP A 516 2.450 -17.732 -0.935 1.00 0.00 H new ATOM 1248 N LEU A 517 2.677 -14.675 1.662 1.00 0.00 N ATOM 1249 CA LEU A 517 3.014 -14.335 3.044 1.00 0.00 C ATOM 1250 C LEU A 517 1.841 -13.583 3.702 1.00 0.00 C ATOM 1251 O LEU A 517 1.679 -13.622 4.924 1.00 0.00 O ATOM 1252 CB LEU A 517 4.302 -13.481 2.944 1.00 0.00 C ATOM 1253 CG LEU A 517 5.495 -14.229 2.306 1.00 0.00 C ATOM 1254 CD1 LEU A 517 6.827 -13.488 2.450 1.00 0.00 C ATOM 1255 CD2 LEU A 517 5.734 -15.647 2.832 1.00 0.00 C ATOM 0 H LEU A 517 2.718 -13.828 1.095 1.00 0.00 H new ATOM 0 HA LEU A 517 3.187 -15.208 3.674 1.00 0.00 H new ATOM 0 HB2 LEU A 517 4.090 -12.587 2.358 1.00 0.00 H new ATOM 0 HB3 LEU A 517 4.585 -13.148 3.943 1.00 0.00 H new ATOM 0 HG LEU A 517 5.183 -14.280 1.263 1.00 0.00 H new ATOM 0 HD11 LEU A 517 7.620 -14.070 1.980 1.00 0.00 H new ATOM 0 HD12 LEU A 517 6.756 -12.514 1.966 1.00 0.00 H new ATOM 0 HD13 LEU A 517 7.055 -13.352 3.507 1.00 0.00 H new ATOM 0 HD21 LEU A 517 6.592 -16.085 2.322 1.00 0.00 H new ATOM 0 HD22 LEU A 517 5.930 -15.609 3.904 1.00 0.00 H new ATOM 0 HD23 LEU A 517 4.851 -16.258 2.646 1.00 0.00 H new ATOM 1267 N ILE A 518 0.997 -12.936 2.885 1.00 0.00 N ATOM 1268 CA ILE A 518 -0.319 -12.407 3.272 1.00 0.00 C ATOM 1269 C ILE A 518 -1.289 -13.580 3.523 1.00 0.00 C ATOM 1270 O ILE A 518 -1.116 -14.677 2.988 1.00 0.00 O ATOM 1271 CB ILE A 518 -0.938 -11.532 2.148 1.00 0.00 C ATOM 1272 CG1 ILE A 518 0.026 -10.761 1.233 1.00 0.00 C ATOM 1273 CG2 ILE A 518 -1.962 -10.545 2.731 1.00 0.00 C ATOM 1274 CD1 ILE A 518 0.897 -9.730 1.943 1.00 0.00 C ATOM 0 H ILE A 518 1.219 -12.761 1.905 1.00 0.00 H new ATOM 0 HA ILE A 518 -0.175 -11.802 4.167 1.00 0.00 H new ATOM 0 HB ILE A 518 -1.399 -12.276 1.498 1.00 0.00 H new ATOM 0 HG12 ILE A 518 0.674 -11.476 0.727 1.00 0.00 H new ATOM 0 HG13 ILE A 518 -0.554 -10.255 0.461 1.00 0.00 H new ATOM 0 HG21 ILE A 518 -2.384 -9.941 1.927 1.00 0.00 H new ATOM 0 HG22 ILE A 518 -2.760 -11.099 3.226 1.00 0.00 H new ATOM 0 HG23 ILE A 518 -1.469 -9.894 3.453 1.00 0.00 H new ATOM 0 HD11 ILE A 518 1.543 -9.238 1.217 1.00 0.00 H new ATOM 0 HD12 ILE A 518 0.262 -8.987 2.425 1.00 0.00 H new ATOM 0 HD13 ILE A 518 1.509 -10.227 2.695 1.00 0.00 H new ATOM 1286 N ASP A 519 -2.360 -13.346 4.278 1.00 0.00 N ATOM 1287 CA ASP A 519 -3.492 -14.272 4.371 1.00 0.00 C ATOM 1288 C ASP A 519 -4.305 -14.250 3.068 1.00 0.00 C ATOM 1289 O ASP A 519 -4.549 -13.204 2.466 1.00 0.00 O ATOM 1290 CB ASP A 519 -4.386 -13.887 5.555 1.00 0.00 C ATOM 1291 CG ASP A 519 -3.669 -14.087 6.894 1.00 0.00 C ATOM 1292 OD1 ASP A 519 -3.723 -15.210 7.450 1.00 0.00 O ATOM 1293 OD2 ASP A 519 -3.052 -13.114 7.386 1.00 0.00 O ATOM 0 H ASP A 519 -2.470 -12.506 4.846 1.00 0.00 H new ATOM 0 HA ASP A 519 -3.110 -15.281 4.528 1.00 0.00 H new ATOM 0 HB2 ASP A 519 -4.691 -12.845 5.457 1.00 0.00 H new ATOM 0 HB3 ASP A 519 -5.295 -14.488 5.535 1.00 0.00 H new ATOM 1298 N ARG A 520 -4.792 -15.421 2.658 1.00 0.00 N ATOM 1299 CA ARG A 520 -5.613 -15.674 1.460 1.00 0.00 C ATOM 1300 C ARG A 520 -6.957 -14.932 1.443 1.00 0.00 C ATOM 1301 O ARG A 520 -7.548 -14.737 0.385 1.00 0.00 O ATOM 1302 CB ARG A 520 -5.790 -17.192 1.347 1.00 0.00 C ATOM 1303 CG ARG A 520 -4.674 -17.833 0.507 1.00 0.00 C ATOM 1304 CD ARG A 520 -3.228 -17.623 0.987 1.00 0.00 C ATOM 1305 NE ARG A 520 -2.945 -18.277 2.281 1.00 0.00 N ATOM 1306 CZ ARG A 520 -1.760 -18.344 2.867 1.00 0.00 C ATOM 1307 NH1 ARG A 520 -0.695 -17.818 2.338 1.00 0.00 N ATOM 1308 NH2 ARG A 520 -1.619 -18.956 4.007 1.00 0.00 N ATOM 0 H ARG A 520 -4.616 -16.277 3.183 1.00 0.00 H new ATOM 0 HA ARG A 520 -5.094 -15.273 0.590 1.00 0.00 H new ATOM 0 HB2 ARG A 520 -5.794 -17.633 2.344 1.00 0.00 H new ATOM 0 HB3 ARG A 520 -6.758 -17.413 0.896 1.00 0.00 H new ATOM 0 HG2 ARG A 520 -4.862 -18.906 0.457 1.00 0.00 H new ATOM 0 HG3 ARG A 520 -4.752 -17.448 -0.510 1.00 0.00 H new ATOM 0 HD2 ARG A 520 -2.542 -18.010 0.234 1.00 0.00 H new ATOM 0 HD3 ARG A 520 -3.033 -16.554 1.077 1.00 0.00 H new ATOM 0 HE ARG A 520 -3.730 -18.714 2.764 1.00 0.00 H new ATOM 0 HH11 ARG A 520 -0.756 -17.334 1.442 1.00 0.00 H new ATOM 0 HH12 ARG A 520 0.202 -17.889 2.819 1.00 0.00 H new ATOM 0 HH21 ARG A 520 -2.426 -19.389 4.456 1.00 0.00 H new ATOM 0 HH22 ARG A 520 -0.702 -19.002 4.451 1.00 0.00 H new ATOM 1322 N SER A 521 -7.390 -14.446 2.602 1.00 0.00 N ATOM 1323 CA SER A 521 -8.534 -13.529 2.792 1.00 0.00 C ATOM 1324 C SER A 521 -8.252 -12.059 2.419 1.00 0.00 C ATOM 1325 O SER A 521 -9.177 -11.243 2.425 1.00 0.00 O ATOM 1326 CB SER A 521 -8.998 -13.578 4.255 1.00 0.00 C ATOM 1327 OG SER A 521 -9.482 -14.869 4.594 1.00 0.00 O ATOM 0 H SER A 521 -6.938 -14.686 3.484 1.00 0.00 H new ATOM 0 HA SER A 521 -9.304 -13.883 2.107 1.00 0.00 H new ATOM 0 HB2 SER A 521 -8.170 -13.313 4.912 1.00 0.00 H new ATOM 0 HB3 SER A 521 -9.782 -12.838 4.416 1.00 0.00 H new ATOM 0 HG SER A 521 -9.770 -14.875 5.531 1.00 0.00 H new ATOM 1333 N ALA A 522 -7.006 -11.687 2.096 1.00 0.00 N ATOM 1334 CA ALA A 522 -6.633 -10.329 1.683 1.00 0.00 C ATOM 1335 C ALA A 522 -6.823 -10.170 0.180 1.00 0.00 C ATOM 1336 O ALA A 522 -7.199 -9.112 -0.313 1.00 0.00 O ATOM 1337 CB ALA A 522 -5.167 -10.067 2.010 1.00 0.00 C ATOM 0 H ALA A 522 -6.217 -12.333 2.115 1.00 0.00 H new ATOM 0 HA ALA A 522 -7.268 -9.622 2.218 1.00 0.00 H new ATOM 0 HB1 ALA A 522 -4.900 -9.057 1.700 1.00 0.00 H new ATOM 0 HB2 ALA A 522 -5.010 -10.170 3.084 1.00 0.00 H new ATOM 0 HB3 ALA A 522 -4.542 -10.786 1.481 1.00 0.00 H new ATOM 1343 N TYR A 523 -6.568 -11.250 -0.539 1.00 0.00 N ATOM 1344 CA TYR A 523 -6.807 -11.393 -1.959 1.00 0.00 C ATOM 1345 C TYR A 523 -8.309 -11.284 -2.335 1.00 0.00 C ATOM 1346 O TYR A 523 -9.175 -11.120 -1.437 1.00 0.00 O ATOM 1347 CB TYR A 523 -6.200 -12.760 -2.300 1.00 0.00 C ATOM 1348 CG TYR A 523 -4.688 -12.899 -2.161 1.00 0.00 C ATOM 1349 CD1 TYR A 523 -4.124 -13.266 -0.924 1.00 0.00 C ATOM 1350 CD2 TYR A 523 -3.848 -12.747 -3.281 1.00 0.00 C ATOM 1351 CE1 TYR A 523 -2.749 -13.533 -0.807 1.00 0.00 C ATOM 1352 CE2 TYR A 523 -2.459 -12.968 -3.164 1.00 0.00 C ATOM 1353 CZ TYR A 523 -1.905 -13.368 -1.926 1.00 0.00 C ATOM 1354 OH TYR A 523 -0.569 -13.597 -1.813 1.00 0.00 O ATOM 1355 OXT TYR A 523 -8.619 -11.339 -3.547 1.00 0.00 O ATOM 0 H TYR A 523 -6.168 -12.092 -0.124 1.00 0.00 H new ATOM 0 HA TYR A 523 -6.353 -10.587 -2.536 1.00 0.00 H new ATOM 0 HB2 TYR A 523 -6.669 -13.508 -1.661 1.00 0.00 H new ATOM 0 HB3 TYR A 523 -6.470 -13.004 -3.328 1.00 0.00 H new ATOM 0 HD1 TYR A 523 -4.757 -13.343 -0.053 1.00 0.00 H new ATOM 0 HD2 TYR A 523 -4.268 -12.460 -4.234 1.00 0.00 H new ATOM 0 HE1 TYR A 523 -2.340 -13.863 0.136 1.00 0.00 H new ATOM 0 HE2 TYR A 523 -1.818 -12.831 -4.022 1.00 0.00 H new ATOM 0 HH TYR A 523 -0.136 -13.438 -2.677 1.00 0.00 H new TER 1365 TYR A 523