USER MOD reduce.3.24.130724 H: found=0, std=0, add=669, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 669 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 482 TYR OH : rot 180:sc= 1.04 USER MOD Set 1.2: A 513 LYS NZ :NH3+ -151:sc= 1.2 (180deg=0) USER MOD Set 2.1: A 475 THR OG1 : rot -41:sc= 0.844 USER MOD Set 2.2: A 491 LYS NZ :NH3+ 167:sc= 0.972 (180deg=0) USER MOD Set 3.1: A 461 LYS NZ :NH3+ 159:sc= 0.659 (180deg=0) USER MOD Set 3.2: A 466 HIS : no HE2:sc= -1.2 K(o=-0.54,f=-4.2) USER MOD Set 4.1: A 455 ASN : amide:sc= -0.187 K(o=-1.1,f=-1.7) USER MOD Set 4.2: A 458 MET CE :methyl -173:sc= -0.959 (180deg=-1.32) USER MOD Single : A 448 THR OG1 : rot -171:sc= 0.0393 USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ 145:sc= 1.25 (180deg=0.609) USER MOD Single : A 462 SER OG : rot 180:sc= 0 USER MOD Single : A 467 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 468 TYR OH : rot 165:sc= 0 USER MOD Single : A 469 SER OG : rot 180:sc= 0.0067 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+ 175:sc= 1.12 (180deg=1.1) USER MOD Single : A 501 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0119) 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 -159:sc= 0.999 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 447 1.023 -4.043 7.424 1.00 0.00 N ATOM 66 CA LEU A 447 1.264 -3.686 6.035 1.00 0.00 C ATOM 67 C LEU A 447 0.816 -4.803 5.070 1.00 0.00 C ATOM 68 O LEU A 447 0.851 -4.609 3.857 1.00 0.00 O ATOM 69 CB LEU A 447 2.765 -3.368 5.935 1.00 0.00 C ATOM 70 CG LEU A 447 3.210 -2.530 4.732 1.00 0.00 C ATOM 71 CD1 LEU A 447 2.650 -1.108 4.775 1.00 0.00 C ATOM 72 CD2 LEU A 447 4.732 -2.401 4.768 1.00 0.00 C ATOM 0 HA LEU A 447 0.674 -2.820 5.735 1.00 0.00 H new ATOM 0 HB2 LEU A 447 3.064 -2.845 6.844 1.00 0.00 H new ATOM 0 HB3 LEU A 447 3.312 -4.310 5.915 1.00 0.00 H new ATOM 0 HG LEU A 447 2.846 -3.031 3.835 1.00 0.00 H new ATOM 0 HD11 LEU A 447 2.994 -0.555 3.901 1.00 0.00 H new ATOM 0 HD12 LEU A 447 1.561 -1.146 4.775 1.00 0.00 H new ATOM 0 HD13 LEU A 447 2.995 -0.608 5.680 1.00 0.00 H new ATOM 0 HD21 LEU A 447 5.067 -1.807 3.918 1.00 0.00 H new ATOM 0 HD22 LEU A 447 5.034 -1.912 5.694 1.00 0.00 H new ATOM 0 HD23 LEU A 447 5.182 -3.392 4.718 1.00 0.00 H new ATOM 84 N THR A 448 0.378 -5.958 5.586 1.00 0.00 N ATOM 85 CA THR A 448 0.025 -7.176 4.834 1.00 0.00 C ATOM 86 C THR A 448 -1.194 -7.927 5.419 1.00 0.00 C ATOM 87 O THR A 448 -1.397 -9.103 5.128 1.00 0.00 O ATOM 88 CB THR A 448 1.247 -8.109 4.694 1.00 0.00 C ATOM 89 OG1 THR A 448 1.604 -8.678 5.936 1.00 0.00 O ATOM 90 CG2 THR A 448 2.498 -7.379 4.183 1.00 0.00 C ATOM 0 H THR A 448 0.253 -6.078 6.591 1.00 0.00 H new ATOM 0 HA THR A 448 -0.278 -6.847 3.840 1.00 0.00 H new ATOM 0 HB THR A 448 0.937 -8.870 3.977 1.00 0.00 H new ATOM 0 HG1 THR A 448 2.460 -9.147 5.847 1.00 0.00 H new ATOM 0 HG21 THR A 448 3.325 -8.085 4.105 1.00 0.00 H new ATOM 0 HG22 THR A 448 2.293 -6.949 3.202 1.00 0.00 H new ATOM 0 HG23 THR A 448 2.765 -6.584 4.879 1.00 0.00 H new ATOM 98 N ASP A 449 -2.019 -7.284 6.257 1.00 0.00 N ATOM 99 CA ASP A 449 -3.206 -7.865 6.909 1.00 0.00 C ATOM 100 C ASP A 449 -4.490 -7.523 6.126 1.00 0.00 C ATOM 101 O ASP A 449 -4.724 -6.343 5.866 1.00 0.00 O ATOM 102 CB ASP A 449 -3.360 -7.299 8.334 1.00 0.00 C ATOM 103 CG ASP A 449 -2.500 -7.961 9.426 1.00 0.00 C ATOM 104 OD1 ASP A 449 -2.050 -9.116 9.249 1.00 0.00 O ATOM 105 OD2 ASP A 449 -2.337 -7.341 10.504 1.00 0.00 O ATOM 0 H ASP A 449 -1.874 -6.307 6.511 1.00 0.00 H new ATOM 0 HA ASP A 449 -3.066 -8.946 6.937 1.00 0.00 H new ATOM 0 HB2 ASP A 449 -3.121 -6.236 8.308 1.00 0.00 H new ATOM 0 HB3 ASP A 449 -4.407 -7.383 8.625 1.00 0.00 H new ATOM 110 N PRO A 450 -5.386 -8.489 5.834 1.00 0.00 N ATOM 111 CA PRO A 450 -6.638 -8.295 5.080 1.00 0.00 C ATOM 112 C PRO A 450 -7.451 -7.070 5.523 1.00 0.00 C ATOM 113 O PRO A 450 -7.910 -6.276 4.704 1.00 0.00 O ATOM 114 CB PRO A 450 -7.441 -9.591 5.286 1.00 0.00 C ATOM 115 CG PRO A 450 -6.396 -10.639 5.657 1.00 0.00 C ATOM 116 CD PRO A 450 -5.286 -9.848 6.323 1.00 0.00 C ATOM 0 HA PRO A 450 -6.411 -8.097 4.032 1.00 0.00 H new ATOM 0 HB2 PRO A 450 -8.184 -9.475 6.075 1.00 0.00 H new ATOM 0 HB3 PRO A 450 -7.979 -9.872 4.381 1.00 0.00 H new ATOM 0 HG2 PRO A 450 -6.808 -11.390 6.331 1.00 0.00 H new ATOM 0 HG3 PRO A 450 -6.033 -11.167 4.775 1.00 0.00 H new ATOM 0 HD2 PRO A 450 -5.389 -9.877 7.408 1.00 0.00 H new ATOM 0 HD3 PRO A 450 -4.311 -10.274 6.084 1.00 0.00 H new ATOM 124 N LYS A 451 -7.581 -6.905 6.841 1.00 0.00 N ATOM 125 CA LYS A 451 -8.329 -5.843 7.531 1.00 0.00 C ATOM 126 C LYS A 451 -7.743 -4.432 7.359 1.00 0.00 C ATOM 127 O LYS A 451 -8.478 -3.454 7.464 1.00 0.00 O ATOM 128 CB LYS A 451 -8.491 -6.257 9.005 1.00 0.00 C ATOM 129 CG LYS A 451 -7.162 -6.352 9.783 1.00 0.00 C ATOM 130 CD LYS A 451 -7.043 -7.581 10.694 1.00 0.00 C ATOM 131 CE LYS A 451 -6.582 -8.811 9.898 1.00 0.00 C ATOM 132 NZ LYS A 451 -6.455 -10.006 10.776 1.00 0.00 N ATOM 0 H LYS A 451 -7.141 -7.548 7.499 1.00 0.00 H new ATOM 0 HA LYS A 451 -9.308 -5.752 7.061 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -9.141 -5.538 9.504 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -8.994 -7.223 9.047 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -6.338 -6.364 9.069 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -7.046 -5.454 10.389 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -6.335 -7.376 11.497 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -8.006 -7.786 11.162 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -7.294 -9.018 9.099 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -5.623 -8.602 9.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -6.142 -10.821 10.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -5.757 -9.815 11.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -7.377 -10.218 11.209 1.00 0.00 H new ATOM 146 N LEU A 452 -6.448 -4.310 7.051 1.00 0.00 N ATOM 147 CA LEU A 452 -5.800 -3.054 6.642 1.00 0.00 C ATOM 148 C LEU A 452 -5.786 -2.961 5.112 1.00 0.00 C ATOM 149 O LEU A 452 -6.112 -1.921 4.559 1.00 0.00 O ATOM 150 CB LEU A 452 -4.349 -2.954 7.158 1.00 0.00 C ATOM 151 CG LEU A 452 -4.077 -2.845 8.674 1.00 0.00 C ATOM 152 CD1 LEU A 452 -4.280 -1.414 9.148 1.00 0.00 C ATOM 153 CD2 LEU A 452 -4.862 -3.799 9.556 1.00 0.00 C ATOM 0 H LEU A 452 -5.803 -5.100 7.079 1.00 0.00 H new ATOM 0 HA LEU A 452 -6.373 -2.234 7.076 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -3.814 -3.831 6.794 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -3.895 -2.084 6.683 1.00 0.00 H new ATOM 0 HG LEU A 452 -3.036 -3.149 8.786 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -4.084 -1.354 10.219 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -3.595 -0.754 8.616 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -5.307 -1.107 8.949 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -4.592 -3.635 10.599 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -5.929 -3.621 9.425 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -4.629 -4.827 9.278 1.00 0.00 H new ATOM 165 N LEU A 453 -5.475 -4.047 4.400 1.00 0.00 N ATOM 166 CA LEU A 453 -5.297 -4.076 2.943 1.00 0.00 C ATOM 167 C LEU A 453 -6.559 -3.677 2.161 1.00 0.00 C ATOM 168 O LEU A 453 -6.491 -3.315 0.985 1.00 0.00 O ATOM 169 CB LEU A 453 -4.838 -5.491 2.554 1.00 0.00 C ATOM 170 CG LEU A 453 -3.384 -5.839 2.947 1.00 0.00 C ATOM 171 CD1 LEU A 453 -3.070 -7.274 2.538 1.00 0.00 C ATOM 172 CD2 LEU A 453 -2.326 -4.932 2.336 1.00 0.00 C ATOM 0 H LEU A 453 -5.335 -4.960 4.834 1.00 0.00 H new ATOM 0 HA LEU A 453 -4.548 -3.331 2.675 1.00 0.00 H new ATOM 0 HB2 LEU A 453 -5.507 -6.214 3.020 1.00 0.00 H new ATOM 0 HB3 LEU A 453 -4.944 -5.607 1.475 1.00 0.00 H new ATOM 0 HG LEU A 453 -3.338 -5.699 4.027 1.00 0.00 H new ATOM 0 HD11 LEU A 453 -2.044 -7.516 2.817 1.00 0.00 H new ATOM 0 HD12 LEU A 453 -3.754 -7.955 3.045 1.00 0.00 H new ATOM 0 HD13 LEU A 453 -3.187 -7.379 1.459 1.00 0.00 H new ATOM 0 HD21 LEU A 453 -1.338 -5.251 2.667 1.00 0.00 H new ATOM 0 HD22 LEU A 453 -2.381 -4.990 1.249 1.00 0.00 H new ATOM 0 HD23 LEU A 453 -2.501 -3.904 2.654 1.00 0.00 H new ATOM 184 N LYS A 454 -7.711 -3.699 2.832 1.00 0.00 N ATOM 185 CA LYS A 454 -9.041 -3.373 2.311 1.00 0.00 C ATOM 186 C LYS A 454 -9.594 -2.082 2.937 1.00 0.00 C ATOM 187 O LYS A 454 -10.691 -1.635 2.609 1.00 0.00 O ATOM 188 CB LYS A 454 -9.926 -4.600 2.552 1.00 0.00 C ATOM 189 CG LYS A 454 -9.348 -5.766 1.757 1.00 0.00 C ATOM 190 CD LYS A 454 -10.160 -7.028 1.972 1.00 0.00 C ATOM 191 CE LYS A 454 -9.381 -8.050 1.181 1.00 0.00 C ATOM 192 NZ LYS A 454 -10.171 -9.236 0.746 1.00 0.00 N ATOM 0 H LYS A 454 -7.743 -3.962 3.817 1.00 0.00 H new ATOM 0 HA LYS A 454 -9.007 -3.160 1.243 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -9.959 -4.843 3.614 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -10.950 -4.397 2.240 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -9.333 -5.515 0.696 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -8.315 -5.939 2.058 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -10.226 -7.294 3.027 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -11.181 -6.922 1.605 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -8.964 -7.565 0.298 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.540 -8.392 1.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.838 -9.551 -0.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -10.050 -10.006 1.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -11.177 -8.980 0.687 1.00 0.00 H new ATOM 206 N ASN A 455 -8.784 -1.469 3.804 1.00 0.00 N ATOM 207 CA ASN A 455 -8.896 -0.157 4.410 1.00 0.00 C ATOM 208 C ASN A 455 -7.606 0.624 4.151 1.00 0.00 C ATOM 209 O ASN A 455 -6.797 0.873 5.051 1.00 0.00 O ATOM 210 CB ASN A 455 -9.096 -0.247 5.909 1.00 0.00 C ATOM 211 CG ASN A 455 -10.443 -0.720 6.397 1.00 0.00 C ATOM 212 OD1 ASN A 455 -11.490 -0.448 5.827 1.00 0.00 O ATOM 213 ND2 ASN A 455 -10.457 -1.253 7.586 1.00 0.00 N ATOM 0 H ASN A 455 -7.941 -1.942 4.129 1.00 0.00 H new ATOM 0 HA ASN A 455 -9.760 0.341 3.969 1.00 0.00 H new ATOM 0 HB2 ASN A 455 -8.336 -0.917 6.312 1.00 0.00 H new ATOM 0 HB3 ASN A 455 -8.909 0.739 6.335 1.00 0.00 H new ATOM 0 HD21 ASN A 455 -11.346 -1.446 8.048 1.00 0.00 H new ATOM 0 HD22 ASN A 455 -9.579 -1.477 8.055 1.00 0.00 H new ATOM 220 N ILE A 456 -7.466 1.093 2.921 1.00 0.00 N ATOM 221 CA ILE A 456 -6.428 2.035 2.517 1.00 0.00 C ATOM 222 C ILE A 456 -6.115 3.139 3.564 1.00 0.00 C ATOM 223 O ILE A 456 -4.927 3.360 3.784 1.00 0.00 O ATOM 224 CB ILE A 456 -6.804 2.565 1.120 1.00 0.00 C ATOM 225 CG1 ILE A 456 -6.823 1.472 0.018 1.00 0.00 C ATOM 226 CG2 ILE A 456 -5.927 3.731 0.661 1.00 0.00 C ATOM 227 CD1 ILE A 456 -5.613 0.527 -0.018 1.00 0.00 C ATOM 0 H ILE A 456 -8.085 0.824 2.156 1.00 0.00 H new ATOM 0 HA ILE A 456 -5.471 1.516 2.461 1.00 0.00 H new ATOM 0 HB ILE A 456 -7.824 2.927 1.251 1.00 0.00 H new ATOM 0 HG12 ILE A 456 -7.724 0.871 0.146 1.00 0.00 H new ATOM 0 HG13 ILE A 456 -6.903 1.964 -0.951 1.00 0.00 H new ATOM 0 HG21 ILE A 456 -6.244 4.057 -0.330 1.00 0.00 H new ATOM 0 HG22 ILE A 456 -6.025 4.558 1.364 1.00 0.00 H new ATOM 0 HG23 ILE A 456 -4.886 3.410 0.621 1.00 0.00 H new ATOM 0 HD11 ILE A 456 -5.737 -0.193 -0.827 1.00 0.00 H new ATOM 0 HD12 ILE A 456 -4.704 1.106 -0.183 1.00 0.00 H new ATOM 0 HD13 ILE A 456 -5.537 -0.004 0.931 1.00 0.00 H new ATOM 239 N PRO A 457 -7.064 3.798 4.277 1.00 0.00 N ATOM 240 CA PRO A 457 -6.723 4.855 5.241 1.00 0.00 C ATOM 241 C PRO A 457 -5.848 4.335 6.397 1.00 0.00 C ATOM 242 O PRO A 457 -4.746 4.840 6.638 1.00 0.00 O ATOM 243 CB PRO A 457 -8.061 5.430 5.744 1.00 0.00 C ATOM 244 CG PRO A 457 -9.118 4.863 4.793 1.00 0.00 C ATOM 245 CD PRO A 457 -8.495 3.540 4.372 1.00 0.00 C ATOM 0 HA PRO A 457 -6.121 5.628 4.764 1.00 0.00 H new ATOM 0 HB2 PRO A 457 -8.256 5.132 6.774 1.00 0.00 H new ATOM 0 HB3 PRO A 457 -8.055 6.520 5.723 1.00 0.00 H new ATOM 0 HG2 PRO A 457 -10.078 4.721 5.289 1.00 0.00 H new ATOM 0 HG3 PRO A 457 -9.293 5.520 3.941 1.00 0.00 H new ATOM 0 HD2 PRO A 457 -8.705 2.757 5.101 1.00 0.00 H new ATOM 0 HD3 PRO A 457 -8.898 3.203 3.417 1.00 0.00 H new ATOM 253 N MET A 458 -6.309 3.294 7.104 1.00 0.00 N ATOM 254 CA MET A 458 -5.552 2.699 8.214 1.00 0.00 C ATOM 255 C MET A 458 -4.350 1.875 7.728 1.00 0.00 C ATOM 256 O MET A 458 -3.410 1.685 8.494 1.00 0.00 O ATOM 257 CB MET A 458 -6.471 1.913 9.162 1.00 0.00 C ATOM 258 CG MET A 458 -7.437 0.965 8.480 1.00 0.00 C ATOM 259 SD MET A 458 -8.604 0.217 9.641 1.00 0.00 S ATOM 260 CE MET A 458 -7.674 -1.282 9.990 1.00 0.00 C ATOM 0 H MET A 458 -7.207 2.845 6.925 1.00 0.00 H new ATOM 0 HA MET A 458 -5.130 3.519 8.794 1.00 0.00 H new ATOM 0 HB2 MET A 458 -5.851 1.341 9.853 1.00 0.00 H new ATOM 0 HB3 MET A 458 -7.043 2.622 9.760 1.00 0.00 H new ATOM 0 HG2 MET A 458 -7.989 1.505 7.711 1.00 0.00 H new ATOM 0 HG3 MET A 458 -6.875 0.178 7.976 1.00 0.00 H new ATOM 0 HE1 MET A 458 -8.280 -1.953 10.599 1.00 0.00 H new ATOM 0 HE2 MET A 458 -7.416 -1.776 9.053 1.00 0.00 H new ATOM 0 HE3 MET A 458 -6.762 -1.027 10.529 1.00 0.00 H new ATOM 270 N TRP A 459 -4.306 1.454 6.458 1.00 0.00 N ATOM 271 CA TRP A 459 -3.093 0.863 5.886 1.00 0.00 C ATOM 272 C TRP A 459 -1.978 1.905 5.667 1.00 0.00 C ATOM 273 O TRP A 459 -0.853 1.734 6.135 1.00 0.00 O ATOM 274 CB TRP A 459 -3.408 0.055 4.636 1.00 0.00 C ATOM 275 CG TRP A 459 -2.251 -0.692 4.048 1.00 0.00 C ATOM 276 CD1 TRP A 459 -1.846 -1.925 4.431 1.00 0.00 C ATOM 277 CD2 TRP A 459 -1.320 -0.273 3.000 1.00 0.00 C ATOM 278 NE1 TRP A 459 -0.763 -2.306 3.669 1.00 0.00 N ATOM 279 CE2 TRP A 459 -0.419 -1.353 2.749 1.00 0.00 C ATOM 280 CE3 TRP A 459 -1.120 0.908 2.251 1.00 0.00 C ATOM 281 CZ2 TRP A 459 0.587 -1.307 1.777 1.00 0.00 C ATOM 282 CZ3 TRP A 459 -0.079 0.987 1.306 1.00 0.00 C ATOM 283 CH2 TRP A 459 0.742 -0.119 1.048 1.00 0.00 C ATOM 0 H TRP A 459 -5.092 1.512 5.811 1.00 0.00 H new ATOM 0 HA TRP A 459 -2.695 0.162 6.619 1.00 0.00 H new ATOM 0 HB2 TRP A 459 -4.197 -0.659 4.874 1.00 0.00 H new ATOM 0 HB3 TRP A 459 -3.807 0.730 3.878 1.00 0.00 H new ATOM 0 HD1 TRP A 459 -2.300 -2.517 5.211 1.00 0.00 H new ATOM 0 HE1 TRP A 459 -0.275 -3.195 3.778 1.00 0.00 H new ATOM 0 HE3 TRP A 459 -1.770 1.757 2.404 1.00 0.00 H new ATOM 0 HZ2 TRP A 459 1.224 -2.160 1.594 1.00 0.00 H new ATOM 0 HZ3 TRP A 459 0.089 1.911 0.773 1.00 0.00 H new ATOM 0 HH2 TRP A 459 1.500 -0.056 0.282 1.00 0.00 H new ATOM 294 N LEU A 460 -2.311 3.035 5.030 1.00 0.00 N ATOM 295 CA LEU A 460 -1.461 4.227 4.878 1.00 0.00 C ATOM 296 C LEU A 460 -1.007 4.851 6.218 1.00 0.00 C ATOM 297 O LEU A 460 -0.025 5.598 6.247 1.00 0.00 O ATOM 298 CB LEU A 460 -2.245 5.274 4.065 1.00 0.00 C ATOM 299 CG LEU A 460 -2.560 4.943 2.599 1.00 0.00 C ATOM 300 CD1 LEU A 460 -3.603 5.941 2.085 1.00 0.00 C ATOM 301 CD2 LEU A 460 -1.335 5.115 1.718 1.00 0.00 C ATOM 0 H LEU A 460 -3.222 3.150 4.586 1.00 0.00 H new ATOM 0 HA LEU A 460 -0.549 3.913 4.370 1.00 0.00 H new ATOM 0 HB2 LEU A 460 -3.189 5.460 4.578 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.681 6.207 4.086 1.00 0.00 H new ATOM 0 HG LEU A 460 -2.909 3.911 2.558 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -3.837 5.719 1.044 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -4.509 5.862 2.686 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -3.206 6.953 2.159 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -1.592 4.873 0.687 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -0.989 6.147 1.773 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.544 4.448 2.061 1.00 0.00 H new ATOM 313 N LYS A 461 -1.690 4.574 7.334 1.00 0.00 N ATOM 314 CA LYS A 461 -1.297 5.004 8.696 1.00 0.00 C ATOM 315 C LYS A 461 0.047 4.459 9.150 1.00 0.00 C ATOM 316 O LYS A 461 0.842 5.200 9.725 1.00 0.00 O ATOM 317 CB LYS A 461 -2.429 4.625 9.656 1.00 0.00 C ATOM 318 CG LYS A 461 -2.238 5.073 11.104 1.00 0.00 C ATOM 319 CD LYS A 461 -2.613 6.497 11.460 1.00 0.00 C ATOM 320 CE LYS A 461 -4.127 6.625 11.561 1.00 0.00 C ATOM 321 NZ LYS A 461 -4.534 7.850 12.300 1.00 0.00 N ATOM 0 H LYS A 461 -2.554 4.032 7.323 1.00 0.00 H new ATOM 0 HA LYS A 461 -1.153 6.084 8.689 1.00 0.00 H new ATOM 0 HB2 LYS A 461 -3.359 5.052 9.281 1.00 0.00 H new ATOM 0 HB3 LYS A 461 -2.547 3.542 9.641 1.00 0.00 H new ATOM 0 HG2 LYS A 461 -2.819 4.405 11.740 1.00 0.00 H new ATOM 0 HG3 LYS A 461 -1.189 4.928 11.363 1.00 0.00 H new ATOM 0 HD2 LYS A 461 -2.152 6.778 12.407 1.00 0.00 H new ATOM 0 HD3 LYS A 461 -2.231 7.183 10.704 1.00 0.00 H new ATOM 0 HE2 LYS A 461 -4.557 6.646 10.560 1.00 0.00 H new ATOM 0 HE3 LYS A 461 -4.532 5.747 12.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 461 -5.514 8.095 12.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 461 -4.468 7.676 13.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 461 -3.905 8.637 12.041 1.00 0.00 H new ATOM 335 N SER A 462 0.346 3.218 8.802 1.00 0.00 N ATOM 336 CA SER A 462 1.668 2.613 9.015 1.00 0.00 C ATOM 337 C SER A 462 2.813 3.392 8.342 1.00 0.00 C ATOM 338 O SER A 462 3.955 3.329 8.798 1.00 0.00 O ATOM 339 CB SER A 462 1.652 1.169 8.513 1.00 0.00 C ATOM 340 OG SER A 462 0.751 0.398 9.294 1.00 0.00 O ATOM 0 H SER A 462 -0.323 2.589 8.359 1.00 0.00 H new ATOM 0 HA SER A 462 1.864 2.645 10.087 1.00 0.00 H new ATOM 0 HB2 SER A 462 1.354 1.142 7.465 1.00 0.00 H new ATOM 0 HB3 SER A 462 2.654 0.743 8.571 1.00 0.00 H new ATOM 0 HG SER A 462 0.743 -0.526 8.967 1.00 0.00 H new ATOM 346 N LEU A 463 2.526 4.181 7.297 1.00 0.00 N ATOM 347 CA LEU A 463 3.478 5.041 6.586 1.00 0.00 C ATOM 348 C LEU A 463 3.578 6.446 7.208 1.00 0.00 C ATOM 349 O LEU A 463 4.367 7.267 6.743 1.00 0.00 O ATOM 350 CB LEU A 463 3.087 5.164 5.096 1.00 0.00 C ATOM 351 CG LEU A 463 2.393 3.944 4.481 1.00 0.00 C ATOM 352 CD1 LEU A 463 2.140 4.159 2.996 1.00 0.00 C ATOM 353 CD2 LEU A 463 3.195 2.648 4.619 1.00 0.00 C ATOM 0 H LEU A 463 1.584 4.239 6.909 1.00 0.00 H new ATOM 0 HA LEU A 463 4.456 4.567 6.674 1.00 0.00 H new ATOM 0 HB2 LEU A 463 2.430 6.026 4.983 1.00 0.00 H new ATOM 0 HB3 LEU A 463 3.989 5.373 4.520 1.00 0.00 H new ATOM 0 HG LEU A 463 1.462 3.840 5.038 1.00 0.00 H new ATOM 0 HD11 LEU A 463 1.647 3.281 2.580 1.00 0.00 H new ATOM 0 HD12 LEU A 463 1.503 5.032 2.858 1.00 0.00 H new ATOM 0 HD13 LEU A 463 3.089 4.318 2.485 1.00 0.00 H new ATOM 0 HD21 LEU A 463 2.642 1.828 4.161 1.00 0.00 H new ATOM 0 HD22 LEU A 463 4.157 2.761 4.119 1.00 0.00 H new ATOM 0 HD23 LEU A 463 3.358 2.431 5.675 1.00 0.00 H new ATOM 365 N ARG A 464 2.759 6.729 8.236 1.00 0.00 N ATOM 366 CA ARG A 464 2.503 8.047 8.833 1.00 0.00 C ATOM 367 C ARG A 464 1.927 9.031 7.798 1.00 0.00 C ATOM 368 O ARG A 464 2.176 10.234 7.862 1.00 0.00 O ATOM 369 CB ARG A 464 3.736 8.551 9.616 1.00 0.00 C ATOM 370 CG ARG A 464 4.111 7.684 10.834 1.00 0.00 C ATOM 371 CD ARG A 464 4.824 6.360 10.512 1.00 0.00 C ATOM 372 NE ARG A 464 5.473 5.798 11.715 1.00 0.00 N ATOM 373 CZ ARG A 464 5.866 4.554 11.923 1.00 0.00 C ATOM 374 NH1 ARG A 464 5.660 3.592 11.069 1.00 0.00 N ATOM 375 NH2 ARG A 464 6.488 4.244 13.024 1.00 0.00 N ATOM 0 H ARG A 464 2.225 5.994 8.700 1.00 0.00 H new ATOM 0 HA ARG A 464 1.718 7.957 9.584 1.00 0.00 H new ATOM 0 HB2 ARG A 464 4.589 8.594 8.939 1.00 0.00 H new ATOM 0 HB3 ARG A 464 3.546 9.570 9.954 1.00 0.00 H new ATOM 0 HG2 ARG A 464 4.752 8.271 11.492 1.00 0.00 H new ATOM 0 HG3 ARG A 464 3.202 7.460 11.392 1.00 0.00 H new ATOM 0 HD2 ARG A 464 4.105 5.644 10.115 1.00 0.00 H new ATOM 0 HD3 ARG A 464 5.571 6.525 9.736 1.00 0.00 H new ATOM 0 HE ARG A 464 5.638 6.452 12.480 1.00 0.00 H new ATOM 0 HH11 ARG A 464 5.175 3.783 10.192 1.00 0.00 H new ATOM 0 HH12 ARG A 464 5.984 2.647 11.277 1.00 0.00 H new ATOM 0 HH21 ARG A 464 6.672 4.961 13.725 1.00 0.00 H new ATOM 0 HH22 ARG A 464 6.792 3.284 13.185 1.00 0.00 H new ATOM 389 N LEU A 465 1.120 8.504 6.861 1.00 0.00 N ATOM 390 CA LEU A 465 0.485 9.263 5.769 1.00 0.00 C ATOM 391 C LEU A 465 -1.035 9.348 5.936 1.00 0.00 C ATOM 392 O LEU A 465 -1.552 10.435 6.174 1.00 0.00 O ATOM 393 CB LEU A 465 0.877 8.673 4.402 1.00 0.00 C ATOM 394 CG LEU A 465 2.353 8.884 4.021 1.00 0.00 C ATOM 395 CD1 LEU A 465 2.619 8.174 2.698 1.00 0.00 C ATOM 396 CD2 LEU A 465 2.717 10.365 3.899 1.00 0.00 C ATOM 0 H LEU A 465 0.885 7.512 6.842 1.00 0.00 H new ATOM 0 HA LEU A 465 0.858 10.286 5.815 1.00 0.00 H new ATOM 0 HB2 LEU A 465 0.664 7.604 4.406 1.00 0.00 H new ATOM 0 HB3 LEU A 465 0.248 9.120 3.632 1.00 0.00 H new ATOM 0 HG LEU A 465 2.974 8.469 4.815 1.00 0.00 H new ATOM 0 HD11 LEU A 465 3.662 8.314 2.413 1.00 0.00 H new ATOM 0 HD12 LEU A 465 2.413 7.109 2.808 1.00 0.00 H new ATOM 0 HD13 LEU A 465 1.973 8.591 1.925 1.00 0.00 H new ATOM 0 HD21 LEU A 465 3.769 10.460 3.629 1.00 0.00 H new ATOM 0 HD22 LEU A 465 2.101 10.829 3.129 1.00 0.00 H new ATOM 0 HD23 LEU A 465 2.541 10.863 4.853 1.00 0.00 H new ATOM 408 N HIS A 466 -1.739 8.209 5.842 1.00 0.00 N ATOM 409 CA HIS A 466 -3.189 8.052 6.128 1.00 0.00 C ATOM 410 C HIS A 466 -4.151 9.153 5.623 1.00 0.00 C ATOM 411 O HIS A 466 -5.186 9.421 6.241 1.00 0.00 O ATOM 412 CB HIS A 466 -3.365 7.679 7.603 1.00 0.00 C ATOM 413 CG HIS A 466 -2.995 8.715 8.628 1.00 0.00 C ATOM 414 ND1 HIS A 466 -1.722 9.057 9.032 1.00 0.00 N ATOM 415 CD2 HIS A 466 -3.856 9.171 9.581 1.00 0.00 C ATOM 416 CE1 HIS A 466 -1.820 9.685 10.215 1.00 0.00 C ATOM 417 NE2 HIS A 466 -3.106 9.795 10.584 1.00 0.00 N ATOM 0 H HIS A 466 -1.304 7.333 5.554 1.00 0.00 H new ATOM 0 HA HIS A 466 -3.530 7.233 5.494 1.00 0.00 H new ATOM 0 HB2 HIS A 466 -4.409 7.408 7.760 1.00 0.00 H new ATOM 0 HB3 HIS A 466 -2.771 6.786 7.798 1.00 0.00 H new ATOM 0 HD1 HIS A 466 -0.859 8.867 8.523 1.00 0.00 H new ATOM 0 HD2 HIS A 466 -4.931 9.068 9.565 1.00 0.00 H new ATOM 0 HE1 HIS A 466 -0.981 10.050 10.789 1.00 0.00 H new ATOM 425 N LYS A 467 -3.833 9.754 4.467 1.00 0.00 N ATOM 426 CA LYS A 467 -4.587 10.853 3.828 1.00 0.00 C ATOM 427 C LYS A 467 -5.001 10.595 2.379 1.00 0.00 C ATOM 428 O LYS A 467 -6.061 11.048 1.948 1.00 0.00 O ATOM 429 CB LYS A 467 -3.785 12.165 3.939 1.00 0.00 C ATOM 430 CG LYS A 467 -2.479 12.118 3.124 1.00 0.00 C ATOM 431 CD LYS A 467 -1.727 13.433 3.000 1.00 0.00 C ATOM 432 CE LYS A 467 -2.558 14.571 2.393 1.00 0.00 C ATOM 433 NZ LYS A 467 -1.732 15.791 2.186 1.00 0.00 N ATOM 0 H LYS A 467 -3.012 9.480 3.927 1.00 0.00 H new ATOM 0 HA LYS A 467 -5.526 10.929 4.376 1.00 0.00 H new ATOM 0 HB2 LYS A 467 -4.399 12.995 3.590 1.00 0.00 H new ATOM 0 HB3 LYS A 467 -3.551 12.359 4.986 1.00 0.00 H new ATOM 0 HG2 LYS A 467 -1.815 11.384 3.580 1.00 0.00 H new ATOM 0 HG3 LYS A 467 -2.712 11.759 2.122 1.00 0.00 H new ATOM 0 HD2 LYS A 467 -1.381 13.736 3.988 1.00 0.00 H new ATOM 0 HD3 LYS A 467 -0.840 13.276 2.386 1.00 0.00 H new ATOM 0 HE2 LYS A 467 -2.980 14.249 1.441 1.00 0.00 H new ATOM 0 HE3 LYS A 467 -3.396 14.803 3.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 467 -2.321 16.543 1.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 467 -1.350 16.111 3.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 467 -0.947 15.573 1.539 1.00 0.00 H new ATOM 447 N TYR A 468 -4.171 9.877 1.618 1.00 0.00 N ATOM 448 CA TYR A 468 -4.326 9.753 0.167 1.00 0.00 C ATOM 449 C TYR A 468 -5.500 8.867 -0.241 1.00 0.00 C ATOM 450 O TYR A 468 -5.970 8.949 -1.371 1.00 0.00 O ATOM 451 CB TYR A 468 -3.005 9.346 -0.473 1.00 0.00 C ATOM 452 CG TYR A 468 -1.941 10.377 -0.202 1.00 0.00 C ATOM 453 CD1 TYR A 468 -2.088 11.640 -0.809 1.00 0.00 C ATOM 454 CD2 TYR A 468 -0.862 10.118 0.659 1.00 0.00 C ATOM 455 CE1 TYR A 468 -1.126 12.640 -0.597 1.00 0.00 C ATOM 456 CE2 TYR A 468 0.112 11.115 0.848 1.00 0.00 C ATOM 457 CZ TYR A 468 0.006 12.361 0.192 1.00 0.00 C ATOM 458 OH TYR A 468 0.956 13.318 0.380 1.00 0.00 O ATOM 0 H TYR A 468 -3.372 9.365 1.991 1.00 0.00 H new ATOM 0 HA TYR A 468 -4.589 10.736 -0.224 1.00 0.00 H new ATOM 0 HB2 TYR A 468 -2.689 8.379 -0.082 1.00 0.00 H new ATOM 0 HB3 TYR A 468 -3.138 9.227 -1.548 1.00 0.00 H new ATOM 0 HD1 TYR A 468 -2.943 11.839 -1.439 1.00 0.00 H new ATOM 0 HD2 TYR A 468 -0.781 9.169 1.168 1.00 0.00 H new ATOM 0 HE1 TYR A 468 -1.254 13.618 -1.037 1.00 0.00 H new ATOM 0 HE2 TYR A 468 0.950 10.925 1.502 1.00 0.00 H new ATOM 0 HH TYR A 468 1.537 13.060 1.126 1.00 0.00 H new ATOM 468 N SER A 469 -6.058 8.118 0.710 1.00 0.00 N ATOM 469 CA SER A 469 -7.296 7.350 0.634 1.00 0.00 C ATOM 470 C SER A 469 -8.466 8.156 0.067 1.00 0.00 C ATOM 471 O SER A 469 -9.309 7.599 -0.631 1.00 0.00 O ATOM 472 CB SER A 469 -7.682 6.913 2.055 1.00 0.00 C ATOM 473 OG SER A 469 -7.480 7.976 2.976 1.00 0.00 O ATOM 0 H SER A 469 -5.619 8.027 1.626 1.00 0.00 H new ATOM 0 HA SER A 469 -7.112 6.507 -0.031 1.00 0.00 H new ATOM 0 HB2 SER A 469 -8.726 6.601 2.075 1.00 0.00 H new ATOM 0 HB3 SER A 469 -7.086 6.050 2.351 1.00 0.00 H new ATOM 0 HG SER A 469 -7.732 7.681 3.876 1.00 0.00 H new ATOM 479 N ASP A 470 -8.476 9.473 0.286 1.00 0.00 N ATOM 480 CA ASP A 470 -9.440 10.421 -0.270 1.00 0.00 C ATOM 481 C ASP A 470 -9.548 10.351 -1.807 1.00 0.00 C ATOM 482 O ASP A 470 -10.610 10.603 -2.380 1.00 0.00 O ATOM 483 CB ASP A 470 -9.013 11.826 0.167 1.00 0.00 C ATOM 484 CG ASP A 470 -10.017 12.909 -0.266 1.00 0.00 C ATOM 485 OD1 ASP A 470 -11.137 12.953 0.295 1.00 0.00 O ATOM 486 OD2 ASP A 470 -9.678 13.733 -1.149 1.00 0.00 O ATOM 0 H ASP A 470 -7.782 9.925 0.881 1.00 0.00 H new ATOM 0 HA ASP A 470 -10.430 10.166 0.108 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -8.905 11.848 1.251 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -8.034 12.053 -0.256 1.00 0.00 H new ATOM 491 N ALA A 471 -8.449 9.958 -2.460 1.00 0.00 N ATOM 492 CA ALA A 471 -8.298 9.786 -3.901 1.00 0.00 C ATOM 493 C ALA A 471 -7.825 8.376 -4.327 1.00 0.00 C ATOM 494 O ALA A 471 -7.779 8.069 -5.521 1.00 0.00 O ATOM 495 CB ALA A 471 -7.362 10.901 -4.378 1.00 0.00 C ATOM 0 H ALA A 471 -7.588 9.738 -1.959 1.00 0.00 H new ATOM 0 HA ALA A 471 -9.273 9.865 -4.382 1.00 0.00 H new ATOM 0 HB1 ALA A 471 -7.215 10.817 -5.455 1.00 0.00 H new ATOM 0 HB2 ALA A 471 -7.803 11.870 -4.146 1.00 0.00 H new ATOM 0 HB3 ALA A 471 -6.400 10.810 -3.873 1.00 0.00 H new ATOM 501 N LEU A 472 -7.507 7.506 -3.360 1.00 0.00 N ATOM 502 CA LEU A 472 -6.819 6.231 -3.541 1.00 0.00 C ATOM 503 C LEU A 472 -7.543 5.002 -2.956 1.00 0.00 C ATOM 504 O LEU A 472 -7.313 3.890 -3.421 1.00 0.00 O ATOM 505 CB LEU A 472 -5.433 6.458 -2.914 1.00 0.00 C ATOM 506 CG LEU A 472 -4.337 5.508 -3.388 1.00 0.00 C ATOM 507 CD1 LEU A 472 -3.049 6.300 -3.596 1.00 0.00 C ATOM 508 CD2 LEU A 472 -4.134 4.324 -2.446 1.00 0.00 C ATOM 0 H LEU A 472 -7.736 7.686 -2.383 1.00 0.00 H new ATOM 0 HA LEU A 472 -6.773 5.971 -4.599 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -5.120 7.481 -3.125 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -5.524 6.370 -1.831 1.00 0.00 H new ATOM 0 HG LEU A 472 -4.647 5.069 -4.337 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -2.260 5.629 -3.935 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -3.215 7.073 -4.346 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -2.751 6.764 -2.656 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -3.343 3.682 -2.833 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -3.854 4.689 -1.458 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -5.060 3.754 -2.373 1.00 0.00 H new ATOM 520 N SER A 473 -8.458 5.167 -1.991 1.00 0.00 N ATOM 521 CA SER A 473 -9.192 4.062 -1.336 1.00 0.00 C ATOM 522 C SER A 473 -10.127 3.295 -2.274 1.00 0.00 C ATOM 523 O SER A 473 -10.425 2.121 -2.050 1.00 0.00 O ATOM 524 CB SER A 473 -9.969 4.596 -0.136 1.00 0.00 C ATOM 525 OG SER A 473 -10.357 3.561 0.754 1.00 0.00 O ATOM 0 H SER A 473 -8.717 6.086 -1.633 1.00 0.00 H new ATOM 0 HA SER A 473 -8.439 3.344 -1.011 1.00 0.00 H new ATOM 0 HB2 SER A 473 -9.356 5.322 0.398 1.00 0.00 H new ATOM 0 HB3 SER A 473 -10.856 5.124 -0.485 1.00 0.00 H new ATOM 0 HG SER A 473 -10.850 3.946 1.508 1.00 0.00 H new ATOM 531 N GLY A 474 -10.531 3.939 -3.371 1.00 0.00 N ATOM 532 CA GLY A 474 -11.223 3.305 -4.500 1.00 0.00 C ATOM 533 C GLY A 474 -10.362 2.279 -5.263 1.00 0.00 C ATOM 534 O GLY A 474 -10.892 1.542 -6.097 1.00 0.00 O ATOM 0 H GLY A 474 -10.384 4.939 -3.504 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -12.121 2.809 -4.131 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -11.549 4.079 -5.195 1.00 0.00 H new ATOM 538 N THR A 475 -9.054 2.203 -4.974 1.00 0.00 N ATOM 539 CA THR A 475 -8.100 1.232 -5.537 1.00 0.00 C ATOM 540 C THR A 475 -7.697 0.188 -4.481 1.00 0.00 C ATOM 541 O THR A 475 -6.951 0.523 -3.557 1.00 0.00 O ATOM 542 CB THR A 475 -6.874 1.937 -6.143 1.00 0.00 C ATOM 543 OG1 THR A 475 -7.285 2.955 -7.037 1.00 0.00 O ATOM 544 CG2 THR A 475 -6.028 0.973 -6.969 1.00 0.00 C ATOM 0 H THR A 475 -8.612 2.843 -4.314 1.00 0.00 H new ATOM 0 HA THR A 475 -8.596 0.703 -6.351 1.00 0.00 H new ATOM 0 HB THR A 475 -6.302 2.336 -5.306 1.00 0.00 H new ATOM 0 HG1 THR A 475 -8.042 2.635 -7.571 1.00 0.00 H new ATOM 0 HG21 THR A 475 -5.170 1.504 -7.382 1.00 0.00 H new ATOM 0 HG22 THR A 475 -5.679 0.159 -6.334 1.00 0.00 H new ATOM 0 HG23 THR A 475 -6.629 0.566 -7.782 1.00 0.00 H new ATOM 552 N PRO A 476 -8.176 -1.074 -4.571 1.00 0.00 N ATOM 553 CA PRO A 476 -7.777 -2.141 -3.649 1.00 0.00 C ATOM 554 C PRO A 476 -6.297 -2.447 -3.785 1.00 0.00 C ATOM 555 O PRO A 476 -5.767 -2.407 -4.894 1.00 0.00 O ATOM 556 CB PRO A 476 -8.589 -3.383 -4.032 1.00 0.00 C ATOM 557 CG PRO A 476 -8.991 -3.122 -5.482 1.00 0.00 C ATOM 558 CD PRO A 476 -9.058 -1.603 -5.601 1.00 0.00 C ATOM 0 HA PRO A 476 -7.961 -1.839 -2.618 1.00 0.00 H new ATOM 0 HB2 PRO A 476 -7.996 -4.293 -3.939 1.00 0.00 H new ATOM 0 HB3 PRO A 476 -9.462 -3.504 -3.390 1.00 0.00 H new ATOM 0 HG2 PRO A 476 -8.262 -3.541 -6.176 1.00 0.00 H new ATOM 0 HG3 PRO A 476 -9.953 -3.580 -5.714 1.00 0.00 H new ATOM 0 HD2 PRO A 476 -8.740 -1.276 -6.591 1.00 0.00 H new ATOM 0 HD3 PRO A 476 -10.078 -1.246 -5.460 1.00 0.00 H new ATOM 566 N TRP A 477 -5.659 -2.867 -2.690 1.00 0.00 N ATOM 567 CA TRP A 477 -4.215 -3.133 -2.602 1.00 0.00 C ATOM 568 C TRP A 477 -3.644 -4.006 -3.725 1.00 0.00 C ATOM 569 O TRP A 477 -2.475 -3.902 -4.079 1.00 0.00 O ATOM 570 CB TRP A 477 -3.911 -3.822 -1.274 1.00 0.00 C ATOM 571 CG TRP A 477 -4.304 -5.269 -1.190 1.00 0.00 C ATOM 572 CD1 TRP A 477 -5.545 -5.770 -0.978 1.00 0.00 C ATOM 573 CD2 TRP A 477 -3.435 -6.430 -1.343 1.00 0.00 C ATOM 574 NE1 TRP A 477 -5.483 -7.138 -0.916 1.00 0.00 N ATOM 575 CE2 TRP A 477 -4.212 -7.611 -1.153 1.00 0.00 C ATOM 576 CE3 TRP A 477 -2.064 -6.604 -1.624 1.00 0.00 C ATOM 577 CZ2 TRP A 477 -3.657 -8.897 -1.216 1.00 0.00 C ATOM 578 CZ3 TRP A 477 -1.500 -7.884 -1.684 1.00 0.00 C ATOM 579 CH2 TRP A 477 -2.286 -9.029 -1.492 1.00 0.00 C ATOM 0 H TRP A 477 -6.146 -3.038 -1.810 1.00 0.00 H new ATOM 0 HA TRP A 477 -3.739 -2.157 -2.692 1.00 0.00 H new ATOM 0 HB2 TRP A 477 -2.841 -3.743 -1.080 1.00 0.00 H new ATOM 0 HB3 TRP A 477 -4.420 -3.279 -0.478 1.00 0.00 H new ATOM 0 HD1 TRP A 477 -6.445 -5.182 -0.874 1.00 0.00 H new ATOM 0 HE1 TRP A 477 -6.285 -7.736 -0.717 1.00 0.00 H new ATOM 0 HE3 TRP A 477 -1.441 -5.739 -1.795 1.00 0.00 H new ATOM 0 HZ2 TRP A 477 -4.272 -9.770 -1.055 1.00 0.00 H new ATOM 0 HZ3 TRP A 477 -0.444 -7.991 -1.881 1.00 0.00 H new ATOM 0 HH2 TRP A 477 -1.839 -10.010 -1.556 1.00 0.00 H new ATOM 590 N ILE A 478 -4.482 -4.852 -4.305 1.00 0.00 N ATOM 591 CA ILE A 478 -4.099 -5.844 -5.306 1.00 0.00 C ATOM 592 C ILE A 478 -4.058 -5.224 -6.707 1.00 0.00 C ATOM 593 O ILE A 478 -3.232 -5.618 -7.527 1.00 0.00 O ATOM 594 CB ILE A 478 -5.009 -7.089 -5.197 1.00 0.00 C ATOM 595 CG1 ILE A 478 -4.390 -8.352 -5.823 1.00 0.00 C ATOM 596 CG2 ILE A 478 -6.390 -6.863 -5.831 1.00 0.00 C ATOM 597 CD1 ILE A 478 -3.195 -8.900 -5.037 1.00 0.00 C ATOM 0 H ILE A 478 -5.478 -4.870 -4.087 1.00 0.00 H new ATOM 0 HA ILE A 478 -3.083 -6.187 -5.111 1.00 0.00 H new ATOM 0 HB ILE A 478 -5.120 -7.248 -4.124 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -5.155 -9.126 -5.893 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -4.072 -8.125 -6.841 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -6.990 -7.767 -5.728 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -6.890 -6.036 -5.328 1.00 0.00 H new ATOM 0 HG23 ILE A 478 -6.271 -6.626 -6.888 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -2.809 -9.790 -5.535 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -2.413 -8.143 -4.989 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -3.512 -9.158 -4.027 1.00 0.00 H new ATOM 609 N GLU A 479 -4.901 -4.214 -6.973 1.00 0.00 N ATOM 610 CA GLU A 479 -4.758 -3.366 -8.168 1.00 0.00 C ATOM 611 C GLU A 479 -3.769 -2.212 -7.897 1.00 0.00 C ATOM 612 O GLU A 479 -3.273 -1.570 -8.824 1.00 0.00 O ATOM 613 CB GLU A 479 -6.125 -2.802 -8.588 1.00 0.00 C ATOM 614 CG GLU A 479 -7.073 -3.907 -9.080 1.00 0.00 C ATOM 615 CD GLU A 479 -8.350 -3.310 -9.701 1.00 0.00 C ATOM 616 OE1 GLU A 479 -8.341 -2.979 -10.912 1.00 0.00 O ATOM 617 OE2 GLU A 479 -9.376 -3.177 -8.991 1.00 0.00 O ATOM 0 H GLU A 479 -5.690 -3.964 -6.376 1.00 0.00 H new ATOM 0 HA GLU A 479 -4.365 -3.978 -8.980 1.00 0.00 H new ATOM 0 HB2 GLU A 479 -6.579 -2.283 -7.744 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -5.986 -2.064 -9.378 1.00 0.00 H new ATOM 0 HG2 GLU A 479 -6.562 -4.526 -9.817 1.00 0.00 H new ATOM 0 HG3 GLU A 479 -7.340 -4.558 -8.247 1.00 0.00 H new ATOM 624 N LEU A 480 -3.478 -1.953 -6.617 1.00 0.00 N ATOM 625 CA LEU A 480 -2.746 -0.800 -6.117 1.00 0.00 C ATOM 626 C LEU A 480 -1.245 -0.932 -6.120 1.00 0.00 C ATOM 627 O LEU A 480 -0.548 -0.052 -6.612 1.00 0.00 O ATOM 628 CB LEU A 480 -3.120 -0.574 -4.651 1.00 0.00 C ATOM 629 CG LEU A 480 -2.668 0.763 -4.095 1.00 0.00 C ATOM 630 CD1 LEU A 480 -3.587 1.782 -4.710 1.00 0.00 C ATOM 631 CD2 LEU A 480 -2.816 0.769 -2.582 1.00 0.00 C ATOM 0 H LEU A 480 -3.766 -2.581 -5.867 1.00 0.00 H new ATOM 0 HA LEU A 480 -3.020 0.009 -6.794 1.00 0.00 H new ATOM 0 HB2 LEU A 480 -4.202 -0.651 -4.547 1.00 0.00 H new ATOM 0 HB3 LEU A 480 -2.684 -1.372 -4.049 1.00 0.00 H new ATOM 0 HG LEU A 480 -1.623 0.971 -4.323 1.00 0.00 H new ATOM 0 HD11 LEU A 480 -3.319 2.776 -4.353 1.00 0.00 H new ATOM 0 HD12 LEU A 480 -3.493 1.749 -5.795 1.00 0.00 H new ATOM 0 HD13 LEU A 480 -4.616 1.560 -4.428 1.00 0.00 H new ATOM 0 HD21 LEU A 480 -2.490 1.732 -2.188 1.00 0.00 H new ATOM 0 HD22 LEU A 480 -3.861 0.604 -2.318 1.00 0.00 H new ATOM 0 HD23 LEU A 480 -2.204 -0.024 -2.153 1.00 0.00 H new ATOM 643 N ILE A 481 -0.733 -1.993 -5.499 1.00 0.00 N ATOM 644 CA ILE A 481 0.695 -2.113 -5.230 1.00 0.00 C ATOM 645 C ILE A 481 1.521 -2.108 -6.533 1.00 0.00 C ATOM 646 O ILE A 481 2.723 -1.855 -6.552 1.00 0.00 O ATOM 647 CB ILE A 481 0.959 -3.378 -4.385 1.00 0.00 C ATOM 648 CG1 ILE A 481 0.546 -4.637 -5.184 1.00 0.00 C ATOM 649 CG2 ILE A 481 0.306 -3.207 -2.996 1.00 0.00 C ATOM 650 CD1 ILE A 481 0.604 -5.934 -4.391 1.00 0.00 C ATOM 0 H ILE A 481 -1.289 -2.783 -5.173 1.00 0.00 H new ATOM 0 HA ILE A 481 1.019 -1.243 -4.659 1.00 0.00 H new ATOM 0 HB ILE A 481 2.020 -3.521 -4.182 1.00 0.00 H new ATOM 0 HG12 ILE A 481 -0.469 -4.499 -5.557 1.00 0.00 H new ATOM 0 HG13 ILE A 481 1.195 -4.729 -6.055 1.00 0.00 H new ATOM 0 HG21 ILE A 481 0.490 -4.098 -2.395 1.00 0.00 H new ATOM 0 HG22 ILE A 481 0.735 -2.338 -2.497 1.00 0.00 H new ATOM 0 HG23 ILE A 481 -0.768 -3.064 -3.114 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.299 -6.764 -5.028 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.623 -6.101 -4.041 1.00 0.00 H new ATOM 0 HD13 ILE A 481 -0.068 -5.868 -3.535 1.00 0.00 H new ATOM 662 N TYR A 482 0.811 -2.363 -7.632 1.00 0.00 N ATOM 663 CA TYR A 482 1.205 -2.397 -9.033 1.00 0.00 C ATOM 664 C TYR A 482 1.459 -1.011 -9.648 1.00 0.00 C ATOM 665 O TYR A 482 1.991 -0.926 -10.760 1.00 0.00 O ATOM 666 CB TYR A 482 0.034 -3.051 -9.777 1.00 0.00 C ATOM 667 CG TYR A 482 -0.156 -4.553 -9.652 1.00 0.00 C ATOM 668 CD1 TYR A 482 0.683 -5.368 -8.861 1.00 0.00 C ATOM 669 CD2 TYR A 482 -1.236 -5.128 -10.346 1.00 0.00 C ATOM 670 CE1 TYR A 482 0.433 -6.749 -8.747 1.00 0.00 C ATOM 671 CE2 TYR A 482 -1.486 -6.507 -10.253 1.00 0.00 C ATOM 672 CZ TYR A 482 -0.656 -7.319 -9.453 1.00 0.00 C ATOM 673 OH TYR A 482 -0.915 -8.653 -9.384 1.00 0.00 O ATOM 0 H TYR A 482 -0.182 -2.578 -7.544 1.00 0.00 H new ATOM 0 HA TYR A 482 2.148 -2.938 -9.117 1.00 0.00 H new ATOM 0 HB2 TYR A 482 -0.884 -2.571 -9.437 1.00 0.00 H new ATOM 0 HB3 TYR A 482 0.142 -2.818 -10.836 1.00 0.00 H new ATOM 0 HD1 TYR A 482 1.521 -4.930 -8.340 1.00 0.00 H new ATOM 0 HD2 TYR A 482 -1.876 -4.506 -10.954 1.00 0.00 H new ATOM 0 HE1 TYR A 482 1.065 -7.368 -8.128 1.00 0.00 H new ATOM 0 HE2 TYR A 482 -2.312 -6.945 -10.793 1.00 0.00 H new ATOM 0 HH TYR A 482 -1.700 -8.863 -9.932 1.00 0.00 H new ATOM 683 N LEU A 483 1.066 0.066 -8.961 1.00 0.00 N ATOM 684 CA LEU A 483 1.341 1.442 -9.399 1.00 0.00 C ATOM 685 C LEU A 483 2.852 1.758 -9.327 1.00 0.00 C ATOM 686 O LEU A 483 3.698 0.923 -8.999 1.00 0.00 O ATOM 687 CB LEU A 483 0.529 2.474 -8.587 1.00 0.00 C ATOM 688 CG LEU A 483 -1.002 2.295 -8.591 1.00 0.00 C ATOM 689 CD1 LEU A 483 -1.626 2.954 -7.379 1.00 0.00 C ATOM 690 CD2 LEU A 483 -1.650 3.035 -9.756 1.00 0.00 C ATOM 0 H LEU A 483 0.548 0.011 -8.084 1.00 0.00 H new ATOM 0 HA LEU A 483 1.025 1.517 -10.439 1.00 0.00 H new ATOM 0 HB2 LEU A 483 0.874 2.444 -7.554 1.00 0.00 H new ATOM 0 HB3 LEU A 483 0.758 3.468 -8.971 1.00 0.00 H new ATOM 0 HG LEU A 483 -1.164 1.218 -8.631 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -2.707 2.814 -7.405 1.00 0.00 H new ATOM 0 HD12 LEU A 483 -1.223 2.503 -6.472 1.00 0.00 H new ATOM 0 HD13 LEU A 483 -1.398 4.020 -7.387 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -2.729 2.886 -9.726 1.00 0.00 H new ATOM 0 HD22 LEU A 483 -1.428 4.099 -9.679 1.00 0.00 H new ATOM 0 HD23 LEU A 483 -1.256 2.649 -10.696 1.00 0.00 H new ATOM 702 N ASP A 484 3.184 3.001 -9.648 1.00 0.00 N ATOM 703 CA ASP A 484 4.534 3.519 -9.842 1.00 0.00 C ATOM 704 C ASP A 484 4.727 4.841 -9.094 1.00 0.00 C ATOM 705 O ASP A 484 3.775 5.414 -8.558 1.00 0.00 O ATOM 706 CB ASP A 484 4.675 3.815 -11.334 1.00 0.00 C ATOM 707 CG ASP A 484 6.120 3.992 -11.841 1.00 0.00 C ATOM 708 OD1 ASP A 484 7.078 3.600 -11.134 1.00 0.00 O ATOM 709 OD2 ASP A 484 6.297 4.544 -12.953 1.00 0.00 O ATOM 0 H ASP A 484 2.475 3.720 -9.789 1.00 0.00 H new ATOM 0 HA ASP A 484 5.263 2.796 -9.476 1.00 0.00 H new ATOM 0 HB2 ASP A 484 4.209 3.004 -11.893 1.00 0.00 H new ATOM 0 HB3 ASP A 484 4.115 4.722 -11.561 1.00 0.00 H new ATOM 714 N ASP A 485 5.942 5.380 -9.183 1.00 0.00 N ATOM 715 CA ASP A 485 6.300 6.721 -8.747 1.00 0.00 C ATOM 716 C ASP A 485 5.310 7.785 -9.242 1.00 0.00 C ATOM 717 O ASP A 485 4.561 8.357 -8.451 1.00 0.00 O ATOM 718 CB ASP A 485 7.748 7.014 -9.177 1.00 0.00 C ATOM 719 CG ASP A 485 8.236 8.381 -8.686 1.00 0.00 C ATOM 720 OD1 ASP A 485 8.288 8.606 -7.459 1.00 0.00 O ATOM 721 OD2 ASP A 485 8.542 9.265 -9.518 1.00 0.00 O ATOM 0 H ASP A 485 6.733 4.871 -9.577 1.00 0.00 H new ATOM 0 HA ASP A 485 6.239 6.767 -7.660 1.00 0.00 H new ATOM 0 HB2 ASP A 485 8.404 6.235 -8.788 1.00 0.00 H new ATOM 0 HB3 ASP A 485 7.817 6.975 -10.264 1.00 0.00 H new ATOM 726 N GLU A 486 5.257 8.045 -10.549 1.00 0.00 N ATOM 727 CA GLU A 486 4.402 9.075 -11.110 1.00 0.00 C ATOM 728 C GLU A 486 2.935 8.652 -11.248 1.00 0.00 C ATOM 729 O GLU A 486 2.077 9.508 -11.437 1.00 0.00 O ATOM 730 CB GLU A 486 4.995 9.511 -12.459 1.00 0.00 C ATOM 731 CG GLU A 486 4.658 10.981 -12.686 1.00 0.00 C ATOM 732 CD GLU A 486 5.022 11.502 -14.091 1.00 0.00 C ATOM 733 OE1 GLU A 486 6.175 11.310 -14.549 1.00 0.00 O ATOM 734 OE2 GLU A 486 4.149 12.136 -14.736 1.00 0.00 O ATOM 0 H GLU A 486 5.809 7.543 -11.244 1.00 0.00 H new ATOM 0 HA GLU A 486 4.380 9.914 -10.415 1.00 0.00 H new ATOM 0 HB2 GLU A 486 6.075 9.366 -12.462 1.00 0.00 H new ATOM 0 HB3 GLU A 486 4.589 8.901 -13.266 1.00 0.00 H new ATOM 0 HG2 GLU A 486 3.590 11.127 -12.522 1.00 0.00 H new ATOM 0 HG3 GLU A 486 5.180 11.581 -11.941 1.00 0.00 H new ATOM 741 N THR A 487 2.593 7.368 -11.122 1.00 0.00 N ATOM 742 CA THR A 487 1.183 6.953 -11.263 1.00 0.00 C ATOM 743 C THR A 487 0.366 7.104 -9.991 1.00 0.00 C ATOM 744 O THR A 487 -0.808 7.467 -10.057 1.00 0.00 O ATOM 745 CB THR A 487 1.026 5.550 -11.866 1.00 0.00 C ATOM 746 OG1 THR A 487 1.774 5.458 -13.060 1.00 0.00 O ATOM 747 CG2 THR A 487 -0.430 5.225 -12.220 1.00 0.00 C ATOM 0 H THR A 487 3.248 6.611 -10.928 1.00 0.00 H new ATOM 0 HA THR A 487 0.765 7.661 -11.979 1.00 0.00 H new ATOM 0 HB THR A 487 1.377 4.847 -11.111 1.00 0.00 H new ATOM 0 HG1 THR A 487 1.673 4.561 -13.441 1.00 0.00 H new ATOM 0 HG21 THR A 487 -0.486 4.222 -12.643 1.00 0.00 H new ATOM 0 HG22 THR A 487 -1.043 5.275 -11.320 1.00 0.00 H new ATOM 0 HG23 THR A 487 -0.797 5.947 -12.949 1.00 0.00 H new ATOM 755 N LEU A 488 0.983 6.963 -8.821 1.00 0.00 N ATOM 756 CA LEU A 488 0.366 7.349 -7.558 1.00 0.00 C ATOM 757 C LEU A 488 -0.019 8.823 -7.541 1.00 0.00 C ATOM 758 O LEU A 488 -0.967 9.243 -6.884 1.00 0.00 O ATOM 759 CB LEU A 488 1.405 7.060 -6.474 1.00 0.00 C ATOM 760 CG LEU A 488 1.427 5.572 -6.123 1.00 0.00 C ATOM 761 CD1 LEU A 488 2.643 5.304 -5.253 1.00 0.00 C ATOM 762 CD2 LEU A 488 0.149 5.216 -5.370 1.00 0.00 C ATOM 0 H LEU A 488 1.923 6.579 -8.723 1.00 0.00 H new ATOM 0 HA LEU A 488 -0.557 6.791 -7.399 1.00 0.00 H new ATOM 0 HB2 LEU A 488 2.391 7.371 -6.818 1.00 0.00 H new ATOM 0 HB3 LEU A 488 1.179 7.645 -5.582 1.00 0.00 H new ATOM 0 HG LEU A 488 1.483 4.964 -7.026 1.00 0.00 H new ATOM 0 HD11 LEU A 488 2.677 4.246 -4.991 1.00 0.00 H new ATOM 0 HD12 LEU A 488 3.547 5.572 -5.799 1.00 0.00 H new ATOM 0 HD13 LEU A 488 2.578 5.901 -4.343 1.00 0.00 H new ATOM 0 HD21 LEU A 488 0.159 4.156 -5.117 1.00 0.00 H new ATOM 0 HD22 LEU A 488 0.089 5.807 -4.456 1.00 0.00 H new ATOM 0 HD23 LEU A 488 -0.715 5.431 -5.998 1.00 0.00 H new ATOM 774 N GLU A 489 0.688 9.623 -8.318 1.00 0.00 N ATOM 775 CA GLU A 489 0.500 11.032 -8.483 1.00 0.00 C ATOM 776 C GLU A 489 -0.622 11.354 -9.489 1.00 0.00 C ATOM 777 O GLU A 489 -1.236 12.416 -9.401 1.00 0.00 O ATOM 778 CB GLU A 489 1.910 11.473 -8.834 1.00 0.00 C ATOM 779 CG GLU A 489 2.017 12.922 -9.241 1.00 0.00 C ATOM 780 CD GLU A 489 3.405 13.504 -8.943 1.00 0.00 C ATOM 781 OE1 GLU A 489 3.808 13.494 -7.753 1.00 0.00 O ATOM 782 OE2 GLU A 489 4.091 13.976 -9.879 1.00 0.00 O ATOM 0 H GLU A 489 1.459 9.270 -8.885 1.00 0.00 H new ATOM 0 HA GLU A 489 0.126 11.579 -7.617 1.00 0.00 H new ATOM 0 HB2 GLU A 489 2.558 11.299 -7.975 1.00 0.00 H new ATOM 0 HB3 GLU A 489 2.283 10.850 -9.647 1.00 0.00 H new ATOM 0 HG2 GLU A 489 1.806 13.015 -10.306 1.00 0.00 H new ATOM 0 HG3 GLU A 489 1.260 13.503 -8.714 1.00 0.00 H new ATOM 789 N LYS A 490 -0.995 10.415 -10.369 1.00 0.00 N ATOM 790 CA LYS A 490 -2.215 10.488 -11.172 1.00 0.00 C ATOM 791 C LYS A 490 -3.449 10.047 -10.373 1.00 0.00 C ATOM 792 O LYS A 490 -4.562 10.466 -10.697 1.00 0.00 O ATOM 793 CB LYS A 490 -2.042 9.657 -12.442 1.00 0.00 C ATOM 794 CG LYS A 490 -0.764 9.896 -13.235 1.00 0.00 C ATOM 795 CD LYS A 490 -0.468 11.351 -13.566 1.00 0.00 C ATOM 796 CE LYS A 490 1.008 11.424 -13.970 1.00 0.00 C ATOM 797 NZ LYS A 490 1.426 12.765 -14.446 1.00 0.00 N ATOM 0 H LYS A 490 -0.447 9.572 -10.543 1.00 0.00 H new ATOM 0 HA LYS A 490 -2.384 11.527 -11.453 1.00 0.00 H new ATOM 0 HB2 LYS A 490 -2.083 8.602 -12.169 1.00 0.00 H new ATOM 0 HB3 LYS A 490 -2.892 9.851 -13.096 1.00 0.00 H new ATOM 0 HG2 LYS A 490 0.076 9.491 -12.670 1.00 0.00 H new ATOM 0 HG3 LYS A 490 -0.823 9.333 -14.167 1.00 0.00 H new ATOM 0 HD2 LYS A 490 -1.108 11.701 -14.376 1.00 0.00 H new ATOM 0 HD3 LYS A 490 -0.665 11.991 -12.706 1.00 0.00 H new ATOM 0 HE2 LYS A 490 1.624 11.142 -13.116 1.00 0.00 H new ATOM 0 HE3 LYS A 490 1.198 10.693 -14.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 2.451 12.767 -14.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 0.923 12.993 -15.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 1.197 13.477 -13.723 1.00 0.00 H new ATOM 811 N LYS A 491 -3.258 9.248 -9.309 1.00 0.00 N ATOM 812 CA LYS A 491 -4.273 8.924 -8.297 1.00 0.00 C ATOM 813 C LYS A 491 -4.510 10.150 -7.424 1.00 0.00 C ATOM 814 O LYS A 491 -5.623 10.665 -7.347 1.00 0.00 O ATOM 815 CB LYS A 491 -3.894 7.611 -7.562 1.00 0.00 C ATOM 816 CG LYS A 491 -3.894 6.345 -8.436 1.00 0.00 C ATOM 817 CD LYS A 491 -5.296 5.864 -8.820 1.00 0.00 C ATOM 818 CE LYS A 491 -5.205 4.496 -9.508 1.00 0.00 C ATOM 819 NZ LYS A 491 -6.543 3.872 -9.674 1.00 0.00 N ATOM 0 H LYS A 491 -2.362 8.796 -9.126 1.00 0.00 H new ATOM 0 HA LYS A 491 -5.243 8.701 -8.742 1.00 0.00 H new ATOM 0 HB2 LYS A 491 -2.902 7.731 -7.126 1.00 0.00 H new ATOM 0 HB3 LYS A 491 -4.590 7.462 -6.736 1.00 0.00 H new ATOM 0 HG2 LYS A 491 -3.325 6.541 -9.345 1.00 0.00 H new ATOM 0 HG3 LYS A 491 -3.378 5.546 -7.903 1.00 0.00 H new ATOM 0 HD2 LYS A 491 -5.923 5.793 -7.931 1.00 0.00 H new ATOM 0 HD3 LYS A 491 -5.768 6.586 -9.486 1.00 0.00 H new ATOM 0 HE2 LYS A 491 -4.734 4.611 -10.484 1.00 0.00 H new ATOM 0 HE3 LYS A 491 -4.566 3.836 -8.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 491 -6.472 3.067 -10.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 491 -6.888 3.539 -8.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 491 -7.208 4.573 -10.059 1.00 0.00 H new ATOM 833 N GLY A 492 -3.432 10.666 -6.864 1.00 0.00 N ATOM 834 CA GLY A 492 -3.314 11.983 -6.280 1.00 0.00 C ATOM 835 C GLY A 492 -2.624 12.053 -4.945 1.00 0.00 C ATOM 836 O GLY A 492 -2.946 12.861 -4.075 1.00 0.00 O ATOM 0 H GLY A 492 -2.561 10.140 -6.803 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -2.775 12.622 -6.979 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -4.314 12.402 -6.172 1.00 0.00 H new ATOM 840 N VAL A 493 -1.606 11.215 -4.845 1.00 0.00 N ATOM 841 CA VAL A 493 -0.586 11.272 -3.830 1.00 0.00 C ATOM 842 C VAL A 493 0.198 12.585 -3.965 1.00 0.00 C ATOM 843 O VAL A 493 0.461 13.298 -3.003 1.00 0.00 O ATOM 844 CB VAL A 493 0.259 10.017 -3.998 1.00 0.00 C ATOM 845 CG1 VAL A 493 1.492 10.162 -3.165 1.00 0.00 C ATOM 846 CG2 VAL A 493 -0.583 8.805 -3.591 1.00 0.00 C ATOM 0 H VAL A 493 -1.469 10.446 -5.501 1.00 0.00 H new ATOM 0 HA VAL A 493 -0.987 11.282 -2.817 1.00 0.00 H new ATOM 0 HB VAL A 493 0.570 9.873 -5.033 1.00 0.00 H new ATOM 0 HG11 VAL A 493 2.111 9.271 -3.273 1.00 0.00 H new ATOM 0 HG12 VAL A 493 2.054 11.036 -3.495 1.00 0.00 H new ATOM 0 HG13 VAL A 493 1.212 10.285 -2.119 1.00 0.00 H new ATOM 0 HG21 VAL A 493 0.008 7.896 -3.706 1.00 0.00 H new ATOM 0 HG22 VAL A 493 -0.891 8.909 -2.551 1.00 0.00 H new ATOM 0 HG23 VAL A 493 -1.466 8.746 -4.227 1.00 0.00 H new ATOM 856 N LEU A 494 0.506 12.923 -5.217 1.00 0.00 N ATOM 857 CA LEU A 494 1.025 14.192 -5.724 1.00 0.00 C ATOM 858 C LEU A 494 2.272 14.780 -5.055 1.00 0.00 C ATOM 859 O LEU A 494 2.530 15.987 -5.056 1.00 0.00 O ATOM 860 CB LEU A 494 -0.133 15.174 -5.879 1.00 0.00 C ATOM 861 CG LEU A 494 -0.795 14.822 -7.215 1.00 0.00 C ATOM 862 CD1 LEU A 494 -2.282 14.868 -7.078 1.00 0.00 C ATOM 863 CD2 LEU A 494 -0.261 15.703 -8.331 1.00 0.00 C ATOM 0 H LEU A 494 0.387 12.250 -5.974 1.00 0.00 H new ATOM 0 HA LEU A 494 1.454 13.964 -6.700 1.00 0.00 H new ATOM 0 HB2 LEU A 494 -0.840 15.080 -5.054 1.00 0.00 H new ATOM 0 HB3 LEU A 494 0.224 16.204 -5.877 1.00 0.00 H new ATOM 0 HG LEU A 494 -0.538 13.800 -7.493 1.00 0.00 H new ATOM 0 HD11 LEU A 494 -2.743 14.616 -8.033 1.00 0.00 H new ATOM 0 HD12 LEU A 494 -2.600 14.151 -6.321 1.00 0.00 H new ATOM 0 HD13 LEU A 494 -2.589 15.870 -6.780 1.00 0.00 H new ATOM 0 HD21 LEU A 494 -0.746 15.435 -9.270 1.00 0.00 H new ATOM 0 HD22 LEU A 494 -0.469 16.748 -8.101 1.00 0.00 H new ATOM 0 HD23 LEU A 494 0.815 15.560 -8.424 1.00 0.00 H new ATOM 875 N ALA A 495 3.034 13.878 -4.469 1.00 0.00 N ATOM 876 CA ALA A 495 4.173 14.158 -3.607 1.00 0.00 C ATOM 877 C ALA A 495 5.183 13.027 -3.708 1.00 0.00 C ATOM 878 O ALA A 495 4.848 11.889 -3.388 1.00 0.00 O ATOM 879 CB ALA A 495 3.671 14.284 -2.167 1.00 0.00 C ATOM 0 H ALA A 495 2.870 12.878 -4.585 1.00 0.00 H new ATOM 0 HA ALA A 495 4.657 15.085 -3.914 1.00 0.00 H new ATOM 0 HB1 ALA A 495 4.512 14.494 -1.506 1.00 0.00 H new ATOM 0 HB2 ALA A 495 2.948 15.097 -2.104 1.00 0.00 H new ATOM 0 HB3 ALA A 495 3.196 13.351 -1.864 1.00 0.00 H new ATOM 885 N LEU A 496 6.418 13.324 -4.112 1.00 0.00 N ATOM 886 CA LEU A 496 7.512 12.356 -4.166 1.00 0.00 C ATOM 887 C LEU A 496 7.688 11.624 -2.851 1.00 0.00 C ATOM 888 O LEU A 496 7.649 10.400 -2.822 1.00 0.00 O ATOM 889 CB LEU A 496 8.773 13.046 -4.650 1.00 0.00 C ATOM 890 CG LEU A 496 10.069 12.210 -4.517 1.00 0.00 C ATOM 891 CD1 LEU A 496 11.043 12.626 -5.611 1.00 0.00 C ATOM 892 CD2 LEU A 496 10.819 12.422 -3.194 1.00 0.00 C ATOM 0 H LEU A 496 6.690 14.259 -4.416 1.00 0.00 H new ATOM 0 HA LEU A 496 7.267 11.576 -4.887 1.00 0.00 H new ATOM 0 HB2 LEU A 496 8.641 13.319 -5.697 1.00 0.00 H new ATOM 0 HB3 LEU A 496 8.898 13.974 -4.092 1.00 0.00 H new ATOM 0 HG LEU A 496 9.751 11.169 -4.580 1.00 0.00 H new ATOM 0 HD11 LEU A 496 11.959 12.042 -5.524 1.00 0.00 H new ATOM 0 HD12 LEU A 496 10.591 12.449 -6.587 1.00 0.00 H new ATOM 0 HD13 LEU A 496 11.277 13.685 -5.506 1.00 0.00 H new ATOM 0 HD21 LEU A 496 11.715 11.801 -3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 496 11.103 13.470 -3.101 1.00 0.00 H new ATOM 0 HD23 LEU A 496 10.173 12.146 -2.361 1.00 0.00 H new ATOM 904 N GLY A 497 7.789 12.351 -1.742 1.00 0.00 N ATOM 905 CA GLY A 497 7.949 11.706 -0.444 1.00 0.00 C ATOM 906 C GLY A 497 6.650 11.269 0.224 1.00 0.00 C ATOM 907 O GLY A 497 6.542 11.207 1.447 1.00 0.00 O ATOM 0 H GLY A 497 7.763 13.370 -1.715 1.00 0.00 H new ATOM 0 HA2 GLY A 497 8.589 10.832 -0.566 1.00 0.00 H new ATOM 0 HA3 GLY A 497 8.470 12.392 0.224 1.00 0.00 H new ATOM 911 N ALA A 498 5.696 10.914 -0.630 1.00 0.00 N ATOM 912 CA ALA A 498 4.468 10.187 -0.334 1.00 0.00 C ATOM 913 C ALA A 498 4.363 8.985 -1.281 1.00 0.00 C ATOM 914 O ALA A 498 4.248 7.844 -0.848 1.00 0.00 O ATOM 915 CB ALA A 498 3.272 11.115 -0.480 1.00 0.00 C ATOM 0 H ALA A 498 5.767 11.145 -1.621 1.00 0.00 H new ATOM 0 HA ALA A 498 4.482 9.822 0.693 1.00 0.00 H new ATOM 0 HB1 ALA A 498 2.357 10.567 -0.258 1.00 0.00 H new ATOM 0 HB2 ALA A 498 3.372 11.950 0.214 1.00 0.00 H new ATOM 0 HB3 ALA A 498 3.229 11.495 -1.501 1.00 0.00 H new ATOM 921 N ARG A 499 4.506 9.205 -2.590 1.00 0.00 N ATOM 922 CA ARG A 499 4.495 8.153 -3.616 1.00 0.00 C ATOM 923 C ARG A 499 5.667 7.164 -3.480 1.00 0.00 C ATOM 924 O ARG A 499 5.496 5.996 -3.779 1.00 0.00 O ATOM 925 CB ARG A 499 4.386 8.792 -5.017 1.00 0.00 C ATOM 926 CG ARG A 499 5.618 9.615 -5.393 1.00 0.00 C ATOM 927 CD ARG A 499 5.415 10.685 -6.474 1.00 0.00 C ATOM 928 NE ARG A 499 6.648 10.882 -7.257 1.00 0.00 N ATOM 929 CZ ARG A 499 7.109 11.950 -7.872 1.00 0.00 C ATOM 930 NH1 ARG A 499 6.519 13.108 -7.841 1.00 0.00 N ATOM 931 NH2 ARG A 499 8.210 11.857 -8.554 1.00 0.00 N ATOM 0 H ARG A 499 4.636 10.140 -2.977 1.00 0.00 H new ATOM 0 HA ARG A 499 3.610 7.535 -3.463 1.00 0.00 H new ATOM 0 HB2 ARG A 499 4.240 8.007 -5.759 1.00 0.00 H new ATOM 0 HB3 ARG A 499 3.504 9.431 -5.052 1.00 0.00 H new ATOM 0 HG2 ARG A 499 5.991 10.104 -4.493 1.00 0.00 H new ATOM 0 HG3 ARG A 499 6.397 8.931 -5.730 1.00 0.00 H new ATOM 0 HD2 ARG A 499 4.602 10.388 -7.137 1.00 0.00 H new ATOM 0 HD3 ARG A 499 5.120 11.626 -6.009 1.00 0.00 H new ATOM 0 HE ARG A 499 7.241 10.056 -7.335 1.00 0.00 H new ATOM 0 HH11 ARG A 499 5.650 13.224 -7.319 1.00 0.00 H new ATOM 0 HH12 ARG A 499 6.925 13.901 -8.338 1.00 0.00 H new ATOM 0 HH21 ARG A 499 8.703 10.966 -8.607 1.00 0.00 H new ATOM 0 HH22 ARG A 499 8.581 12.675 -9.037 1.00 0.00 H new ATOM 945 N ARG A 500 6.825 7.553 -2.931 1.00 0.00 N ATOM 946 CA ARG A 500 8.060 6.755 -2.774 1.00 0.00 C ATOM 947 C ARG A 500 7.982 5.972 -1.472 1.00 0.00 C ATOM 948 O ARG A 500 8.334 4.800 -1.382 1.00 0.00 O ATOM 949 CB ARG A 500 9.199 7.774 -2.745 1.00 0.00 C ATOM 950 CG ARG A 500 10.511 7.156 -2.311 1.00 0.00 C ATOM 951 CD ARG A 500 11.591 8.223 -2.431 1.00 0.00 C ATOM 952 NE ARG A 500 12.909 7.709 -2.010 1.00 0.00 N ATOM 953 CZ ARG A 500 14.040 8.386 -1.914 1.00 0.00 C ATOM 954 NH1 ARG A 500 14.114 9.655 -2.201 1.00 0.00 N ATOM 955 NH2 ARG A 500 15.132 7.795 -1.522 1.00 0.00 N ATOM 0 H ARG A 500 6.937 8.496 -2.558 1.00 0.00 H new ATOM 0 HA ARG A 500 8.208 6.033 -3.577 1.00 0.00 H new ATOM 0 HB2 ARG A 500 9.317 8.213 -3.736 1.00 0.00 H new ATOM 0 HB3 ARG A 500 8.940 8.586 -2.066 1.00 0.00 H new ATOM 0 HG2 ARG A 500 10.442 6.796 -1.285 1.00 0.00 H new ATOM 0 HG3 ARG A 500 10.753 6.296 -2.935 1.00 0.00 H new ATOM 0 HD2 ARG A 500 11.648 8.570 -3.463 1.00 0.00 H new ATOM 0 HD3 ARG A 500 11.323 9.084 -1.819 1.00 0.00 H new ATOM 0 HE ARG A 500 12.952 6.720 -1.766 1.00 0.00 H new ATOM 0 HH11 ARG A 500 13.282 10.157 -2.511 1.00 0.00 H new ATOM 0 HH12 ARG A 500 15.004 10.146 -2.116 1.00 0.00 H new ATOM 0 HH21 ARG A 500 15.118 6.803 -1.286 1.00 0.00 H new ATOM 0 HH22 ARG A 500 16.001 8.324 -1.450 1.00 0.00 H new ATOM 969 N LYS A 501 7.436 6.636 -0.461 1.00 0.00 N ATOM 970 CA LYS A 501 6.996 6.045 0.791 1.00 0.00 C ATOM 971 C LYS A 501 5.935 4.965 0.560 1.00 0.00 C ATOM 972 O LYS A 501 5.884 3.957 1.266 1.00 0.00 O ATOM 973 CB LYS A 501 6.436 7.217 1.586 1.00 0.00 C ATOM 974 CG LYS A 501 7.462 8.220 2.138 1.00 0.00 C ATOM 975 CD LYS A 501 8.499 7.629 3.106 1.00 0.00 C ATOM 976 CE LYS A 501 9.559 8.672 3.495 1.00 0.00 C ATOM 977 NZ LYS A 501 8.994 9.805 4.279 1.00 0.00 N ATOM 0 H LYS A 501 7.282 7.644 -0.495 1.00 0.00 H new ATOM 0 HA LYS A 501 7.807 5.541 1.316 1.00 0.00 H new ATOM 0 HB2 LYS A 501 5.737 7.759 0.949 1.00 0.00 H new ATOM 0 HB3 LYS A 501 5.862 6.819 2.423 1.00 0.00 H new ATOM 0 HG2 LYS A 501 7.989 8.675 1.299 1.00 0.00 H new ATOM 0 HG3 LYS A 501 6.926 9.020 2.649 1.00 0.00 H new ATOM 0 HD2 LYS A 501 7.997 7.266 4.003 1.00 0.00 H new ATOM 0 HD3 LYS A 501 8.984 6.770 2.642 1.00 0.00 H new ATOM 0 HE2 LYS A 501 10.342 8.187 4.078 1.00 0.00 H new ATOM 0 HE3 LYS A 501 10.029 9.060 2.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 9.762 10.442 4.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 8.315 10.329 3.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 8.510 9.436 5.122 1.00 0.00 H new ATOM 991 N LEU A 502 5.144 5.129 -0.495 1.00 0.00 N ATOM 992 CA LEU A 502 4.249 4.097 -0.965 1.00 0.00 C ATOM 993 C LEU A 502 4.967 2.996 -1.746 1.00 0.00 C ATOM 994 O LEU A 502 4.573 1.848 -1.625 1.00 0.00 O ATOM 995 CB LEU A 502 3.145 4.705 -1.824 1.00 0.00 C ATOM 996 CG LEU A 502 1.816 4.851 -1.068 1.00 0.00 C ATOM 997 CD1 LEU A 502 1.879 5.901 0.033 1.00 0.00 C ATOM 998 CD2 LEU A 502 0.735 5.291 -2.041 1.00 0.00 C ATOM 0 H LEU A 502 5.111 5.987 -1.045 1.00 0.00 H new ATOM 0 HA LEU A 502 3.817 3.632 -0.079 1.00 0.00 H new ATOM 0 HB2 LEU A 502 3.465 5.684 -2.180 1.00 0.00 H new ATOM 0 HB3 LEU A 502 2.991 4.081 -2.704 1.00 0.00 H new ATOM 0 HG LEU A 502 1.602 3.881 -0.619 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.913 5.962 0.534 1.00 0.00 H new ATOM 0 HD12 LEU A 502 2.646 5.624 0.756 1.00 0.00 H new ATOM 0 HD13 LEU A 502 2.124 6.870 -0.402 1.00 0.00 H new ATOM 0 HD21 LEU A 502 -0.211 5.396 -1.510 1.00 0.00 H new ATOM 0 HD22 LEU A 502 1.011 6.248 -2.484 1.00 0.00 H new ATOM 0 HD23 LEU A 502 0.628 4.545 -2.828 1.00 0.00 H new ATOM 1010 N LEU A 503 6.036 3.284 -2.499 1.00 0.00 N ATOM 1011 CA LEU A 503 6.821 2.286 -3.199 1.00 0.00 C ATOM 1012 C LEU A 503 7.479 1.338 -2.192 1.00 0.00 C ATOM 1013 O LEU A 503 7.568 0.136 -2.449 1.00 0.00 O ATOM 1014 CB LEU A 503 7.842 3.014 -4.094 1.00 0.00 C ATOM 1015 CG LEU A 503 7.294 3.598 -5.411 1.00 0.00 C ATOM 1016 CD1 LEU A 503 5.789 3.502 -5.676 1.00 0.00 C ATOM 1017 CD2 LEU A 503 7.837 4.949 -5.870 1.00 0.00 C ATOM 0 H LEU A 503 6.377 4.236 -2.635 1.00 0.00 H new ATOM 0 HA LEU A 503 6.191 1.667 -3.838 1.00 0.00 H new ATOM 0 HB2 LEU A 503 8.286 3.825 -3.518 1.00 0.00 H new ATOM 0 HB3 LEU A 503 8.645 2.317 -4.335 1.00 0.00 H new ATOM 0 HG LEU A 503 7.754 2.848 -6.055 1.00 0.00 H new ATOM 0 HD11 LEU A 503 5.560 3.956 -6.640 1.00 0.00 H new ATOM 0 HD12 LEU A 503 5.488 2.455 -5.687 1.00 0.00 H new ATOM 0 HD13 LEU A 503 5.247 4.027 -4.890 1.00 0.00 H new ATOM 0 HD21 LEU A 503 7.361 5.232 -6.809 1.00 0.00 H new ATOM 0 HD22 LEU A 503 7.623 5.703 -5.113 1.00 0.00 H new ATOM 0 HD23 LEU A 503 8.915 4.877 -6.017 1.00 0.00 H new ATOM 1029 N LYS A 504 7.848 1.866 -1.012 1.00 0.00 N ATOM 1030 CA LYS A 504 8.231 1.069 0.156 1.00 0.00 C ATOM 1031 C LYS A 504 7.088 0.132 0.541 1.00 0.00 C ATOM 1032 O LYS A 504 7.236 -1.086 0.511 1.00 0.00 O ATOM 1033 CB LYS A 504 8.631 1.972 1.344 1.00 0.00 C ATOM 1034 CG LYS A 504 8.870 1.239 2.682 1.00 0.00 C ATOM 1035 CD LYS A 504 8.475 2.051 3.928 1.00 0.00 C ATOM 1036 CE LYS A 504 6.969 1.979 4.285 1.00 0.00 C ATOM 1037 NZ LYS A 504 6.768 2.247 5.736 1.00 0.00 N ATOM 0 H LYS A 504 7.888 2.872 -0.845 1.00 0.00 H new ATOM 0 HA LYS A 504 9.104 0.470 -0.104 1.00 0.00 H new ATOM 0 HB2 LYS A 504 9.539 2.512 1.078 1.00 0.00 H new ATOM 0 HB3 LYS A 504 7.849 2.717 1.492 1.00 0.00 H new ATOM 0 HG2 LYS A 504 8.307 0.306 2.677 1.00 0.00 H new ATOM 0 HG3 LYS A 504 9.925 0.974 2.755 1.00 0.00 H new ATOM 0 HD2 LYS A 504 9.056 1.694 4.779 1.00 0.00 H new ATOM 0 HD3 LYS A 504 8.749 3.094 3.770 1.00 0.00 H new ATOM 0 HE2 LYS A 504 6.413 2.706 3.694 1.00 0.00 H new ATOM 0 HE3 LYS A 504 6.575 0.995 4.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 504 5.754 2.196 5.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 504 7.283 1.537 6.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 504 7.126 3.196 5.967 1.00 0.00 H new ATOM 1051 N ALA A 505 5.950 0.724 0.909 1.00 0.00 N ATOM 1052 CA ALA A 505 4.757 0.043 1.398 1.00 0.00 C ATOM 1053 C ALA A 505 4.366 -1.119 0.468 1.00 0.00 C ATOM 1054 O ALA A 505 4.250 -2.287 0.870 1.00 0.00 O ATOM 1055 CB ALA A 505 3.684 1.126 1.534 1.00 0.00 C ATOM 0 H ALA A 505 5.833 1.737 0.871 1.00 0.00 H new ATOM 0 HA ALA A 505 4.913 -0.434 2.366 1.00 0.00 H new ATOM 0 HB1 ALA A 505 2.759 0.678 1.899 1.00 0.00 H new ATOM 0 HB2 ALA A 505 4.022 1.886 2.238 1.00 0.00 H new ATOM 0 HB3 ALA A 505 3.506 1.586 0.562 1.00 0.00 H new ATOM 1061 N PHE A 506 4.274 -0.774 -0.818 1.00 0.00 N ATOM 1062 CA PHE A 506 3.990 -1.654 -1.923 1.00 0.00 C ATOM 1063 C PHE A 506 4.987 -2.771 -1.989 1.00 0.00 C ATOM 1064 O PHE A 506 4.579 -3.903 -1.787 1.00 0.00 O ATOM 1065 CB PHE A 506 3.901 -0.906 -3.254 1.00 0.00 C ATOM 1066 CG PHE A 506 2.741 0.055 -3.378 1.00 0.00 C ATOM 1067 CD1 PHE A 506 1.694 0.066 -2.435 1.00 0.00 C ATOM 1068 CD2 PHE A 506 2.691 0.923 -4.479 1.00 0.00 C ATOM 1069 CE1 PHE A 506 0.658 1.002 -2.531 1.00 0.00 C ATOM 1070 CE2 PHE A 506 1.617 1.816 -4.613 1.00 0.00 C ATOM 1071 CZ PHE A 506 0.623 1.880 -3.621 1.00 0.00 C ATOM 0 H PHE A 506 4.406 0.191 -1.121 1.00 0.00 H new ATOM 0 HA PHE A 506 3.006 -2.088 -1.743 1.00 0.00 H new ATOM 0 HB2 PHE A 506 4.828 -0.352 -3.403 1.00 0.00 H new ATOM 0 HB3 PHE A 506 3.833 -1.637 -4.059 1.00 0.00 H new ATOM 0 HD1 PHE A 506 1.691 -0.655 -1.631 1.00 0.00 H new ATOM 0 HD2 PHE A 506 3.476 0.904 -5.220 1.00 0.00 H new ATOM 0 HE1 PHE A 506 -0.108 1.047 -1.771 1.00 0.00 H new ATOM 0 HE2 PHE A 506 1.554 2.456 -5.481 1.00 0.00 H new ATOM 0 HZ PHE A 506 -0.170 2.609 -3.700 1.00 0.00 H new ATOM 1081 N GLY A 507 6.272 -2.527 -2.249 1.00 0.00 N ATOM 1082 CA GLY A 507 7.121 -3.670 -2.495 1.00 0.00 C ATOM 1083 C GLY A 507 7.458 -4.551 -1.298 1.00 0.00 C ATOM 1084 O GLY A 507 7.947 -5.656 -1.516 1.00 0.00 O ATOM 0 H GLY A 507 6.717 -1.610 -2.292 1.00 0.00 H new ATOM 0 HA2 GLY A 507 6.641 -4.293 -3.250 1.00 0.00 H new ATOM 0 HA3 GLY A 507 8.056 -3.311 -2.926 1.00 0.00 H new ATOM 1088 N ILE A 508 7.147 -4.137 -0.062 1.00 0.00 N ATOM 1089 CA ILE A 508 7.145 -5.070 1.067 1.00 0.00 C ATOM 1090 C ILE A 508 5.957 -6.005 0.852 1.00 0.00 C ATOM 1091 O ILE A 508 6.164 -7.209 0.824 1.00 0.00 O ATOM 1092 CB ILE A 508 7.089 -4.389 2.455 1.00 0.00 C ATOM 1093 CG1 ILE A 508 8.489 -4.000 2.979 1.00 0.00 C ATOM 1094 CG2 ILE A 508 6.515 -5.355 3.520 1.00 0.00 C ATOM 1095 CD1 ILE A 508 9.170 -2.835 2.265 1.00 0.00 C ATOM 0 H ILE A 508 6.898 -3.177 0.177 1.00 0.00 H new ATOM 0 HA ILE A 508 8.091 -5.611 1.084 1.00 0.00 H new ATOM 0 HB ILE A 508 6.467 -3.505 2.314 1.00 0.00 H new ATOM 0 HG12 ILE A 508 8.403 -3.752 4.037 1.00 0.00 H new ATOM 0 HG13 ILE A 508 9.138 -4.873 2.908 1.00 0.00 H new ATOM 0 HG21 ILE A 508 6.485 -4.854 4.488 1.00 0.00 H new ATOM 0 HG22 ILE A 508 5.506 -5.653 3.235 1.00 0.00 H new ATOM 0 HG23 ILE A 508 7.149 -6.239 3.589 1.00 0.00 H new ATOM 0 HD11 ILE A 508 10.145 -2.651 2.717 1.00 0.00 H new ATOM 0 HD12 ILE A 508 9.299 -3.080 1.211 1.00 0.00 H new ATOM 0 HD13 ILE A 508 8.553 -1.941 2.357 1.00 0.00 H new ATOM 1107 N VAL A 509 4.731 -5.508 0.635 1.00 0.00 N ATOM 1108 CA VAL A 509 3.588 -6.407 0.424 1.00 0.00 C ATOM 1109 C VAL A 509 3.739 -7.179 -0.887 1.00 0.00 C ATOM 1110 O VAL A 509 3.333 -8.329 -0.957 1.00 0.00 O ATOM 1111 CB VAL A 509 2.243 -5.688 0.567 1.00 0.00 C ATOM 1112 CG1 VAL A 509 1.974 -4.662 -0.500 1.00 0.00 C ATOM 1113 CG2 VAL A 509 1.064 -6.657 0.586 1.00 0.00 C ATOM 0 H VAL A 509 4.508 -4.513 0.601 1.00 0.00 H new ATOM 0 HA VAL A 509 3.590 -7.149 1.223 1.00 0.00 H new ATOM 0 HB VAL A 509 2.332 -5.176 1.525 1.00 0.00 H new ATOM 0 HG11 VAL A 509 1.002 -4.201 -0.324 1.00 0.00 H new ATOM 0 HG12 VAL A 509 2.749 -3.896 -0.472 1.00 0.00 H new ATOM 0 HG13 VAL A 509 1.975 -5.145 -1.477 1.00 0.00 H new ATOM 0 HG21 VAL A 509 0.134 -6.097 0.689 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.045 -7.225 -0.344 1.00 0.00 H new ATOM 0 HG23 VAL A 509 1.170 -7.342 1.427 1.00 0.00 H new ATOM 1123 N ILE A 510 4.414 -6.627 -1.900 1.00 0.00 N ATOM 1124 CA ILE A 510 4.828 -7.366 -3.101 1.00 0.00 C ATOM 1125 C ILE A 510 5.703 -8.569 -2.767 1.00 0.00 C ATOM 1126 O ILE A 510 5.458 -9.657 -3.277 1.00 0.00 O ATOM 1127 CB ILE A 510 5.424 -6.481 -4.187 1.00 0.00 C ATOM 1128 CG1 ILE A 510 4.264 -5.590 -4.698 1.00 0.00 C ATOM 1129 CG2 ILE A 510 6.063 -7.274 -5.343 1.00 0.00 C ATOM 1130 CD1 ILE A 510 4.638 -4.610 -5.804 1.00 0.00 C ATOM 0 H ILE A 510 4.692 -5.646 -1.911 1.00 0.00 H new ATOM 0 HA ILE A 510 3.910 -7.762 -3.535 1.00 0.00 H new ATOM 0 HB ILE A 510 6.243 -5.893 -3.773 1.00 0.00 H new ATOM 0 HG12 ILE A 510 3.464 -6.235 -5.061 1.00 0.00 H new ATOM 0 HG13 ILE A 510 3.862 -5.027 -3.856 1.00 0.00 H new ATOM 0 HG21 ILE A 510 6.467 -6.580 -6.080 1.00 0.00 H new ATOM 0 HG22 ILE A 510 6.867 -7.900 -4.955 1.00 0.00 H new ATOM 0 HG23 ILE A 510 5.308 -7.904 -5.813 1.00 0.00 H new ATOM 0 HD11 ILE A 510 3.759 -4.034 -6.092 1.00 0.00 H new ATOM 0 HD12 ILE A 510 5.413 -3.934 -5.444 1.00 0.00 H new ATOM 0 HD13 ILE A 510 5.010 -5.161 -6.668 1.00 0.00 H new ATOM 1142 N ASP A 511 6.636 -8.441 -1.827 1.00 0.00 N ATOM 1143 CA ASP A 511 7.574 -9.485 -1.373 1.00 0.00 C ATOM 1144 C ASP A 511 6.991 -10.566 -0.507 1.00 0.00 C ATOM 1145 O ASP A 511 7.662 -11.351 0.161 1.00 0.00 O ATOM 1146 CB ASP A 511 8.702 -8.812 -0.615 1.00 0.00 C ATOM 1147 CG ASP A 511 10.021 -9.602 -0.578 1.00 0.00 C ATOM 1148 OD1 ASP A 511 10.402 -10.193 -1.618 1.00 0.00 O ATOM 1149 OD2 ASP A 511 10.706 -9.595 0.473 1.00 0.00 O ATOM 0 H ASP A 511 6.772 -7.561 -1.329 1.00 0.00 H new ATOM 0 HA ASP A 511 7.904 -9.994 -2.278 1.00 0.00 H new ATOM 0 HB2 ASP A 511 8.892 -7.838 -1.065 1.00 0.00 H new ATOM 0 HB3 ASP A 511 8.375 -8.632 0.409 1.00 0.00 H new ATOM 1154 N TYR A 512 5.688 -10.562 -0.574 1.00 0.00 N ATOM 1155 CA TYR A 512 4.788 -11.219 0.294 1.00 0.00 C ATOM 1156 C TYR A 512 3.570 -11.676 -0.505 1.00 0.00 C ATOM 1157 O TYR A 512 2.969 -12.683 -0.181 1.00 0.00 O ATOM 1158 CB TYR A 512 4.382 -10.178 1.327 1.00 0.00 C ATOM 1159 CG TYR A 512 4.969 -10.100 2.719 1.00 0.00 C ATOM 1160 CD1 TYR A 512 6.207 -9.455 2.885 1.00 0.00 C ATOM 1161 CD2 TYR A 512 4.220 -10.463 3.851 1.00 0.00 C ATOM 1162 CE1 TYR A 512 6.729 -9.196 4.162 1.00 0.00 C ATOM 1163 CE2 TYR A 512 4.757 -10.262 5.141 1.00 0.00 C ATOM 1164 CZ TYR A 512 6.012 -9.627 5.300 1.00 0.00 C ATOM 1165 OH TYR A 512 6.500 -9.398 6.551 1.00 0.00 O ATOM 0 H TYR A 512 5.200 -10.049 -1.308 1.00 0.00 H new ATOM 0 HA TYR A 512 5.229 -12.096 0.768 1.00 0.00 H new ATOM 0 HB2 TYR A 512 4.558 -9.206 0.866 1.00 0.00 H new ATOM 0 HB3 TYR A 512 3.304 -10.279 1.455 1.00 0.00 H new ATOM 0 HD1 TYR A 512 6.768 -9.153 2.013 1.00 0.00 H new ATOM 0 HD2 TYR A 512 3.237 -10.894 3.735 1.00 0.00 H new ATOM 0 HE1 TYR A 512 7.668 -8.673 4.273 1.00 0.00 H new ATOM 0 HE2 TYR A 512 4.208 -10.594 6.010 1.00 0.00 H new ATOM 0 HH TYR A 512 5.878 -9.760 7.216 1.00 0.00 H new ATOM 1175 N LYS A 513 3.203 -10.982 -1.584 1.00 0.00 N ATOM 1176 CA LYS A 513 2.063 -11.289 -2.439 1.00 0.00 C ATOM 1177 C LYS A 513 2.546 -12.095 -3.625 1.00 0.00 C ATOM 1178 O LYS A 513 2.022 -13.160 -3.931 1.00 0.00 O ATOM 1179 CB LYS A 513 1.460 -9.924 -2.793 1.00 0.00 C ATOM 1180 CG LYS A 513 0.440 -9.848 -3.919 1.00 0.00 C ATOM 1181 CD LYS A 513 1.094 -9.875 -5.300 1.00 0.00 C ATOM 1182 CE LYS A 513 0.026 -9.796 -6.379 1.00 0.00 C ATOM 1183 NZ LYS A 513 0.549 -10.307 -7.674 1.00 0.00 N ATOM 0 H LYS A 513 3.716 -10.157 -1.896 1.00 0.00 H new ATOM 0 HA LYS A 513 1.294 -11.906 -1.974 1.00 0.00 H new ATOM 0 HB2 LYS A 513 0.990 -9.527 -1.893 1.00 0.00 H new ATOM 0 HB3 LYS A 513 2.282 -9.254 -3.046 1.00 0.00 H new ATOM 0 HG2 LYS A 513 -0.255 -10.683 -3.833 1.00 0.00 H new ATOM 0 HG3 LYS A 513 -0.145 -8.934 -3.815 1.00 0.00 H new ATOM 0 HD2 LYS A 513 1.787 -9.040 -5.400 1.00 0.00 H new ATOM 0 HD3 LYS A 513 1.676 -10.789 -5.419 1.00 0.00 H new ATOM 0 HE2 LYS A 513 -0.846 -10.377 -6.078 1.00 0.00 H new ATOM 0 HE3 LYS A 513 -0.304 -8.764 -6.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 0.060 -9.830 -8.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 1.570 -10.117 -7.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 0.383 -11.332 -7.735 1.00 0.00 H new ATOM 1197 N GLU A 514 3.615 -11.600 -4.255 1.00 0.00 N ATOM 1198 CA GLU A 514 4.393 -12.300 -5.268 1.00 0.00 C ATOM 1199 C GLU A 514 5.108 -13.529 -4.659 1.00 0.00 C ATOM 1200 O GLU A 514 5.716 -14.318 -5.384 1.00 0.00 O ATOM 1201 CB GLU A 514 5.372 -11.267 -5.862 1.00 0.00 C ATOM 1202 CG GLU A 514 5.731 -11.548 -7.323 1.00 0.00 C ATOM 1203 CD GLU A 514 6.748 -10.526 -7.876 1.00 0.00 C ATOM 1204 OE1 GLU A 514 7.973 -10.697 -7.656 1.00 0.00 O ATOM 1205 OE2 GLU A 514 6.329 -9.559 -8.557 1.00 0.00 O ATOM 0 H GLU A 514 3.972 -10.664 -4.062 1.00 0.00 H new ATOM 0 HA GLU A 514 3.760 -12.700 -6.060 1.00 0.00 H new ATOM 0 HB2 GLU A 514 4.931 -10.273 -5.788 1.00 0.00 H new ATOM 0 HB3 GLU A 514 6.284 -11.256 -5.266 1.00 0.00 H new ATOM 0 HG2 GLU A 514 6.144 -12.553 -7.408 1.00 0.00 H new ATOM 0 HG3 GLU A 514 4.826 -11.523 -7.930 1.00 0.00 H new ATOM 1212 N ARG A 515 5.033 -13.691 -3.319 1.00 0.00 N ATOM 1213 CA ARG A 515 5.614 -14.825 -2.551 1.00 0.00 C ATOM 1214 C ARG A 515 4.545 -15.758 -2.006 1.00 0.00 C ATOM 1215 O ARG A 515 4.609 -16.960 -2.256 1.00 0.00 O ATOM 1216 CB ARG A 515 6.540 -14.353 -1.413 1.00 0.00 C ATOM 1217 CG ARG A 515 7.954 -13.938 -1.853 1.00 0.00 C ATOM 1218 CD ARG A 515 7.862 -12.888 -2.953 1.00 0.00 C ATOM 1219 NE ARG A 515 9.109 -12.154 -3.193 1.00 0.00 N ATOM 1220 CZ ARG A 515 9.482 -11.640 -4.348 1.00 0.00 C ATOM 1221 NH1 ARG A 515 8.981 -12.052 -5.477 1.00 0.00 N ATOM 1222 NH2 ARG A 515 10.346 -10.673 -4.363 1.00 0.00 N ATOM 0 H ARG A 515 4.553 -13.019 -2.721 1.00 0.00 H new ATOM 0 HA ARG A 515 6.220 -15.384 -3.265 1.00 0.00 H new ATOM 0 HB2 ARG A 515 6.070 -13.508 -0.910 1.00 0.00 H new ATOM 0 HB3 ARG A 515 6.625 -15.154 -0.679 1.00 0.00 H new ATOM 0 HG2 ARG A 515 8.508 -13.540 -1.003 1.00 0.00 H new ATOM 0 HG3 ARG A 515 8.503 -14.808 -2.212 1.00 0.00 H new ATOM 0 HD2 ARG A 515 7.557 -13.375 -3.879 1.00 0.00 H new ATOM 0 HD3 ARG A 515 7.079 -12.175 -2.694 1.00 0.00 H new ATOM 0 HE ARG A 515 9.740 -12.031 -2.401 1.00 0.00 H new ATOM 0 HH11 ARG A 515 8.279 -12.792 -5.484 1.00 0.00 H new ATOM 0 HH12 ARG A 515 9.290 -11.634 -6.355 1.00 0.00 H new ATOM 0 HH21 ARG A 515 10.729 -10.318 -3.487 1.00 0.00 H new ATOM 0 HH22 ARG A 515 10.642 -10.267 -5.251 1.00 0.00 H new ATOM 1236 N ASP A 516 3.602 -15.180 -1.263 1.00 0.00 N ATOM 1237 CA ASP A 516 2.360 -15.742 -0.704 1.00 0.00 C ATOM 1238 C ASP A 516 2.482 -15.949 0.820 1.00 0.00 C ATOM 1239 O ASP A 516 2.455 -17.050 1.375 1.00 0.00 O ATOM 1240 CB ASP A 516 1.802 -16.949 -1.474 1.00 0.00 C ATOM 1241 CG ASP A 516 0.360 -17.312 -1.072 1.00 0.00 C ATOM 1242 OD1 ASP A 516 -0.347 -16.481 -0.447 1.00 0.00 O ATOM 1243 OD2 ASP A 516 -0.075 -18.447 -1.376 1.00 0.00 O ATOM 0 H ASP A 516 3.695 -14.197 -1.006 1.00 0.00 H new ATOM 0 HA ASP A 516 1.582 -14.993 -0.853 1.00 0.00 H new ATOM 0 HB2 ASP A 516 1.831 -16.735 -2.542 1.00 0.00 H new ATOM 0 HB3 ASP A 516 2.448 -17.811 -1.303 1.00 0.00 H new ATOM 1248 N LEU A 517 2.662 -14.807 1.471 1.00 0.00 N ATOM 1249 CA LEU A 517 2.953 -14.495 2.872 1.00 0.00 C ATOM 1250 C LEU A 517 1.755 -13.789 3.538 1.00 0.00 C ATOM 1251 O LEU A 517 1.602 -13.821 4.759 1.00 0.00 O ATOM 1252 CB LEU A 517 4.192 -13.574 2.824 1.00 0.00 C ATOM 1253 CG LEU A 517 5.469 -14.221 2.246 1.00 0.00 C ATOM 1254 CD1 LEU A 517 6.718 -13.435 2.648 1.00 0.00 C ATOM 1255 CD2 LEU A 517 5.724 -15.668 2.669 1.00 0.00 C ATOM 0 H LEU A 517 2.597 -13.937 0.943 1.00 0.00 H new ATOM 0 HA LEU A 517 3.138 -15.391 3.464 1.00 0.00 H new ATOM 0 HB2 LEU A 517 3.948 -12.694 2.229 1.00 0.00 H new ATOM 0 HB3 LEU A 517 4.406 -13.226 3.835 1.00 0.00 H new ATOM 0 HG LEU A 517 5.285 -14.205 1.172 1.00 0.00 H new ATOM 0 HD11 LEU A 517 7.601 -13.915 2.226 1.00 0.00 H new ATOM 0 HD12 LEU A 517 6.644 -12.415 2.270 1.00 0.00 H new ATOM 0 HD13 LEU A 517 6.801 -13.414 3.735 1.00 0.00 H new ATOM 0 HD21 LEU A 517 6.645 -16.025 2.208 1.00 0.00 H new ATOM 0 HD22 LEU A 517 5.818 -15.719 3.754 1.00 0.00 H new ATOM 0 HD23 LEU A 517 4.891 -16.293 2.348 1.00 0.00 H new ATOM 1267 N ILE A 518 0.893 -13.181 2.714 1.00 0.00 N ATOM 1268 CA ILE A 518 -0.424 -12.632 3.064 1.00 0.00 C ATOM 1269 C ILE A 518 -1.378 -13.722 3.613 1.00 0.00 C ATOM 1270 O ILE A 518 -1.219 -14.912 3.344 1.00 0.00 O ATOM 1271 CB ILE A 518 -1.072 -11.964 1.825 1.00 0.00 C ATOM 1272 CG1 ILE A 518 -0.141 -11.385 0.742 1.00 0.00 C ATOM 1273 CG2 ILE A 518 -2.017 -10.849 2.276 1.00 0.00 C ATOM 1274 CD1 ILE A 518 0.711 -10.200 1.198 1.00 0.00 C ATOM 0 H ILE A 518 1.109 -13.051 1.726 1.00 0.00 H new ATOM 0 HA ILE A 518 -0.266 -11.891 3.848 1.00 0.00 H new ATOM 0 HB ILE A 518 -1.574 -12.800 1.339 1.00 0.00 H new ATOM 0 HG12 ILE A 518 0.521 -12.176 0.390 1.00 0.00 H new ATOM 0 HG13 ILE A 518 -0.746 -11.073 -0.109 1.00 0.00 H new ATOM 0 HG21 ILE A 518 -2.471 -10.381 1.402 1.00 0.00 H new ATOM 0 HG22 ILE A 518 -2.798 -11.268 2.910 1.00 0.00 H new ATOM 0 HG23 ILE A 518 -1.456 -10.102 2.837 1.00 0.00 H new ATOM 0 HD11 ILE A 518 1.334 -9.860 0.371 1.00 0.00 H new ATOM 0 HD12 ILE A 518 0.061 -9.387 1.521 1.00 0.00 H new ATOM 0 HD13 ILE A 518 1.347 -10.507 2.028 1.00 0.00 H new ATOM 1286 N ASP A 519 -2.424 -13.320 4.338 1.00 0.00 N ATOM 1287 CA ASP A 519 -3.321 -14.189 5.123 1.00 0.00 C ATOM 1288 C ASP A 519 -4.455 -14.909 4.363 1.00 0.00 C ATOM 1289 O ASP A 519 -5.408 -15.387 4.983 1.00 0.00 O ATOM 1290 CB ASP A 519 -3.848 -13.398 6.327 1.00 0.00 C ATOM 1291 CG ASP A 519 -2.708 -12.895 7.222 1.00 0.00 C ATOM 1292 OD1 ASP A 519 -2.162 -11.807 6.926 1.00 0.00 O ATOM 1293 OD2 ASP A 519 -2.353 -13.587 8.205 1.00 0.00 O ATOM 0 H ASP A 519 -2.686 -12.336 4.401 1.00 0.00 H new ATOM 0 HA ASP A 519 -2.702 -15.029 5.438 1.00 0.00 H new ATOM 0 HB2 ASP A 519 -4.435 -12.550 5.976 1.00 0.00 H new ATOM 0 HB3 ASP A 519 -4.518 -14.029 6.912 1.00 0.00 H new ATOM 1298 N ARG A 520 -4.370 -15.010 3.029 1.00 0.00 N ATOM 1299 CA ARG A 520 -5.265 -15.713 2.087 1.00 0.00 C ATOM 1300 C ARG A 520 -6.665 -15.103 1.937 1.00 0.00 C ATOM 1301 O ARG A 520 -7.243 -15.154 0.853 1.00 0.00 O ATOM 1302 CB ARG A 520 -5.306 -17.222 2.401 1.00 0.00 C ATOM 1303 CG ARG A 520 -4.484 -18.074 1.423 1.00 0.00 C ATOM 1304 CD ARG A 520 -2.974 -17.791 1.442 1.00 0.00 C ATOM 1305 NE ARG A 520 -2.332 -18.183 2.711 1.00 0.00 N ATOM 1306 CZ ARG A 520 -1.037 -18.124 2.963 1.00 0.00 C ATOM 1307 NH1 ARG A 520 -0.192 -17.676 2.084 1.00 0.00 N ATOM 1308 NH2 ARG A 520 -0.558 -18.534 4.103 1.00 0.00 N ATOM 0 H ARG A 520 -3.602 -14.560 2.531 1.00 0.00 H new ATOM 0 HA ARG A 520 -4.823 -15.573 1.100 1.00 0.00 H new ATOM 0 HB2 ARG A 520 -4.935 -17.385 3.413 1.00 0.00 H new ATOM 0 HB3 ARG A 520 -6.342 -17.561 2.383 1.00 0.00 H new ATOM 0 HG2 ARG A 520 -4.646 -19.127 1.654 1.00 0.00 H new ATOM 0 HG3 ARG A 520 -4.859 -17.908 0.413 1.00 0.00 H new ATOM 0 HD2 ARG A 520 -2.499 -18.326 0.620 1.00 0.00 H new ATOM 0 HD3 ARG A 520 -2.807 -16.728 1.269 1.00 0.00 H new ATOM 0 HE ARG A 520 -2.938 -18.528 3.455 1.00 0.00 H new ATOM 0 HH11 ARG A 520 -0.524 -17.359 1.173 1.00 0.00 H new ATOM 0 HH12 ARG A 520 0.803 -17.641 2.305 1.00 0.00 H new ATOM 0 HH21 ARG A 520 -1.186 -18.907 4.815 1.00 0.00 H new ATOM 0 HH22 ARG A 520 0.445 -18.482 4.283 1.00 0.00 H new ATOM 1322 N SER A 521 -7.154 -14.428 2.969 1.00 0.00 N ATOM 1323 CA SER A 521 -8.371 -13.606 2.966 1.00 0.00 C ATOM 1324 C SER A 521 -8.150 -12.156 2.498 1.00 0.00 C ATOM 1325 O SER A 521 -9.093 -11.361 2.492 1.00 0.00 O ATOM 1326 CB SER A 521 -8.996 -13.603 4.369 1.00 0.00 C ATOM 1327 OG SER A 521 -9.324 -14.927 4.771 1.00 0.00 O ATOM 0 H SER A 521 -6.694 -14.435 3.879 1.00 0.00 H new ATOM 0 HA SER A 521 -9.043 -14.062 2.239 1.00 0.00 H new ATOM 0 HB2 SER A 521 -8.300 -13.162 5.083 1.00 0.00 H new ATOM 0 HB3 SER A 521 -9.892 -12.983 4.373 1.00 0.00 H new ATOM 0 HG SER A 521 -9.720 -14.908 5.667 1.00 0.00 H new ATOM 1333 N ALA A 522 -6.922 -11.776 2.120 1.00 0.00 N ATOM 1334 CA ALA A 522 -6.598 -10.403 1.701 1.00 0.00 C ATOM 1335 C ALA A 522 -6.873 -10.182 0.224 1.00 0.00 C ATOM 1336 O ALA A 522 -7.232 -9.094 -0.212 1.00 0.00 O ATOM 1337 CB ALA A 522 -5.124 -10.161 1.955 1.00 0.00 C ATOM 0 H ALA A 522 -6.124 -12.411 2.096 1.00 0.00 H new ATOM 0 HA ALA A 522 -7.224 -9.716 2.271 1.00 0.00 H new ATOM 0 HB1 ALA A 522 -4.864 -9.147 1.650 1.00 0.00 H new ATOM 0 HB2 ALA A 522 -4.912 -10.286 3.017 1.00 0.00 H new ATOM 0 HB3 ALA A 522 -4.534 -10.875 1.381 1.00 0.00 H new ATOM 1343 N TYR A 523 -6.696 -11.240 -0.539 1.00 0.00 N ATOM 1344 CA TYR A 523 -6.966 -11.339 -1.951 1.00 0.00 C ATOM 1345 C TYR A 523 -8.465 -11.157 -2.304 1.00 0.00 C ATOM 1346 O TYR A 523 -9.312 -11.010 -1.386 1.00 0.00 O ATOM 1347 CB TYR A 523 -6.435 -12.735 -2.284 1.00 0.00 C ATOM 1348 CG TYR A 523 -4.953 -12.983 -2.022 1.00 0.00 C ATOM 1349 CD1 TYR A 523 -3.956 -12.236 -2.681 1.00 0.00 C ATOM 1350 CD2 TYR A 523 -4.574 -14.005 -1.137 1.00 0.00 C ATOM 1351 CE1 TYR A 523 -2.595 -12.547 -2.484 1.00 0.00 C ATOM 1352 CE2 TYR A 523 -3.215 -14.315 -0.927 1.00 0.00 C ATOM 1353 CZ TYR A 523 -2.218 -13.593 -1.613 1.00 0.00 C ATOM 1354 OH TYR A 523 -0.906 -13.910 -1.446 1.00 0.00 O ATOM 1355 OXT TYR A 523 -8.786 -11.142 -3.514 1.00 0.00 O ATOM 0 H TYR A 523 -6.334 -12.114 -0.158 1.00 0.00 H new ATOM 0 HA TYR A 523 -6.495 -10.547 -2.534 1.00 0.00 H new ATOM 0 HB2 TYR A 523 -7.009 -13.463 -1.711 1.00 0.00 H new ATOM 0 HB3 TYR A 523 -6.632 -12.932 -3.338 1.00 0.00 H new ATOM 0 HD1 TYR A 523 -4.235 -11.425 -3.337 1.00 0.00 H new ATOM 0 HD2 TYR A 523 -5.335 -14.562 -0.610 1.00 0.00 H new ATOM 0 HE1 TYR A 523 -1.835 -11.981 -3.003 1.00 0.00 H new ATOM 0 HE2 TYR A 523 -2.939 -15.103 -0.243 1.00 0.00 H new ATOM 0 HH TYR A 523 -0.832 -14.822 -1.095 1.00 0.00 H new