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= -0.539 USER MOD Set 1.2: A 513 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 475 THR OG1 : rot 140:sc= 0.661 USER MOD Set 2.2: A 491 LYS NZ :NH3+ 150:sc= 0.728 (180deg=0) USER MOD Set 3.1: A 467 LYS NZ :NH3+ 177:sc= 0.365 (180deg=0) USER MOD Set 3.2: A 468 TYR OH : rot 173:sc= 0.341 USER MOD Set 4.1: A 461 LYS NZ :NH3+ -121:sc= 0.391 (180deg=0) USER MOD Set 4.2: A 466 HIS : no HD1:sc= -0.0215 K(o=0.37,f=-0.91) USER MOD Set 5.1: A 446 SER OG : rot 180:sc= 0.0377 USER MOD Set 5.2: A 462 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 445 LYS NZ :NH3+ 177:sc= 2.57 (180deg=2.35) USER MOD Set 6.2: A 448 THR OG1 : rot -78:sc= 0.771 USER MOD Single : A 443 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 451 LYS NZ :NH3+ -103:sc= 1.29 (180deg=0.0618) USER MOD Single : A 454 LYS NZ :NH3+ 153:sc= 1.54 (180deg=0.972) USER MOD Single : A 455 ASN : amide:sc= -0.116 X(o=-0.12,f=-0.23) USER MOD Single : A 458 MET CE :methyl -167:sc= -0.901 (180deg=-1.72) USER MOD Single : A 469 SER OG : rot 180:sc= 0.00447 USER MOD Single : A 473 SER OG : rot 71:sc= 0.176 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 -139:sc= 1.26 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 443 6.083 -5.096 13.644 1.00 0.00 N ATOM 2 CA MET A 443 6.242 -6.085 12.542 1.00 0.00 C ATOM 3 C MET A 443 5.318 -5.758 11.357 1.00 0.00 C ATOM 4 O MET A 443 4.250 -5.187 11.582 1.00 0.00 O ATOM 5 CB MET A 443 6.043 -7.543 13.026 1.00 0.00 C ATOM 6 CG MET A 443 4.644 -7.869 13.582 1.00 0.00 C ATOM 7 SD MET A 443 4.331 -9.633 13.888 1.00 0.00 S ATOM 8 CE MET A 443 5.430 -9.946 15.298 1.00 0.00 C ATOM 0 HA MET A 443 7.272 -6.006 12.195 1.00 0.00 H new ATOM 0 HB2 MET A 443 6.251 -8.216 12.194 1.00 0.00 H new ATOM 0 HB3 MET A 443 6.781 -7.755 13.799 1.00 0.00 H new ATOM 0 HG2 MET A 443 4.504 -7.323 14.515 1.00 0.00 H new ATOM 0 HG3 MET A 443 3.896 -7.499 12.881 1.00 0.00 H new ATOM 0 HE1 MET A 443 5.347 -10.990 15.599 1.00 0.00 H new ATOM 0 HE2 MET A 443 6.460 -9.732 15.011 1.00 0.00 H new ATOM 0 HE3 MET A 443 5.144 -9.304 16.131 1.00 0.00 H new ATOM 18 N PRO A 444 5.667 -6.133 10.106 1.00 0.00 N ATOM 19 CA PRO A 444 4.841 -5.926 8.899 1.00 0.00 C ATOM 20 C PRO A 444 3.440 -6.573 8.879 1.00 0.00 C ATOM 21 O PRO A 444 2.695 -6.376 7.915 1.00 0.00 O ATOM 22 CB PRO A 444 5.669 -6.471 7.729 1.00 0.00 C ATOM 23 CG PRO A 444 7.107 -6.377 8.225 1.00 0.00 C ATOM 24 CD PRO A 444 6.964 -6.681 9.714 1.00 0.00 C ATOM 0 HA PRO A 444 4.618 -4.860 8.851 1.00 0.00 H new ATOM 0 HB2 PRO A 444 5.395 -7.498 7.490 1.00 0.00 H new ATOM 0 HB3 PRO A 444 5.519 -5.882 6.824 1.00 0.00 H new ATOM 0 HG2 PRO A 444 7.756 -7.095 7.725 1.00 0.00 H new ATOM 0 HG3 PRO A 444 7.532 -5.388 8.052 1.00 0.00 H new ATOM 0 HD2 PRO A 444 7.008 -7.754 9.901 1.00 0.00 H new ATOM 0 HD3 PRO A 444 7.771 -6.224 10.286 1.00 0.00 H new ATOM 32 N LYS A 445 3.054 -7.352 9.902 1.00 0.00 N ATOM 33 CA LYS A 445 1.734 -7.995 10.062 1.00 0.00 C ATOM 34 C LYS A 445 0.614 -6.997 10.440 1.00 0.00 C ATOM 35 O LYS A 445 -0.048 -7.090 11.476 1.00 0.00 O ATOM 36 CB LYS A 445 1.869 -9.211 11.008 1.00 0.00 C ATOM 37 CG LYS A 445 0.918 -10.350 10.603 1.00 0.00 C ATOM 38 CD LYS A 445 1.417 -11.106 9.352 1.00 0.00 C ATOM 39 CE LYS A 445 0.273 -11.743 8.555 1.00 0.00 C ATOM 40 NZ LYS A 445 -0.480 -10.737 7.769 1.00 0.00 N ATOM 0 H LYS A 445 3.681 -7.562 10.678 1.00 0.00 H new ATOM 0 HA LYS A 445 1.402 -8.375 9.096 1.00 0.00 H new ATOM 0 HB2 LYS A 445 2.897 -9.572 10.993 1.00 0.00 H new ATOM 0 HB3 LYS A 445 1.654 -8.903 12.031 1.00 0.00 H new ATOM 0 HG2 LYS A 445 0.817 -11.050 11.433 1.00 0.00 H new ATOM 0 HG3 LYS A 445 -0.074 -9.942 10.408 1.00 0.00 H new ATOM 0 HD2 LYS A 445 1.963 -10.416 8.709 1.00 0.00 H new ATOM 0 HD3 LYS A 445 2.119 -11.882 9.657 1.00 0.00 H new ATOM 0 HE2 LYS A 445 0.676 -12.501 7.883 1.00 0.00 H new ATOM 0 HE3 LYS A 445 -0.406 -12.252 9.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -1.212 -11.214 7.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -0.929 -10.057 8.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 0.172 -10.233 7.134 1.00 0.00 H new ATOM 54 N SER A 446 0.453 -6.009 9.564 1.00 0.00 N ATOM 55 CA SER A 446 -0.595 -4.986 9.453 1.00 0.00 C ATOM 56 C SER A 446 -0.646 -4.514 7.992 1.00 0.00 C ATOM 57 O SER A 446 -1.649 -4.663 7.301 1.00 0.00 O ATOM 58 CB SER A 446 -0.318 -3.814 10.409 1.00 0.00 C ATOM 59 OG SER A 446 0.977 -3.266 10.204 1.00 0.00 O ATOM 0 H SER A 446 1.139 -5.888 8.819 1.00 0.00 H new ATOM 0 HA SER A 446 -1.560 -5.404 9.738 1.00 0.00 H new ATOM 0 HB2 SER A 446 -1.069 -3.038 10.262 1.00 0.00 H new ATOM 0 HB3 SER A 446 -0.410 -4.155 11.440 1.00 0.00 H new ATOM 0 HG SER A 446 1.120 -2.523 10.826 1.00 0.00 H new ATOM 65 N LEU A 447 0.501 -4.094 7.460 1.00 0.00 N ATOM 66 CA LEU A 447 0.823 -3.786 6.068 1.00 0.00 C ATOM 67 C LEU A 447 0.573 -4.972 5.106 1.00 0.00 C ATOM 68 O LEU A 447 0.677 -4.817 3.893 1.00 0.00 O ATOM 69 CB LEU A 447 2.303 -3.363 6.061 1.00 0.00 C ATOM 70 CG LEU A 447 2.754 -2.527 4.853 1.00 0.00 C ATOM 71 CD1 LEU A 447 2.323 -1.069 4.990 1.00 0.00 C ATOM 72 CD2 LEU A 447 4.278 -2.548 4.785 1.00 0.00 C ATOM 0 H LEU A 447 1.314 -3.946 8.058 1.00 0.00 H new ATOM 0 HA LEU A 447 0.170 -2.995 5.700 1.00 0.00 H new ATOM 0 HB2 LEU A 447 2.503 -2.793 6.968 1.00 0.00 H new ATOM 0 HB3 LEU A 447 2.918 -4.262 6.107 1.00 0.00 H new ATOM 0 HG LEU A 447 2.299 -2.954 3.959 1.00 0.00 H new ATOM 0 HD11 LEU A 447 2.659 -0.507 4.118 1.00 0.00 H new ATOM 0 HD12 LEU A 447 1.237 -1.016 5.060 1.00 0.00 H new ATOM 0 HD13 LEU A 447 2.766 -0.642 5.890 1.00 0.00 H new ATOM 0 HD21 LEU A 447 4.612 -1.958 3.932 1.00 0.00 H new ATOM 0 HD22 LEU A 447 4.689 -2.125 5.702 1.00 0.00 H new ATOM 0 HD23 LEU A 447 4.623 -3.576 4.673 1.00 0.00 H new ATOM 84 N THR A 448 0.240 -6.146 5.647 1.00 0.00 N ATOM 85 CA THR A 448 0.009 -7.429 4.973 1.00 0.00 C ATOM 86 C THR A 448 -1.274 -8.128 5.481 1.00 0.00 C ATOM 87 O THR A 448 -1.425 -9.340 5.323 1.00 0.00 O ATOM 88 CB THR A 448 1.251 -8.331 5.121 1.00 0.00 C ATOM 89 OG1 THR A 448 1.453 -8.674 6.478 1.00 0.00 O ATOM 90 CG2 THR A 448 2.538 -7.656 4.620 1.00 0.00 C ATOM 0 H THR A 448 0.114 -6.232 6.655 1.00 0.00 H new ATOM 0 HA THR A 448 -0.151 -7.234 3.913 1.00 0.00 H new ATOM 0 HB THR A 448 1.054 -9.214 4.513 1.00 0.00 H new ATOM 0 HG1 THR A 448 1.863 -7.918 6.949 1.00 0.00 H new ATOM 0 HG21 THR A 448 3.380 -8.337 4.749 1.00 0.00 H new ATOM 0 HG22 THR A 448 2.431 -7.407 3.564 1.00 0.00 H new ATOM 0 HG23 THR A 448 2.717 -6.745 5.191 1.00 0.00 H new ATOM 98 N ASP A 449 -2.203 -7.392 6.112 1.00 0.00 N ATOM 99 CA ASP A 449 -3.430 -7.907 6.751 1.00 0.00 C ATOM 100 C ASP A 449 -4.713 -7.507 5.993 1.00 0.00 C ATOM 101 O ASP A 449 -4.908 -6.320 5.736 1.00 0.00 O ATOM 102 CB ASP A 449 -3.537 -7.367 8.185 1.00 0.00 C ATOM 103 CG ASP A 449 -2.689 -8.151 9.191 1.00 0.00 C ATOM 104 OD1 ASP A 449 -1.516 -8.460 8.893 1.00 0.00 O ATOM 105 OD2 ASP A 449 -3.236 -8.503 10.264 1.00 0.00 O ATOM 0 H ASP A 449 -2.118 -6.379 6.196 1.00 0.00 H new ATOM 0 HA ASP A 449 -3.351 -8.994 6.740 1.00 0.00 H new ATOM 0 HB2 ASP A 449 -3.228 -6.322 8.196 1.00 0.00 H new ATOM 0 HB3 ASP A 449 -4.580 -7.395 8.500 1.00 0.00 H new ATOM 110 N PRO A 450 -5.652 -8.443 5.729 1.00 0.00 N ATOM 111 CA PRO A 450 -6.931 -8.180 5.049 1.00 0.00 C ATOM 112 C PRO A 450 -7.684 -6.955 5.596 1.00 0.00 C ATOM 113 O PRO A 450 -8.170 -6.116 4.837 1.00 0.00 O ATOM 114 CB PRO A 450 -7.762 -9.462 5.219 1.00 0.00 C ATOM 115 CG PRO A 450 -6.759 -10.563 5.555 1.00 0.00 C ATOM 116 CD PRO A 450 -5.528 -9.847 6.083 1.00 0.00 C ATOM 0 HA PRO A 450 -6.749 -7.936 4.002 1.00 0.00 H new ATOM 0 HB2 PRO A 450 -8.499 -9.348 6.014 1.00 0.00 H new ATOM 0 HB3 PRO A 450 -8.310 -9.697 4.307 1.00 0.00 H new ATOM 0 HG2 PRO A 450 -7.164 -11.248 6.300 1.00 0.00 H new ATOM 0 HG3 PRO A 450 -6.519 -11.157 4.673 1.00 0.00 H new ATOM 0 HD2 PRO A 450 -5.451 -9.964 7.164 1.00 0.00 H new ATOM 0 HD3 PRO A 450 -4.622 -10.273 5.651 1.00 0.00 H new ATOM 124 N LYS A 451 -7.702 -6.827 6.930 1.00 0.00 N ATOM 125 CA LYS A 451 -8.261 -5.730 7.736 1.00 0.00 C ATOM 126 C LYS A 451 -7.792 -4.341 7.284 1.00 0.00 C ATOM 127 O LYS A 451 -8.579 -3.399 7.230 1.00 0.00 O ATOM 128 CB LYS A 451 -7.846 -5.973 9.200 1.00 0.00 C ATOM 129 CG LYS A 451 -8.474 -7.225 9.845 1.00 0.00 C ATOM 130 CD LYS A 451 -7.465 -8.041 10.676 1.00 0.00 C ATOM 131 CE LYS A 451 -6.608 -8.963 9.797 1.00 0.00 C ATOM 132 NZ LYS A 451 -5.657 -9.768 10.608 1.00 0.00 N ATOM 0 H LYS A 451 -7.292 -7.548 7.524 1.00 0.00 H new ATOM 0 HA LYS A 451 -9.344 -5.733 7.614 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.761 -6.062 9.246 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -8.120 -5.099 9.791 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -9.303 -6.921 10.485 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.891 -7.860 9.063 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -6.816 -7.361 11.228 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -8.002 -8.639 11.413 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -7.256 -9.630 9.229 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -6.054 -8.365 9.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -4.703 -9.361 10.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -5.956 -9.759 11.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -5.646 -10.748 10.259 1.00 0.00 H new ATOM 146 N LEU A 452 -6.502 -4.206 6.979 1.00 0.00 N ATOM 147 CA LEU A 452 -5.852 -2.961 6.562 1.00 0.00 C ATOM 148 C LEU A 452 -5.932 -2.811 5.039 1.00 0.00 C ATOM 149 O LEU A 452 -6.321 -1.756 4.537 1.00 0.00 O ATOM 150 CB LEU A 452 -4.374 -2.974 7.012 1.00 0.00 C ATOM 151 CG LEU A 452 -4.044 -2.883 8.519 1.00 0.00 C ATOM 152 CD1 LEU A 452 -4.234 -1.452 8.998 1.00 0.00 C ATOM 153 CD2 LEU A 452 -4.804 -3.830 9.441 1.00 0.00 C ATOM 0 H LEU A 452 -5.853 -4.992 7.017 1.00 0.00 H new ATOM 0 HA LEU A 452 -6.363 -2.117 7.026 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -3.923 -3.891 6.632 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -3.873 -2.143 6.516 1.00 0.00 H new ATOM 0 HG LEU A 452 -3.005 -3.207 8.588 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -4.001 -1.390 10.061 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -3.570 -0.791 8.442 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -5.268 -1.148 8.835 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -4.484 -3.670 10.471 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -5.874 -3.637 9.359 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -4.598 -4.861 9.153 1.00 0.00 H new ATOM 165 N LEU A 453 -5.606 -3.885 4.310 1.00 0.00 N ATOM 166 CA LEU A 453 -5.414 -3.937 2.857 1.00 0.00 C ATOM 167 C LEU A 453 -6.673 -3.566 2.061 1.00 0.00 C ATOM 168 O LEU A 453 -6.602 -3.210 0.884 1.00 0.00 O ATOM 169 CB LEU A 453 -4.946 -5.367 2.514 1.00 0.00 C ATOM 170 CG LEU A 453 -3.498 -5.696 2.942 1.00 0.00 C ATOM 171 CD1 LEU A 453 -3.185 -7.163 2.657 1.00 0.00 C ATOM 172 CD2 LEU A 453 -2.413 -4.875 2.260 1.00 0.00 C ATOM 0 H LEU A 453 -5.461 -4.796 4.746 1.00 0.00 H new ATOM 0 HA LEU A 453 -4.671 -3.192 2.570 1.00 0.00 H new ATOM 0 HB2 LEU A 453 -5.621 -6.079 2.989 1.00 0.00 H new ATOM 0 HB3 LEU A 453 -5.034 -5.514 1.438 1.00 0.00 H new ATOM 0 HG LEU A 453 -3.476 -5.453 4.004 1.00 0.00 H new ATOM 0 HD11 LEU A 453 -2.162 -7.383 2.963 1.00 0.00 H new ATOM 0 HD12 LEU A 453 -3.875 -7.797 3.214 1.00 0.00 H new ATOM 0 HD13 LEU A 453 -3.295 -7.358 1.590 1.00 0.00 H new ATOM 0 HD21 LEU A 453 -1.436 -5.184 2.631 1.00 0.00 H new ATOM 0 HD22 LEU A 453 -2.459 -5.034 1.183 1.00 0.00 H new ATOM 0 HD23 LEU A 453 -2.566 -3.818 2.478 1.00 0.00 H new ATOM 184 N LYS A 454 -7.830 -3.621 2.721 1.00 0.00 N ATOM 185 CA LYS A 454 -9.158 -3.369 2.162 1.00 0.00 C ATOM 186 C LYS A 454 -9.792 -2.098 2.730 1.00 0.00 C ATOM 187 O LYS A 454 -10.831 -1.662 2.235 1.00 0.00 O ATOM 188 CB LYS A 454 -10.008 -4.617 2.401 1.00 0.00 C ATOM 189 CG LYS A 454 -9.355 -5.777 1.663 1.00 0.00 C ATOM 190 CD LYS A 454 -10.177 -7.038 1.834 1.00 0.00 C ATOM 191 CE LYS A 454 -9.425 -8.025 0.980 1.00 0.00 C ATOM 192 NZ LYS A 454 -10.231 -9.188 0.521 1.00 0.00 N ATOM 0 H LYS A 454 -7.868 -3.855 3.713 1.00 0.00 H new ATOM 0 HA LYS A 454 -9.084 -3.183 1.090 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -10.076 -4.833 3.467 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -11.025 -4.460 2.042 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -9.261 -5.537 0.604 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -8.346 -5.938 2.044 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -10.225 -7.355 2.876 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -11.204 -6.904 1.494 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -9.032 -7.504 0.106 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.568 -8.394 1.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.840 -9.550 -0.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -10.200 -9.938 1.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -11.216 -8.891 0.373 1.00 0.00 H new ATOM 206 N ASN A 455 -9.159 -1.490 3.742 1.00 0.00 N ATOM 207 CA ASN A 455 -9.491 -0.152 4.200 1.00 0.00 C ATOM 208 C ASN A 455 -8.883 0.865 3.232 1.00 0.00 C ATOM 209 O ASN A 455 -9.612 1.529 2.498 1.00 0.00 O ATOM 210 CB ASN A 455 -9.020 0.090 5.645 1.00 0.00 C ATOM 211 CG ASN A 455 -10.181 -0.055 6.613 1.00 0.00 C ATOM 212 OD1 ASN A 455 -11.120 0.727 6.606 1.00 0.00 O ATOM 213 ND2 ASN A 455 -10.161 -1.031 7.475 1.00 0.00 N ATOM 0 H ASN A 455 -8.398 -1.924 4.264 1.00 0.00 H new ATOM 0 HA ASN A 455 -10.575 -0.037 4.210 1.00 0.00 H new ATOM 0 HB2 ASN A 455 -8.234 -0.620 5.901 1.00 0.00 H new ATOM 0 HB3 ASN A 455 -8.589 1.087 5.731 1.00 0.00 H new ATOM 0 HD21 ASN A 455 -10.927 -1.140 8.140 1.00 0.00 H new ATOM 0 HD22 ASN A 455 -9.380 -1.687 7.485 1.00 0.00 H new ATOM 220 N ILE A 456 -7.545 0.971 3.291 1.00 0.00 N ATOM 221 CA ILE A 456 -6.619 1.958 2.706 1.00 0.00 C ATOM 222 C ILE A 456 -6.213 3.048 3.730 1.00 0.00 C ATOM 223 O ILE A 456 -5.009 3.153 3.963 1.00 0.00 O ATOM 224 CB ILE A 456 -7.037 2.474 1.304 1.00 0.00 C ATOM 225 CG1 ILE A 456 -7.151 1.354 0.232 1.00 0.00 C ATOM 226 CG2 ILE A 456 -6.096 3.557 0.756 1.00 0.00 C ATOM 227 CD1 ILE A 456 -5.999 0.337 0.178 1.00 0.00 C ATOM 0 H ILE A 456 -7.018 0.275 3.819 1.00 0.00 H new ATOM 0 HA ILE A 456 -5.695 1.425 2.482 1.00 0.00 H new ATOM 0 HB ILE A 456 -8.025 2.899 1.478 1.00 0.00 H new ATOM 0 HG12 ILE A 456 -8.079 0.809 0.405 1.00 0.00 H new ATOM 0 HG13 ILE A 456 -7.236 1.826 -0.747 1.00 0.00 H new ATOM 0 HG21 ILE A 456 -6.442 3.876 -0.227 1.00 0.00 H new ATOM 0 HG22 ILE A 456 -6.090 4.411 1.434 1.00 0.00 H new ATOM 0 HG23 ILE A 456 -5.087 3.154 0.672 1.00 0.00 H new ATOM 0 HD11 ILE A 456 -6.194 -0.392 -0.608 1.00 0.00 H new ATOM 0 HD12 ILE A 456 -5.064 0.857 -0.033 1.00 0.00 H new ATOM 0 HD13 ILE A 456 -5.921 -0.176 1.137 1.00 0.00 H new ATOM 239 N PRO A 457 -7.102 3.816 4.414 1.00 0.00 N ATOM 240 CA PRO A 457 -6.685 4.842 5.384 1.00 0.00 C ATOM 241 C PRO A 457 -5.802 4.288 6.507 1.00 0.00 C ATOM 242 O PRO A 457 -4.720 4.813 6.766 1.00 0.00 O ATOM 243 CB PRO A 457 -7.969 5.462 5.960 1.00 0.00 C ATOM 244 CG PRO A 457 -9.067 5.077 4.974 1.00 0.00 C ATOM 245 CD PRO A 457 -8.555 3.773 4.373 1.00 0.00 C ATOM 0 HA PRO A 457 -6.071 5.585 4.875 1.00 0.00 H new ATOM 0 HB2 PRO A 457 -8.181 5.077 6.957 1.00 0.00 H new ATOM 0 HB3 PRO A 457 -7.880 6.545 6.049 1.00 0.00 H new ATOM 0 HG2 PRO A 457 -10.026 4.941 5.473 1.00 0.00 H new ATOM 0 HG3 PRO A 457 -9.210 5.843 4.212 1.00 0.00 H new ATOM 0 HD2 PRO A 457 -8.930 2.918 4.936 1.00 0.00 H new ATOM 0 HD3 PRO A 457 -8.907 3.659 3.348 1.00 0.00 H new ATOM 253 N MET A 458 -6.234 3.203 7.161 1.00 0.00 N ATOM 254 CA MET A 458 -5.482 2.572 8.254 1.00 0.00 C ATOM 255 C MET A 458 -4.263 1.783 7.758 1.00 0.00 C ATOM 256 O MET A 458 -3.292 1.652 8.499 1.00 0.00 O ATOM 257 CB MET A 458 -6.416 1.754 9.159 1.00 0.00 C ATOM 258 CG MET A 458 -7.445 0.850 8.510 1.00 0.00 C ATOM 259 SD MET A 458 -8.499 0.116 9.788 1.00 0.00 S ATOM 260 CE MET A 458 -7.626 -1.447 9.938 1.00 0.00 C ATOM 0 H MET A 458 -7.116 2.737 6.947 1.00 0.00 H new ATOM 0 HA MET A 458 -5.063 3.367 8.870 1.00 0.00 H new ATOM 0 HB2 MET A 458 -5.793 1.136 9.806 1.00 0.00 H new ATOM 0 HB3 MET A 458 -6.949 2.453 9.803 1.00 0.00 H new ATOM 0 HG2 MET A 458 -8.052 1.419 7.806 1.00 0.00 H new ATOM 0 HG3 MET A 458 -6.947 0.066 7.940 1.00 0.00 H new ATOM 0 HE1 MET A 458 -8.235 -2.151 10.506 1.00 0.00 H new ATOM 0 HE2 MET A 458 -7.433 -1.853 8.945 1.00 0.00 H new ATOM 0 HE3 MET A 458 -6.680 -1.287 10.455 1.00 0.00 H new ATOM 270 N TRP A 459 -4.241 1.345 6.492 1.00 0.00 N ATOM 271 CA TRP A 459 -3.032 0.772 5.888 1.00 0.00 C ATOM 272 C TRP A 459 -1.940 1.840 5.680 1.00 0.00 C ATOM 273 O TRP A 459 -0.806 1.690 6.138 1.00 0.00 O ATOM 274 CB TRP A 459 -3.374 0.016 4.606 1.00 0.00 C ATOM 275 CG TRP A 459 -2.233 -0.728 3.978 1.00 0.00 C ATOM 276 CD1 TRP A 459 -1.890 -2.009 4.247 1.00 0.00 C ATOM 277 CD2 TRP A 459 -1.260 -0.254 2.989 1.00 0.00 C ATOM 278 NE1 TRP A 459 -0.794 -2.362 3.484 1.00 0.00 N ATOM 279 CE2 TRP A 459 -0.379 -1.334 2.677 1.00 0.00 C ATOM 280 CE3 TRP A 459 -1.017 0.974 2.333 1.00 0.00 C ATOM 281 CZ2 TRP A 459 0.664 -1.226 1.749 1.00 0.00 C ATOM 282 CZ3 TRP A 459 0.051 1.104 1.423 1.00 0.00 C ATOM 283 CH2 TRP A 459 0.867 0.008 1.117 1.00 0.00 C ATOM 0 H TRP A 459 -5.047 1.377 5.867 1.00 0.00 H new ATOM 0 HA TRP A 459 -2.613 0.045 6.584 1.00 0.00 H new ATOM 0 HB2 TRP A 459 -4.173 -0.693 4.824 1.00 0.00 H new ATOM 0 HB3 TRP A 459 -3.768 0.726 3.879 1.00 0.00 H new ATOM 0 HD1 TRP A 459 -2.395 -2.655 4.950 1.00 0.00 H new ATOM 0 HE1 TRP A 459 -0.347 -3.278 3.517 1.00 0.00 H new ATOM 0 HE3 TRP A 459 -1.656 1.821 2.531 1.00 0.00 H new ATOM 0 HZ2 TRP A 459 1.296 -2.073 1.526 1.00 0.00 H new ATOM 0 HZ3 TRP A 459 0.242 2.059 0.957 1.00 0.00 H new ATOM 0 HH2 TRP A 459 1.658 0.114 0.389 1.00 0.00 H new ATOM 294 N LEU A 460 -2.313 2.973 5.072 1.00 0.00 N ATOM 295 CA LEU A 460 -1.512 4.201 4.946 1.00 0.00 C ATOM 296 C LEU A 460 -1.120 4.824 6.298 1.00 0.00 C ATOM 297 O LEU A 460 -0.174 5.614 6.360 1.00 0.00 O ATOM 298 CB LEU A 460 -2.327 5.227 4.135 1.00 0.00 C ATOM 299 CG LEU A 460 -2.589 4.884 2.663 1.00 0.00 C ATOM 300 CD1 LEU A 460 -3.631 5.858 2.107 1.00 0.00 C ATOM 301 CD2 LEU A 460 -1.325 5.056 1.830 1.00 0.00 C ATOM 0 H LEU A 460 -3.228 3.065 4.631 1.00 0.00 H new ATOM 0 HA LEU A 460 -0.580 3.932 4.448 1.00 0.00 H new ATOM 0 HB2 LEU A 460 -3.289 5.366 4.629 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.807 6.184 4.175 1.00 0.00 H new ATOM 0 HG LEU A 460 -2.929 3.850 2.610 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -3.826 5.624 1.060 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -4.555 5.767 2.677 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -3.255 6.878 2.187 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -1.538 4.807 0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -0.986 6.090 1.893 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.546 4.395 2.210 1.00 0.00 H new ATOM 313 N LYS A 461 -1.823 4.503 7.390 1.00 0.00 N ATOM 314 CA LYS A 461 -1.511 4.987 8.741 1.00 0.00 C ATOM 315 C LYS A 461 -0.245 4.408 9.332 1.00 0.00 C ATOM 316 O LYS A 461 0.478 5.132 10.017 1.00 0.00 O ATOM 317 CB LYS A 461 -2.735 4.784 9.636 1.00 0.00 C ATOM 318 CG LYS A 461 -2.524 5.461 10.984 1.00 0.00 C ATOM 319 CD LYS A 461 -3.793 5.492 11.818 1.00 0.00 C ATOM 320 CE LYS A 461 -4.690 6.636 11.326 1.00 0.00 C ATOM 321 NZ LYS A 461 -4.621 7.829 12.212 1.00 0.00 N ATOM 0 H LYS A 461 -2.638 3.890 7.360 1.00 0.00 H new ATOM 0 HA LYS A 461 -1.290 6.052 8.671 1.00 0.00 H new ATOM 0 HB2 LYS A 461 -3.621 5.194 9.151 1.00 0.00 H new ATOM 0 HB3 LYS A 461 -2.915 3.719 9.781 1.00 0.00 H new ATOM 0 HG2 LYS A 461 -1.743 4.935 11.534 1.00 0.00 H new ATOM 0 HG3 LYS A 461 -2.171 6.480 10.825 1.00 0.00 H new ATOM 0 HD2 LYS A 461 -4.319 4.541 11.738 1.00 0.00 H new ATOM 0 HD3 LYS A 461 -3.548 5.633 12.871 1.00 0.00 H new ATOM 0 HE2 LYS A 461 -4.393 6.919 10.316 1.00 0.00 H new ATOM 0 HE3 LYS A 461 -5.721 6.287 11.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 461 -5.570 8.045 12.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 461 -3.980 7.634 13.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 461 -4.265 8.643 11.671 1.00 0.00 H new ATOM 335 N SER A 462 0.105 3.186 8.961 1.00 0.00 N ATOM 336 CA SER A 462 1.417 2.642 9.304 1.00 0.00 C ATOM 337 C SER A 462 2.572 3.472 8.702 1.00 0.00 C ATOM 338 O SER A 462 3.677 3.476 9.246 1.00 0.00 O ATOM 339 CB SER A 462 1.528 1.187 8.838 1.00 0.00 C ATOM 340 OG SER A 462 0.570 0.383 9.508 1.00 0.00 O ATOM 0 H SER A 462 -0.492 2.554 8.427 1.00 0.00 H new ATOM 0 HA SER A 462 1.508 2.689 10.389 1.00 0.00 H new ATOM 0 HB2 SER A 462 1.372 1.130 7.761 1.00 0.00 H new ATOM 0 HB3 SER A 462 2.532 0.810 9.035 1.00 0.00 H new ATOM 0 HG SER A 462 0.649 -0.544 9.201 1.00 0.00 H new ATOM 346 N LEU A 463 2.323 4.236 7.622 1.00 0.00 N ATOM 347 CA LEU A 463 3.280 5.129 6.956 1.00 0.00 C ATOM 348 C LEU A 463 3.307 6.539 7.580 1.00 0.00 C ATOM 349 O LEU A 463 4.089 7.386 7.148 1.00 0.00 O ATOM 350 CB LEU A 463 2.954 5.248 5.447 1.00 0.00 C ATOM 351 CG LEU A 463 2.355 4.004 4.778 1.00 0.00 C ATOM 352 CD1 LEU A 463 2.157 4.228 3.282 1.00 0.00 C ATOM 353 CD2 LEU A 463 3.231 2.758 4.937 1.00 0.00 C ATOM 0 H LEU A 463 1.407 4.246 7.173 1.00 0.00 H new ATOM 0 HA LEU A 463 4.265 4.682 7.092 1.00 0.00 H new ATOM 0 HB2 LEU A 463 2.259 6.077 5.312 1.00 0.00 H new ATOM 0 HB3 LEU A 463 3.871 5.512 4.919 1.00 0.00 H new ATOM 0 HG LEU A 463 1.403 3.839 5.282 1.00 0.00 H new ATOM 0 HD11 LEU A 463 1.731 3.331 2.833 1.00 0.00 H new ATOM 0 HD12 LEU A 463 1.480 5.068 3.126 1.00 0.00 H new ATOM 0 HD13 LEU A 463 3.118 4.446 2.816 1.00 0.00 H new ATOM 0 HD21 LEU A 463 2.753 1.912 4.443 1.00 0.00 H new ATOM 0 HD22 LEU A 463 4.206 2.939 4.485 1.00 0.00 H new ATOM 0 HD23 LEU A 463 3.358 2.535 5.996 1.00 0.00 H new ATOM 365 N ARG A 464 2.421 6.805 8.559 1.00 0.00 N ATOM 366 CA ARG A 464 2.096 8.121 9.141 1.00 0.00 C ATOM 367 C ARG A 464 1.513 9.110 8.109 1.00 0.00 C ATOM 368 O ARG A 464 1.438 10.311 8.366 1.00 0.00 O ATOM 369 CB ARG A 464 3.277 8.676 9.970 1.00 0.00 C ATOM 370 CG ARG A 464 3.644 7.821 11.203 1.00 0.00 C ATOM 371 CD ARG A 464 4.479 6.555 10.941 1.00 0.00 C ATOM 372 NE ARG A 464 5.771 6.864 10.298 1.00 0.00 N ATOM 373 CZ ARG A 464 6.541 6.053 9.593 1.00 0.00 C ATOM 374 NH1 ARG A 464 6.204 4.826 9.309 1.00 0.00 N ATOM 375 NH2 ARG A 464 7.694 6.469 9.152 1.00 0.00 N ATOM 0 H ARG A 464 1.878 6.058 8.992 1.00 0.00 H new ATOM 0 HA ARG A 464 1.280 7.976 9.849 1.00 0.00 H new ATOM 0 HB2 ARG A 464 4.152 8.757 9.325 1.00 0.00 H new ATOM 0 HB3 ARG A 464 3.031 9.685 10.302 1.00 0.00 H new ATOM 0 HG2 ARG A 464 4.192 8.451 11.904 1.00 0.00 H new ATOM 0 HG3 ARG A 464 2.720 7.523 11.698 1.00 0.00 H new ATOM 0 HD2 ARG A 464 4.658 6.038 11.884 1.00 0.00 H new ATOM 0 HD3 ARG A 464 3.913 5.873 10.307 1.00 0.00 H new ATOM 0 HE ARG A 464 6.111 7.819 10.411 1.00 0.00 H new ATOM 0 HH11 ARG A 464 5.312 4.454 9.634 1.00 0.00 H new ATOM 0 HH12 ARG A 464 6.832 4.238 8.761 1.00 0.00 H new ATOM 0 HH21 ARG A 464 8.003 7.421 9.351 1.00 0.00 H new ATOM 0 HH22 ARG A 464 8.288 5.843 8.608 1.00 0.00 H new ATOM 389 N LEU A 465 1.051 8.593 6.962 1.00 0.00 N ATOM 390 CA LEU A 465 0.388 9.337 5.886 1.00 0.00 C ATOM 391 C LEU A 465 -1.136 9.379 6.087 1.00 0.00 C ATOM 392 O LEU A 465 -1.678 10.454 6.333 1.00 0.00 O ATOM 393 CB LEU A 465 0.772 8.733 4.519 1.00 0.00 C ATOM 394 CG LEU A 465 2.256 8.915 4.134 1.00 0.00 C ATOM 395 CD1 LEU A 465 2.524 8.138 2.854 1.00 0.00 C ATOM 396 CD2 LEU A 465 2.639 10.386 3.955 1.00 0.00 C ATOM 0 H LEU A 465 1.134 7.599 6.751 1.00 0.00 H new ATOM 0 HA LEU A 465 0.732 10.371 5.912 1.00 0.00 H new ATOM 0 HB2 LEU A 465 0.540 7.668 4.528 1.00 0.00 H new ATOM 0 HB3 LEU A 465 0.151 9.188 3.747 1.00 0.00 H new ATOM 0 HG LEU A 465 2.871 8.533 4.949 1.00 0.00 H new ATOM 0 HD11 LEU A 465 3.569 8.257 2.568 1.00 0.00 H new ATOM 0 HD12 LEU A 465 2.310 7.082 3.018 1.00 0.00 H new ATOM 0 HD13 LEU A 465 1.885 8.518 2.057 1.00 0.00 H new ATOM 0 HD21 LEU A 465 3.693 10.457 3.685 1.00 0.00 H new ATOM 0 HD22 LEU A 465 2.031 10.827 3.165 1.00 0.00 H new ATOM 0 HD23 LEU A 465 2.466 10.923 4.888 1.00 0.00 H new ATOM 408 N HIS A 466 -1.818 8.226 5.985 1.00 0.00 N ATOM 409 CA HIS A 466 -3.277 8.052 6.226 1.00 0.00 C ATOM 410 C HIS A 466 -4.233 9.139 5.685 1.00 0.00 C ATOM 411 O HIS A 466 -5.258 9.456 6.296 1.00 0.00 O ATOM 412 CB HIS A 466 -3.494 7.687 7.696 1.00 0.00 C ATOM 413 CG HIS A 466 -3.149 8.710 8.744 1.00 0.00 C ATOM 414 ND1 HIS A 466 -1.985 8.743 9.476 1.00 0.00 N ATOM 415 CD2 HIS A 466 -4.020 9.603 9.308 1.00 0.00 C ATOM 416 CE1 HIS A 466 -2.152 9.620 10.476 1.00 0.00 C ATOM 417 NE2 HIS A 466 -3.377 10.168 10.417 1.00 0.00 N ATOM 0 H HIS A 466 -1.360 7.353 5.724 1.00 0.00 H new ATOM 0 HA HIS A 466 -3.589 7.225 5.588 1.00 0.00 H new ATOM 0 HB2 HIS A 466 -4.544 7.424 7.822 1.00 0.00 H new ATOM 0 HB3 HIS A 466 -2.913 6.789 7.905 1.00 0.00 H new ATOM 0 HD2 HIS A 466 -5.018 9.830 8.962 1.00 0.00 H new ATOM 0 HE1 HIS A 466 -1.407 9.853 11.223 1.00 0.00 H new ATOM 0 HE2 HIS A 466 -3.764 10.862 11.056 1.00 0.00 H new ATOM 425 N LYS A 467 -3.906 9.681 4.505 1.00 0.00 N ATOM 426 CA LYS A 467 -4.584 10.813 3.839 1.00 0.00 C ATOM 427 C LYS A 467 -5.009 10.533 2.399 1.00 0.00 C ATOM 428 O LYS A 467 -6.067 10.985 1.962 1.00 0.00 O ATOM 429 CB LYS A 467 -3.677 12.057 3.921 1.00 0.00 C ATOM 430 CG LYS A 467 -2.408 11.850 3.081 1.00 0.00 C ATOM 431 CD LYS A 467 -1.352 12.931 3.173 1.00 0.00 C ATOM 432 CE LYS A 467 -1.780 14.227 2.474 1.00 0.00 C ATOM 433 NZ LYS A 467 -0.609 15.104 2.207 1.00 0.00 N ATOM 0 H LYS A 467 -3.122 9.328 3.957 1.00 0.00 H new ATOM 0 HA LYS A 467 -5.519 10.986 4.373 1.00 0.00 H new ATOM 0 HB2 LYS A 467 -4.218 12.934 3.564 1.00 0.00 H new ATOM 0 HB3 LYS A 467 -3.406 12.250 4.959 1.00 0.00 H new ATOM 0 HG2 LYS A 467 -1.954 10.904 3.376 1.00 0.00 H new ATOM 0 HG3 LYS A 467 -2.703 11.750 2.037 1.00 0.00 H new ATOM 0 HD2 LYS A 467 -1.140 13.140 4.222 1.00 0.00 H new ATOM 0 HD3 LYS A 467 -0.426 12.569 2.726 1.00 0.00 H new ATOM 0 HE2 LYS A 467 -2.281 13.989 1.536 1.00 0.00 H new ATOM 0 HE3 LYS A 467 -2.501 14.758 3.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 467 -0.920 15.950 1.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 467 -0.177 15.390 3.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 467 0.090 14.586 1.637 1.00 0.00 H new ATOM 447 N TYR A 468 -4.187 9.789 1.652 1.00 0.00 N ATOM 448 CA TYR A 468 -4.340 9.629 0.208 1.00 0.00 C ATOM 449 C TYR A 468 -5.539 8.763 -0.171 1.00 0.00 C ATOM 450 O TYR A 468 -6.048 8.869 -1.282 1.00 0.00 O ATOM 451 CB TYR A 468 -3.017 9.175 -0.409 1.00 0.00 C ATOM 452 CG TYR A 468 -1.910 10.166 -0.134 1.00 0.00 C ATOM 453 CD1 TYR A 468 -2.072 11.477 -0.623 1.00 0.00 C ATOM 454 CD2 TYR A 468 -0.757 9.818 0.589 1.00 0.00 C ATOM 455 CE1 TYR A 468 -1.078 12.446 -0.412 1.00 0.00 C ATOM 456 CE2 TYR A 468 0.252 10.783 0.781 1.00 0.00 C ATOM 457 CZ TYR A 468 0.097 12.098 0.280 1.00 0.00 C ATOM 458 OH TYR A 468 1.006 13.070 0.571 1.00 0.00 O ATOM 0 H TYR A 468 -3.393 9.279 2.038 1.00 0.00 H new ATOM 0 HA TYR A 468 -4.578 10.600 -0.225 1.00 0.00 H new ATOM 0 HB2 TYR A 468 -2.742 8.200 -0.007 1.00 0.00 H new ATOM 0 HB3 TYR A 468 -3.139 9.053 -1.485 1.00 0.00 H new ATOM 0 HD1 TYR A 468 -2.969 11.739 -1.165 1.00 0.00 H new ATOM 0 HD2 TYR A 468 -0.645 8.823 0.993 1.00 0.00 H new ATOM 0 HE1 TYR A 468 -1.214 13.453 -0.779 1.00 0.00 H new ATOM 0 HE2 TYR A 468 1.152 10.517 1.315 1.00 0.00 H new ATOM 0 HH TYR A 468 1.711 12.698 1.141 1.00 0.00 H new ATOM 468 N SER A 469 -6.077 8.015 0.793 1.00 0.00 N ATOM 469 CA SER A 469 -7.328 7.263 0.762 1.00 0.00 C ATOM 470 C SER A 469 -8.511 8.079 0.246 1.00 0.00 C ATOM 471 O SER A 469 -9.386 7.525 -0.416 1.00 0.00 O ATOM 472 CB SER A 469 -7.658 6.824 2.190 1.00 0.00 C ATOM 473 OG SER A 469 -7.412 7.884 3.106 1.00 0.00 O ATOM 0 H SER A 469 -5.606 7.912 1.692 1.00 0.00 H new ATOM 0 HA SER A 469 -7.181 6.423 0.083 1.00 0.00 H new ATOM 0 HB2 SER A 469 -8.702 6.518 2.251 1.00 0.00 H new ATOM 0 HB3 SER A 469 -7.056 5.956 2.458 1.00 0.00 H new ATOM 0 HG SER A 469 -7.629 7.588 4.015 1.00 0.00 H new ATOM 479 N ASP A 470 -8.505 9.395 0.469 1.00 0.00 N ATOM 480 CA ASP A 470 -9.491 10.344 -0.048 1.00 0.00 C ATOM 481 C ASP A 470 -9.648 10.282 -1.581 1.00 0.00 C ATOM 482 O ASP A 470 -10.724 10.545 -2.123 1.00 0.00 O ATOM 483 CB ASP A 470 -9.057 11.748 0.385 1.00 0.00 C ATOM 484 CG ASP A 470 -10.080 12.828 -0.005 1.00 0.00 C ATOM 485 OD1 ASP A 470 -11.181 12.862 0.594 1.00 0.00 O ATOM 486 OD2 ASP A 470 -9.775 13.661 -0.892 1.00 0.00 O ATOM 0 H ASP A 470 -7.786 9.845 1.036 1.00 0.00 H new ATOM 0 HA ASP A 470 -10.468 10.084 0.361 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -8.912 11.763 1.465 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -8.094 11.983 -0.069 1.00 0.00 H new ATOM 491 N ALA A 471 -8.573 9.881 -2.265 1.00 0.00 N ATOM 492 CA ALA A 471 -8.453 9.714 -3.709 1.00 0.00 C ATOM 493 C ALA A 471 -8.029 8.291 -4.148 1.00 0.00 C ATOM 494 O ALA A 471 -8.053 7.974 -5.339 1.00 0.00 O ATOM 495 CB ALA A 471 -7.450 10.773 -4.177 1.00 0.00 C ATOM 0 H ALA A 471 -7.703 9.649 -1.786 1.00 0.00 H new ATOM 0 HA ALA A 471 -9.431 9.845 -4.172 1.00 0.00 H new ATOM 0 HB1 ALA A 471 -7.318 10.697 -5.256 1.00 0.00 H new ATOM 0 HB2 ALA A 471 -7.825 11.765 -3.926 1.00 0.00 H new ATOM 0 HB3 ALA A 471 -6.492 10.611 -3.682 1.00 0.00 H new ATOM 501 N LEU A 472 -7.667 7.429 -3.190 1.00 0.00 N ATOM 502 CA LEU A 472 -6.985 6.150 -3.397 1.00 0.00 C ATOM 503 C LEU A 472 -7.668 4.919 -2.771 1.00 0.00 C ATOM 504 O LEU A 472 -7.393 3.801 -3.192 1.00 0.00 O ATOM 505 CB LEU A 472 -5.573 6.391 -2.841 1.00 0.00 C ATOM 506 CG LEU A 472 -4.495 5.415 -3.306 1.00 0.00 C ATOM 507 CD1 LEU A 472 -3.233 6.196 -3.650 1.00 0.00 C ATOM 508 CD2 LEU A 472 -4.228 4.321 -2.273 1.00 0.00 C ATOM 0 H LEU A 472 -7.851 7.615 -2.204 1.00 0.00 H new ATOM 0 HA LEU A 472 -6.996 5.881 -4.453 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -5.264 7.400 -3.114 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -5.622 6.356 -1.753 1.00 0.00 H new ATOM 0 HG LEU A 472 -4.847 4.899 -4.199 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -2.458 5.506 -3.983 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -3.451 6.908 -4.446 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -2.886 6.733 -2.767 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -3.454 3.650 -2.646 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -3.895 4.775 -1.340 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -5.144 3.757 -2.096 1.00 0.00 H new ATOM 520 N SER A 473 -8.599 5.085 -1.822 1.00 0.00 N ATOM 521 CA SER A 473 -9.373 3.989 -1.198 1.00 0.00 C ATOM 522 C SER A 473 -10.216 3.196 -2.202 1.00 0.00 C ATOM 523 O SER A 473 -10.394 1.983 -2.072 1.00 0.00 O ATOM 524 CB SER A 473 -10.248 4.563 -0.088 1.00 0.00 C ATOM 525 OG SER A 473 -11.004 3.579 0.598 1.00 0.00 O ATOM 0 H SER A 473 -8.845 6.004 -1.454 1.00 0.00 H new ATOM 0 HA SER A 473 -8.659 3.277 -0.783 1.00 0.00 H new ATOM 0 HB2 SER A 473 -9.616 5.089 0.627 1.00 0.00 H new ATOM 0 HB3 SER A 473 -10.928 5.300 -0.516 1.00 0.00 H new ATOM 0 HG SER A 473 -10.407 3.037 1.155 1.00 0.00 H new ATOM 531 N GLY A 474 -10.645 3.870 -3.270 1.00 0.00 N ATOM 532 CA GLY A 474 -11.263 3.267 -4.459 1.00 0.00 C ATOM 533 C GLY A 474 -10.343 2.327 -5.263 1.00 0.00 C ATOM 534 O GLY A 474 -10.811 1.677 -6.199 1.00 0.00 O ATOM 0 H GLY A 474 -10.571 4.885 -3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -12.146 2.709 -4.148 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -11.606 4.066 -5.117 1.00 0.00 H new ATOM 538 N THR A 475 -9.054 2.225 -4.905 1.00 0.00 N ATOM 539 CA THR A 475 -8.064 1.300 -5.480 1.00 0.00 C ATOM 540 C THR A 475 -7.658 0.250 -4.432 1.00 0.00 C ATOM 541 O THR A 475 -6.938 0.586 -3.488 1.00 0.00 O ATOM 542 CB THR A 475 -6.842 2.046 -6.051 1.00 0.00 C ATOM 543 OG1 THR A 475 -7.253 3.084 -6.924 1.00 0.00 O ATOM 544 CG2 THR A 475 -5.973 1.112 -6.889 1.00 0.00 C ATOM 0 H THR A 475 -8.654 2.812 -4.173 1.00 0.00 H new ATOM 0 HA THR A 475 -8.525 0.784 -6.322 1.00 0.00 H new ATOM 0 HB THR A 475 -6.290 2.437 -5.196 1.00 0.00 H new ATOM 0 HG1 THR A 475 -6.689 3.873 -6.783 1.00 0.00 H new ATOM 0 HG21 THR A 475 -5.118 1.664 -7.280 1.00 0.00 H new ATOM 0 HG22 THR A 475 -5.620 0.288 -6.268 1.00 0.00 H new ATOM 0 HG23 THR A 475 -6.559 0.716 -7.718 1.00 0.00 H new ATOM 552 N PRO A 476 -8.113 -1.017 -4.545 1.00 0.00 N ATOM 553 CA PRO A 476 -7.747 -2.076 -3.603 1.00 0.00 C ATOM 554 C PRO A 476 -6.263 -2.379 -3.696 1.00 0.00 C ATOM 555 O PRO A 476 -5.704 -2.331 -4.791 1.00 0.00 O ATOM 556 CB PRO A 476 -8.550 -3.312 -4.019 1.00 0.00 C ATOM 557 CG PRO A 476 -8.817 -3.083 -5.504 1.00 0.00 C ATOM 558 CD PRO A 476 -8.912 -1.566 -5.632 1.00 0.00 C ATOM 0 HA PRO A 476 -7.961 -1.778 -2.577 1.00 0.00 H new ATOM 0 HB2 PRO A 476 -7.988 -4.231 -3.850 1.00 0.00 H new ATOM 0 HB3 PRO A 476 -9.478 -3.397 -3.453 1.00 0.00 H new ATOM 0 HG2 PRO A 476 -8.014 -3.486 -6.121 1.00 0.00 H new ATOM 0 HG3 PRO A 476 -9.739 -3.569 -5.823 1.00 0.00 H new ATOM 0 HD2 PRO A 476 -8.536 -1.232 -6.599 1.00 0.00 H new ATOM 0 HD3 PRO A 476 -9.948 -1.233 -5.561 1.00 0.00 H new ATOM 566 N TRP A 477 -5.646 -2.797 -2.587 1.00 0.00 N ATOM 567 CA TRP A 477 -4.200 -3.046 -2.466 1.00 0.00 C ATOM 568 C TRP A 477 -3.582 -3.885 -3.591 1.00 0.00 C ATOM 569 O TRP A 477 -2.405 -3.756 -3.908 1.00 0.00 O ATOM 570 CB TRP A 477 -3.917 -3.770 -1.154 1.00 0.00 C ATOM 571 CG TRP A 477 -4.311 -5.219 -1.133 1.00 0.00 C ATOM 572 CD1 TRP A 477 -5.562 -5.731 -1.025 1.00 0.00 C ATOM 573 CD2 TRP A 477 -3.432 -6.371 -1.287 1.00 0.00 C ATOM 574 NE1 TRP A 477 -5.499 -7.100 -1.016 1.00 0.00 N ATOM 575 CE2 TRP A 477 -4.217 -7.561 -1.217 1.00 0.00 C ATOM 576 CE3 TRP A 477 -2.047 -6.527 -1.493 1.00 0.00 C ATOM 577 CZ2 TRP A 477 -3.658 -8.842 -1.347 1.00 0.00 C ATOM 578 CZ3 TRP A 477 -1.478 -7.802 -1.600 1.00 0.00 C ATOM 579 CH2 TRP A 477 -2.273 -8.960 -1.553 1.00 0.00 C ATOM 0 H TRP A 477 -6.152 -2.978 -1.720 1.00 0.00 H new ATOM 0 HA TRP A 477 -3.744 -2.057 -2.518 1.00 0.00 H new ATOM 0 HB2 TRP A 477 -2.851 -3.695 -0.937 1.00 0.00 H new ATOM 0 HB3 TRP A 477 -4.443 -3.254 -0.351 1.00 0.00 H new ATOM 0 HD1 TRP A 477 -6.469 -5.149 -0.957 1.00 0.00 H new ATOM 0 HE1 TRP A 477 -6.307 -7.707 -0.877 1.00 0.00 H new ATOM 0 HE3 TRP A 477 -1.417 -5.653 -1.569 1.00 0.00 H new ATOM 0 HZ2 TRP A 477 -4.282 -9.722 -1.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 477 -0.409 -7.897 -1.721 1.00 0.00 H new ATOM 0 HH2 TRP A 477 -1.822 -9.934 -1.674 1.00 0.00 H new ATOM 590 N ILE A 478 -4.391 -4.738 -4.206 1.00 0.00 N ATOM 591 CA ILE A 478 -3.960 -5.711 -5.206 1.00 0.00 C ATOM 592 C ILE A 478 -3.935 -5.098 -6.608 1.00 0.00 C ATOM 593 O ILE A 478 -3.104 -5.483 -7.428 1.00 0.00 O ATOM 594 CB ILE A 478 -4.785 -7.009 -5.096 1.00 0.00 C ATOM 595 CG1 ILE A 478 -3.989 -8.176 -5.715 1.00 0.00 C ATOM 596 CG2 ILE A 478 -6.190 -6.874 -5.709 1.00 0.00 C ATOM 597 CD1 ILE A 478 -4.477 -9.549 -5.246 1.00 0.00 C ATOM 0 H ILE A 478 -5.393 -4.774 -4.019 1.00 0.00 H new ATOM 0 HA ILE A 478 -2.928 -5.996 -5.003 1.00 0.00 H new ATOM 0 HB ILE A 478 -4.953 -7.219 -4.040 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -4.062 -8.122 -6.801 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -2.935 -8.065 -5.460 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -6.725 -7.818 -5.603 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -6.738 -6.086 -5.193 1.00 0.00 H new ATOM 0 HG23 ILE A 478 -6.103 -6.623 -6.766 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -3.878 -10.328 -5.716 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -4.379 -9.620 -4.163 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -5.523 -9.678 -5.524 1.00 0.00 H new ATOM 609 N GLU A 479 -4.796 -4.105 -6.877 1.00 0.00 N ATOM 610 CA GLU A 479 -4.645 -3.249 -8.064 1.00 0.00 C ATOM 611 C GLU A 479 -3.676 -2.088 -7.754 1.00 0.00 C ATOM 612 O GLU A 479 -3.152 -1.439 -8.661 1.00 0.00 O ATOM 613 CB GLU A 479 -6.009 -2.694 -8.507 1.00 0.00 C ATOM 614 CG GLU A 479 -6.934 -3.801 -9.032 1.00 0.00 C ATOM 615 CD GLU A 479 -8.202 -3.209 -9.675 1.00 0.00 C ATOM 616 OE1 GLU A 479 -8.173 -2.876 -10.886 1.00 0.00 O ATOM 617 OE2 GLU A 479 -9.241 -3.081 -8.984 1.00 0.00 O ATOM 0 H GLU A 479 -5.600 -3.875 -6.293 1.00 0.00 H new ATOM 0 HA GLU A 479 -4.236 -3.849 -8.877 1.00 0.00 H new ATOM 0 HB2 GLU A 479 -6.486 -2.190 -7.666 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -5.861 -1.945 -9.285 1.00 0.00 H new ATOM 0 HG2 GLU A 479 -6.401 -4.407 -9.764 1.00 0.00 H new ATOM 0 HG3 GLU A 479 -7.214 -4.464 -8.213 1.00 0.00 H new ATOM 624 N LEU A 480 -3.429 -1.834 -6.463 1.00 0.00 N ATOM 625 CA LEU A 480 -2.728 -0.675 -5.936 1.00 0.00 C ATOM 626 C LEU A 480 -1.224 -0.759 -5.974 1.00 0.00 C ATOM 627 O LEU A 480 -0.566 0.117 -6.524 1.00 0.00 O ATOM 628 CB LEU A 480 -3.099 -0.475 -4.465 1.00 0.00 C ATOM 629 CG LEU A 480 -2.665 0.857 -3.887 1.00 0.00 C ATOM 630 CD1 LEU A 480 -3.600 1.880 -4.477 1.00 0.00 C ATOM 631 CD2 LEU A 480 -2.795 0.830 -2.372 1.00 0.00 C ATOM 0 H LEU A 480 -3.732 -2.470 -5.726 1.00 0.00 H new ATOM 0 HA LEU A 480 -3.038 0.144 -6.586 1.00 0.00 H new ATOM 0 HB2 LEU A 480 -4.180 -0.569 -4.359 1.00 0.00 H new ATOM 0 HB3 LEU A 480 -2.651 -1.276 -3.877 1.00 0.00 H new ATOM 0 HG LEU A 480 -1.625 1.085 -4.121 1.00 0.00 H new ATOM 0 HD11 LEU A 480 -3.342 2.869 -4.100 1.00 0.00 H new ATOM 0 HD12 LEU A 480 -3.511 1.871 -5.563 1.00 0.00 H new ATOM 0 HD13 LEU A 480 -4.625 1.641 -4.195 1.00 0.00 H new ATOM 0 HD21 LEU A 480 -2.481 1.790 -1.963 1.00 0.00 H new ATOM 0 HD22 LEU A 480 -3.833 0.641 -2.099 1.00 0.00 H new ATOM 0 HD23 LEU A 480 -2.164 0.039 -1.967 1.00 0.00 H new ATOM 643 N ILE A 481 -0.669 -1.781 -5.328 1.00 0.00 N ATOM 644 CA ILE A 481 0.764 -1.872 -5.066 1.00 0.00 C ATOM 645 C ILE A 481 1.606 -1.830 -6.359 1.00 0.00 C ATOM 646 O ILE A 481 2.804 -1.559 -6.365 1.00 0.00 O ATOM 647 CB ILE A 481 1.043 -3.145 -4.236 1.00 0.00 C ATOM 648 CG1 ILE A 481 0.630 -4.391 -5.056 1.00 0.00 C ATOM 649 CG2 ILE A 481 0.392 -2.997 -2.842 1.00 0.00 C ATOM 650 CD1 ILE A 481 0.709 -5.691 -4.277 1.00 0.00 C ATOM 0 H ILE A 481 -1.203 -2.573 -4.970 1.00 0.00 H new ATOM 0 HA ILE A 481 1.069 -0.996 -4.493 1.00 0.00 H new ATOM 0 HB ILE A 481 2.105 -3.285 -4.034 1.00 0.00 H new ATOM 0 HG12 ILE A 481 -0.390 -4.256 -5.416 1.00 0.00 H new ATOM 0 HG13 ILE A 481 1.271 -4.465 -5.934 1.00 0.00 H new ATOM 0 HG21 ILE A 481 0.586 -3.893 -2.253 1.00 0.00 H new ATOM 0 HG22 ILE A 481 0.814 -2.130 -2.334 1.00 0.00 H new ATOM 0 HG23 ILE A 481 -0.684 -2.863 -2.955 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.405 -6.518 -4.918 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.733 -5.851 -3.939 1.00 0.00 H new ATOM 0 HD13 ILE A 481 0.046 -5.638 -3.413 1.00 0.00 H new ATOM 662 N TYR A 482 0.916 -2.086 -7.466 1.00 0.00 N ATOM 663 CA TYR A 482 1.336 -2.133 -8.858 1.00 0.00 C ATOM 664 C TYR A 482 1.527 -0.762 -9.525 1.00 0.00 C ATOM 665 O TYR A 482 2.174 -0.684 -10.571 1.00 0.00 O ATOM 666 CB TYR A 482 0.205 -2.850 -9.602 1.00 0.00 C ATOM 667 CG TYR A 482 0.089 -4.360 -9.459 1.00 0.00 C ATOM 668 CD1 TYR A 482 1.027 -5.132 -8.738 1.00 0.00 C ATOM 669 CD2 TYR A 482 -1.005 -4.997 -10.076 1.00 0.00 C ATOM 670 CE1 TYR A 482 0.882 -6.531 -8.651 1.00 0.00 C ATOM 671 CE2 TYR A 482 -1.155 -6.394 -9.995 1.00 0.00 C ATOM 672 CZ TYR A 482 -0.203 -7.167 -9.298 1.00 0.00 C ATOM 673 OH TYR A 482 -0.330 -8.521 -9.264 1.00 0.00 O ATOM 0 H TYR A 482 -0.080 -2.292 -7.395 1.00 0.00 H new ATOM 0 HA TYR A 482 2.308 -2.625 -8.898 1.00 0.00 H new ATOM 0 HB2 TYR A 482 -0.738 -2.412 -9.275 1.00 0.00 H new ATOM 0 HB3 TYR A 482 0.310 -2.624 -10.663 1.00 0.00 H new ATOM 0 HD1 TYR A 482 1.860 -4.647 -8.251 1.00 0.00 H new ATOM 0 HD2 TYR A 482 -1.734 -4.410 -10.615 1.00 0.00 H new ATOM 0 HE1 TYR A 482 1.597 -7.116 -8.092 1.00 0.00 H new ATOM 0 HE2 TYR A 482 -1.999 -6.874 -10.467 1.00 0.00 H new ATOM 0 HH TYR A 482 -1.133 -8.787 -9.759 1.00 0.00 H new ATOM 683 N LEU A 483 0.943 0.297 -8.955 1.00 0.00 N ATOM 684 CA LEU A 483 0.898 1.645 -9.565 1.00 0.00 C ATOM 685 C LEU A 483 2.304 2.158 -9.902 1.00 0.00 C ATOM 686 O LEU A 483 2.617 2.469 -11.051 1.00 0.00 O ATOM 687 CB LEU A 483 0.250 2.643 -8.595 1.00 0.00 C ATOM 688 CG LEU A 483 -1.271 2.480 -8.426 1.00 0.00 C ATOM 689 CD1 LEU A 483 -1.748 3.082 -7.121 1.00 0.00 C ATOM 690 CD2 LEU A 483 -2.019 3.257 -9.499 1.00 0.00 C ATOM 0 H LEU A 483 0.481 0.250 -8.047 1.00 0.00 H new ATOM 0 HA LEU A 483 0.314 1.563 -10.482 1.00 0.00 H new ATOM 0 HB2 LEU A 483 0.724 2.540 -7.619 1.00 0.00 H new ATOM 0 HB3 LEU A 483 0.457 3.655 -8.944 1.00 0.00 H new ATOM 0 HG LEU A 483 -1.463 1.408 -8.475 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -2.826 2.950 -7.032 1.00 0.00 H new ATOM 0 HD12 LEU A 483 -1.252 2.584 -6.288 1.00 0.00 H new ATOM 0 HD13 LEU A 483 -1.510 4.145 -7.102 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -3.092 3.128 -9.360 1.00 0.00 H new ATOM 0 HD22 LEU A 483 -1.768 4.315 -9.423 1.00 0.00 H new ATOM 0 HD23 LEU A 483 -1.733 2.886 -10.483 1.00 0.00 H new ATOM 702 N ASP A 484 3.125 2.220 -8.855 1.00 0.00 N ATOM 703 CA ASP A 484 4.504 2.706 -8.800 1.00 0.00 C ATOM 704 C ASP A 484 4.621 4.246 -8.897 1.00 0.00 C ATOM 705 O ASP A 484 3.620 4.965 -8.930 1.00 0.00 O ATOM 706 CB ASP A 484 5.358 1.996 -9.853 1.00 0.00 C ATOM 707 CG ASP A 484 6.781 1.687 -9.358 1.00 0.00 C ATOM 708 OD1 ASP A 484 7.650 2.586 -9.423 1.00 0.00 O ATOM 709 OD2 ASP A 484 7.029 0.548 -8.898 1.00 0.00 O ATOM 0 H ASP A 484 2.813 1.902 -7.938 1.00 0.00 H new ATOM 0 HA ASP A 484 4.891 2.456 -7.812 1.00 0.00 H new ATOM 0 HB2 ASP A 484 4.869 1.066 -10.143 1.00 0.00 H new ATOM 0 HB3 ASP A 484 5.416 2.618 -10.746 1.00 0.00 H new ATOM 714 N ASP A 485 5.866 4.729 -8.948 1.00 0.00 N ATOM 715 CA ASP A 485 6.338 6.099 -8.762 1.00 0.00 C ATOM 716 C ASP A 485 5.373 7.234 -9.147 1.00 0.00 C ATOM 717 O ASP A 485 4.574 7.668 -8.319 1.00 0.00 O ATOM 718 CB ASP A 485 7.747 6.249 -9.361 1.00 0.00 C ATOM 719 CG ASP A 485 8.368 7.606 -9.007 1.00 0.00 C ATOM 720 OD1 ASP A 485 8.413 7.964 -7.810 1.00 0.00 O ATOM 721 OD2 ASP A 485 8.768 8.361 -9.921 1.00 0.00 O ATOM 0 H ASP A 485 6.647 4.102 -9.141 1.00 0.00 H new ATOM 0 HA ASP A 485 6.386 6.243 -7.683 1.00 0.00 H new ATOM 0 HB2 ASP A 485 8.387 5.448 -8.992 1.00 0.00 H new ATOM 0 HB3 ASP A 485 7.696 6.143 -10.445 1.00 0.00 H new ATOM 726 N GLU A 486 5.420 7.750 -10.377 1.00 0.00 N ATOM 727 CA GLU A 486 4.600 8.874 -10.805 1.00 0.00 C ATOM 728 C GLU A 486 3.116 8.518 -10.975 1.00 0.00 C ATOM 729 O GLU A 486 2.293 9.403 -11.174 1.00 0.00 O ATOM 730 CB GLU A 486 5.184 9.420 -12.114 1.00 0.00 C ATOM 731 CG GLU A 486 4.879 10.913 -12.216 1.00 0.00 C ATOM 732 CD GLU A 486 5.274 11.536 -13.569 1.00 0.00 C ATOM 733 OE1 GLU A 486 6.475 11.515 -13.933 1.00 0.00 O ATOM 734 OE2 GLU A 486 4.376 12.068 -14.271 1.00 0.00 O ATOM 0 H GLU A 486 6.036 7.392 -11.107 1.00 0.00 H new ATOM 0 HA GLU A 486 4.626 9.632 -10.022 1.00 0.00 H new ATOM 0 HB2 GLU A 486 6.261 9.254 -12.143 1.00 0.00 H new ATOM 0 HB3 GLU A 486 4.757 8.890 -12.966 1.00 0.00 H new ATOM 0 HG2 GLU A 486 3.813 11.069 -12.052 1.00 0.00 H new ATOM 0 HG3 GLU A 486 5.404 11.437 -11.418 1.00 0.00 H new ATOM 741 N THR A 487 2.737 7.243 -10.887 1.00 0.00 N ATOM 742 CA THR A 487 1.338 6.834 -11.097 1.00 0.00 C ATOM 743 C THR A 487 0.462 6.894 -9.849 1.00 0.00 C ATOM 744 O THR A 487 -0.728 7.192 -9.940 1.00 0.00 O ATOM 745 CB THR A 487 1.267 5.504 -11.854 1.00 0.00 C ATOM 746 OG1 THR A 487 1.769 5.677 -13.165 1.00 0.00 O ATOM 747 CG2 THR A 487 -0.147 4.956 -11.984 1.00 0.00 C ATOM 0 H THR A 487 3.372 6.474 -10.673 1.00 0.00 H new ATOM 0 HA THR A 487 0.885 7.591 -11.738 1.00 0.00 H new ATOM 0 HB THR A 487 1.859 4.797 -11.273 1.00 0.00 H new ATOM 0 HG1 THR A 487 1.725 4.825 -13.647 1.00 0.00 H new ATOM 0 HG21 THR A 487 -0.123 4.013 -12.530 1.00 0.00 H new ATOM 0 HG22 THR A 487 -0.565 4.790 -10.991 1.00 0.00 H new ATOM 0 HG23 THR A 487 -0.767 5.672 -12.523 1.00 0.00 H new ATOM 755 N LEU A 488 1.051 6.766 -8.666 1.00 0.00 N ATOM 756 CA LEU A 488 0.455 7.127 -7.378 1.00 0.00 C ATOM 757 C LEU A 488 0.015 8.599 -7.408 1.00 0.00 C ATOM 758 O LEU A 488 -0.989 9.031 -6.838 1.00 0.00 O ATOM 759 CB LEU A 488 1.599 6.926 -6.370 1.00 0.00 C ATOM 760 CG LEU A 488 1.845 5.434 -6.126 1.00 0.00 C ATOM 761 CD1 LEU A 488 3.202 5.204 -5.477 1.00 0.00 C ATOM 762 CD2 LEU A 488 0.745 4.861 -5.248 1.00 0.00 C ATOM 0 H LEU A 488 1.995 6.393 -8.570 1.00 0.00 H new ATOM 0 HA LEU A 488 -0.426 6.535 -7.130 1.00 0.00 H new ATOM 0 HB2 LEU A 488 2.509 7.394 -6.746 1.00 0.00 H new ATOM 0 HB3 LEU A 488 1.353 7.418 -5.429 1.00 0.00 H new ATOM 0 HG LEU A 488 1.837 4.925 -7.090 1.00 0.00 H new ATOM 0 HD11 LEU A 488 3.351 4.137 -5.315 1.00 0.00 H new ATOM 0 HD12 LEU A 488 3.987 5.585 -6.130 1.00 0.00 H new ATOM 0 HD13 LEU A 488 3.241 5.725 -4.521 1.00 0.00 H new ATOM 0 HD21 LEU A 488 0.929 3.800 -5.080 1.00 0.00 H new ATOM 0 HD22 LEU A 488 0.734 5.383 -4.291 1.00 0.00 H new ATOM 0 HD23 LEU A 488 -0.218 4.989 -5.742 1.00 0.00 H new ATOM 774 N GLU A 489 0.777 9.381 -8.158 1.00 0.00 N ATOM 775 CA GLU A 489 0.638 10.785 -8.413 1.00 0.00 C ATOM 776 C GLU A 489 -0.272 11.093 -9.625 1.00 0.00 C ATOM 777 O GLU A 489 -0.436 12.243 -10.032 1.00 0.00 O ATOM 778 CB GLU A 489 2.094 11.224 -8.535 1.00 0.00 C ATOM 779 CG GLU A 489 2.309 12.653 -9.014 1.00 0.00 C ATOM 780 CD GLU A 489 3.724 13.191 -8.775 1.00 0.00 C ATOM 781 OE1 GLU A 489 4.251 13.034 -7.649 1.00 0.00 O ATOM 782 OE2 GLU A 489 4.314 13.795 -9.702 1.00 0.00 O ATOM 0 H GLU A 489 1.586 8.997 -8.647 1.00 0.00 H new ATOM 0 HA GLU A 489 0.114 11.342 -7.637 1.00 0.00 H new ATOM 0 HB2 GLU A 489 2.573 11.109 -7.563 1.00 0.00 H new ATOM 0 HB3 GLU A 489 2.603 10.548 -9.222 1.00 0.00 H new ATOM 0 HG2 GLU A 489 2.089 12.704 -10.080 1.00 0.00 H new ATOM 0 HG3 GLU A 489 1.595 13.304 -8.510 1.00 0.00 H new ATOM 789 N LYS A 490 -0.930 10.076 -10.189 1.00 0.00 N ATOM 790 CA LYS A 490 -2.066 10.237 -11.078 1.00 0.00 C ATOM 791 C LYS A 490 -3.376 9.901 -10.359 1.00 0.00 C ATOM 792 O LYS A 490 -4.457 10.107 -10.913 1.00 0.00 O ATOM 793 CB LYS A 490 -1.843 9.411 -12.338 1.00 0.00 C ATOM 794 CG LYS A 490 -0.518 9.668 -13.040 1.00 0.00 C ATOM 795 CD LYS A 490 -0.301 11.084 -13.542 1.00 0.00 C ATOM 796 CE LYS A 490 1.199 11.218 -13.843 1.00 0.00 C ATOM 797 NZ LYS A 490 1.591 12.561 -14.332 1.00 0.00 N ATOM 0 H LYS A 490 -0.676 9.101 -10.032 1.00 0.00 H new ATOM 0 HA LYS A 490 -2.154 11.280 -11.382 1.00 0.00 H new ATOM 0 HB2 LYS A 490 -1.902 8.354 -12.078 1.00 0.00 H new ATOM 0 HB3 LYS A 490 -2.654 9.613 -13.037 1.00 0.00 H new ATOM 0 HG2 LYS A 490 0.290 9.418 -12.353 1.00 0.00 H new ATOM 0 HG3 LYS A 490 -0.439 8.986 -13.887 1.00 0.00 H new ATOM 0 HD2 LYS A 490 -0.894 11.273 -14.437 1.00 0.00 H new ATOM 0 HD3 LYS A 490 -0.613 11.812 -12.793 1.00 0.00 H new ATOM 0 HE2 LYS A 490 1.764 10.991 -12.939 1.00 0.00 H new ATOM 0 HE3 LYS A 490 1.479 10.474 -14.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 2.627 12.616 -14.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 1.172 12.725 -15.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 1.249 13.285 -13.669 1.00 0.00 H new ATOM 811 N LYS A 491 -3.273 9.440 -9.101 1.00 0.00 N ATOM 812 CA LYS A 491 -4.369 9.164 -8.181 1.00 0.00 C ATOM 813 C LYS A 491 -4.586 10.262 -7.163 1.00 0.00 C ATOM 814 O LYS A 491 -5.693 10.788 -7.063 1.00 0.00 O ATOM 815 CB LYS A 491 -4.141 7.789 -7.503 1.00 0.00 C ATOM 816 CG LYS A 491 -4.019 6.551 -8.406 1.00 0.00 C ATOM 817 CD LYS A 491 -5.345 6.157 -9.062 1.00 0.00 C ATOM 818 CE LYS A 491 -5.318 4.682 -9.483 1.00 0.00 C ATOM 819 NZ LYS A 491 -6.684 4.115 -9.635 1.00 0.00 N ATOM 0 H LYS A 491 -2.364 9.241 -8.682 1.00 0.00 H new ATOM 0 HA LYS A 491 -5.289 9.130 -8.764 1.00 0.00 H new ATOM 0 HB2 LYS A 491 -3.232 7.858 -6.906 1.00 0.00 H new ATOM 0 HB3 LYS A 491 -4.965 7.617 -6.810 1.00 0.00 H new ATOM 0 HG2 LYS A 491 -3.279 6.746 -9.183 1.00 0.00 H new ATOM 0 HG3 LYS A 491 -3.648 5.713 -7.816 1.00 0.00 H new ATOM 0 HD2 LYS A 491 -6.167 6.328 -8.366 1.00 0.00 H new ATOM 0 HD3 LYS A 491 -5.528 6.787 -9.933 1.00 0.00 H new ATOM 0 HE2 LYS A 491 -4.780 4.585 -10.426 1.00 0.00 H new ATOM 0 HE3 LYS A 491 -4.767 4.104 -8.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 491 -6.671 3.368 -10.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 491 -6.996 3.714 -8.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 491 -7.341 4.867 -9.926 1.00 0.00 H new ATOM 833 N GLY A 492 -3.542 10.632 -6.435 1.00 0.00 N ATOM 834 CA GLY A 492 -3.653 11.701 -5.444 1.00 0.00 C ATOM 835 C GLY A 492 -2.609 11.796 -4.354 1.00 0.00 C ATOM 836 O GLY A 492 -2.679 12.663 -3.488 1.00 0.00 O ATOM 0 H GLY A 492 -2.614 10.214 -6.508 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -3.657 12.650 -5.981 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -4.626 11.604 -4.962 1.00 0.00 H new ATOM 840 N VAL A 493 -1.642 10.895 -4.423 1.00 0.00 N ATOM 841 CA VAL A 493 -0.468 10.826 -3.554 1.00 0.00 C ATOM 842 C VAL A 493 0.368 12.103 -3.721 1.00 0.00 C ATOM 843 O VAL A 493 0.935 12.672 -2.796 1.00 0.00 O ATOM 844 CB VAL A 493 0.260 9.516 -3.838 1.00 0.00 C ATOM 845 CG1 VAL A 493 1.460 9.373 -2.936 1.00 0.00 C ATOM 846 CG2 VAL A 493 -0.705 8.349 -3.580 1.00 0.00 C ATOM 0 H VAL A 493 -1.651 10.152 -5.121 1.00 0.00 H new ATOM 0 HA VAL A 493 -0.728 10.802 -2.496 1.00 0.00 H new ATOM 0 HB VAL A 493 0.597 9.511 -4.875 1.00 0.00 H new ATOM 0 HG11 VAL A 493 1.968 8.433 -3.152 1.00 0.00 H new ATOM 0 HG12 VAL A 493 2.145 10.203 -3.108 1.00 0.00 H new ATOM 0 HG13 VAL A 493 1.136 9.379 -1.895 1.00 0.00 H new ATOM 0 HG21 VAL A 493 -0.197 7.406 -3.779 1.00 0.00 H new ATOM 0 HG22 VAL A 493 -1.034 8.372 -2.541 1.00 0.00 H new ATOM 0 HG23 VAL A 493 -1.570 8.441 -4.236 1.00 0.00 H new ATOM 856 N LEU A 494 0.300 12.566 -4.961 1.00 0.00 N ATOM 857 CA LEU A 494 0.601 13.833 -5.592 1.00 0.00 C ATOM 858 C LEU A 494 1.913 14.519 -5.190 1.00 0.00 C ATOM 859 O LEU A 494 1.997 15.743 -5.044 1.00 0.00 O ATOM 860 CB LEU A 494 -0.633 14.726 -5.510 1.00 0.00 C ATOM 861 CG LEU A 494 -1.827 14.217 -6.350 1.00 0.00 C ATOM 862 CD1 LEU A 494 -2.147 15.154 -7.462 1.00 0.00 C ATOM 863 CD2 LEU A 494 -1.655 12.957 -7.228 1.00 0.00 C ATOM 0 H LEU A 494 -0.035 11.925 -5.680 1.00 0.00 H new ATOM 0 HA LEU A 494 0.826 13.615 -6.636 1.00 0.00 H new ATOM 0 HB2 LEU A 494 -0.942 14.808 -4.468 1.00 0.00 H new ATOM 0 HB3 LEU A 494 -0.367 15.729 -5.844 1.00 0.00 H new ATOM 0 HG LEU A 494 -2.534 14.066 -5.534 1.00 0.00 H new ATOM 0 HD11 LEU A 494 -2.991 14.767 -8.033 1.00 0.00 H new ATOM 0 HD12 LEU A 494 -2.404 16.131 -7.052 1.00 0.00 H new ATOM 0 HD13 LEU A 494 -1.281 15.252 -8.116 1.00 0.00 H new ATOM 0 HD21 LEU A 494 -2.590 12.744 -7.746 1.00 0.00 H new ATOM 0 HD22 LEU A 494 -0.865 13.128 -7.960 1.00 0.00 H new ATOM 0 HD23 LEU A 494 -1.388 12.108 -6.598 1.00 0.00 H new ATOM 875 N ALA A 495 2.927 13.699 -4.976 1.00 0.00 N ATOM 876 CA ALA A 495 4.200 14.081 -4.380 1.00 0.00 C ATOM 877 C ALA A 495 5.171 12.916 -4.415 1.00 0.00 C ATOM 878 O ALA A 495 4.833 11.814 -3.990 1.00 0.00 O ATOM 879 CB ALA A 495 3.975 14.445 -2.910 1.00 0.00 C ATOM 0 H ALA A 495 2.887 12.710 -5.221 1.00 0.00 H new ATOM 0 HA ALA A 495 4.605 14.923 -4.941 1.00 0.00 H new ATOM 0 HB1 ALA A 495 4.924 14.732 -2.457 1.00 0.00 H new ATOM 0 HB2 ALA A 495 3.275 15.278 -2.844 1.00 0.00 H new ATOM 0 HB3 ALA A 495 3.566 13.585 -2.381 1.00 0.00 H new ATOM 885 N LEU A 496 6.411 13.192 -4.807 1.00 0.00 N ATOM 886 CA LEU A 496 7.549 12.282 -4.749 1.00 0.00 C ATOM 887 C LEU A 496 7.762 11.659 -3.386 1.00 0.00 C ATOM 888 O LEU A 496 7.923 10.448 -3.290 1.00 0.00 O ATOM 889 CB LEU A 496 8.761 13.054 -5.209 1.00 0.00 C ATOM 890 CG LEU A 496 10.116 12.344 -4.978 1.00 0.00 C ATOM 891 CD1 LEU A 496 11.066 12.736 -6.097 1.00 0.00 C ATOM 892 CD2 LEU A 496 10.830 12.765 -3.686 1.00 0.00 C ATOM 0 H LEU A 496 6.661 14.102 -5.193 1.00 0.00 H new ATOM 0 HA LEU A 496 7.357 11.431 -5.402 1.00 0.00 H new ATOM 0 HB2 LEU A 496 8.656 13.266 -6.273 1.00 0.00 H new ATOM 0 HB3 LEU A 496 8.779 14.014 -4.693 1.00 0.00 H new ATOM 0 HG LEU A 496 9.886 11.280 -4.931 1.00 0.00 H new ATOM 0 HD11 LEU A 496 12.027 12.243 -5.948 1.00 0.00 H new ATOM 0 HD12 LEU A 496 10.646 12.430 -7.055 1.00 0.00 H new ATOM 0 HD13 LEU A 496 11.208 13.817 -6.092 1.00 0.00 H new ATOM 0 HD21 LEU A 496 11.771 12.223 -3.597 1.00 0.00 H new ATOM 0 HD22 LEU A 496 11.029 13.836 -3.713 1.00 0.00 H new ATOM 0 HD23 LEU A 496 10.197 12.535 -2.829 1.00 0.00 H new ATOM 904 N GLY A 497 7.786 12.461 -2.327 1.00 0.00 N ATOM 905 CA GLY A 497 8.132 11.870 -1.043 1.00 0.00 C ATOM 906 C GLY A 497 7.027 10.998 -0.476 1.00 0.00 C ATOM 907 O GLY A 497 7.290 9.997 0.187 1.00 0.00 O ATOM 0 H GLY A 497 7.584 13.461 -2.326 1.00 0.00 H new ATOM 0 HA2 GLY A 497 9.037 11.273 -1.156 1.00 0.00 H new ATOM 0 HA3 GLY A 497 8.361 12.665 -0.333 1.00 0.00 H new ATOM 911 N ALA A 498 5.794 11.316 -0.859 1.00 0.00 N ATOM 912 CA ALA A 498 4.612 10.523 -0.545 1.00 0.00 C ATOM 913 C ALA A 498 4.588 9.214 -1.345 1.00 0.00 C ATOM 914 O ALA A 498 4.498 8.126 -0.782 1.00 0.00 O ATOM 915 CB ALA A 498 3.396 11.384 -0.847 1.00 0.00 C ATOM 0 H ALA A 498 5.585 12.150 -1.408 1.00 0.00 H new ATOM 0 HA ALA A 498 4.617 10.234 0.506 1.00 0.00 H new ATOM 0 HB1 ALA A 498 2.488 10.823 -0.624 1.00 0.00 H new ATOM 0 HB2 ALA A 498 3.426 12.284 -0.233 1.00 0.00 H new ATOM 0 HB3 ALA A 498 3.400 11.663 -1.901 1.00 0.00 H new ATOM 921 N ARG A 499 4.727 9.301 -2.670 1.00 0.00 N ATOM 922 CA ARG A 499 4.745 8.141 -3.565 1.00 0.00 C ATOM 923 C ARG A 499 5.936 7.207 -3.296 1.00 0.00 C ATOM 924 O ARG A 499 5.788 6.008 -3.446 1.00 0.00 O ATOM 925 CB ARG A 499 4.596 8.603 -5.031 1.00 0.00 C ATOM 926 CG ARG A 499 5.820 9.348 -5.547 1.00 0.00 C ATOM 927 CD ARG A 499 5.628 10.241 -6.772 1.00 0.00 C ATOM 928 NE ARG A 499 6.836 10.265 -7.621 1.00 0.00 N ATOM 929 CZ ARG A 499 7.334 11.236 -8.358 1.00 0.00 C ATOM 930 NH1 ARG A 499 6.833 12.433 -8.383 1.00 0.00 N ATOM 931 NH2 ARG A 499 8.372 11.007 -9.105 1.00 0.00 N ATOM 0 H ARG A 499 4.832 10.191 -3.158 1.00 0.00 H new ATOM 0 HA ARG A 499 3.880 7.513 -3.353 1.00 0.00 H new ATOM 0 HB2 ARG A 499 4.413 7.734 -5.663 1.00 0.00 H new ATOM 0 HB3 ARG A 499 3.722 9.249 -5.116 1.00 0.00 H new ATOM 0 HG2 ARG A 499 6.207 9.965 -4.736 1.00 0.00 H new ATOM 0 HG3 ARG A 499 6.589 8.612 -5.782 1.00 0.00 H new ATOM 0 HD2 ARG A 499 4.780 9.883 -7.355 1.00 0.00 H new ATOM 0 HD3 ARG A 499 5.388 11.254 -6.450 1.00 0.00 H new ATOM 0 HE ARG A 499 7.367 9.394 -7.639 1.00 0.00 H new ATOM 0 HH11 ARG A 499 6.016 12.656 -7.814 1.00 0.00 H new ATOM 0 HH12 ARG A 499 7.256 13.151 -8.971 1.00 0.00 H new ATOM 0 HH21 ARG A 499 8.796 10.079 -9.118 1.00 0.00 H new ATOM 0 HH22 ARG A 499 8.763 11.755 -9.678 1.00 0.00 H new ATOM 945 N ARG A 500 7.073 7.682 -2.770 1.00 0.00 N ATOM 946 CA ARG A 500 8.283 6.906 -2.425 1.00 0.00 C ATOM 947 C ARG A 500 8.104 6.161 -1.121 1.00 0.00 C ATOM 948 O ARG A 500 8.442 4.987 -0.992 1.00 0.00 O ATOM 949 CB ARG A 500 9.424 7.902 -2.260 1.00 0.00 C ATOM 950 CG ARG A 500 10.104 8.132 -3.602 1.00 0.00 C ATOM 951 CD ARG A 500 11.359 8.972 -3.393 1.00 0.00 C ATOM 952 NE ARG A 500 12.073 9.193 -4.665 1.00 0.00 N ATOM 953 CZ ARG A 500 13.264 9.742 -4.830 1.00 0.00 C ATOM 954 NH1 ARG A 500 13.962 10.197 -3.828 1.00 0.00 N ATOM 955 NH2 ARG A 500 13.781 9.848 -6.020 1.00 0.00 N ATOM 0 H ARG A 500 7.185 8.674 -2.560 1.00 0.00 H new ATOM 0 HA ARG A 500 8.483 6.176 -3.209 1.00 0.00 H new ATOM 0 HB2 ARG A 500 9.042 8.845 -1.869 1.00 0.00 H new ATOM 0 HB3 ARG A 500 10.146 7.525 -1.536 1.00 0.00 H new ATOM 0 HG2 ARG A 500 10.363 7.177 -4.060 1.00 0.00 H new ATOM 0 HG3 ARG A 500 9.423 8.639 -4.286 1.00 0.00 H new ATOM 0 HD2 ARG A 500 11.088 9.932 -2.954 1.00 0.00 H new ATOM 0 HD3 ARG A 500 12.020 8.473 -2.684 1.00 0.00 H new ATOM 0 HE ARG A 500 11.594 8.888 -5.512 1.00 0.00 H new ATOM 0 HH11 ARG A 500 13.592 10.135 -2.879 1.00 0.00 H new ATOM 0 HH12 ARG A 500 14.878 10.615 -3.992 1.00 0.00 H new ATOM 0 HH21 ARG A 500 13.267 9.506 -6.832 1.00 0.00 H new ATOM 0 HH22 ARG A 500 14.701 10.273 -6.141 1.00 0.00 H new ATOM 969 N LYS A 501 7.497 6.853 -0.166 1.00 0.00 N ATOM 970 CA LYS A 501 6.960 6.219 1.046 1.00 0.00 C ATOM 971 C LYS A 501 6.028 5.080 0.675 1.00 0.00 C ATOM 972 O LYS A 501 6.005 4.037 1.326 1.00 0.00 O ATOM 973 CB LYS A 501 6.121 7.239 1.820 1.00 0.00 C ATOM 974 CG LYS A 501 6.632 7.625 3.218 1.00 0.00 C ATOM 975 CD LYS A 501 7.608 8.815 3.226 1.00 0.00 C ATOM 976 CE LYS A 501 8.942 8.587 2.492 1.00 0.00 C ATOM 977 NZ LYS A 501 9.859 7.692 3.249 1.00 0.00 N ATOM 0 H LYS A 501 7.360 7.863 -0.202 1.00 0.00 H new ATOM 0 HA LYS A 501 7.798 5.854 1.639 1.00 0.00 H new ATOM 0 HB2 LYS A 501 6.048 8.146 1.220 1.00 0.00 H new ATOM 0 HB3 LYS A 501 5.111 6.843 1.923 1.00 0.00 H new ATOM 0 HG2 LYS A 501 5.778 7.866 3.851 1.00 0.00 H new ATOM 0 HG3 LYS A 501 7.126 6.761 3.663 1.00 0.00 H new ATOM 0 HD2 LYS A 501 7.109 9.674 2.777 1.00 0.00 H new ATOM 0 HD3 LYS A 501 7.824 9.077 4.262 1.00 0.00 H new ATOM 0 HE2 LYS A 501 8.745 8.155 1.511 1.00 0.00 H new ATOM 0 HE3 LYS A 501 9.431 9.547 2.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 10.743 7.569 2.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 10.070 8.115 4.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 9.406 6.766 3.386 1.00 0.00 H new ATOM 991 N LEU A 502 5.253 5.290 -0.385 1.00 0.00 N ATOM 992 CA LEU A 502 4.347 4.268 -0.824 1.00 0.00 C ATOM 993 C LEU A 502 5.083 3.132 -1.541 1.00 0.00 C ATOM 994 O LEU A 502 4.667 1.990 -1.408 1.00 0.00 O ATOM 995 CB LEU A 502 3.238 4.849 -1.695 1.00 0.00 C ATOM 996 CG LEU A 502 1.916 5.020 -0.916 1.00 0.00 C ATOM 997 CD1 LEU A 502 2.033 6.062 0.192 1.00 0.00 C ATOM 998 CD2 LEU A 502 0.794 5.480 -1.840 1.00 0.00 C ATOM 0 H LEU A 502 5.243 6.147 -0.938 1.00 0.00 H new ATOM 0 HA LEU A 502 3.881 3.842 0.064 1.00 0.00 H new ATOM 0 HB2 LEU A 502 3.555 5.815 -2.087 1.00 0.00 H new ATOM 0 HB3 LEU A 502 3.071 4.196 -2.552 1.00 0.00 H new ATOM 0 HG LEU A 502 1.696 4.043 -0.486 1.00 0.00 H new ATOM 0 HD11 LEU A 502 1.079 6.148 0.713 1.00 0.00 H new ATOM 0 HD12 LEU A 502 2.806 5.757 0.898 1.00 0.00 H new ATOM 0 HD13 LEU A 502 2.298 7.026 -0.242 1.00 0.00 H new ATOM 0 HD21 LEU A 502 -0.126 5.593 -1.267 1.00 0.00 H new ATOM 0 HD22 LEU A 502 1.061 6.437 -2.289 1.00 0.00 H new ATOM 0 HD23 LEU A 502 0.643 4.740 -2.626 1.00 0.00 H new ATOM 1010 N LEU A 503 6.197 3.390 -2.238 1.00 0.00 N ATOM 1011 CA LEU A 503 6.999 2.395 -2.915 1.00 0.00 C ATOM 1012 C LEU A 503 7.612 1.432 -1.901 1.00 0.00 C ATOM 1013 O LEU A 503 7.692 0.231 -2.161 1.00 0.00 O ATOM 1014 CB LEU A 503 8.098 3.119 -3.719 1.00 0.00 C ATOM 1015 CG LEU A 503 7.695 3.722 -5.075 1.00 0.00 C ATOM 1016 CD1 LEU A 503 6.221 3.635 -5.460 1.00 0.00 C ATOM 1017 CD2 LEU A 503 8.281 5.081 -5.448 1.00 0.00 C ATOM 0 H LEU A 503 6.567 4.335 -2.342 1.00 0.00 H new ATOM 0 HA LEU A 503 6.378 1.810 -3.593 1.00 0.00 H new ATOM 0 HB2 LEU A 503 8.498 3.921 -3.098 1.00 0.00 H new ATOM 0 HB3 LEU A 503 8.911 2.413 -3.891 1.00 0.00 H new ATOM 0 HG LEU A 503 8.218 3.001 -5.704 1.00 0.00 H new ATOM 0 HD11 LEU A 503 6.072 4.096 -6.436 1.00 0.00 H new ATOM 0 HD12 LEU A 503 5.917 2.589 -5.502 1.00 0.00 H new ATOM 0 HD13 LEU A 503 5.619 4.158 -4.716 1.00 0.00 H new ATOM 0 HD21 LEU A 503 7.910 5.381 -6.428 1.00 0.00 H new ATOM 0 HD22 LEU A 503 7.984 5.822 -4.706 1.00 0.00 H new ATOM 0 HD23 LEU A 503 9.368 5.013 -5.477 1.00 0.00 H new ATOM 1029 N LYS A 504 7.977 1.958 -0.721 1.00 0.00 N ATOM 1030 CA LYS A 504 8.343 1.163 0.451 1.00 0.00 C ATOM 1031 C LYS A 504 7.196 0.222 0.814 1.00 0.00 C ATOM 1032 O LYS A 504 7.335 -0.995 0.752 1.00 0.00 O ATOM 1033 CB LYS A 504 8.707 2.086 1.632 1.00 0.00 C ATOM 1034 CG LYS A 504 9.051 1.388 2.961 1.00 0.00 C ATOM 1035 CD LYS A 504 8.491 2.155 4.175 1.00 0.00 C ATOM 1036 CE LYS A 504 7.007 1.826 4.439 1.00 0.00 C ATOM 1037 NZ LYS A 504 6.858 0.642 5.331 1.00 0.00 N ATOM 0 H LYS A 504 8.025 2.964 -0.557 1.00 0.00 H new ATOM 0 HA LYS A 504 9.221 0.560 0.219 1.00 0.00 H new ATOM 0 HB2 LYS A 504 9.558 2.700 1.337 1.00 0.00 H new ATOM 0 HB3 LYS A 504 7.871 2.763 1.807 1.00 0.00 H new ATOM 0 HG2 LYS A 504 8.648 0.375 2.954 1.00 0.00 H new ATOM 0 HG3 LYS A 504 10.133 1.300 3.055 1.00 0.00 H new ATOM 0 HD2 LYS A 504 9.079 1.910 5.060 1.00 0.00 H new ATOM 0 HD3 LYS A 504 8.599 3.227 4.007 1.00 0.00 H new ATOM 0 HE2 LYS A 504 6.518 2.688 4.893 1.00 0.00 H new ATOM 0 HE3 LYS A 504 6.502 1.635 3.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 504 5.848 0.450 5.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 504 7.303 -0.186 4.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 504 7.319 0.835 6.243 1.00 0.00 H new ATOM 1051 N ALA A 505 6.056 0.808 1.178 1.00 0.00 N ATOM 1052 CA ALA A 505 4.853 0.131 1.648 1.00 0.00 C ATOM 1053 C ALA A 505 4.453 -1.003 0.685 1.00 0.00 C ATOM 1054 O ALA A 505 4.308 -2.173 1.066 1.00 0.00 O ATOM 1055 CB ALA A 505 3.794 1.225 1.812 1.00 0.00 C ATOM 0 H ALA A 505 5.943 1.821 1.151 1.00 0.00 H new ATOM 0 HA ALA A 505 4.997 -0.372 2.604 1.00 0.00 H new ATOM 0 HB1 ALA A 505 2.863 0.780 2.164 1.00 0.00 H new ATOM 0 HB2 ALA A 505 4.141 1.962 2.537 1.00 0.00 H new ATOM 0 HB3 ALA A 505 3.623 1.713 0.852 1.00 0.00 H new ATOM 1061 N PHE A 506 4.402 -0.633 -0.595 1.00 0.00 N ATOM 1062 CA PHE A 506 4.155 -1.494 -1.728 1.00 0.00 C ATOM 1063 C PHE A 506 5.149 -2.620 -1.765 1.00 0.00 C ATOM 1064 O PHE A 506 4.733 -3.748 -1.571 1.00 0.00 O ATOM 1065 CB PHE A 506 4.162 -0.736 -3.056 1.00 0.00 C ATOM 1066 CG PHE A 506 2.997 0.195 -3.289 1.00 0.00 C ATOM 1067 CD1 PHE A 506 1.904 0.251 -2.402 1.00 0.00 C ATOM 1068 CD2 PHE A 506 2.991 0.975 -4.453 1.00 0.00 C ATOM 1069 CE1 PHE A 506 0.840 1.129 -2.641 1.00 0.00 C ATOM 1070 CE2 PHE A 506 1.899 1.809 -4.725 1.00 0.00 C ATOM 1071 CZ PHE A 506 0.838 1.906 -3.807 1.00 0.00 C ATOM 0 H PHE A 506 4.542 0.338 -0.874 1.00 0.00 H new ATOM 0 HA PHE A 506 3.153 -1.904 -1.598 1.00 0.00 H new ATOM 0 HB2 PHE A 506 5.083 -0.156 -3.117 1.00 0.00 H new ATOM 0 HB3 PHE A 506 4.189 -1.463 -3.867 1.00 0.00 H new ATOM 0 HD1 PHE A 506 1.887 -0.388 -1.531 1.00 0.00 H new ATOM 0 HD2 PHE A 506 3.825 0.933 -5.138 1.00 0.00 H new ATOM 0 HE1 PHE A 506 0.028 1.207 -1.933 1.00 0.00 H new ATOM 0 HE2 PHE A 506 1.872 2.379 -5.642 1.00 0.00 H new ATOM 0 HZ PHE A 506 0.019 2.582 -4.002 1.00 0.00 H new ATOM 1081 N GLY A 507 6.439 -2.385 -2.004 1.00 0.00 N ATOM 1082 CA GLY A 507 7.285 -3.531 -2.239 1.00 0.00 C ATOM 1083 C GLY A 507 7.590 -4.417 -1.037 1.00 0.00 C ATOM 1084 O GLY A 507 8.085 -5.521 -1.246 1.00 0.00 O ATOM 0 H GLY A 507 6.890 -1.471 -2.037 1.00 0.00 H new ATOM 0 HA2 GLY A 507 6.816 -4.148 -3.006 1.00 0.00 H new ATOM 0 HA3 GLY A 507 8.231 -3.177 -2.649 1.00 0.00 H new ATOM 1088 N ILE A 508 7.248 -4.003 0.193 1.00 0.00 N ATOM 1089 CA ILE A 508 7.193 -4.952 1.308 1.00 0.00 C ATOM 1090 C ILE A 508 6.024 -5.888 1.001 1.00 0.00 C ATOM 1091 O ILE A 508 6.241 -7.084 0.896 1.00 0.00 O ATOM 1092 CB ILE A 508 7.035 -4.303 2.703 1.00 0.00 C ATOM 1093 CG1 ILE A 508 8.375 -3.847 3.324 1.00 0.00 C ATOM 1094 CG2 ILE A 508 6.458 -5.314 3.723 1.00 0.00 C ATOM 1095 CD1 ILE A 508 9.022 -2.611 2.698 1.00 0.00 C ATOM 0 H ILE A 508 7.011 -3.041 0.435 1.00 0.00 H new ATOM 0 HA ILE A 508 8.147 -5.475 1.377 1.00 0.00 H new ATOM 0 HB ILE A 508 6.380 -3.449 2.529 1.00 0.00 H new ATOM 0 HG12 ILE A 508 8.212 -3.649 4.383 1.00 0.00 H new ATOM 0 HG13 ILE A 508 9.082 -4.674 3.259 1.00 0.00 H new ATOM 0 HG21 ILE A 508 6.357 -4.832 4.696 1.00 0.00 H new ATOM 0 HG22 ILE A 508 5.480 -5.655 3.384 1.00 0.00 H new ATOM 0 HG23 ILE A 508 7.130 -6.168 3.809 1.00 0.00 H new ATOM 0 HD11 ILE A 508 9.955 -2.387 3.216 1.00 0.00 H new ATOM 0 HD12 ILE A 508 9.228 -2.802 1.645 1.00 0.00 H new ATOM 0 HD13 ILE A 508 8.345 -1.761 2.787 1.00 0.00 H new ATOM 1107 N VAL A 509 4.797 -5.393 0.791 1.00 0.00 N ATOM 1108 CA VAL A 509 3.650 -6.281 0.555 1.00 0.00 C ATOM 1109 C VAL A 509 3.800 -7.027 -0.773 1.00 0.00 C ATOM 1110 O VAL A 509 3.393 -8.176 -0.866 1.00 0.00 O ATOM 1111 CB VAL A 509 2.319 -5.532 0.700 1.00 0.00 C ATOM 1112 CG1 VAL A 509 2.091 -4.495 -0.367 1.00 0.00 C ATOM 1113 CG2 VAL A 509 1.101 -6.448 0.710 1.00 0.00 C ATOM 0 H VAL A 509 4.574 -4.398 0.779 1.00 0.00 H new ATOM 0 HA VAL A 509 3.636 -7.047 1.330 1.00 0.00 H new ATOM 0 HB VAL A 509 2.420 -5.045 1.670 1.00 0.00 H new ATOM 0 HG11 VAL A 509 1.131 -4.006 -0.200 1.00 0.00 H new ATOM 0 HG12 VAL A 509 2.888 -3.752 -0.329 1.00 0.00 H new ATOM 0 HG13 VAL A 509 2.089 -4.974 -1.346 1.00 0.00 H new ATOM 0 HG21 VAL A 509 0.196 -5.849 0.815 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.059 -7.008 -0.224 1.00 0.00 H new ATOM 0 HG23 VAL A 509 1.175 -7.143 1.546 1.00 0.00 H new ATOM 1123 N ILE A 510 4.476 -6.455 -1.775 1.00 0.00 N ATOM 1124 CA ILE A 510 4.891 -7.159 -2.997 1.00 0.00 C ATOM 1125 C ILE A 510 5.750 -8.382 -2.693 1.00 0.00 C ATOM 1126 O ILE A 510 5.490 -9.452 -3.232 1.00 0.00 O ATOM 1127 CB ILE A 510 5.512 -6.249 -4.048 1.00 0.00 C ATOM 1128 CG1 ILE A 510 4.392 -5.295 -4.533 1.00 0.00 C ATOM 1129 CG2 ILE A 510 6.124 -7.025 -5.233 1.00 0.00 C ATOM 1130 CD1 ILE A 510 4.813 -4.310 -5.616 1.00 0.00 C ATOM 0 H ILE A 510 4.756 -5.474 -1.761 1.00 0.00 H new ATOM 0 HA ILE A 510 3.971 -7.526 -3.452 1.00 0.00 H new ATOM 0 HB ILE A 510 6.343 -5.700 -3.606 1.00 0.00 H new ATOM 0 HG12 ILE A 510 3.563 -5.894 -4.909 1.00 0.00 H new ATOM 0 HG13 ILE A 510 4.017 -4.733 -3.677 1.00 0.00 H new ATOM 0 HG21 ILE A 510 6.550 -6.321 -5.948 1.00 0.00 H new ATOM 0 HG22 ILE A 510 6.907 -7.690 -4.867 1.00 0.00 H new ATOM 0 HG23 ILE A 510 5.348 -7.613 -5.722 1.00 0.00 H new ATOM 0 HD11 ILE A 510 3.963 -3.686 -5.890 1.00 0.00 H new ATOM 0 HD12 ILE A 510 5.620 -3.680 -5.241 1.00 0.00 H new ATOM 0 HD13 ILE A 510 5.158 -4.858 -6.492 1.00 0.00 H new ATOM 1142 N ASP A 511 6.688 -8.287 -1.753 1.00 0.00 N ATOM 1143 CA ASP A 511 7.619 -9.355 -1.332 1.00 0.00 C ATOM 1144 C ASP A 511 7.025 -10.463 -0.509 1.00 0.00 C ATOM 1145 O ASP A 511 7.689 -11.295 0.108 1.00 0.00 O ATOM 1146 CB ASP A 511 8.737 -8.711 -0.536 1.00 0.00 C ATOM 1147 CG ASP A 511 10.035 -9.527 -0.403 1.00 0.00 C ATOM 1148 OD1 ASP A 511 10.472 -10.141 -1.406 1.00 0.00 O ATOM 1149 OD2 ASP A 511 10.651 -9.518 0.689 1.00 0.00 O ATOM 0 H ASP A 511 6.834 -7.422 -1.232 1.00 0.00 H new ATOM 0 HA ASP A 511 7.955 -9.834 -2.252 1.00 0.00 H new ATOM 0 HB2 ASP A 511 8.980 -7.754 -0.999 1.00 0.00 H new ATOM 0 HB3 ASP A 511 8.364 -8.495 0.465 1.00 0.00 H new ATOM 1154 N TYR A 512 5.722 -10.427 -0.556 1.00 0.00 N ATOM 1155 CA TYR A 512 4.824 -11.098 0.300 1.00 0.00 C ATOM 1156 C TYR A 512 3.570 -11.489 -0.486 1.00 0.00 C ATOM 1157 O TYR A 512 2.900 -12.443 -0.140 1.00 0.00 O ATOM 1158 CB TYR A 512 4.484 -10.089 1.387 1.00 0.00 C ATOM 1159 CG TYR A 512 5.116 -10.079 2.761 1.00 0.00 C ATOM 1160 CD1 TYR A 512 6.327 -9.386 2.929 1.00 0.00 C ATOM 1161 CD2 TYR A 512 4.433 -10.558 3.889 1.00 0.00 C ATOM 1162 CE1 TYR A 512 6.891 -9.199 4.201 1.00 0.00 C ATOM 1163 CE2 TYR A 512 5.022 -10.446 5.168 1.00 0.00 C ATOM 1164 CZ TYR A 512 6.257 -9.772 5.325 1.00 0.00 C ATOM 1165 OH TYR A 512 6.817 -9.639 6.559 1.00 0.00 O ATOM 0 H TYR A 512 5.234 -9.875 -1.261 1.00 0.00 H new ATOM 0 HA TYR A 512 5.244 -12.012 0.720 1.00 0.00 H new ATOM 0 HB2 TYR A 512 4.673 -9.105 0.958 1.00 0.00 H new ATOM 0 HB3 TYR A 512 3.409 -10.166 1.547 1.00 0.00 H new ATOM 0 HD1 TYR A 512 6.834 -8.989 2.062 1.00 0.00 H new ATOM 0 HD2 TYR A 512 3.459 -11.011 3.780 1.00 0.00 H new ATOM 0 HE1 TYR A 512 7.798 -8.624 4.318 1.00 0.00 H new ATOM 0 HE2 TYR A 512 4.529 -10.875 6.028 1.00 0.00 H new ATOM 0 HH TYR A 512 6.255 -10.090 7.223 1.00 0.00 H new ATOM 1175 N LYS A 513 3.244 -10.811 -1.587 1.00 0.00 N ATOM 1176 CA LYS A 513 2.098 -11.110 -2.441 1.00 0.00 C ATOM 1177 C LYS A 513 2.559 -11.857 -3.673 1.00 0.00 C ATOM 1178 O LYS A 513 2.023 -12.906 -4.016 1.00 0.00 O ATOM 1179 CB LYS A 513 1.444 -9.760 -2.713 1.00 0.00 C ATOM 1180 CG LYS A 513 0.435 -9.692 -3.850 1.00 0.00 C ATOM 1181 CD LYS A 513 1.108 -9.591 -5.221 1.00 0.00 C ATOM 1182 CE LYS A 513 0.119 -9.187 -6.313 1.00 0.00 C ATOM 1183 NZ LYS A 513 -0.795 -10.296 -6.697 1.00 0.00 N ATOM 0 H LYS A 513 3.788 -10.014 -1.918 1.00 0.00 H new ATOM 0 HA LYS A 513 1.363 -11.774 -1.987 1.00 0.00 H new ATOM 0 HB2 LYS A 513 0.946 -9.436 -1.799 1.00 0.00 H new ATOM 0 HB3 LYS A 513 2.234 -9.037 -2.919 1.00 0.00 H new ATOM 0 HG2 LYS A 513 -0.199 -10.579 -3.824 1.00 0.00 H new ATOM 0 HG3 LYS A 513 -0.216 -8.830 -3.703 1.00 0.00 H new ATOM 0 HD2 LYS A 513 1.917 -8.861 -5.176 1.00 0.00 H new ATOM 0 HD3 LYS A 513 1.558 -10.550 -5.476 1.00 0.00 H new ATOM 0 HE2 LYS A 513 -0.471 -8.338 -5.967 1.00 0.00 H new ATOM 0 HE3 LYS A 513 0.671 -8.855 -7.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 -1.445 -9.969 -7.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 -0.237 -11.098 -7.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 -1.343 -10.597 -5.866 1.00 0.00 H new ATOM 1197 N GLU A 514 3.615 -11.339 -4.302 1.00 0.00 N ATOM 1198 CA GLU A 514 4.363 -12.030 -5.348 1.00 0.00 C ATOM 1199 C GLU A 514 5.023 -13.306 -4.779 1.00 0.00 C ATOM 1200 O GLU A 514 5.390 -14.214 -5.526 1.00 0.00 O ATOM 1201 CB GLU A 514 5.383 -11.014 -5.889 1.00 0.00 C ATOM 1202 CG GLU A 514 5.748 -11.209 -7.365 1.00 0.00 C ATOM 1203 CD GLU A 514 6.741 -12.358 -7.631 1.00 0.00 C ATOM 1204 OE1 GLU A 514 7.711 -12.528 -6.853 1.00 0.00 O ATOM 1205 OE2 GLU A 514 6.582 -13.071 -8.654 1.00 0.00 O ATOM 0 H GLU A 514 3.980 -10.410 -4.093 1.00 0.00 H new ATOM 0 HA GLU A 514 3.722 -12.372 -6.161 1.00 0.00 H new ATOM 0 HB2 GLU A 514 4.982 -10.009 -5.756 1.00 0.00 H new ATOM 0 HB3 GLU A 514 6.292 -11.076 -5.291 1.00 0.00 H new ATOM 0 HG2 GLU A 514 4.835 -11.396 -7.930 1.00 0.00 H new ATOM 0 HG3 GLU A 514 6.175 -10.281 -7.746 1.00 0.00 H new ATOM 1212 N ARG A 515 5.109 -13.395 -3.437 1.00 0.00 N ATOM 1213 CA ARG A 515 5.692 -14.535 -2.689 1.00 0.00 C ATOM 1214 C ARG A 515 4.651 -15.445 -2.059 1.00 0.00 C ATOM 1215 O ARG A 515 4.835 -16.661 -2.059 1.00 0.00 O ATOM 1216 CB ARG A 515 6.671 -14.067 -1.610 1.00 0.00 C ATOM 1217 CG ARG A 515 8.052 -13.685 -2.155 1.00 0.00 C ATOM 1218 CD ARG A 515 7.984 -12.568 -3.197 1.00 0.00 C ATOM 1219 NE ARG A 515 9.256 -11.838 -3.241 1.00 0.00 N ATOM 1220 CZ ARG A 515 10.148 -11.688 -4.199 1.00 0.00 C ATOM 1221 NH1 ARG A 515 10.001 -12.122 -5.416 1.00 0.00 N ATOM 1222 NH2 ARG A 515 11.244 -11.056 -3.908 1.00 0.00 N ATOM 0 H ARG A 515 4.766 -12.657 -2.823 1.00 0.00 H new ATOM 0 HA ARG A 515 6.227 -15.116 -3.440 1.00 0.00 H new ATOM 0 HB2 ARG A 515 6.244 -13.208 -1.092 1.00 0.00 H new ATOM 0 HB3 ARG A 515 6.788 -14.859 -0.870 1.00 0.00 H new ATOM 0 HG2 ARG A 515 8.690 -13.369 -1.329 1.00 0.00 H new ATOM 0 HG3 ARG A 515 8.519 -14.564 -2.600 1.00 0.00 H new ATOM 0 HD2 ARG A 515 7.764 -12.989 -4.178 1.00 0.00 H new ATOM 0 HD3 ARG A 515 7.171 -11.883 -2.954 1.00 0.00 H new ATOM 0 HE ARG A 515 9.493 -11.360 -2.372 1.00 0.00 H new ATOM 0 HH11 ARG A 515 9.149 -12.617 -5.682 1.00 0.00 H new ATOM 0 HH12 ARG A 515 10.737 -11.968 -6.105 1.00 0.00 H new ATOM 0 HH21 ARG A 515 11.390 -10.696 -2.965 1.00 0.00 H new ATOM 0 HH22 ARG A 515 11.959 -10.919 -4.622 1.00 0.00 H new ATOM 1236 N ASP A 516 3.582 -14.848 -1.533 1.00 0.00 N ATOM 1237 CA ASP A 516 2.343 -15.486 -1.056 1.00 0.00 C ATOM 1238 C ASP A 516 2.392 -15.819 0.451 1.00 0.00 C ATOM 1239 O ASP A 516 2.156 -16.931 0.929 1.00 0.00 O ATOM 1240 CB ASP A 516 1.876 -16.627 -1.972 1.00 0.00 C ATOM 1241 CG ASP A 516 0.399 -17.009 -1.770 1.00 0.00 C ATOM 1242 OD1 ASP A 516 -0.369 -16.212 -1.179 1.00 0.00 O ATOM 1243 OD2 ASP A 516 0.000 -18.106 -2.230 1.00 0.00 O ATOM 0 H ASP A 516 3.551 -13.835 -1.418 1.00 0.00 H new ATOM 0 HA ASP A 516 1.544 -14.748 -1.134 1.00 0.00 H new ATOM 0 HB2 ASP A 516 2.029 -16.334 -3.011 1.00 0.00 H new ATOM 0 HB3 ASP A 516 2.498 -17.504 -1.793 1.00 0.00 H new ATOM 1248 N LEU A 517 2.740 -14.764 1.177 1.00 0.00 N ATOM 1249 CA LEU A 517 2.964 -14.526 2.601 1.00 0.00 C ATOM 1250 C LEU A 517 1.756 -13.825 3.256 1.00 0.00 C ATOM 1251 O LEU A 517 1.549 -13.947 4.465 1.00 0.00 O ATOM 1252 CB LEU A 517 4.213 -13.614 2.647 1.00 0.00 C ATOM 1253 CG LEU A 517 5.507 -14.231 2.069 1.00 0.00 C ATOM 1254 CD1 LEU A 517 6.744 -13.484 2.567 1.00 0.00 C ATOM 1255 CD2 LEU A 517 5.725 -15.709 2.393 1.00 0.00 C ATOM 0 H LEU A 517 2.902 -13.889 0.679 1.00 0.00 H new ATOM 0 HA LEU A 517 3.100 -15.457 3.151 1.00 0.00 H new ATOM 0 HB2 LEU A 517 3.993 -12.697 2.101 1.00 0.00 H new ATOM 0 HB3 LEU A 517 4.397 -13.331 3.683 1.00 0.00 H new ATOM 0 HG LEU A 517 5.371 -14.138 0.992 1.00 0.00 H new ATOM 0 HD11 LEU A 517 7.639 -13.940 2.144 1.00 0.00 H new ATOM 0 HD12 LEU A 517 6.688 -12.440 2.258 1.00 0.00 H new ATOM 0 HD13 LEU A 517 6.788 -13.538 3.655 1.00 0.00 H new ATOM 0 HD21 LEU A 517 6.659 -16.046 1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 517 5.775 -15.841 3.474 1.00 0.00 H new ATOM 0 HD23 LEU A 517 4.897 -16.295 1.994 1.00 0.00 H new ATOM 1267 N ILE A 518 0.944 -13.116 2.460 1.00 0.00 N ATOM 1268 CA ILE A 518 -0.339 -12.516 2.870 1.00 0.00 C ATOM 1269 C ILE A 518 -1.367 -13.594 3.262 1.00 0.00 C ATOM 1270 O ILE A 518 -1.371 -14.708 2.729 1.00 0.00 O ATOM 1271 CB ILE A 518 -0.957 -11.686 1.716 1.00 0.00 C ATOM 1272 CG1 ILE A 518 -0.009 -10.864 0.841 1.00 0.00 C ATOM 1273 CG2 ILE A 518 -2.038 -10.724 2.220 1.00 0.00 C ATOM 1274 CD1 ILE A 518 0.866 -9.869 1.598 1.00 0.00 C ATOM 0 H ILE A 518 1.167 -12.937 1.481 1.00 0.00 H new ATOM 0 HA ILE A 518 -0.120 -11.879 3.727 1.00 0.00 H new ATOM 0 HB ILE A 518 -1.352 -12.481 1.083 1.00 0.00 H new ATOM 0 HG12 ILE A 518 0.637 -11.547 0.290 1.00 0.00 H new ATOM 0 HG13 ILE A 518 -0.599 -10.319 0.104 1.00 0.00 H new ATOM 0 HG21 ILE A 518 -2.445 -10.162 1.380 1.00 0.00 H new ATOM 0 HG22 ILE A 518 -2.836 -11.292 2.698 1.00 0.00 H new ATOM 0 HG23 ILE A 518 -1.602 -10.033 2.942 1.00 0.00 H new ATOM 0 HD11 ILE A 518 1.503 -9.335 0.893 1.00 0.00 H new ATOM 0 HD12 ILE A 518 0.233 -9.157 2.127 1.00 0.00 H new ATOM 0 HD13 ILE A 518 1.488 -10.404 2.315 1.00 0.00 H new ATOM 1286 N ASP A 519 -2.300 -13.248 4.147 1.00 0.00 N ATOM 1287 CA ASP A 519 -3.495 -14.041 4.436 1.00 0.00 C ATOM 1288 C ASP A 519 -4.402 -14.144 3.192 1.00 0.00 C ATOM 1289 O ASP A 519 -4.621 -13.187 2.450 1.00 0.00 O ATOM 1290 CB ASP A 519 -4.260 -13.403 5.602 1.00 0.00 C ATOM 1291 CG ASP A 519 -3.389 -13.228 6.857 1.00 0.00 C ATOM 1292 OD1 ASP A 519 -3.327 -14.167 7.685 1.00 0.00 O ATOM 1293 OD2 ASP A 519 -2.767 -12.148 7.010 1.00 0.00 O ATOM 0 H ASP A 519 -2.246 -12.390 4.696 1.00 0.00 H new ATOM 0 HA ASP A 519 -3.189 -15.050 4.712 1.00 0.00 H new ATOM 0 HB2 ASP A 519 -4.643 -12.431 5.292 1.00 0.00 H new ATOM 0 HB3 ASP A 519 -5.123 -14.022 5.847 1.00 0.00 H new ATOM 1298 N ARG A 520 -4.967 -15.328 2.969 1.00 0.00 N ATOM 1299 CA ARG A 520 -5.746 -15.746 1.788 1.00 0.00 C ATOM 1300 C ARG A 520 -7.082 -15.006 1.631 1.00 0.00 C ATOM 1301 O ARG A 520 -7.639 -14.955 0.536 1.00 0.00 O ATOM 1302 CB ARG A 520 -5.911 -17.271 1.869 1.00 0.00 C ATOM 1303 CG ARG A 520 -4.731 -18.035 1.237 1.00 0.00 C ATOM 1304 CD ARG A 520 -3.331 -17.540 1.644 1.00 0.00 C ATOM 1305 NE ARG A 520 -2.270 -18.471 1.219 1.00 0.00 N ATOM 1306 CZ ARG A 520 -0.966 -18.287 1.346 1.00 0.00 C ATOM 1307 NH1 ARG A 520 -0.452 -17.237 1.913 1.00 0.00 N ATOM 1308 NH2 ARG A 520 -0.119 -19.174 0.910 1.00 0.00 N ATOM 0 H ARG A 520 -4.892 -16.080 3.653 1.00 0.00 H new ATOM 0 HA ARG A 520 -5.204 -15.472 0.883 1.00 0.00 H new ATOM 0 HB2 ARG A 520 -6.011 -17.566 2.914 1.00 0.00 H new ATOM 0 HB3 ARG A 520 -6.835 -17.559 1.367 1.00 0.00 H new ATOM 0 HG2 ARG A 520 -4.817 -19.088 1.504 1.00 0.00 H new ATOM 0 HG3 ARG A 520 -4.819 -17.973 0.152 1.00 0.00 H new ATOM 0 HD2 ARG A 520 -3.151 -16.560 1.203 1.00 0.00 H new ATOM 0 HD3 ARG A 520 -3.291 -17.415 2.726 1.00 0.00 H new ATOM 0 HE ARG A 520 -2.571 -19.343 0.784 1.00 0.00 H new ATOM 0 HH11 ARG A 520 -1.061 -16.508 2.285 1.00 0.00 H new ATOM 0 HH12 ARG A 520 0.561 -17.141 1.987 1.00 0.00 H new ATOM 0 HH21 ARG A 520 -0.458 -20.026 0.463 1.00 0.00 H new ATOM 0 HH22 ARG A 520 0.883 -19.017 1.016 1.00 0.00 H new ATOM 1322 N SER A 521 -7.537 -14.359 2.700 1.00 0.00 N ATOM 1323 CA SER A 521 -8.705 -13.461 2.760 1.00 0.00 C ATOM 1324 C SER A 521 -8.393 -11.994 2.409 1.00 0.00 C ATOM 1325 O SER A 521 -9.304 -11.164 2.383 1.00 0.00 O ATOM 1326 CB SER A 521 -9.321 -13.511 4.167 1.00 0.00 C ATOM 1327 OG SER A 521 -9.668 -14.843 4.514 1.00 0.00 O ATOM 0 H SER A 521 -7.078 -14.447 3.607 1.00 0.00 H new ATOM 0 HA SER A 521 -9.400 -13.825 2.003 1.00 0.00 H new ATOM 0 HB2 SER A 521 -8.613 -13.113 4.894 1.00 0.00 H new ATOM 0 HB3 SER A 521 -10.207 -12.877 4.205 1.00 0.00 H new ATOM 0 HG SER A 521 -10.057 -14.856 5.413 1.00 0.00 H new ATOM 1333 N ALA A 522 -7.127 -11.641 2.145 1.00 0.00 N ATOM 1334 CA ALA A 522 -6.703 -10.297 1.737 1.00 0.00 C ATOM 1335 C ALA A 522 -6.867 -10.144 0.233 1.00 0.00 C ATOM 1336 O ALA A 522 -7.203 -9.080 -0.275 1.00 0.00 O ATOM 1337 CB ALA A 522 -5.226 -10.099 2.056 1.00 0.00 C ATOM 0 H ALA A 522 -6.351 -12.300 2.211 1.00 0.00 H new ATOM 0 HA ALA A 522 -7.312 -9.568 2.271 1.00 0.00 H new ATOM 0 HB1 ALA A 522 -4.919 -9.099 1.750 1.00 0.00 H new ATOM 0 HB2 ALA A 522 -5.066 -10.216 3.128 1.00 0.00 H new ATOM 0 HB3 ALA A 522 -4.635 -10.840 1.518 1.00 0.00 H new ATOM 1343 N TYR A 523 -6.632 -11.241 -0.469 1.00 0.00 N ATOM 1344 CA TYR A 523 -6.880 -11.382 -1.888 1.00 0.00 C ATOM 1345 C TYR A 523 -8.376 -11.232 -2.272 1.00 0.00 C ATOM 1346 O TYR A 523 -9.244 -11.088 -1.373 1.00 0.00 O ATOM 1347 CB TYR A 523 -6.317 -12.765 -2.219 1.00 0.00 C ATOM 1348 CG TYR A 523 -4.813 -12.923 -2.046 1.00 0.00 C ATOM 1349 CD1 TYR A 523 -3.927 -12.536 -3.070 1.00 0.00 C ATOM 1350 CD2 TYR A 523 -4.300 -13.493 -0.866 1.00 0.00 C ATOM 1351 CE1 TYR A 523 -2.540 -12.736 -2.918 1.00 0.00 C ATOM 1352 CE2 TYR A 523 -2.925 -13.734 -0.724 1.00 0.00 C ATOM 1353 CZ TYR A 523 -2.038 -13.351 -1.751 1.00 0.00 C ATOM 1354 OH TYR A 523 -0.710 -13.593 -1.631 1.00 0.00 O ATOM 1355 OXT TYR A 523 -8.674 -11.233 -3.488 1.00 0.00 O ATOM 0 H TYR A 523 -6.249 -12.087 -0.047 1.00 0.00 H new ATOM 0 HA TYR A 523 -6.405 -10.588 -2.465 1.00 0.00 H new ATOM 0 HB2 TYR A 523 -6.816 -13.501 -1.589 1.00 0.00 H new ATOM 0 HB3 TYR A 523 -6.573 -13.004 -3.251 1.00 0.00 H new ATOM 0 HD1 TYR A 523 -4.311 -12.085 -3.973 1.00 0.00 H new ATOM 0 HD2 TYR A 523 -4.973 -13.748 -0.060 1.00 0.00 H new ATOM 0 HE1 TYR A 523 -1.861 -12.418 -3.695 1.00 0.00 H new ATOM 0 HE2 TYR A 523 -2.548 -14.211 0.168 1.00 0.00 H new ATOM 0 HH TYR A 523 -0.574 -14.472 -1.219 1.00 0.00 H new TER 1365 TYR A 523