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= -0.689 USER MOD Set 1.2: A 513 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 443 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 512 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 475 THR OG1 : rot 120:sc= 0.626 USER MOD Set 3.2: A 491 LYS NZ :NH3+ 149:sc= 0.698 (180deg=0) USER MOD Set 4.1: A 467 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 468 TYR OH : rot 175:sc= 0 USER MOD Set 5.1: A 446 SER OG : rot 91:sc= 0.394 USER MOD Set 5.2: A 462 SER OG : rot 154:sc= 0.39 USER MOD Set 6.1: A 461 LYS NZ :NH3+ 167:sc= 0.738 (180deg=0) USER MOD Set 6.2: A 466 HIS : no HE2:sc= -1.15 K(o=-0.41,f=-4.2) USER MOD Set 7.1: A 455 ASN : amide:sc= -0.156 K(o=-1.1,f=-1.6) USER MOD Set 7.2: A 458 MET CE :methyl -171:sc= -0.909 (180deg=-1.33) USER MOD Single : A 445 LYS NZ :NH3+ -156:sc= 3.22 (180deg=2.26) USER MOD Single : A 448 THR OG1 : rot 179:sc= 0.0337 USER MOD Single : A 451 LYS NZ :NH3+ -161:sc= 1.17 (180deg=0.584) USER MOD Single : A 454 LYS NZ :NH3+ 155:sc= 1.18 (180deg=0.881) USER MOD Single : A 469 SER OG : rot 180:sc= 0.0181 USER MOD Single : A 473 SER OG : rot 180:sc= -0.0422 USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 LYS NZ :NH3+ 174:sc= 1.04 (180deg=1.01) 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 521 SER OG : rot 180:sc= 0 USER MOD Single : A 523 TYR OH : rot 40:sc= 1.2 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 443 8.220 -6.706 13.256 1.00 0.00 N ATOM 2 CA MET A 443 7.804 -6.375 11.867 1.00 0.00 C ATOM 3 C MET A 443 6.293 -6.102 11.824 1.00 0.00 C ATOM 4 O MET A 443 5.516 -7.004 12.144 1.00 0.00 O ATOM 5 CB MET A 443 8.209 -7.501 10.891 1.00 0.00 C ATOM 6 CG MET A 443 7.941 -7.163 9.419 1.00 0.00 C ATOM 7 SD MET A 443 8.847 -5.728 8.775 1.00 0.00 S ATOM 8 CE MET A 443 8.201 -5.707 7.080 1.00 0.00 C ATOM 0 HA MET A 443 8.320 -5.470 11.547 1.00 0.00 H new ATOM 0 HB2 MET A 443 9.270 -7.717 11.018 1.00 0.00 H new ATOM 0 HB3 MET A 443 7.665 -8.409 11.151 1.00 0.00 H new ATOM 0 HG2 MET A 443 8.192 -8.033 8.812 1.00 0.00 H new ATOM 0 HG3 MET A 443 6.873 -6.984 9.293 1.00 0.00 H new ATOM 0 HE1 MET A 443 8.652 -4.881 6.529 1.00 0.00 H new ATOM 0 HE2 MET A 443 8.444 -6.648 6.586 1.00 0.00 H new ATOM 0 HE3 MET A 443 7.119 -5.579 7.105 1.00 0.00 H new ATOM 18 N PRO A 444 5.845 -4.875 11.480 1.00 0.00 N ATOM 19 CA PRO A 444 4.430 -4.490 11.515 1.00 0.00 C ATOM 20 C PRO A 444 3.595 -5.162 10.408 1.00 0.00 C ATOM 21 O PRO A 444 3.586 -4.728 9.252 1.00 0.00 O ATOM 22 CB PRO A 444 4.420 -2.959 11.421 1.00 0.00 C ATOM 23 CG PRO A 444 5.696 -2.640 10.646 1.00 0.00 C ATOM 24 CD PRO A 444 6.665 -3.718 11.133 1.00 0.00 C ATOM 0 HA PRO A 444 3.954 -4.832 12.434 1.00 0.00 H new ATOM 0 HB2 PRO A 444 3.534 -2.595 10.902 1.00 0.00 H new ATOM 0 HB3 PRO A 444 4.424 -2.496 12.408 1.00 0.00 H new ATOM 0 HG2 PRO A 444 5.539 -2.694 9.569 1.00 0.00 H new ATOM 0 HG3 PRO A 444 6.063 -1.637 10.865 1.00 0.00 H new ATOM 0 HD2 PRO A 444 7.388 -3.971 10.357 1.00 0.00 H new ATOM 0 HD3 PRO A 444 7.233 -3.370 11.996 1.00 0.00 H new ATOM 32 N LYS A 445 2.830 -6.203 10.772 1.00 0.00 N ATOM 33 CA LYS A 445 1.825 -6.863 9.908 1.00 0.00 C ATOM 34 C LYS A 445 0.660 -5.975 9.494 1.00 0.00 C ATOM 35 O LYS A 445 -0.082 -6.326 8.580 1.00 0.00 O ATOM 36 CB LYS A 445 1.366 -8.189 10.550 1.00 0.00 C ATOM 37 CG LYS A 445 0.910 -9.223 9.505 1.00 0.00 C ATOM 38 CD LYS A 445 0.332 -10.483 10.160 1.00 0.00 C ATOM 39 CE LYS A 445 -0.093 -11.543 9.131 1.00 0.00 C ATOM 40 NZ LYS A 445 -1.183 -11.069 8.244 1.00 0.00 N ATOM 0 H LYS A 445 2.891 -6.624 11.699 1.00 0.00 H new ATOM 0 HA LYS A 445 2.323 -7.083 8.964 1.00 0.00 H new ATOM 0 HB2 LYS A 445 2.184 -8.607 11.137 1.00 0.00 H new ATOM 0 HB3 LYS A 445 0.547 -7.990 11.241 1.00 0.00 H new ATOM 0 HG2 LYS A 445 0.159 -8.775 8.855 1.00 0.00 H new ATOM 0 HG3 LYS A 445 1.755 -9.497 8.873 1.00 0.00 H new ATOM 0 HD2 LYS A 445 1.075 -10.912 10.832 1.00 0.00 H new ATOM 0 HD3 LYS A 445 -0.529 -10.209 10.770 1.00 0.00 H new ATOM 0 HE2 LYS A 445 0.769 -11.822 8.525 1.00 0.00 H new ATOM 0 HE3 LYS A 445 -0.420 -12.442 9.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -1.704 -11.886 7.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -1.833 -10.464 8.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 -0.778 -10.523 7.457 1.00 0.00 H new ATOM 54 N SER A 446 0.569 -4.760 10.026 1.00 0.00 N ATOM 55 CA SER A 446 -0.416 -3.777 9.583 1.00 0.00 C ATOM 56 C SER A 446 -0.167 -3.173 8.187 1.00 0.00 C ATOM 57 O SER A 446 -0.907 -2.302 7.726 1.00 0.00 O ATOM 58 CB SER A 446 -0.599 -2.688 10.648 1.00 0.00 C ATOM 59 OG SER A 446 0.626 -2.016 10.897 1.00 0.00 O ATOM 0 H SER A 446 1.175 -4.428 10.776 1.00 0.00 H new ATOM 0 HA SER A 446 -1.346 -4.333 9.464 1.00 0.00 H new ATOM 0 HB2 SER A 446 -1.351 -1.972 10.317 1.00 0.00 H new ATOM 0 HB3 SER A 446 -0.968 -3.134 11.571 1.00 0.00 H new ATOM 0 HG SER A 446 0.702 -1.242 10.300 1.00 0.00 H new ATOM 65 N LEU A 447 0.852 -3.657 7.479 1.00 0.00 N ATOM 66 CA LEU A 447 1.128 -3.402 6.073 1.00 0.00 C ATOM 67 C LEU A 447 0.768 -4.630 5.203 1.00 0.00 C ATOM 68 O LEU A 447 0.804 -4.554 3.978 1.00 0.00 O ATOM 69 CB LEU A 447 2.616 -3.023 6.011 1.00 0.00 C ATOM 70 CG LEU A 447 3.113 -2.417 4.693 1.00 0.00 C ATOM 71 CD1 LEU A 447 2.587 -1.000 4.489 1.00 0.00 C ATOM 72 CD2 LEU A 447 4.635 -2.320 4.738 1.00 0.00 C ATOM 0 H LEU A 447 1.546 -4.274 7.900 1.00 0.00 H new ATOM 0 HA LEU A 447 0.518 -2.595 5.667 1.00 0.00 H new ATOM 0 HB2 LEU A 447 2.821 -2.313 6.812 1.00 0.00 H new ATOM 0 HB3 LEU A 447 3.205 -3.916 6.219 1.00 0.00 H new ATOM 0 HG LEU A 447 2.761 -3.057 3.884 1.00 0.00 H new ATOM 0 HD11 LEU A 447 2.961 -0.605 3.544 1.00 0.00 H new ATOM 0 HD12 LEU A 447 1.497 -1.016 4.469 1.00 0.00 H new ATOM 0 HD13 LEU A 447 2.926 -0.365 5.307 1.00 0.00 H new ATOM 0 HD21 LEU A 447 5.000 -1.890 3.805 1.00 0.00 H new ATOM 0 HD22 LEU A 447 4.935 -1.685 5.572 1.00 0.00 H new ATOM 0 HD23 LEU A 447 5.059 -3.315 4.869 1.00 0.00 H new ATOM 84 N THR A 448 0.402 -5.760 5.821 1.00 0.00 N ATOM 85 CA THR A 448 0.245 -7.091 5.207 1.00 0.00 C ATOM 86 C THR A 448 -0.884 -7.907 5.882 1.00 0.00 C ATOM 87 O THR A 448 -0.755 -9.108 6.140 1.00 0.00 O ATOM 88 CB THR A 448 1.597 -7.843 5.215 1.00 0.00 C ATOM 89 OG1 THR A 448 2.001 -8.169 6.525 1.00 0.00 O ATOM 90 CG2 THR A 448 2.748 -7.015 4.626 1.00 0.00 C ATOM 0 H THR A 448 0.195 -5.774 6.820 1.00 0.00 H new ATOM 0 HA THR A 448 -0.059 -6.957 4.169 1.00 0.00 H new ATOM 0 HB THR A 448 1.415 -8.731 4.610 1.00 0.00 H new ATOM 0 HG1 THR A 448 2.852 -8.655 6.494 1.00 0.00 H new ATOM 0 HG21 THR A 448 3.669 -7.597 4.660 1.00 0.00 H new ATOM 0 HG22 THR A 448 2.519 -6.758 3.592 1.00 0.00 H new ATOM 0 HG23 THR A 448 2.874 -6.102 5.208 1.00 0.00 H new ATOM 98 N ASP A 449 -2.004 -7.247 6.197 1.00 0.00 N ATOM 99 CA ASP A 449 -3.193 -7.784 6.884 1.00 0.00 C ATOM 100 C ASP A 449 -4.481 -7.499 6.085 1.00 0.00 C ATOM 101 O ASP A 449 -4.729 -6.333 5.783 1.00 0.00 O ATOM 102 CB ASP A 449 -3.333 -7.141 8.274 1.00 0.00 C ATOM 103 CG ASP A 449 -2.759 -7.977 9.428 1.00 0.00 C ATOM 104 OD1 ASP A 449 -2.892 -9.225 9.378 1.00 0.00 O ATOM 105 OD2 ASP A 449 -2.324 -7.397 10.446 1.00 0.00 O ATOM 0 H ASP A 449 -2.115 -6.260 5.966 1.00 0.00 H new ATOM 0 HA ASP A 449 -3.059 -8.862 6.973 1.00 0.00 H new ATOM 0 HB2 ASP A 449 -2.835 -6.171 8.263 1.00 0.00 H new ATOM 0 HB3 ASP A 449 -4.389 -6.955 8.469 1.00 0.00 H new ATOM 110 N PRO A 450 -5.361 -8.491 5.831 1.00 0.00 N ATOM 111 CA PRO A 450 -6.686 -8.311 5.203 1.00 0.00 C ATOM 112 C PRO A 450 -7.463 -7.093 5.728 1.00 0.00 C ATOM 113 O PRO A 450 -8.001 -6.296 4.959 1.00 0.00 O ATOM 114 CB PRO A 450 -7.449 -9.610 5.507 1.00 0.00 C ATOM 115 CG PRO A 450 -6.372 -10.665 5.756 1.00 0.00 C ATOM 116 CD PRO A 450 -5.156 -9.875 6.226 1.00 0.00 C ATOM 0 HA PRO A 450 -6.570 -8.118 4.137 1.00 0.00 H new ATOM 0 HB2 PRO A 450 -8.093 -9.493 6.379 1.00 0.00 H new ATOM 0 HB3 PRO A 450 -8.091 -9.893 4.673 1.00 0.00 H new ATOM 0 HG2 PRO A 450 -6.691 -11.386 6.509 1.00 0.00 H new ATOM 0 HG3 PRO A 450 -6.152 -11.228 4.849 1.00 0.00 H new ATOM 0 HD2 PRO A 450 -5.041 -9.953 7.307 1.00 0.00 H new ATOM 0 HD3 PRO A 450 -4.244 -10.271 5.779 1.00 0.00 H new ATOM 124 N LYS A 451 -7.456 -6.935 7.057 1.00 0.00 N ATOM 125 CA LYS A 451 -8.092 -5.877 7.855 1.00 0.00 C ATOM 126 C LYS A 451 -7.643 -4.460 7.469 1.00 0.00 C ATOM 127 O LYS A 451 -8.419 -3.515 7.584 1.00 0.00 O ATOM 128 CB LYS A 451 -7.773 -6.156 9.337 1.00 0.00 C ATOM 129 CG LYS A 451 -8.317 -7.505 9.859 1.00 0.00 C ATOM 130 CD LYS A 451 -7.309 -8.270 10.739 1.00 0.00 C ATOM 131 CE LYS A 451 -6.146 -8.871 9.945 1.00 0.00 C ATOM 132 NZ LYS A 451 -5.224 -9.636 10.827 1.00 0.00 N ATOM 0 H LYS A 451 -6.964 -7.600 7.653 1.00 0.00 H new ATOM 0 HA LYS A 451 -9.165 -5.902 7.663 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.692 -6.135 9.474 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -8.187 -5.351 9.944 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -9.226 -7.325 10.433 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.595 -8.130 9.010 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -6.912 -7.594 11.496 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -7.831 -9.068 11.267 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -6.536 -9.527 9.167 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -5.596 -8.075 9.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -4.307 -9.754 10.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -5.088 -9.119 11.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -5.632 -10.571 11.028 1.00 0.00 H new ATOM 146 N LEU A 452 -6.396 -4.308 7.013 1.00 0.00 N ATOM 147 CA LEU A 452 -5.785 -3.040 6.595 1.00 0.00 C ATOM 148 C LEU A 452 -5.806 -2.932 5.072 1.00 0.00 C ATOM 149 O LEU A 452 -6.139 -1.890 4.532 1.00 0.00 O ATOM 150 CB LEU A 452 -4.320 -2.939 7.067 1.00 0.00 C ATOM 151 CG LEU A 452 -4.012 -2.890 8.577 1.00 0.00 C ATOM 152 CD1 LEU A 452 -4.178 -1.473 9.103 1.00 0.00 C ATOM 153 CD2 LEU A 452 -4.783 -3.858 9.459 1.00 0.00 C ATOM 0 H LEU A 452 -5.757 -5.098 6.921 1.00 0.00 H new ATOM 0 HA LEU A 452 -6.362 -2.233 7.046 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -3.783 -3.792 6.651 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -3.893 -2.043 6.617 1.00 0.00 H new ATOM 0 HG LEU A 452 -2.977 -3.224 8.644 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -3.957 -1.453 10.170 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -3.493 -0.807 8.578 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -5.203 -1.141 8.938 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -4.478 -3.726 10.497 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -5.851 -3.662 9.367 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -4.574 -4.881 9.146 1.00 0.00 H new ATOM 165 N LEU A 453 -5.503 -4.015 4.355 1.00 0.00 N ATOM 166 CA LEU A 453 -5.326 -4.039 2.902 1.00 0.00 C ATOM 167 C LEU A 453 -6.595 -3.659 2.125 1.00 0.00 C ATOM 168 O LEU A 453 -6.541 -3.315 0.944 1.00 0.00 O ATOM 169 CB LEU A 453 -4.845 -5.451 2.539 1.00 0.00 C ATOM 170 CG LEU A 453 -3.381 -5.728 2.954 1.00 0.00 C ATOM 171 CD1 LEU A 453 -3.018 -7.188 2.717 1.00 0.00 C ATOM 172 CD2 LEU A 453 -2.343 -4.880 2.236 1.00 0.00 C ATOM 0 H LEU A 453 -5.370 -4.931 4.784 1.00 0.00 H new ATOM 0 HA LEU A 453 -4.595 -3.283 2.614 1.00 0.00 H new ATOM 0 HB2 LEU A 453 -5.495 -6.183 3.019 1.00 0.00 H new ATOM 0 HB3 LEU A 453 -4.943 -5.595 1.463 1.00 0.00 H new ATOM 0 HG LEU A 453 -3.351 -5.466 4.012 1.00 0.00 H new ATOM 0 HD11 LEU A 453 -1.984 -7.359 3.016 1.00 0.00 H new ATOM 0 HD12 LEU A 453 -3.676 -7.827 3.306 1.00 0.00 H new ATOM 0 HD13 LEU A 453 -3.134 -7.425 1.659 1.00 0.00 H new ATOM 0 HD21 LEU A 453 -1.347 -5.145 2.592 1.00 0.00 H new ATOM 0 HD22 LEU A 453 -2.404 -5.061 1.163 1.00 0.00 H new ATOM 0 HD23 LEU A 453 -2.532 -3.826 2.438 1.00 0.00 H new ATOM 184 N LYS A 454 -7.735 -3.675 2.817 1.00 0.00 N ATOM 185 CA LYS A 454 -9.068 -3.350 2.315 1.00 0.00 C ATOM 186 C LYS A 454 -9.620 -2.063 2.950 1.00 0.00 C ATOM 187 O LYS A 454 -10.703 -1.595 2.601 1.00 0.00 O ATOM 188 CB LYS A 454 -9.945 -4.580 2.561 1.00 0.00 C ATOM 189 CG LYS A 454 -9.345 -5.751 1.788 1.00 0.00 C ATOM 190 CD LYS A 454 -10.209 -6.983 1.953 1.00 0.00 C ATOM 191 CE LYS A 454 -9.485 -8.022 1.140 1.00 0.00 C ATOM 192 NZ LYS A 454 -10.345 -9.116 0.615 1.00 0.00 N ATOM 0 H LYS A 454 -7.752 -3.931 3.804 1.00 0.00 H new ATOM 0 HA LYS A 454 -9.045 -3.130 1.248 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -9.989 -4.809 3.626 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -10.967 -4.391 2.233 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -9.262 -5.495 0.732 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -8.336 -5.955 2.147 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -10.294 -7.278 2.999 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -11.221 -6.817 1.585 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -8.996 -7.529 0.300 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.699 -8.460 1.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.907 -9.524 -0.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -10.449 -9.854 1.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -11.282 -8.735 0.373 1.00 0.00 H new ATOM 206 N ASN A 455 -8.827 -1.476 3.847 1.00 0.00 N ATOM 207 CA ASN A 455 -8.936 -0.169 4.463 1.00 0.00 C ATOM 208 C ASN A 455 -7.653 0.615 4.178 1.00 0.00 C ATOM 209 O ASN A 455 -6.834 0.877 5.065 1.00 0.00 O ATOM 210 CB ASN A 455 -9.102 -0.266 5.967 1.00 0.00 C ATOM 211 CG ASN A 455 -10.428 -0.761 6.485 1.00 0.00 C ATOM 212 OD1 ASN A 455 -11.493 -0.500 5.943 1.00 0.00 O ATOM 213 ND2 ASN A 455 -10.402 -1.303 7.671 1.00 0.00 N ATOM 0 H ASN A 455 -8.003 -1.967 4.193 1.00 0.00 H new ATOM 0 HA ASN A 455 -9.814 0.326 4.048 1.00 0.00 H new ATOM 0 HB2 ASN A 455 -8.323 -0.925 6.351 1.00 0.00 H new ATOM 0 HB3 ASN A 455 -8.922 0.722 6.391 1.00 0.00 H new ATOM 0 HD21 ASN A 455 -11.275 -1.513 8.155 1.00 0.00 H new ATOM 0 HD22 ASN A 455 -9.509 -1.517 8.115 1.00 0.00 H new ATOM 220 N ILE A 456 -7.528 1.069 2.939 1.00 0.00 N ATOM 221 CA ILE A 456 -6.496 2.009 2.515 1.00 0.00 C ATOM 222 C ILE A 456 -6.173 3.130 3.543 1.00 0.00 C ATOM 223 O ILE A 456 -4.982 3.372 3.727 1.00 0.00 O ATOM 224 CB ILE A 456 -6.878 2.517 1.111 1.00 0.00 C ATOM 225 CG1 ILE A 456 -6.879 1.413 0.020 1.00 0.00 C ATOM 226 CG2 ILE A 456 -6.009 3.688 0.649 1.00 0.00 C ATOM 227 CD1 ILE A 456 -5.621 0.536 -0.059 1.00 0.00 C ATOM 0 H ILE A 456 -8.154 0.789 2.183 1.00 0.00 H new ATOM 0 HA ILE A 456 -5.539 1.489 2.463 1.00 0.00 H new ATOM 0 HB ILE A 456 -7.905 2.864 1.229 1.00 0.00 H new ATOM 0 HG12 ILE A 456 -7.738 0.764 0.190 1.00 0.00 H new ATOM 0 HG13 ILE A 456 -7.026 1.889 -0.949 1.00 0.00 H new ATOM 0 HG21 ILE A 456 -6.323 4.004 -0.346 1.00 0.00 H new ATOM 0 HG22 ILE A 456 -6.119 4.519 1.345 1.00 0.00 H new ATOM 0 HG23 ILE A 456 -4.965 3.376 0.618 1.00 0.00 H new ATOM 0 HD11 ILE A 456 -5.738 -0.197 -0.857 1.00 0.00 H new ATOM 0 HD12 ILE A 456 -4.753 1.162 -0.267 1.00 0.00 H new ATOM 0 HD13 ILE A 456 -5.477 0.020 0.890 1.00 0.00 H new ATOM 239 N PRO A 457 -7.114 3.774 4.283 1.00 0.00 N ATOM 240 CA PRO A 457 -6.764 4.824 5.249 1.00 0.00 C ATOM 241 C PRO A 457 -5.867 4.302 6.385 1.00 0.00 C ATOM 242 O PRO A 457 -4.777 4.829 6.620 1.00 0.00 O ATOM 243 CB PRO A 457 -8.096 5.384 5.786 1.00 0.00 C ATOM 244 CG PRO A 457 -9.165 4.824 4.848 1.00 0.00 C ATOM 245 CD PRO A 457 -8.542 3.509 4.403 1.00 0.00 C ATOM 0 HA PRO A 457 -6.177 5.604 4.764 1.00 0.00 H new ATOM 0 HB2 PRO A 457 -8.270 5.070 6.815 1.00 0.00 H new ATOM 0 HB3 PRO A 457 -8.097 6.474 5.780 1.00 0.00 H new ATOM 0 HG2 PRO A 457 -10.116 4.672 5.358 1.00 0.00 H new ATOM 0 HG3 PRO A 457 -9.358 5.489 4.006 1.00 0.00 H new ATOM 0 HD2 PRO A 457 -8.735 2.719 5.128 1.00 0.00 H new ATOM 0 HD3 PRO A 457 -8.961 3.178 3.453 1.00 0.00 H new ATOM 253 N MET A 458 -6.296 3.242 7.085 1.00 0.00 N ATOM 254 CA MET A 458 -5.510 2.647 8.176 1.00 0.00 C ATOM 255 C MET A 458 -4.319 1.825 7.663 1.00 0.00 C ATOM 256 O MET A 458 -3.363 1.631 8.408 1.00 0.00 O ATOM 257 CB MET A 458 -6.403 1.869 9.155 1.00 0.00 C ATOM 258 CG MET A 458 -7.399 0.929 8.508 1.00 0.00 C ATOM 259 SD MET A 458 -8.518 0.171 9.708 1.00 0.00 S ATOM 260 CE MET A 458 -7.572 -1.327 10.009 1.00 0.00 C ATOM 0 H MET A 458 -7.188 2.777 6.914 1.00 0.00 H new ATOM 0 HA MET A 458 -5.071 3.469 8.742 1.00 0.00 H new ATOM 0 HB2 MET A 458 -5.765 1.292 9.825 1.00 0.00 H new ATOM 0 HB3 MET A 458 -6.949 2.584 9.771 1.00 0.00 H new ATOM 0 HG2 MET A 458 -7.982 1.477 7.768 1.00 0.00 H new ATOM 0 HG3 MET A 458 -6.861 0.146 7.974 1.00 0.00 H new ATOM 0 HE1 MET A 458 -8.166 -2.018 10.607 1.00 0.00 H new ATOM 0 HE2 MET A 458 -7.319 -1.795 9.058 1.00 0.00 H new ATOM 0 HE3 MET A 458 -6.656 -1.078 10.545 1.00 0.00 H new ATOM 270 N TRP A 459 -4.300 1.409 6.390 1.00 0.00 N ATOM 271 CA TRP A 459 -3.090 0.834 5.791 1.00 0.00 C ATOM 272 C TRP A 459 -1.990 1.892 5.599 1.00 0.00 C ATOM 273 O TRP A 459 -0.873 1.741 6.093 1.00 0.00 O ATOM 274 CB TRP A 459 -3.405 0.080 4.507 1.00 0.00 C ATOM 275 CG TRP A 459 -2.254 -0.657 3.896 1.00 0.00 C ATOM 276 CD1 TRP A 459 -1.862 -1.898 4.262 1.00 0.00 C ATOM 277 CD2 TRP A 459 -1.318 -0.233 2.849 1.00 0.00 C ATOM 278 NE1 TRP A 459 -0.785 -2.282 3.493 1.00 0.00 N ATOM 279 CE2 TRP A 459 -0.433 -1.321 2.579 1.00 0.00 C ATOM 280 CE3 TRP A 459 -1.101 0.953 2.112 1.00 0.00 C ATOM 281 CZ2 TRP A 459 0.566 -1.272 1.598 1.00 0.00 C ATOM 282 CZ3 TRP A 459 -0.069 1.026 1.154 1.00 0.00 C ATOM 283 CH2 TRP A 459 0.736 -0.087 0.870 1.00 0.00 C ATOM 0 H TRP A 459 -5.101 1.459 5.761 1.00 0.00 H new ATOM 0 HA TRP A 459 -2.693 0.101 6.494 1.00 0.00 H new ATOM 0 HB2 TRP A 459 -4.204 -0.633 4.711 1.00 0.00 H new ATOM 0 HB3 TRP A 459 -3.790 0.789 3.774 1.00 0.00 H new ATOM 0 HD1 TRP A 459 -2.321 -2.495 5.036 1.00 0.00 H new ATOM 0 HE1 TRP A 459 -0.305 -3.177 3.592 1.00 0.00 H new ATOM 0 HE3 TRP A 459 -1.732 1.812 2.284 1.00 0.00 H new ATOM 0 HZ2 TRP A 459 1.193 -2.131 1.407 1.00 0.00 H new ATOM 0 HZ3 TRP A 459 0.105 1.954 0.630 1.00 0.00 H new ATOM 0 HH2 TRP A 459 1.484 -0.031 0.093 1.00 0.00 H new ATOM 294 N LEU A 460 -2.328 3.017 4.955 1.00 0.00 N ATOM 295 CA LEU A 460 -1.504 4.230 4.836 1.00 0.00 C ATOM 296 C LEU A 460 -1.071 4.841 6.188 1.00 0.00 C ATOM 297 O LEU A 460 -0.094 5.592 6.236 1.00 0.00 O ATOM 298 CB LEU A 460 -2.298 5.272 4.027 1.00 0.00 C ATOM 299 CG LEU A 460 -2.579 4.944 2.553 1.00 0.00 C ATOM 300 CD1 LEU A 460 -3.631 5.925 2.022 1.00 0.00 C ATOM 301 CD2 LEU A 460 -1.335 5.138 1.700 1.00 0.00 C ATOM 0 H LEU A 460 -3.226 3.112 4.480 1.00 0.00 H new ATOM 0 HA LEU A 460 -0.579 3.942 4.336 1.00 0.00 H new ATOM 0 HB2 LEU A 460 -3.253 5.432 4.526 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.755 6.217 4.066 1.00 0.00 H new ATOM 0 HG LEU A 460 -2.912 3.907 2.498 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -3.840 5.703 0.975 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -4.547 5.826 2.604 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -3.255 6.944 2.109 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -1.565 4.898 0.662 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -1.005 6.175 1.769 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.543 4.480 2.057 1.00 0.00 H new ATOM 313 N LYS A 461 -1.761 4.547 7.299 1.00 0.00 N ATOM 314 CA LYS A 461 -1.373 4.964 8.667 1.00 0.00 C ATOM 315 C LYS A 461 -0.042 4.386 9.117 1.00 0.00 C ATOM 316 O LYS A 461 0.761 5.102 9.716 1.00 0.00 O ATOM 317 CB LYS A 461 -2.519 4.609 9.624 1.00 0.00 C ATOM 318 CG LYS A 461 -2.295 5.006 11.082 1.00 0.00 C ATOM 319 CD LYS A 461 -2.623 6.429 11.482 1.00 0.00 C ATOM 320 CE LYS A 461 -4.136 6.586 11.578 1.00 0.00 C ATOM 321 NZ LYS A 461 -4.525 7.792 12.357 1.00 0.00 N ATOM 0 H LYS A 461 -2.623 4.002 7.279 1.00 0.00 H new ATOM 0 HA LYS A 461 -1.213 6.042 8.671 1.00 0.00 H new ATOM 0 HB2 LYS A 461 -3.430 5.091 9.269 1.00 0.00 H new ATOM 0 HB3 LYS A 461 -2.689 3.533 9.579 1.00 0.00 H new ATOM 0 HG2 LYS A 461 -2.887 4.337 11.707 1.00 0.00 H new ATOM 0 HG3 LYS A 461 -1.248 4.823 11.322 1.00 0.00 H new ATOM 0 HD2 LYS A 461 -2.159 6.666 12.439 1.00 0.00 H new ATOM 0 HD3 LYS A 461 -2.218 7.128 10.750 1.00 0.00 H new ATOM 0 HE2 LYS A 461 -4.558 6.651 10.575 1.00 0.00 H new ATOM 0 HE3 LYS A 461 -4.563 5.699 12.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 461 -5.537 7.985 12.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 461 -4.342 7.627 13.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 461 -3.968 8.609 12.034 1.00 0.00 H new ATOM 335 N SER A 462 0.243 3.151 8.733 1.00 0.00 N ATOM 336 CA SER A 462 1.559 2.524 8.915 1.00 0.00 C ATOM 337 C SER A 462 2.710 3.343 8.299 1.00 0.00 C ATOM 338 O SER A 462 3.846 3.259 8.769 1.00 0.00 O ATOM 339 CB SER A 462 1.548 1.119 8.304 1.00 0.00 C ATOM 340 OG SER A 462 0.587 0.295 8.946 1.00 0.00 O ATOM 0 H SER A 462 -0.437 2.541 8.279 1.00 0.00 H new ATOM 0 HA SER A 462 1.741 2.476 9.989 1.00 0.00 H new ATOM 0 HB2 SER A 462 1.325 1.183 7.239 1.00 0.00 H new ATOM 0 HB3 SER A 462 2.537 0.670 8.396 1.00 0.00 H new ATOM 0 HG SER A 462 0.294 -0.408 8.329 1.00 0.00 H new ATOM 346 N LEU A 463 2.432 4.185 7.292 1.00 0.00 N ATOM 347 CA LEU A 463 3.403 5.050 6.608 1.00 0.00 C ATOM 348 C LEU A 463 3.499 6.447 7.247 1.00 0.00 C ATOM 349 O LEU A 463 4.282 7.278 6.787 1.00 0.00 O ATOM 350 CB LEU A 463 3.032 5.205 5.117 1.00 0.00 C ATOM 351 CG LEU A 463 2.378 3.985 4.460 1.00 0.00 C ATOM 352 CD1 LEU A 463 2.126 4.237 2.981 1.00 0.00 C ATOM 353 CD2 LEU A 463 3.243 2.724 4.561 1.00 0.00 C ATOM 0 H LEU A 463 1.488 4.285 6.918 1.00 0.00 H new ATOM 0 HA LEU A 463 4.374 4.565 6.706 1.00 0.00 H new ATOM 0 HB2 LEU A 463 2.355 6.054 5.017 1.00 0.00 H new ATOM 0 HB3 LEU A 463 3.937 5.452 4.561 1.00 0.00 H new ATOM 0 HG LEU A 463 1.444 3.828 5.000 1.00 0.00 H new ATOM 0 HD11 LEU A 463 1.661 3.357 2.536 1.00 0.00 H new ATOM 0 HD12 LEU A 463 1.463 5.095 2.866 1.00 0.00 H new ATOM 0 HD13 LEU A 463 3.073 4.440 2.480 1.00 0.00 H new ATOM 0 HD21 LEU A 463 2.730 1.892 4.079 1.00 0.00 H new ATOM 0 HD22 LEU A 463 4.198 2.897 4.066 1.00 0.00 H new ATOM 0 HD23 LEU A 463 3.416 2.485 5.610 1.00 0.00 H new ATOM 365 N ARG A 464 2.681 6.715 8.280 1.00 0.00 N ATOM 366 CA ARG A 464 2.427 8.032 8.884 1.00 0.00 C ATOM 367 C ARG A 464 1.821 9.012 7.862 1.00 0.00 C ATOM 368 O ARG A 464 2.009 10.224 7.966 1.00 0.00 O ATOM 369 CB ARG A 464 3.679 8.557 9.626 1.00 0.00 C ATOM 370 CG ARG A 464 4.177 7.669 10.786 1.00 0.00 C ATOM 371 CD ARG A 464 4.914 6.387 10.364 1.00 0.00 C ATOM 372 NE ARG A 464 5.718 5.833 11.472 1.00 0.00 N ATOM 373 CZ ARG A 464 6.159 4.595 11.613 1.00 0.00 C ATOM 374 NH1 ARG A 464 5.853 3.631 10.791 1.00 0.00 N ATOM 375 NH2 ARG A 464 6.941 4.293 12.613 1.00 0.00 N ATOM 0 H ARG A 464 2.150 5.976 8.741 1.00 0.00 H new ATOM 0 HA ARG A 464 1.664 7.928 9.655 1.00 0.00 H new ATOM 0 HB2 ARG A 464 4.488 8.671 8.904 1.00 0.00 H new ATOM 0 HB3 ARG A 464 3.459 9.550 10.018 1.00 0.00 H new ATOM 0 HG2 ARG A 464 4.843 8.261 11.414 1.00 0.00 H new ATOM 0 HG3 ARG A 464 3.322 7.391 11.401 1.00 0.00 H new ATOM 0 HD2 ARG A 464 4.190 5.643 10.031 1.00 0.00 H new ATOM 0 HD3 ARG A 464 5.563 6.602 9.515 1.00 0.00 H new ATOM 0 HE ARG A 464 5.962 6.484 12.218 1.00 0.00 H new ATOM 0 HH11 ARG A 464 5.246 3.815 9.993 1.00 0.00 H new ATOM 0 HH12 ARG A 464 6.221 2.692 10.946 1.00 0.00 H new ATOM 0 HH21 ARG A 464 7.211 5.012 13.284 1.00 0.00 H new ATOM 0 HH22 ARG A 464 7.282 3.338 12.723 1.00 0.00 H new ATOM 389 N LEU A 465 1.060 8.480 6.889 1.00 0.00 N ATOM 390 CA LEU A 465 0.428 9.243 5.796 1.00 0.00 C ATOM 391 C LEU A 465 -1.092 9.323 5.959 1.00 0.00 C ATOM 392 O LEU A 465 -1.610 10.411 6.197 1.00 0.00 O ATOM 393 CB LEU A 465 0.819 8.662 4.424 1.00 0.00 C ATOM 394 CG LEU A 465 2.284 8.905 4.019 1.00 0.00 C ATOM 395 CD1 LEU A 465 2.548 8.197 2.694 1.00 0.00 C ATOM 396 CD2 LEU A 465 2.611 10.393 3.879 1.00 0.00 C ATOM 0 H LEU A 465 0.862 7.481 6.839 1.00 0.00 H new ATOM 0 HA LEU A 465 0.805 10.264 5.849 1.00 0.00 H new ATOM 0 HB2 LEU A 465 0.631 7.588 4.432 1.00 0.00 H new ATOM 0 HB3 LEU A 465 0.169 9.094 3.663 1.00 0.00 H new ATOM 0 HG LEU A 465 2.923 8.508 4.808 1.00 0.00 H new ATOM 0 HD11 LEU A 465 3.583 8.360 2.394 1.00 0.00 H new ATOM 0 HD12 LEU A 465 2.368 7.128 2.810 1.00 0.00 H new ATOM 0 HD13 LEU A 465 1.881 8.596 1.929 1.00 0.00 H new ATOM 0 HD21 LEU A 465 3.656 10.510 3.592 1.00 0.00 H new ATOM 0 HD22 LEU A 465 1.973 10.835 3.114 1.00 0.00 H new ATOM 0 HD23 LEU A 465 2.438 10.895 4.831 1.00 0.00 H new ATOM 408 N HIS A 466 -1.792 8.183 5.857 1.00 0.00 N ATOM 409 CA HIS A 466 -3.245 8.025 6.134 1.00 0.00 C ATOM 410 C HIS A 466 -4.202 9.134 5.638 1.00 0.00 C ATOM 411 O HIS A 466 -5.227 9.418 6.265 1.00 0.00 O ATOM 412 CB HIS A 466 -3.429 7.641 7.605 1.00 0.00 C ATOM 413 CG HIS A 466 -3.063 8.665 8.645 1.00 0.00 C ATOM 414 ND1 HIS A 466 -1.794 9.022 9.043 1.00 0.00 N ATOM 415 CD2 HIS A 466 -3.925 9.103 9.606 1.00 0.00 C ATOM 416 CE1 HIS A 466 -1.894 9.650 10.226 1.00 0.00 C ATOM 417 NE2 HIS A 466 -3.179 9.740 10.603 1.00 0.00 N ATOM 0 H HIS A 466 -1.354 7.308 5.569 1.00 0.00 H new ATOM 0 HA HIS A 466 -3.582 7.213 5.490 1.00 0.00 H new ATOM 0 HB2 HIS A 466 -4.475 7.371 7.753 1.00 0.00 H new ATOM 0 HB3 HIS A 466 -2.839 6.745 7.794 1.00 0.00 H new ATOM 0 HD1 HIS A 466 -0.931 8.841 8.530 1.00 0.00 H new ATOM 0 HD2 HIS A 466 -4.998 8.980 9.599 1.00 0.00 H new ATOM 0 HE1 HIS A 466 -1.058 10.029 10.794 1.00 0.00 H new ATOM 425 N LYS A 467 -3.884 9.730 4.479 1.00 0.00 N ATOM 426 CA LYS A 467 -4.621 10.842 3.843 1.00 0.00 C ATOM 427 C LYS A 467 -5.061 10.571 2.404 1.00 0.00 C ATOM 428 O LYS A 467 -6.132 11.014 1.988 1.00 0.00 O ATOM 429 CB LYS A 467 -3.782 12.133 3.925 1.00 0.00 C ATOM 430 CG LYS A 467 -2.507 12.041 3.069 1.00 0.00 C ATOM 431 CD LYS A 467 -1.645 13.290 3.023 1.00 0.00 C ATOM 432 CE LYS A 467 -2.361 14.496 2.403 1.00 0.00 C ATOM 433 NZ LYS A 467 -1.433 15.646 2.241 1.00 0.00 N ATOM 0 H LYS A 467 -3.072 9.441 3.933 1.00 0.00 H new ATOM 0 HA LYS A 467 -5.548 10.955 4.405 1.00 0.00 H new ATOM 0 HB2 LYS A 467 -4.383 12.979 3.592 1.00 0.00 H new ATOM 0 HB3 LYS A 467 -3.510 12.324 4.963 1.00 0.00 H new ATOM 0 HG2 LYS A 467 -1.899 11.218 3.445 1.00 0.00 H new ATOM 0 HG3 LYS A 467 -2.795 11.785 2.050 1.00 0.00 H new ATOM 0 HD2 LYS A 467 -1.330 13.544 4.035 1.00 0.00 H new ATOM 0 HD3 LYS A 467 -0.741 13.079 2.451 1.00 0.00 H new ATOM 0 HE2 LYS A 467 -2.773 14.218 1.433 1.00 0.00 H new ATOM 0 HE3 LYS A 467 -3.200 14.788 3.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 467 -1.944 16.448 1.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 467 -1.059 15.924 3.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 467 -0.646 15.372 1.619 1.00 0.00 H new ATOM 447 N TYR A 468 -4.236 9.854 1.636 1.00 0.00 N ATOM 448 CA TYR A 468 -4.410 9.718 0.189 1.00 0.00 C ATOM 449 C TYR A 468 -5.592 8.831 -0.197 1.00 0.00 C ATOM 450 O TYR A 468 -6.091 8.917 -1.314 1.00 0.00 O ATOM 451 CB TYR A 468 -3.091 9.314 -0.461 1.00 0.00 C ATOM 452 CG TYR A 468 -2.028 10.358 -0.234 1.00 0.00 C ATOM 453 CD1 TYR A 468 -2.188 11.598 -0.882 1.00 0.00 C ATOM 454 CD2 TYR A 468 -0.929 10.131 0.611 1.00 0.00 C ATOM 455 CE1 TYR A 468 -1.232 12.613 -0.722 1.00 0.00 C ATOM 456 CE2 TYR A 468 0.042 11.142 0.753 1.00 0.00 C ATOM 457 CZ TYR A 468 -0.095 12.374 0.074 1.00 0.00 C ATOM 458 OH TYR A 468 0.829 13.359 0.244 1.00 0.00 O ATOM 0 H TYR A 468 -3.428 9.351 2.002 1.00 0.00 H new ATOM 0 HA TYR A 468 -4.682 10.694 -0.212 1.00 0.00 H new ATOM 0 HB2 TYR A 468 -2.759 8.359 -0.053 1.00 0.00 H new ATOM 0 HB3 TYR A 468 -3.239 9.169 -1.531 1.00 0.00 H new ATOM 0 HD1 TYR A 468 -3.052 11.769 -1.506 1.00 0.00 H new ATOM 0 HD2 TYR A 468 -0.830 9.197 1.143 1.00 0.00 H new ATOM 0 HE1 TYR A 468 -1.367 13.569 -1.205 1.00 0.00 H new ATOM 0 HE2 TYR A 468 0.900 10.974 1.387 1.00 0.00 H new ATOM 0 HH TYR A 468 1.506 13.065 0.888 1.00 0.00 H new ATOM 468 N SER A 469 -6.125 8.080 0.767 1.00 0.00 N ATOM 469 CA SER A 469 -7.369 7.315 0.749 1.00 0.00 C ATOM 470 C SER A 469 -8.552 8.117 0.204 1.00 0.00 C ATOM 471 O SER A 469 -9.406 7.563 -0.486 1.00 0.00 O ATOM 472 CB SER A 469 -7.698 6.916 2.197 1.00 0.00 C ATOM 473 OG SER A 469 -7.302 7.928 3.119 1.00 0.00 O ATOM 0 H SER A 469 -5.650 7.984 1.665 1.00 0.00 H new ATOM 0 HA SER A 469 -7.221 6.454 0.097 1.00 0.00 H new ATOM 0 HB2 SER A 469 -8.769 6.735 2.291 1.00 0.00 H new ATOM 0 HB3 SER A 469 -7.194 5.981 2.442 1.00 0.00 H new ATOM 0 HG SER A 469 -7.526 7.646 4.030 1.00 0.00 H new ATOM 479 N ASP A 470 -8.558 9.436 0.421 1.00 0.00 N ATOM 480 CA ASP A 470 -9.541 10.376 -0.120 1.00 0.00 C ATOM 481 C ASP A 470 -9.691 10.286 -1.654 1.00 0.00 C ATOM 482 O ASP A 470 -10.761 10.557 -2.203 1.00 0.00 O ATOM 483 CB ASP A 470 -9.125 11.794 0.288 1.00 0.00 C ATOM 484 CG ASP A 470 -10.192 12.843 -0.072 1.00 0.00 C ATOM 485 OD1 ASP A 470 -11.285 12.831 0.546 1.00 0.00 O ATOM 486 OD2 ASP A 470 -9.929 13.698 -0.952 1.00 0.00 O ATOM 0 H ASP A 470 -7.853 9.893 0.999 1.00 0.00 H new ATOM 0 HA ASP A 470 -10.516 10.117 0.293 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -8.940 11.821 1.362 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -8.187 12.050 -0.204 1.00 0.00 H new ATOM 491 N ALA A 471 -8.618 9.859 -2.328 1.00 0.00 N ATOM 492 CA ALA A 471 -8.512 9.653 -3.769 1.00 0.00 C ATOM 493 C ALA A 471 -8.029 8.241 -4.182 1.00 0.00 C ATOM 494 O ALA A 471 -8.002 7.918 -5.372 1.00 0.00 O ATOM 495 CB ALA A 471 -7.621 10.778 -4.307 1.00 0.00 C ATOM 0 H ALA A 471 -7.747 9.635 -1.847 1.00 0.00 H new ATOM 0 HA ALA A 471 -9.505 9.697 -4.216 1.00 0.00 H new ATOM 0 HB1 ALA A 471 -7.509 10.669 -5.386 1.00 0.00 H new ATOM 0 HB2 ALA A 471 -8.078 11.742 -4.085 1.00 0.00 H new ATOM 0 HB3 ALA A 471 -6.641 10.724 -3.834 1.00 0.00 H new ATOM 501 N LEU A 472 -7.686 7.385 -3.211 1.00 0.00 N ATOM 502 CA LEU A 472 -6.993 6.112 -3.387 1.00 0.00 C ATOM 503 C LEU A 472 -7.734 4.891 -2.811 1.00 0.00 C ATOM 504 O LEU A 472 -7.485 3.779 -3.267 1.00 0.00 O ATOM 505 CB LEU A 472 -5.606 6.329 -2.756 1.00 0.00 C ATOM 506 CG LEU A 472 -4.500 5.402 -3.258 1.00 0.00 C ATOM 507 CD1 LEU A 472 -3.221 6.211 -3.438 1.00 0.00 C ATOM 508 CD2 LEU A 472 -4.252 4.218 -2.332 1.00 0.00 C ATOM 0 H LEU A 472 -7.898 7.576 -2.232 1.00 0.00 H new ATOM 0 HA LEU A 472 -6.929 5.855 -4.444 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -5.301 7.360 -2.937 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -5.695 6.208 -1.676 1.00 0.00 H new ATOM 0 HG LEU A 472 -4.824 4.983 -4.211 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -2.425 5.558 -3.796 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -3.392 7.006 -4.164 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -2.930 6.648 -2.483 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -3.456 3.596 -2.742 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -3.958 4.582 -1.347 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -5.164 3.628 -2.244 1.00 0.00 H new ATOM 520 N SER A 473 -8.693 5.061 -1.889 1.00 0.00 N ATOM 521 CA SER A 473 -9.492 3.948 -1.331 1.00 0.00 C ATOM 522 C SER A 473 -10.361 3.214 -2.361 1.00 0.00 C ATOM 523 O SER A 473 -10.740 2.063 -2.136 1.00 0.00 O ATOM 524 CB SER A 473 -10.386 4.412 -0.180 1.00 0.00 C ATOM 525 OG SER A 473 -9.608 4.809 0.931 1.00 0.00 O ATOM 0 H SER A 473 -8.941 5.973 -1.506 1.00 0.00 H new ATOM 0 HA SER A 473 -8.745 3.242 -0.969 1.00 0.00 H new ATOM 0 HB2 SER A 473 -11.008 5.244 -0.510 1.00 0.00 H new ATOM 0 HB3 SER A 473 -11.059 3.606 0.111 1.00 0.00 H new ATOM 0 HG SER A 473 -10.199 5.104 1.655 1.00 0.00 H new ATOM 531 N GLY A 474 -10.630 3.834 -3.517 1.00 0.00 N ATOM 532 CA GLY A 474 -11.249 3.178 -4.676 1.00 0.00 C ATOM 533 C GLY A 474 -10.332 2.165 -5.384 1.00 0.00 C ATOM 534 O GLY A 474 -10.792 1.450 -6.277 1.00 0.00 O ATOM 0 H GLY A 474 -10.421 4.820 -3.676 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -12.155 2.667 -4.351 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -11.553 3.941 -5.393 1.00 0.00 H new ATOM 538 N THR A 475 -9.052 2.083 -4.993 1.00 0.00 N ATOM 539 CA THR A 475 -8.042 1.161 -5.543 1.00 0.00 C ATOM 540 C THR A 475 -7.625 0.131 -4.482 1.00 0.00 C ATOM 541 O THR A 475 -6.882 0.482 -3.561 1.00 0.00 O ATOM 542 CB THR A 475 -6.826 1.931 -6.094 1.00 0.00 C ATOM 543 OG1 THR A 475 -7.247 3.011 -6.913 1.00 0.00 O ATOM 544 CG2 THR A 475 -5.953 1.033 -6.967 1.00 0.00 C ATOM 0 H THR A 475 -8.675 2.679 -4.256 1.00 0.00 H new ATOM 0 HA THR A 475 -8.487 0.622 -6.380 1.00 0.00 H new ATOM 0 HB THR A 475 -6.265 2.288 -5.230 1.00 0.00 H new ATOM 0 HG1 THR A 475 -6.918 3.854 -6.537 1.00 0.00 H new ATOM 0 HG21 THR A 475 -5.103 1.604 -7.341 1.00 0.00 H new ATOM 0 HG22 THR A 475 -5.592 0.191 -6.376 1.00 0.00 H new ATOM 0 HG23 THR A 475 -6.539 0.662 -7.808 1.00 0.00 H new ATOM 552 N PRO A 476 -8.089 -1.136 -4.562 1.00 0.00 N ATOM 553 CA PRO A 476 -7.704 -2.180 -3.613 1.00 0.00 C ATOM 554 C PRO A 476 -6.222 -2.479 -3.730 1.00 0.00 C ATOM 555 O PRO A 476 -5.685 -2.471 -4.836 1.00 0.00 O ATOM 556 CB PRO A 476 -8.513 -3.428 -3.984 1.00 0.00 C ATOM 557 CG PRO A 476 -8.832 -3.216 -5.461 1.00 0.00 C ATOM 558 CD PRO A 476 -8.918 -1.701 -5.618 1.00 0.00 C ATOM 0 HA PRO A 476 -7.901 -1.865 -2.588 1.00 0.00 H new ATOM 0 HB2 PRO A 476 -7.940 -4.341 -3.824 1.00 0.00 H new ATOM 0 HB3 PRO A 476 -9.420 -3.512 -3.385 1.00 0.00 H new ATOM 0 HG2 PRO A 476 -8.056 -3.638 -6.099 1.00 0.00 H new ATOM 0 HG3 PRO A 476 -9.770 -3.698 -5.738 1.00 0.00 H new ATOM 0 HD2 PRO A 476 -8.562 -1.391 -6.600 1.00 0.00 H new ATOM 0 HD3 PRO A 476 -9.949 -1.358 -5.529 1.00 0.00 H new ATOM 566 N TRP A 477 -5.583 -2.858 -2.621 1.00 0.00 N ATOM 567 CA TRP A 477 -4.139 -3.111 -2.511 1.00 0.00 C ATOM 568 C TRP A 477 -3.535 -4.017 -3.590 1.00 0.00 C ATOM 569 O TRP A 477 -2.343 -3.966 -3.866 1.00 0.00 O ATOM 570 CB TRP A 477 -3.854 -3.779 -1.171 1.00 0.00 C ATOM 571 CG TRP A 477 -4.259 -5.224 -1.088 1.00 0.00 C ATOM 572 CD1 TRP A 477 -5.515 -5.721 -0.975 1.00 0.00 C ATOM 573 CD2 TRP A 477 -3.386 -6.390 -1.155 1.00 0.00 C ATOM 574 NE1 TRP A 477 -5.461 -7.088 -0.875 1.00 0.00 N ATOM 575 CE2 TRP A 477 -4.176 -7.569 -1.013 1.00 0.00 C ATOM 576 CE3 TRP A 477 -1.997 -6.563 -1.320 1.00 0.00 C ATOM 577 CZ2 TRP A 477 -3.614 -8.857 -1.026 1.00 0.00 C ATOM 578 CZ3 TRP A 477 -1.428 -7.842 -1.313 1.00 0.00 C ATOM 579 CH2 TRP A 477 -2.225 -8.992 -1.186 1.00 0.00 C ATOM 0 H TRP A 477 -6.074 -3.004 -1.739 1.00 0.00 H new ATOM 0 HA TRP A 477 -3.679 -2.129 -2.626 1.00 0.00 H new ATOM 0 HB2 TRP A 477 -2.787 -3.703 -0.963 1.00 0.00 H new ATOM 0 HB3 TRP A 477 -4.372 -3.226 -0.388 1.00 0.00 H new ATOM 0 HD1 TRP A 477 -6.420 -5.131 -0.965 1.00 0.00 H new ATOM 0 HE1 TRP A 477 -6.277 -7.680 -0.717 1.00 0.00 H new ATOM 0 HE3 TRP A 477 -1.364 -5.698 -1.453 1.00 0.00 H new ATOM 0 HZ2 TRP A 477 -4.240 -9.730 -0.915 1.00 0.00 H new ATOM 0 HZ3 TRP A 477 -0.357 -7.947 -1.407 1.00 0.00 H new ATOM 0 HH2 TRP A 477 -1.773 -9.973 -1.211 1.00 0.00 H new ATOM 590 N ILE A 478 -4.369 -4.841 -4.207 1.00 0.00 N ATOM 591 CA ILE A 478 -3.968 -5.885 -5.148 1.00 0.00 C ATOM 592 C ILE A 478 -3.974 -5.351 -6.582 1.00 0.00 C ATOM 593 O ILE A 478 -3.159 -5.781 -7.396 1.00 0.00 O ATOM 594 CB ILE A 478 -4.801 -7.169 -4.936 1.00 0.00 C ATOM 595 CG1 ILE A 478 -4.003 -8.392 -5.437 1.00 0.00 C ATOM 596 CG2 ILE A 478 -6.195 -7.083 -5.580 1.00 0.00 C ATOM 597 CD1 ILE A 478 -4.523 -9.729 -4.895 1.00 0.00 C ATOM 0 H ILE A 478 -5.378 -4.803 -4.064 1.00 0.00 H new ATOM 0 HA ILE A 478 -2.937 -6.178 -4.951 1.00 0.00 H new ATOM 0 HB ILE A 478 -4.983 -7.284 -3.867 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -4.034 -8.414 -6.526 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -2.958 -8.275 -5.151 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -6.737 -8.012 -5.400 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -6.747 -6.251 -5.143 1.00 0.00 H new ATOM 0 HG23 ILE A 478 -6.091 -6.926 -6.654 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -3.914 -10.543 -5.289 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -4.466 -9.727 -3.807 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -5.559 -9.868 -5.204 1.00 0.00 H new ATOM 609 N GLU A 479 -4.845 -4.376 -6.887 1.00 0.00 N ATOM 610 CA GLU A 479 -4.709 -3.585 -8.121 1.00 0.00 C ATOM 611 C GLU A 479 -3.700 -2.441 -7.885 1.00 0.00 C ATOM 612 O GLU A 479 -3.108 -1.910 -8.826 1.00 0.00 O ATOM 613 CB GLU A 479 -6.067 -3.011 -8.554 1.00 0.00 C ATOM 614 CG GLU A 479 -7.032 -4.115 -9.011 1.00 0.00 C ATOM 615 CD GLU A 479 -8.306 -3.516 -9.639 1.00 0.00 C ATOM 616 OE1 GLU A 479 -8.298 -3.205 -10.856 1.00 0.00 O ATOM 617 OE2 GLU A 479 -9.328 -3.365 -8.928 1.00 0.00 O ATOM 0 H GLU A 479 -5.642 -4.118 -6.304 1.00 0.00 H new ATOM 0 HA GLU A 479 -4.347 -4.234 -8.918 1.00 0.00 H new ATOM 0 HB2 GLU A 479 -6.511 -2.461 -7.724 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -5.919 -2.299 -9.366 1.00 0.00 H new ATOM 0 HG2 GLU A 479 -6.535 -4.760 -9.736 1.00 0.00 H new ATOM 0 HG3 GLU A 479 -7.302 -4.741 -8.160 1.00 0.00 H new ATOM 624 N LEU A 480 -3.496 -2.077 -6.612 1.00 0.00 N ATOM 625 CA LEU A 480 -2.735 -0.934 -6.148 1.00 0.00 C ATOM 626 C LEU A 480 -1.236 -1.096 -6.240 1.00 0.00 C ATOM 627 O LEU A 480 -0.575 -0.307 -6.899 1.00 0.00 O ATOM 628 CB LEU A 480 -3.049 -0.650 -4.678 1.00 0.00 C ATOM 629 CG LEU A 480 -2.509 0.674 -4.158 1.00 0.00 C ATOM 630 CD1 LEU A 480 -3.251 1.768 -4.888 1.00 0.00 C ATOM 631 CD2 LEU A 480 -2.757 0.770 -2.657 1.00 0.00 C ATOM 0 H LEU A 480 -3.887 -2.614 -5.838 1.00 0.00 H new ATOM 0 HA LEU A 480 -3.035 -0.122 -6.811 1.00 0.00 H new ATOM 0 HB2 LEU A 480 -4.130 -0.665 -4.542 1.00 0.00 H new ATOM 0 HB3 LEU A 480 -2.640 -1.457 -4.070 1.00 0.00 H new ATOM 0 HG LEU A 480 -1.436 0.762 -4.328 1.00 0.00 H new ATOM 0 HD11 LEU A 480 -2.895 2.740 -4.546 1.00 0.00 H new ATOM 0 HD12 LEU A 480 -3.076 1.674 -5.960 1.00 0.00 H new ATOM 0 HD13 LEU A 480 -4.319 1.681 -4.686 1.00 0.00 H new ATOM 0 HD21 LEU A 480 -2.370 1.718 -2.284 1.00 0.00 H new ATOM 0 HD22 LEU A 480 -3.828 0.712 -2.461 1.00 0.00 H new ATOM 0 HD23 LEU A 480 -2.251 -0.052 -2.151 1.00 0.00 H new ATOM 643 N ILE A 481 -0.690 -2.082 -5.530 1.00 0.00 N ATOM 644 CA ILE A 481 0.750 -2.189 -5.300 1.00 0.00 C ATOM 645 C ILE A 481 1.562 -2.283 -6.605 1.00 0.00 C ATOM 646 O ILE A 481 2.760 -2.022 -6.646 1.00 0.00 O ATOM 647 CB ILE A 481 1.037 -3.379 -4.357 1.00 0.00 C ATOM 648 CG1 ILE A 481 0.598 -4.692 -5.046 1.00 0.00 C ATOM 649 CG2 ILE A 481 0.430 -3.079 -2.968 1.00 0.00 C ATOM 650 CD1 ILE A 481 0.681 -5.920 -4.156 1.00 0.00 C ATOM 0 H ILE A 481 -1.233 -2.829 -5.098 1.00 0.00 H new ATOM 0 HA ILE A 481 1.080 -1.268 -4.820 1.00 0.00 H new ATOM 0 HB ILE A 481 2.100 -3.521 -4.164 1.00 0.00 H new ATOM 0 HG12 ILE A 481 -0.428 -4.580 -5.396 1.00 0.00 H new ATOM 0 HG13 ILE A 481 1.220 -4.853 -5.927 1.00 0.00 H new ATOM 0 HG21 ILE A 481 0.628 -3.914 -2.296 1.00 0.00 H new ATOM 0 HG22 ILE A 481 0.880 -2.173 -2.563 1.00 0.00 H new ATOM 0 HG23 ILE A 481 -0.647 -2.938 -3.064 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.356 -6.797 -4.715 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.710 -6.061 -3.826 1.00 0.00 H new ATOM 0 HD13 ILE A 481 0.037 -5.784 -3.287 1.00 0.00 H new ATOM 662 N TYR A 482 0.862 -2.647 -7.680 1.00 0.00 N ATOM 663 CA TYR A 482 1.316 -2.788 -9.058 1.00 0.00 C ATOM 664 C TYR A 482 1.568 -1.448 -9.774 1.00 0.00 C ATOM 665 O TYR A 482 2.226 -1.446 -10.818 1.00 0.00 O ATOM 666 CB TYR A 482 0.233 -3.574 -9.813 1.00 0.00 C ATOM 667 CG TYR A 482 0.061 -5.053 -9.502 1.00 0.00 C ATOM 668 CD1 TYR A 482 0.945 -5.765 -8.663 1.00 0.00 C ATOM 669 CD2 TYR A 482 -1.016 -5.729 -10.108 1.00 0.00 C ATOM 670 CE1 TYR A 482 0.768 -7.146 -8.453 1.00 0.00 C ATOM 671 CE2 TYR A 482 -1.200 -7.108 -9.903 1.00 0.00 C ATOM 672 CZ TYR A 482 -0.299 -7.824 -9.088 1.00 0.00 C ATOM 673 OH TYR A 482 -0.456 -9.167 -8.934 1.00 0.00 O ATOM 0 H TYR A 482 -0.130 -2.871 -7.597 1.00 0.00 H new ATOM 0 HA TYR A 482 2.277 -3.301 -9.046 1.00 0.00 H new ATOM 0 HB2 TYR A 482 -0.722 -3.083 -9.628 1.00 0.00 H new ATOM 0 HB3 TYR A 482 0.438 -3.481 -10.879 1.00 0.00 H new ATOM 0 HD1 TYR A 482 1.761 -5.248 -8.180 1.00 0.00 H new ATOM 0 HD2 TYR A 482 -1.706 -5.184 -10.735 1.00 0.00 H new ATOM 0 HE1 TYR A 482 1.445 -7.687 -7.809 1.00 0.00 H new ATOM 0 HE2 TYR A 482 -2.030 -7.618 -10.369 1.00 0.00 H new ATOM 0 HH TYR A 482 -1.241 -9.465 -9.440 1.00 0.00 H new ATOM 683 N LEU A 483 1.079 -0.320 -9.234 1.00 0.00 N ATOM 684 CA LEU A 483 1.442 1.023 -9.733 1.00 0.00 C ATOM 685 C LEU A 483 2.765 1.548 -9.132 1.00 0.00 C ATOM 686 O LEU A 483 3.437 0.844 -8.377 1.00 0.00 O ATOM 687 CB LEU A 483 0.239 1.994 -9.872 1.00 0.00 C ATOM 688 CG LEU A 483 -0.873 2.196 -8.840 1.00 0.00 C ATOM 689 CD1 LEU A 483 -0.290 2.714 -7.565 1.00 0.00 C ATOM 690 CD2 LEU A 483 -1.882 3.252 -9.297 1.00 0.00 C ATOM 0 H LEU A 483 0.428 -0.308 -8.449 1.00 0.00 H new ATOM 0 HA LEU A 483 1.713 0.929 -10.785 1.00 0.00 H new ATOM 0 HB2 LEU A 483 0.673 2.980 -10.035 1.00 0.00 H new ATOM 0 HB3 LEU A 483 -0.264 1.710 -10.796 1.00 0.00 H new ATOM 0 HG LEU A 483 -1.361 1.230 -8.712 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -1.085 2.856 -6.833 1.00 0.00 H new ATOM 0 HD12 LEU A 483 0.435 1.997 -7.179 1.00 0.00 H new ATOM 0 HD13 LEU A 483 0.206 3.666 -7.752 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -2.656 3.368 -8.539 1.00 0.00 H new ATOM 0 HD22 LEU A 483 -1.372 4.204 -9.443 1.00 0.00 H new ATOM 0 HD23 LEU A 483 -2.338 2.937 -10.236 1.00 0.00 H new ATOM 702 N ASP A 484 3.217 2.734 -9.551 1.00 0.00 N ATOM 703 CA ASP A 484 4.579 3.232 -9.297 1.00 0.00 C ATOM 704 C ASP A 484 4.645 4.768 -9.177 1.00 0.00 C ATOM 705 O ASP A 484 3.614 5.438 -9.120 1.00 0.00 O ATOM 706 CB ASP A 484 5.508 2.730 -10.423 1.00 0.00 C ATOM 707 CG ASP A 484 6.875 2.265 -9.892 1.00 0.00 C ATOM 708 OD1 ASP A 484 7.646 3.122 -9.400 1.00 0.00 O ATOM 709 OD2 ASP A 484 7.190 1.056 -9.988 1.00 0.00 O ATOM 0 H ASP A 484 2.642 3.387 -10.084 1.00 0.00 H new ATOM 0 HA ASP A 484 4.907 2.843 -8.333 1.00 0.00 H new ATOM 0 HB2 ASP A 484 5.026 1.905 -10.948 1.00 0.00 H new ATOM 0 HB3 ASP A 484 5.656 3.528 -11.151 1.00 0.00 H new ATOM 714 N ASP A 485 5.869 5.305 -9.149 1.00 0.00 N ATOM 715 CA ASP A 485 6.272 6.676 -8.836 1.00 0.00 C ATOM 716 C ASP A 485 5.287 7.768 -9.287 1.00 0.00 C ATOM 717 O ASP A 485 4.493 8.255 -8.485 1.00 0.00 O ATOM 718 CB ASP A 485 7.702 6.909 -9.356 1.00 0.00 C ATOM 719 CG ASP A 485 8.262 8.262 -8.904 1.00 0.00 C ATOM 720 OD1 ASP A 485 8.331 8.516 -7.682 1.00 0.00 O ATOM 721 OD2 ASP A 485 8.605 9.111 -9.757 1.00 0.00 O ATOM 0 H ASP A 485 6.683 4.730 -9.367 1.00 0.00 H new ATOM 0 HA ASP A 485 6.255 6.774 -7.751 1.00 0.00 H new ATOM 0 HB2 ASP A 485 8.352 6.110 -9.000 1.00 0.00 H new ATOM 0 HB3 ASP A 485 7.705 6.861 -10.445 1.00 0.00 H new ATOM 726 N GLU A 486 5.298 8.166 -10.562 1.00 0.00 N ATOM 727 CA GLU A 486 4.414 9.196 -11.080 1.00 0.00 C ATOM 728 C GLU A 486 2.960 8.728 -11.221 1.00 0.00 C ATOM 729 O GLU A 486 2.071 9.547 -11.426 1.00 0.00 O ATOM 730 CB GLU A 486 4.967 9.674 -12.431 1.00 0.00 C ATOM 731 CG GLU A 486 4.543 11.125 -12.656 1.00 0.00 C ATOM 732 CD GLU A 486 4.851 11.662 -14.066 1.00 0.00 C ATOM 733 OE1 GLU A 486 6.021 11.592 -14.516 1.00 0.00 O ATOM 734 OE2 GLU A 486 3.915 12.179 -14.726 1.00 0.00 O ATOM 0 H GLU A 486 5.928 7.776 -11.263 1.00 0.00 H new ATOM 0 HA GLU A 486 4.390 10.016 -10.362 1.00 0.00 H new ATOM 0 HB2 GLU A 486 6.054 9.593 -12.443 1.00 0.00 H new ATOM 0 HB3 GLU A 486 4.591 9.043 -13.236 1.00 0.00 H new ATOM 0 HG2 GLU A 486 3.472 11.211 -12.473 1.00 0.00 H new ATOM 0 HG3 GLU A 486 5.044 11.756 -11.922 1.00 0.00 H new ATOM 741 N THR A 487 2.673 7.433 -11.095 1.00 0.00 N ATOM 742 CA THR A 487 1.299 6.929 -11.248 1.00 0.00 C ATOM 743 C THR A 487 0.457 7.025 -9.986 1.00 0.00 C ATOM 744 O THR A 487 -0.745 7.281 -10.060 1.00 0.00 O ATOM 745 CB THR A 487 1.264 5.511 -11.841 1.00 0.00 C ATOM 746 OG1 THR A 487 2.117 5.412 -12.965 1.00 0.00 O ATOM 747 CG2 THR A 487 -0.134 5.092 -12.305 1.00 0.00 C ATOM 0 H THR A 487 3.366 6.713 -10.889 1.00 0.00 H new ATOM 0 HA THR A 487 0.832 7.604 -11.965 1.00 0.00 H new ATOM 0 HB THR A 487 1.589 4.855 -11.034 1.00 0.00 H new ATOM 0 HG1 THR A 487 2.080 4.501 -13.325 1.00 0.00 H new ATOM 0 HG21 THR A 487 -0.094 4.082 -12.714 1.00 0.00 H new ATOM 0 HG22 THR A 487 -0.820 5.114 -11.458 1.00 0.00 H new ATOM 0 HG23 THR A 487 -0.484 5.781 -13.074 1.00 0.00 H new ATOM 755 N LEU A 488 1.082 6.959 -8.817 1.00 0.00 N ATOM 756 CA LEU A 488 0.470 7.317 -7.542 1.00 0.00 C ATOM 757 C LEU A 488 -0.012 8.778 -7.576 1.00 0.00 C ATOM 758 O LEU A 488 -1.033 9.176 -7.020 1.00 0.00 O ATOM 759 CB LEU A 488 1.586 7.105 -6.517 1.00 0.00 C ATOM 760 CG LEU A 488 1.756 5.603 -6.266 1.00 0.00 C ATOM 761 CD1 LEU A 488 3.064 5.303 -5.562 1.00 0.00 C ATOM 762 CD2 LEU A 488 0.579 5.114 -5.433 1.00 0.00 C ATOM 0 H LEU A 488 2.049 6.648 -8.726 1.00 0.00 H new ATOM 0 HA LEU A 488 -0.411 6.721 -7.304 1.00 0.00 H new ATOM 0 HB2 LEU A 488 2.519 7.533 -6.883 1.00 0.00 H new ATOM 0 HB3 LEU A 488 1.344 7.617 -5.586 1.00 0.00 H new ATOM 0 HG LEU A 488 1.780 5.082 -7.223 1.00 0.00 H new ATOM 0 HD11 LEU A 488 3.152 4.229 -5.400 1.00 0.00 H new ATOM 0 HD12 LEU A 488 3.896 5.646 -6.177 1.00 0.00 H new ATOM 0 HD13 LEU A 488 3.087 5.818 -4.602 1.00 0.00 H new ATOM 0 HD21 LEU A 488 0.685 4.046 -5.245 1.00 0.00 H new ATOM 0 HD22 LEU A 488 0.558 5.649 -4.483 1.00 0.00 H new ATOM 0 HD23 LEU A 488 -0.350 5.297 -5.973 1.00 0.00 H new ATOM 774 N GLU A 489 0.710 9.599 -8.319 1.00 0.00 N ATOM 775 CA GLU A 489 0.485 10.996 -8.577 1.00 0.00 C ATOM 776 C GLU A 489 -0.553 11.244 -9.695 1.00 0.00 C ATOM 777 O GLU A 489 -0.899 12.386 -9.982 1.00 0.00 O ATOM 778 CB GLU A 489 1.909 11.467 -8.827 1.00 0.00 C ATOM 779 CG GLU A 489 2.082 12.898 -9.291 1.00 0.00 C ATOM 780 CD GLU A 489 3.484 13.450 -8.983 1.00 0.00 C ATOM 781 OE1 GLU A 489 3.921 13.372 -7.809 1.00 0.00 O ATOM 782 OE2 GLU A 489 4.151 13.976 -9.904 1.00 0.00 O ATOM 0 H GLU A 489 1.546 9.264 -8.798 1.00 0.00 H new ATOM 0 HA GLU A 489 0.009 11.562 -7.776 1.00 0.00 H new ATOM 0 HB2 GLU A 489 2.477 11.337 -7.906 1.00 0.00 H new ATOM 0 HB3 GLU A 489 2.358 10.811 -9.573 1.00 0.00 H new ATOM 0 HG2 GLU A 489 1.901 12.953 -10.364 1.00 0.00 H new ATOM 0 HG3 GLU A 489 1.333 13.526 -8.809 1.00 0.00 H new ATOM 789 N LYS A 490 -1.124 10.186 -10.286 1.00 0.00 N ATOM 790 CA LYS A 490 -2.327 10.235 -11.109 1.00 0.00 C ATOM 791 C LYS A 490 -3.562 9.798 -10.295 1.00 0.00 C ATOM 792 O LYS A 490 -4.690 10.103 -10.685 1.00 0.00 O ATOM 793 CB LYS A 490 -2.118 9.379 -12.354 1.00 0.00 C ATOM 794 CG LYS A 490 -0.839 9.660 -13.133 1.00 0.00 C ATOM 795 CD LYS A 490 -0.671 11.090 -13.621 1.00 0.00 C ATOM 796 CE LYS A 490 0.801 11.257 -14.022 1.00 0.00 C ATOM 797 NZ LYS A 490 1.121 12.600 -14.561 1.00 0.00 N ATOM 0 H LYS A 490 -0.744 9.244 -10.198 1.00 0.00 H new ATOM 0 HA LYS A 490 -2.515 11.259 -11.431 1.00 0.00 H new ATOM 0 HB2 LYS A 490 -2.120 8.330 -12.058 1.00 0.00 H new ATOM 0 HB3 LYS A 490 -2.968 9.523 -13.020 1.00 0.00 H new ATOM 0 HG2 LYS A 490 0.013 9.407 -12.502 1.00 0.00 H new ATOM 0 HG3 LYS A 490 -0.806 8.994 -13.995 1.00 0.00 H new ATOM 0 HD2 LYS A 490 -1.327 11.288 -14.469 1.00 0.00 H new ATOM 0 HD3 LYS A 490 -0.940 11.799 -12.838 1.00 0.00 H new ATOM 0 HE2 LYS A 490 1.430 11.064 -13.153 1.00 0.00 H new ATOM 0 HE3 LYS A 490 1.053 10.505 -14.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 2.147 12.677 -14.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 0.623 12.739 -15.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 0.818 13.328 -13.883 1.00 0.00 H new ATOM 811 N LYS A 491 -3.357 9.134 -9.139 1.00 0.00 N ATOM 812 CA LYS A 491 -4.369 8.828 -8.115 1.00 0.00 C ATOM 813 C LYS A 491 -4.642 10.058 -7.233 1.00 0.00 C ATOM 814 O LYS A 491 -5.798 10.304 -6.907 1.00 0.00 O ATOM 815 CB LYS A 491 -3.922 7.630 -7.247 1.00 0.00 C ATOM 816 CG LYS A 491 -3.699 6.297 -7.983 1.00 0.00 C ATOM 817 CD LYS A 491 -4.934 5.390 -8.051 1.00 0.00 C ATOM 818 CE LYS A 491 -5.979 5.832 -9.077 1.00 0.00 C ATOM 819 NZ LYS A 491 -6.967 4.746 -9.315 1.00 0.00 N ATOM 0 H LYS A 491 -2.435 8.781 -8.885 1.00 0.00 H new ATOM 0 HA LYS A 491 -5.295 8.559 -8.624 1.00 0.00 H new ATOM 0 HB2 LYS A 491 -2.995 7.901 -6.742 1.00 0.00 H new ATOM 0 HB3 LYS A 491 -4.672 7.471 -6.472 1.00 0.00 H new ATOM 0 HG2 LYS A 491 -3.364 6.509 -8.998 1.00 0.00 H new ATOM 0 HG3 LYS A 491 -2.893 5.755 -7.489 1.00 0.00 H new ATOM 0 HD2 LYS A 491 -4.614 4.376 -8.289 1.00 0.00 H new ATOM 0 HD3 LYS A 491 -5.400 5.355 -7.066 1.00 0.00 H new ATOM 0 HE2 LYS A 491 -6.491 6.726 -8.721 1.00 0.00 H new ATOM 0 HE3 LYS A 491 -5.488 6.097 -10.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 491 -7.891 5.162 -9.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 491 -6.645 4.151 -10.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 491 -7.057 4.165 -8.457 1.00 0.00 H new ATOM 833 N GLY A 492 -3.619 10.848 -6.865 1.00 0.00 N ATOM 834 CA GLY A 492 -3.692 12.018 -6.008 1.00 0.00 C ATOM 835 C GLY A 492 -2.771 11.952 -4.797 1.00 0.00 C ATOM 836 O GLY A 492 -2.917 12.723 -3.854 1.00 0.00 O ATOM 0 H GLY A 492 -2.667 10.666 -7.183 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -3.443 12.902 -6.594 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -4.719 12.142 -5.665 1.00 0.00 H new ATOM 840 N VAL A 493 -1.798 11.040 -4.827 1.00 0.00 N ATOM 841 CA VAL A 493 -0.684 11.010 -3.878 1.00 0.00 C ATOM 842 C VAL A 493 0.169 12.276 -3.995 1.00 0.00 C ATOM 843 O VAL A 493 0.712 12.798 -3.026 1.00 0.00 O ATOM 844 CB VAL A 493 0.099 9.721 -4.074 1.00 0.00 C ATOM 845 CG1 VAL A 493 1.309 9.682 -3.183 1.00 0.00 C ATOM 846 CG2 VAL A 493 -0.841 8.563 -3.740 1.00 0.00 C ATOM 0 H VAL A 493 -1.761 10.292 -5.520 1.00 0.00 H new ATOM 0 HA VAL A 493 -1.057 11.010 -2.854 1.00 0.00 H new ATOM 0 HB VAL A 493 0.454 9.651 -5.102 1.00 0.00 H new ATOM 0 HG11 VAL A 493 1.850 8.749 -3.344 1.00 0.00 H new ATOM 0 HG12 VAL A 493 1.960 10.524 -3.417 1.00 0.00 H new ATOM 0 HG13 VAL A 493 0.996 9.744 -2.141 1.00 0.00 H new ATOM 0 HG21 VAL A 493 -0.314 7.618 -3.869 1.00 0.00 H new ATOM 0 HG22 VAL A 493 -1.177 8.653 -2.707 1.00 0.00 H new ATOM 0 HG23 VAL A 493 -1.704 8.591 -4.406 1.00 0.00 H new ATOM 856 N LEU A 494 0.200 12.786 -5.221 1.00 0.00 N ATOM 857 CA LEU A 494 0.626 14.089 -5.700 1.00 0.00 C ATOM 858 C LEU A 494 2.008 14.646 -5.255 1.00 0.00 C ATOM 859 O LEU A 494 2.288 15.831 -5.458 1.00 0.00 O ATOM 860 CB LEU A 494 -0.550 15.060 -5.458 1.00 0.00 C ATOM 861 CG LEU A 494 -1.662 15.092 -6.538 1.00 0.00 C ATOM 862 CD1 LEU A 494 -1.631 14.022 -7.619 1.00 0.00 C ATOM 863 CD2 LEU A 494 -3.038 15.388 -5.947 1.00 0.00 C ATOM 0 H LEU A 494 -0.117 12.214 -6.004 1.00 0.00 H new ATOM 0 HA LEU A 494 0.854 13.966 -6.759 1.00 0.00 H new ATOM 0 HB2 LEU A 494 -1.010 14.805 -4.503 1.00 0.00 H new ATOM 0 HB3 LEU A 494 -0.144 16.067 -5.358 1.00 0.00 H new ATOM 0 HG LEU A 494 -1.395 15.956 -7.146 1.00 0.00 H new ATOM 0 HD11 LEU A 494 -2.467 14.170 -8.302 1.00 0.00 H new ATOM 0 HD12 LEU A 494 -0.694 14.091 -8.172 1.00 0.00 H new ATOM 0 HD13 LEU A 494 -1.709 13.037 -7.158 1.00 0.00 H new ATOM 0 HD21 LEU A 494 -3.781 15.399 -6.744 1.00 0.00 H new ATOM 0 HD22 LEU A 494 -3.296 14.617 -5.221 1.00 0.00 H new ATOM 0 HD23 LEU A 494 -3.021 16.360 -5.453 1.00 0.00 H new ATOM 875 N ALA A 495 2.875 13.835 -4.644 1.00 0.00 N ATOM 876 CA ALA A 495 4.118 14.254 -3.996 1.00 0.00 C ATOM 877 C ALA A 495 5.129 13.117 -4.029 1.00 0.00 C ATOM 878 O ALA A 495 4.785 11.988 -3.682 1.00 0.00 O ATOM 879 CB ALA A 495 3.834 14.591 -2.526 1.00 0.00 C ATOM 0 H ALA A 495 2.723 12.828 -4.585 1.00 0.00 H new ATOM 0 HA ALA A 495 4.513 15.123 -4.522 1.00 0.00 H new ATOM 0 HB1 ALA A 495 4.758 14.904 -2.039 1.00 0.00 H new ATOM 0 HB2 ALA A 495 3.104 15.399 -2.472 1.00 0.00 H new ATOM 0 HB3 ALA A 495 3.438 13.710 -2.021 1.00 0.00 H new ATOM 885 N LEU A 496 6.386 13.415 -4.362 1.00 0.00 N ATOM 886 CA LEU A 496 7.496 12.464 -4.329 1.00 0.00 C ATOM 887 C LEU A 496 7.629 11.782 -2.982 1.00 0.00 C ATOM 888 O LEU A 496 7.600 10.560 -2.910 1.00 0.00 O ATOM 889 CB LEU A 496 8.765 13.159 -4.787 1.00 0.00 C ATOM 890 CG LEU A 496 10.074 12.362 -4.567 1.00 0.00 C ATOM 891 CD1 LEU A 496 11.083 12.761 -5.634 1.00 0.00 C ATOM 892 CD2 LEU A 496 10.764 12.634 -3.223 1.00 0.00 C ATOM 0 H LEU A 496 6.666 14.346 -4.669 1.00 0.00 H new ATOM 0 HA LEU A 496 7.293 11.651 -5.026 1.00 0.00 H new ATOM 0 HB2 LEU A 496 8.672 13.386 -5.849 1.00 0.00 H new ATOM 0 HB3 LEU A 496 8.847 14.111 -4.263 1.00 0.00 H new ATOM 0 HG LEU A 496 9.780 11.313 -4.602 1.00 0.00 H new ATOM 0 HD11 LEU A 496 12.008 12.204 -5.486 1.00 0.00 H new ATOM 0 HD12 LEU A 496 10.678 12.536 -6.620 1.00 0.00 H new ATOM 0 HD13 LEU A 496 11.287 13.829 -5.561 1.00 0.00 H new ATOM 0 HD21 LEU A 496 11.672 12.035 -3.152 1.00 0.00 H new ATOM 0 HD22 LEU A 496 11.020 13.691 -3.153 1.00 0.00 H new ATOM 0 HD23 LEU A 496 10.090 12.369 -2.408 1.00 0.00 H new ATOM 904 N GLY A 497 7.693 12.540 -1.892 1.00 0.00 N ATOM 905 CA GLY A 497 7.837 11.929 -0.574 1.00 0.00 C ATOM 906 C GLY A 497 6.529 11.454 0.057 1.00 0.00 C ATOM 907 O GLY A 497 6.403 11.359 1.276 1.00 0.00 O ATOM 0 H GLY A 497 7.649 13.559 -1.892 1.00 0.00 H new ATOM 0 HA2 GLY A 497 8.515 11.079 -0.655 1.00 0.00 H new ATOM 0 HA3 GLY A 497 8.307 12.649 0.096 1.00 0.00 H new ATOM 911 N ALA A 498 5.580 11.117 -0.814 1.00 0.00 N ATOM 912 CA ALA A 498 4.352 10.383 -0.531 1.00 0.00 C ATOM 913 C ALA A 498 4.299 9.139 -1.428 1.00 0.00 C ATOM 914 O ALA A 498 4.202 8.012 -0.954 1.00 0.00 O ATOM 915 CB ALA A 498 3.157 11.298 -0.758 1.00 0.00 C ATOM 0 H ALA A 498 5.655 11.367 -1.800 1.00 0.00 H new ATOM 0 HA ALA A 498 4.327 10.054 0.508 1.00 0.00 H new ATOM 0 HB1 ALA A 498 2.237 10.753 -0.548 1.00 0.00 H new ATOM 0 HB2 ALA A 498 3.228 12.160 -0.095 1.00 0.00 H new ATOM 0 HB3 ALA A 498 3.150 11.636 -1.794 1.00 0.00 H new ATOM 921 N ARG A 499 4.473 9.317 -2.739 1.00 0.00 N ATOM 922 CA ARG A 499 4.550 8.228 -3.720 1.00 0.00 C ATOM 923 C ARG A 499 5.760 7.296 -3.525 1.00 0.00 C ATOM 924 O ARG A 499 5.649 6.118 -3.811 1.00 0.00 O ATOM 925 CB ARG A 499 4.468 8.815 -5.143 1.00 0.00 C ATOM 926 CG ARG A 499 5.701 9.639 -5.507 1.00 0.00 C ATOM 927 CD ARG A 499 5.516 10.662 -6.629 1.00 0.00 C ATOM 928 NE ARG A 499 6.749 10.811 -7.423 1.00 0.00 N ATOM 929 CZ ARG A 499 7.214 11.853 -8.082 1.00 0.00 C ATOM 930 NH1 ARG A 499 6.636 13.016 -8.072 1.00 0.00 N ATOM 931 NH2 ARG A 499 8.297 11.723 -8.786 1.00 0.00 N ATOM 0 H ARG A 499 4.567 10.242 -3.159 1.00 0.00 H new ATOM 0 HA ARG A 499 3.692 7.575 -3.558 1.00 0.00 H new ATOM 0 HB2 ARG A 499 4.352 8.003 -5.861 1.00 0.00 H new ATOM 0 HB3 ARG A 499 3.580 9.441 -5.224 1.00 0.00 H new ATOM 0 HG2 ARG A 499 6.038 10.165 -4.614 1.00 0.00 H new ATOM 0 HG3 ARG A 499 6.499 8.955 -5.794 1.00 0.00 H new ATOM 0 HD2 ARG A 499 4.698 10.350 -7.278 1.00 0.00 H new ATOM 0 HD3 ARG A 499 5.236 11.626 -6.204 1.00 0.00 H new ATOM 0 HE ARG A 499 7.334 9.977 -7.470 1.00 0.00 H new ATOM 0 HH11 ARG A 499 5.780 13.155 -7.536 1.00 0.00 H new ATOM 0 HH12 ARG A 499 7.039 13.790 -8.600 1.00 0.00 H new ATOM 0 HH21 ARG A 499 8.776 10.823 -8.824 1.00 0.00 H new ATOM 0 HH22 ARG A 499 8.669 12.521 -9.302 1.00 0.00 H new ATOM 945 N ARG A 500 6.883 7.743 -2.952 1.00 0.00 N ATOM 946 CA ARG A 500 8.146 7.000 -2.750 1.00 0.00 C ATOM 947 C ARG A 500 8.048 6.212 -1.456 1.00 0.00 C ATOM 948 O ARG A 500 8.425 5.049 -1.357 1.00 0.00 O ATOM 949 CB ARG A 500 9.245 8.060 -2.690 1.00 0.00 C ATOM 950 CG ARG A 500 10.571 7.486 -2.240 1.00 0.00 C ATOM 951 CD ARG A 500 11.618 8.587 -2.358 1.00 0.00 C ATOM 952 NE ARG A 500 12.957 8.126 -1.939 1.00 0.00 N ATOM 953 CZ ARG A 500 13.874 7.518 -2.671 1.00 0.00 C ATOM 954 NH1 ARG A 500 13.685 7.230 -3.928 1.00 0.00 N ATOM 955 NH2 ARG A 500 15.018 7.183 -2.147 1.00 0.00 N ATOM 0 H ARG A 500 6.945 8.695 -2.591 1.00 0.00 H new ATOM 0 HA ARG A 500 8.356 6.286 -3.546 1.00 0.00 H new ATOM 0 HB2 ARG A 500 9.363 8.514 -3.674 1.00 0.00 H new ATOM 0 HB3 ARG A 500 8.944 8.854 -2.006 1.00 0.00 H new ATOM 0 HG2 ARG A 500 10.504 7.131 -1.212 1.00 0.00 H new ATOM 0 HG3 ARG A 500 10.846 6.630 -2.856 1.00 0.00 H new ATOM 0 HD2 ARG A 500 11.662 8.936 -3.390 1.00 0.00 H new ATOM 0 HD3 ARG A 500 11.320 9.438 -1.745 1.00 0.00 H new ATOM 0 HE ARG A 500 13.205 8.298 -0.965 1.00 0.00 H new ATOM 0 HH11 ARG A 500 12.804 7.475 -4.380 1.00 0.00 H new ATOM 0 HH12 ARG A 500 14.418 6.760 -4.459 1.00 0.00 H new ATOM 0 HH21 ARG A 500 15.210 7.390 -1.167 1.00 0.00 H new ATOM 0 HH22 ARG A 500 15.722 6.714 -2.717 1.00 0.00 H new ATOM 969 N LYS A 501 7.440 6.862 -0.475 1.00 0.00 N ATOM 970 CA LYS A 501 6.966 6.256 0.751 1.00 0.00 C ATOM 971 C LYS A 501 5.948 5.152 0.480 1.00 0.00 C ATOM 972 O LYS A 501 5.911 4.144 1.188 1.00 0.00 O ATOM 973 CB LYS A 501 6.365 7.410 1.540 1.00 0.00 C ATOM 974 CG LYS A 501 7.371 8.422 2.114 1.00 0.00 C ATOM 975 CD LYS A 501 8.417 7.825 3.066 1.00 0.00 C ATOM 976 CE LYS A 501 9.393 8.928 3.495 1.00 0.00 C ATOM 977 NZ LYS A 501 10.397 8.427 4.472 1.00 0.00 N ATOM 0 H LYS A 501 7.258 7.865 -0.517 1.00 0.00 H new ATOM 0 HA LYS A 501 7.766 5.762 1.302 1.00 0.00 H new ATOM 0 HB2 LYS A 501 5.669 7.944 0.893 1.00 0.00 H new ATOM 0 HB3 LYS A 501 5.782 6.998 2.364 1.00 0.00 H new ATOM 0 HG2 LYS A 501 7.889 8.907 1.286 1.00 0.00 H new ATOM 0 HG3 LYS A 501 6.820 9.199 2.644 1.00 0.00 H new ATOM 0 HD2 LYS A 501 7.928 7.395 3.940 1.00 0.00 H new ATOM 0 HD3 LYS A 501 8.957 7.017 2.573 1.00 0.00 H new ATOM 0 HE2 LYS A 501 9.905 9.322 2.617 1.00 0.00 H new ATOM 0 HE3 LYS A 501 8.836 9.754 3.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 11.039 9.201 4.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 9.910 8.074 5.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 10.945 7.655 4.041 1.00 0.00 H new ATOM 991 N LEU A 502 5.195 5.283 -0.610 1.00 0.00 N ATOM 992 CA LEU A 502 4.358 4.205 -1.090 1.00 0.00 C ATOM 993 C LEU A 502 5.129 3.137 -1.865 1.00 0.00 C ATOM 994 O LEU A 502 4.749 1.981 -1.770 1.00 0.00 O ATOM 995 CB LEU A 502 3.212 4.738 -1.942 1.00 0.00 C ATOM 996 CG LEU A 502 1.890 4.832 -1.157 1.00 0.00 C ATOM 997 CD1 LEU A 502 1.923 5.895 -0.063 1.00 0.00 C ATOM 998 CD2 LEU A 502 0.762 5.211 -2.102 1.00 0.00 C ATOM 0 H LEU A 502 5.153 6.132 -1.174 1.00 0.00 H new ATOM 0 HA LEU A 502 3.956 3.724 -0.198 1.00 0.00 H new ATOM 0 HB2 LEU A 502 3.475 5.724 -2.324 1.00 0.00 H new ATOM 0 HB3 LEU A 502 3.073 4.088 -2.806 1.00 0.00 H new ATOM 0 HG LEU A 502 1.738 3.855 -0.699 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.964 5.914 0.455 1.00 0.00 H new ATOM 0 HD12 LEU A 502 2.715 5.661 0.648 1.00 0.00 H new ATOM 0 HD13 LEU A 502 2.114 6.871 -0.510 1.00 0.00 H new ATOM 0 HD21 LEU A 502 -0.173 5.277 -1.545 1.00 0.00 H new ATOM 0 HD22 LEU A 502 0.980 6.176 -2.561 1.00 0.00 H new ATOM 0 HD23 LEU A 502 0.668 4.453 -2.879 1.00 0.00 H new ATOM 1010 N LEU A 503 6.219 3.447 -2.578 1.00 0.00 N ATOM 1011 CA LEU A 503 7.038 2.462 -3.257 1.00 0.00 C ATOM 1012 C LEU A 503 7.660 1.506 -2.235 1.00 0.00 C ATOM 1013 O LEU A 503 7.753 0.301 -2.482 1.00 0.00 O ATOM 1014 CB LEU A 503 8.108 3.204 -4.082 1.00 0.00 C ATOM 1015 CG LEU A 503 7.651 3.821 -5.418 1.00 0.00 C ATOM 1016 CD1 LEU A 503 6.171 3.704 -5.778 1.00 0.00 C ATOM 1017 CD2 LEU A 503 8.188 5.203 -5.781 1.00 0.00 C ATOM 0 H LEU A 503 6.553 4.404 -2.695 1.00 0.00 H new ATOM 0 HA LEU A 503 6.434 1.857 -3.934 1.00 0.00 H new ATOM 0 HB2 LEU A 503 8.522 4.001 -3.464 1.00 0.00 H new ATOM 0 HB3 LEU A 503 8.920 2.507 -4.290 1.00 0.00 H new ATOM 0 HG LEU A 503 8.177 3.118 -6.064 1.00 0.00 H new ATOM 0 HD11 LEU A 503 5.992 4.181 -6.742 1.00 0.00 H new ATOM 0 HD12 LEU A 503 5.893 2.652 -5.836 1.00 0.00 H new ATOM 0 HD13 LEU A 503 5.570 4.196 -5.013 1.00 0.00 H new ATOM 0 HD21 LEU A 503 7.782 5.509 -6.745 1.00 0.00 H new ATOM 0 HD22 LEU A 503 7.890 5.921 -5.017 1.00 0.00 H new ATOM 0 HD23 LEU A 503 9.276 5.167 -5.840 1.00 0.00 H new ATOM 1029 N LYS A 504 8.000 2.042 -1.052 1.00 0.00 N ATOM 1030 CA LYS A 504 8.358 1.264 0.133 1.00 0.00 C ATOM 1031 C LYS A 504 7.206 0.337 0.526 1.00 0.00 C ATOM 1032 O LYS A 504 7.356 -0.881 0.530 1.00 0.00 O ATOM 1033 CB LYS A 504 8.748 2.208 1.286 1.00 0.00 C ATOM 1034 CG LYS A 504 9.095 1.530 2.626 1.00 0.00 C ATOM 1035 CD LYS A 504 8.557 2.330 3.827 1.00 0.00 C ATOM 1036 CE LYS A 504 7.079 2.002 4.115 1.00 0.00 C ATOM 1037 NZ LYS A 504 6.946 0.866 5.070 1.00 0.00 N ATOM 0 H LYS A 504 8.033 3.049 -0.895 1.00 0.00 H new ATOM 0 HA LYS A 504 9.222 0.639 -0.093 1.00 0.00 H new ATOM 0 HB2 LYS A 504 9.606 2.802 0.969 1.00 0.00 H new ATOM 0 HB3 LYS A 504 7.925 2.902 1.455 1.00 0.00 H new ATOM 0 HG2 LYS A 504 8.677 0.523 2.643 1.00 0.00 H new ATOM 0 HG3 LYS A 504 10.177 1.428 2.712 1.00 0.00 H new ATOM 0 HD2 LYS A 504 9.157 2.109 4.710 1.00 0.00 H new ATOM 0 HD3 LYS A 504 8.661 3.397 3.630 1.00 0.00 H new ATOM 0 HE2 LYS A 504 6.583 2.882 4.524 1.00 0.00 H new ATOM 0 HE3 LYS A 504 6.572 1.755 3.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 504 5.939 0.672 5.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 504 7.398 0.020 4.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 504 7.409 1.112 5.968 1.00 0.00 H new ATOM 1051 N ALA A 505 6.052 0.927 0.846 1.00 0.00 N ATOM 1052 CA ALA A 505 4.846 0.247 1.314 1.00 0.00 C ATOM 1053 C ALA A 505 4.486 -0.927 0.390 1.00 0.00 C ATOM 1054 O ALA A 505 4.337 -2.078 0.821 1.00 0.00 O ATOM 1055 CB ALA A 505 3.738 1.305 1.392 1.00 0.00 C ATOM 0 H ALA A 505 5.929 1.938 0.782 1.00 0.00 H new ATOM 0 HA ALA A 505 4.995 -0.195 2.299 1.00 0.00 H new ATOM 0 HB1 ALA A 505 2.815 0.840 1.739 1.00 0.00 H new ATOM 0 HB2 ALA A 505 4.033 2.090 2.088 1.00 0.00 H new ATOM 0 HB3 ALA A 505 3.578 1.738 0.404 1.00 0.00 H new ATOM 1061 N PHE A 506 4.465 -0.608 -0.906 1.00 0.00 N ATOM 1062 CA PHE A 506 4.241 -1.494 -2.022 1.00 0.00 C ATOM 1063 C PHE A 506 5.210 -2.638 -1.976 1.00 0.00 C ATOM 1064 O PHE A 506 4.777 -3.745 -1.707 1.00 0.00 O ATOM 1065 CB PHE A 506 4.364 -0.777 -3.374 1.00 0.00 C ATOM 1066 CG PHE A 506 3.232 0.135 -3.771 1.00 0.00 C ATOM 1067 CD1 PHE A 506 2.072 0.247 -2.983 1.00 0.00 C ATOM 1068 CD2 PHE A 506 3.332 0.831 -4.990 1.00 0.00 C ATOM 1069 CE1 PHE A 506 1.005 1.041 -3.425 1.00 0.00 C ATOM 1070 CE2 PHE A 506 2.255 1.606 -5.446 1.00 0.00 C ATOM 1071 CZ PHE A 506 1.083 1.671 -4.679 1.00 0.00 C ATOM 0 H PHE A 506 4.617 0.353 -1.213 1.00 0.00 H new ATOM 0 HA PHE A 506 3.219 -1.863 -1.934 1.00 0.00 H new ATOM 0 HB2 PHE A 506 5.283 -0.191 -3.364 1.00 0.00 H new ATOM 0 HB3 PHE A 506 4.477 -1.534 -4.150 1.00 0.00 H new ATOM 0 HD1 PHE A 506 2.004 -0.277 -2.041 1.00 0.00 H new ATOM 0 HD2 PHE A 506 4.238 0.769 -5.575 1.00 0.00 H new ATOM 0 HE1 PHE A 506 0.129 1.168 -2.806 1.00 0.00 H new ATOM 0 HE2 PHE A 506 2.328 2.147 -6.378 1.00 0.00 H new ATOM 0 HZ PHE A 506 0.228 2.213 -5.057 1.00 0.00 H new ATOM 1081 N GLY A 507 6.505 -2.431 -2.224 1.00 0.00 N ATOM 1082 CA GLY A 507 7.333 -3.597 -2.414 1.00 0.00 C ATOM 1083 C GLY A 507 7.654 -4.430 -1.182 1.00 0.00 C ATOM 1084 O GLY A 507 8.126 -5.551 -1.350 1.00 0.00 O ATOM 0 H GLY A 507 6.969 -1.525 -2.293 1.00 0.00 H new ATOM 0 HA2 GLY A 507 6.843 -4.244 -3.141 1.00 0.00 H new ATOM 0 HA3 GLY A 507 8.275 -3.274 -2.858 1.00 0.00 H new ATOM 1088 N ILE A 508 7.347 -3.955 0.032 1.00 0.00 N ATOM 1089 CA ILE A 508 7.326 -4.845 1.195 1.00 0.00 C ATOM 1090 C ILE A 508 6.131 -5.779 1.003 1.00 0.00 C ATOM 1091 O ILE A 508 6.331 -6.984 1.010 1.00 0.00 O ATOM 1092 CB ILE A 508 7.270 -4.116 2.555 1.00 0.00 C ATOM 1093 CG1 ILE A 508 8.663 -3.678 3.062 1.00 0.00 C ATOM 1094 CG2 ILE A 508 6.717 -5.048 3.658 1.00 0.00 C ATOM 1095 CD1 ILE A 508 9.314 -2.526 2.302 1.00 0.00 C ATOM 0 H ILE A 508 7.115 -2.982 0.231 1.00 0.00 H new ATOM 0 HA ILE A 508 8.267 -5.394 1.240 1.00 0.00 H new ATOM 0 HB ILE A 508 6.634 -3.248 2.379 1.00 0.00 H new ATOM 0 HG12 ILE A 508 8.574 -3.393 4.110 1.00 0.00 H new ATOM 0 HG13 ILE A 508 9.331 -4.539 3.021 1.00 0.00 H new ATOM 0 HG21 ILE A 508 6.687 -4.512 4.606 1.00 0.00 H new ATOM 0 HG22 ILE A 508 5.710 -5.370 3.391 1.00 0.00 H new ATOM 0 HG23 ILE A 508 7.363 -5.921 3.755 1.00 0.00 H new ATOM 0 HD11 ILE A 508 10.286 -2.303 2.742 1.00 0.00 H new ATOM 0 HD12 ILE A 508 9.445 -2.807 1.257 1.00 0.00 H new ATOM 0 HD13 ILE A 508 8.677 -1.644 2.363 1.00 0.00 H new ATOM 1107 N VAL A 509 4.907 -5.284 0.766 1.00 0.00 N ATOM 1108 CA VAL A 509 3.753 -6.176 0.593 1.00 0.00 C ATOM 1109 C VAL A 509 3.884 -6.988 -0.695 1.00 0.00 C ATOM 1110 O VAL A 509 3.470 -8.137 -0.724 1.00 0.00 O ATOM 1111 CB VAL A 509 2.421 -5.424 0.721 1.00 0.00 C ATOM 1112 CG1 VAL A 509 2.135 -4.477 -0.416 1.00 0.00 C ATOM 1113 CG2 VAL A 509 1.227 -6.367 0.812 1.00 0.00 C ATOM 0 H VAL A 509 4.693 -4.289 0.691 1.00 0.00 H new ATOM 0 HA VAL A 509 3.748 -6.897 1.410 1.00 0.00 H new ATOM 0 HB VAL A 509 2.546 -4.855 1.642 1.00 0.00 H new ATOM 0 HG11 VAL A 509 1.176 -3.986 -0.249 1.00 0.00 H new ATOM 0 HG12 VAL A 509 2.923 -3.725 -0.470 1.00 0.00 H new ATOM 0 HG13 VAL A 509 2.099 -5.033 -1.353 1.00 0.00 H new ATOM 0 HG21 VAL A 509 0.310 -5.785 0.901 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.180 -6.983 -0.086 1.00 0.00 H new ATOM 0 HG23 VAL A 509 1.336 -7.009 1.686 1.00 0.00 H new ATOM 1123 N ILE A 510 4.543 -6.467 -1.736 1.00 0.00 N ATOM 1124 CA ILE A 510 4.937 -7.253 -2.912 1.00 0.00 C ATOM 1125 C ILE A 510 5.791 -8.459 -2.540 1.00 0.00 C ATOM 1126 O ILE A 510 5.520 -9.559 -3.008 1.00 0.00 O ATOM 1127 CB ILE A 510 5.557 -6.421 -4.025 1.00 0.00 C ATOM 1128 CG1 ILE A 510 4.422 -5.513 -4.557 1.00 0.00 C ATOM 1129 CG2 ILE A 510 6.174 -7.272 -5.153 1.00 0.00 C ATOM 1130 CD1 ILE A 510 4.840 -4.605 -5.702 1.00 0.00 C ATOM 0 H ILE A 510 4.819 -5.486 -1.787 1.00 0.00 H new ATOM 0 HA ILE A 510 4.007 -7.639 -3.329 1.00 0.00 H new ATOM 0 HB ILE A 510 6.395 -5.842 -3.636 1.00 0.00 H new ATOM 0 HG12 ILE A 510 3.594 -6.140 -4.888 1.00 0.00 H new ATOM 0 HG13 ILE A 510 4.048 -4.899 -3.738 1.00 0.00 H new ATOM 0 HG21 ILE A 510 6.598 -6.616 -5.913 1.00 0.00 H new ATOM 0 HG22 ILE A 510 6.959 -7.906 -4.742 1.00 0.00 H new ATOM 0 HG23 ILE A 510 5.401 -7.896 -5.602 1.00 0.00 H new ATOM 0 HD11 ILE A 510 3.989 -4.002 -6.017 1.00 0.00 H new ATOM 0 HD12 ILE A 510 5.646 -3.950 -5.371 1.00 0.00 H new ATOM 0 HD13 ILE A 510 5.185 -5.211 -6.540 1.00 0.00 H new ATOM 1142 N ASP A 511 6.739 -8.312 -1.618 1.00 0.00 N ATOM 1143 CA ASP A 511 7.670 -9.360 -1.157 1.00 0.00 C ATOM 1144 C ASP A 511 7.092 -10.399 -0.239 1.00 0.00 C ATOM 1145 O ASP A 511 7.767 -11.172 0.439 1.00 0.00 O ATOM 1146 CB ASP A 511 8.830 -8.684 -0.455 1.00 0.00 C ATOM 1147 CG ASP A 511 10.130 -9.504 -0.397 1.00 0.00 C ATOM 1148 OD1 ASP A 511 10.481 -10.155 -1.414 1.00 0.00 O ATOM 1149 OD2 ASP A 511 10.831 -9.463 0.639 1.00 0.00 O ATOM 0 H ASP A 511 6.893 -7.421 -1.145 1.00 0.00 H new ATOM 0 HA ASP A 511 7.964 -9.906 -2.053 1.00 0.00 H new ATOM 0 HB2 ASP A 511 9.037 -7.740 -0.958 1.00 0.00 H new ATOM 0 HB3 ASP A 511 8.526 -8.442 0.564 1.00 0.00 H new ATOM 1154 N TYR A 512 5.789 -10.374 -0.274 1.00 0.00 N ATOM 1155 CA TYR A 512 4.901 -10.979 0.642 1.00 0.00 C ATOM 1156 C TYR A 512 3.651 -11.448 -0.096 1.00 0.00 C ATOM 1157 O TYR A 512 3.016 -12.401 0.317 1.00 0.00 O ATOM 1158 CB TYR A 512 4.536 -9.885 1.631 1.00 0.00 C ATOM 1159 CG TYR A 512 5.162 -9.762 2.999 1.00 0.00 C ATOM 1160 CD1 TYR A 512 6.428 -9.159 3.104 1.00 0.00 C ATOM 1161 CD2 TYR A 512 4.425 -10.038 4.162 1.00 0.00 C ATOM 1162 CE1 TYR A 512 6.987 -8.862 4.356 1.00 0.00 C ATOM 1163 CE2 TYR A 512 4.998 -9.802 5.429 1.00 0.00 C ATOM 1164 CZ TYR A 512 6.280 -9.214 5.529 1.00 0.00 C ATOM 1165 OH TYR A 512 6.815 -8.946 6.750 1.00 0.00 O ATOM 0 H TYR A 512 5.291 -9.882 -1.016 1.00 0.00 H new ATOM 0 HA TYR A 512 5.344 -11.843 1.137 1.00 0.00 H new ATOM 0 HB2 TYR A 512 4.717 -8.938 1.123 1.00 0.00 H new ATOM 0 HB3 TYR A 512 3.460 -9.960 1.790 1.00 0.00 H new ATOM 0 HD1 TYR A 512 6.979 -8.921 2.206 1.00 0.00 H new ATOM 0 HD2 TYR A 512 3.422 -10.430 4.086 1.00 0.00 H new ATOM 0 HE1 TYR A 512 7.946 -8.370 4.423 1.00 0.00 H new ATOM 0 HE2 TYR A 512 4.457 -10.071 6.324 1.00 0.00 H new ATOM 0 HH TYR A 512 6.201 -9.251 7.450 1.00 0.00 H new ATOM 1175 N LYS A 513 3.289 -10.823 -1.216 1.00 0.00 N ATOM 1176 CA LYS A 513 2.141 -11.179 -2.040 1.00 0.00 C ATOM 1177 C LYS A 513 2.607 -11.996 -3.228 1.00 0.00 C ATOM 1178 O LYS A 513 2.064 -13.058 -3.511 1.00 0.00 O ATOM 1179 CB LYS A 513 1.480 -9.847 -2.379 1.00 0.00 C ATOM 1180 CG LYS A 513 0.426 -9.830 -3.476 1.00 0.00 C ATOM 1181 CD LYS A 513 1.057 -9.879 -4.869 1.00 0.00 C ATOM 1182 CE LYS A 513 0.033 -9.586 -5.957 1.00 0.00 C ATOM 1183 NZ LYS A 513 -0.916 -10.711 -6.173 1.00 0.00 N ATOM 0 H LYS A 513 3.808 -10.026 -1.585 1.00 0.00 H new ATOM 0 HA LYS A 513 1.407 -11.820 -1.551 1.00 0.00 H new ATOM 0 HB2 LYS A 513 1.021 -9.461 -1.469 1.00 0.00 H new ATOM 0 HB3 LYS A 513 2.266 -9.147 -2.661 1.00 0.00 H new ATOM 0 HG2 LYS A 513 -0.244 -10.681 -3.350 1.00 0.00 H new ATOM 0 HG3 LYS A 513 -0.181 -8.930 -3.383 1.00 0.00 H new ATOM 0 HD2 LYS A 513 1.869 -9.154 -4.927 1.00 0.00 H new ATOM 0 HD3 LYS A 513 1.496 -10.863 -5.036 1.00 0.00 H new ATOM 0 HE2 LYS A 513 -0.527 -8.690 -5.690 1.00 0.00 H new ATOM 0 HE3 LYS A 513 0.553 -9.371 -6.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 -1.590 -10.457 -6.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 -0.388 -11.561 -6.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 -1.435 -10.902 -5.292 1.00 0.00 H new ATOM 1197 N GLU A 514 3.674 -11.533 -3.884 1.00 0.00 N ATOM 1198 CA GLU A 514 4.428 -12.307 -4.866 1.00 0.00 C ATOM 1199 C GLU A 514 5.091 -13.535 -4.191 1.00 0.00 C ATOM 1200 O GLU A 514 5.650 -14.394 -4.875 1.00 0.00 O ATOM 1201 CB GLU A 514 5.452 -11.348 -5.507 1.00 0.00 C ATOM 1202 CG GLU A 514 5.919 -11.802 -6.892 1.00 0.00 C ATOM 1203 CD GLU A 514 6.876 -10.781 -7.544 1.00 0.00 C ATOM 1204 OE1 GLU A 514 6.399 -9.873 -8.268 1.00 0.00 O ATOM 1205 OE2 GLU A 514 8.113 -10.897 -7.358 1.00 0.00 O ATOM 0 H GLU A 514 4.043 -10.592 -3.743 1.00 0.00 H new ATOM 0 HA GLU A 514 3.781 -12.711 -5.645 1.00 0.00 H new ATOM 0 HB2 GLU A 514 5.009 -10.355 -5.587 1.00 0.00 H new ATOM 0 HB3 GLU A 514 6.317 -11.259 -4.850 1.00 0.00 H new ATOM 0 HG2 GLU A 514 6.421 -12.766 -6.807 1.00 0.00 H new ATOM 0 HG3 GLU A 514 5.052 -11.949 -7.536 1.00 0.00 H new ATOM 1212 N ARG A 515 5.026 -13.623 -2.844 1.00 0.00 N ATOM 1213 CA ARG A 515 5.590 -14.729 -2.022 1.00 0.00 C ATOM 1214 C ARG A 515 4.508 -15.603 -1.404 1.00 0.00 C ATOM 1215 O ARG A 515 4.526 -16.817 -1.596 1.00 0.00 O ATOM 1216 CB ARG A 515 6.554 -14.219 -0.933 1.00 0.00 C ATOM 1217 CG ARG A 515 7.971 -13.876 -1.424 1.00 0.00 C ATOM 1218 CD ARG A 515 7.893 -12.882 -2.577 1.00 0.00 C ATOM 1219 NE ARG A 515 9.157 -12.193 -2.857 1.00 0.00 N ATOM 1220 CZ ARG A 515 9.550 -11.765 -4.040 1.00 0.00 C ATOM 1221 NH1 ARG A 515 9.051 -12.239 -5.144 1.00 0.00 N ATOM 1222 NH2 ARG A 515 10.434 -10.820 -4.110 1.00 0.00 N ATOM 0 H ARG A 515 4.568 -12.909 -2.278 1.00 0.00 H new ATOM 0 HA ARG A 515 6.163 -15.346 -2.714 1.00 0.00 H new ATOM 0 HB2 ARG A 515 6.121 -13.331 -0.473 1.00 0.00 H new ATOM 0 HB3 ARG A 515 6.630 -14.977 -0.153 1.00 0.00 H new ATOM 0 HG2 ARG A 515 8.556 -13.454 -0.607 1.00 0.00 H new ATOM 0 HG3 ARG A 515 8.483 -14.782 -1.748 1.00 0.00 H new ATOM 0 HD2 ARG A 515 7.571 -13.408 -3.476 1.00 0.00 H new ATOM 0 HD3 ARG A 515 7.128 -12.139 -2.351 1.00 0.00 H new ATOM 0 HE ARG A 515 9.785 -12.031 -2.070 1.00 0.00 H new ATOM 0 HH11 ARG A 515 8.334 -12.963 -5.110 1.00 0.00 H new ATOM 0 HH12 ARG A 515 9.377 -11.886 -6.044 1.00 0.00 H new ATOM 0 HH21 ARG A 515 10.818 -10.416 -3.255 1.00 0.00 H new ATOM 0 HH22 ARG A 515 10.746 -10.480 -5.020 1.00 0.00 H new ATOM 1236 N ASP A 516 3.604 -14.962 -0.664 1.00 0.00 N ATOM 1237 CA ASP A 516 2.357 -15.449 -0.046 1.00 0.00 C ATOM 1238 C ASP A 516 2.498 -15.592 1.486 1.00 0.00 C ATOM 1239 O ASP A 516 2.383 -16.660 2.091 1.00 0.00 O ATOM 1240 CB ASP A 516 1.739 -16.664 -0.747 1.00 0.00 C ATOM 1241 CG ASP A 516 0.281 -16.914 -0.322 1.00 0.00 C ATOM 1242 OD1 ASP A 516 -0.413 -15.957 0.096 1.00 0.00 O ATOM 1243 OD2 ASP A 516 -0.207 -18.056 -0.494 1.00 0.00 O ATOM 0 H ASP A 516 3.738 -13.973 -0.455 1.00 0.00 H new ATOM 0 HA ASP A 516 1.610 -14.672 -0.207 1.00 0.00 H new ATOM 0 HB2 ASP A 516 1.779 -16.515 -1.826 1.00 0.00 H new ATOM 0 HB3 ASP A 516 2.335 -17.549 -0.525 1.00 0.00 H new ATOM 1248 N LEU A 517 2.808 -14.440 2.073 1.00 0.00 N ATOM 1249 CA LEU A 517 3.149 -14.063 3.446 1.00 0.00 C ATOM 1250 C LEU A 517 1.982 -13.309 4.116 1.00 0.00 C ATOM 1251 O LEU A 517 1.921 -13.208 5.343 1.00 0.00 O ATOM 1252 CB LEU A 517 4.402 -13.174 3.317 1.00 0.00 C ATOM 1253 CG LEU A 517 5.646 -13.879 2.735 1.00 0.00 C ATOM 1254 CD1 LEU A 517 6.921 -13.101 3.059 1.00 0.00 C ATOM 1255 CD2 LEU A 517 5.877 -15.313 3.213 1.00 0.00 C ATOM 0 H LEU A 517 2.829 -13.603 1.491 1.00 0.00 H new ATOM 0 HA LEU A 517 3.339 -14.931 4.077 1.00 0.00 H new ATOM 0 HB2 LEU A 517 4.159 -12.319 2.686 1.00 0.00 H new ATOM 0 HB3 LEU A 517 4.653 -12.781 4.302 1.00 0.00 H new ATOM 0 HG LEU A 517 5.433 -13.912 1.666 1.00 0.00 H new ATOM 0 HD11 LEU A 517 7.781 -13.620 2.637 1.00 0.00 H new ATOM 0 HD12 LEU A 517 6.855 -12.101 2.631 1.00 0.00 H new ATOM 0 HD13 LEU A 517 7.037 -13.026 4.140 1.00 0.00 H new ATOM 0 HD21 LEU A 517 6.776 -15.713 2.743 1.00 0.00 H new ATOM 0 HD22 LEU A 517 6.000 -15.320 4.296 1.00 0.00 H new ATOM 0 HD23 LEU A 517 5.020 -15.930 2.941 1.00 0.00 H new ATOM 1267 N ILE A 518 1.061 -12.789 3.293 1.00 0.00 N ATOM 1268 CA ILE A 518 -0.273 -12.289 3.660 1.00 0.00 C ATOM 1269 C ILE A 518 -1.162 -13.476 4.142 1.00 0.00 C ATOM 1270 O ILE A 518 -0.681 -14.524 4.581 1.00 0.00 O ATOM 1271 CB ILE A 518 -0.933 -11.536 2.464 1.00 0.00 C ATOM 1272 CG1 ILE A 518 -0.016 -10.885 1.411 1.00 0.00 C ATOM 1273 CG2 ILE A 518 -1.915 -10.455 2.966 1.00 0.00 C ATOM 1274 CD1 ILE A 518 0.864 -9.745 1.917 1.00 0.00 C ATOM 0 H ILE A 518 1.237 -12.700 2.292 1.00 0.00 H new ATOM 0 HA ILE A 518 -0.173 -11.575 4.477 1.00 0.00 H new ATOM 0 HB ILE A 518 -1.423 -12.357 1.940 1.00 0.00 H new ATOM 0 HG12 ILE A 518 0.627 -11.657 0.989 1.00 0.00 H new ATOM 0 HG13 ILE A 518 -0.637 -10.508 0.598 1.00 0.00 H new ATOM 0 HG21 ILE A 518 -2.362 -9.945 2.113 1.00 0.00 H new ATOM 0 HG22 ILE A 518 -2.700 -10.924 3.560 1.00 0.00 H new ATOM 0 HG23 ILE A 518 -1.378 -9.732 3.580 1.00 0.00 H new ATOM 0 HD11 ILE A 518 1.468 -9.360 1.096 1.00 0.00 H new ATOM 0 HD12 ILE A 518 0.235 -8.947 2.310 1.00 0.00 H new ATOM 0 HD13 ILE A 518 1.518 -10.114 2.707 1.00 0.00 H new ATOM 1286 N ASP A 519 -2.482 -13.338 4.047 1.00 0.00 N ATOM 1287 CA ASP A 519 -3.521 -14.332 4.298 1.00 0.00 C ATOM 1288 C ASP A 519 -4.516 -14.242 3.145 1.00 0.00 C ATOM 1289 O ASP A 519 -4.801 -13.162 2.627 1.00 0.00 O ATOM 1290 CB ASP A 519 -4.205 -14.031 5.638 1.00 0.00 C ATOM 1291 CG ASP A 519 -3.262 -14.208 6.838 1.00 0.00 C ATOM 1292 OD1 ASP A 519 -3.120 -15.352 7.331 1.00 0.00 O ATOM 1293 OD2 ASP A 519 -2.690 -13.193 7.307 1.00 0.00 O ATOM 0 H ASP A 519 -2.888 -12.445 3.767 1.00 0.00 H new ATOM 0 HA ASP A 519 -3.106 -15.338 4.356 1.00 0.00 H new ATOM 0 HB2 ASP A 519 -4.584 -13.009 5.626 1.00 0.00 H new ATOM 0 HB3 ASP A 519 -5.066 -14.689 5.758 1.00 0.00 H new ATOM 1298 N ARG A 520 -5.050 -15.385 2.727 1.00 0.00 N ATOM 1299 CA ARG A 520 -5.886 -15.548 1.531 1.00 0.00 C ATOM 1300 C ARG A 520 -7.270 -14.880 1.604 1.00 0.00 C ATOM 1301 O ARG A 520 -7.992 -14.854 0.610 1.00 0.00 O ATOM 1302 CB ARG A 520 -5.896 -17.045 1.190 1.00 0.00 C ATOM 1303 CG ARG A 520 -4.597 -17.519 0.525 1.00 0.00 C ATOM 1304 CD ARG A 520 -4.318 -16.859 -0.826 1.00 0.00 C ATOM 1305 NE ARG A 520 -3.061 -17.371 -1.376 1.00 0.00 N ATOM 1306 CZ ARG A 520 -2.678 -17.417 -2.638 1.00 0.00 C ATOM 1307 NH1 ARG A 520 -3.424 -16.985 -3.616 1.00 0.00 N ATOM 1308 NH2 ARG A 520 -1.516 -17.916 -2.932 1.00 0.00 N ATOM 0 H ARG A 520 -4.910 -16.262 3.229 1.00 0.00 H new ATOM 0 HA ARG A 520 -5.450 -14.991 0.702 1.00 0.00 H new ATOM 0 HB2 ARG A 520 -6.060 -17.618 2.102 1.00 0.00 H new ATOM 0 HB3 ARG A 520 -6.735 -17.255 0.526 1.00 0.00 H new ATOM 0 HG2 ARG A 520 -3.762 -17.318 1.196 1.00 0.00 H new ATOM 0 HG3 ARG A 520 -4.643 -18.599 0.388 1.00 0.00 H new ATOM 0 HD2 ARG A 520 -5.137 -17.061 -1.516 1.00 0.00 H new ATOM 0 HD3 ARG A 520 -4.260 -15.777 -0.708 1.00 0.00 H new ATOM 0 HE ARG A 520 -2.396 -17.739 -0.696 1.00 0.00 H new ATOM 0 HH11 ARG A 520 -4.344 -16.592 -3.420 1.00 0.00 H new ATOM 0 HH12 ARG A 520 -3.087 -17.040 -4.577 1.00 0.00 H new ATOM 0 HH21 ARG A 520 -0.910 -18.267 -2.191 1.00 0.00 H new ATOM 0 HH22 ARG A 520 -1.210 -17.957 -3.904 1.00 0.00 H new ATOM 1322 N SER A 521 -7.589 -14.249 2.735 1.00 0.00 N ATOM 1323 CA SER A 521 -8.733 -13.342 2.933 1.00 0.00 C ATOM 1324 C SER A 521 -8.413 -11.876 2.567 1.00 0.00 C ATOM 1325 O SER A 521 -9.313 -11.032 2.578 1.00 0.00 O ATOM 1326 CB SER A 521 -9.192 -13.393 4.398 1.00 0.00 C ATOM 1327 OG SER A 521 -9.535 -14.721 4.768 1.00 0.00 O ATOM 0 H SER A 521 -7.032 -14.358 3.583 1.00 0.00 H new ATOM 0 HA SER A 521 -9.521 -13.687 2.263 1.00 0.00 H new ATOM 0 HB2 SER A 521 -8.398 -13.022 5.047 1.00 0.00 H new ATOM 0 HB3 SER A 521 -10.051 -12.737 4.539 1.00 0.00 H new ATOM 0 HG SER A 521 -9.823 -14.736 5.704 1.00 0.00 H new ATOM 1333 N ALA A 522 -7.153 -11.544 2.247 1.00 0.00 N ATOM 1334 CA ALA A 522 -6.713 -10.208 1.823 1.00 0.00 C ATOM 1335 C ALA A 522 -6.909 -10.048 0.320 1.00 0.00 C ATOM 1336 O ALA A 522 -7.258 -8.984 -0.178 1.00 0.00 O ATOM 1337 CB ALA A 522 -5.229 -10.023 2.143 1.00 0.00 C ATOM 0 H ALA A 522 -6.389 -12.220 2.277 1.00 0.00 H new ATOM 0 HA ALA A 522 -7.304 -9.463 2.355 1.00 0.00 H new ATOM 0 HB1 ALA A 522 -4.909 -9.030 1.826 1.00 0.00 H new ATOM 0 HB2 ALA A 522 -5.072 -10.129 3.216 1.00 0.00 H new ATOM 0 HB3 ALA A 522 -4.646 -10.778 1.615 1.00 0.00 H new ATOM 1343 N TYR A 523 -6.692 -11.139 -0.395 1.00 0.00 N ATOM 1344 CA TYR A 523 -6.942 -11.313 -1.809 1.00 0.00 C ATOM 1345 C TYR A 523 -8.434 -11.125 -2.187 1.00 0.00 C ATOM 1346 O TYR A 523 -8.731 -11.082 -3.404 1.00 0.00 O ATOM 1347 CB TYR A 523 -6.425 -12.729 -2.104 1.00 0.00 C ATOM 1348 CG TYR A 523 -4.917 -12.946 -2.025 1.00 0.00 C ATOM 1349 CD1 TYR A 523 -4.285 -13.115 -0.777 1.00 0.00 C ATOM 1350 CD2 TYR A 523 -4.155 -13.074 -3.204 1.00 0.00 C ATOM 1351 CE1 TYR A 523 -2.925 -13.464 -0.698 1.00 0.00 C ATOM 1352 CE2 TYR A 523 -2.784 -13.399 -3.132 1.00 0.00 C ATOM 1353 CZ TYR A 523 -2.170 -13.617 -1.879 1.00 0.00 C ATOM 1354 OH TYR A 523 -0.872 -14.008 -1.812 1.00 0.00 O ATOM 1355 OXT TYR A 523 -9.300 -11.001 -1.285 1.00 0.00 O ATOM 0 H TYR A 523 -6.310 -11.983 0.031 1.00 0.00 H new ATOM 0 HA TYR A 523 -6.439 -10.557 -2.411 1.00 0.00 H new ATOM 0 HB2 TYR A 523 -6.903 -13.416 -1.406 1.00 0.00 H new ATOM 0 HB3 TYR A 523 -6.756 -13.009 -3.104 1.00 0.00 H new ATOM 0 HD1 TYR A 523 -4.853 -12.975 0.131 1.00 0.00 H new ATOM 0 HD2 TYR A 523 -4.622 -12.923 -4.166 1.00 0.00 H new ATOM 0 HE1 TYR A 523 -2.460 -13.614 0.265 1.00 0.00 H new ATOM 0 HE2 TYR A 523 -2.202 -13.481 -4.038 1.00 0.00 H new ATOM 0 HH TYR A 523 -0.773 -14.696 -1.121 1.00 0.00 H new TER 1365 TYR A 523