USER MOD reduce.3.24.130724 H: found=0, std=0, add=669, rem=0, adj=17 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= -0.384 USER MOD Set 1.2: A 513 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 475 THR OG1 : rot 140:sc= 0.761 USER MOD Set 2.2: A 491 LYS NZ :NH3+ 171:sc= 0.845 (180deg=0) USER MOD Set 3.1: A 461 LYS NZ :NH3+ -129:sc= 0.498 (180deg=0) USER MOD Set 3.2: A 466 HIS : no HD1:sc= 0.122 K(o=0.62,f=-1.5) USER MOD Set 4.1: A 455 ASN : amide:sc= -0.182 X(o=-1.3,f=-1.8) USER MOD Set 4.2: A 458 MET CE :methyl -173:sc= -1.16 (180deg=-1.47) USER MOD Single : A 448 THR OG1 : rot 180:sc= 0 USER MOD Single : A 451 LYS NZ :NH3+ 144:sc= 1.26 (180deg=0.036) USER MOD Single : A 454 LYS NZ :NH3+ 151:sc= 1.11 (180deg=0.627) 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 180:sc= 0 USER MOD Single : A 469 SER OG : rot 180:sc= 0.027 USER MOD Single : A 473 SER OG : rot 180:sc= -0.0476 USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 LYS NZ :NH3+ 175:sc= 1.18 (180deg=1.16) USER MOD Single : A 501 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 504 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 512 TYR OH : rot 180:sc= 0 USER MOD Single : A 521 SER OG : rot 180:sc= 0 USER MOD Single : A 523 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 447 0.736 -4.105 7.387 1.00 0.00 N ATOM 66 CA LEU A 447 0.891 -3.792 5.966 1.00 0.00 C ATOM 67 C LEU A 447 0.587 -4.995 5.042 1.00 0.00 C ATOM 68 O LEU A 447 0.665 -4.876 3.825 1.00 0.00 O ATOM 69 CB LEU A 447 2.345 -3.318 5.788 1.00 0.00 C ATOM 70 CG LEU A 447 2.586 -2.446 4.546 1.00 0.00 C ATOM 71 CD1 LEU A 447 2.307 -0.975 4.845 1.00 0.00 C ATOM 72 CD2 LEU A 447 4.033 -2.582 4.100 1.00 0.00 C ATOM 0 HA LEU A 447 0.172 -3.026 5.677 1.00 0.00 H new ATOM 0 HB2 LEU A 447 2.641 -2.756 6.674 1.00 0.00 H new ATOM 0 HB3 LEU A 447 2.994 -4.192 5.734 1.00 0.00 H new ATOM 0 HG LEU A 447 1.910 -2.785 3.761 1.00 0.00 H new ATOM 0 HD11 LEU A 447 2.486 -0.381 3.949 1.00 0.00 H new ATOM 0 HD12 LEU A 447 1.269 -0.858 5.157 1.00 0.00 H new ATOM 0 HD13 LEU A 447 2.967 -0.634 5.643 1.00 0.00 H new ATOM 0 HD21 LEU A 447 4.202 -1.963 3.219 1.00 0.00 H new ATOM 0 HD22 LEU A 447 4.694 -2.257 4.904 1.00 0.00 H new ATOM 0 HD23 LEU A 447 4.242 -3.624 3.857 1.00 0.00 H new ATOM 84 N THR A 448 0.279 -6.157 5.621 1.00 0.00 N ATOM 85 CA THR A 448 0.153 -7.479 4.998 1.00 0.00 C ATOM 86 C THR A 448 -1.036 -8.270 5.586 1.00 0.00 C ATOM 87 O THR A 448 -1.013 -9.502 5.656 1.00 0.00 O ATOM 88 CB THR A 448 1.494 -8.230 5.125 1.00 0.00 C ATOM 89 OG1 THR A 448 1.881 -8.362 6.476 1.00 0.00 O ATOM 90 CG2 THR A 448 2.648 -7.484 4.440 1.00 0.00 C ATOM 0 H THR A 448 0.095 -6.203 6.623 1.00 0.00 H new ATOM 0 HA THR A 448 -0.069 -7.362 3.937 1.00 0.00 H new ATOM 0 HB THR A 448 1.322 -9.198 4.653 1.00 0.00 H new ATOM 0 HG1 THR A 448 2.733 -8.843 6.527 1.00 0.00 H new ATOM 0 HG21 THR A 448 3.570 -8.053 4.558 1.00 0.00 H new ATOM 0 HG22 THR A 448 2.427 -7.367 3.379 1.00 0.00 H new ATOM 0 HG23 THR A 448 2.768 -6.501 4.896 1.00 0.00 H new ATOM 98 N ASP A 449 -2.091 -7.556 6.012 1.00 0.00 N ATOM 99 CA ASP A 449 -3.301 -8.064 6.686 1.00 0.00 C ATOM 100 C ASP A 449 -4.598 -7.672 5.947 1.00 0.00 C ATOM 101 O ASP A 449 -4.803 -6.482 5.717 1.00 0.00 O ATOM 102 CB ASP A 449 -3.382 -7.476 8.106 1.00 0.00 C ATOM 103 CG ASP A 449 -2.586 -8.282 9.139 1.00 0.00 C ATOM 104 OD1 ASP A 449 -1.464 -8.740 8.829 1.00 0.00 O ATOM 105 OD2 ASP A 449 -3.129 -8.509 10.247 1.00 0.00 O ATOM 0 H ASP A 449 -2.125 -6.544 5.888 1.00 0.00 H new ATOM 0 HA ASP A 449 -3.220 -9.151 6.700 1.00 0.00 H new ATOM 0 HB2 ASP A 449 -3.011 -6.451 8.090 1.00 0.00 H new ATOM 0 HB3 ASP A 449 -4.426 -7.432 8.415 1.00 0.00 H new ATOM 110 N PRO A 450 -5.536 -8.606 5.671 1.00 0.00 N ATOM 111 CA PRO A 450 -6.842 -8.335 5.038 1.00 0.00 C ATOM 112 C PRO A 450 -7.574 -7.111 5.621 1.00 0.00 C ATOM 113 O PRO A 450 -8.074 -6.261 4.884 1.00 0.00 O ATOM 114 CB PRO A 450 -7.666 -9.616 5.236 1.00 0.00 C ATOM 115 CG PRO A 450 -6.652 -10.721 5.521 1.00 0.00 C ATOM 116 CD PRO A 450 -5.400 -10.011 6.012 1.00 0.00 C ATOM 0 HA PRO A 450 -6.699 -8.084 3.987 1.00 0.00 H new ATOM 0 HB2 PRO A 450 -8.368 -9.506 6.063 1.00 0.00 H new ATOM 0 HB3 PRO A 450 -8.254 -9.844 4.347 1.00 0.00 H new ATOM 0 HG2 PRO A 450 -7.029 -11.415 6.272 1.00 0.00 H new ATOM 0 HG3 PRO A 450 -6.445 -11.304 4.624 1.00 0.00 H new ATOM 0 HD2 PRO A 450 -5.286 -10.135 7.089 1.00 0.00 H new ATOM 0 HD3 PRO A 450 -4.511 -10.435 5.546 1.00 0.00 H new ATOM 124 N LYS A 451 -7.561 -7.003 6.956 1.00 0.00 N ATOM 125 CA LYS A 451 -8.097 -5.917 7.793 1.00 0.00 C ATOM 126 C LYS A 451 -7.636 -4.521 7.357 1.00 0.00 C ATOM 127 O LYS A 451 -8.428 -3.581 7.345 1.00 0.00 O ATOM 128 CB LYS A 451 -7.657 -6.183 9.244 1.00 0.00 C ATOM 129 CG LYS A 451 -8.283 -7.445 9.874 1.00 0.00 C ATOM 130 CD LYS A 451 -7.267 -8.280 10.674 1.00 0.00 C ATOM 131 CE LYS A 451 -6.378 -9.136 9.758 1.00 0.00 C ATOM 132 NZ LYS A 451 -5.431 -9.970 10.543 1.00 0.00 N ATOM 0 H LYS A 451 -7.140 -7.735 7.529 1.00 0.00 H new ATOM 0 HA LYS A 451 -9.182 -5.917 7.691 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.571 -6.277 9.271 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -7.917 -5.319 9.855 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -9.101 -7.150 10.531 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.714 -8.063 9.086 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -6.641 -7.616 11.270 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -7.799 -8.927 11.371 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -7.004 -9.779 9.139 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -5.820 -8.488 9.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -5.305 -10.889 10.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -4.513 -9.485 10.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -5.811 -10.120 11.499 1.00 0.00 H new ATOM 146 N LEU A 452 -6.354 -4.378 7.017 1.00 0.00 N ATOM 147 CA LEU A 452 -5.734 -3.129 6.566 1.00 0.00 C ATOM 148 C LEU A 452 -5.791 -3.039 5.039 1.00 0.00 C ATOM 149 O LEU A 452 -6.111 -1.993 4.495 1.00 0.00 O ATOM 150 CB LEU A 452 -4.262 -3.058 7.023 1.00 0.00 C ATOM 151 CG LEU A 452 -3.933 -2.935 8.529 1.00 0.00 C ATOM 152 CD1 LEU A 452 -4.154 -1.504 8.994 1.00 0.00 C ATOM 153 CD2 LEU A 452 -4.661 -3.904 9.451 1.00 0.00 C ATOM 0 H LEU A 452 -5.695 -5.156 7.049 1.00 0.00 H new ATOM 0 HA LEU A 452 -6.284 -2.296 7.005 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -3.762 -3.953 6.652 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -3.805 -2.206 6.519 1.00 0.00 H new ATOM 0 HG LEU A 452 -2.883 -3.218 8.608 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -3.920 -1.426 10.056 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -3.506 -0.834 8.429 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -5.195 -1.225 8.830 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -4.353 -3.727 10.481 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -5.737 -3.752 9.363 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -4.415 -4.928 9.170 1.00 0.00 H new ATOM 165 N LEU A 453 -5.528 -4.133 4.323 1.00 0.00 N ATOM 166 CA LEU A 453 -5.359 -4.160 2.868 1.00 0.00 C ATOM 167 C LEU A 453 -6.626 -3.761 2.099 1.00 0.00 C ATOM 168 O LEU A 453 -6.573 -3.401 0.923 1.00 0.00 O ATOM 169 CB LEU A 453 -4.894 -5.574 2.490 1.00 0.00 C ATOM 170 CG LEU A 453 -3.436 -5.877 2.900 1.00 0.00 C ATOM 171 CD1 LEU A 453 -3.092 -7.335 2.618 1.00 0.00 C ATOM 172 CD2 LEU A 453 -2.369 -5.034 2.217 1.00 0.00 C ATOM 0 H LEU A 453 -5.423 -5.053 4.752 1.00 0.00 H new ATOM 0 HA LEU A 453 -4.618 -3.414 2.582 1.00 0.00 H new ATOM 0 HB2 LEU A 453 -5.554 -6.302 2.962 1.00 0.00 H new ATOM 0 HB3 LEU A 453 -4.994 -5.704 1.412 1.00 0.00 H new ATOM 0 HG LEU A 453 -3.416 -5.633 3.962 1.00 0.00 H new ATOM 0 HD11 LEU A 453 -2.061 -7.529 2.913 1.00 0.00 H new ATOM 0 HD12 LEU A 453 -3.760 -7.983 3.185 1.00 0.00 H new ATOM 0 HD13 LEU A 453 -3.209 -7.537 1.553 1.00 0.00 H new ATOM 0 HD21 LEU A 453 -1.384 -5.330 2.579 1.00 0.00 H new ATOM 0 HD22 LEU A 453 -2.420 -5.186 1.139 1.00 0.00 H new ATOM 0 HD23 LEU A 453 -2.537 -3.981 2.444 1.00 0.00 H new ATOM 184 N LYS A 454 -7.768 -3.773 2.787 1.00 0.00 N ATOM 185 CA LYS A 454 -9.094 -3.428 2.275 1.00 0.00 C ATOM 186 C LYS A 454 -9.619 -2.125 2.906 1.00 0.00 C ATOM 187 O LYS A 454 -10.729 -1.681 2.618 1.00 0.00 O ATOM 188 CB LYS A 454 -9.997 -4.645 2.505 1.00 0.00 C ATOM 189 CG LYS A 454 -9.406 -5.811 1.720 1.00 0.00 C ATOM 190 CD LYS A 454 -10.237 -7.069 1.860 1.00 0.00 C ATOM 191 CE LYS A 454 -9.463 -8.040 1.000 1.00 0.00 C ATOM 192 NZ LYS A 454 -10.237 -9.230 0.547 1.00 0.00 N ATOM 0 H LYS A 454 -7.794 -4.039 3.771 1.00 0.00 H new ATOM 0 HA LYS A 454 -9.066 -3.212 1.207 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -10.052 -4.886 3.567 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -11.014 -4.436 2.173 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -9.334 -5.539 0.667 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -8.392 -6.006 2.069 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -10.305 -7.402 2.896 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -11.257 -6.928 1.503 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -9.092 -7.510 0.123 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.591 -8.382 1.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.863 -9.561 -0.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -10.151 -9.989 1.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -11.238 -8.971 0.437 1.00 0.00 H new ATOM 206 N ASN A 455 -8.774 -1.501 3.732 1.00 0.00 N ATOM 207 CA ASN A 455 -8.864 -0.191 4.342 1.00 0.00 C ATOM 208 C ASN A 455 -7.578 0.591 4.051 1.00 0.00 C ATOM 209 O ASN A 455 -6.737 0.813 4.930 1.00 0.00 O ATOM 210 CB ASN A 455 -9.025 -0.284 5.848 1.00 0.00 C ATOM 211 CG ASN A 455 -10.365 -0.739 6.374 1.00 0.00 C ATOM 212 OD1 ASN A 455 -11.424 -0.428 5.847 1.00 0.00 O ATOM 213 ND2 ASN A 455 -10.354 -1.305 7.549 1.00 0.00 N ATOM 0 H ASN A 455 -7.912 -1.966 4.016 1.00 0.00 H new ATOM 0 HA ASN A 455 -9.737 0.310 3.923 1.00 0.00 H new ATOM 0 HB2 ASN A 455 -8.264 -0.967 6.227 1.00 0.00 H new ATOM 0 HB3 ASN A 455 -8.812 0.698 6.271 1.00 0.00 H new ATOM 0 HD21 ASN A 455 -11.232 -1.491 8.034 1.00 0.00 H new ATOM 0 HD22 ASN A 455 -9.467 -1.562 7.983 1.00 0.00 H new ATOM 220 N ILE A 456 -7.475 1.094 2.828 1.00 0.00 N ATOM 221 CA ILE A 456 -6.446 2.051 2.427 1.00 0.00 C ATOM 222 C ILE A 456 -6.115 3.127 3.500 1.00 0.00 C ATOM 223 O ILE A 456 -4.923 3.355 3.697 1.00 0.00 O ATOM 224 CB ILE A 456 -6.849 2.631 1.055 1.00 0.00 C ATOM 225 CG1 ILE A 456 -6.829 1.597 -0.102 1.00 0.00 C ATOM 226 CG2 ILE A 456 -6.012 3.850 0.657 1.00 0.00 C ATOM 227 CD1 ILE A 456 -5.534 0.785 -0.264 1.00 0.00 C ATOM 0 H ILE A 456 -8.114 0.846 2.072 1.00 0.00 H new ATOM 0 HA ILE A 456 -5.494 1.529 2.332 1.00 0.00 H new ATOM 0 HB ILE A 456 -7.884 2.941 1.202 1.00 0.00 H new ATOM 0 HG12 ILE A 456 -7.654 0.900 0.047 1.00 0.00 H new ATOM 0 HG13 ILE A 456 -7.022 2.124 -1.036 1.00 0.00 H new ATOM 0 HG21 ILE A 456 -6.340 4.215 -0.316 1.00 0.00 H new ATOM 0 HG22 ILE A 456 -6.138 4.637 1.401 1.00 0.00 H new ATOM 0 HG23 ILE A 456 -4.961 3.567 0.603 1.00 0.00 H new ATOM 0 HD11 ILE A 456 -5.639 0.097 -1.103 1.00 0.00 H new ATOM 0 HD12 ILE A 456 -4.701 1.462 -0.452 1.00 0.00 H new ATOM 0 HD13 ILE A 456 -5.343 0.219 0.648 1.00 0.00 H new ATOM 239 N PRO A 457 -7.054 3.753 4.258 1.00 0.00 N ATOM 240 CA PRO A 457 -6.708 4.788 5.242 1.00 0.00 C ATOM 241 C PRO A 457 -5.797 4.259 6.363 1.00 0.00 C ATOM 242 O PRO A 457 -4.703 4.783 6.582 1.00 0.00 O ATOM 243 CB PRO A 457 -8.041 5.330 5.792 1.00 0.00 C ATOM 244 CG PRO A 457 -9.105 4.799 4.828 1.00 0.00 C ATOM 245 CD PRO A 457 -8.484 3.491 4.361 1.00 0.00 C ATOM 0 HA PRO A 457 -6.129 5.581 4.768 1.00 0.00 H new ATOM 0 HB2 PRO A 457 -8.220 4.982 6.809 1.00 0.00 H new ATOM 0 HB3 PRO A 457 -8.043 6.420 5.822 1.00 0.00 H new ATOM 0 HG2 PRO A 457 -10.063 4.642 5.324 1.00 0.00 H new ATOM 0 HG3 PRO A 457 -9.284 5.485 4.000 1.00 0.00 H new ATOM 0 HD2 PRO A 457 -8.685 2.687 5.068 1.00 0.00 H new ATOM 0 HD3 PRO A 457 -8.896 3.182 3.401 1.00 0.00 H new ATOM 253 N MET A 458 -6.215 3.198 7.068 1.00 0.00 N ATOM 254 CA MET A 458 -5.416 2.581 8.140 1.00 0.00 C ATOM 255 C MET A 458 -4.228 1.776 7.595 1.00 0.00 C ATOM 256 O MET A 458 -3.245 1.608 8.312 1.00 0.00 O ATOM 257 CB MET A 458 -6.311 1.770 9.093 1.00 0.00 C ATOM 258 CG MET A 458 -7.313 0.852 8.421 1.00 0.00 C ATOM 259 SD MET A 458 -8.449 0.091 9.604 1.00 0.00 S ATOM 260 CE MET A 458 -7.530 -1.427 9.884 1.00 0.00 C ATOM 0 H MET A 458 -7.115 2.743 6.913 1.00 0.00 H new ATOM 0 HA MET A 458 -4.971 3.384 8.728 1.00 0.00 H new ATOM 0 HB2 MET A 458 -5.672 1.170 9.742 1.00 0.00 H new ATOM 0 HB3 MET A 458 -6.853 2.465 9.734 1.00 0.00 H new ATOM 0 HG2 MET A 458 -7.884 1.418 7.685 1.00 0.00 H new ATOM 0 HG3 MET A 458 -6.780 0.071 7.879 1.00 0.00 H new ATOM 0 HE1 MET A 458 -8.124 -2.104 10.498 1.00 0.00 H new ATOM 0 HE2 MET A 458 -7.312 -1.902 8.927 1.00 0.00 H new ATOM 0 HE3 MET A 458 -6.596 -1.198 10.397 1.00 0.00 H new ATOM 270 N TRP A 459 -4.234 1.360 6.322 1.00 0.00 N ATOM 271 CA TRP A 459 -3.041 0.770 5.707 1.00 0.00 C ATOM 272 C TRP A 459 -1.927 1.806 5.466 1.00 0.00 C ATOM 273 O TRP A 459 -0.789 1.621 5.897 1.00 0.00 O ATOM 274 CB TRP A 459 -3.398 -0.044 4.472 1.00 0.00 C ATOM 275 CG TRP A 459 -2.260 -0.789 3.845 1.00 0.00 C ATOM 276 CD1 TRP A 459 -1.920 -2.067 4.133 1.00 0.00 C ATOM 277 CD2 TRP A 459 -1.284 -0.326 2.854 1.00 0.00 C ATOM 278 NE1 TRP A 459 -0.828 -2.432 3.373 1.00 0.00 N ATOM 279 CE2 TRP A 459 -0.405 -1.411 2.560 1.00 0.00 C ATOM 280 CE3 TRP A 459 -1.033 0.896 2.185 1.00 0.00 C ATOM 281 CZ2 TRP A 459 0.644 -1.315 1.637 1.00 0.00 C ATOM 282 CZ3 TRP A 459 0.049 1.015 1.288 1.00 0.00 C ATOM 283 CH2 TRP A 459 0.863 -0.086 1.005 1.00 0.00 C ATOM 0 H TRP A 459 -5.043 1.421 5.704 1.00 0.00 H new ATOM 0 HA TRP A 459 -2.617 0.066 6.423 1.00 0.00 H new ATOM 0 HB2 TRP A 459 -4.175 -0.760 4.741 1.00 0.00 H new ATOM 0 HB3 TRP A 459 -3.826 0.626 3.727 1.00 0.00 H new ATOM 0 HD1 TRP A 459 -2.425 -2.702 4.846 1.00 0.00 H new ATOM 0 HE1 TRP A 459 -0.388 -3.351 3.411 1.00 0.00 H new ATOM 0 HE3 TRP A 459 -1.676 1.745 2.363 1.00 0.00 H new ATOM 0 HZ2 TRP A 459 1.269 -2.169 1.418 1.00 0.00 H new ATOM 0 HZ3 TRP A 459 0.251 1.965 0.816 1.00 0.00 H new ATOM 0 HH2 TRP A 459 1.668 0.013 0.292 1.00 0.00 H new ATOM 294 N LEU A 460 -2.273 2.953 4.869 1.00 0.00 N ATOM 295 CA LEU A 460 -1.425 4.149 4.740 1.00 0.00 C ATOM 296 C LEU A 460 -0.994 4.733 6.096 1.00 0.00 C ATOM 297 O LEU A 460 -0.015 5.481 6.165 1.00 0.00 O ATOM 298 CB LEU A 460 -2.215 5.223 3.971 1.00 0.00 C ATOM 299 CG LEU A 460 -2.517 4.933 2.498 1.00 0.00 C ATOM 300 CD1 LEU A 460 -3.556 5.944 2.001 1.00 0.00 C ATOM 301 CD2 LEU A 460 -1.278 5.122 1.636 1.00 0.00 C ATOM 0 H LEU A 460 -3.191 3.081 4.443 1.00 0.00 H new ATOM 0 HA LEU A 460 -0.518 3.852 4.214 1.00 0.00 H new ATOM 0 HB2 LEU A 460 -3.162 5.384 4.487 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.659 6.159 4.026 1.00 0.00 H new ATOM 0 HG LEU A 460 -2.870 3.904 2.423 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -3.781 5.749 0.952 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -4.467 5.849 2.591 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -3.160 6.954 2.105 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -1.523 4.909 0.595 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -0.927 6.150 1.723 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.495 4.442 1.971 1.00 0.00 H new ATOM 313 N LYS A 461 -1.704 4.423 7.185 1.00 0.00 N ATOM 314 CA LYS A 461 -1.340 4.840 8.546 1.00 0.00 C ATOM 315 C LYS A 461 -0.079 4.190 9.078 1.00 0.00 C ATOM 316 O LYS A 461 0.673 4.847 9.798 1.00 0.00 O ATOM 317 CB LYS A 461 -2.548 4.628 9.456 1.00 0.00 C ATOM 318 CG LYS A 461 -2.329 5.285 10.811 1.00 0.00 C ATOM 319 CD LYS A 461 -3.571 5.228 11.683 1.00 0.00 C ATOM 320 CE LYS A 461 -4.548 6.326 11.243 1.00 0.00 C ATOM 321 NZ LYS A 461 -4.467 7.537 12.105 1.00 0.00 N ATOM 0 H LYS A 461 -2.559 3.868 7.147 1.00 0.00 H new ATOM 0 HA LYS A 461 -1.083 5.899 8.520 1.00 0.00 H new ATOM 0 HB2 LYS A 461 -3.440 5.043 8.986 1.00 0.00 H new ATOM 0 HB3 LYS A 461 -2.725 3.561 9.589 1.00 0.00 H new ATOM 0 HG2 LYS A 461 -1.504 4.790 11.324 1.00 0.00 H new ATOM 0 HG3 LYS A 461 -2.036 6.325 10.666 1.00 0.00 H new ATOM 0 HD2 LYS A 461 -4.044 4.249 11.600 1.00 0.00 H new ATOM 0 HD3 LYS A 461 -3.301 5.363 12.730 1.00 0.00 H new ATOM 0 HE2 LYS A 461 -4.337 6.604 10.210 1.00 0.00 H new ATOM 0 HE3 LYS A 461 -5.565 5.934 11.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 461 -5.421 7.799 12.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 461 -3.867 7.336 12.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 461 -4.057 8.323 11.562 1.00 0.00 H new ATOM 335 N SER A 462 0.236 2.985 8.623 1.00 0.00 N ATOM 336 CA SER A 462 1.539 2.381 8.903 1.00 0.00 C ATOM 337 C SER A 462 2.706 3.224 8.348 1.00 0.00 C ATOM 338 O SER A 462 3.813 3.185 8.886 1.00 0.00 O ATOM 339 CB SER A 462 1.607 0.968 8.315 1.00 0.00 C ATOM 340 OG SER A 462 0.644 0.128 8.929 1.00 0.00 O ATOM 0 H SER A 462 -0.387 2.406 8.061 1.00 0.00 H new ATOM 0 HA SER A 462 1.643 2.338 9.987 1.00 0.00 H new ATOM 0 HB2 SER A 462 1.432 1.006 7.240 1.00 0.00 H new ATOM 0 HB3 SER A 462 2.605 0.555 8.461 1.00 0.00 H new ATOM 0 HG SER A 462 0.699 -0.770 8.541 1.00 0.00 H new ATOM 346 N LEU A 463 2.468 4.037 7.304 1.00 0.00 N ATOM 347 CA LEU A 463 3.425 4.956 6.679 1.00 0.00 C ATOM 348 C LEU A 463 3.466 6.331 7.375 1.00 0.00 C ATOM 349 O LEU A 463 4.247 7.193 6.974 1.00 0.00 O ATOM 350 CB LEU A 463 3.091 5.144 5.179 1.00 0.00 C ATOM 351 CG LEU A 463 2.457 3.941 4.466 1.00 0.00 C ATOM 352 CD1 LEU A 463 2.251 4.229 2.987 1.00 0.00 C ATOM 353 CD2 LEU A 463 3.292 2.665 4.566 1.00 0.00 C ATOM 0 H LEU A 463 1.554 4.070 6.853 1.00 0.00 H new ATOM 0 HA LEU A 463 4.411 4.503 6.786 1.00 0.00 H new ATOM 0 HB2 LEU A 463 2.415 5.993 5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 463 4.010 5.407 4.655 1.00 0.00 H new ATOM 0 HG LEU A 463 1.507 3.782 4.976 1.00 0.00 H new ATOM 0 HD11 LEU A 463 1.801 3.360 2.506 1.00 0.00 H new ATOM 0 HD12 LEU A 463 1.592 5.090 2.872 1.00 0.00 H new ATOM 0 HD13 LEU A 463 3.213 4.444 2.521 1.00 0.00 H new ATOM 0 HD21 LEU A 463 2.785 1.856 4.041 1.00 0.00 H new ATOM 0 HD22 LEU A 463 4.270 2.834 4.115 1.00 0.00 H new ATOM 0 HD23 LEU A 463 3.418 2.394 5.614 1.00 0.00 H new ATOM 365 N ARG A 464 2.598 6.554 8.379 1.00 0.00 N ATOM 366 CA ARG A 464 2.298 7.841 9.034 1.00 0.00 C ATOM 367 C ARG A 464 1.700 8.888 8.070 1.00 0.00 C ATOM 368 O ARG A 464 1.617 10.068 8.407 1.00 0.00 O ATOM 369 CB ARG A 464 3.505 8.343 9.856 1.00 0.00 C ATOM 370 CG ARG A 464 3.909 7.413 11.017 1.00 0.00 C ATOM 371 CD ARG A 464 4.739 6.182 10.618 1.00 0.00 C ATOM 372 NE ARG A 464 5.421 5.597 11.789 1.00 0.00 N ATOM 373 CZ ARG A 464 5.840 4.355 11.957 1.00 0.00 C ATOM 374 NH1 ARG A 464 5.616 3.407 11.090 1.00 0.00 N ATOM 375 NH2 ARG A 464 6.511 4.034 13.026 1.00 0.00 N ATOM 0 H ARG A 464 2.052 5.791 8.780 1.00 0.00 H new ATOM 0 HA ARG A 464 1.497 7.666 9.752 1.00 0.00 H new ATOM 0 HB2 ARG A 464 4.359 8.465 9.189 1.00 0.00 H new ATOM 0 HB3 ARG A 464 3.271 9.328 10.259 1.00 0.00 H new ATOM 0 HG2 ARG A 464 4.477 7.993 11.744 1.00 0.00 H new ATOM 0 HG3 ARG A 464 3.003 7.072 11.519 1.00 0.00 H new ATOM 0 HD2 ARG A 464 4.090 5.435 10.161 1.00 0.00 H new ATOM 0 HD3 ARG A 464 5.477 6.465 9.868 1.00 0.00 H new ATOM 0 HE ARG A 464 5.591 6.233 12.568 1.00 0.00 H new ATOM 0 HH11 ARG A 464 5.096 3.609 10.236 1.00 0.00 H new ATOM 0 HH12 ARG A 464 5.961 2.463 11.266 1.00 0.00 H new ATOM 0 HH21 ARG A 464 6.713 4.741 13.733 1.00 0.00 H new ATOM 0 HH22 ARG A 464 6.835 3.076 13.156 1.00 0.00 H new ATOM 389 N LEU A 465 1.236 8.443 6.895 1.00 0.00 N ATOM 390 CA LEU A 465 0.551 9.250 5.880 1.00 0.00 C ATOM 391 C LEU A 465 -0.962 9.277 6.124 1.00 0.00 C ATOM 392 O LEU A 465 -1.495 10.319 6.498 1.00 0.00 O ATOM 393 CB LEU A 465 0.885 8.722 4.471 1.00 0.00 C ATOM 394 CG LEU A 465 2.360 8.928 4.075 1.00 0.00 C ATOM 395 CD1 LEU A 465 2.628 8.213 2.755 1.00 0.00 C ATOM 396 CD2 LEU A 465 2.748 10.411 3.998 1.00 0.00 C ATOM 0 H LEU A 465 1.333 7.467 6.615 1.00 0.00 H new ATOM 0 HA LEU A 465 0.907 10.278 5.954 1.00 0.00 H new ATOM 0 HB2 LEU A 465 0.649 7.659 4.424 1.00 0.00 H new ATOM 0 HB3 LEU A 465 0.247 9.223 3.743 1.00 0.00 H new ATOM 0 HG LEU A 465 2.987 8.497 4.856 1.00 0.00 H new ATOM 0 HD11 LEU A 465 3.670 8.355 2.469 1.00 0.00 H new ATOM 0 HD12 LEU A 465 2.425 7.148 2.870 1.00 0.00 H new ATOM 0 HD13 LEU A 465 1.980 8.624 1.981 1.00 0.00 H new ATOM 0 HD21 LEU A 465 3.797 10.498 3.715 1.00 0.00 H new ATOM 0 HD22 LEU A 465 2.129 10.911 3.253 1.00 0.00 H new ATOM 0 HD23 LEU A 465 2.594 10.878 4.971 1.00 0.00 H new ATOM 408 N HIS A 466 -1.646 8.142 5.910 1.00 0.00 N ATOM 409 CA HIS A 466 -3.104 7.967 6.122 1.00 0.00 C ATOM 410 C HIS A 466 -4.041 9.068 5.582 1.00 0.00 C ATOM 411 O HIS A 466 -5.128 9.283 6.125 1.00 0.00 O ATOM 412 CB HIS A 466 -3.342 7.566 7.582 1.00 0.00 C ATOM 413 CG HIS A 466 -2.988 8.545 8.666 1.00 0.00 C ATOM 414 ND1 HIS A 466 -1.815 8.538 9.385 1.00 0.00 N ATOM 415 CD2 HIS A 466 -3.856 9.394 9.293 1.00 0.00 C ATOM 416 CE1 HIS A 466 -1.978 9.337 10.447 1.00 0.00 C ATOM 417 NE2 HIS A 466 -3.208 9.883 10.436 1.00 0.00 N ATOM 0 H HIS A 466 -1.193 7.292 5.575 1.00 0.00 H new ATOM 0 HA HIS A 466 -3.418 7.155 5.466 1.00 0.00 H new ATOM 0 HB2 HIS A 466 -4.399 7.322 7.690 1.00 0.00 H new ATOM 0 HB3 HIS A 466 -2.782 6.650 7.769 1.00 0.00 H new ATOM 0 HD2 HIS A 466 -4.856 9.642 8.968 1.00 0.00 H new ATOM 0 HE1 HIS A 466 -1.229 9.518 11.204 1.00 0.00 H new ATOM 0 HE2 HIS A 466 -3.594 10.528 11.126 1.00 0.00 H new ATOM 425 N LYS A 467 -3.634 9.746 4.494 1.00 0.00 N ATOM 426 CA LYS A 467 -4.317 10.934 3.944 1.00 0.00 C ATOM 427 C LYS A 467 -4.571 10.942 2.428 1.00 0.00 C ATOM 428 O LYS A 467 -5.275 11.825 1.943 1.00 0.00 O ATOM 429 CB LYS A 467 -3.612 12.196 4.486 1.00 0.00 C ATOM 430 CG LYS A 467 -2.174 12.498 4.048 1.00 0.00 C ATOM 431 CD LYS A 467 -2.009 13.084 2.649 1.00 0.00 C ATOM 432 CE LYS A 467 -2.853 14.324 2.319 1.00 0.00 C ATOM 433 NZ LYS A 467 -2.482 15.502 3.147 1.00 0.00 N ATOM 0 H LYS A 467 -2.806 9.480 3.961 1.00 0.00 H new ATOM 0 HA LYS A 467 -5.346 10.909 4.303 1.00 0.00 H new ATOM 0 HB2 LYS A 467 -4.225 13.056 4.215 1.00 0.00 H new ATOM 0 HB3 LYS A 467 -3.617 12.132 5.574 1.00 0.00 H new ATOM 0 HG2 LYS A 467 -1.735 13.192 4.765 1.00 0.00 H new ATOM 0 HG3 LYS A 467 -1.597 11.575 4.104 1.00 0.00 H new ATOM 0 HD2 LYS A 467 -0.959 13.339 2.508 1.00 0.00 H new ATOM 0 HD3 LYS A 467 -2.248 12.306 1.924 1.00 0.00 H new ATOM 0 HE2 LYS A 467 -2.731 14.572 1.265 1.00 0.00 H new ATOM 0 HE3 LYS A 467 -3.907 14.093 2.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 467 -3.080 16.312 2.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 467 -2.623 15.278 4.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 467 -1.483 15.742 2.982 1.00 0.00 H new ATOM 447 N TYR A 468 -4.060 9.956 1.681 1.00 0.00 N ATOM 448 CA TYR A 468 -4.302 9.807 0.230 1.00 0.00 C ATOM 449 C TYR A 468 -5.560 9.006 -0.107 1.00 0.00 C ATOM 450 O TYR A 468 -6.064 9.078 -1.226 1.00 0.00 O ATOM 451 CB TYR A 468 -3.065 9.239 -0.472 1.00 0.00 C ATOM 452 CG TYR A 468 -1.892 10.148 -0.183 1.00 0.00 C ATOM 453 CD1 TYR A 468 -1.907 11.437 -0.749 1.00 0.00 C ATOM 454 CD2 TYR A 468 -0.908 9.809 0.765 1.00 0.00 C ATOM 455 CE1 TYR A 468 -0.909 12.373 -0.431 1.00 0.00 C ATOM 456 CE2 TYR A 468 0.056 10.768 1.120 1.00 0.00 C ATOM 457 CZ TYR A 468 0.083 12.038 0.509 1.00 0.00 C ATOM 458 OH TYR A 468 1.006 12.962 0.891 1.00 0.00 O ATOM 0 H TYR A 468 -3.459 9.227 2.066 1.00 0.00 H new ATOM 0 HA TYR A 468 -4.490 10.810 -0.152 1.00 0.00 H new ATOM 0 HB2 TYR A 468 -2.858 8.229 -0.118 1.00 0.00 H new ATOM 0 HB3 TYR A 468 -3.236 9.171 -1.546 1.00 0.00 H new ATOM 0 HD1 TYR A 468 -2.695 11.709 -1.436 1.00 0.00 H new ATOM 0 HD2 TYR A 468 -0.894 8.826 1.213 1.00 0.00 H new ATOM 0 HE1 TYR A 468 -0.903 13.343 -0.905 1.00 0.00 H new ATOM 0 HE2 TYR A 468 0.790 10.527 1.875 1.00 0.00 H new ATOM 0 HH TYR A 468 1.616 12.564 1.547 1.00 0.00 H new ATOM 468 N SER A 469 -6.121 8.308 0.878 1.00 0.00 N ATOM 469 CA SER A 469 -7.351 7.516 0.828 1.00 0.00 C ATOM 470 C SER A 469 -8.535 8.299 0.256 1.00 0.00 C ATOM 471 O SER A 469 -9.367 7.743 -0.459 1.00 0.00 O ATOM 472 CB SER A 469 -7.699 7.100 2.265 1.00 0.00 C ATOM 473 OG SER A 469 -7.422 8.152 3.182 1.00 0.00 O ATOM 0 H SER A 469 -5.695 8.278 1.804 1.00 0.00 H new ATOM 0 HA SER A 469 -7.176 6.660 0.176 1.00 0.00 H new ATOM 0 HB2 SER A 469 -8.753 6.830 2.324 1.00 0.00 H new ATOM 0 HB3 SER A 469 -7.127 6.214 2.539 1.00 0.00 H new ATOM 0 HG SER A 469 -7.653 7.864 4.090 1.00 0.00 H new ATOM 479 N ASP A 470 -8.564 9.613 0.489 1.00 0.00 N ATOM 480 CA ASP A 470 -9.554 10.558 -0.028 1.00 0.00 C ATOM 481 C ASP A 470 -9.692 10.519 -1.564 1.00 0.00 C ATOM 482 O ASP A 470 -10.761 10.802 -2.110 1.00 0.00 O ATOM 483 CB ASP A 470 -9.146 11.962 0.431 1.00 0.00 C ATOM 484 CG ASP A 470 -10.211 13.020 0.097 1.00 0.00 C ATOM 485 OD1 ASP A 470 -11.305 12.994 0.712 1.00 0.00 O ATOM 486 OD2 ASP A 470 -9.948 13.900 -0.758 1.00 0.00 O ATOM 0 H ASP A 470 -7.862 10.069 1.073 1.00 0.00 H new ATOM 0 HA ASP A 470 -10.531 10.277 0.365 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -8.971 11.953 1.507 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -8.204 12.237 -0.043 1.00 0.00 H new ATOM 491 N ALA A 471 -8.612 10.125 -2.246 1.00 0.00 N ATOM 492 CA ALA A 471 -8.495 10.000 -3.696 1.00 0.00 C ATOM 493 C ALA A 471 -8.100 8.584 -4.182 1.00 0.00 C ATOM 494 O ALA A 471 -8.179 8.289 -5.377 1.00 0.00 O ATOM 495 CB ALA A 471 -7.480 11.059 -4.141 1.00 0.00 C ATOM 0 H ALA A 471 -7.747 9.871 -1.769 1.00 0.00 H new ATOM 0 HA ALA A 471 -9.473 10.161 -4.150 1.00 0.00 H new ATOM 0 HB1 ALA A 471 -7.353 11.010 -5.223 1.00 0.00 H new ATOM 0 HB2 ALA A 471 -7.841 12.049 -3.863 1.00 0.00 H new ATOM 0 HB3 ALA A 471 -6.523 10.872 -3.655 1.00 0.00 H new ATOM 501 N LEU A 472 -7.713 7.698 -3.257 1.00 0.00 N ATOM 502 CA LEU A 472 -7.054 6.420 -3.492 1.00 0.00 C ATOM 503 C LEU A 472 -7.757 5.183 -2.904 1.00 0.00 C ATOM 504 O LEU A 472 -7.483 4.077 -3.362 1.00 0.00 O ATOM 505 CB LEU A 472 -5.646 6.602 -2.906 1.00 0.00 C ATOM 506 CG LEU A 472 -4.627 5.590 -3.427 1.00 0.00 C ATOM 507 CD1 LEU A 472 -3.380 6.320 -3.912 1.00 0.00 C ATOM 508 CD2 LEU A 472 -4.273 4.538 -2.386 1.00 0.00 C ATOM 0 H LEU A 472 -7.864 7.871 -2.263 1.00 0.00 H new ATOM 0 HA LEU A 472 -7.063 6.198 -4.559 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -5.295 7.608 -3.134 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -5.701 6.522 -1.820 1.00 0.00 H new ATOM 0 HG LEU A 472 -5.081 5.058 -4.263 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -2.655 5.595 -4.283 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -3.649 7.007 -4.714 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -2.942 6.881 -3.086 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -3.546 3.842 -2.804 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -3.847 5.024 -1.508 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -5.172 3.993 -2.099 1.00 0.00 H new ATOM 520 N SER A 473 -8.692 5.323 -1.956 1.00 0.00 N ATOM 521 CA SER A 473 -9.461 4.189 -1.396 1.00 0.00 C ATOM 522 C SER A 473 -10.310 3.435 -2.429 1.00 0.00 C ATOM 523 O SER A 473 -10.665 2.277 -2.206 1.00 0.00 O ATOM 524 CB SER A 473 -10.363 4.628 -0.241 1.00 0.00 C ATOM 525 OG SER A 473 -9.584 4.956 0.895 1.00 0.00 O ATOM 0 H SER A 473 -8.942 6.225 -1.551 1.00 0.00 H new ATOM 0 HA SER A 473 -8.698 3.501 -1.033 1.00 0.00 H new ATOM 0 HB2 SER A 473 -10.958 5.490 -0.543 1.00 0.00 H new ATOM 0 HB3 SER A 473 -11.062 3.829 0.007 1.00 0.00 H new ATOM 0 HG SER A 473 -10.173 5.237 1.626 1.00 0.00 H new ATOM 531 N GLY A 474 -10.586 4.047 -3.587 1.00 0.00 N ATOM 532 CA GLY A 474 -11.179 3.378 -4.751 1.00 0.00 C ATOM 533 C GLY A 474 -10.239 2.370 -5.437 1.00 0.00 C ATOM 534 O GLY A 474 -10.688 1.616 -6.302 1.00 0.00 O ATOM 0 H GLY A 474 -10.400 5.038 -3.744 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -12.085 2.860 -4.437 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -11.479 4.133 -5.478 1.00 0.00 H new ATOM 538 N THR A 475 -8.953 2.330 -5.056 1.00 0.00 N ATOM 539 CA THR A 475 -7.941 1.388 -5.573 1.00 0.00 C ATOM 540 C THR A 475 -7.568 0.341 -4.507 1.00 0.00 C ATOM 541 O THR A 475 -6.850 0.679 -3.562 1.00 0.00 O ATOM 542 CB THR A 475 -6.700 2.128 -6.111 1.00 0.00 C ATOM 543 OG1 THR A 475 -7.083 3.136 -7.031 1.00 0.00 O ATOM 544 CG2 THR A 475 -5.793 1.179 -6.892 1.00 0.00 C ATOM 0 H THR A 475 -8.574 2.971 -4.358 1.00 0.00 H new ATOM 0 HA THR A 475 -8.381 0.855 -6.416 1.00 0.00 H new ATOM 0 HB THR A 475 -6.186 2.545 -5.245 1.00 0.00 H new ATOM 0 HG1 THR A 475 -6.533 3.935 -6.889 1.00 0.00 H new ATOM 0 HG21 THR A 475 -4.925 1.726 -7.261 1.00 0.00 H new ATOM 0 HG22 THR A 475 -5.462 0.372 -6.239 1.00 0.00 H new ATOM 0 HG23 THR A 475 -6.343 0.761 -7.735 1.00 0.00 H new ATOM 552 N PRO A 476 -8.037 -0.925 -4.611 1.00 0.00 N ATOM 553 CA PRO A 476 -7.707 -1.985 -3.650 1.00 0.00 C ATOM 554 C PRO A 476 -6.232 -2.335 -3.699 1.00 0.00 C ATOM 555 O PRO A 476 -5.635 -2.276 -4.771 1.00 0.00 O ATOM 556 CB PRO A 476 -8.492 -3.232 -4.082 1.00 0.00 C ATOM 557 CG PRO A 476 -8.796 -2.980 -5.557 1.00 0.00 C ATOM 558 CD PRO A 476 -8.851 -1.463 -5.690 1.00 0.00 C ATOM 0 HA PRO A 476 -7.953 -1.651 -2.642 1.00 0.00 H new ATOM 0 HB2 PRO A 476 -7.906 -4.141 -3.944 1.00 0.00 H new ATOM 0 HB3 PRO A 476 -9.406 -3.351 -3.500 1.00 0.00 H new ATOM 0 HG2 PRO A 476 -8.024 -3.405 -6.198 1.00 0.00 H new ATOM 0 HG3 PRO A 476 -9.741 -3.437 -5.850 1.00 0.00 H new ATOM 0 HD2 PRO A 476 -8.469 -1.144 -6.660 1.00 0.00 H new ATOM 0 HD3 PRO A 476 -9.878 -1.104 -5.618 1.00 0.00 H new ATOM 566 N TRP A 477 -5.673 -2.823 -2.588 1.00 0.00 N ATOM 567 CA TRP A 477 -4.255 -3.184 -2.479 1.00 0.00 C ATOM 568 C TRP A 477 -3.722 -4.048 -3.635 1.00 0.00 C ATOM 569 O TRP A 477 -2.582 -3.881 -4.061 1.00 0.00 O ATOM 570 CB TRP A 477 -3.976 -3.880 -1.164 1.00 0.00 C ATOM 571 CG TRP A 477 -4.385 -5.321 -1.118 1.00 0.00 C ATOM 572 CD1 TRP A 477 -5.640 -5.821 -1.035 1.00 0.00 C ATOM 573 CD2 TRP A 477 -3.506 -6.477 -1.222 1.00 0.00 C ATOM 574 NE1 TRP A 477 -5.582 -7.192 -1.005 1.00 0.00 N ATOM 575 CE2 TRP A 477 -4.295 -7.663 -1.155 1.00 0.00 C ATOM 576 CE3 TRP A 477 -2.115 -6.636 -1.373 1.00 0.00 C ATOM 577 CZ2 TRP A 477 -3.730 -8.946 -1.234 1.00 0.00 C ATOM 578 CZ3 TRP A 477 -1.543 -7.911 -1.414 1.00 0.00 C ATOM 579 CH2 TRP A 477 -2.337 -9.069 -1.372 1.00 0.00 C ATOM 0 H TRP A 477 -6.198 -2.981 -1.728 1.00 0.00 H new ATOM 0 HA TRP A 477 -3.722 -2.235 -2.532 1.00 0.00 H new ATOM 0 HB2 TRP A 477 -2.909 -3.813 -0.952 1.00 0.00 H new ATOM 0 HB3 TRP A 477 -4.493 -3.344 -0.368 1.00 0.00 H new ATOM 0 HD1 TRP A 477 -6.545 -5.233 -0.998 1.00 0.00 H new ATOM 0 HE1 TRP A 477 -6.397 -7.793 -0.885 1.00 0.00 H new ATOM 0 HE3 TRP A 477 -1.484 -5.764 -1.458 1.00 0.00 H new ATOM 0 HZ2 TRP A 477 -4.356 -9.825 -1.189 1.00 0.00 H new ATOM 0 HZ3 TRP A 477 -0.469 -8.008 -1.479 1.00 0.00 H new ATOM 0 HH2 TRP A 477 -1.881 -10.045 -1.445 1.00 0.00 H new ATOM 590 N ILE A 478 -4.546 -4.941 -4.181 1.00 0.00 N ATOM 591 CA ILE A 478 -4.109 -5.840 -5.247 1.00 0.00 C ATOM 592 C ILE A 478 -4.036 -5.166 -6.632 1.00 0.00 C ATOM 593 O ILE A 478 -3.352 -5.677 -7.516 1.00 0.00 O ATOM 594 CB ILE A 478 -4.956 -7.123 -5.215 1.00 0.00 C ATOM 595 CG1 ILE A 478 -4.164 -8.305 -5.816 1.00 0.00 C ATOM 596 CG2 ILE A 478 -6.333 -6.949 -5.878 1.00 0.00 C ATOM 597 CD1 ILE A 478 -4.617 -9.666 -5.279 1.00 0.00 C ATOM 0 H ILE A 478 -5.520 -5.061 -3.902 1.00 0.00 H new ATOM 0 HA ILE A 478 -3.073 -6.121 -5.056 1.00 0.00 H new ATOM 0 HB ILE A 478 -5.165 -7.350 -4.170 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -4.274 -8.294 -6.900 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -3.104 -8.171 -5.601 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -6.884 -7.888 -5.824 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -6.891 -6.170 -5.358 1.00 0.00 H new ATOM 0 HG23 ILE A 478 -6.201 -6.665 -6.922 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -4.022 -10.455 -5.740 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -4.482 -9.694 -4.198 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -5.670 -9.819 -5.517 1.00 0.00 H new ATOM 609 N GLU A 479 -4.675 -4.000 -6.823 1.00 0.00 N ATOM 610 CA GLU A 479 -4.489 -3.149 -8.022 1.00 0.00 C ATOM 611 C GLU A 479 -3.601 -1.917 -7.738 1.00 0.00 C ATOM 612 O GLU A 479 -3.045 -1.296 -8.643 1.00 0.00 O ATOM 613 CB GLU A 479 -5.857 -2.698 -8.565 1.00 0.00 C ATOM 614 CG GLU A 479 -6.703 -3.877 -9.066 1.00 0.00 C ATOM 615 CD GLU A 479 -7.968 -3.379 -9.792 1.00 0.00 C ATOM 616 OE1 GLU A 479 -7.912 -3.152 -11.027 1.00 0.00 O ATOM 617 OE2 GLU A 479 -9.030 -3.222 -9.142 1.00 0.00 O ATOM 0 H GLU A 479 -5.339 -3.615 -6.151 1.00 0.00 H new ATOM 0 HA GLU A 479 -3.975 -3.752 -8.770 1.00 0.00 H new ATOM 0 HB2 GLU A 479 -6.401 -2.171 -7.781 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -5.706 -1.990 -9.380 1.00 0.00 H new ATOM 0 HG2 GLU A 479 -6.110 -4.493 -9.742 1.00 0.00 H new ATOM 0 HG3 GLU A 479 -6.987 -4.509 -8.225 1.00 0.00 H new ATOM 624 N LEU A 480 -3.453 -1.596 -6.455 1.00 0.00 N ATOM 625 CA LEU A 480 -2.698 -0.516 -5.817 1.00 0.00 C ATOM 626 C LEU A 480 -1.205 -0.750 -5.877 1.00 0.00 C ATOM 627 O LEU A 480 -0.470 0.080 -6.402 1.00 0.00 O ATOM 628 CB LEU A 480 -3.174 -0.542 -4.370 1.00 0.00 C ATOM 629 CG LEU A 480 -2.701 0.304 -3.196 1.00 0.00 C ATOM 630 CD1 LEU A 480 -1.501 -0.264 -2.463 1.00 0.00 C ATOM 631 CD2 LEU A 480 -2.486 1.712 -3.662 1.00 0.00 C ATOM 0 H LEU A 480 -3.920 -2.160 -5.745 1.00 0.00 H new ATOM 0 HA LEU A 480 -2.865 0.439 -6.315 1.00 0.00 H new ATOM 0 HB2 LEU A 480 -4.249 -0.369 -4.425 1.00 0.00 H new ATOM 0 HB3 LEU A 480 -3.033 -1.573 -4.047 1.00 0.00 H new ATOM 0 HG LEU A 480 -3.487 0.292 -2.441 1.00 0.00 H new ATOM 0 HD11 LEU A 480 -1.229 0.399 -1.642 1.00 0.00 H new ATOM 0 HD12 LEU A 480 -1.749 -1.249 -2.067 1.00 0.00 H new ATOM 0 HD13 LEU A 480 -0.661 -0.351 -3.152 1.00 0.00 H new ATOM 0 HD21 LEU A 480 -2.147 2.324 -2.826 1.00 0.00 H new ATOM 0 HD22 LEU A 480 -1.732 1.724 -4.449 1.00 0.00 H new ATOM 0 HD23 LEU A 480 -3.422 2.114 -4.050 1.00 0.00 H new ATOM 643 N ILE A 481 -0.736 -1.877 -5.332 1.00 0.00 N ATOM 644 CA ILE A 481 0.694 -2.053 -5.136 1.00 0.00 C ATOM 645 C ILE A 481 1.458 -2.074 -6.475 1.00 0.00 C ATOM 646 O ILE A 481 2.628 -1.710 -6.563 1.00 0.00 O ATOM 647 CB ILE A 481 0.997 -3.312 -4.295 1.00 0.00 C ATOM 648 CG1 ILE A 481 0.558 -4.598 -5.032 1.00 0.00 C ATOM 649 CG2 ILE A 481 0.387 -3.146 -2.894 1.00 0.00 C ATOM 650 CD1 ILE A 481 0.638 -5.864 -4.184 1.00 0.00 C ATOM 0 H ILE A 481 -1.315 -2.660 -5.027 1.00 0.00 H new ATOM 0 HA ILE A 481 1.050 -1.188 -4.576 1.00 0.00 H new ATOM 0 HB ILE A 481 2.073 -3.424 -4.160 1.00 0.00 H new ATOM 0 HG12 ILE A 481 -0.467 -4.472 -5.380 1.00 0.00 H new ATOM 0 HG13 ILE A 481 1.181 -4.727 -5.917 1.00 0.00 H new ATOM 0 HG21 ILE A 481 0.599 -4.033 -2.297 1.00 0.00 H new ATOM 0 HG22 ILE A 481 0.821 -2.271 -2.410 1.00 0.00 H new ATOM 0 HG23 ILE A 481 -0.692 -3.016 -2.980 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.313 -6.720 -4.776 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.666 -6.019 -3.857 1.00 0.00 H new ATOM 0 HD13 ILE A 481 -0.008 -5.759 -3.312 1.00 0.00 H new ATOM 662 N TYR A 482 0.744 -2.477 -7.528 1.00 0.00 N ATOM 663 CA TYR A 482 1.116 -2.507 -8.939 1.00 0.00 C ATOM 664 C TYR A 482 1.310 -1.128 -9.594 1.00 0.00 C ATOM 665 O TYR A 482 1.798 -1.069 -10.729 1.00 0.00 O ATOM 666 CB TYR A 482 -0.006 -3.249 -9.676 1.00 0.00 C ATOM 667 CG TYR A 482 -0.107 -4.758 -9.496 1.00 0.00 C ATOM 668 CD1 TYR A 482 0.795 -5.490 -8.692 1.00 0.00 C ATOM 669 CD2 TYR A 482 -1.141 -5.439 -10.168 1.00 0.00 C ATOM 670 CE1 TYR A 482 0.662 -6.885 -8.560 1.00 0.00 C ATOM 671 CE2 TYR A 482 -1.275 -6.835 -10.047 1.00 0.00 C ATOM 672 CZ TYR A 482 -0.370 -7.564 -9.246 1.00 0.00 C ATOM 673 OH TYR A 482 -0.490 -8.917 -9.142 1.00 0.00 O ATOM 0 H TYR A 482 -0.206 -2.825 -7.397 1.00 0.00 H new ATOM 0 HA TYR A 482 2.088 -2.996 -9.007 1.00 0.00 H new ATOM 0 HB2 TYR A 482 -0.955 -2.812 -9.365 1.00 0.00 H new ATOM 0 HB3 TYR A 482 0.104 -3.047 -10.741 1.00 0.00 H new ATOM 0 HD1 TYR A 482 1.592 -4.976 -8.175 1.00 0.00 H new ATOM 0 HD2 TYR A 482 -1.837 -4.885 -10.781 1.00 0.00 H new ATOM 0 HE1 TYR A 482 1.349 -7.436 -7.935 1.00 0.00 H new ATOM 0 HE2 TYR A 482 -2.070 -7.348 -10.567 1.00 0.00 H new ATOM 0 HH TYR A 482 -1.253 -9.220 -9.677 1.00 0.00 H new ATOM 683 N LEU A 483 0.943 -0.026 -8.927 1.00 0.00 N ATOM 684 CA LEU A 483 1.268 1.323 -9.425 1.00 0.00 C ATOM 685 C LEU A 483 2.784 1.590 -9.303 1.00 0.00 C ATOM 686 O LEU A 483 3.591 0.724 -8.955 1.00 0.00 O ATOM 687 CB LEU A 483 0.463 2.442 -8.726 1.00 0.00 C ATOM 688 CG LEU A 483 -1.065 2.239 -8.646 1.00 0.00 C ATOM 689 CD1 LEU A 483 -1.656 2.824 -7.375 1.00 0.00 C ATOM 690 CD2 LEU A 483 -1.798 3.007 -9.739 1.00 0.00 C ATOM 0 H LEU A 483 0.425 -0.038 -8.048 1.00 0.00 H new ATOM 0 HA LEU A 483 0.977 1.345 -10.475 1.00 0.00 H new ATOM 0 HB2 LEU A 483 0.846 2.556 -7.712 1.00 0.00 H new ATOM 0 HB3 LEU A 483 0.657 3.379 -9.248 1.00 0.00 H new ATOM 0 HG LEU A 483 -1.192 1.159 -8.718 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -2.733 2.657 -7.364 1.00 0.00 H new ATOM 0 HD12 LEU A 483 -1.205 2.341 -6.508 1.00 0.00 H new ATOM 0 HD13 LEU A 483 -1.455 3.895 -7.339 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -2.871 2.837 -9.647 1.00 0.00 H new ATOM 0 HD22 LEU A 483 -1.590 4.072 -9.638 1.00 0.00 H new ATOM 0 HD23 LEU A 483 -1.459 2.662 -10.716 1.00 0.00 H new ATOM 702 N ASP A 484 3.175 2.820 -9.608 1.00 0.00 N ATOM 703 CA ASP A 484 4.558 3.275 -9.688 1.00 0.00 C ATOM 704 C ASP A 484 4.686 4.711 -9.166 1.00 0.00 C ATOM 705 O ASP A 484 3.691 5.353 -8.817 1.00 0.00 O ATOM 706 CB ASP A 484 4.947 3.270 -11.166 1.00 0.00 C ATOM 707 CG ASP A 484 6.456 3.138 -11.457 1.00 0.00 C ATOM 708 OD1 ASP A 484 7.278 3.116 -10.511 1.00 0.00 O ATOM 709 OD2 ASP A 484 6.824 3.063 -12.655 1.00 0.00 O ATOM 0 H ASP A 484 2.507 3.562 -9.816 1.00 0.00 H new ATOM 0 HA ASP A 484 5.197 2.625 -9.090 1.00 0.00 H new ATOM 0 HB2 ASP A 484 4.427 2.448 -11.657 1.00 0.00 H new ATOM 0 HB3 ASP A 484 4.587 4.192 -11.621 1.00 0.00 H new ATOM 714 N ASP A 485 5.910 5.232 -9.229 1.00 0.00 N ATOM 715 CA ASP A 485 6.303 6.580 -8.859 1.00 0.00 C ATOM 716 C ASP A 485 5.306 7.655 -9.310 1.00 0.00 C ATOM 717 O ASP A 485 4.574 8.206 -8.490 1.00 0.00 O ATOM 718 CB ASP A 485 7.735 6.840 -9.363 1.00 0.00 C ATOM 719 CG ASP A 485 8.281 8.185 -8.872 1.00 0.00 C ATOM 720 OD1 ASP A 485 8.329 8.414 -7.644 1.00 0.00 O ATOM 721 OD2 ASP A 485 8.638 9.049 -9.704 1.00 0.00 O ATOM 0 H ASP A 485 6.702 4.683 -9.563 1.00 0.00 H new ATOM 0 HA ASP A 485 6.292 6.653 -7.772 1.00 0.00 H new ATOM 0 HB2 ASP A 485 8.390 6.037 -9.024 1.00 0.00 H new ATOM 0 HB3 ASP A 485 7.745 6.821 -10.453 1.00 0.00 H new ATOM 726 N GLU A 486 5.231 7.957 -10.607 1.00 0.00 N ATOM 727 CA GLU A 486 4.383 9.018 -11.111 1.00 0.00 C ATOM 728 C GLU A 486 2.905 8.628 -11.243 1.00 0.00 C ATOM 729 O GLU A 486 2.068 9.512 -11.389 1.00 0.00 O ATOM 730 CB GLU A 486 4.963 9.505 -12.446 1.00 0.00 C ATOM 731 CG GLU A 486 4.694 11.001 -12.570 1.00 0.00 C ATOM 732 CD GLU A 486 5.105 11.589 -13.934 1.00 0.00 C ATOM 733 OE1 GLU A 486 6.294 11.480 -14.324 1.00 0.00 O ATOM 734 OE2 GLU A 486 4.237 12.187 -14.618 1.00 0.00 O ATOM 0 H GLU A 486 5.759 7.469 -11.330 1.00 0.00 H new ATOM 0 HA GLU A 486 4.383 9.825 -10.378 1.00 0.00 H new ATOM 0 HB2 GLU A 486 6.034 9.307 -12.489 1.00 0.00 H new ATOM 0 HB3 GLU A 486 4.506 8.967 -13.277 1.00 0.00 H new ATOM 0 HG2 GLU A 486 3.632 11.186 -12.409 1.00 0.00 H new ATOM 0 HG3 GLU A 486 5.232 11.525 -11.780 1.00 0.00 H new ATOM 741 N THR A 487 2.536 7.345 -11.158 1.00 0.00 N ATOM 742 CA THR A 487 1.114 6.961 -11.300 1.00 0.00 C ATOM 743 C THR A 487 0.297 7.120 -10.034 1.00 0.00 C ATOM 744 O THR A 487 -0.874 7.499 -10.100 1.00 0.00 O ATOM 745 CB THR A 487 0.917 5.561 -11.903 1.00 0.00 C ATOM 746 OG1 THR A 487 1.610 5.475 -13.131 1.00 0.00 O ATOM 747 CG2 THR A 487 -0.557 5.235 -12.183 1.00 0.00 C ATOM 0 H THR A 487 3.177 6.568 -10.996 1.00 0.00 H new ATOM 0 HA THR A 487 0.725 7.686 -12.015 1.00 0.00 H new ATOM 0 HB THR A 487 1.297 4.851 -11.169 1.00 0.00 H new ATOM 0 HG1 THR A 487 1.486 4.582 -13.515 1.00 0.00 H new ATOM 0 HG21 THR A 487 -0.634 4.234 -12.608 1.00 0.00 H new ATOM 0 HG22 THR A 487 -1.122 5.279 -11.252 1.00 0.00 H new ATOM 0 HG23 THR A 487 -0.963 5.961 -12.888 1.00 0.00 H new ATOM 755 N LEU A 488 0.917 6.965 -8.870 1.00 0.00 N ATOM 756 CA LEU A 488 0.334 7.380 -7.599 1.00 0.00 C ATOM 757 C LEU A 488 -0.061 8.862 -7.643 1.00 0.00 C ATOM 758 O LEU A 488 -1.038 9.320 -7.050 1.00 0.00 O ATOM 759 CB LEU A 488 1.426 7.107 -6.558 1.00 0.00 C ATOM 760 CG LEU A 488 1.546 5.605 -6.277 1.00 0.00 C ATOM 761 CD1 LEU A 488 2.761 5.367 -5.394 1.00 0.00 C ATOM 762 CD2 LEU A 488 0.291 5.084 -5.587 1.00 0.00 C ATOM 0 H LEU A 488 1.843 6.546 -8.781 1.00 0.00 H new ATOM 0 HA LEU A 488 -0.583 6.840 -7.362 1.00 0.00 H new ATOM 0 HB2 LEU A 488 2.381 7.492 -6.916 1.00 0.00 H new ATOM 0 HB3 LEU A 488 1.195 7.637 -5.634 1.00 0.00 H new ATOM 0 HG LEU A 488 1.660 5.071 -7.220 1.00 0.00 H new ATOM 0 HD11 LEU A 488 2.857 4.301 -5.187 1.00 0.00 H new ATOM 0 HD12 LEU A 488 3.657 5.720 -5.905 1.00 0.00 H new ATOM 0 HD13 LEU A 488 2.641 5.909 -4.456 1.00 0.00 H new ATOM 0 HD21 LEU A 488 0.397 4.016 -5.397 1.00 0.00 H new ATOM 0 HD22 LEU A 488 0.151 5.609 -4.642 1.00 0.00 H new ATOM 0 HD23 LEU A 488 -0.574 5.254 -6.228 1.00 0.00 H new ATOM 774 N GLU A 489 0.678 9.615 -8.442 1.00 0.00 N ATOM 775 CA GLU A 489 0.562 11.021 -8.676 1.00 0.00 C ATOM 776 C GLU A 489 -0.357 11.371 -9.869 1.00 0.00 C ATOM 777 O GLU A 489 -0.541 12.537 -10.221 1.00 0.00 O ATOM 778 CB GLU A 489 2.022 11.428 -8.803 1.00 0.00 C ATOM 779 CG GLU A 489 2.254 12.873 -9.203 1.00 0.00 C ATOM 780 CD GLU A 489 3.658 13.378 -8.855 1.00 0.00 C ATOM 781 OE1 GLU A 489 4.046 13.303 -7.665 1.00 0.00 O ATOM 782 OE2 GLU A 489 4.374 13.871 -9.758 1.00 0.00 O ATOM 0 H GLU A 489 1.439 9.208 -8.986 1.00 0.00 H new ATOM 0 HA GLU A 489 0.054 11.578 -7.889 1.00 0.00 H new ATOM 0 HB2 GLU A 489 2.518 11.247 -7.849 1.00 0.00 H new ATOM 0 HB3 GLU A 489 2.501 10.782 -9.539 1.00 0.00 H new ATOM 0 HG2 GLU A 489 2.093 12.976 -10.276 1.00 0.00 H new ATOM 0 HG3 GLU A 489 1.515 13.503 -8.708 1.00 0.00 H new ATOM 789 N LYS A 490 -0.997 10.371 -10.483 1.00 0.00 N ATOM 790 CA LYS A 490 -2.155 10.551 -11.338 1.00 0.00 C ATOM 791 C LYS A 490 -3.440 10.236 -10.561 1.00 0.00 C ATOM 792 O LYS A 490 -4.537 10.473 -11.070 1.00 0.00 O ATOM 793 CB LYS A 490 -2.005 9.697 -12.589 1.00 0.00 C ATOM 794 CG LYS A 490 -0.691 9.875 -13.334 1.00 0.00 C ATOM 795 CD LYS A 490 -0.412 11.290 -13.811 1.00 0.00 C ATOM 796 CE LYS A 490 1.093 11.396 -14.080 1.00 0.00 C ATOM 797 NZ LYS A 490 1.494 12.711 -14.635 1.00 0.00 N ATOM 0 H LYS A 490 -0.711 9.396 -10.392 1.00 0.00 H new ATOM 0 HA LYS A 490 -2.224 11.591 -11.658 1.00 0.00 H new ATOM 0 HB2 LYS A 490 -2.108 8.648 -12.310 1.00 0.00 H new ATOM 0 HB3 LYS A 490 -2.825 9.928 -13.269 1.00 0.00 H new ATOM 0 HG2 LYS A 490 0.124 9.559 -12.683 1.00 0.00 H new ATOM 0 HG3 LYS A 490 -0.686 9.209 -14.197 1.00 0.00 H new ATOM 0 HD2 LYS A 490 -0.980 11.509 -14.715 1.00 0.00 H new ATOM 0 HD3 LYS A 490 -0.719 12.016 -13.058 1.00 0.00 H new ATOM 0 HE2 LYS A 490 1.635 11.220 -13.151 1.00 0.00 H new ATOM 0 HE3 LYS A 490 1.388 10.610 -14.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 2.530 12.752 -14.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 1.068 12.835 -15.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 1.166 13.469 -14.003 1.00 0.00 H new ATOM 811 N LYS A 491 -3.297 9.742 -9.317 1.00 0.00 N ATOM 812 CA LYS A 491 -4.373 9.335 -8.416 1.00 0.00 C ATOM 813 C LYS A 491 -4.609 10.256 -7.237 1.00 0.00 C ATOM 814 O LYS A 491 -5.763 10.499 -6.896 1.00 0.00 O ATOM 815 CB LYS A 491 -4.131 7.873 -7.951 1.00 0.00 C ATOM 816 CG LYS A 491 -4.146 6.768 -9.025 1.00 0.00 C ATOM 817 CD LYS A 491 -5.530 6.147 -9.238 1.00 0.00 C ATOM 818 CE LYS A 491 -5.410 4.779 -9.925 1.00 0.00 C ATOM 819 NZ LYS A 491 -6.667 3.993 -9.801 1.00 0.00 N ATOM 0 H LYS A 491 -2.376 9.612 -8.898 1.00 0.00 H new ATOM 0 HA LYS A 491 -5.295 9.403 -8.993 1.00 0.00 H new ATOM 0 HB2 LYS A 491 -3.166 7.837 -7.446 1.00 0.00 H new ATOM 0 HB3 LYS A 491 -4.889 7.628 -7.207 1.00 0.00 H new ATOM 0 HG2 LYS A 491 -3.793 7.184 -9.969 1.00 0.00 H new ATOM 0 HG3 LYS A 491 -3.444 5.984 -8.740 1.00 0.00 H new ATOM 0 HD2 LYS A 491 -6.036 6.035 -8.279 1.00 0.00 H new ATOM 0 HD3 LYS A 491 -6.143 6.812 -9.846 1.00 0.00 H new ATOM 0 HE2 LYS A 491 -5.171 4.920 -10.979 1.00 0.00 H new ATOM 0 HE3 LYS A 491 -4.585 4.220 -9.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 491 -6.607 3.145 -10.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 491 -6.801 3.707 -8.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 491 -7.473 4.576 -10.105 1.00 0.00 H new ATOM 833 N GLY A 492 -3.555 10.821 -6.660 1.00 0.00 N ATOM 834 CA GLY A 492 -3.694 11.890 -5.673 1.00 0.00 C ATOM 835 C GLY A 492 -2.672 11.965 -4.564 1.00 0.00 C ATOM 836 O GLY A 492 -2.759 12.804 -3.671 1.00 0.00 O ATOM 0 H GLY A 492 -2.590 10.557 -6.858 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -3.680 12.841 -6.206 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -4.678 11.796 -5.215 1.00 0.00 H new ATOM 840 N VAL A 493 -1.703 11.068 -4.648 1.00 0.00 N ATOM 841 CA VAL A 493 -0.547 10.982 -3.768 1.00 0.00 C ATOM 842 C VAL A 493 0.288 12.265 -3.871 1.00 0.00 C ATOM 843 O VAL A 493 0.810 12.815 -2.908 1.00 0.00 O ATOM 844 CB VAL A 493 0.176 9.679 -4.063 1.00 0.00 C ATOM 845 CG1 VAL A 493 1.398 9.561 -3.200 1.00 0.00 C ATOM 846 CG2 VAL A 493 -0.777 8.508 -3.772 1.00 0.00 C ATOM 0 H VAL A 493 -1.700 10.344 -5.367 1.00 0.00 H new ATOM 0 HA VAL A 493 -0.822 10.936 -2.714 1.00 0.00 H new ATOM 0 HB VAL A 493 0.483 9.660 -5.109 1.00 0.00 H new ATOM 0 HG11 VAL A 493 1.909 8.624 -3.419 1.00 0.00 H new ATOM 0 HG12 VAL A 493 2.069 10.396 -3.403 1.00 0.00 H new ATOM 0 HG13 VAL A 493 1.105 9.578 -2.150 1.00 0.00 H new ATOM 0 HG21 VAL A 493 -0.270 7.566 -3.980 1.00 0.00 H new ATOM 0 HG22 VAL A 493 -1.077 8.535 -2.725 1.00 0.00 H new ATOM 0 HG23 VAL A 493 -1.660 8.592 -4.405 1.00 0.00 H new ATOM 856 N LEU A 494 0.272 12.756 -5.102 1.00 0.00 N ATOM 857 CA LEU A 494 0.583 14.050 -5.677 1.00 0.00 C ATOM 858 C LEU A 494 1.886 14.734 -5.219 1.00 0.00 C ATOM 859 O LEU A 494 1.992 15.961 -5.144 1.00 0.00 O ATOM 860 CB LEU A 494 -0.667 14.922 -5.580 1.00 0.00 C ATOM 861 CG LEU A 494 -1.836 14.433 -6.470 1.00 0.00 C ATOM 862 CD1 LEU A 494 -2.121 15.394 -7.571 1.00 0.00 C ATOM 863 CD2 LEU A 494 -1.644 13.193 -7.372 1.00 0.00 C ATOM 0 H LEU A 494 -0.015 12.130 -5.854 1.00 0.00 H new ATOM 0 HA LEU A 494 0.842 13.881 -6.722 1.00 0.00 H new ATOM 0 HB2 LEU A 494 -0.999 14.951 -4.542 1.00 0.00 H new ATOM 0 HB3 LEU A 494 -0.410 15.943 -5.861 1.00 0.00 H new ATOM 0 HG LEU A 494 -2.565 14.265 -5.677 1.00 0.00 H new ATOM 0 HD11 LEU A 494 -2.947 15.020 -8.176 1.00 0.00 H new ATOM 0 HD12 LEU A 494 -2.390 16.362 -7.148 1.00 0.00 H new ATOM 0 HD13 LEU A 494 -1.235 15.505 -8.196 1.00 0.00 H new ATOM 0 HD21 LEU A 494 -2.564 12.997 -7.922 1.00 0.00 H new ATOM 0 HD22 LEU A 494 -0.832 13.377 -8.076 1.00 0.00 H new ATOM 0 HD23 LEU A 494 -1.400 12.328 -6.755 1.00 0.00 H new ATOM 875 N ALA A 495 2.860 13.907 -4.874 1.00 0.00 N ATOM 876 CA ALA A 495 4.104 14.274 -4.200 1.00 0.00 C ATOM 877 C ALA A 495 5.088 13.110 -4.170 1.00 0.00 C ATOM 878 O ALA A 495 4.714 11.995 -3.801 1.00 0.00 O ATOM 879 CB ALA A 495 3.782 14.633 -2.747 1.00 0.00 C ATOM 0 H ALA A 495 2.805 12.907 -5.065 1.00 0.00 H new ATOM 0 HA ALA A 495 4.549 15.108 -4.743 1.00 0.00 H new ATOM 0 HB1 ALA A 495 4.700 14.910 -2.229 1.00 0.00 H new ATOM 0 HB2 ALA A 495 3.086 15.472 -2.725 1.00 0.00 H new ATOM 0 HB3 ALA A 495 3.330 13.774 -2.251 1.00 0.00 H new ATOM 885 N LEU A 496 6.363 13.384 -4.458 1.00 0.00 N ATOM 886 CA LEU A 496 7.469 12.433 -4.375 1.00 0.00 C ATOM 887 C LEU A 496 7.577 11.794 -3.007 1.00 0.00 C ATOM 888 O LEU A 496 7.540 10.575 -2.904 1.00 0.00 O ATOM 889 CB LEU A 496 8.751 13.112 -4.826 1.00 0.00 C ATOM 890 CG LEU A 496 10.042 12.282 -4.619 1.00 0.00 C ATOM 891 CD1 LEU A 496 11.050 12.645 -5.702 1.00 0.00 C ATOM 892 CD2 LEU A 496 10.748 12.542 -3.282 1.00 0.00 C ATOM 0 H LEU A 496 6.662 14.309 -4.767 1.00 0.00 H new ATOM 0 HA LEU A 496 7.274 11.601 -5.052 1.00 0.00 H new ATOM 0 HB2 LEU A 496 8.661 13.357 -5.884 1.00 0.00 H new ATOM 0 HB3 LEU A 496 8.853 14.054 -4.288 1.00 0.00 H new ATOM 0 HG LEU A 496 9.724 11.240 -4.649 1.00 0.00 H new ATOM 0 HD11 LEU A 496 11.961 12.063 -5.561 1.00 0.00 H new ATOM 0 HD12 LEU A 496 10.627 12.424 -6.682 1.00 0.00 H new ATOM 0 HD13 LEU A 496 11.285 13.708 -5.639 1.00 0.00 H new ATOM 0 HD21 LEU A 496 11.642 11.922 -3.216 1.00 0.00 H new ATOM 0 HD22 LEU A 496 11.030 13.593 -3.218 1.00 0.00 H new ATOM 0 HD23 LEU A 496 10.075 12.296 -2.461 1.00 0.00 H new ATOM 904 N GLY A 497 7.646 12.582 -1.938 1.00 0.00 N ATOM 905 CA GLY A 497 7.811 11.996 -0.611 1.00 0.00 C ATOM 906 C GLY A 497 6.522 11.533 0.060 1.00 0.00 C ATOM 907 O GLY A 497 6.406 11.484 1.283 1.00 0.00 O ATOM 0 H GLY A 497 7.592 13.600 -1.960 1.00 0.00 H new ATOM 0 HA2 GLY A 497 8.487 11.145 -0.689 1.00 0.00 H new ATOM 0 HA3 GLY A 497 8.295 12.729 0.035 1.00 0.00 H new ATOM 911 N ALA A 498 5.587 11.139 -0.796 1.00 0.00 N ATOM 912 CA ALA A 498 4.371 10.403 -0.498 1.00 0.00 C ATOM 913 C ALA A 498 4.340 9.151 -1.383 1.00 0.00 C ATOM 914 O ALA A 498 4.342 8.024 -0.900 1.00 0.00 O ATOM 915 CB ALA A 498 3.184 11.324 -0.736 1.00 0.00 C ATOM 0 H ALA A 498 5.668 11.343 -1.792 1.00 0.00 H new ATOM 0 HA ALA A 498 4.330 10.076 0.541 1.00 0.00 H new ATOM 0 HB1 ALA A 498 2.259 10.790 -0.518 1.00 0.00 H new ATOM 0 HB2 ALA A 498 3.263 12.195 -0.085 1.00 0.00 H new ATOM 0 HB3 ALA A 498 3.178 11.649 -1.777 1.00 0.00 H new ATOM 921 N ARG A 499 4.438 9.331 -2.701 1.00 0.00 N ATOM 922 CA ARG A 499 4.526 8.241 -3.689 1.00 0.00 C ATOM 923 C ARG A 499 5.734 7.308 -3.510 1.00 0.00 C ATOM 924 O ARG A 499 5.619 6.137 -3.815 1.00 0.00 O ATOM 925 CB ARG A 499 4.426 8.815 -5.118 1.00 0.00 C ATOM 926 CG ARG A 499 5.681 9.595 -5.503 1.00 0.00 C ATOM 927 CD ARG A 499 5.524 10.593 -6.647 1.00 0.00 C ATOM 928 NE ARG A 499 6.774 10.733 -7.414 1.00 0.00 N ATOM 929 CZ ARG A 499 7.287 11.779 -8.027 1.00 0.00 C ATOM 930 NH1 ARG A 499 6.752 12.961 -7.982 1.00 0.00 N ATOM 931 NH2 ARG A 499 8.379 11.640 -8.716 1.00 0.00 N ATOM 0 H ARG A 499 4.459 10.258 -3.127 1.00 0.00 H new ATOM 0 HA ARG A 499 3.671 7.589 -3.509 1.00 0.00 H new ATOM 0 HB2 ARG A 499 4.272 8.001 -5.827 1.00 0.00 H new ATOM 0 HB3 ARG A 499 3.556 9.468 -5.188 1.00 0.00 H new ATOM 0 HG2 ARG A 499 6.034 10.133 -4.623 1.00 0.00 H new ATOM 0 HG3 ARG A 499 6.459 8.882 -5.774 1.00 0.00 H new ATOM 0 HD2 ARG A 499 4.723 10.266 -7.310 1.00 0.00 H new ATOM 0 HD3 ARG A 499 5.230 11.564 -6.247 1.00 0.00 H new ATOM 0 HE ARG A 499 7.332 9.882 -7.481 1.00 0.00 H new ATOM 0 HH11 ARG A 499 5.893 13.112 -7.453 1.00 0.00 H new ATOM 0 HH12 ARG A 499 7.191 13.738 -8.476 1.00 0.00 H new ATOM 0 HH21 ARG A 499 8.830 10.727 -8.778 1.00 0.00 H new ATOM 0 HH22 ARG A 499 8.785 12.443 -9.195 1.00 0.00 H new ATOM 945 N ARG A 500 6.862 7.744 -2.941 1.00 0.00 N ATOM 946 CA ARG A 500 8.129 7.000 -2.786 1.00 0.00 C ATOM 947 C ARG A 500 8.084 6.223 -1.479 1.00 0.00 C ATOM 948 O ARG A 500 8.479 5.066 -1.384 1.00 0.00 O ATOM 949 CB ARG A 500 9.218 8.069 -2.778 1.00 0.00 C ATOM 950 CG ARG A 500 10.569 7.522 -2.373 1.00 0.00 C ATOM 951 CD ARG A 500 11.581 8.649 -2.541 1.00 0.00 C ATOM 952 NE ARG A 500 12.946 8.231 -2.160 1.00 0.00 N ATOM 953 CZ ARG A 500 13.860 7.651 -2.919 1.00 0.00 C ATOM 954 NH1 ARG A 500 13.639 7.345 -4.167 1.00 0.00 N ATOM 955 NH2 ARG A 500 15.032 7.361 -2.432 1.00 0.00 N ATOM 0 H ARG A 500 6.925 8.684 -2.550 1.00 0.00 H new ATOM 0 HA ARG A 500 8.310 6.275 -3.580 1.00 0.00 H new ATOM 0 HB2 ARG A 500 9.293 8.513 -3.771 1.00 0.00 H new ATOM 0 HB3 ARG A 500 8.933 8.867 -2.092 1.00 0.00 H new ATOM 0 HG2 ARG A 500 10.549 7.174 -1.340 1.00 0.00 H new ATOM 0 HG3 ARG A 500 10.839 6.667 -2.993 1.00 0.00 H new ATOM 0 HD2 ARG A 500 11.581 8.984 -3.578 1.00 0.00 H new ATOM 0 HD3 ARG A 500 11.279 9.501 -1.931 1.00 0.00 H new ATOM 0 HE ARG A 500 13.216 8.412 -1.193 1.00 0.00 H new ATOM 0 HH11 ARG A 500 12.735 7.553 -4.591 1.00 0.00 H new ATOM 0 HH12 ARG A 500 14.370 6.898 -4.720 1.00 0.00 H new ATOM 0 HH21 ARG A 500 15.249 7.581 -1.460 1.00 0.00 H new ATOM 0 HH22 ARG A 500 15.733 6.914 -3.022 1.00 0.00 H new ATOM 969 N LYS A 501 7.504 6.872 -0.477 1.00 0.00 N ATOM 970 CA LYS A 501 7.078 6.268 0.773 1.00 0.00 C ATOM 971 C LYS A 501 6.044 5.159 0.533 1.00 0.00 C ATOM 972 O LYS A 501 6.020 4.138 1.226 1.00 0.00 O ATOM 973 CB LYS A 501 6.500 7.432 1.570 1.00 0.00 C ATOM 974 CG LYS A 501 7.512 8.480 2.067 1.00 0.00 C ATOM 975 CD LYS A 501 8.610 7.921 2.983 1.00 0.00 C ATOM 976 CE LYS A 501 9.566 9.055 3.374 1.00 0.00 C ATOM 977 NZ LYS A 501 10.626 8.585 4.306 1.00 0.00 N ATOM 0 H LYS A 501 7.311 7.873 -0.518 1.00 0.00 H new ATOM 0 HA LYS A 501 7.894 5.777 1.304 1.00 0.00 H new ATOM 0 HB2 LYS A 501 5.759 7.937 0.951 1.00 0.00 H new ATOM 0 HB3 LYS A 501 5.972 7.028 2.434 1.00 0.00 H new ATOM 0 HG2 LYS A 501 7.982 8.951 1.203 1.00 0.00 H new ATOM 0 HG3 LYS A 501 6.973 9.262 2.602 1.00 0.00 H new ATOM 0 HD2 LYS A 501 8.166 7.480 3.875 1.00 0.00 H new ATOM 0 HD3 LYS A 501 9.157 7.128 2.473 1.00 0.00 H new ATOM 0 HE2 LYS A 501 10.027 9.468 2.477 1.00 0.00 H new ATOM 0 HE3 LYS A 501 9.002 9.862 3.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 11.253 9.379 4.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 10.187 8.214 5.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 11.181 7.833 3.850 1.00 0.00 H new ATOM 991 N LEU A 502 5.253 5.306 -0.524 1.00 0.00 N ATOM 992 CA LEU A 502 4.386 4.252 -1.001 1.00 0.00 C ATOM 993 C LEU A 502 5.140 3.165 -1.771 1.00 0.00 C ATOM 994 O LEU A 502 4.773 2.008 -1.649 1.00 0.00 O ATOM 995 CB LEU A 502 3.271 4.835 -1.864 1.00 0.00 C ATOM 996 CG LEU A 502 1.940 4.961 -1.104 1.00 0.00 C ATOM 997 CD1 LEU A 502 1.995 5.987 0.021 1.00 0.00 C ATOM 998 CD2 LEU A 502 0.845 5.407 -2.058 1.00 0.00 C ATOM 0 H LEU A 502 5.200 6.165 -1.071 1.00 0.00 H new ATOM 0 HA LEU A 502 3.955 3.774 -0.121 1.00 0.00 H new ATOM 0 HB2 LEU A 502 3.573 5.818 -2.226 1.00 0.00 H new ATOM 0 HB3 LEU A 502 3.126 4.203 -2.740 1.00 0.00 H new ATOM 0 HG LEU A 502 1.739 3.978 -0.678 1.00 0.00 H new ATOM 0 HD11 LEU A 502 1.027 6.031 0.521 1.00 0.00 H new ATOM 0 HD12 LEU A 502 2.762 5.698 0.740 1.00 0.00 H new ATOM 0 HD13 LEU A 502 2.236 6.967 -0.392 1.00 0.00 H new ATOM 0 HD21 LEU A 502 -0.096 5.495 -1.516 1.00 0.00 H new ATOM 0 HD22 LEU A 502 1.108 6.374 -2.488 1.00 0.00 H new ATOM 0 HD23 LEU A 502 0.737 4.673 -2.856 1.00 0.00 H new ATOM 1010 N LEU A 503 6.211 3.472 -2.511 1.00 0.00 N ATOM 1011 CA LEU A 503 7.018 2.490 -3.207 1.00 0.00 C ATOM 1012 C LEU A 503 7.686 1.551 -2.199 1.00 0.00 C ATOM 1013 O LEU A 503 7.784 0.347 -2.451 1.00 0.00 O ATOM 1014 CB LEU A 503 8.032 3.237 -4.091 1.00 0.00 C ATOM 1015 CG LEU A 503 7.486 3.806 -5.413 1.00 0.00 C ATOM 1016 CD1 LEU A 503 5.986 3.680 -5.695 1.00 0.00 C ATOM 1017 CD2 LEU A 503 8.014 5.163 -5.869 1.00 0.00 C ATOM 0 H LEU A 503 6.539 4.429 -2.639 1.00 0.00 H new ATOM 0 HA LEU A 503 6.403 1.862 -3.851 1.00 0.00 H new ATOM 0 HB2 LEU A 503 8.453 4.059 -3.511 1.00 0.00 H new ATOM 0 HB3 LEU A 503 8.852 2.557 -4.322 1.00 0.00 H new ATOM 0 HG LEU A 503 7.960 3.062 -6.053 1.00 0.00 H new ATOM 0 HD11 LEU A 503 5.759 4.127 -6.663 1.00 0.00 H new ATOM 0 HD12 LEU A 503 5.705 2.627 -5.707 1.00 0.00 H new ATOM 0 HD13 LEU A 503 5.425 4.196 -4.916 1.00 0.00 H new ATOM 0 HD21 LEU A 503 7.543 5.438 -6.813 1.00 0.00 H new ATOM 0 HD22 LEU A 503 7.783 5.915 -5.115 1.00 0.00 H new ATOM 0 HD23 LEU A 503 9.094 5.106 -6.005 1.00 0.00 H new ATOM 1029 N LYS A 504 8.055 2.092 -1.024 1.00 0.00 N ATOM 1030 CA LYS A 504 8.442 1.303 0.147 1.00 0.00 C ATOM 1031 C LYS A 504 7.315 0.334 0.495 1.00 0.00 C ATOM 1032 O LYS A 504 7.489 -0.880 0.431 1.00 0.00 O ATOM 1033 CB LYS A 504 8.787 2.205 1.354 1.00 0.00 C ATOM 1034 CG LYS A 504 9.012 1.468 2.689 1.00 0.00 C ATOM 1035 CD LYS A 504 8.607 2.282 3.931 1.00 0.00 C ATOM 1036 CE LYS A 504 7.099 2.210 4.274 1.00 0.00 C ATOM 1037 NZ LYS A 504 6.873 2.640 5.681 1.00 0.00 N ATOM 0 H LYS A 504 8.091 3.099 -0.865 1.00 0.00 H new ATOM 0 HA LYS A 504 9.343 0.739 -0.095 1.00 0.00 H new ATOM 0 HB2 LYS A 504 9.687 2.773 1.116 1.00 0.00 H new ATOM 0 HB3 LYS A 504 7.981 2.927 1.488 1.00 0.00 H new ATOM 0 HG2 LYS A 504 8.446 0.537 2.678 1.00 0.00 H new ATOM 0 HG3 LYS A 504 10.065 1.200 2.771 1.00 0.00 H new ATOM 0 HD2 LYS A 504 9.180 1.926 4.787 1.00 0.00 H new ATOM 0 HD3 LYS A 504 8.883 3.325 3.774 1.00 0.00 H new ATOM 0 HE2 LYS A 504 6.533 2.848 3.595 1.00 0.00 H new ATOM 0 HE3 LYS A 504 6.734 1.192 4.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 504 5.858 2.588 5.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 504 7.399 2.014 6.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 504 7.204 3.618 5.802 1.00 0.00 H new ATOM 1051 N ALA A 505 6.160 0.895 0.858 1.00 0.00 N ATOM 1052 CA ALA A 505 4.985 0.178 1.327 1.00 0.00 C ATOM 1053 C ALA A 505 4.632 -0.980 0.378 1.00 0.00 C ATOM 1054 O ALA A 505 4.510 -2.140 0.786 1.00 0.00 O ATOM 1055 CB ALA A 505 3.865 1.209 1.475 1.00 0.00 C ATOM 0 H ALA A 505 6.018 1.905 0.830 1.00 0.00 H new ATOM 0 HA ALA A 505 5.161 -0.297 2.292 1.00 0.00 H new ATOM 0 HB1 ALA A 505 2.959 0.715 1.826 1.00 0.00 H new ATOM 0 HB2 ALA A 505 4.165 1.971 2.194 1.00 0.00 H new ATOM 0 HB3 ALA A 505 3.672 1.677 0.510 1.00 0.00 H new ATOM 1061 N PHE A 506 4.572 -0.648 -0.914 1.00 0.00 N ATOM 1062 CA PHE A 506 4.257 -1.539 -2.009 1.00 0.00 C ATOM 1063 C PHE A 506 5.228 -2.684 -2.011 1.00 0.00 C ATOM 1064 O PHE A 506 4.792 -3.795 -1.766 1.00 0.00 O ATOM 1065 CB PHE A 506 4.219 -0.822 -3.365 1.00 0.00 C ATOM 1066 CG PHE A 506 3.096 0.180 -3.531 1.00 0.00 C ATOM 1067 CD1 PHE A 506 2.157 0.383 -2.504 1.00 0.00 C ATOM 1068 CD2 PHE A 506 2.993 0.920 -4.721 1.00 0.00 C ATOM 1069 CE1 PHE A 506 1.200 1.396 -2.605 1.00 0.00 C ATOM 1070 CE2 PHE A 506 1.954 1.856 -4.872 1.00 0.00 C ATOM 1071 CZ PHE A 506 1.069 2.095 -3.806 1.00 0.00 C ATOM 0 H PHE A 506 4.754 0.304 -1.231 1.00 0.00 H new ATOM 0 HA PHE A 506 3.249 -1.924 -1.855 1.00 0.00 H new ATOM 0 HB2 PHE A 506 5.169 -0.308 -3.513 1.00 0.00 H new ATOM 0 HB3 PHE A 506 4.136 -1.571 -4.152 1.00 0.00 H new ATOM 0 HD1 PHE A 506 2.176 -0.250 -1.629 1.00 0.00 H new ATOM 0 HD2 PHE A 506 3.708 0.771 -5.516 1.00 0.00 H new ATOM 0 HE1 PHE A 506 0.568 1.636 -1.763 1.00 0.00 H new ATOM 0 HE2 PHE A 506 1.836 2.389 -5.804 1.00 0.00 H new ATOM 0 HZ PHE A 506 0.281 2.825 -3.917 1.00 0.00 H new ATOM 1081 N GLY A 507 6.528 -2.475 -2.222 1.00 0.00 N ATOM 1082 CA GLY A 507 7.388 -3.635 -2.350 1.00 0.00 C ATOM 1083 C GLY A 507 7.714 -4.428 -1.091 1.00 0.00 C ATOM 1084 O GLY A 507 8.305 -5.495 -1.222 1.00 0.00 O ATOM 0 H GLY A 507 6.983 -1.565 -2.303 1.00 0.00 H new ATOM 0 HA2 GLY A 507 6.924 -4.317 -3.063 1.00 0.00 H new ATOM 0 HA3 GLY A 507 8.329 -3.305 -2.790 1.00 0.00 H new ATOM 1088 N ILE A 508 7.297 -3.982 0.101 1.00 0.00 N ATOM 1089 CA ILE A 508 7.256 -4.885 1.257 1.00 0.00 C ATOM 1090 C ILE A 508 6.098 -5.851 0.985 1.00 0.00 C ATOM 1091 O ILE A 508 6.330 -7.046 0.911 1.00 0.00 O ATOM 1092 CB ILE A 508 7.096 -4.175 2.622 1.00 0.00 C ATOM 1093 CG1 ILE A 508 8.447 -3.694 3.204 1.00 0.00 C ATOM 1094 CG2 ILE A 508 6.522 -5.120 3.704 1.00 0.00 C ATOM 1095 CD1 ILE A 508 9.047 -2.460 2.538 1.00 0.00 C ATOM 0 H ILE A 508 6.991 -3.027 0.288 1.00 0.00 H new ATOM 0 HA ILE A 508 8.214 -5.397 1.352 1.00 0.00 H new ATOM 0 HB ILE A 508 6.429 -3.339 2.409 1.00 0.00 H new ATOM 0 HG12 ILE A 508 8.311 -3.483 4.265 1.00 0.00 H new ATOM 0 HG13 ILE A 508 9.165 -4.510 3.131 1.00 0.00 H new ATOM 0 HG21 ILE A 508 6.427 -4.579 4.646 1.00 0.00 H new ATOM 0 HG22 ILE A 508 5.542 -5.479 3.391 1.00 0.00 H new ATOM 0 HG23 ILE A 508 7.193 -5.968 3.839 1.00 0.00 H new ATOM 0 HD11 ILE A 508 9.991 -2.208 3.021 1.00 0.00 H new ATOM 0 HD12 ILE A 508 9.223 -2.666 1.482 1.00 0.00 H new ATOM 0 HD13 ILE A 508 8.356 -1.623 2.634 1.00 0.00 H new ATOM 1107 N VAL A 509 4.864 -5.379 0.763 1.00 0.00 N ATOM 1108 CA VAL A 509 3.708 -6.268 0.580 1.00 0.00 C ATOM 1109 C VAL A 509 3.826 -7.041 -0.732 1.00 0.00 C ATOM 1110 O VAL A 509 3.415 -8.191 -0.785 1.00 0.00 O ATOM 1111 CB VAL A 509 2.383 -5.503 0.724 1.00 0.00 C ATOM 1112 CG1 VAL A 509 2.196 -4.461 -0.347 1.00 0.00 C ATOM 1113 CG2 VAL A 509 1.140 -6.392 0.724 1.00 0.00 C ATOM 0 H VAL A 509 4.640 -4.386 0.706 1.00 0.00 H new ATOM 0 HA VAL A 509 3.706 -7.011 1.378 1.00 0.00 H new ATOM 0 HB VAL A 509 2.475 -5.032 1.703 1.00 0.00 H new ATOM 0 HG11 VAL A 509 1.244 -3.952 -0.197 1.00 0.00 H new ATOM 0 HG12 VAL A 509 3.008 -3.736 -0.295 1.00 0.00 H new ATOM 0 HG13 VAL A 509 2.200 -4.940 -1.326 1.00 0.00 H new ATOM 0 HG21 VAL A 509 0.250 -5.772 0.830 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.088 -6.945 -0.214 1.00 0.00 H new ATOM 0 HG23 VAL A 509 1.195 -7.094 1.556 1.00 0.00 H new ATOM 1123 N ILE A 510 4.468 -6.491 -1.766 1.00 0.00 N ATOM 1124 CA ILE A 510 4.848 -7.238 -2.974 1.00 0.00 C ATOM 1125 C ILE A 510 5.720 -8.445 -2.650 1.00 0.00 C ATOM 1126 O ILE A 510 5.464 -9.530 -3.161 1.00 0.00 O ATOM 1127 CB ILE A 510 5.412 -6.373 -4.093 1.00 0.00 C ATOM 1128 CG1 ILE A 510 4.263 -5.455 -4.566 1.00 0.00 C ATOM 1129 CG2 ILE A 510 5.995 -7.190 -5.263 1.00 0.00 C ATOM 1130 CD1 ILE A 510 4.650 -4.486 -5.676 1.00 0.00 C ATOM 0 H ILE A 510 4.742 -5.509 -1.791 1.00 0.00 H new ATOM 0 HA ILE A 510 3.915 -7.626 -3.382 1.00 0.00 H new ATOM 0 HB ILE A 510 6.255 -5.796 -3.715 1.00 0.00 H new ATOM 0 HG12 ILE A 510 3.437 -6.076 -4.914 1.00 0.00 H new ATOM 0 HG13 ILE A 510 3.895 -4.884 -3.713 1.00 0.00 H new ATOM 0 HG21 ILE A 510 6.379 -6.512 -6.025 1.00 0.00 H new ATOM 0 HG22 ILE A 510 6.805 -7.822 -4.898 1.00 0.00 H new ATOM 0 HG23 ILE A 510 5.214 -7.815 -5.695 1.00 0.00 H new ATOM 0 HD11 ILE A 510 3.786 -3.880 -5.948 1.00 0.00 H new ATOM 0 HD12 ILE A 510 5.453 -3.837 -5.328 1.00 0.00 H new ATOM 0 HD13 ILE A 510 4.988 -5.047 -6.547 1.00 0.00 H new ATOM 1142 N ASP A 511 6.661 -8.323 -1.716 1.00 0.00 N ATOM 1143 CA ASP A 511 7.600 -9.388 -1.303 1.00 0.00 C ATOM 1144 C ASP A 511 7.038 -10.447 -0.398 1.00 0.00 C ATOM 1145 O ASP A 511 7.721 -11.211 0.281 1.00 0.00 O ATOM 1146 CB ASP A 511 8.780 -8.729 -0.626 1.00 0.00 C ATOM 1147 CG ASP A 511 10.075 -9.558 -0.612 1.00 0.00 C ATOM 1148 OD1 ASP A 511 10.420 -10.155 -1.661 1.00 0.00 O ATOM 1149 OD2 ASP A 511 10.780 -9.575 0.427 1.00 0.00 O ATOM 0 H ASP A 511 6.803 -7.453 -1.202 1.00 0.00 H new ATOM 0 HA ASP A 511 7.870 -9.921 -2.214 1.00 0.00 H new ATOM 0 HB2 ASP A 511 8.980 -7.780 -1.124 1.00 0.00 H new ATOM 0 HB3 ASP A 511 8.505 -8.497 0.403 1.00 0.00 H new ATOM 1154 N TYR A 512 5.733 -10.447 -0.446 1.00 0.00 N ATOM 1155 CA TYR A 512 4.856 -11.087 0.459 1.00 0.00 C ATOM 1156 C TYR A 512 3.595 -11.521 -0.293 1.00 0.00 C ATOM 1157 O TYR A 512 2.977 -12.508 0.060 1.00 0.00 O ATOM 1158 CB TYR A 512 4.521 -10.038 1.508 1.00 0.00 C ATOM 1159 CG TYR A 512 5.199 -9.953 2.861 1.00 0.00 C ATOM 1160 CD1 TYR A 512 6.434 -9.287 2.951 1.00 0.00 C ATOM 1161 CD2 TYR A 512 4.539 -10.339 4.039 1.00 0.00 C ATOM 1162 CE1 TYR A 512 7.032 -9.021 4.193 1.00 0.00 C ATOM 1163 CE2 TYR A 512 5.157 -10.140 5.292 1.00 0.00 C ATOM 1164 CZ TYR A 512 6.404 -9.479 5.372 1.00 0.00 C ATOM 1165 OH TYR A 512 6.972 -9.248 6.587 1.00 0.00 O ATOM 0 H TYR A 512 5.229 -9.956 -1.184 1.00 0.00 H new ATOM 0 HA TYR A 512 5.294 -11.975 0.916 1.00 0.00 H new ATOM 0 HB2 TYR A 512 4.670 -9.070 1.030 1.00 0.00 H new ATOM 0 HB3 TYR A 512 3.454 -10.135 1.707 1.00 0.00 H new ATOM 0 HD1 TYR A 512 6.933 -8.974 2.046 1.00 0.00 H new ATOM 0 HD2 TYR A 512 3.558 -10.788 3.986 1.00 0.00 H new ATOM 0 HE1 TYR A 512 7.961 -8.473 4.246 1.00 0.00 H new ATOM 0 HE2 TYR A 512 4.676 -10.494 6.192 1.00 0.00 H new ATOM 0 HH TYR A 512 6.407 -9.630 7.290 1.00 0.00 H new ATOM 1175 N LYS A 513 3.212 -10.837 -1.374 1.00 0.00 N ATOM 1176 CA LYS A 513 2.054 -11.150 -2.202 1.00 0.00 C ATOM 1177 C LYS A 513 2.496 -11.946 -3.410 1.00 0.00 C ATOM 1178 O LYS A 513 1.931 -12.994 -3.708 1.00 0.00 O ATOM 1179 CB LYS A 513 1.416 -9.802 -2.522 1.00 0.00 C ATOM 1180 CG LYS A 513 0.361 -9.763 -3.620 1.00 0.00 C ATOM 1181 CD LYS A 513 0.986 -9.760 -5.017 1.00 0.00 C ATOM 1182 CE LYS A 513 -0.029 -9.398 -6.098 1.00 0.00 C ATOM 1183 NZ LYS A 513 -0.974 -10.505 -6.399 1.00 0.00 N ATOM 0 H LYS A 513 3.723 -10.019 -1.706 1.00 0.00 H new ATOM 0 HA LYS A 513 1.314 -11.784 -1.714 1.00 0.00 H new ATOM 0 HB2 LYS A 513 0.963 -9.419 -1.607 1.00 0.00 H new ATOM 0 HB3 LYS A 513 2.212 -9.110 -2.797 1.00 0.00 H new ATOM 0 HG2 LYS A 513 -0.298 -10.625 -3.520 1.00 0.00 H new ATOM 0 HG3 LYS A 513 -0.257 -8.873 -3.497 1.00 0.00 H new ATOM 0 HD2 LYS A 513 1.812 -9.049 -5.043 1.00 0.00 H new ATOM 0 HD3 LYS A 513 1.405 -10.744 -5.228 1.00 0.00 H new ATOM 0 HE2 LYS A 513 -0.594 -8.522 -5.780 1.00 0.00 H new ATOM 0 HE3 LYS A 513 0.501 -9.122 -7.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 -1.639 -10.202 -7.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 -0.442 -11.335 -6.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 -1.503 -10.753 -5.539 1.00 0.00 H new ATOM 1197 N GLU A 514 3.561 -11.476 -4.064 1.00 0.00 N ATOM 1198 CA GLU A 514 4.301 -12.222 -5.076 1.00 0.00 C ATOM 1199 C GLU A 514 4.984 -13.463 -4.445 1.00 0.00 C ATOM 1200 O GLU A 514 5.547 -14.294 -5.160 1.00 0.00 O ATOM 1201 CB GLU A 514 5.312 -11.240 -5.701 1.00 0.00 C ATOM 1202 CG GLU A 514 5.748 -11.641 -7.113 1.00 0.00 C ATOM 1203 CD GLU A 514 6.662 -10.579 -7.761 1.00 0.00 C ATOM 1204 OE1 GLU A 514 6.143 -9.662 -8.442 1.00 0.00 O ATOM 1205 OE2 GLU A 514 7.907 -10.672 -7.620 1.00 0.00 O ATOM 0 H GLU A 514 3.939 -10.543 -3.898 1.00 0.00 H new ATOM 0 HA GLU A 514 3.643 -12.611 -5.853 1.00 0.00 H new ATOM 0 HB2 GLU A 514 4.869 -10.244 -5.733 1.00 0.00 H new ATOM 0 HB3 GLU A 514 6.191 -11.177 -5.060 1.00 0.00 H new ATOM 0 HG2 GLU A 514 6.273 -12.595 -7.073 1.00 0.00 H new ATOM 0 HG3 GLU A 514 4.866 -11.789 -7.736 1.00 0.00 H new ATOM 1212 N ARG A 515 4.936 -13.587 -3.100 1.00 0.00 N ATOM 1213 CA ARG A 515 5.550 -14.691 -2.312 1.00 0.00 C ATOM 1214 C ARG A 515 4.533 -15.612 -1.655 1.00 0.00 C ATOM 1215 O ARG A 515 4.715 -16.825 -1.724 1.00 0.00 O ATOM 1216 CB ARG A 515 6.532 -14.179 -1.245 1.00 0.00 C ATOM 1217 CG ARG A 515 7.929 -13.802 -1.762 1.00 0.00 C ATOM 1218 CD ARG A 515 7.822 -12.806 -2.910 1.00 0.00 C ATOM 1219 NE ARG A 515 9.074 -12.094 -3.188 1.00 0.00 N ATOM 1220 CZ ARG A 515 9.441 -11.616 -4.359 1.00 0.00 C ATOM 1221 NH1 ARG A 515 8.926 -12.051 -5.471 1.00 0.00 N ATOM 1222 NH2 ARG A 515 10.317 -10.660 -4.405 1.00 0.00 N ATOM 0 H ARG A 515 4.457 -12.905 -2.512 1.00 0.00 H new ATOM 0 HA ARG A 515 6.099 -15.273 -3.052 1.00 0.00 H new ATOM 0 HB2 ARG A 515 6.094 -13.306 -0.762 1.00 0.00 H new ATOM 0 HB3 ARG A 515 6.642 -14.946 -0.478 1.00 0.00 H new ATOM 0 HG2 ARG A 515 8.519 -13.371 -0.953 1.00 0.00 H new ATOM 0 HG3 ARG A 515 8.453 -14.697 -2.097 1.00 0.00 H new ATOM 0 HD2 ARG A 515 7.506 -13.334 -3.810 1.00 0.00 H new ATOM 0 HD3 ARG A 515 7.044 -12.079 -2.678 1.00 0.00 H new ATOM 0 HE ARG A 515 9.716 -11.957 -2.407 1.00 0.00 H new ATOM 0 HH11 ARG A 515 8.216 -12.783 -5.452 1.00 0.00 H new ATOM 0 HH12 ARG A 515 9.232 -11.660 -6.362 1.00 0.00 H new ATOM 0 HH21 ARG A 515 10.712 -10.288 -3.541 1.00 0.00 H new ATOM 0 HH22 ARG A 515 10.611 -10.280 -5.305 1.00 0.00 H new ATOM 1236 N ASP A 516 3.506 -15.030 -1.029 1.00 0.00 N ATOM 1237 CA ASP A 516 2.284 -15.662 -0.476 1.00 0.00 C ATOM 1238 C ASP A 516 2.359 -15.808 1.063 1.00 0.00 C ATOM 1239 O ASP A 516 2.177 -16.866 1.671 1.00 0.00 O ATOM 1240 CB ASP A 516 1.876 -16.941 -1.222 1.00 0.00 C ATOM 1241 CG ASP A 516 0.445 -17.428 -0.927 1.00 0.00 C ATOM 1242 OD1 ASP A 516 -0.346 -16.710 -0.270 1.00 0.00 O ATOM 1243 OD2 ASP A 516 0.103 -18.554 -1.361 1.00 0.00 O ATOM 0 H ASP A 516 3.498 -14.021 -0.879 1.00 0.00 H new ATOM 0 HA ASP A 516 1.456 -14.978 -0.661 1.00 0.00 H new ATOM 0 HB2 ASP A 516 1.973 -16.767 -2.294 1.00 0.00 H new ATOM 0 HB3 ASP A 516 2.576 -17.735 -0.964 1.00 0.00 H new ATOM 1248 N LEU A 517 2.693 -14.671 1.662 1.00 0.00 N ATOM 1249 CA LEU A 517 2.959 -14.311 3.055 1.00 0.00 C ATOM 1250 C LEU A 517 1.757 -13.560 3.664 1.00 0.00 C ATOM 1251 O LEU A 517 1.557 -13.570 4.880 1.00 0.00 O ATOM 1252 CB LEU A 517 4.218 -13.418 3.000 1.00 0.00 C ATOM 1253 CG LEU A 517 5.486 -14.100 2.438 1.00 0.00 C ATOM 1254 CD1 LEU A 517 6.749 -13.342 2.849 1.00 0.00 C ATOM 1255 CD2 LEU A 517 5.694 -15.553 2.868 1.00 0.00 C ATOM 0 H LEU A 517 2.802 -13.840 1.081 1.00 0.00 H new ATOM 0 HA LEU A 517 3.115 -15.185 3.688 1.00 0.00 H new ATOM 0 HB2 LEU A 517 3.996 -12.542 2.391 1.00 0.00 H new ATOM 0 HB3 LEU A 517 4.434 -13.060 4.007 1.00 0.00 H new ATOM 0 HG LEU A 517 5.319 -14.085 1.361 1.00 0.00 H new ATOM 0 HD11 LEU A 517 7.625 -13.845 2.439 1.00 0.00 H new ATOM 0 HD12 LEU A 517 6.703 -12.323 2.465 1.00 0.00 H new ATOM 0 HD13 LEU A 517 6.821 -13.317 3.936 1.00 0.00 H new ATOM 0 HD21 LEU A 517 6.610 -15.938 2.420 1.00 0.00 H new ATOM 0 HD22 LEU A 517 5.772 -15.603 3.954 1.00 0.00 H new ATOM 0 HD23 LEU A 517 4.848 -16.155 2.537 1.00 0.00 H new ATOM 1267 N ILE A 518 0.941 -12.927 2.812 1.00 0.00 N ATOM 1268 CA ILE A 518 -0.376 -12.379 3.160 1.00 0.00 C ATOM 1269 C ILE A 518 -1.352 -13.530 3.470 1.00 0.00 C ATOM 1270 O ILE A 518 -1.226 -14.632 2.934 1.00 0.00 O ATOM 1271 CB ILE A 518 -0.980 -11.566 1.987 1.00 0.00 C ATOM 1272 CG1 ILE A 518 -0.009 -10.785 1.093 1.00 0.00 C ATOM 1273 CG2 ILE A 518 -2.066 -10.604 2.482 1.00 0.00 C ATOM 1274 CD1 ILE A 518 0.862 -9.769 1.821 1.00 0.00 C ATOM 0 H ILE A 518 1.186 -12.778 1.833 1.00 0.00 H new ATOM 0 HA ILE A 518 -0.238 -11.729 4.024 1.00 0.00 H new ATOM 0 HB ILE A 518 -1.384 -12.352 1.349 1.00 0.00 H new ATOM 0 HG12 ILE A 518 0.639 -11.495 0.580 1.00 0.00 H new ATOM 0 HG13 ILE A 518 -0.583 -10.265 0.326 1.00 0.00 H new ATOM 0 HG21 ILE A 518 -2.471 -10.047 1.637 1.00 0.00 H new ATOM 0 HG22 ILE A 518 -2.865 -11.172 2.959 1.00 0.00 H new ATOM 0 HG23 ILE A 518 -1.635 -9.908 3.202 1.00 0.00 H new ATOM 0 HD11 ILE A 518 1.514 -9.269 1.105 1.00 0.00 H new ATOM 0 HD12 ILE A 518 0.227 -9.031 2.311 1.00 0.00 H new ATOM 0 HD13 ILE A 518 1.469 -10.280 2.569 1.00 0.00 H new ATOM 1286 N ASP A 519 -2.371 -13.270 4.285 1.00 0.00 N ATOM 1287 CA ASP A 519 -3.509 -14.175 4.455 1.00 0.00 C ATOM 1288 C ASP A 519 -4.365 -14.193 3.174 1.00 0.00 C ATOM 1289 O ASP A 519 -4.651 -13.162 2.565 1.00 0.00 O ATOM 1290 CB ASP A 519 -4.346 -13.729 5.661 1.00 0.00 C ATOM 1291 CG ASP A 519 -3.544 -13.766 6.969 1.00 0.00 C ATOM 1292 OD1 ASP A 519 -3.508 -14.833 7.627 1.00 0.00 O ATOM 1293 OD2 ASP A 519 -2.943 -12.726 7.336 1.00 0.00 O ATOM 0 H ASP A 519 -2.433 -12.423 4.849 1.00 0.00 H new ATOM 0 HA ASP A 519 -3.144 -15.186 4.637 1.00 0.00 H new ATOM 0 HB2 ASP A 519 -4.714 -12.717 5.491 1.00 0.00 H new ATOM 0 HB3 ASP A 519 -5.219 -14.375 5.754 1.00 0.00 H new ATOM 1298 N ARG A 520 -4.815 -15.380 2.773 1.00 0.00 N ATOM 1299 CA ARG A 520 -5.619 -15.677 1.573 1.00 0.00 C ATOM 1300 C ARG A 520 -6.967 -14.945 1.516 1.00 0.00 C ATOM 1301 O ARG A 520 -7.521 -14.747 0.438 1.00 0.00 O ATOM 1302 CB ARG A 520 -5.782 -17.201 1.494 1.00 0.00 C ATOM 1303 CG ARG A 520 -4.676 -17.855 0.650 1.00 0.00 C ATOM 1304 CD ARG A 520 -3.223 -17.576 1.072 1.00 0.00 C ATOM 1305 NE ARG A 520 -2.876 -18.165 2.381 1.00 0.00 N ATOM 1306 CZ ARG A 520 -1.665 -18.195 2.912 1.00 0.00 C ATOM 1307 NH1 ARG A 520 -0.632 -17.697 2.302 1.00 0.00 N ATOM 1308 NH2 ARG A 520 -1.465 -18.742 4.078 1.00 0.00 N ATOM 0 H ARG A 520 -4.618 -16.224 3.311 1.00 0.00 H new ATOM 0 HA ARG A 520 -5.090 -15.298 0.699 1.00 0.00 H new ATOM 0 HB2 ARG A 520 -5.766 -17.620 2.500 1.00 0.00 H new ATOM 0 HB3 ARG A 520 -6.755 -17.440 1.065 1.00 0.00 H new ATOM 0 HG2 ARG A 520 -4.832 -18.934 0.663 1.00 0.00 H new ATOM 0 HG3 ARG A 520 -4.798 -17.528 -0.382 1.00 0.00 H new ATOM 0 HD2 ARG A 520 -2.548 -17.971 0.312 1.00 0.00 H new ATOM 0 HD3 ARG A 520 -3.063 -16.499 1.111 1.00 0.00 H new ATOM 0 HE ARG A 520 -3.634 -18.584 2.921 1.00 0.00 H new ATOM 0 HH11 ARG A 520 -0.741 -17.266 1.384 1.00 0.00 H new ATOM 0 HH12 ARG A 520 0.288 -17.737 2.741 1.00 0.00 H new ATOM 0 HH21 ARG A 520 -2.246 -19.152 4.590 1.00 0.00 H new ATOM 0 HH22 ARG A 520 -0.527 -18.760 4.479 1.00 0.00 H new ATOM 1322 N SER A 521 -7.443 -14.464 2.659 1.00 0.00 N ATOM 1323 CA SER A 521 -8.614 -13.581 2.817 1.00 0.00 C ATOM 1324 C SER A 521 -8.372 -12.113 2.410 1.00 0.00 C ATOM 1325 O SER A 521 -9.313 -11.315 2.397 1.00 0.00 O ATOM 1326 CB SER A 521 -9.083 -13.610 4.279 1.00 0.00 C ATOM 1327 OG SER A 521 -9.356 -14.943 4.692 1.00 0.00 O ATOM 0 H SER A 521 -7.006 -14.686 3.553 1.00 0.00 H new ATOM 0 HA SER A 521 -9.370 -13.973 2.136 1.00 0.00 H new ATOM 0 HB2 SER A 521 -8.317 -13.175 4.921 1.00 0.00 H new ATOM 0 HB3 SER A 521 -9.978 -12.998 4.391 1.00 0.00 H new ATOM 0 HG SER A 521 -9.652 -14.942 5.626 1.00 0.00 H new ATOM 1333 N ALA A 522 -7.133 -11.723 2.084 1.00 0.00 N ATOM 1334 CA ALA A 522 -6.765 -10.365 1.667 1.00 0.00 C ATOM 1335 C ALA A 522 -6.944 -10.221 0.163 1.00 0.00 C ATOM 1336 O ALA A 522 -7.317 -9.166 -0.341 1.00 0.00 O ATOM 1337 CB ALA A 522 -5.299 -10.101 1.994 1.00 0.00 C ATOM 0 H ALA A 522 -6.338 -12.361 2.104 1.00 0.00 H new ATOM 0 HA ALA A 522 -7.404 -9.657 2.195 1.00 0.00 H new ATOM 0 HB1 ALA A 522 -5.033 -9.091 1.682 1.00 0.00 H new ATOM 0 HB2 ALA A 522 -5.142 -10.202 3.068 1.00 0.00 H new ATOM 0 HB3 ALA A 522 -4.673 -10.821 1.466 1.00 0.00 H new ATOM 1343 N TYR A 523 -6.681 -11.308 -0.542 1.00 0.00 N ATOM 1344 CA TYR A 523 -6.897 -11.451 -1.965 1.00 0.00 C ATOM 1345 C TYR A 523 -8.395 -11.345 -2.363 1.00 0.00 C ATOM 1346 O TYR A 523 -8.687 -11.406 -3.580 1.00 0.00 O ATOM 1347 CB TYR A 523 -6.277 -12.813 -2.297 1.00 0.00 C ATOM 1348 CG TYR A 523 -4.767 -12.936 -2.131 1.00 0.00 C ATOM 1349 CD1 TYR A 523 -4.223 -13.290 -0.880 1.00 0.00 C ATOM 1350 CD2 TYR A 523 -3.907 -12.776 -3.235 1.00 0.00 C ATOM 1351 CE1 TYR A 523 -2.847 -13.535 -0.735 1.00 0.00 C ATOM 1352 CE2 TYR A 523 -2.517 -12.976 -3.088 1.00 0.00 C ATOM 1353 CZ TYR A 523 -1.982 -13.360 -1.837 1.00 0.00 C ATOM 1354 OH TYR A 523 -0.644 -13.560 -1.694 1.00 0.00 O ATOM 1355 OXT TYR A 523 -9.273 -11.173 -1.478 1.00 0.00 O ATOM 0 H TYR A 523 -6.294 -12.150 -0.116 1.00 0.00 H new ATOM 0 HA TYR A 523 -6.438 -10.644 -2.537 1.00 0.00 H new ATOM 0 HB2 TYR A 523 -6.751 -13.565 -1.667 1.00 0.00 H new ATOM 0 HB3 TYR A 523 -6.527 -13.058 -3.329 1.00 0.00 H new ATOM 0 HD1 TYR A 523 -4.872 -13.374 -0.021 1.00 0.00 H new ATOM 0 HD2 TYR A 523 -4.312 -12.499 -4.197 1.00 0.00 H new ATOM 0 HE1 TYR A 523 -2.452 -13.856 0.217 1.00 0.00 H new ATOM 0 HE2 TYR A 523 -1.860 -12.835 -3.934 1.00 0.00 H new ATOM 0 HH TYR A 523 -0.196 -13.398 -2.550 1.00 0.00 H new