USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 703 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 482 TYR OH : rot 180:sc= -0.2 USER MOD Set 1.2: A 513 LYS NZ :NH3+ -156:sc=4.74e-05 (180deg=0) USER MOD Set 2.1: A 475 THR OG1 : rot 119:sc= 0.414 USER MOD Set 2.2: A 491 LYS NZ :NH3+ -165:sc= 0.427 (180deg=0) USER MOD Set 3.1: A 467 LYS NZ :NH3+ 175:sc= 0.197 (180deg=0) USER MOD Set 3.2: A 468 TYR OH : rot 180:sc= 0.187 USER MOD Set 4.1: A 461 LYS NZ :NH3+ -123:sc= 0.424 (180deg=0) USER MOD Set 4.2: A 466 HIS : no HD1:sc=-0.00277 K(o=0.42,f=-1) USER MOD Set 5.1: A 455 ASN : amide:sc= -0.161 K(o=-1.3,f=-1.8) USER MOD Set 5.2: A 458 MET CE :methyl -173:sc= -1.17 (180deg=-1.52) USER MOD Set 6.1: A 446 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 462 SER OG : rot 180:sc= 0 USER MOD Set 7.1: A 445 LYS NZ :NH3+ -177:sc= 3.06 (180deg=2.24) USER MOD Set 7.2: A 448 THR OG1 : rot 170:sc= 0.633 USER MOD Single : A 443 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 451 LYS NZ :NH3+ -136:sc= 1.25 (180deg=0.0254) USER MOD Single : A 454 LYS NZ :NH3+ 151:sc= 1.18 (180deg=0.783) USER MOD Single : A 469 SER OG : rot 180:sc= 0.00548 USER MOD Single : A 473 SER OG : rot 180:sc= 0 USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 LYS NZ :NH3+ 174:sc= 1.04 (180deg=1.02) USER MOD Single : A 501 LYS NZ :NH3+ -114:sc= 1.2 (180deg=-0.067) 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 8.809 -7.599 11.766 1.00 0.00 N ATOM 2 CA MET A 443 8.201 -7.310 10.439 1.00 0.00 C ATOM 3 C MET A 443 6.901 -6.510 10.592 1.00 0.00 C ATOM 4 O MET A 443 6.200 -6.700 11.589 1.00 0.00 O ATOM 5 CB MET A 443 7.993 -8.590 9.594 1.00 0.00 C ATOM 6 CG MET A 443 6.876 -9.549 10.047 1.00 0.00 C ATOM 7 SD MET A 443 7.120 -10.362 11.653 1.00 0.00 S ATOM 8 CE MET A 443 5.673 -11.457 11.674 1.00 0.00 C ATOM 0 HA MET A 443 8.910 -6.692 9.888 1.00 0.00 H new ATOM 0 HB2 MET A 443 7.786 -8.289 8.567 1.00 0.00 H new ATOM 0 HB3 MET A 443 8.932 -9.144 9.581 1.00 0.00 H new ATOM 0 HG2 MET A 443 5.940 -8.992 10.084 1.00 0.00 H new ATOM 0 HG3 MET A 443 6.758 -10.321 9.287 1.00 0.00 H new ATOM 0 HE1 MET A 443 5.667 -12.034 12.598 1.00 0.00 H new ATOM 0 HE2 MET A 443 4.763 -10.859 11.614 1.00 0.00 H new ATOM 0 HE3 MET A 443 5.718 -12.136 10.822 1.00 0.00 H new ATOM 18 N PRO A 444 6.548 -5.616 9.644 1.00 0.00 N ATOM 19 CA PRO A 444 5.336 -4.789 9.711 1.00 0.00 C ATOM 20 C PRO A 444 4.065 -5.598 9.378 1.00 0.00 C ATOM 21 O PRO A 444 3.460 -5.433 8.314 1.00 0.00 O ATOM 22 CB PRO A 444 5.603 -3.634 8.736 1.00 0.00 C ATOM 23 CG PRO A 444 6.454 -4.293 7.651 1.00 0.00 C ATOM 24 CD PRO A 444 7.322 -5.264 8.455 1.00 0.00 C ATOM 0 HA PRO A 444 5.140 -4.414 10.715 1.00 0.00 H new ATOM 0 HB2 PRO A 444 4.677 -3.225 8.331 1.00 0.00 H new ATOM 0 HB3 PRO A 444 6.130 -2.811 9.219 1.00 0.00 H new ATOM 0 HG2 PRO A 444 5.841 -4.812 6.914 1.00 0.00 H new ATOM 0 HG3 PRO A 444 7.056 -3.564 7.109 1.00 0.00 H new ATOM 0 HD2 PRO A 444 7.559 -6.151 7.868 1.00 0.00 H new ATOM 0 HD3 PRO A 444 8.270 -4.802 8.731 1.00 0.00 H new ATOM 32 N LYS A 445 3.642 -6.490 10.287 1.00 0.00 N ATOM 33 CA LYS A 445 2.432 -7.327 10.161 1.00 0.00 C ATOM 34 C LYS A 445 1.149 -6.513 10.421 1.00 0.00 C ATOM 35 O LYS A 445 0.462 -6.645 11.437 1.00 0.00 O ATOM 36 CB LYS A 445 2.573 -8.596 11.027 1.00 0.00 C ATOM 37 CG LYS A 445 1.637 -9.726 10.560 1.00 0.00 C ATOM 38 CD LYS A 445 2.139 -10.434 9.285 1.00 0.00 C ATOM 39 CE LYS A 445 1.022 -11.210 8.576 1.00 0.00 C ATOM 40 NZ LYS A 445 0.129 -10.312 7.807 1.00 0.00 N ATOM 0 H LYS A 445 4.146 -6.656 11.158 1.00 0.00 H new ATOM 0 HA LYS A 445 2.333 -7.671 9.131 1.00 0.00 H new ATOM 0 HB2 LYS A 445 3.605 -8.944 10.993 1.00 0.00 H new ATOM 0 HB3 LYS A 445 2.354 -8.351 12.066 1.00 0.00 H new ATOM 0 HG2 LYS A 445 1.534 -10.459 11.360 1.00 0.00 H new ATOM 0 HG3 LYS A 445 0.645 -9.315 10.374 1.00 0.00 H new ATOM 0 HD2 LYS A 445 2.556 -9.695 8.601 1.00 0.00 H new ATOM 0 HD3 LYS A 445 2.946 -11.119 9.545 1.00 0.00 H new ATOM 0 HE2 LYS A 445 1.462 -11.947 7.904 1.00 0.00 H new ATOM 0 HE3 LYS A 445 0.437 -11.760 9.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -0.642 -10.868 7.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -0.271 -9.593 8.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 0.672 -9.844 7.053 1.00 0.00 H new ATOM 54 N SER A 446 0.897 -5.616 9.475 1.00 0.00 N ATOM 55 CA SER A 446 -0.235 -4.695 9.308 1.00 0.00 C ATOM 56 C SER A 446 -0.319 -4.287 7.831 1.00 0.00 C ATOM 57 O SER A 446 -1.351 -4.402 7.177 1.00 0.00 O ATOM 58 CB SER A 446 -0.044 -3.456 10.197 1.00 0.00 C ATOM 59 OG SER A 446 1.255 -2.901 10.034 1.00 0.00 O ATOM 0 H SER A 446 1.561 -5.498 8.709 1.00 0.00 H new ATOM 0 HA SER A 446 -1.162 -5.186 9.606 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.796 -2.707 9.948 1.00 0.00 H new ATOM 0 HB3 SER A 446 -0.198 -3.727 11.241 1.00 0.00 H new ATOM 0 HG SER A 446 1.349 -2.113 10.610 1.00 0.00 H new ATOM 65 N LEU A 447 0.831 -3.941 7.255 1.00 0.00 N ATOM 66 CA LEU A 447 1.118 -3.661 5.855 1.00 0.00 C ATOM 67 C LEU A 447 0.795 -4.841 4.914 1.00 0.00 C ATOM 68 O LEU A 447 0.833 -4.678 3.698 1.00 0.00 O ATOM 69 CB LEU A 447 2.612 -3.290 5.818 1.00 0.00 C ATOM 70 CG LEU A 447 3.108 -2.512 4.593 1.00 0.00 C ATOM 71 CD1 LEU A 447 2.591 -1.075 4.604 1.00 0.00 C ATOM 72 CD2 LEU A 447 4.634 -2.438 4.654 1.00 0.00 C ATOM 0 H LEU A 447 1.673 -3.840 7.822 1.00 0.00 H new ATOM 0 HA LEU A 447 0.483 -2.855 5.486 1.00 0.00 H new ATOM 0 HB2 LEU A 447 2.836 -2.700 6.707 1.00 0.00 H new ATOM 0 HB3 LEU A 447 3.191 -4.210 5.892 1.00 0.00 H new ATOM 0 HG LEU A 447 2.752 -3.022 3.698 1.00 0.00 H new ATOM 0 HD11 LEU A 447 2.959 -0.549 3.723 1.00 0.00 H new ATOM 0 HD12 LEU A 447 1.501 -1.080 4.594 1.00 0.00 H new ATOM 0 HD13 LEU A 447 2.943 -0.569 5.503 1.00 0.00 H new ATOM 0 HD21 LEU A 447 5.006 -1.888 3.790 1.00 0.00 H new ATOM 0 HD22 LEU A 447 4.937 -1.927 5.568 1.00 0.00 H new ATOM 0 HD23 LEU A 447 5.048 -3.446 4.648 1.00 0.00 H new ATOM 84 N THR A 448 0.469 -6.015 5.466 1.00 0.00 N ATOM 85 CA THR A 448 0.218 -7.290 4.772 1.00 0.00 C ATOM 86 C THR A 448 -1.003 -8.038 5.348 1.00 0.00 C ATOM 87 O THR A 448 -1.098 -9.260 5.250 1.00 0.00 O ATOM 88 CB THR A 448 1.488 -8.164 4.788 1.00 0.00 C ATOM 89 OG1 THR A 448 1.797 -8.582 6.104 1.00 0.00 O ATOM 90 CG2 THR A 448 2.708 -7.395 4.262 1.00 0.00 C ATOM 0 H THR A 448 0.366 -6.109 6.476 1.00 0.00 H new ATOM 0 HA THR A 448 -0.028 -7.064 3.735 1.00 0.00 H new ATOM 0 HB THR A 448 1.278 -9.021 4.148 1.00 0.00 H new ATOM 0 HG1 THR A 448 2.504 -9.260 6.074 1.00 0.00 H new ATOM 0 HG21 THR A 448 3.585 -8.042 4.288 1.00 0.00 H new ATOM 0 HG22 THR A 448 2.522 -7.076 3.236 1.00 0.00 H new ATOM 0 HG23 THR A 448 2.884 -6.520 4.888 1.00 0.00 H new ATOM 98 N ASP A 449 -1.942 -7.319 5.973 1.00 0.00 N ATOM 99 CA ASP A 449 -3.111 -7.843 6.702 1.00 0.00 C ATOM 100 C ASP A 449 -4.439 -7.482 6.016 1.00 0.00 C ATOM 101 O ASP A 449 -4.691 -6.295 5.816 1.00 0.00 O ATOM 102 CB ASP A 449 -3.096 -7.276 8.119 1.00 0.00 C ATOM 103 CG ASP A 449 -2.128 -8.072 8.995 1.00 0.00 C ATOM 104 OD1 ASP A 449 -0.899 -7.968 8.791 1.00 0.00 O ATOM 105 OD2 ASP A 449 -2.609 -8.878 9.823 1.00 0.00 O ATOM 0 H ASP A 449 -1.908 -6.300 5.987 1.00 0.00 H new ATOM 0 HA ASP A 449 -3.042 -8.931 6.716 1.00 0.00 H new ATOM 0 HB2 ASP A 449 -2.799 -6.227 8.096 1.00 0.00 H new ATOM 0 HB3 ASP A 449 -4.099 -7.314 8.545 1.00 0.00 H new ATOM 110 N PRO A 450 -5.340 -8.446 5.728 1.00 0.00 N ATOM 111 CA PRO A 450 -6.650 -8.223 5.092 1.00 0.00 C ATOM 112 C PRO A 450 -7.428 -7.029 5.666 1.00 0.00 C ATOM 113 O PRO A 450 -7.970 -6.203 4.932 1.00 0.00 O ATOM 114 CB PRO A 450 -7.429 -9.534 5.291 1.00 0.00 C ATOM 115 CG PRO A 450 -6.370 -10.604 5.547 1.00 0.00 C ATOM 116 CD PRO A 450 -5.146 -9.848 6.045 1.00 0.00 C ATOM 0 HA PRO A 450 -6.511 -7.968 4.041 1.00 0.00 H new ATOM 0 HB2 PRO A 450 -8.119 -9.456 6.131 1.00 0.00 H new ATOM 0 HB3 PRO A 450 -8.024 -9.774 4.410 1.00 0.00 H new ATOM 0 HG2 PRO A 450 -6.713 -11.328 6.287 1.00 0.00 H new ATOM 0 HG3 PRO A 450 -6.145 -11.160 4.637 1.00 0.00 H new ATOM 0 HD2 PRO A 450 -5.022 -9.984 7.119 1.00 0.00 H new ATOM 0 HD3 PRO A 450 -4.242 -10.227 5.569 1.00 0.00 H new ATOM 124 N LYS A 451 -7.410 -6.920 6.999 1.00 0.00 N ATOM 125 CA LYS A 451 -8.015 -5.880 7.844 1.00 0.00 C ATOM 126 C LYS A 451 -7.562 -4.457 7.482 1.00 0.00 C ATOM 127 O LYS A 451 -8.354 -3.521 7.556 1.00 0.00 O ATOM 128 CB LYS A 451 -7.658 -6.209 9.306 1.00 0.00 C ATOM 129 CG LYS A 451 -8.212 -7.569 9.792 1.00 0.00 C ATOM 130 CD LYS A 451 -7.203 -8.367 10.636 1.00 0.00 C ATOM 131 CE LYS A 451 -6.046 -8.945 9.820 1.00 0.00 C ATOM 132 NZ LYS A 451 -5.083 -9.662 10.699 1.00 0.00 N ATOM 0 H LYS A 451 -6.929 -7.619 7.566 1.00 0.00 H new ATOM 0 HA LYS A 451 -9.093 -5.886 7.685 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.573 -6.209 9.414 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -8.043 -5.419 9.951 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -9.113 -7.398 10.381 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.505 -8.165 8.927 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -6.800 -7.719 11.414 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -7.725 -9.181 11.138 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -6.434 -9.629 9.065 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -5.533 -8.143 9.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -4.111 -9.407 10.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -5.250 -9.392 11.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -5.214 -10.688 10.593 1.00 0.00 H new ATOM 146 N LEU A 452 -6.299 -4.292 7.086 1.00 0.00 N ATOM 147 CA LEU A 452 -5.705 -3.031 6.627 1.00 0.00 C ATOM 148 C LEU A 452 -5.779 -2.937 5.101 1.00 0.00 C ATOM 149 O LEU A 452 -6.139 -1.898 4.569 1.00 0.00 O ATOM 150 CB LEU A 452 -4.225 -2.933 7.054 1.00 0.00 C ATOM 151 CG LEU A 452 -3.855 -2.821 8.549 1.00 0.00 C ATOM 152 CD1 LEU A 452 -4.093 -1.399 9.037 1.00 0.00 C ATOM 153 CD2 LEU A 452 -4.542 -3.811 9.485 1.00 0.00 C ATOM 0 H LEU A 452 -5.633 -5.064 7.075 1.00 0.00 H new ATOM 0 HA LEU A 452 -6.267 -2.215 7.080 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -3.716 -3.812 6.660 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -3.800 -2.065 6.550 1.00 0.00 H new ATOM 0 HG LEU A 452 -2.799 -3.087 8.592 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -3.830 -1.328 10.092 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -3.476 -0.709 8.462 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -5.144 -1.141 8.907 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -4.206 -3.638 10.507 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -5.622 -3.674 9.430 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -4.290 -4.829 9.187 1.00 0.00 H new ATOM 165 N LEU A 453 -5.482 -4.016 4.372 1.00 0.00 N ATOM 166 CA LEU A 453 -5.316 -4.035 2.915 1.00 0.00 C ATOM 167 C LEU A 453 -6.589 -3.642 2.147 1.00 0.00 C ATOM 168 O LEU A 453 -6.539 -3.277 0.973 1.00 0.00 O ATOM 169 CB LEU A 453 -4.849 -5.448 2.523 1.00 0.00 C ATOM 170 CG LEU A 453 -3.382 -5.762 2.901 1.00 0.00 C ATOM 171 CD1 LEU A 453 -3.051 -7.214 2.575 1.00 0.00 C ATOM 172 CD2 LEU A 453 -2.326 -4.905 2.219 1.00 0.00 C ATOM 0 H LEU A 453 -5.345 -4.934 4.795 1.00 0.00 H new ATOM 0 HA LEU A 453 -4.578 -3.283 2.638 1.00 0.00 H new ATOM 0 HB2 LEU A 453 -5.500 -6.179 3.003 1.00 0.00 H new ATOM 0 HB3 LEU A 453 -4.969 -5.572 1.447 1.00 0.00 H new ATOM 0 HG LEU A 453 -3.338 -5.543 3.968 1.00 0.00 H new ATOM 0 HD11 LEU A 453 -2.016 -7.421 2.846 1.00 0.00 H new ATOM 0 HD12 LEU A 453 -3.712 -7.873 3.138 1.00 0.00 H new ATOM 0 HD13 LEU A 453 -3.188 -7.388 1.508 1.00 0.00 H new ATOM 0 HD21 LEU A 453 -1.336 -5.211 2.557 1.00 0.00 H new ATOM 0 HD22 LEU A 453 -2.396 -5.032 1.139 1.00 0.00 H new ATOM 0 HD23 LEU A 453 -2.488 -3.857 2.472 1.00 0.00 H new ATOM 184 N LYS A 454 -7.729 -3.673 2.837 1.00 0.00 N ATOM 185 CA LYS A 454 -9.068 -3.353 2.338 1.00 0.00 C ATOM 186 C LYS A 454 -9.624 -2.071 2.982 1.00 0.00 C ATOM 187 O LYS A 454 -10.728 -1.629 2.669 1.00 0.00 O ATOM 188 CB LYS A 454 -9.938 -4.589 2.585 1.00 0.00 C ATOM 189 CG LYS A 454 -9.334 -5.756 1.812 1.00 0.00 C ATOM 190 CD LYS A 454 -10.167 -7.008 1.991 1.00 0.00 C ATOM 191 CE LYS A 454 -9.424 -8.021 1.159 1.00 0.00 C ATOM 192 NZ LYS A 454 -10.245 -9.185 0.729 1.00 0.00 N ATOM 0 H LYS A 454 -7.744 -3.939 3.822 1.00 0.00 H new ATOM 0 HA LYS A 454 -9.051 -3.130 1.271 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -9.979 -4.819 3.650 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -10.962 -4.405 2.258 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -9.272 -5.504 0.753 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -8.316 -5.939 2.157 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -10.227 -7.309 3.037 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -11.190 -6.868 1.641 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -9.027 -7.525 0.273 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.570 -8.385 1.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.881 -9.552 -0.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -10.194 -9.931 1.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -11.234 -8.887 0.608 1.00 0.00 H new ATOM 206 N ASN A 455 -8.811 -1.463 3.846 1.00 0.00 N ATOM 207 CA ASN A 455 -8.922 -0.160 4.473 1.00 0.00 C ATOM 208 C ASN A 455 -7.650 0.639 4.176 1.00 0.00 C ATOM 209 O ASN A 455 -6.818 0.896 5.052 1.00 0.00 O ATOM 210 CB ASN A 455 -9.062 -0.272 5.977 1.00 0.00 C ATOM 211 CG ASN A 455 -10.379 -0.775 6.516 1.00 0.00 C ATOM 212 OD1 ASN A 455 -11.452 -0.518 5.992 1.00 0.00 O ATOM 213 ND2 ASN A 455 -10.331 -1.318 7.701 1.00 0.00 N ATOM 0 H ASN A 455 -7.961 -1.934 4.155 1.00 0.00 H new ATOM 0 HA ASN A 455 -9.810 0.331 4.074 1.00 0.00 H new ATOM 0 HB2 ASN A 455 -8.275 -0.933 6.340 1.00 0.00 H new ATOM 0 HB3 ASN A 455 -8.876 0.712 6.407 1.00 0.00 H new ATOM 0 HD21 ASN A 455 -11.195 -1.532 8.199 1.00 0.00 H new ATOM 0 HD22 ASN A 455 -9.430 -1.529 8.129 1.00 0.00 H new ATOM 220 N ILE A 456 -7.550 1.115 2.944 1.00 0.00 N ATOM 221 CA ILE A 456 -6.534 2.073 2.519 1.00 0.00 C ATOM 222 C ILE A 456 -6.217 3.183 3.555 1.00 0.00 C ATOM 223 O ILE A 456 -5.027 3.447 3.725 1.00 0.00 O ATOM 224 CB ILE A 456 -6.951 2.603 1.135 1.00 0.00 C ATOM 225 CG1 ILE A 456 -6.990 1.510 0.036 1.00 0.00 C ATOM 226 CG2 ILE A 456 -6.086 3.773 0.657 1.00 0.00 C ATOM 227 CD1 ILE A 456 -5.767 0.585 -0.034 1.00 0.00 C ATOM 0 H ILE A 456 -8.185 0.842 2.194 1.00 0.00 H new ATOM 0 HA ILE A 456 -5.573 1.564 2.443 1.00 0.00 H new ATOM 0 HB ILE A 456 -7.969 2.961 1.288 1.00 0.00 H new ATOM 0 HG12 ILE A 456 -7.877 0.896 0.193 1.00 0.00 H new ATOM 0 HG13 ILE A 456 -7.107 1.999 -0.931 1.00 0.00 H new ATOM 0 HG21 ILE A 456 -6.429 4.102 -0.324 1.00 0.00 H new ATOM 0 HG22 ILE A 456 -6.166 4.598 1.365 1.00 0.00 H new ATOM 0 HG23 ILE A 456 -5.046 3.453 0.589 1.00 0.00 H new ATOM 0 HD11 ILE A 456 -5.904 -0.139 -0.838 1.00 0.00 H new ATOM 0 HD12 ILE A 456 -4.873 1.178 -0.228 1.00 0.00 H new ATOM 0 HD13 ILE A 456 -5.655 0.058 0.914 1.00 0.00 H new ATOM 239 N PRO A 457 -7.161 3.806 4.306 1.00 0.00 N ATOM 240 CA PRO A 457 -6.823 4.860 5.270 1.00 0.00 C ATOM 241 C PRO A 457 -5.899 4.355 6.394 1.00 0.00 C ATOM 242 O PRO A 457 -4.833 4.926 6.628 1.00 0.00 O ATOM 243 CB PRO A 457 -8.160 5.392 5.817 1.00 0.00 C ATOM 244 CG PRO A 457 -9.216 4.845 4.853 1.00 0.00 C ATOM 245 CD PRO A 457 -8.587 3.528 4.425 1.00 0.00 C ATOM 0 HA PRO A 457 -6.257 5.655 4.784 1.00 0.00 H new ATOM 0 HB2 PRO A 457 -8.337 5.047 6.836 1.00 0.00 H new ATOM 0 HB3 PRO A 457 -8.173 6.482 5.842 1.00 0.00 H new ATOM 0 HG2 PRO A 457 -10.180 4.699 5.341 1.00 0.00 H new ATOM 0 HG3 PRO A 457 -9.384 5.512 4.008 1.00 0.00 H new ATOM 0 HD2 PRO A 457 -8.775 2.745 5.159 1.00 0.00 H new ATOM 0 HD3 PRO A 457 -9.001 3.183 3.478 1.00 0.00 H new ATOM 253 N MET A 458 -6.271 3.263 7.077 1.00 0.00 N ATOM 254 CA MET A 458 -5.448 2.668 8.143 1.00 0.00 C ATOM 255 C MET A 458 -4.251 1.877 7.593 1.00 0.00 C ATOM 256 O MET A 458 -3.248 1.760 8.292 1.00 0.00 O ATOM 257 CB MET A 458 -6.309 1.858 9.127 1.00 0.00 C ATOM 258 CG MET A 458 -7.317 0.925 8.489 1.00 0.00 C ATOM 259 SD MET A 458 -8.420 0.160 9.701 1.00 0.00 S ATOM 260 CE MET A 458 -7.468 -1.337 9.993 1.00 0.00 C ATOM 0 H MET A 458 -7.147 2.768 6.908 1.00 0.00 H new ATOM 0 HA MET A 458 -5.011 3.488 8.712 1.00 0.00 H new ATOM 0 HB2 MET A 458 -5.648 1.271 9.764 1.00 0.00 H new ATOM 0 HB3 MET A 458 -6.842 2.553 9.775 1.00 0.00 H new ATOM 0 HG2 MET A 458 -7.910 1.479 7.762 1.00 0.00 H new ATOM 0 HG3 MET A 458 -6.789 0.145 7.941 1.00 0.00 H new ATOM 0 HE1 MET A 458 -8.041 -2.015 10.626 1.00 0.00 H new ATOM 0 HE2 MET A 458 -7.254 -1.824 9.041 1.00 0.00 H new ATOM 0 HE3 MET A 458 -6.531 -1.082 10.488 1.00 0.00 H new ATOM 270 N TRP A 459 -4.274 1.419 6.333 1.00 0.00 N ATOM 271 CA TRP A 459 -3.071 0.851 5.711 1.00 0.00 C ATOM 272 C TRP A 459 -1.988 1.918 5.470 1.00 0.00 C ATOM 273 O TRP A 459 -0.843 1.768 5.898 1.00 0.00 O ATOM 274 CB TRP A 459 -3.401 0.043 4.463 1.00 0.00 C ATOM 275 CG TRP A 459 -2.249 -0.696 3.850 1.00 0.00 C ATOM 276 CD1 TRP A 459 -1.867 -1.953 4.176 1.00 0.00 C ATOM 277 CD2 TRP A 459 -1.302 -0.246 2.828 1.00 0.00 C ATOM 278 NE1 TRP A 459 -0.776 -2.315 3.412 1.00 0.00 N ATOM 279 CE2 TRP A 459 -0.406 -1.322 2.544 1.00 0.00 C ATOM 280 CE3 TRP A 459 -1.088 0.960 2.124 1.00 0.00 C ATOM 281 CZ2 TRP A 459 0.615 -1.241 1.589 1.00 0.00 C ATOM 282 CZ3 TRP A 459 -0.036 1.069 1.194 1.00 0.00 C ATOM 283 CH2 TRP A 459 0.788 -0.027 0.908 1.00 0.00 C ATOM 0 H TRP A 459 -5.099 1.430 5.733 1.00 0.00 H new ATOM 0 HA TRP A 459 -2.643 0.144 6.422 1.00 0.00 H new ATOM 0 HB2 TRP A 459 -4.180 -0.677 4.713 1.00 0.00 H new ATOM 0 HB3 TRP A 459 -3.818 0.717 3.714 1.00 0.00 H new ATOM 0 HD1 TRP A 459 -2.342 -2.576 4.919 1.00 0.00 H new ATOM 0 HE1 TRP A 459 -0.302 -3.215 3.485 1.00 0.00 H new ATOM 0 HE3 TRP A 459 -1.737 1.805 2.300 1.00 0.00 H new ATOM 0 HZ2 TRP A 459 1.251 -2.089 1.383 1.00 0.00 H new ATOM 0 HZ3 TRP A 459 0.138 2.011 0.694 1.00 0.00 H new ATOM 0 HH2 TRP A 459 1.561 0.063 0.159 1.00 0.00 H new ATOM 294 N LEU A 460 -2.368 3.052 4.868 1.00 0.00 N ATOM 295 CA LEU A 460 -1.553 4.269 4.746 1.00 0.00 C ATOM 296 C LEU A 460 -1.127 4.859 6.103 1.00 0.00 C ATOM 297 O LEU A 460 -0.146 5.604 6.167 1.00 0.00 O ATOM 298 CB LEU A 460 -2.356 5.323 3.965 1.00 0.00 C ATOM 299 CG LEU A 460 -2.623 4.997 2.490 1.00 0.00 C ATOM 300 CD1 LEU A 460 -3.660 5.987 1.949 1.00 0.00 C ATOM 301 CD2 LEU A 460 -1.363 5.180 1.656 1.00 0.00 C ATOM 0 H LEU A 460 -3.287 3.152 4.436 1.00 0.00 H new ATOM 0 HA LEU A 460 -0.637 3.994 4.223 1.00 0.00 H new ATOM 0 HB2 LEU A 460 -3.314 5.468 4.465 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.822 6.272 4.018 1.00 0.00 H new ATOM 0 HG LEU A 460 -2.966 3.964 2.426 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -3.860 5.767 0.900 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -4.583 5.896 2.521 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -3.275 7.003 2.040 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -1.579 4.943 0.614 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -1.024 6.213 1.730 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.582 4.515 2.026 1.00 0.00 H new ATOM 313 N LYS A 461 -1.835 4.554 7.197 1.00 0.00 N ATOM 314 CA LYS A 461 -1.456 4.974 8.555 1.00 0.00 C ATOM 315 C LYS A 461 -0.206 4.308 9.087 1.00 0.00 C ATOM 316 O LYS A 461 0.570 4.961 9.784 1.00 0.00 O ATOM 317 CB LYS A 461 -2.659 4.797 9.486 1.00 0.00 C ATOM 318 CG LYS A 461 -2.389 5.442 10.840 1.00 0.00 C ATOM 319 CD LYS A 461 -3.630 5.469 11.715 1.00 0.00 C ATOM 320 CE LYS A 461 -4.527 6.636 11.278 1.00 0.00 C ATOM 321 NZ LYS A 461 -4.393 7.817 12.173 1.00 0.00 N ATOM 0 H LYS A 461 -2.694 4.005 7.166 1.00 0.00 H new ATOM 0 HA LYS A 461 -1.184 6.029 8.509 1.00 0.00 H new ATOM 0 HB2 LYS A 461 -3.544 5.244 9.034 1.00 0.00 H new ATOM 0 HB3 LYS A 461 -2.870 3.736 9.618 1.00 0.00 H new ATOM 0 HG2 LYS A 461 -1.597 4.894 11.351 1.00 0.00 H new ATOM 0 HG3 LYS A 461 -2.028 6.460 10.691 1.00 0.00 H new ATOM 0 HD2 LYS A 461 -4.171 4.527 11.630 1.00 0.00 H new ATOM 0 HD3 LYS A 461 -3.349 5.582 12.762 1.00 0.00 H new ATOM 0 HE2 LYS A 461 -4.272 6.925 10.258 1.00 0.00 H new ATOM 0 HE3 LYS A 461 -5.566 6.308 11.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 461 -5.326 8.068 12.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 461 -3.745 7.589 12.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 461 -4.014 8.621 11.633 1.00 0.00 H new ATOM 335 N SER A 462 0.070 3.085 8.659 1.00 0.00 N ATOM 336 CA SER A 462 1.355 2.449 8.940 1.00 0.00 C ATOM 337 C SER A 462 2.549 3.222 8.333 1.00 0.00 C ATOM 338 O SER A 462 3.677 3.078 8.802 1.00 0.00 O ATOM 339 CB SER A 462 1.347 1.011 8.414 1.00 0.00 C ATOM 340 OG SER A 462 0.302 0.258 9.013 1.00 0.00 O ATOM 0 H SER A 462 -0.576 2.511 8.116 1.00 0.00 H new ATOM 0 HA SER A 462 1.486 2.454 10.022 1.00 0.00 H new ATOM 0 HB2 SER A 462 1.222 1.016 7.331 1.00 0.00 H new ATOM 0 HB3 SER A 462 2.307 0.538 8.622 1.00 0.00 H new ATOM 0 HG SER A 462 0.315 -0.657 8.661 1.00 0.00 H new ATOM 346 N LEU A 463 2.317 4.079 7.320 1.00 0.00 N ATOM 347 CA LEU A 463 3.298 4.962 6.678 1.00 0.00 C ATOM 348 C LEU A 463 3.366 6.356 7.335 1.00 0.00 C ATOM 349 O LEU A 463 4.157 7.195 6.904 1.00 0.00 O ATOM 350 CB LEU A 463 2.974 5.120 5.174 1.00 0.00 C ATOM 351 CG LEU A 463 2.297 3.928 4.484 1.00 0.00 C ATOM 352 CD1 LEU A 463 2.125 4.197 2.995 1.00 0.00 C ATOM 353 CD2 LEU A 463 3.070 2.614 4.624 1.00 0.00 C ATOM 0 H LEU A 463 1.389 4.176 6.909 1.00 0.00 H new ATOM 0 HA LEU A 463 4.272 4.490 6.805 1.00 0.00 H new ATOM 0 HB2 LEU A 463 2.331 5.992 5.055 1.00 0.00 H new ATOM 0 HB3 LEU A 463 3.904 5.335 4.647 1.00 0.00 H new ATOM 0 HG LEU A 463 1.336 3.818 4.988 1.00 0.00 H new ATOM 0 HD11 LEU A 463 1.643 3.340 2.524 1.00 0.00 H new ATOM 0 HD12 LEU A 463 1.507 5.084 2.854 1.00 0.00 H new ATOM 0 HD13 LEU A 463 3.102 4.360 2.539 1.00 0.00 H new ATOM 0 HD21 LEU A 463 2.530 1.818 4.111 1.00 0.00 H new ATOM 0 HD22 LEU A 463 4.060 2.725 4.181 1.00 0.00 H new ATOM 0 HD23 LEU A 463 3.171 2.362 5.680 1.00 0.00 H new ATOM 365 N ARG A 464 2.512 6.622 8.342 1.00 0.00 N ATOM 366 CA ARG A 464 2.243 7.932 8.967 1.00 0.00 C ATOM 367 C ARG A 464 1.663 8.971 7.981 1.00 0.00 C ATOM 368 O ARG A 464 1.674 10.169 8.260 1.00 0.00 O ATOM 369 CB ARG A 464 3.463 8.427 9.780 1.00 0.00 C ATOM 370 CG ARG A 464 3.835 7.530 10.978 1.00 0.00 C ATOM 371 CD ARG A 464 4.679 6.295 10.627 1.00 0.00 C ATOM 372 NE ARG A 464 5.097 5.563 11.839 1.00 0.00 N ATOM 373 CZ ARG A 464 6.214 5.701 12.533 1.00 0.00 C ATOM 374 NH1 ARG A 464 7.130 6.572 12.213 1.00 0.00 N ATOM 375 NH2 ARG A 464 6.436 4.956 13.577 1.00 0.00 N ATOM 0 H ARG A 464 1.956 5.881 8.768 1.00 0.00 H new ATOM 0 HA ARG A 464 1.440 7.791 9.690 1.00 0.00 H new ATOM 0 HB2 ARG A 464 4.323 8.499 9.114 1.00 0.00 H new ATOM 0 HB3 ARG A 464 3.257 9.433 10.145 1.00 0.00 H new ATOM 0 HG2 ARG A 464 4.381 8.130 11.706 1.00 0.00 H new ATOM 0 HG3 ARG A 464 2.917 7.198 11.463 1.00 0.00 H new ATOM 0 HD2 ARG A 464 4.104 5.632 9.980 1.00 0.00 H new ATOM 0 HD3 ARG A 464 5.560 6.603 10.065 1.00 0.00 H new ATOM 0 HE ARG A 464 4.441 4.862 12.185 1.00 0.00 H new ATOM 0 HH11 ARG A 464 6.998 7.177 11.402 1.00 0.00 H new ATOM 0 HH12 ARG A 464 7.979 6.649 12.773 1.00 0.00 H new ATOM 0 HH21 ARG A 464 5.746 4.261 13.864 1.00 0.00 H new ATOM 0 HH22 ARG A 464 7.300 5.067 14.108 1.00 0.00 H new ATOM 389 N LEU A 465 1.109 8.504 6.853 1.00 0.00 N ATOM 390 CA LEU A 465 0.453 9.318 5.819 1.00 0.00 C ATOM 391 C LEU A 465 -1.065 9.390 6.028 1.00 0.00 C ATOM 392 O LEU A 465 -1.584 10.466 6.317 1.00 0.00 O ATOM 393 CB LEU A 465 0.803 8.771 4.422 1.00 0.00 C ATOM 394 CG LEU A 465 2.284 8.934 4.037 1.00 0.00 C ATOM 395 CD1 LEU A 465 2.523 8.207 2.720 1.00 0.00 C ATOM 396 CD2 LEU A 465 2.697 10.402 3.900 1.00 0.00 C ATOM 0 H LEU A 465 1.105 7.509 6.627 1.00 0.00 H new ATOM 0 HA LEU A 465 0.828 10.339 5.899 1.00 0.00 H new ATOM 0 HB2 LEU A 465 0.542 7.713 4.382 1.00 0.00 H new ATOM 0 HB3 LEU A 465 0.188 9.279 3.680 1.00 0.00 H new ATOM 0 HG LEU A 465 2.892 8.508 4.835 1.00 0.00 H new ATOM 0 HD11 LEU A 465 3.569 8.312 2.431 1.00 0.00 H new ATOM 0 HD12 LEU A 465 2.284 7.150 2.839 1.00 0.00 H new ATOM 0 HD13 LEU A 465 1.888 8.638 1.946 1.00 0.00 H new ATOM 0 HD21 LEU A 465 3.751 10.460 3.627 1.00 0.00 H new ATOM 0 HD22 LEU A 465 2.095 10.879 3.126 1.00 0.00 H new ATOM 0 HD23 LEU A 465 2.539 10.914 4.849 1.00 0.00 H new ATOM 408 N HIS A 466 -1.770 8.257 5.879 1.00 0.00 N ATOM 409 CA HIS A 466 -3.226 8.105 6.146 1.00 0.00 C ATOM 410 C HIS A 466 -4.179 9.214 5.642 1.00 0.00 C ATOM 411 O HIS A 466 -5.212 9.491 6.259 1.00 0.00 O ATOM 412 CB HIS A 466 -3.411 7.723 7.615 1.00 0.00 C ATOM 413 CG HIS A 466 -3.009 8.717 8.669 1.00 0.00 C ATOM 414 ND1 HIS A 466 -1.822 8.707 9.362 1.00 0.00 N ATOM 415 CD2 HIS A 466 -3.838 9.618 9.278 1.00 0.00 C ATOM 416 CE1 HIS A 466 -1.935 9.563 10.386 1.00 0.00 C ATOM 417 NE2 HIS A 466 -3.147 10.143 10.380 1.00 0.00 N ATOM 0 H HIS A 466 -1.338 7.390 5.560 1.00 0.00 H new ATOM 0 HA HIS A 466 -3.568 7.297 5.500 1.00 0.00 H new ATOM 0 HB2 HIS A 466 -4.464 7.487 7.766 1.00 0.00 H new ATOM 0 HB3 HIS A 466 -2.850 6.806 7.793 1.00 0.00 H new ATOM 0 HD2 HIS A 466 -4.839 9.877 8.968 1.00 0.00 H new ATOM 0 HE1 HIS A 466 -1.161 9.759 11.114 1.00 0.00 H new ATOM 0 HE2 HIS A 466 -3.497 10.831 11.047 1.00 0.00 H new ATOM 425 N LYS A 467 -3.853 9.814 4.490 1.00 0.00 N ATOM 426 CA LYS A 467 -4.590 10.925 3.850 1.00 0.00 C ATOM 427 C LYS A 467 -5.023 10.662 2.406 1.00 0.00 C ATOM 428 O LYS A 467 -6.080 11.127 1.983 1.00 0.00 O ATOM 429 CB LYS A 467 -3.753 12.217 3.940 1.00 0.00 C ATOM 430 CG LYS A 467 -2.447 12.082 3.142 1.00 0.00 C ATOM 431 CD LYS A 467 -1.592 13.328 3.029 1.00 0.00 C ATOM 432 CE LYS A 467 -2.257 14.460 2.237 1.00 0.00 C ATOM 433 NZ LYS A 467 -1.256 15.479 1.822 1.00 0.00 N ATOM 0 H LYS A 467 -3.035 9.531 3.951 1.00 0.00 H new ATOM 0 HA LYS A 467 -5.522 11.030 4.406 1.00 0.00 H new ATOM 0 HB2 LYS A 467 -4.332 13.057 3.557 1.00 0.00 H new ATOM 0 HB3 LYS A 467 -3.525 12.435 4.983 1.00 0.00 H new ATOM 0 HG2 LYS A 467 -1.846 11.297 3.601 1.00 0.00 H new ATOM 0 HG3 LYS A 467 -2.695 11.746 2.135 1.00 0.00 H new ATOM 0 HD2 LYS A 467 -1.355 13.687 4.030 1.00 0.00 H new ATOM 0 HD3 LYS A 467 -0.647 13.068 2.551 1.00 0.00 H new ATOM 0 HE2 LYS A 467 -2.751 14.051 1.356 1.00 0.00 H new ATOM 0 HE3 LYS A 467 -3.029 14.930 2.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 467 -1.714 16.190 1.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 467 -0.864 15.944 2.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 467 -0.489 15.017 1.293 1.00 0.00 H new ATOM 447 N TYR A 468 -4.211 9.926 1.641 1.00 0.00 N ATOM 448 CA TYR A 468 -4.382 9.798 0.193 1.00 0.00 C ATOM 449 C TYR A 468 -5.573 8.924 -0.198 1.00 0.00 C ATOM 450 O TYR A 468 -6.050 9.007 -1.325 1.00 0.00 O ATOM 451 CB TYR A 468 -3.064 9.390 -0.464 1.00 0.00 C ATOM 452 CG TYR A 468 -2.000 10.437 -0.242 1.00 0.00 C ATOM 453 CD1 TYR A 468 -2.177 11.686 -0.870 1.00 0.00 C ATOM 454 CD2 TYR A 468 -0.896 10.212 0.596 1.00 0.00 C ATOM 455 CE1 TYR A 468 -1.241 12.715 -0.682 1.00 0.00 C ATOM 456 CE2 TYR A 468 0.053 11.239 0.767 1.00 0.00 C ATOM 457 CZ TYR A 468 -0.107 12.487 0.118 1.00 0.00 C ATOM 458 OH TYR A 468 0.751 13.518 0.362 1.00 0.00 O ATOM 0 H TYR A 468 -3.417 9.403 2.010 1.00 0.00 H new ATOM 0 HA TYR A 468 -4.643 10.779 -0.203 1.00 0.00 H new ATOM 0 HB2 TYR A 468 -2.731 8.436 -0.056 1.00 0.00 H new ATOM 0 HB3 TYR A 468 -3.217 9.243 -1.533 1.00 0.00 H new ATOM 0 HD1 TYR A 468 -3.038 11.853 -1.500 1.00 0.00 H new ATOM 0 HD2 TYR A 468 -0.776 9.265 1.102 1.00 0.00 H new ATOM 0 HE1 TYR A 468 -1.391 13.677 -1.149 1.00 0.00 H new ATOM 0 HE2 TYR A 468 0.912 11.072 1.400 1.00 0.00 H new ATOM 0 HH TYR A 468 1.485 13.205 0.931 1.00 0.00 H new ATOM 468 N SER A 469 -6.141 8.190 0.761 1.00 0.00 N ATOM 469 CA SER A 469 -7.392 7.437 0.692 1.00 0.00 C ATOM 470 C SER A 469 -8.554 8.255 0.128 1.00 0.00 C ATOM 471 O SER A 469 -9.404 7.707 -0.571 1.00 0.00 O ATOM 472 CB SER A 469 -7.773 6.998 2.113 1.00 0.00 C ATOM 473 OG SER A 469 -7.567 8.059 3.036 1.00 0.00 O ATOM 0 H SER A 469 -5.702 8.101 1.678 1.00 0.00 H new ATOM 0 HA SER A 469 -7.224 6.592 0.024 1.00 0.00 H new ATOM 0 HB2 SER A 469 -8.817 6.687 2.136 1.00 0.00 H new ATOM 0 HB3 SER A 469 -7.176 6.134 2.405 1.00 0.00 H new ATOM 0 HG SER A 469 -7.816 7.763 3.936 1.00 0.00 H new ATOM 479 N ASP A 470 -8.547 9.571 0.345 1.00 0.00 N ATOM 480 CA ASP A 470 -9.500 10.531 -0.209 1.00 0.00 C ATOM 481 C ASP A 470 -9.611 10.463 -1.747 1.00 0.00 C ATOM 482 O ASP A 470 -10.670 10.733 -2.318 1.00 0.00 O ATOM 483 CB ASP A 470 -9.054 11.928 0.229 1.00 0.00 C ATOM 484 CG ASP A 470 -10.039 13.026 -0.206 1.00 0.00 C ATOM 485 OD1 ASP A 470 -11.160 13.089 0.354 1.00 0.00 O ATOM 486 OD2 ASP A 470 -9.687 13.846 -1.088 1.00 0.00 O ATOM 0 H ASP A 470 -7.846 10.015 0.938 1.00 0.00 H new ATOM 0 HA ASP A 470 -10.494 10.289 0.169 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -8.949 11.948 1.314 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -8.071 12.140 -0.191 1.00 0.00 H new ATOM 491 N ALA A 471 -8.521 10.052 -2.401 1.00 0.00 N ATOM 492 CA ALA A 471 -8.371 9.884 -3.843 1.00 0.00 C ATOM 493 C ALA A 471 -7.914 8.470 -4.275 1.00 0.00 C ATOM 494 O ALA A 471 -7.861 8.172 -5.471 1.00 0.00 O ATOM 495 CB ALA A 471 -7.409 10.982 -4.311 1.00 0.00 C ATOM 0 H ALA A 471 -7.665 9.813 -1.901 1.00 0.00 H new ATOM 0 HA ALA A 471 -9.345 9.982 -4.322 1.00 0.00 H new ATOM 0 HB1 ALA A 471 -7.261 10.902 -5.388 1.00 0.00 H new ATOM 0 HB2 ALA A 471 -7.830 11.959 -4.074 1.00 0.00 H new ATOM 0 HB3 ALA A 471 -6.451 10.867 -3.804 1.00 0.00 H new ATOM 501 N LEU A 472 -7.613 7.590 -3.311 1.00 0.00 N ATOM 502 CA LEU A 472 -6.934 6.309 -3.497 1.00 0.00 C ATOM 503 C LEU A 472 -7.658 5.085 -2.904 1.00 0.00 C ATOM 504 O LEU A 472 -7.414 3.969 -3.349 1.00 0.00 O ATOM 505 CB LEU A 472 -5.543 6.525 -2.878 1.00 0.00 C ATOM 506 CG LEU A 472 -4.462 5.544 -3.324 1.00 0.00 C ATOM 507 CD1 LEU A 472 -3.175 6.310 -3.609 1.00 0.00 C ATOM 508 CD2 LEU A 472 -4.248 4.415 -2.318 1.00 0.00 C ATOM 0 H LEU A 472 -7.850 7.764 -2.334 1.00 0.00 H new ATOM 0 HA LEU A 472 -6.899 6.052 -4.556 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -5.212 7.536 -3.117 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -5.635 6.468 -1.793 1.00 0.00 H new ATOM 0 HG LEU A 472 -4.793 5.057 -4.241 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -2.400 5.613 -3.928 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -3.353 7.040 -4.398 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -2.850 6.825 -2.705 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -3.469 3.745 -2.683 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -3.945 4.835 -1.359 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -5.177 3.858 -2.193 1.00 0.00 H new ATOM 520 N SER A 473 -8.584 5.255 -1.950 1.00 0.00 N ATOM 521 CA SER A 473 -9.323 4.155 -1.294 1.00 0.00 C ATOM 522 C SER A 473 -10.235 3.366 -2.237 1.00 0.00 C ATOM 523 O SER A 473 -10.528 2.193 -2.002 1.00 0.00 O ATOM 524 CB SER A 473 -10.122 4.697 -0.113 1.00 0.00 C ATOM 525 OG SER A 473 -10.509 3.672 0.786 1.00 0.00 O ATOM 0 H SER A 473 -8.849 6.177 -1.603 1.00 0.00 H new ATOM 0 HA SER A 473 -8.571 3.446 -0.948 1.00 0.00 H new ATOM 0 HB2 SER A 473 -9.525 5.438 0.418 1.00 0.00 H new ATOM 0 HB3 SER A 473 -11.011 5.209 -0.482 1.00 0.00 H new ATOM 0 HG SER A 473 -11.017 4.062 1.528 1.00 0.00 H new ATOM 531 N GLY A 474 -10.625 3.991 -3.350 1.00 0.00 N ATOM 532 CA GLY A 474 -11.291 3.335 -4.483 1.00 0.00 C ATOM 533 C GLY A 474 -10.408 2.311 -5.222 1.00 0.00 C ATOM 534 O GLY A 474 -10.915 1.557 -6.053 1.00 0.00 O ATOM 0 H GLY A 474 -10.484 4.991 -3.494 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -12.188 2.832 -4.122 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -11.616 4.097 -5.191 1.00 0.00 H new ATOM 538 N THR A 475 -9.103 2.259 -4.916 1.00 0.00 N ATOM 539 CA THR A 475 -8.127 1.295 -5.450 1.00 0.00 C ATOM 540 C THR A 475 -7.742 0.259 -4.379 1.00 0.00 C ATOM 541 O THR A 475 -7.042 0.611 -3.426 1.00 0.00 O ATOM 542 CB THR A 475 -6.880 2.004 -6.008 1.00 0.00 C ATOM 543 OG1 THR A 475 -7.243 3.044 -6.893 1.00 0.00 O ATOM 544 CG2 THR A 475 -6.025 1.041 -6.828 1.00 0.00 C ATOM 0 H THR A 475 -8.680 2.916 -4.261 1.00 0.00 H new ATOM 0 HA THR A 475 -8.600 0.768 -6.279 1.00 0.00 H new ATOM 0 HB THR A 475 -6.334 2.387 -5.146 1.00 0.00 H new ATOM 0 HG1 THR A 475 -6.915 3.899 -6.545 1.00 0.00 H new ATOM 0 HG21 THR A 475 -5.150 1.567 -7.211 1.00 0.00 H new ATOM 0 HG22 THR A 475 -5.703 0.213 -6.197 1.00 0.00 H new ATOM 0 HG23 THR A 475 -6.610 0.655 -7.663 1.00 0.00 H new ATOM 552 N PRO A 476 -8.179 -1.015 -4.488 1.00 0.00 N ATOM 553 CA PRO A 476 -7.782 -2.068 -3.551 1.00 0.00 C ATOM 554 C PRO A 476 -6.299 -2.360 -3.673 1.00 0.00 C ATOM 555 O PRO A 476 -5.762 -2.311 -4.778 1.00 0.00 O ATOM 556 CB PRO A 476 -8.579 -3.319 -3.941 1.00 0.00 C ATOM 557 CG PRO A 476 -8.900 -3.091 -5.418 1.00 0.00 C ATOM 558 CD PRO A 476 -8.990 -1.575 -5.560 1.00 0.00 C ATOM 0 HA PRO A 476 -7.979 -1.763 -2.523 1.00 0.00 H new ATOM 0 HB2 PRO A 476 -7.997 -4.228 -3.792 1.00 0.00 H new ATOM 0 HB3 PRO A 476 -9.485 -3.420 -3.344 1.00 0.00 H new ATOM 0 HG2 PRO A 476 -8.123 -3.504 -6.061 1.00 0.00 H new ATOM 0 HG3 PRO A 476 -9.837 -3.572 -5.699 1.00 0.00 H new ATOM 0 HD2 PRO A 476 -8.622 -1.253 -6.534 1.00 0.00 H new ATOM 0 HD3 PRO A 476 -10.024 -1.238 -5.482 1.00 0.00 H new ATOM 566 N TRP A 477 -5.660 -2.777 -2.575 1.00 0.00 N ATOM 567 CA TRP A 477 -4.213 -3.030 -2.480 1.00 0.00 C ATOM 568 C TRP A 477 -3.616 -3.871 -3.615 1.00 0.00 C ATOM 569 O TRP A 477 -2.443 -3.744 -3.951 1.00 0.00 O ATOM 570 CB TRP A 477 -3.910 -3.757 -1.174 1.00 0.00 C ATOM 571 CG TRP A 477 -4.314 -5.204 -1.142 1.00 0.00 C ATOM 572 CD1 TRP A 477 -5.564 -5.708 -1.000 1.00 0.00 C ATOM 573 CD2 TRP A 477 -3.446 -6.363 -1.318 1.00 0.00 C ATOM 574 NE1 TRP A 477 -5.508 -7.078 -0.976 1.00 0.00 N ATOM 575 CE2 TRP A 477 -4.236 -7.548 -1.216 1.00 0.00 C ATOM 576 CE3 TRP A 477 -2.070 -6.526 -1.572 1.00 0.00 C ATOM 577 CZ2 TRP A 477 -3.684 -8.833 -1.361 1.00 0.00 C ATOM 578 CZ3 TRP A 477 -1.510 -7.803 -1.695 1.00 0.00 C ATOM 579 CH2 TRP A 477 -2.308 -8.956 -1.612 1.00 0.00 C ATOM 0 H TRP A 477 -6.149 -2.954 -1.698 1.00 0.00 H new ATOM 0 HA TRP A 477 -3.756 -2.042 -2.540 1.00 0.00 H new ATOM 0 HB2 TRP A 477 -2.840 -3.690 -0.979 1.00 0.00 H new ATOM 0 HB3 TRP A 477 -4.416 -3.236 -0.361 1.00 0.00 H new ATOM 0 HD1 TRP A 477 -6.466 -5.120 -0.918 1.00 0.00 H new ATOM 0 HE1 TRP A 477 -6.314 -7.678 -0.801 1.00 0.00 H new ATOM 0 HE3 TRP A 477 -1.439 -5.655 -1.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 477 -4.308 -9.711 -1.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 477 -0.447 -7.903 -1.856 1.00 0.00 H new ATOM 0 HH2 TRP A 477 -1.865 -9.933 -1.741 1.00 0.00 H new ATOM 590 N ILE A 478 -4.435 -4.722 -4.215 1.00 0.00 N ATOM 591 CA ILE A 478 -4.016 -5.697 -5.220 1.00 0.00 C ATOM 592 C ILE A 478 -4.012 -5.087 -6.624 1.00 0.00 C ATOM 593 O ILE A 478 -3.188 -5.462 -7.454 1.00 0.00 O ATOM 594 CB ILE A 478 -4.842 -6.990 -5.090 1.00 0.00 C ATOM 595 CG1 ILE A 478 -4.072 -8.162 -5.735 1.00 0.00 C ATOM 596 CG2 ILE A 478 -6.269 -6.851 -5.651 1.00 0.00 C ATOM 597 CD1 ILE A 478 -4.542 -9.529 -5.233 1.00 0.00 C ATOM 0 H ILE A 478 -5.434 -4.757 -4.014 1.00 0.00 H new ATOM 0 HA ILE A 478 -2.980 -5.982 -5.037 1.00 0.00 H new ATOM 0 HB ILE A 478 -4.975 -7.199 -4.029 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -4.191 -8.117 -6.818 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -3.008 -8.050 -5.527 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -6.801 -7.795 -5.531 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -6.797 -6.065 -5.111 1.00 0.00 H new ATOM 0 HG23 ILE A 478 -6.221 -6.594 -6.709 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -3.965 -10.314 -5.721 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -4.397 -9.590 -4.154 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -5.599 -9.658 -5.465 1.00 0.00 H new ATOM 609 N GLU A 479 -4.882 -4.099 -6.874 1.00 0.00 N ATOM 610 CA GLU A 479 -4.773 -3.235 -8.059 1.00 0.00 C ATOM 611 C GLU A 479 -3.793 -2.076 -7.776 1.00 0.00 C ATOM 612 O GLU A 479 -3.290 -1.430 -8.696 1.00 0.00 O ATOM 613 CB GLU A 479 -6.155 -2.667 -8.421 1.00 0.00 C ATOM 614 CG GLU A 479 -7.138 -3.733 -8.926 1.00 0.00 C ATOM 615 CD GLU A 479 -6.752 -4.265 -10.321 1.00 0.00 C ATOM 616 OE1 GLU A 479 -7.003 -3.565 -11.332 1.00 0.00 O ATOM 617 OE2 GLU A 479 -6.206 -5.391 -10.421 1.00 0.00 O ATOM 0 H GLU A 479 -5.673 -3.877 -6.269 1.00 0.00 H new ATOM 0 HA GLU A 479 -4.398 -3.826 -8.895 1.00 0.00 H new ATOM 0 HB2 GLU A 479 -6.580 -2.178 -7.544 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -6.036 -1.901 -9.187 1.00 0.00 H new ATOM 0 HG2 GLU A 479 -7.168 -4.562 -8.218 1.00 0.00 H new ATOM 0 HG3 GLU A 479 -8.142 -3.310 -8.965 1.00 0.00 H new ATOM 624 N LEU A 480 -3.521 -1.817 -6.491 1.00 0.00 N ATOM 625 CA LEU A 480 -2.806 -0.661 -5.975 1.00 0.00 C ATOM 626 C LEU A 480 -1.304 -0.750 -6.043 1.00 0.00 C ATOM 627 O LEU A 480 -0.652 0.137 -6.580 1.00 0.00 O ATOM 628 CB LEU A 480 -3.138 -0.477 -4.491 1.00 0.00 C ATOM 629 CG LEU A 480 -2.687 0.852 -3.913 1.00 0.00 C ATOM 630 CD1 LEU A 480 -3.636 1.881 -4.468 1.00 0.00 C ATOM 631 CD2 LEU A 480 -2.780 0.816 -2.396 1.00 0.00 C ATOM 0 H LEU A 480 -3.814 -2.450 -5.747 1.00 0.00 H new ATOM 0 HA LEU A 480 -3.130 0.162 -6.612 1.00 0.00 H new ATOM 0 HB2 LEU A 480 -4.216 -0.572 -4.357 1.00 0.00 H new ATOM 0 HB3 LEU A 480 -2.674 -1.284 -3.924 1.00 0.00 H new ATOM 0 HG LEU A 480 -1.653 1.078 -4.173 1.00 0.00 H new ATOM 0 HD11 LEU A 480 -3.366 2.867 -4.089 1.00 0.00 H new ATOM 0 HD12 LEU A 480 -3.576 1.882 -5.556 1.00 0.00 H new ATOM 0 HD13 LEU A 480 -4.654 1.640 -4.161 1.00 0.00 H new ATOM 0 HD21 LEU A 480 -2.455 1.773 -1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 480 -3.812 0.627 -2.099 1.00 0.00 H new ATOM 0 HD23 LEU A 480 -2.140 0.022 -2.011 1.00 0.00 H new ATOM 643 N ILE A 481 -0.744 -1.790 -5.429 1.00 0.00 N ATOM 644 CA ILE A 481 0.692 -1.892 -5.194 1.00 0.00 C ATOM 645 C ILE A 481 1.513 -1.846 -6.500 1.00 0.00 C ATOM 646 O ILE A 481 2.714 -1.597 -6.524 1.00 0.00 O ATOM 647 CB ILE A 481 0.981 -3.169 -4.375 1.00 0.00 C ATOM 648 CG1 ILE A 481 0.543 -4.409 -5.189 1.00 0.00 C ATOM 649 CG2 ILE A 481 0.361 -3.015 -2.969 1.00 0.00 C ATOM 650 CD1 ILE A 481 0.646 -5.716 -4.423 1.00 0.00 C ATOM 0 H ILE A 481 -1.276 -2.587 -5.080 1.00 0.00 H new ATOM 0 HA ILE A 481 1.010 -1.020 -4.622 1.00 0.00 H new ATOM 0 HB ILE A 481 2.045 -3.321 -4.196 1.00 0.00 H new ATOM 0 HG12 ILE A 481 -0.488 -4.271 -5.516 1.00 0.00 H new ATOM 0 HG13 ILE A 481 1.156 -4.477 -6.088 1.00 0.00 H new ATOM 0 HG21 ILE A 481 0.560 -3.912 -2.383 1.00 0.00 H new ATOM 0 HG22 ILE A 481 0.800 -2.151 -2.470 1.00 0.00 H new ATOM 0 HG23 ILE A 481 -0.716 -2.873 -3.060 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.321 -6.538 -5.061 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.680 -5.879 -4.119 1.00 0.00 H new ATOM 0 HD13 ILE A 481 0.011 -5.670 -3.539 1.00 0.00 H new ATOM 662 N TYR A 482 0.798 -2.071 -7.598 1.00 0.00 N ATOM 663 CA TYR A 482 1.193 -2.088 -8.997 1.00 0.00 C ATOM 664 C TYR A 482 1.396 -0.696 -9.621 1.00 0.00 C ATOM 665 O TYR A 482 2.015 -0.590 -10.682 1.00 0.00 O ATOM 666 CB TYR A 482 0.038 -2.781 -9.728 1.00 0.00 C ATOM 667 CG TYR A 482 -0.094 -4.293 -9.609 1.00 0.00 C ATOM 668 CD1 TYR A 482 0.841 -5.089 -8.911 1.00 0.00 C ATOM 669 CD2 TYR A 482 -1.214 -4.904 -10.207 1.00 0.00 C ATOM 670 CE1 TYR A 482 0.658 -6.482 -8.814 1.00 0.00 C ATOM 671 CE2 TYR A 482 -1.402 -6.295 -10.118 1.00 0.00 C ATOM 672 CZ TYR A 482 -0.462 -7.090 -9.427 1.00 0.00 C ATOM 673 OH TYR A 482 -0.635 -8.439 -9.361 1.00 0.00 O ATOM 0 H TYR A 482 -0.199 -2.271 -7.512 1.00 0.00 H new ATOM 0 HA TYR A 482 2.157 -2.589 -9.083 1.00 0.00 H new ATOM 0 HB2 TYR A 482 -0.892 -2.338 -9.373 1.00 0.00 H new ATOM 0 HB3 TYR A 482 0.123 -2.538 -10.787 1.00 0.00 H new ATOM 0 HD1 TYR A 482 1.701 -4.627 -8.449 1.00 0.00 H new ATOM 0 HD2 TYR A 482 -1.934 -4.299 -10.738 1.00 0.00 H new ATOM 0 HE1 TYR A 482 1.372 -7.085 -8.272 1.00 0.00 H new ATOM 0 HE2 TYR A 482 -2.265 -6.754 -10.578 1.00 0.00 H new ATOM 0 HH TYR A 482 -1.456 -8.687 -9.835 1.00 0.00 H new ATOM 683 N LEU A 483 0.860 0.356 -8.994 1.00 0.00 N ATOM 684 CA LEU A 483 0.868 1.739 -9.517 1.00 0.00 C ATOM 685 C LEU A 483 2.307 2.259 -9.693 1.00 0.00 C ATOM 686 O LEU A 483 2.789 2.458 -10.807 1.00 0.00 O ATOM 687 CB LEU A 483 0.118 2.669 -8.551 1.00 0.00 C ATOM 688 CG LEU A 483 -1.407 2.489 -8.468 1.00 0.00 C ATOM 689 CD1 LEU A 483 -1.921 3.113 -7.187 1.00 0.00 C ATOM 690 CD2 LEU A 483 -2.130 3.255 -9.564 1.00 0.00 C ATOM 0 H LEU A 483 0.397 0.275 -8.089 1.00 0.00 H new ATOM 0 HA LEU A 483 0.375 1.730 -10.489 1.00 0.00 H new ATOM 0 HB2 LEU A 483 0.533 2.529 -7.553 1.00 0.00 H new ATOM 0 HB3 LEU A 483 0.324 3.699 -8.841 1.00 0.00 H new ATOM 0 HG LEU A 483 -1.590 1.417 -8.541 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -3.002 2.985 -7.128 1.00 0.00 H new ATOM 0 HD12 LEU A 483 -1.451 2.627 -6.332 1.00 0.00 H new ATOM 0 HD13 LEU A 483 -1.680 4.176 -7.178 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -3.205 3.100 -9.468 1.00 0.00 H new ATOM 0 HD22 LEU A 483 -1.907 4.318 -9.473 1.00 0.00 H new ATOM 0 HD23 LEU A 483 -1.797 2.897 -10.538 1.00 0.00 H new ATOM 702 N ASP A 484 2.972 2.453 -8.553 1.00 0.00 N ATOM 703 CA ASP A 484 4.353 2.912 -8.380 1.00 0.00 C ATOM 704 C ASP A 484 4.629 4.331 -8.944 1.00 0.00 C ATOM 705 O ASP A 484 3.705 5.096 -9.233 1.00 0.00 O ATOM 706 CB ASP A 484 5.291 1.831 -8.934 1.00 0.00 C ATOM 707 CG ASP A 484 6.615 1.729 -8.162 1.00 0.00 C ATOM 708 OD1 ASP A 484 7.577 2.438 -8.537 1.00 0.00 O ATOM 709 OD2 ASP A 484 6.686 0.948 -7.187 1.00 0.00 O ATOM 0 H ASP A 484 2.523 2.279 -7.654 1.00 0.00 H new ATOM 0 HA ASP A 484 4.547 3.042 -7.315 1.00 0.00 H new ATOM 0 HB2 ASP A 484 4.783 0.867 -8.902 1.00 0.00 H new ATOM 0 HB3 ASP A 484 5.504 2.045 -9.981 1.00 0.00 H new ATOM 714 N ASP A 485 5.916 4.688 -9.024 1.00 0.00 N ATOM 715 CA ASP A 485 6.555 5.981 -9.300 1.00 0.00 C ATOM 716 C ASP A 485 5.605 7.187 -9.468 1.00 0.00 C ATOM 717 O ASP A 485 5.149 7.761 -8.476 1.00 0.00 O ATOM 718 CB ASP A 485 7.565 5.814 -10.454 1.00 0.00 C ATOM 719 CG ASP A 485 8.397 7.079 -10.751 1.00 0.00 C ATOM 720 OD1 ASP A 485 8.607 7.918 -9.843 1.00 0.00 O ATOM 721 OD2 ASP A 485 8.841 7.234 -11.914 1.00 0.00 O ATOM 0 H ASP A 485 6.632 3.977 -8.876 1.00 0.00 H new ATOM 0 HA ASP A 485 7.091 6.263 -8.394 1.00 0.00 H new ATOM 0 HB2 ASP A 485 8.243 4.995 -10.214 1.00 0.00 H new ATOM 0 HB3 ASP A 485 7.025 5.527 -11.356 1.00 0.00 H new ATOM 726 N GLU A 486 5.323 7.610 -10.704 1.00 0.00 N ATOM 727 CA GLU A 486 4.512 8.769 -11.051 1.00 0.00 C ATOM 728 C GLU A 486 3.020 8.433 -11.161 1.00 0.00 C ATOM 729 O GLU A 486 2.196 9.305 -11.401 1.00 0.00 O ATOM 730 CB GLU A 486 5.043 9.294 -12.393 1.00 0.00 C ATOM 731 CG GLU A 486 4.727 10.780 -12.550 1.00 0.00 C ATOM 732 CD GLU A 486 5.104 11.359 -13.927 1.00 0.00 C ATOM 733 OE1 GLU A 486 6.294 11.294 -14.323 1.00 0.00 O ATOM 734 OE2 GLU A 486 4.205 11.907 -14.614 1.00 0.00 O ATOM 0 H GLU A 486 5.675 7.124 -11.529 1.00 0.00 H new ATOM 0 HA GLU A 486 4.590 9.518 -10.263 1.00 0.00 H new ATOM 0 HB2 GLU A 486 6.120 9.137 -12.451 1.00 0.00 H new ATOM 0 HB3 GLU A 486 4.595 8.732 -13.213 1.00 0.00 H new ATOM 0 HG2 GLU A 486 3.661 10.934 -12.382 1.00 0.00 H new ATOM 0 HG3 GLU A 486 5.255 11.337 -11.776 1.00 0.00 H new ATOM 741 N THR A 487 2.638 7.169 -11.005 1.00 0.00 N ATOM 742 CA THR A 487 1.245 6.741 -11.214 1.00 0.00 C ATOM 743 C THR A 487 0.371 6.820 -9.963 1.00 0.00 C ATOM 744 O THR A 487 -0.822 7.108 -10.047 1.00 0.00 O ATOM 745 CB THR A 487 1.203 5.386 -11.928 1.00 0.00 C ATOM 746 OG1 THR A 487 1.747 5.511 -13.227 1.00 0.00 O ATOM 747 CG2 THR A 487 -0.210 4.850 -12.088 1.00 0.00 C ATOM 0 H THR A 487 3.270 6.416 -10.734 1.00 0.00 H new ATOM 0 HA THR A 487 0.779 7.469 -11.878 1.00 0.00 H new ATOM 0 HB THR A 487 1.778 4.698 -11.308 1.00 0.00 H new ATOM 0 HG1 THR A 487 1.719 4.642 -13.678 1.00 0.00 H new ATOM 0 HG21 THR A 487 -0.179 3.888 -12.600 1.00 0.00 H new ATOM 0 HG22 THR A 487 -0.664 4.723 -11.105 1.00 0.00 H new ATOM 0 HG23 THR A 487 -0.802 5.554 -12.673 1.00 0.00 H new ATOM 755 N LEU A 488 0.977 6.716 -8.785 1.00 0.00 N ATOM 756 CA LEU A 488 0.404 7.055 -7.483 1.00 0.00 C ATOM 757 C LEU A 488 -0.113 8.499 -7.493 1.00 0.00 C ATOM 758 O LEU A 488 -1.145 8.865 -6.930 1.00 0.00 O ATOM 759 CB LEU A 488 1.584 6.916 -6.502 1.00 0.00 C ATOM 760 CG LEU A 488 1.908 5.442 -6.240 1.00 0.00 C ATOM 761 CD1 LEU A 488 3.282 5.265 -5.605 1.00 0.00 C ATOM 762 CD2 LEU A 488 0.833 4.866 -5.330 1.00 0.00 C ATOM 0 H LEU A 488 1.935 6.374 -8.707 1.00 0.00 H new ATOM 0 HA LEU A 488 -0.439 6.418 -7.216 1.00 0.00 H new ATOM 0 HB2 LEU A 488 2.461 7.418 -6.909 1.00 0.00 H new ATOM 0 HB3 LEU A 488 1.341 7.411 -5.562 1.00 0.00 H new ATOM 0 HG LEU A 488 1.927 4.914 -7.193 1.00 0.00 H new ATOM 0 HD11 LEU A 488 3.471 4.205 -5.436 1.00 0.00 H new ATOM 0 HD12 LEU A 488 4.045 5.668 -6.271 1.00 0.00 H new ATOM 0 HD13 LEU A 488 3.314 5.795 -4.653 1.00 0.00 H new ATOM 0 HD21 LEU A 488 1.048 3.816 -5.133 1.00 0.00 H new ATOM 0 HD22 LEU A 488 0.819 5.417 -4.389 1.00 0.00 H new ATOM 0 HD23 LEU A 488 -0.139 4.952 -5.815 1.00 0.00 H new ATOM 774 N GLU A 489 0.621 9.347 -8.191 1.00 0.00 N ATOM 775 CA GLU A 489 0.409 10.756 -8.359 1.00 0.00 C ATOM 776 C GLU A 489 -0.730 11.069 -9.347 1.00 0.00 C ATOM 777 O GLU A 489 -1.401 12.089 -9.201 1.00 0.00 O ATOM 778 CB GLU A 489 1.800 11.223 -8.768 1.00 0.00 C ATOM 779 CG GLU A 489 1.836 12.640 -9.300 1.00 0.00 C ATOM 780 CD GLU A 489 3.257 13.230 -9.353 1.00 0.00 C ATOM 781 OE1 GLU A 489 3.885 13.377 -8.276 1.00 0.00 O ATOM 782 OE2 GLU A 489 3.731 13.581 -10.458 1.00 0.00 O ATOM 0 H GLU A 489 1.450 9.030 -8.694 1.00 0.00 H new ATOM 0 HA GLU A 489 0.051 11.283 -7.475 1.00 0.00 H new ATOM 0 HB2 GLU A 489 2.465 11.151 -7.908 1.00 0.00 H new ATOM 0 HB3 GLU A 489 2.190 10.548 -9.530 1.00 0.00 H new ATOM 0 HG2 GLU A 489 1.405 12.657 -10.301 1.00 0.00 H new ATOM 0 HG3 GLU A 489 1.209 13.273 -8.672 1.00 0.00 H new ATOM 789 N LYS A 490 -1.045 10.158 -10.276 1.00 0.00 N ATOM 790 CA LYS A 490 -2.236 10.221 -11.127 1.00 0.00 C ATOM 791 C LYS A 490 -3.526 9.853 -10.377 1.00 0.00 C ATOM 792 O LYS A 490 -4.615 10.189 -10.846 1.00 0.00 O ATOM 793 CB LYS A 490 -2.002 9.350 -12.364 1.00 0.00 C ATOM 794 CG LYS A 490 -0.705 9.616 -13.125 1.00 0.00 C ATOM 795 CD LYS A 490 -0.444 11.065 -13.503 1.00 0.00 C ATOM 796 CE LYS A 490 1.034 11.160 -13.903 1.00 0.00 C ATOM 797 NZ LYS A 490 1.448 12.507 -14.363 1.00 0.00 N ATOM 0 H LYS A 490 -0.465 9.339 -10.460 1.00 0.00 H new ATOM 0 HA LYS A 490 -2.389 11.253 -11.443 1.00 0.00 H new ATOM 0 HB2 LYS A 490 -2.014 8.304 -12.057 1.00 0.00 H new ATOM 0 HB3 LYS A 490 -2.839 9.491 -13.048 1.00 0.00 H new ATOM 0 HG2 LYS A 490 0.129 9.263 -12.518 1.00 0.00 H new ATOM 0 HG3 LYS A 490 -0.712 9.018 -14.036 1.00 0.00 H new ATOM 0 HD2 LYS A 490 -1.088 11.371 -14.327 1.00 0.00 H new ATOM 0 HD3 LYS A 490 -0.661 11.728 -12.666 1.00 0.00 H new ATOM 0 HE2 LYS A 490 1.650 10.873 -13.051 1.00 0.00 H new ATOM 0 HE3 LYS A 490 1.232 10.439 -14.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 2.476 12.520 -14.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 0.961 12.735 -15.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 1.198 13.212 -13.641 1.00 0.00 H new ATOM 811 N LYS A 491 -3.418 9.212 -9.199 1.00 0.00 N ATOM 812 CA LYS A 491 -4.505 9.009 -8.231 1.00 0.00 C ATOM 813 C LYS A 491 -4.657 10.255 -7.380 1.00 0.00 C ATOM 814 O LYS A 491 -5.719 10.872 -7.344 1.00 0.00 O ATOM 815 CB LYS A 491 -4.290 7.697 -7.439 1.00 0.00 C ATOM 816 CG LYS A 491 -4.255 6.414 -8.291 1.00 0.00 C ATOM 817 CD LYS A 491 -5.426 6.355 -9.275 1.00 0.00 C ATOM 818 CE LYS A 491 -5.511 5.029 -10.041 1.00 0.00 C ATOM 819 NZ LYS A 491 -6.466 4.069 -9.425 1.00 0.00 N ATOM 0 H LYS A 491 -2.536 8.807 -8.886 1.00 0.00 H new ATOM 0 HA LYS A 491 -5.460 8.872 -8.739 1.00 0.00 H new ATOM 0 HB2 LYS A 491 -3.353 7.774 -6.888 1.00 0.00 H new ATOM 0 HB3 LYS A 491 -5.087 7.602 -6.701 1.00 0.00 H new ATOM 0 HG2 LYS A 491 -3.315 6.368 -8.841 1.00 0.00 H new ATOM 0 HG3 LYS A 491 -4.285 5.542 -7.637 1.00 0.00 H new ATOM 0 HD2 LYS A 491 -6.357 6.512 -8.730 1.00 0.00 H new ATOM 0 HD3 LYS A 491 -5.333 7.173 -9.989 1.00 0.00 H new ATOM 0 HE2 LYS A 491 -5.814 5.227 -11.069 1.00 0.00 H new ATOM 0 HE3 LYS A 491 -4.521 4.574 -10.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 491 -6.304 3.119 -9.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 491 -6.323 4.049 -8.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 491 -7.440 4.367 -9.633 1.00 0.00 H new ATOM 833 N GLY A 492 -3.550 10.660 -6.783 1.00 0.00 N ATOM 834 CA GLY A 492 -3.366 11.964 -6.184 1.00 0.00 C ATOM 835 C GLY A 492 -2.581 11.978 -4.899 1.00 0.00 C ATOM 836 O GLY A 492 -2.795 12.804 -4.015 1.00 0.00 O ATOM 0 H GLY A 492 -2.726 10.065 -6.701 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -2.863 12.609 -6.905 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -4.347 12.401 -5.996 1.00 0.00 H new ATOM 840 N VAL A 493 -1.616 11.070 -4.848 1.00 0.00 N ATOM 841 CA VAL A 493 -0.560 11.059 -3.855 1.00 0.00 C ATOM 842 C VAL A 493 0.284 12.345 -3.962 1.00 0.00 C ATOM 843 O VAL A 493 0.698 12.940 -2.975 1.00 0.00 O ATOM 844 CB VAL A 493 0.222 9.763 -4.054 1.00 0.00 C ATOM 845 CG1 VAL A 493 1.409 9.812 -3.143 1.00 0.00 C ATOM 846 CG2 VAL A 493 -0.709 8.578 -3.756 1.00 0.00 C ATOM 0 H VAL A 493 -1.548 10.302 -5.516 1.00 0.00 H new ATOM 0 HA VAL A 493 -0.942 11.067 -2.834 1.00 0.00 H new ATOM 0 HB VAL A 493 0.579 9.642 -5.077 1.00 0.00 H new ATOM 0 HG11 VAL A 493 1.994 8.899 -3.258 1.00 0.00 H new ATOM 0 HG12 VAL A 493 2.027 10.673 -3.397 1.00 0.00 H new ATOM 0 HG13 VAL A 493 1.072 9.899 -2.110 1.00 0.00 H new ATOM 0 HG21 VAL A 493 -0.164 7.644 -3.894 1.00 0.00 H new ATOM 0 HG22 VAL A 493 -1.063 8.643 -2.727 1.00 0.00 H new ATOM 0 HG23 VAL A 493 -1.561 8.605 -4.435 1.00 0.00 H new ATOM 856 N LEU A 494 0.477 12.780 -5.204 1.00 0.00 N ATOM 857 CA LEU A 494 0.975 14.064 -5.720 1.00 0.00 C ATOM 858 C LEU A 494 2.243 14.701 -5.158 1.00 0.00 C ATOM 859 O LEU A 494 2.526 15.892 -5.314 1.00 0.00 O ATOM 860 CB LEU A 494 -0.200 15.027 -5.799 1.00 0.00 C ATOM 861 CG LEU A 494 -0.903 14.672 -7.109 1.00 0.00 C ATOM 862 CD1 LEU A 494 -2.369 14.883 -6.940 1.00 0.00 C ATOM 863 CD2 LEU A 494 -0.306 15.457 -8.263 1.00 0.00 C ATOM 0 H LEU A 494 0.259 12.158 -5.983 1.00 0.00 H new ATOM 0 HA LEU A 494 1.385 13.805 -6.696 1.00 0.00 H new ATOM 0 HB2 LEU A 494 -0.868 14.908 -4.946 1.00 0.00 H new ATOM 0 HB3 LEU A 494 0.137 16.064 -5.798 1.00 0.00 H new ATOM 0 HG LEU A 494 -0.749 13.622 -7.357 1.00 0.00 H new ATOM 0 HD11 LEU A 494 -2.882 14.633 -7.869 1.00 0.00 H new ATOM 0 HD12 LEU A 494 -2.738 14.244 -6.138 1.00 0.00 H new ATOM 0 HD13 LEU A 494 -2.560 15.927 -6.690 1.00 0.00 H new ATOM 0 HD21 LEU A 494 -0.819 15.191 -9.187 1.00 0.00 H new ATOM 0 HD22 LEU A 494 -0.424 16.524 -8.076 1.00 0.00 H new ATOM 0 HD23 LEU A 494 0.754 15.220 -8.355 1.00 0.00 H new ATOM 875 N ALA A 495 3.014 13.861 -4.509 1.00 0.00 N ATOM 876 CA ALA A 495 4.206 14.211 -3.751 1.00 0.00 C ATOM 877 C ALA A 495 5.174 13.056 -3.790 1.00 0.00 C ATOM 878 O ALA A 495 4.799 11.950 -3.413 1.00 0.00 O ATOM 879 CB ALA A 495 3.798 14.486 -2.300 1.00 0.00 C ATOM 0 H ALA A 495 2.822 12.859 -4.491 1.00 0.00 H new ATOM 0 HA ALA A 495 4.680 15.095 -4.179 1.00 0.00 H new ATOM 0 HB1 ALA A 495 4.681 14.750 -1.718 1.00 0.00 H new ATOM 0 HB2 ALA A 495 3.085 15.310 -2.272 1.00 0.00 H new ATOM 0 HB3 ALA A 495 3.337 13.594 -1.876 1.00 0.00 H new ATOM 885 N LEU A 496 6.421 13.306 -4.191 1.00 0.00 N ATOM 886 CA LEU A 496 7.442 12.269 -4.160 1.00 0.00 C ATOM 887 C LEU A 496 7.598 11.661 -2.775 1.00 0.00 C ATOM 888 O LEU A 496 7.506 10.447 -2.660 1.00 0.00 O ATOM 889 CB LEU A 496 8.733 12.739 -4.781 1.00 0.00 C ATOM 890 CG LEU A 496 9.841 11.664 -4.656 1.00 0.00 C ATOM 891 CD1 LEU A 496 9.587 10.423 -5.517 1.00 0.00 C ATOM 892 CD2 LEU A 496 11.192 12.217 -5.053 1.00 0.00 C ATOM 0 H LEU A 496 6.742 14.210 -4.537 1.00 0.00 H new ATOM 0 HA LEU A 496 7.103 11.446 -4.789 1.00 0.00 H new ATOM 0 HB2 LEU A 496 8.569 12.975 -5.832 1.00 0.00 H new ATOM 0 HB3 LEU A 496 9.059 13.659 -4.295 1.00 0.00 H new ATOM 0 HG LEU A 496 9.827 11.375 -3.605 1.00 0.00 H new ATOM 0 HD11 LEU A 496 10.402 9.712 -5.380 1.00 0.00 H new ATOM 0 HD12 LEU A 496 8.647 9.959 -5.218 1.00 0.00 H new ATOM 0 HD13 LEU A 496 9.531 10.713 -6.566 1.00 0.00 H new ATOM 0 HD21 LEU A 496 11.948 11.438 -4.954 1.00 0.00 H new ATOM 0 HD22 LEU A 496 11.156 12.558 -6.088 1.00 0.00 H new ATOM 0 HD23 LEU A 496 11.447 13.054 -4.404 1.00 0.00 H new ATOM 904 N GLY A 497 7.742 12.459 -1.715 1.00 0.00 N ATOM 905 CA GLY A 497 7.881 11.885 -0.374 1.00 0.00 C ATOM 906 C GLY A 497 6.633 11.214 0.193 1.00 0.00 C ATOM 907 O GLY A 497 6.671 10.669 1.296 1.00 0.00 O ATOM 0 H GLY A 497 7.765 13.478 -1.754 1.00 0.00 H new ATOM 0 HA2 GLY A 497 8.687 11.152 -0.395 1.00 0.00 H new ATOM 0 HA3 GLY A 497 8.188 12.677 0.310 1.00 0.00 H new ATOM 911 N ALA A 498 5.554 11.199 -0.583 1.00 0.00 N ATOM 912 CA ALA A 498 4.380 10.378 -0.330 1.00 0.00 C ATOM 913 C ALA A 498 4.423 9.124 -1.213 1.00 0.00 C ATOM 914 O ALA A 498 4.436 8.009 -0.703 1.00 0.00 O ATOM 915 CB ALA A 498 3.135 11.214 -0.571 1.00 0.00 C ATOM 0 H ALA A 498 5.472 11.771 -1.424 1.00 0.00 H new ATOM 0 HA ALA A 498 4.362 10.039 0.706 1.00 0.00 H new ATOM 0 HB1 ALA A 498 2.248 10.608 -0.384 1.00 0.00 H new ATOM 0 HB2 ALA A 498 3.137 12.072 0.102 1.00 0.00 H new ATOM 0 HB3 ALA A 498 3.125 11.563 -1.604 1.00 0.00 H new ATOM 921 N ARG A 499 4.516 9.282 -2.539 1.00 0.00 N ATOM 922 CA ARG A 499 4.581 8.169 -3.498 1.00 0.00 C ATOM 923 C ARG A 499 5.791 7.244 -3.258 1.00 0.00 C ATOM 924 O ARG A 499 5.616 6.043 -3.339 1.00 0.00 O ATOM 925 CB ARG A 499 4.413 8.657 -4.955 1.00 0.00 C ATOM 926 CG ARG A 499 5.508 9.601 -5.428 1.00 0.00 C ATOM 927 CD ARG A 499 5.058 10.575 -6.532 1.00 0.00 C ATOM 928 NE ARG A 499 6.139 11.380 -7.135 1.00 0.00 N ATOM 929 CZ ARG A 499 7.061 10.959 -7.984 1.00 0.00 C ATOM 930 NH1 ARG A 499 7.165 9.707 -8.306 1.00 0.00 N ATOM 931 NH2 ARG A 499 7.900 11.791 -8.532 1.00 0.00 N ATOM 0 H ARG A 499 4.549 10.199 -2.984 1.00 0.00 H new ATOM 0 HA ARG A 499 3.721 7.525 -3.314 1.00 0.00 H new ATOM 0 HB2 ARG A 499 4.386 7.790 -5.615 1.00 0.00 H new ATOM 0 HB3 ARG A 499 3.450 9.159 -5.049 1.00 0.00 H new ATOM 0 HG2 ARG A 499 5.872 10.176 -4.576 1.00 0.00 H new ATOM 0 HG3 ARG A 499 6.348 9.012 -5.797 1.00 0.00 H new ATOM 0 HD2 ARG A 499 4.568 10.004 -7.321 1.00 0.00 H new ATOM 0 HD3 ARG A 499 4.311 11.251 -6.116 1.00 0.00 H new ATOM 0 HE ARG A 499 6.179 12.364 -6.869 1.00 0.00 H new ATOM 0 HH11 ARG A 499 6.527 9.022 -7.902 1.00 0.00 H new ATOM 0 HH12 ARG A 499 7.885 9.408 -8.964 1.00 0.00 H new ATOM 0 HH21 ARG A 499 7.852 12.785 -8.308 1.00 0.00 H new ATOM 0 HH22 ARG A 499 8.605 11.449 -9.185 1.00 0.00 H new ATOM 945 N ARG A 500 6.975 7.720 -2.843 1.00 0.00 N ATOM 946 CA ARG A 500 8.194 6.941 -2.520 1.00 0.00 C ATOM 947 C ARG A 500 8.038 6.238 -1.169 1.00 0.00 C ATOM 948 O ARG A 500 8.452 5.095 -0.999 1.00 0.00 O ATOM 949 CB ARG A 500 9.319 7.970 -2.487 1.00 0.00 C ATOM 950 CG ARG A 500 10.617 7.460 -1.893 1.00 0.00 C ATOM 951 CD ARG A 500 11.612 8.607 -2.024 1.00 0.00 C ATOM 952 NE ARG A 500 12.914 8.287 -1.406 1.00 0.00 N ATOM 953 CZ ARG A 500 13.928 7.623 -1.935 1.00 0.00 C ATOM 954 NH1 ARG A 500 13.890 7.140 -3.146 1.00 0.00 N ATOM 955 NH2 ARG A 500 15.015 7.428 -1.247 1.00 0.00 N ATOM 0 H ARG A 500 7.122 8.721 -2.714 1.00 0.00 H new ATOM 0 HA ARG A 500 8.392 6.154 -3.248 1.00 0.00 H new ATOM 0 HB2 ARG A 500 9.509 8.315 -3.503 1.00 0.00 H new ATOM 0 HB3 ARG A 500 8.987 8.835 -1.914 1.00 0.00 H new ATOM 0 HG2 ARG A 500 10.484 7.175 -0.849 1.00 0.00 H new ATOM 0 HG3 ARG A 500 10.969 6.575 -2.423 1.00 0.00 H new ATOM 0 HD2 ARG A 500 11.759 8.840 -3.079 1.00 0.00 H new ATOM 0 HD3 ARG A 500 11.199 9.500 -1.555 1.00 0.00 H new ATOM 0 HE ARG A 500 13.048 8.620 -0.451 1.00 0.00 H new ATOM 0 HH11 ARG A 500 13.057 7.269 -3.721 1.00 0.00 H new ATOM 0 HH12 ARG A 500 14.693 6.633 -3.518 1.00 0.00 H new ATOM 0 HH21 ARG A 500 15.088 7.788 -0.295 1.00 0.00 H new ATOM 0 HH22 ARG A 500 15.794 6.915 -1.659 1.00 0.00 H new ATOM 969 N LYS A 501 7.388 6.888 -0.200 1.00 0.00 N ATOM 970 CA LYS A 501 6.894 6.179 0.998 1.00 0.00 C ATOM 971 C LYS A 501 5.997 5.032 0.601 1.00 0.00 C ATOM 972 O LYS A 501 5.984 3.981 1.235 1.00 0.00 O ATOM 973 CB LYS A 501 6.001 7.119 1.801 1.00 0.00 C ATOM 974 CG LYS A 501 6.210 7.171 3.324 1.00 0.00 C ATOM 975 CD LYS A 501 7.660 7.323 3.820 1.00 0.00 C ATOM 976 CE LYS A 501 8.444 8.521 3.262 1.00 0.00 C ATOM 977 NZ LYS A 501 7.870 9.826 3.680 1.00 0.00 N ATOM 0 H LYS A 501 7.190 7.889 -0.214 1.00 0.00 H new ATOM 0 HA LYS A 501 7.762 5.834 1.560 1.00 0.00 H new ATOM 0 HB2 LYS A 501 6.135 8.127 1.409 1.00 0.00 H new ATOM 0 HB3 LYS A 501 4.964 6.840 1.613 1.00 0.00 H new ATOM 0 HG2 LYS A 501 5.627 8.003 3.719 1.00 0.00 H new ATOM 0 HG3 LYS A 501 5.797 6.259 3.755 1.00 0.00 H new ATOM 0 HD2 LYS A 501 7.644 7.400 4.907 1.00 0.00 H new ATOM 0 HD3 LYS A 501 8.204 6.412 3.573 1.00 0.00 H new ATOM 0 HE2 LYS A 501 9.480 8.460 3.597 1.00 0.00 H new ATOM 0 HE3 LYS A 501 8.457 8.466 2.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 7.498 10.325 2.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 7.099 9.665 4.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 8.610 10.404 4.127 1.00 0.00 H new ATOM 991 N LEU A 502 5.219 5.261 -0.449 1.00 0.00 N ATOM 992 CA LEU A 502 4.342 4.238 -0.928 1.00 0.00 C ATOM 993 C LEU A 502 5.118 3.151 -1.691 1.00 0.00 C ATOM 994 O LEU A 502 4.704 2.002 -1.662 1.00 0.00 O ATOM 995 CB LEU A 502 3.224 4.809 -1.798 1.00 0.00 C ATOM 996 CG LEU A 502 1.879 4.935 -1.055 1.00 0.00 C ATOM 997 CD1 LEU A 502 1.946 6.007 0.028 1.00 0.00 C ATOM 998 CD2 LEU A 502 0.757 5.344 -2.006 1.00 0.00 C ATOM 0 H LEU A 502 5.187 6.138 -0.969 1.00 0.00 H new ATOM 0 HA LEU A 502 3.880 3.780 -0.053 1.00 0.00 H new ATOM 0 HB2 LEU A 502 3.523 5.791 -2.164 1.00 0.00 H new ATOM 0 HB3 LEU A 502 3.091 4.171 -2.672 1.00 0.00 H new ATOM 0 HG LEU A 502 1.679 3.956 -0.620 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.983 6.073 0.535 1.00 0.00 H new ATOM 0 HD12 LEU A 502 2.719 5.746 0.751 1.00 0.00 H new ATOM 0 HD13 LEU A 502 2.184 6.969 -0.426 1.00 0.00 H new ATOM 0 HD21 LEU A 502 -0.178 5.424 -1.452 1.00 0.00 H new ATOM 0 HD22 LEU A 502 0.995 6.307 -2.457 1.00 0.00 H new ATOM 0 HD23 LEU A 502 0.652 4.593 -2.789 1.00 0.00 H new ATOM 1010 N LEU A 503 6.258 3.468 -2.328 1.00 0.00 N ATOM 1011 CA LEU A 503 7.124 2.527 -3.016 1.00 0.00 C ATOM 1012 C LEU A 503 7.638 1.499 -2.004 1.00 0.00 C ATOM 1013 O LEU A 503 7.642 0.299 -2.285 1.00 0.00 O ATOM 1014 CB LEU A 503 8.336 3.255 -3.654 1.00 0.00 C ATOM 1015 CG LEU A 503 8.187 3.778 -5.082 1.00 0.00 C ATOM 1016 CD1 LEU A 503 7.010 4.662 -5.442 1.00 0.00 C ATOM 1017 CD2 LEU A 503 9.477 4.432 -5.581 1.00 0.00 C ATOM 0 H LEU A 503 6.605 4.426 -2.373 1.00 0.00 H new ATOM 0 HA LEU A 503 6.555 2.039 -3.807 1.00 0.00 H new ATOM 0 HB2 LEU A 503 8.593 4.099 -3.014 1.00 0.00 H new ATOM 0 HB3 LEU A 503 9.184 2.571 -3.636 1.00 0.00 H new ATOM 0 HG LEU A 503 7.958 2.846 -5.599 1.00 0.00 H new ATOM 0 HD11 LEU A 503 7.070 4.936 -6.495 1.00 0.00 H new ATOM 0 HD12 LEU A 503 6.081 4.123 -5.259 1.00 0.00 H new ATOM 0 HD13 LEU A 503 7.032 5.564 -4.831 1.00 0.00 H new ATOM 0 HD21 LEU A 503 9.332 4.792 -6.600 1.00 0.00 H new ATOM 0 HD22 LEU A 503 9.734 5.270 -4.933 1.00 0.00 H new ATOM 0 HD23 LEU A 503 10.285 3.701 -5.566 1.00 0.00 H new ATOM 1029 N LYS A 504 8.015 1.986 -0.807 1.00 0.00 N ATOM 1030 CA LYS A 504 8.324 1.161 0.364 1.00 0.00 C ATOM 1031 C LYS A 504 7.168 0.205 0.646 1.00 0.00 C ATOM 1032 O LYS A 504 7.311 -1.012 0.569 1.00 0.00 O ATOM 1033 CB LYS A 504 8.633 2.038 1.602 1.00 0.00 C ATOM 1034 CG LYS A 504 8.873 1.263 2.912 1.00 0.00 C ATOM 1035 CD LYS A 504 8.409 2.017 4.173 1.00 0.00 C ATOM 1036 CE LYS A 504 6.884 1.939 4.443 1.00 0.00 C ATOM 1037 NZ LYS A 504 6.603 2.133 5.892 1.00 0.00 N ATOM 0 H LYS A 504 8.114 2.985 -0.629 1.00 0.00 H new ATOM 0 HA LYS A 504 9.218 0.576 0.149 1.00 0.00 H new ATOM 0 HB2 LYS A 504 9.515 2.641 1.389 1.00 0.00 H new ATOM 0 HB3 LYS A 504 7.804 2.729 1.754 1.00 0.00 H new ATOM 0 HG2 LYS A 504 8.352 0.307 2.859 1.00 0.00 H new ATOM 0 HG3 LYS A 504 9.936 1.041 3.003 1.00 0.00 H new ATOM 0 HD2 LYS A 504 8.939 1.616 5.037 1.00 0.00 H new ATOM 0 HD3 LYS A 504 8.696 3.065 4.081 1.00 0.00 H new ATOM 0 HE2 LYS A 504 6.366 2.701 3.860 1.00 0.00 H new ATOM 0 HE3 LYS A 504 6.500 0.972 4.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 504 5.578 2.078 6.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 504 7.082 1.391 6.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 504 6.952 3.066 6.192 1.00 0.00 H new ATOM 1051 N ALA A 505 6.017 0.788 0.973 1.00 0.00 N ATOM 1052 CA ALA A 505 4.800 0.121 1.397 1.00 0.00 C ATOM 1053 C ALA A 505 4.440 -1.010 0.422 1.00 0.00 C ATOM 1054 O ALA A 505 4.297 -2.183 0.797 1.00 0.00 O ATOM 1055 CB ALA A 505 3.738 1.221 1.505 1.00 0.00 C ATOM 0 H ALA A 505 5.908 1.802 0.945 1.00 0.00 H new ATOM 0 HA ALA A 505 4.900 -0.376 2.362 1.00 0.00 H new ATOM 0 HB1 ALA A 505 2.792 0.783 1.822 1.00 0.00 H new ATOM 0 HB2 ALA A 505 4.057 1.964 2.236 1.00 0.00 H new ATOM 0 HB3 ALA A 505 3.609 1.699 0.534 1.00 0.00 H new ATOM 1061 N PHE A 506 4.413 -0.633 -0.860 1.00 0.00 N ATOM 1062 CA PHE A 506 4.157 -1.502 -1.977 1.00 0.00 C ATOM 1063 C PHE A 506 5.143 -2.633 -2.013 1.00 0.00 C ATOM 1064 O PHE A 506 4.720 -3.758 -1.809 1.00 0.00 O ATOM 1065 CB PHE A 506 4.156 -0.749 -3.307 1.00 0.00 C ATOM 1066 CG PHE A 506 2.992 0.186 -3.522 1.00 0.00 C ATOM 1067 CD1 PHE A 506 1.905 0.235 -2.628 1.00 0.00 C ATOM 1068 CD2 PHE A 506 2.985 0.979 -4.677 1.00 0.00 C ATOM 1069 CE1 PHE A 506 0.832 1.104 -2.860 1.00 0.00 C ATOM 1070 CE2 PHE A 506 1.889 1.811 -4.936 1.00 0.00 C ATOM 1071 CZ PHE A 506 0.821 1.882 -4.026 1.00 0.00 C ATOM 0 H PHE A 506 4.578 0.333 -1.144 1.00 0.00 H new ATOM 0 HA PHE A 506 3.157 -1.913 -1.836 1.00 0.00 H new ATOM 0 HB2 PHE A 506 5.079 -0.175 -3.380 1.00 0.00 H new ATOM 0 HB3 PHE A 506 4.169 -1.478 -4.117 1.00 0.00 H new ATOM 0 HD1 PHE A 506 1.899 -0.403 -1.756 1.00 0.00 H new ATOM 0 HD2 PHE A 506 3.819 0.949 -5.363 1.00 0.00 H new ATOM 0 HE1 PHE A 506 0.022 1.174 -2.149 1.00 0.00 H new ATOM 0 HE2 PHE A 506 1.865 2.401 -5.840 1.00 0.00 H new ATOM 0 HZ PHE A 506 -0.012 2.539 -4.226 1.00 0.00 H new ATOM 1081 N GLY A 507 6.433 -2.402 -2.257 1.00 0.00 N ATOM 1082 CA GLY A 507 7.270 -3.554 -2.505 1.00 0.00 C ATOM 1083 C GLY A 507 7.590 -4.448 -1.314 1.00 0.00 C ATOM 1084 O GLY A 507 8.081 -5.550 -1.536 1.00 0.00 O ATOM 0 H GLY A 507 6.889 -1.490 -2.286 1.00 0.00 H new ATOM 0 HA2 GLY A 507 6.787 -4.166 -3.267 1.00 0.00 H new ATOM 0 HA3 GLY A 507 8.212 -3.203 -2.928 1.00 0.00 H new ATOM 1088 N ILE A 508 7.262 -4.044 -0.079 1.00 0.00 N ATOM 1089 CA ILE A 508 7.234 -4.992 1.038 1.00 0.00 C ATOM 1090 C ILE A 508 6.041 -5.915 0.785 1.00 0.00 C ATOM 1091 O ILE A 508 6.242 -7.117 0.712 1.00 0.00 O ATOM 1092 CB ILE A 508 7.160 -4.331 2.435 1.00 0.00 C ATOM 1093 CG1 ILE A 508 8.546 -3.918 2.983 1.00 0.00 C ATOM 1094 CG2 ILE A 508 6.596 -5.318 3.483 1.00 0.00 C ATOM 1095 CD1 ILE A 508 9.218 -2.738 2.287 1.00 0.00 C ATOM 0 H ILE A 508 7.017 -3.085 0.167 1.00 0.00 H new ATOM 0 HA ILE A 508 8.176 -5.540 1.067 1.00 0.00 H new ATOM 0 HB ILE A 508 6.525 -3.456 2.293 1.00 0.00 H new ATOM 0 HG12 ILE A 508 8.439 -3.677 4.041 1.00 0.00 H new ATOM 0 HG13 ILE A 508 9.211 -4.779 2.918 1.00 0.00 H new ATOM 0 HG21 ILE A 508 6.554 -4.830 4.457 1.00 0.00 H new ATOM 0 HG22 ILE A 508 5.593 -5.628 3.189 1.00 0.00 H new ATOM 0 HG23 ILE A 508 7.243 -6.193 3.544 1.00 0.00 H new ATOM 0 HD11 ILE A 508 10.182 -2.540 2.756 1.00 0.00 H new ATOM 0 HD12 ILE A 508 9.368 -2.974 1.234 1.00 0.00 H new ATOM 0 HD13 ILE A 508 8.584 -1.855 2.374 1.00 0.00 H new ATOM 1107 N VAL A 509 4.816 -5.408 0.580 1.00 0.00 N ATOM 1108 CA VAL A 509 3.662 -6.291 0.357 1.00 0.00 C ATOM 1109 C VAL A 509 3.790 -7.037 -0.971 1.00 0.00 C ATOM 1110 O VAL A 509 3.369 -8.180 -1.064 1.00 0.00 O ATOM 1111 CB VAL A 509 2.331 -5.549 0.521 1.00 0.00 C ATOM 1112 CG1 VAL A 509 2.063 -4.527 -0.553 1.00 0.00 C ATOM 1113 CG2 VAL A 509 1.131 -6.490 0.553 1.00 0.00 C ATOM 0 H VAL A 509 4.601 -4.411 0.564 1.00 0.00 H new ATOM 0 HA VAL A 509 3.662 -7.053 1.136 1.00 0.00 H new ATOM 0 HB VAL A 509 2.446 -5.042 1.479 1.00 0.00 H new ATOM 0 HG11 VAL A 509 1.103 -4.046 -0.366 1.00 0.00 H new ATOM 0 HG12 VAL A 509 2.853 -3.776 -0.546 1.00 0.00 H new ATOM 0 HG13 VAL A 509 2.039 -5.019 -1.525 1.00 0.00 H new ATOM 0 HG21 VAL A 509 0.216 -5.909 0.671 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.086 -7.053 -0.379 1.00 0.00 H new ATOM 0 HG23 VAL A 509 1.233 -7.181 1.390 1.00 0.00 H new ATOM 1123 N ILE A 510 4.458 -6.467 -1.979 1.00 0.00 N ATOM 1124 CA ILE A 510 4.850 -7.179 -3.204 1.00 0.00 C ATOM 1125 C ILE A 510 5.711 -8.401 -2.906 1.00 0.00 C ATOM 1126 O ILE A 510 5.446 -9.472 -3.442 1.00 0.00 O ATOM 1127 CB ILE A 510 5.448 -6.276 -4.273 1.00 0.00 C ATOM 1128 CG1 ILE A 510 4.306 -5.346 -4.750 1.00 0.00 C ATOM 1129 CG2 ILE A 510 6.060 -7.058 -5.454 1.00 0.00 C ATOM 1130 CD1 ILE A 510 4.697 -4.366 -5.848 1.00 0.00 C ATOM 0 H ILE A 510 4.746 -5.488 -1.969 1.00 0.00 H new ATOM 0 HA ILE A 510 3.923 -7.549 -3.642 1.00 0.00 H new ATOM 0 HB ILE A 510 6.279 -5.710 -3.853 1.00 0.00 H new ATOM 0 HG12 ILE A 510 3.481 -5.962 -5.109 1.00 0.00 H new ATOM 0 HG13 ILE A 510 3.934 -4.782 -3.894 1.00 0.00 H new ATOM 0 HG21 ILE A 510 6.469 -6.357 -6.181 1.00 0.00 H new ATOM 0 HG22 ILE A 510 6.856 -7.707 -5.088 1.00 0.00 H new ATOM 0 HG23 ILE A 510 5.288 -7.664 -5.928 1.00 0.00 H new ATOM 0 HD11 ILE A 510 3.834 -3.757 -6.117 1.00 0.00 H new ATOM 0 HD12 ILE A 510 5.499 -3.720 -5.491 1.00 0.00 H new ATOM 0 HD13 ILE A 510 5.039 -4.918 -6.724 1.00 0.00 H new ATOM 1142 N ASP A 511 6.657 -8.307 -1.975 1.00 0.00 N ATOM 1143 CA ASP A 511 7.593 -9.377 -1.575 1.00 0.00 C ATOM 1144 C ASP A 511 7.017 -10.470 -0.721 1.00 0.00 C ATOM 1145 O ASP A 511 7.693 -11.271 -0.079 1.00 0.00 O ATOM 1146 CB ASP A 511 8.745 -8.735 -0.830 1.00 0.00 C ATOM 1147 CG ASP A 511 10.053 -9.544 -0.825 1.00 0.00 C ATOM 1148 OD1 ASP A 511 10.419 -10.106 -1.887 1.00 0.00 O ATOM 1149 OD2 ASP A 511 10.743 -9.582 0.222 1.00 0.00 O ATOM 0 H ASP A 511 6.806 -7.446 -1.449 1.00 0.00 H new ATOM 0 HA ASP A 511 7.894 -9.870 -2.500 1.00 0.00 H new ATOM 0 HB2 ASP A 511 8.942 -7.758 -1.271 1.00 0.00 H new ATOM 0 HB3 ASP A 511 8.439 -8.563 0.202 1.00 0.00 H new ATOM 1154 N TYR A 512 5.714 -10.459 -0.771 1.00 0.00 N ATOM 1155 CA TYR A 512 4.825 -11.128 0.101 1.00 0.00 C ATOM 1156 C TYR A 512 3.594 -11.570 -0.685 1.00 0.00 C ATOM 1157 O TYR A 512 3.017 -12.601 -0.392 1.00 0.00 O ATOM 1158 CB TYR A 512 4.440 -10.101 1.154 1.00 0.00 C ATOM 1159 CG TYR A 512 5.056 -10.053 2.535 1.00 0.00 C ATOM 1160 CD1 TYR A 512 6.302 -9.421 2.685 1.00 0.00 C ATOM 1161 CD2 TYR A 512 4.333 -10.443 3.674 1.00 0.00 C ATOM 1162 CE1 TYR A 512 6.859 -9.203 3.954 1.00 0.00 C ATOM 1163 CE2 TYR A 512 4.907 -10.290 4.954 1.00 0.00 C ATOM 1164 CZ TYR A 512 6.170 -9.668 5.098 1.00 0.00 C ATOM 1165 OH TYR A 512 6.698 -9.482 6.338 1.00 0.00 O ATOM 0 H TYR A 512 5.217 -9.933 -1.490 1.00 0.00 H new ATOM 0 HA TYR A 512 5.270 -12.014 0.554 1.00 0.00 H new ATOM 0 HB2 TYR A 512 4.613 -9.122 0.706 1.00 0.00 H new ATOM 0 HB3 TYR A 512 3.364 -10.199 1.300 1.00 0.00 H new ATOM 0 HD1 TYR A 512 6.841 -9.097 1.807 1.00 0.00 H new ATOM 0 HD2 TYR A 512 3.341 -10.858 3.571 1.00 0.00 H new ATOM 0 HE1 TYR A 512 7.802 -8.687 4.056 1.00 0.00 H new ATOM 0 HE2 TYR A 512 4.381 -10.649 5.826 1.00 0.00 H new ATOM 0 HH TYR A 512 6.095 -9.861 7.011 1.00 0.00 H new ATOM 1175 N LYS A 513 3.197 -10.835 -1.726 1.00 0.00 N ATOM 1176 CA LYS A 513 2.046 -11.140 -2.570 1.00 0.00 C ATOM 1177 C LYS A 513 2.504 -11.887 -3.804 1.00 0.00 C ATOM 1178 O LYS A 513 1.950 -12.925 -4.152 1.00 0.00 O ATOM 1179 CB LYS A 513 1.378 -9.796 -2.844 1.00 0.00 C ATOM 1180 CG LYS A 513 0.364 -9.726 -3.978 1.00 0.00 C ATOM 1181 CD LYS A 513 1.034 -9.627 -5.351 1.00 0.00 C ATOM 1182 CE LYS A 513 0.042 -9.224 -6.441 1.00 0.00 C ATOM 1183 NZ LYS A 513 -0.855 -10.338 -6.847 1.00 0.00 N ATOM 0 H LYS A 513 3.684 -9.986 -2.011 1.00 0.00 H new ATOM 0 HA LYS A 513 1.318 -11.805 -2.106 1.00 0.00 H new ATOM 0 HB2 LYS A 513 0.880 -9.477 -1.929 1.00 0.00 H new ATOM 0 HB3 LYS A 513 2.162 -9.068 -3.050 1.00 0.00 H new ATOM 0 HG2 LYS A 513 -0.272 -10.611 -3.949 1.00 0.00 H new ATOM 0 HG3 LYS A 513 -0.285 -8.863 -3.830 1.00 0.00 H new ATOM 0 HD2 LYS A 513 1.843 -8.898 -5.309 1.00 0.00 H new ATOM 0 HD3 LYS A 513 1.483 -10.587 -5.606 1.00 0.00 H new ATOM 0 HE2 LYS A 513 -0.562 -8.389 -6.085 1.00 0.00 H new ATOM 0 HE3 LYS A 513 0.592 -8.871 -7.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 -1.205 -10.168 -7.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 -0.328 -11.234 -6.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 -1.660 -10.392 -6.191 1.00 0.00 H new ATOM 1197 N GLU A 514 3.573 -11.385 -4.427 1.00 0.00 N ATOM 1198 CA GLU A 514 4.325 -12.080 -5.467 1.00 0.00 C ATOM 1199 C GLU A 514 5.020 -13.337 -4.888 1.00 0.00 C ATOM 1200 O GLU A 514 5.604 -14.123 -5.636 1.00 0.00 O ATOM 1201 CB GLU A 514 5.329 -11.063 -6.044 1.00 0.00 C ATOM 1202 CG GLU A 514 5.753 -11.379 -7.481 1.00 0.00 C ATOM 1203 CD GLU A 514 6.708 -10.310 -8.053 1.00 0.00 C ATOM 1204 OE1 GLU A 514 7.946 -10.437 -7.877 1.00 0.00 O ATOM 1205 OE2 GLU A 514 6.229 -9.353 -8.709 1.00 0.00 O ATOM 0 H GLU A 514 3.947 -10.460 -4.214 1.00 0.00 H new ATOM 0 HA GLU A 514 3.672 -12.442 -6.261 1.00 0.00 H new ATOM 0 HB2 GLU A 514 4.885 -10.068 -6.014 1.00 0.00 H new ATOM 0 HB3 GLU A 514 6.214 -11.037 -5.409 1.00 0.00 H new ATOM 0 HG2 GLU A 514 6.242 -12.353 -7.508 1.00 0.00 H new ATOM 0 HG3 GLU A 514 4.867 -11.449 -8.113 1.00 0.00 H new ATOM 1212 N ARG A 515 4.964 -13.527 -3.552 1.00 0.00 N ATOM 1213 CA ARG A 515 5.579 -14.667 -2.820 1.00 0.00 C ATOM 1214 C ARG A 515 4.542 -15.632 -2.276 1.00 0.00 C ATOM 1215 O ARG A 515 4.623 -16.818 -2.591 1.00 0.00 O ATOM 1216 CB ARG A 515 6.523 -14.217 -1.691 1.00 0.00 C ATOM 1217 CG ARG A 515 7.929 -13.800 -2.150 1.00 0.00 C ATOM 1218 CD ARG A 515 7.820 -12.728 -3.227 1.00 0.00 C ATOM 1219 NE ARG A 515 9.071 -12.001 -3.474 1.00 0.00 N ATOM 1220 CZ ARG A 515 9.442 -11.485 -4.628 1.00 0.00 C ATOM 1221 NH1 ARG A 515 8.931 -11.882 -5.756 1.00 0.00 N ATOM 1222 NH2 ARG A 515 10.319 -10.530 -4.641 1.00 0.00 N ATOM 0 H ARG A 515 4.479 -12.878 -2.933 1.00 0.00 H new ATOM 0 HA ARG A 515 6.178 -15.191 -3.564 1.00 0.00 H new ATOM 0 HB2 ARG A 515 6.065 -13.379 -1.166 1.00 0.00 H new ATOM 0 HB3 ARG A 515 6.618 -15.030 -0.971 1.00 0.00 H new ATOM 0 HG2 ARG A 515 8.501 -13.422 -1.303 1.00 0.00 H new ATOM 0 HG3 ARG A 515 8.467 -14.665 -2.537 1.00 0.00 H new ATOM 0 HD2 ARG A 515 7.493 -13.193 -4.157 1.00 0.00 H new ATOM 0 HD3 ARG A 515 7.048 -12.015 -2.938 1.00 0.00 H new ATOM 0 HE ARG A 515 9.707 -11.885 -2.685 1.00 0.00 H new ATOM 0 HH11 ARG A 515 8.221 -12.614 -5.765 1.00 0.00 H new ATOM 0 HH12 ARG A 515 9.241 -11.461 -6.632 1.00 0.00 H new ATOM 0 HH21 ARG A 515 10.713 -10.187 -3.765 1.00 0.00 H new ATOM 0 HH22 ARG A 515 10.615 -10.122 -5.528 1.00 0.00 H new ATOM 1236 N ASP A 516 3.621 -15.104 -1.467 1.00 0.00 N ATOM 1237 CA ASP A 516 2.408 -15.719 -0.887 1.00 0.00 C ATOM 1238 C ASP A 516 2.552 -15.879 0.642 1.00 0.00 C ATOM 1239 O ASP A 516 2.582 -16.970 1.219 1.00 0.00 O ATOM 1240 CB ASP A 516 1.944 -16.992 -1.609 1.00 0.00 C ATOM 1241 CG ASP A 516 0.558 -17.498 -1.169 1.00 0.00 C ATOM 1242 OD1 ASP A 516 -0.186 -16.766 -0.473 1.00 0.00 O ATOM 1243 OD2 ASP A 516 0.207 -18.650 -1.520 1.00 0.00 O ATOM 0 H ASP A 516 3.709 -14.133 -1.166 1.00 0.00 H new ATOM 0 HA ASP A 516 1.586 -15.024 -1.059 1.00 0.00 H new ATOM 0 HB2 ASP A 516 1.925 -16.801 -2.682 1.00 0.00 H new ATOM 0 HB3 ASP A 516 2.677 -17.780 -1.439 1.00 0.00 H new ATOM 1248 N LEU A 517 2.692 -14.720 1.274 1.00 0.00 N ATOM 1249 CA LEU A 517 3.014 -14.401 2.666 1.00 0.00 C ATOM 1250 C LEU A 517 1.846 -13.669 3.361 1.00 0.00 C ATOM 1251 O LEU A 517 1.731 -13.695 4.587 1.00 0.00 O ATOM 1252 CB LEU A 517 4.272 -13.510 2.601 1.00 0.00 C ATOM 1253 CG LEU A 517 5.533 -14.165 1.998 1.00 0.00 C ATOM 1254 CD1 LEU A 517 6.795 -13.394 2.387 1.00 0.00 C ATOM 1255 CD2 LEU A 517 5.781 -15.617 2.404 1.00 0.00 C ATOM 0 H LEU A 517 2.564 -13.856 0.747 1.00 0.00 H new ATOM 0 HA LEU A 517 3.188 -15.303 3.253 1.00 0.00 H new ATOM 0 HB2 LEU A 517 4.034 -12.621 2.017 1.00 0.00 H new ATOM 0 HB3 LEU A 517 4.508 -13.174 3.611 1.00 0.00 H new ATOM 0 HG LEU A 517 5.332 -14.139 0.927 1.00 0.00 H new ATOM 0 HD11 LEU A 517 7.667 -13.879 1.948 1.00 0.00 H new ATOM 0 HD12 LEU A 517 6.724 -12.371 2.018 1.00 0.00 H new ATOM 0 HD13 LEU A 517 6.894 -13.382 3.472 1.00 0.00 H new ATOM 0 HD21 LEU A 517 6.691 -15.978 1.925 1.00 0.00 H new ATOM 0 HD22 LEU A 517 5.892 -15.678 3.487 1.00 0.00 H new ATOM 0 HD23 LEU A 517 4.937 -16.232 2.091 1.00 0.00 H new ATOM 1267 N ILE A 518 0.969 -13.038 2.569 1.00 0.00 N ATOM 1268 CA ILE A 518 -0.324 -12.465 2.981 1.00 0.00 C ATOM 1269 C ILE A 518 -1.276 -13.556 3.525 1.00 0.00 C ATOM 1270 O ILE A 518 -1.153 -14.733 3.188 1.00 0.00 O ATOM 1271 CB ILE A 518 -1.003 -11.750 1.784 1.00 0.00 C ATOM 1272 CG1 ILE A 518 -0.089 -11.088 0.737 1.00 0.00 C ATOM 1273 CG2 ILE A 518 -2.010 -10.704 2.271 1.00 0.00 C ATOM 1274 CD1 ILE A 518 0.759 -9.937 1.274 1.00 0.00 C ATOM 0 H ILE A 518 1.149 -12.906 1.574 1.00 0.00 H new ATOM 0 HA ILE A 518 -0.125 -11.746 3.776 1.00 0.00 H new ATOM 0 HB ILE A 518 -1.479 -12.580 1.262 1.00 0.00 H new ATOM 0 HG12 ILE A 518 0.573 -11.847 0.320 1.00 0.00 H new ATOM 0 HG13 ILE A 518 -0.705 -10.717 -0.082 1.00 0.00 H new ATOM 0 HG21 ILE A 518 -2.472 -10.217 1.413 1.00 0.00 H new ATOM 0 HG22 ILE A 518 -2.780 -11.191 2.870 1.00 0.00 H new ATOM 0 HG23 ILE A 518 -1.496 -9.959 2.878 1.00 0.00 H new ATOM 0 HD11 ILE A 518 1.371 -9.530 0.469 1.00 0.00 H new ATOM 0 HD12 ILE A 518 0.107 -9.156 1.664 1.00 0.00 H new ATOM 0 HD13 ILE A 518 1.405 -10.303 2.072 1.00 0.00 H new ATOM 1286 N ASP A 519 -2.282 -13.174 4.316 1.00 0.00 N ATOM 1287 CA ASP A 519 -3.185 -14.075 5.059 1.00 0.00 C ATOM 1288 C ASP A 519 -4.301 -14.791 4.261 1.00 0.00 C ATOM 1289 O ASP A 519 -5.242 -15.316 4.860 1.00 0.00 O ATOM 1290 CB ASP A 519 -3.738 -13.325 6.280 1.00 0.00 C ATOM 1291 CG ASP A 519 -2.622 -12.867 7.232 1.00 0.00 C ATOM 1292 OD1 ASP A 519 -2.190 -13.670 8.090 1.00 0.00 O ATOM 1293 OD2 ASP A 519 -2.177 -11.702 7.116 1.00 0.00 O ATOM 0 H ASP A 519 -2.504 -12.190 4.466 1.00 0.00 H new ATOM 0 HA ASP A 519 -2.562 -14.919 5.356 1.00 0.00 H new ATOM 0 HB2 ASP A 519 -4.307 -12.458 5.945 1.00 0.00 H new ATOM 0 HB3 ASP A 519 -4.431 -13.972 6.819 1.00 0.00 H new ATOM 1298 N ARG A 520 -4.218 -14.839 2.923 1.00 0.00 N ATOM 1299 CA ARG A 520 -5.106 -15.500 1.941 1.00 0.00 C ATOM 1300 C ARG A 520 -6.504 -14.889 1.823 1.00 0.00 C ATOM 1301 O ARG A 520 -7.061 -14.847 0.728 1.00 0.00 O ATOM 1302 CB ARG A 520 -5.155 -17.022 2.178 1.00 0.00 C ATOM 1303 CG ARG A 520 -4.266 -17.822 1.216 1.00 0.00 C ATOM 1304 CD ARG A 520 -2.764 -17.543 1.352 1.00 0.00 C ATOM 1305 NE ARG A 520 -2.229 -17.926 2.674 1.00 0.00 N ATOM 1306 CZ ARG A 520 -0.951 -17.938 3.008 1.00 0.00 C ATOM 1307 NH1 ARG A 520 -0.026 -17.611 2.158 1.00 0.00 N ATOM 1308 NH2 ARG A 520 -0.575 -18.299 4.203 1.00 0.00 N ATOM 0 H ARG A 520 -3.448 -14.368 2.447 1.00 0.00 H new ATOM 0 HA ARG A 520 -4.652 -15.314 0.968 1.00 0.00 H new ATOM 0 HB2 ARG A 520 -4.848 -17.232 3.203 1.00 0.00 H new ATOM 0 HB3 ARG A 520 -6.185 -17.364 2.077 1.00 0.00 H new ATOM 0 HG2 ARG A 520 -4.441 -18.885 1.380 1.00 0.00 H new ATOM 0 HG3 ARG A 520 -4.572 -17.603 0.193 1.00 0.00 H new ATOM 0 HD2 ARG A 520 -2.226 -18.087 0.576 1.00 0.00 H new ATOM 0 HD3 ARG A 520 -2.579 -16.482 1.184 1.00 0.00 H new ATOM 0 HE ARG A 520 -2.902 -18.204 3.388 1.00 0.00 H new ATOM 0 HH11 ARG A 520 -0.279 -17.337 1.209 1.00 0.00 H new ATOM 0 HH12 ARG A 520 0.954 -17.628 2.439 1.00 0.00 H new ATOM 0 HH21 ARG A 520 -1.271 -18.577 4.894 1.00 0.00 H new ATOM 0 HH22 ARG A 520 0.416 -18.303 4.446 1.00 0.00 H new ATOM 1322 N SER A 521 -7.017 -14.309 2.900 1.00 0.00 N ATOM 1323 CA SER A 521 -8.261 -13.531 2.945 1.00 0.00 C ATOM 1324 C SER A 521 -8.103 -12.068 2.500 1.00 0.00 C ATOM 1325 O SER A 521 -9.078 -11.312 2.495 1.00 0.00 O ATOM 1326 CB SER A 521 -8.848 -13.572 4.365 1.00 0.00 C ATOM 1327 OG SER A 521 -9.093 -14.908 4.783 1.00 0.00 O ATOM 0 H SER A 521 -6.561 -14.367 3.811 1.00 0.00 H new ATOM 0 HA SER A 521 -8.936 -14.000 2.229 1.00 0.00 H new ATOM 0 HB2 SER A 521 -8.159 -13.092 5.060 1.00 0.00 H new ATOM 0 HB3 SER A 521 -9.777 -13.003 4.393 1.00 0.00 H new ATOM 0 HG SER A 521 -9.464 -14.904 5.690 1.00 0.00 H new ATOM 1333 N ALA A 522 -6.888 -11.638 2.133 1.00 0.00 N ATOM 1334 CA ALA A 522 -6.620 -10.261 1.694 1.00 0.00 C ATOM 1335 C ALA A 522 -6.925 -10.082 0.210 1.00 0.00 C ATOM 1336 O ALA A 522 -7.273 -9.003 -0.255 1.00 0.00 O ATOM 1337 CB ALA A 522 -5.148 -9.966 1.914 1.00 0.00 C ATOM 0 H ALA A 522 -6.062 -12.236 2.132 1.00 0.00 H new ATOM 0 HA ALA A 522 -7.256 -9.585 2.266 1.00 0.00 H new ATOM 0 HB1 ALA A 522 -4.929 -8.947 1.594 1.00 0.00 H new ATOM 0 HB2 ALA A 522 -4.910 -10.073 2.972 1.00 0.00 H new ATOM 0 HB3 ALA A 522 -4.546 -10.666 1.334 1.00 0.00 H new ATOM 1343 N TYR A 523 -6.783 -11.167 -0.525 1.00 0.00 N ATOM 1344 CA TYR A 523 -7.069 -11.312 -1.931 1.00 0.00 C ATOM 1345 C TYR A 523 -8.576 -11.163 -2.263 1.00 0.00 C ATOM 1346 O TYR A 523 -9.406 -10.991 -1.334 1.00 0.00 O ATOM 1347 CB TYR A 523 -6.514 -12.708 -2.242 1.00 0.00 C ATOM 1348 CG TYR A 523 -4.999 -12.851 -2.193 1.00 0.00 C ATOM 1349 CD1 TYR A 523 -4.214 -12.557 -3.324 1.00 0.00 C ATOM 1350 CD2 TYR A 523 -4.375 -13.328 -1.025 1.00 0.00 C ATOM 1351 CE1 TYR A 523 -2.814 -12.733 -3.285 1.00 0.00 C ATOM 1352 CE2 TYR A 523 -2.983 -13.529 -0.984 1.00 0.00 C ATOM 1353 CZ TYR A 523 -2.193 -13.222 -2.113 1.00 0.00 C ATOM 1354 OH TYR A 523 -0.847 -13.409 -2.071 1.00 0.00 O ATOM 1355 OXT TYR A 523 -8.923 -11.197 -3.466 1.00 0.00 O ATOM 0 H TYR A 523 -6.437 -12.036 -0.118 1.00 0.00 H new ATOM 0 HA TYR A 523 -6.618 -10.531 -2.542 1.00 0.00 H new ATOM 0 HB2 TYR A 523 -6.949 -13.415 -1.536 1.00 0.00 H new ATOM 0 HB3 TYR A 523 -6.854 -12.999 -3.236 1.00 0.00 H new ATOM 0 HD1 TYR A 523 -4.685 -12.195 -4.226 1.00 0.00 H new ATOM 0 HD2 TYR A 523 -4.971 -13.542 -0.150 1.00 0.00 H new ATOM 0 HE1 TYR A 523 -2.216 -12.494 -4.152 1.00 0.00 H new ATOM 0 HE2 TYR A 523 -2.519 -13.918 -0.089 1.00 0.00 H new ATOM 0 HH TYR A 523 -0.591 -13.749 -1.188 1.00 0.00 H new TER 1365 TYR A 523