USER MOD reduce.3.24.130724 H: found=0, std=0, add=669, rem=0, adj=18 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= -0.23 USER MOD Set 1.2: A 513 LYS NZ :NH3+ -150:sc= 0.00273 (180deg=0) USER MOD Set 2.1: A 475 THR OG1 : rot 140:sc= 0.819 USER MOD Set 2.2: A 491 LYS NZ :NH3+ 167:sc= 0.94 (180deg=0) USER MOD Set 3.1: A 461 LYS NZ :NH3+ -125:sc= 0.413 (180deg=0) USER MOD Set 3.2: A 466 HIS : no HD1:sc= 0.0469 K(o=0.46,f=-0.95) USER MOD Set 4.1: A 455 ASN : amide:sc= -0.395 K(o=-2,f=-2.5) USER MOD Set 4.2: A 458 MET CE :methyl -166:sc= -1.58 (180deg=-2.72!) USER MOD Single : A 448 THR OG1 : rot 180:sc= 0 USER MOD Single : A 451 LYS NZ :NH3+ 178:sc= 2.16 (180deg=2.16) USER MOD Single : A 454 LYS NZ :NH3+ 165:sc= 0.785 (180deg=0.688) USER MOD Single : A 462 SER OG : rot -71:sc= 1.3 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= 0.0337 USER MOD Single : A 473 SER OG : rot 180:sc= -0.0658 USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 LYS NZ :NH3+ 175:sc= 1.07 (180deg=1.05) 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 -170:sc= 0.00584 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 447 0.657 -3.935 7.390 1.00 0.00 N ATOM 66 CA LEU A 447 1.065 -3.705 6.006 1.00 0.00 C ATOM 67 C LEU A 447 0.787 -4.898 5.070 1.00 0.00 C ATOM 68 O LEU A 447 0.827 -4.750 3.850 1.00 0.00 O ATOM 69 CB LEU A 447 2.561 -3.344 6.049 1.00 0.00 C ATOM 70 CG LEU A 447 3.125 -2.690 4.778 1.00 0.00 C ATOM 71 CD1 LEU A 447 2.671 -1.244 4.629 1.00 0.00 C ATOM 72 CD2 LEU A 447 4.649 -2.665 4.857 1.00 0.00 C ATOM 0 HA LEU A 447 0.471 -2.897 5.579 1.00 0.00 H new ATOM 0 HB2 LEU A 447 2.729 -2.669 6.888 1.00 0.00 H new ATOM 0 HB3 LEU A 447 3.129 -4.252 6.251 1.00 0.00 H new ATOM 0 HG LEU A 447 2.764 -3.275 3.932 1.00 0.00 H new ATOM 0 HD11 LEU A 447 3.094 -0.822 3.717 1.00 0.00 H new ATOM 0 HD12 LEU A 447 1.583 -1.208 4.575 1.00 0.00 H new ATOM 0 HD13 LEU A 447 3.011 -0.666 5.488 1.00 0.00 H new ATOM 0 HD21 LEU A 447 5.052 -2.202 3.957 1.00 0.00 H new ATOM 0 HD22 LEU A 447 4.959 -2.091 5.730 1.00 0.00 H new ATOM 0 HD23 LEU A 447 5.026 -3.684 4.940 1.00 0.00 H new ATOM 84 N THR A 448 0.485 -6.067 5.630 1.00 0.00 N ATOM 85 CA THR A 448 0.274 -7.348 4.943 1.00 0.00 C ATOM 86 C THR A 448 -0.990 -8.072 5.458 1.00 0.00 C ATOM 87 O THR A 448 -1.103 -9.295 5.356 1.00 0.00 O ATOM 88 CB THR A 448 1.552 -8.207 5.038 1.00 0.00 C ATOM 89 OG1 THR A 448 1.921 -8.437 6.380 1.00 0.00 O ATOM 90 CG2 THR A 448 2.757 -7.513 4.378 1.00 0.00 C ATOM 0 H THR A 448 0.373 -6.155 6.640 1.00 0.00 H new ATOM 0 HA THR A 448 0.085 -7.160 3.886 1.00 0.00 H new ATOM 0 HB THR A 448 1.313 -9.141 4.529 1.00 0.00 H new ATOM 0 HG1 THR A 448 2.733 -8.985 6.407 1.00 0.00 H new ATOM 0 HG21 THR A 448 3.637 -8.150 4.466 1.00 0.00 H new ATOM 0 HG22 THR A 448 2.542 -7.335 3.324 1.00 0.00 H new ATOM 0 HG23 THR A 448 2.946 -6.562 4.875 1.00 0.00 H new ATOM 98 N ASP A 449 -1.970 -7.325 5.993 1.00 0.00 N ATOM 99 CA ASP A 449 -3.166 -7.830 6.683 1.00 0.00 C ATOM 100 C ASP A 449 -4.483 -7.430 5.978 1.00 0.00 C ATOM 101 O ASP A 449 -4.739 -6.236 5.815 1.00 0.00 O ATOM 102 CB ASP A 449 -3.186 -7.279 8.112 1.00 0.00 C ATOM 103 CG ASP A 449 -2.225 -8.010 9.058 1.00 0.00 C ATOM 104 OD1 ASP A 449 -0.992 -7.943 8.854 1.00 0.00 O ATOM 105 OD2 ASP A 449 -2.725 -8.649 10.014 1.00 0.00 O ATOM 0 H ASP A 449 -1.948 -6.306 5.954 1.00 0.00 H new ATOM 0 HA ASP A 449 -3.108 -8.918 6.674 1.00 0.00 H new ATOM 0 HB2 ASP A 449 -2.927 -6.220 8.089 1.00 0.00 H new ATOM 0 HB3 ASP A 449 -4.199 -7.351 8.508 1.00 0.00 H new ATOM 110 N PRO A 450 -5.384 -8.378 5.637 1.00 0.00 N ATOM 111 CA PRO A 450 -6.656 -8.147 4.932 1.00 0.00 C ATOM 112 C PRO A 450 -7.473 -6.975 5.490 1.00 0.00 C ATOM 113 O PRO A 450 -7.975 -6.127 4.753 1.00 0.00 O ATOM 114 CB PRO A 450 -7.456 -9.453 5.069 1.00 0.00 C ATOM 115 CG PRO A 450 -6.421 -10.524 5.389 1.00 0.00 C ATOM 116 CD PRO A 450 -5.237 -9.776 5.976 1.00 0.00 C ATOM 0 HA PRO A 450 -6.446 -7.878 3.897 1.00 0.00 H new ATOM 0 HB2 PRO A 450 -8.201 -9.377 5.861 1.00 0.00 H new ATOM 0 HB3 PRO A 450 -7.991 -9.685 4.148 1.00 0.00 H new ATOM 0 HG2 PRO A 450 -6.816 -11.253 6.097 1.00 0.00 H new ATOM 0 HG3 PRO A 450 -6.134 -11.073 4.492 1.00 0.00 H new ATOM 0 HD2 PRO A 450 -5.202 -9.905 7.058 1.00 0.00 H new ATOM 0 HD3 PRO A 450 -4.302 -10.169 5.578 1.00 0.00 H new ATOM 124 N LYS A 451 -7.554 -6.931 6.823 1.00 0.00 N ATOM 125 CA LYS A 451 -8.264 -5.947 7.649 1.00 0.00 C ATOM 126 C LYS A 451 -7.777 -4.499 7.448 1.00 0.00 C ATOM 127 O LYS A 451 -8.559 -3.564 7.602 1.00 0.00 O ATOM 128 CB LYS A 451 -8.219 -6.438 9.115 1.00 0.00 C ATOM 129 CG LYS A 451 -6.802 -6.535 9.718 1.00 0.00 C ATOM 130 CD LYS A 451 -6.428 -7.851 10.430 1.00 0.00 C ATOM 131 CE LYS A 451 -6.109 -8.985 9.440 1.00 0.00 C ATOM 132 NZ LYS A 451 -5.167 -9.992 10.005 1.00 0.00 N ATOM 0 H LYS A 451 -7.090 -7.635 7.397 1.00 0.00 H new ATOM 0 HA LYS A 451 -9.304 -5.887 7.329 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -8.815 -5.763 9.729 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -8.691 -7.419 9.170 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -6.082 -6.368 8.917 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -6.681 -5.719 10.431 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -5.564 -7.680 11.073 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -7.251 -8.158 11.076 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -7.035 -9.482 9.152 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -5.679 -8.560 8.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -5.012 -10.751 9.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -4.260 -9.534 10.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -5.571 -10.395 10.874 1.00 0.00 H new ATOM 146 N LEU A 452 -6.519 -4.301 7.037 1.00 0.00 N ATOM 147 CA LEU A 452 -5.941 -3.019 6.608 1.00 0.00 C ATOM 148 C LEU A 452 -6.016 -2.855 5.084 1.00 0.00 C ATOM 149 O LEU A 452 -6.419 -1.800 4.594 1.00 0.00 O ATOM 150 CB LEU A 452 -4.456 -2.943 7.018 1.00 0.00 C ATOM 151 CG LEU A 452 -4.082 -2.795 8.502 1.00 0.00 C ATOM 152 CD1 LEU A 452 -4.327 -1.377 8.981 1.00 0.00 C ATOM 153 CD2 LEU A 452 -4.722 -3.781 9.468 1.00 0.00 C ATOM 0 H LEU A 452 -5.844 -5.064 6.992 1.00 0.00 H new ATOM 0 HA LEU A 452 -6.516 -2.228 7.089 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -3.969 -3.845 6.648 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -4.014 -2.101 6.485 1.00 0.00 H new ATOM 0 HG LEU A 452 -3.020 -3.040 8.521 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -4.055 -1.296 10.034 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -3.721 -0.685 8.396 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -5.381 -1.129 8.858 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -4.379 -3.572 10.481 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -5.807 -3.681 9.424 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -4.440 -4.797 9.191 1.00 0.00 H new ATOM 165 N LEU A 453 -5.642 -3.902 4.340 1.00 0.00 N ATOM 166 CA LEU A 453 -5.413 -3.919 2.888 1.00 0.00 C ATOM 167 C LEU A 453 -6.658 -3.551 2.063 1.00 0.00 C ATOM 168 O LEU A 453 -6.561 -3.202 0.886 1.00 0.00 O ATOM 169 CB LEU A 453 -4.904 -5.329 2.520 1.00 0.00 C ATOM 170 CG LEU A 453 -3.449 -5.635 2.948 1.00 0.00 C ATOM 171 CD1 LEU A 453 -3.105 -7.098 2.680 1.00 0.00 C ATOM 172 CD2 LEU A 453 -2.369 -4.808 2.266 1.00 0.00 C ATOM 0 H LEU A 453 -5.481 -4.817 4.760 1.00 0.00 H new ATOM 0 HA LEU A 453 -4.678 -3.153 2.642 1.00 0.00 H new ATOM 0 HB2 LEU A 453 -5.563 -6.067 2.977 1.00 0.00 H new ATOM 0 HB3 LEU A 453 -4.983 -5.456 1.440 1.00 0.00 H new ATOM 0 HG LEU A 453 -3.443 -5.380 4.008 1.00 0.00 H new ATOM 0 HD11 LEU A 453 -2.078 -7.292 2.988 1.00 0.00 H new ATOM 0 HD12 LEU A 453 -3.781 -7.740 3.245 1.00 0.00 H new ATOM 0 HD13 LEU A 453 -3.211 -7.307 1.616 1.00 0.00 H new ATOM 0 HD21 LEU A 453 -1.390 -5.107 2.642 1.00 0.00 H new ATOM 0 HD22 LEU A 453 -2.410 -4.973 1.189 1.00 0.00 H new ATOM 0 HD23 LEU A 453 -2.532 -3.751 2.478 1.00 0.00 H new ATOM 184 N LYS A 454 -7.830 -3.603 2.698 1.00 0.00 N ATOM 185 CA LYS A 454 -9.151 -3.364 2.117 1.00 0.00 C ATOM 186 C LYS A 454 -9.808 -2.099 2.669 1.00 0.00 C ATOM 187 O LYS A 454 -10.850 -1.680 2.166 1.00 0.00 O ATOM 188 CB LYS A 454 -9.991 -4.621 2.357 1.00 0.00 C ATOM 189 CG LYS A 454 -9.333 -5.780 1.625 1.00 0.00 C ATOM 190 CD LYS A 454 -10.162 -7.038 1.801 1.00 0.00 C ATOM 191 CE LYS A 454 -9.394 -8.050 0.991 1.00 0.00 C ATOM 192 NZ LYS A 454 -10.207 -9.195 0.495 1.00 0.00 N ATOM 0 H LYS A 454 -7.885 -3.827 3.692 1.00 0.00 H new ATOM 0 HA LYS A 454 -9.063 -3.180 1.046 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -10.059 -4.835 3.424 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -11.009 -4.472 1.996 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -9.235 -5.544 0.565 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -8.326 -5.940 2.010 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -10.239 -7.330 2.848 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -11.179 -6.909 1.431 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -8.943 -7.545 0.137 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.577 -8.438 1.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -9.681 -9.698 -0.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -10.405 -9.847 1.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -11.104 -8.841 0.105 1.00 0.00 H new ATOM 206 N ASN A 455 -9.192 -1.478 3.683 1.00 0.00 N ATOM 207 CA ASN A 455 -9.541 -0.143 4.135 1.00 0.00 C ATOM 208 C ASN A 455 -8.932 0.877 3.168 1.00 0.00 C ATOM 209 O ASN A 455 -9.666 1.544 2.443 1.00 0.00 O ATOM 210 CB ASN A 455 -9.085 0.105 5.583 1.00 0.00 C ATOM 211 CG ASN A 455 -10.222 -0.145 6.555 1.00 0.00 C ATOM 212 OD1 ASN A 455 -11.229 0.547 6.553 1.00 0.00 O ATOM 213 ND2 ASN A 455 -10.107 -1.107 7.427 1.00 0.00 N ATOM 0 H ASN A 455 -8.430 -1.901 4.213 1.00 0.00 H new ATOM 0 HA ASN A 455 -10.626 -0.036 4.136 1.00 0.00 H new ATOM 0 HB2 ASN A 455 -8.246 -0.548 5.822 1.00 0.00 H new ATOM 0 HB3 ASN A 455 -8.730 1.130 5.687 1.00 0.00 H new ATOM 0 HD21 ASN A 455 -10.854 -1.277 8.100 1.00 0.00 H new ATOM 0 HD22 ASN A 455 -9.270 -1.690 7.436 1.00 0.00 H new ATOM 220 N ILE A 456 -7.593 0.968 3.213 1.00 0.00 N ATOM 221 CA ILE A 456 -6.652 1.944 2.630 1.00 0.00 C ATOM 222 C ILE A 456 -6.219 3.015 3.660 1.00 0.00 C ATOM 223 O ILE A 456 -5.016 3.074 3.914 1.00 0.00 O ATOM 224 CB ILE A 456 -7.064 2.505 1.243 1.00 0.00 C ATOM 225 CG1 ILE A 456 -7.220 1.422 0.145 1.00 0.00 C ATOM 226 CG2 ILE A 456 -6.067 3.565 0.749 1.00 0.00 C ATOM 227 CD1 ILE A 456 -6.050 0.437 -0.005 1.00 0.00 C ATOM 0 H ILE A 456 -7.072 0.260 3.731 1.00 0.00 H new ATOM 0 HA ILE A 456 -5.752 1.378 2.389 1.00 0.00 H new ATOM 0 HB ILE A 456 -8.045 2.951 1.407 1.00 0.00 H new ATOM 0 HG12 ILE A 456 -8.125 0.851 0.353 1.00 0.00 H new ATOM 0 HG13 ILE A 456 -7.372 1.923 -0.811 1.00 0.00 H new ATOM 0 HG21 ILE A 456 -6.385 3.937 -0.225 1.00 0.00 H new ATOM 0 HG22 ILE A 456 -6.032 4.391 1.460 1.00 0.00 H new ATOM 0 HG23 ILE A 456 -5.076 3.120 0.661 1.00 0.00 H new ATOM 0 HD11 ILE A 456 -6.272 -0.273 -0.802 1.00 0.00 H new ATOM 0 HD12 ILE A 456 -5.141 0.986 -0.251 1.00 0.00 H new ATOM 0 HD13 ILE A 456 -5.906 -0.102 0.931 1.00 0.00 H new ATOM 239 N PRO A 457 -7.094 3.816 4.321 1.00 0.00 N ATOM 240 CA PRO A 457 -6.668 4.846 5.279 1.00 0.00 C ATOM 241 C PRO A 457 -5.804 4.290 6.416 1.00 0.00 C ATOM 242 O PRO A 457 -4.723 4.809 6.687 1.00 0.00 O ATOM 243 CB PRO A 457 -7.947 5.495 5.833 1.00 0.00 C ATOM 244 CG PRO A 457 -9.023 5.146 4.812 1.00 0.00 C ATOM 245 CD PRO A 457 -8.547 3.811 4.255 1.00 0.00 C ATOM 0 HA PRO A 457 -6.036 5.573 4.769 1.00 0.00 H new ATOM 0 HB2 PRO A 457 -8.195 5.105 6.820 1.00 0.00 H new ATOM 0 HB3 PRO A 457 -7.832 6.574 5.936 1.00 0.00 H new ATOM 0 HG2 PRO A 457 -10.006 5.063 5.275 1.00 0.00 H new ATOM 0 HG3 PRO A 457 -9.101 5.904 4.032 1.00 0.00 H new ATOM 0 HD2 PRO A 457 -8.956 2.983 4.834 1.00 0.00 H new ATOM 0 HD3 PRO A 457 -8.886 3.679 3.227 1.00 0.00 H new ATOM 253 N MET A 458 -6.253 3.207 7.067 1.00 0.00 N ATOM 254 CA MET A 458 -5.502 2.581 8.162 1.00 0.00 C ATOM 255 C MET A 458 -4.290 1.780 7.670 1.00 0.00 C ATOM 256 O MET A 458 -3.306 1.668 8.398 1.00 0.00 O ATOM 257 CB MET A 458 -6.439 1.784 9.081 1.00 0.00 C ATOM 258 CG MET A 458 -7.502 0.907 8.447 1.00 0.00 C ATOM 259 SD MET A 458 -8.562 0.205 9.738 1.00 0.00 S ATOM 260 CE MET A 458 -7.700 -1.363 9.916 1.00 0.00 C ATOM 0 H MET A 458 -7.137 2.746 6.852 1.00 0.00 H new ATOM 0 HA MET A 458 -5.072 3.378 8.769 1.00 0.00 H new ATOM 0 HB2 MET A 458 -5.820 1.149 9.715 1.00 0.00 H new ATOM 0 HB3 MET A 458 -6.943 2.494 9.737 1.00 0.00 H new ATOM 0 HG2 MET A 458 -8.101 1.492 7.749 1.00 0.00 H new ATOM 0 HG3 MET A 458 -7.033 0.108 7.873 1.00 0.00 H new ATOM 0 HE1 MET A 458 -8.321 -2.058 10.481 1.00 0.00 H new ATOM 0 HE2 MET A 458 -7.495 -1.779 8.930 1.00 0.00 H new ATOM 0 HE3 MET A 458 -6.761 -1.204 10.445 1.00 0.00 H new ATOM 270 N TRP A 459 -4.280 1.309 6.416 1.00 0.00 N ATOM 271 CA TRP A 459 -3.079 0.714 5.821 1.00 0.00 C ATOM 272 C TRP A 459 -1.963 1.755 5.633 1.00 0.00 C ATOM 273 O TRP A 459 -0.862 1.599 6.161 1.00 0.00 O ATOM 274 CB TRP A 459 -3.416 -0.023 4.529 1.00 0.00 C ATOM 275 CG TRP A 459 -2.271 -0.785 3.939 1.00 0.00 C ATOM 276 CD1 TRP A 459 -1.902 -2.035 4.303 1.00 0.00 C ATOM 277 CD2 TRP A 459 -1.307 -0.363 2.920 1.00 0.00 C ATOM 278 NE1 TRP A 459 -0.806 -2.418 3.560 1.00 0.00 N ATOM 279 CE2 TRP A 459 -0.421 -1.452 2.673 1.00 0.00 C ATOM 280 CE3 TRP A 459 -1.068 0.825 2.189 1.00 0.00 C ATOM 281 CZ2 TRP A 459 0.608 -1.409 1.728 1.00 0.00 C ATOM 282 CZ3 TRP A 459 -0.004 0.898 1.266 1.00 0.00 C ATOM 283 CH2 TRP A 459 0.804 -0.221 1.017 1.00 0.00 C ATOM 0 H TRP A 459 -5.090 1.329 5.796 1.00 0.00 H new ATOM 0 HA TRP A 459 -2.690 -0.028 6.519 1.00 0.00 H new ATOM 0 HB2 TRP A 459 -4.236 -0.714 4.722 1.00 0.00 H new ATOM 0 HB3 TRP A 459 -3.774 0.699 3.795 1.00 0.00 H new ATOM 0 HD1 TRP A 459 -2.389 -2.637 5.056 1.00 0.00 H new ATOM 0 HE1 TRP A 459 -0.337 -3.318 3.660 1.00 0.00 H new ATOM 0 HE3 TRP A 459 -1.706 1.683 2.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 459 1.235 -2.270 1.552 1.00 0.00 H new ATOM 0 HZ3 TRP A 459 0.190 1.824 0.746 1.00 0.00 H new ATOM 0 HH2 TRP A 459 1.583 -0.165 0.271 1.00 0.00 H new ATOM 294 N LEU A 460 -2.285 2.875 4.978 1.00 0.00 N ATOM 295 CA LEU A 460 -1.454 4.084 4.869 1.00 0.00 C ATOM 296 C LEU A 460 -1.054 4.673 6.237 1.00 0.00 C ATOM 297 O LEU A 460 -0.068 5.407 6.325 1.00 0.00 O ATOM 298 CB LEU A 460 -2.248 5.142 4.079 1.00 0.00 C ATOM 299 CG LEU A 460 -2.591 4.836 2.615 1.00 0.00 C ATOM 300 CD1 LEU A 460 -3.686 5.802 2.149 1.00 0.00 C ATOM 301 CD2 LEU A 460 -1.394 5.066 1.703 1.00 0.00 C ATOM 0 H LEU A 460 -3.173 2.970 4.485 1.00 0.00 H new ATOM 0 HA LEU A 460 -0.529 3.806 4.364 1.00 0.00 H new ATOM 0 HB2 LEU A 460 -3.182 5.325 4.610 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.681 6.072 4.102 1.00 0.00 H new ATOM 0 HG LEU A 460 -2.905 3.794 2.561 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -3.937 5.593 1.109 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -4.573 5.673 2.770 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -3.328 6.828 2.236 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -1.672 4.840 0.674 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -1.078 6.107 1.773 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.574 4.416 2.008 1.00 0.00 H new ATOM 313 N LYS A 461 -1.792 4.379 7.316 1.00 0.00 N ATOM 314 CA LYS A 461 -1.464 4.806 8.686 1.00 0.00 C ATOM 315 C LYS A 461 -0.275 4.103 9.292 1.00 0.00 C ATOM 316 O LYS A 461 0.472 4.729 10.043 1.00 0.00 O ATOM 317 CB LYS A 461 -2.714 4.694 9.560 1.00 0.00 C ATOM 318 CG LYS A 461 -2.497 5.369 10.910 1.00 0.00 C ATOM 319 CD LYS A 461 -3.784 5.453 11.715 1.00 0.00 C ATOM 320 CE LYS A 461 -4.624 6.629 11.197 1.00 0.00 C ATOM 321 NZ LYS A 461 -4.509 7.831 12.066 1.00 0.00 N ATOM 0 H LYS A 461 -2.649 3.828 7.262 1.00 0.00 H new ATOM 0 HA LYS A 461 -1.148 5.848 8.633 1.00 0.00 H new ATOM 0 HB2 LYS A 461 -3.561 5.154 9.051 1.00 0.00 H new ATOM 0 HB3 LYS A 461 -2.965 3.644 9.710 1.00 0.00 H new ATOM 0 HG2 LYS A 461 -1.750 4.814 11.477 1.00 0.00 H new ATOM 0 HG3 LYS A 461 -2.100 6.372 10.755 1.00 0.00 H new ATOM 0 HD2 LYS A 461 -4.345 4.522 11.626 1.00 0.00 H new ATOM 0 HD3 LYS A 461 -3.558 5.589 12.773 1.00 0.00 H new ATOM 0 HE2 LYS A 461 -4.305 6.883 10.186 1.00 0.00 H new ATOM 0 HE3 LYS A 461 -5.669 6.327 11.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 461 -5.458 8.136 12.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 461 -3.940 7.600 12.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 461 -4.049 8.599 11.537 1.00 0.00 H new ATOM 335 N SER A 462 -0.012 2.874 8.875 1.00 0.00 N ATOM 336 CA SER A 462 1.238 2.213 9.241 1.00 0.00 C ATOM 337 C SER A 462 2.478 2.968 8.711 1.00 0.00 C ATOM 338 O SER A 462 3.542 2.936 9.332 1.00 0.00 O ATOM 339 CB SER A 462 1.215 0.760 8.769 1.00 0.00 C ATOM 340 OG SER A 462 1.388 0.655 7.368 1.00 0.00 O ATOM 0 H SER A 462 -0.636 2.318 8.291 1.00 0.00 H new ATOM 0 HA SER A 462 1.321 2.225 10.328 1.00 0.00 H new ATOM 0 HB2 SER A 462 2.003 0.202 9.274 1.00 0.00 H new ATOM 0 HB3 SER A 462 0.268 0.302 9.053 1.00 0.00 H new ATOM 0 HG SER A 462 0.580 0.974 6.914 1.00 0.00 H new ATOM 346 N LEU A 463 2.320 3.738 7.619 1.00 0.00 N ATOM 347 CA LEU A 463 3.324 4.625 7.012 1.00 0.00 C ATOM 348 C LEU A 463 3.389 6.016 7.675 1.00 0.00 C ATOM 349 O LEU A 463 4.254 6.820 7.328 1.00 0.00 O ATOM 350 CB LEU A 463 3.031 4.842 5.508 1.00 0.00 C ATOM 351 CG LEU A 463 2.381 3.678 4.754 1.00 0.00 C ATOM 352 CD1 LEU A 463 2.135 4.039 3.296 1.00 0.00 C ATOM 353 CD2 LEU A 463 3.262 2.427 4.764 1.00 0.00 C ATOM 0 H LEU A 463 1.437 3.758 7.109 1.00 0.00 H new ATOM 0 HA LEU A 463 4.278 4.120 7.161 1.00 0.00 H new ATOM 0 HB2 LEU A 463 2.383 5.713 5.411 1.00 0.00 H new ATOM 0 HB3 LEU A 463 3.970 5.086 5.011 1.00 0.00 H new ATOM 0 HG LEU A 463 1.441 3.477 5.268 1.00 0.00 H new ATOM 0 HD11 LEU A 463 1.673 3.194 2.785 1.00 0.00 H new ATOM 0 HD12 LEU A 463 1.472 4.903 3.242 1.00 0.00 H new ATOM 0 HD13 LEU A 463 3.084 4.279 2.816 1.00 0.00 H new ATOM 0 HD21 LEU A 463 2.763 1.626 4.218 1.00 0.00 H new ATOM 0 HD22 LEU A 463 4.217 2.650 4.288 1.00 0.00 H new ATOM 0 HD23 LEU A 463 3.435 2.112 5.793 1.00 0.00 H new ATOM 365 N ARG A 464 2.438 6.323 8.576 1.00 0.00 N ATOM 366 CA ARG A 464 2.147 7.650 9.151 1.00 0.00 C ATOM 367 C ARG A 464 1.716 8.694 8.095 1.00 0.00 C ATOM 368 O ARG A 464 1.651 9.885 8.391 1.00 0.00 O ATOM 369 CB ARG A 464 3.274 8.108 10.106 1.00 0.00 C ATOM 370 CG ARG A 464 3.418 7.229 11.368 1.00 0.00 C ATOM 371 CD ARG A 464 4.194 5.912 11.200 1.00 0.00 C ATOM 372 NE ARG A 464 5.601 6.144 10.822 1.00 0.00 N ATOM 373 CZ ARG A 464 6.440 5.293 10.257 1.00 0.00 C ATOM 374 NH1 ARG A 464 6.085 4.102 9.864 1.00 0.00 N ATOM 375 NH2 ARG A 464 7.686 5.630 10.077 1.00 0.00 N ATOM 0 H ARG A 464 1.813 5.607 8.945 1.00 0.00 H new ATOM 0 HA ARG A 464 1.259 7.552 9.776 1.00 0.00 H new ATOM 0 HB2 ARG A 464 4.220 8.107 9.564 1.00 0.00 H new ATOM 0 HB3 ARG A 464 3.083 9.137 10.411 1.00 0.00 H new ATOM 0 HG2 ARG A 464 3.910 7.819 12.141 1.00 0.00 H new ATOM 0 HG3 ARG A 464 2.419 6.992 11.735 1.00 0.00 H new ATOM 0 HD2 ARG A 464 4.157 5.348 12.132 1.00 0.00 H new ATOM 0 HD3 ARG A 464 3.710 5.301 10.438 1.00 0.00 H new ATOM 0 HE ARG A 464 5.971 7.073 11.021 1.00 0.00 H new ATOM 0 HH11 ARG A 464 5.122 3.790 9.987 1.00 0.00 H new ATOM 0 HH12 ARG A 464 6.770 3.482 9.433 1.00 0.00 H new ATOM 0 HH21 ARG A 464 8.013 6.550 10.372 1.00 0.00 H new ATOM 0 HH22 ARG A 464 8.334 4.974 9.641 1.00 0.00 H new ATOM 389 N LEU A 465 1.355 8.237 6.886 1.00 0.00 N ATOM 390 CA LEU A 465 0.720 9.026 5.821 1.00 0.00 C ATOM 391 C LEU A 465 -0.788 9.164 6.070 1.00 0.00 C ATOM 392 O LEU A 465 -1.254 10.253 6.389 1.00 0.00 O ATOM 393 CB LEU A 465 0.997 8.385 4.443 1.00 0.00 C ATOM 394 CG LEU A 465 2.417 8.687 3.934 1.00 0.00 C ATOM 395 CD1 LEU A 465 2.819 7.663 2.878 1.00 0.00 C ATOM 396 CD2 LEU A 465 2.503 10.064 3.280 1.00 0.00 C ATOM 0 H LEU A 465 1.504 7.266 6.613 1.00 0.00 H new ATOM 0 HA LEU A 465 1.151 10.027 5.827 1.00 0.00 H new ATOM 0 HB2 LEU A 465 0.860 7.306 4.513 1.00 0.00 H new ATOM 0 HB3 LEU A 465 0.268 8.753 3.720 1.00 0.00 H new ATOM 0 HG LEU A 465 3.078 8.650 4.800 1.00 0.00 H new ATOM 0 HD11 LEU A 465 3.825 7.883 2.522 1.00 0.00 H new ATOM 0 HD12 LEU A 465 2.799 6.664 3.314 1.00 0.00 H new ATOM 0 HD13 LEU A 465 2.121 7.709 2.042 1.00 0.00 H new ATOM 0 HD21 LEU A 465 3.522 10.239 2.934 1.00 0.00 H new ATOM 0 HD22 LEU A 465 1.819 10.108 2.432 1.00 0.00 H new ATOM 0 HD23 LEU A 465 2.230 10.829 4.006 1.00 0.00 H new ATOM 408 N HIS A 466 -1.539 8.063 5.911 1.00 0.00 N ATOM 409 CA HIS A 466 -3.005 7.972 6.127 1.00 0.00 C ATOM 410 C HIS A 466 -3.905 9.095 5.565 1.00 0.00 C ATOM 411 O HIS A 466 -5.008 9.308 6.075 1.00 0.00 O ATOM 412 CB HIS A 466 -3.265 7.622 7.595 1.00 0.00 C ATOM 413 CG HIS A 466 -2.891 8.629 8.646 1.00 0.00 C ATOM 414 ND1 HIS A 466 -1.748 8.595 9.409 1.00 0.00 N ATOM 415 CD2 HIS A 466 -3.727 9.561 9.191 1.00 0.00 C ATOM 416 CE1 HIS A 466 -1.896 9.470 10.413 1.00 0.00 C ATOM 417 NE2 HIS A 466 -3.090 10.084 10.325 1.00 0.00 N ATOM 0 H HIS A 466 -1.134 7.174 5.618 1.00 0.00 H new ATOM 0 HA HIS A 466 -3.344 7.164 5.478 1.00 0.00 H new ATOM 0 HB2 HIS A 466 -4.329 7.409 7.702 1.00 0.00 H new ATOM 0 HB3 HIS A 466 -2.731 6.698 7.816 1.00 0.00 H new ATOM 0 HD2 HIS A 466 -4.700 9.843 8.817 1.00 0.00 H new ATOM 0 HE1 HIS A 466 -1.162 9.656 11.183 1.00 0.00 H new ATOM 0 HE2 HIS A 466 -3.460 10.792 10.960 1.00 0.00 H new ATOM 425 N LYS A 467 -3.466 9.793 4.502 1.00 0.00 N ATOM 426 CA LYS A 467 -4.153 10.979 3.949 1.00 0.00 C ATOM 427 C LYS A 467 -4.395 10.995 2.431 1.00 0.00 C ATOM 428 O LYS A 467 -5.142 11.852 1.962 1.00 0.00 O ATOM 429 CB LYS A 467 -3.480 12.251 4.507 1.00 0.00 C ATOM 430 CG LYS A 467 -2.056 12.598 4.055 1.00 0.00 C ATOM 431 CD LYS A 467 -1.932 13.221 2.666 1.00 0.00 C ATOM 432 CE LYS A 467 -2.796 14.456 2.378 1.00 0.00 C ATOM 433 NZ LYS A 467 -2.411 15.627 3.209 1.00 0.00 N ATOM 0 H LYS A 467 -2.615 9.548 3.996 1.00 0.00 H new ATOM 0 HA LYS A 467 -5.185 10.934 4.298 1.00 0.00 H new ATOM 0 HB2 LYS A 467 -4.120 13.098 4.258 1.00 0.00 H new ATOM 0 HB3 LYS A 467 -3.469 12.168 5.594 1.00 0.00 H new ATOM 0 HG2 LYS A 467 -1.622 13.286 4.781 1.00 0.00 H new ATOM 0 HG3 LYS A 467 -1.456 11.689 4.079 1.00 0.00 H new ATOM 0 HD2 LYS A 467 -0.888 13.493 2.509 1.00 0.00 H new ATOM 0 HD3 LYS A 467 -2.177 12.457 1.929 1.00 0.00 H new ATOM 0 HE2 LYS A 467 -2.709 14.718 1.324 1.00 0.00 H new ATOM 0 HE3 LYS A 467 -3.843 14.214 2.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 467 -3.024 16.434 2.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 467 -2.519 15.389 4.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 467 -1.420 15.878 3.017 1.00 0.00 H new ATOM 447 N TYR A 468 -3.838 10.049 1.664 1.00 0.00 N ATOM 448 CA TYR A 468 -4.099 9.926 0.212 1.00 0.00 C ATOM 449 C TYR A 468 -5.312 9.072 -0.139 1.00 0.00 C ATOM 450 O TYR A 468 -5.800 9.121 -1.264 1.00 0.00 O ATOM 451 CB TYR A 468 -2.848 9.493 -0.555 1.00 0.00 C ATOM 452 CG TYR A 468 -1.794 10.562 -0.364 1.00 0.00 C ATOM 453 CD1 TYR A 468 -1.990 11.790 -1.026 1.00 0.00 C ATOM 454 CD2 TYR A 468 -0.770 10.435 0.596 1.00 0.00 C ATOM 455 CE1 TYR A 468 -1.130 12.874 -0.790 1.00 0.00 C ATOM 456 CE2 TYR A 468 0.062 11.541 0.856 1.00 0.00 C ATOM 457 CZ TYR A 468 -0.073 12.742 0.129 1.00 0.00 C ATOM 458 OH TYR A 468 0.755 13.791 0.385 1.00 0.00 O ATOM 0 H TYR A 468 -3.194 9.345 2.025 1.00 0.00 H new ATOM 0 HA TYR A 468 -4.361 10.931 -0.118 1.00 0.00 H new ATOM 0 HB2 TYR A 468 -2.488 8.532 -0.187 1.00 0.00 H new ATOM 0 HB3 TYR A 468 -3.074 9.365 -1.613 1.00 0.00 H new ATOM 0 HD1 TYR A 468 -2.809 11.898 -1.721 1.00 0.00 H new ATOM 0 HD2 TYR A 468 -0.626 9.504 1.124 1.00 0.00 H new ATOM 0 HE1 TYR A 468 -1.279 13.807 -1.313 1.00 0.00 H new ATOM 0 HE2 TYR A 468 0.816 11.468 1.625 1.00 0.00 H new ATOM 0 HH TYR A 468 1.428 13.523 1.045 1.00 0.00 H new ATOM 468 N SER A 469 -5.873 8.374 0.845 1.00 0.00 N ATOM 469 CA SER A 469 -7.126 7.623 0.800 1.00 0.00 C ATOM 470 C SER A 469 -8.288 8.438 0.225 1.00 0.00 C ATOM 471 O SER A 469 -9.143 7.893 -0.469 1.00 0.00 O ATOM 472 CB SER A 469 -7.480 7.217 2.237 1.00 0.00 C ATOM 473 OG SER A 469 -7.081 8.216 3.172 1.00 0.00 O ATOM 0 H SER A 469 -5.432 8.314 1.763 1.00 0.00 H new ATOM 0 HA SER A 469 -6.980 6.762 0.148 1.00 0.00 H new ATOM 0 HB2 SER A 469 -8.554 7.051 2.316 1.00 0.00 H new ATOM 0 HB3 SER A 469 -6.993 6.273 2.481 1.00 0.00 H new ATOM 0 HG SER A 469 -7.321 7.930 4.078 1.00 0.00 H new ATOM 479 N ASP A 470 -8.265 9.760 0.417 1.00 0.00 N ATOM 480 CA ASP A 470 -9.205 10.728 -0.150 1.00 0.00 C ATOM 481 C ASP A 470 -9.355 10.615 -1.681 1.00 0.00 C ATOM 482 O ASP A 470 -10.420 10.902 -2.234 1.00 0.00 O ATOM 483 CB ASP A 470 -8.719 12.132 0.227 1.00 0.00 C ATOM 484 CG ASP A 470 -9.721 13.228 -0.176 1.00 0.00 C ATOM 485 OD1 ASP A 470 -10.814 13.302 0.436 1.00 0.00 O ATOM 486 OD2 ASP A 470 -9.409 14.034 -1.085 1.00 0.00 O ATOM 0 H ASP A 470 -7.556 10.204 1.000 1.00 0.00 H new ATOM 0 HA ASP A 470 -10.193 10.520 0.262 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -8.548 12.178 1.303 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -7.761 12.324 -0.256 1.00 0.00 H new ATOM 491 N ALA A 471 -8.294 10.152 -2.350 1.00 0.00 N ATOM 492 CA ALA A 471 -8.199 9.926 -3.788 1.00 0.00 C ATOM 493 C ALA A 471 -7.764 8.491 -4.177 1.00 0.00 C ATOM 494 O ALA A 471 -7.735 8.155 -5.364 1.00 0.00 O ATOM 495 CB ALA A 471 -7.254 11.001 -4.338 1.00 0.00 C ATOM 0 H ALA A 471 -7.428 9.912 -1.868 1.00 0.00 H new ATOM 0 HA ALA A 471 -9.189 10.010 -4.236 1.00 0.00 H new ATOM 0 HB1 ALA A 471 -7.148 10.876 -5.416 1.00 0.00 H new ATOM 0 HB2 ALA A 471 -7.664 11.989 -4.126 1.00 0.00 H new ATOM 0 HB3 ALA A 471 -6.277 10.904 -3.864 1.00 0.00 H new ATOM 501 N LEU A 472 -7.454 7.635 -3.193 1.00 0.00 N ATOM 502 CA LEU A 472 -6.800 6.339 -3.354 1.00 0.00 C ATOM 503 C LEU A 472 -7.559 5.142 -2.743 1.00 0.00 C ATOM 504 O LEU A 472 -7.352 4.016 -3.187 1.00 0.00 O ATOM 505 CB LEU A 472 -5.391 6.533 -2.766 1.00 0.00 C ATOM 506 CG LEU A 472 -4.345 5.540 -3.274 1.00 0.00 C ATOM 507 CD1 LEU A 472 -3.063 6.284 -3.642 1.00 0.00 C ATOM 508 CD2 LEU A 472 -4.103 4.392 -2.296 1.00 0.00 C ATOM 0 H LEU A 472 -7.665 7.843 -2.217 1.00 0.00 H new ATOM 0 HA LEU A 472 -6.772 6.057 -4.407 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -5.053 7.544 -2.993 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -5.451 6.454 -1.681 1.00 0.00 H new ATOM 0 HG LEU A 472 -4.732 5.065 -4.176 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -2.320 5.573 -4.003 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -3.277 7.013 -4.423 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -2.675 6.798 -2.762 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -3.352 3.717 -2.706 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -3.751 4.792 -1.345 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -5.033 3.847 -2.138 1.00 0.00 H new ATOM 520 N SER A 473 -8.498 5.352 -1.810 1.00 0.00 N ATOM 521 CA SER A 473 -9.389 4.304 -1.262 1.00 0.00 C ATOM 522 C SER A 473 -10.269 3.612 -2.310 1.00 0.00 C ATOM 523 O SER A 473 -10.718 2.485 -2.092 1.00 0.00 O ATOM 524 CB SER A 473 -10.297 4.855 -0.161 1.00 0.00 C ATOM 525 OG SER A 473 -9.535 5.195 0.981 1.00 0.00 O ATOM 0 H SER A 473 -8.668 6.272 -1.403 1.00 0.00 H new ATOM 0 HA SER A 473 -8.705 3.558 -0.858 1.00 0.00 H new ATOM 0 HB2 SER A 473 -10.830 5.733 -0.526 1.00 0.00 H new ATOM 0 HB3 SER A 473 -11.050 4.113 0.104 1.00 0.00 H new ATOM 0 HG SER A 473 -10.128 5.548 1.677 1.00 0.00 H new ATOM 531 N GLY A 474 -10.474 4.239 -3.474 1.00 0.00 N ATOM 532 CA GLY A 474 -11.099 3.617 -4.646 1.00 0.00 C ATOM 533 C GLY A 474 -10.239 2.528 -5.312 1.00 0.00 C ATOM 534 O GLY A 474 -10.722 1.848 -6.218 1.00 0.00 O ATOM 0 H GLY A 474 -10.205 5.210 -3.630 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -12.052 3.180 -4.348 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -11.319 4.391 -5.381 1.00 0.00 H new ATOM 538 N THR A 475 -8.986 2.342 -4.871 1.00 0.00 N ATOM 539 CA THR A 475 -8.035 1.351 -5.407 1.00 0.00 C ATOM 540 C THR A 475 -7.645 0.319 -4.338 1.00 0.00 C ATOM 541 O THR A 475 -6.917 0.667 -3.404 1.00 0.00 O ATOM 542 CB THR A 475 -6.793 2.034 -6.005 1.00 0.00 C ATOM 543 OG1 THR A 475 -7.173 3.059 -6.906 1.00 0.00 O ATOM 544 CG2 THR A 475 -5.953 1.054 -6.818 1.00 0.00 C ATOM 0 H THR A 475 -8.592 2.893 -4.108 1.00 0.00 H new ATOM 0 HA THR A 475 -8.536 0.816 -6.214 1.00 0.00 H new ATOM 0 HB THR A 475 -6.225 2.426 -5.161 1.00 0.00 H new ATOM 0 HG1 THR A 475 -6.581 3.831 -6.791 1.00 0.00 H new ATOM 0 HG21 THR A 475 -5.084 1.571 -7.225 1.00 0.00 H new ATOM 0 HG22 THR A 475 -5.622 0.238 -6.175 1.00 0.00 H new ATOM 0 HG23 THR A 475 -6.552 0.652 -7.635 1.00 0.00 H new ATOM 552 N PRO A 476 -8.105 -0.948 -4.431 1.00 0.00 N ATOM 553 CA PRO A 476 -7.716 -2.004 -3.494 1.00 0.00 C ATOM 554 C PRO A 476 -6.240 -2.330 -3.633 1.00 0.00 C ATOM 555 O PRO A 476 -5.711 -2.295 -4.743 1.00 0.00 O ATOM 556 CB PRO A 476 -8.548 -3.236 -3.868 1.00 0.00 C ATOM 557 CG PRO A 476 -8.863 -3.018 -5.346 1.00 0.00 C ATOM 558 CD PRO A 476 -8.936 -1.501 -5.492 1.00 0.00 C ATOM 0 HA PRO A 476 -7.889 -1.690 -2.465 1.00 0.00 H new ATOM 0 HB2 PRO A 476 -7.992 -4.160 -3.708 1.00 0.00 H new ATOM 0 HB3 PRO A 476 -9.457 -3.304 -3.270 1.00 0.00 H new ATOM 0 HG2 PRO A 476 -8.089 -3.443 -5.985 1.00 0.00 H new ATOM 0 HG3 PRO A 476 -9.804 -3.491 -5.627 1.00 0.00 H new ATOM 0 HD2 PRO A 476 -8.576 -1.187 -6.472 1.00 0.00 H new ATOM 0 HD3 PRO A 476 -9.964 -1.151 -5.403 1.00 0.00 H new ATOM 566 N TRP A 477 -5.600 -2.762 -2.543 1.00 0.00 N ATOM 567 CA TRP A 477 -4.159 -3.049 -2.470 1.00 0.00 C ATOM 568 C TRP A 477 -3.607 -3.924 -3.602 1.00 0.00 C ATOM 569 O TRP A 477 -2.440 -3.832 -3.962 1.00 0.00 O ATOM 570 CB TRP A 477 -3.853 -3.765 -1.156 1.00 0.00 C ATOM 571 CG TRP A 477 -4.250 -5.217 -1.115 1.00 0.00 C ATOM 572 CD1 TRP A 477 -5.503 -5.724 -1.016 1.00 0.00 C ATOM 573 CD2 TRP A 477 -3.373 -6.378 -1.235 1.00 0.00 C ATOM 574 NE1 TRP A 477 -5.444 -7.094 -0.978 1.00 0.00 N ATOM 575 CE2 TRP A 477 -4.162 -7.564 -1.140 1.00 0.00 C ATOM 576 CE3 TRP A 477 -1.988 -6.549 -1.427 1.00 0.00 C ATOM 577 CZ2 TRP A 477 -3.604 -8.850 -1.217 1.00 0.00 C ATOM 578 CZ3 TRP A 477 -1.423 -7.828 -1.491 1.00 0.00 C ATOM 579 CH2 TRP A 477 -2.222 -8.981 -1.401 1.00 0.00 C ATOM 0 H TRP A 477 -6.082 -2.928 -1.659 1.00 0.00 H new ATOM 0 HA TRP A 477 -3.676 -2.076 -2.554 1.00 0.00 H new ATOM 0 HB2 TRP A 477 -2.783 -3.691 -0.960 1.00 0.00 H new ATOM 0 HB3 TRP A 477 -4.363 -3.242 -0.347 1.00 0.00 H new ATOM 0 HD1 TRP A 477 -6.410 -5.139 -0.974 1.00 0.00 H new ATOM 0 HE1 TRP A 477 -6.257 -7.695 -0.845 1.00 0.00 H new ATOM 0 HE3 TRP A 477 -1.353 -5.681 -1.526 1.00 0.00 H new ATOM 0 HZ2 TRP A 477 -4.231 -9.725 -1.136 1.00 0.00 H new ATOM 0 HZ3 TRP A 477 -0.355 -7.931 -1.612 1.00 0.00 H new ATOM 0 HH2 TRP A 477 -1.773 -9.961 -1.473 1.00 0.00 H new ATOM 590 N ILE A 478 -4.460 -4.761 -4.176 1.00 0.00 N ATOM 591 CA ILE A 478 -4.080 -5.762 -5.172 1.00 0.00 C ATOM 592 C ILE A 478 -4.071 -5.158 -6.581 1.00 0.00 C ATOM 593 O ILE A 478 -3.278 -5.578 -7.421 1.00 0.00 O ATOM 594 CB ILE A 478 -4.933 -7.039 -5.031 1.00 0.00 C ATOM 595 CG1 ILE A 478 -4.187 -8.228 -5.675 1.00 0.00 C ATOM 596 CG2 ILE A 478 -6.349 -6.871 -5.607 1.00 0.00 C ATOM 597 CD1 ILE A 478 -4.679 -9.592 -5.184 1.00 0.00 C ATOM 0 H ILE A 478 -5.457 -4.766 -3.960 1.00 0.00 H new ATOM 0 HA ILE A 478 -3.054 -6.080 -4.986 1.00 0.00 H new ATOM 0 HB ILE A 478 -5.072 -7.240 -3.969 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -4.303 -8.176 -6.758 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -3.122 -8.137 -5.463 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -6.906 -7.800 -5.481 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -6.863 -6.066 -5.081 1.00 0.00 H new ATOM 0 HG23 ILE A 478 -6.284 -6.628 -6.668 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -4.112 -10.382 -5.677 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -4.538 -9.663 -4.105 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -5.737 -9.703 -5.420 1.00 0.00 H new ATOM 609 N GLU A 479 -4.904 -4.138 -6.831 1.00 0.00 N ATOM 610 CA GLU A 479 -4.770 -3.295 -8.031 1.00 0.00 C ATOM 611 C GLU A 479 -3.753 -2.161 -7.778 1.00 0.00 C ATOM 612 O GLU A 479 -3.228 -1.557 -8.713 1.00 0.00 O ATOM 613 CB GLU A 479 -6.132 -2.699 -8.426 1.00 0.00 C ATOM 614 CG GLU A 479 -7.106 -3.776 -8.925 1.00 0.00 C ATOM 615 CD GLU A 479 -8.395 -3.146 -9.490 1.00 0.00 C ATOM 616 OE1 GLU A 479 -8.384 -2.675 -10.655 1.00 0.00 O ATOM 617 OE2 GLU A 479 -9.432 -3.130 -8.784 1.00 0.00 O ATOM 0 H GLU A 479 -5.677 -3.876 -6.220 1.00 0.00 H new ATOM 0 HA GLU A 479 -4.410 -3.918 -8.850 1.00 0.00 H new ATOM 0 HB2 GLU A 479 -6.566 -2.186 -7.568 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -5.988 -1.950 -9.205 1.00 0.00 H new ATOM 0 HG2 GLU A 479 -6.624 -4.377 -9.696 1.00 0.00 H new ATOM 0 HG3 GLU A 479 -7.357 -4.450 -8.106 1.00 0.00 H new ATOM 624 N LEU A 480 -3.471 -1.880 -6.501 1.00 0.00 N ATOM 625 CA LEU A 480 -2.705 -0.741 -6.017 1.00 0.00 C ATOM 626 C LEU A 480 -1.209 -0.907 -6.057 1.00 0.00 C ATOM 627 O LEU A 480 -0.504 -0.051 -6.580 1.00 0.00 O ATOM 628 CB LEU A 480 -3.041 -0.500 -4.544 1.00 0.00 C ATOM 629 CG LEU A 480 -2.544 0.833 -4.012 1.00 0.00 C ATOM 630 CD1 LEU A 480 -3.455 1.869 -4.613 1.00 0.00 C ATOM 631 CD2 LEU A 480 -2.656 0.851 -2.499 1.00 0.00 C ATOM 0 H LEU A 480 -3.792 -2.479 -5.740 1.00 0.00 H new ATOM 0 HA LEU A 480 -2.980 0.074 -6.686 1.00 0.00 H new ATOM 0 HB2 LEU A 480 -4.122 -0.552 -4.414 1.00 0.00 H new ATOM 0 HB3 LEU A 480 -2.609 -1.303 -3.946 1.00 0.00 H new ATOM 0 HG LEU A 480 -1.501 1.017 -4.269 1.00 0.00 H new ATOM 0 HD11 LEU A 480 -3.155 2.860 -4.272 1.00 0.00 H new ATOM 0 HD12 LEU A 480 -3.389 1.825 -5.700 1.00 0.00 H new ATOM 0 HD13 LEU A 480 -4.482 1.674 -4.303 1.00 0.00 H new ATOM 0 HD21 LEU A 480 -2.299 1.808 -2.119 1.00 0.00 H new ATOM 0 HD22 LEU A 480 -3.698 0.711 -2.210 1.00 0.00 H new ATOM 0 HD23 LEU A 480 -2.052 0.046 -2.080 1.00 0.00 H new ATOM 643 N ILE A 481 -0.707 -1.970 -5.435 1.00 0.00 N ATOM 644 CA ILE A 481 0.723 -2.117 -5.197 1.00 0.00 C ATOM 645 C ILE A 481 1.519 -2.147 -6.519 1.00 0.00 C ATOM 646 O ILE A 481 2.723 -1.913 -6.568 1.00 0.00 O ATOM 647 CB ILE A 481 0.981 -3.371 -4.333 1.00 0.00 C ATOM 648 CG1 ILE A 481 0.531 -4.635 -5.103 1.00 0.00 C ATOM 649 CG2 ILE A 481 0.357 -3.159 -2.936 1.00 0.00 C ATOM 650 CD1 ILE A 481 0.596 -5.918 -4.287 1.00 0.00 C ATOM 0 H ILE A 481 -1.273 -2.744 -5.086 1.00 0.00 H new ATOM 0 HA ILE A 481 1.079 -1.246 -4.648 1.00 0.00 H new ATOM 0 HB ILE A 481 2.042 -3.534 -4.145 1.00 0.00 H new ATOM 0 HG12 ILE A 481 -0.492 -4.490 -5.451 1.00 0.00 H new ATOM 0 HG13 ILE A 481 1.156 -4.749 -5.989 1.00 0.00 H new ATOM 0 HG21 ILE A 481 0.535 -4.041 -2.320 1.00 0.00 H new ATOM 0 HG22 ILE A 481 0.811 -2.288 -2.463 1.00 0.00 H new ATOM 0 HG23 ILE A 481 -0.716 -2.998 -3.037 1.00 0.00 H new ATOM 0 HD11 ILE A 481 0.264 -6.756 -4.900 1.00 0.00 H new ATOM 0 HD12 ILE A 481 1.622 -6.090 -3.961 1.00 0.00 H new ATOM 0 HD13 ILE A 481 -0.051 -5.828 -3.415 1.00 0.00 H new ATOM 662 N TYR A 482 0.782 -2.407 -7.600 1.00 0.00 N ATOM 663 CA TYR A 482 1.163 -2.473 -9.006 1.00 0.00 C ATOM 664 C TYR A 482 1.406 -1.105 -9.658 1.00 0.00 C ATOM 665 O TYR A 482 1.926 -1.043 -10.778 1.00 0.00 O ATOM 666 CB TYR A 482 0.003 -3.157 -9.736 1.00 0.00 C ATOM 667 CG TYR A 482 -0.164 -4.661 -9.559 1.00 0.00 C ATOM 668 CD1 TYR A 482 0.740 -5.441 -8.804 1.00 0.00 C ATOM 669 CD2 TYR A 482 -1.266 -5.284 -10.176 1.00 0.00 C ATOM 670 CE1 TYR A 482 0.541 -6.826 -8.662 1.00 0.00 C ATOM 671 CE2 TYR A 482 -1.469 -6.672 -10.044 1.00 0.00 C ATOM 672 CZ TYR A 482 -0.564 -7.448 -9.289 1.00 0.00 C ATOM 673 OH TYR A 482 -0.752 -8.792 -9.178 1.00 0.00 O ATOM 0 H TYR A 482 -0.214 -2.599 -7.494 1.00 0.00 H new ATOM 0 HA TYR A 482 2.108 -3.011 -9.075 1.00 0.00 H new ATOM 0 HB2 TYR A 482 -0.922 -2.678 -9.416 1.00 0.00 H new ATOM 0 HB3 TYR A 482 0.114 -2.956 -10.802 1.00 0.00 H new ATOM 0 HD1 TYR A 482 1.590 -4.970 -8.332 1.00 0.00 H new ATOM 0 HD2 TYR A 482 -1.961 -4.693 -10.755 1.00 0.00 H new ATOM 0 HE1 TYR A 482 1.231 -7.414 -8.075 1.00 0.00 H new ATOM 0 HE2 TYR A 482 -2.317 -7.142 -10.520 1.00 0.00 H new ATOM 0 HH TYR A 482 -1.559 -9.051 -9.669 1.00 0.00 H new ATOM 683 N LEU A 483 1.030 -0.013 -8.987 1.00 0.00 N ATOM 684 CA LEU A 483 1.350 1.346 -9.439 1.00 0.00 C ATOM 685 C LEU A 483 2.868 1.613 -9.328 1.00 0.00 C ATOM 686 O LEU A 483 3.679 0.752 -8.980 1.00 0.00 O ATOM 687 CB LEU A 483 0.555 2.413 -8.659 1.00 0.00 C ATOM 688 CG LEU A 483 -0.978 2.246 -8.618 1.00 0.00 C ATOM 689 CD1 LEU A 483 -1.574 2.933 -7.412 1.00 0.00 C ATOM 690 CD2 LEU A 483 -1.643 2.965 -9.785 1.00 0.00 C ATOM 0 H LEU A 483 0.497 -0.044 -8.118 1.00 0.00 H new ATOM 0 HA LEU A 483 1.056 1.419 -10.486 1.00 0.00 H new ATOM 0 HB2 LEU A 483 0.923 2.428 -7.633 1.00 0.00 H new ATOM 0 HB3 LEU A 483 0.779 3.388 -9.092 1.00 0.00 H new ATOM 0 HG LEU A 483 -1.147 1.169 -8.624 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -2.655 2.796 -7.413 1.00 0.00 H new ATOM 0 HD12 LEU A 483 -1.154 2.502 -6.503 1.00 0.00 H new ATOM 0 HD13 LEU A 483 -1.343 3.998 -7.448 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -2.723 2.829 -9.728 1.00 0.00 H new ATOM 0 HD22 LEU A 483 -1.408 4.028 -9.738 1.00 0.00 H new ATOM 0 HD23 LEU A 483 -1.274 2.553 -10.724 1.00 0.00 H new ATOM 702 N ASP A 484 3.245 2.845 -9.632 1.00 0.00 N ATOM 703 CA ASP A 484 4.611 3.347 -9.700 1.00 0.00 C ATOM 704 C ASP A 484 4.670 4.768 -9.133 1.00 0.00 C ATOM 705 O ASP A 484 3.636 5.356 -8.808 1.00 0.00 O ATOM 706 CB ASP A 484 4.979 3.424 -11.179 1.00 0.00 C ATOM 707 CG ASP A 484 6.487 3.494 -11.489 1.00 0.00 C ATOM 708 OD1 ASP A 484 7.323 3.368 -10.562 1.00 0.00 O ATOM 709 OD2 ASP A 484 6.840 3.686 -12.677 1.00 0.00 O ATOM 0 H ASP A 484 2.561 3.569 -9.852 1.00 0.00 H new ATOM 0 HA ASP A 484 5.283 2.700 -9.136 1.00 0.00 H new ATOM 0 HB2 ASP A 484 4.563 2.552 -11.684 1.00 0.00 H new ATOM 0 HB3 ASP A 484 4.497 4.302 -11.609 1.00 0.00 H new ATOM 714 N ASP A 485 5.866 5.354 -9.140 1.00 0.00 N ATOM 715 CA ASP A 485 6.135 6.739 -8.789 1.00 0.00 C ATOM 716 C ASP A 485 5.117 7.728 -9.379 1.00 0.00 C ATOM 717 O ASP A 485 4.241 8.227 -8.671 1.00 0.00 O ATOM 718 CB ASP A 485 7.584 7.084 -9.178 1.00 0.00 C ATOM 719 CG ASP A 485 7.945 8.536 -8.842 1.00 0.00 C ATOM 720 OD1 ASP A 485 7.811 8.932 -7.664 1.00 0.00 O ATOM 721 OD2 ASP A 485 8.360 9.287 -9.756 1.00 0.00 O ATOM 0 H ASP A 485 6.711 4.848 -9.404 1.00 0.00 H new ATOM 0 HA ASP A 485 6.020 6.844 -7.710 1.00 0.00 H new ATOM 0 HB2 ASP A 485 8.267 6.412 -8.659 1.00 0.00 H new ATOM 0 HB3 ASP A 485 7.721 6.915 -10.246 1.00 0.00 H new ATOM 726 N GLU A 486 5.189 8.012 -10.681 1.00 0.00 N ATOM 727 CA GLU A 486 4.351 9.021 -11.297 1.00 0.00 C ATOM 728 C GLU A 486 2.887 8.590 -11.427 1.00 0.00 C ATOM 729 O GLU A 486 2.030 9.441 -11.631 1.00 0.00 O ATOM 730 CB GLU A 486 4.952 9.412 -12.657 1.00 0.00 C ATOM 731 CG GLU A 486 4.628 10.881 -12.916 1.00 0.00 C ATOM 732 CD GLU A 486 4.971 11.363 -14.338 1.00 0.00 C ATOM 733 OE1 GLU A 486 6.113 11.147 -14.812 1.00 0.00 O ATOM 734 OE2 GLU A 486 4.092 11.988 -14.984 1.00 0.00 O ATOM 0 H GLU A 486 5.828 7.548 -11.327 1.00 0.00 H new ATOM 0 HA GLU A 486 4.335 9.892 -10.642 1.00 0.00 H new ATOM 0 HB2 GLU A 486 6.031 9.255 -12.655 1.00 0.00 H new ATOM 0 HB3 GLU A 486 4.540 8.786 -13.449 1.00 0.00 H new ATOM 0 HG2 GLU A 486 3.565 11.044 -12.736 1.00 0.00 H new ATOM 0 HG3 GLU A 486 5.171 11.493 -12.196 1.00 0.00 H new ATOM 741 N THR A 487 2.552 7.308 -11.262 1.00 0.00 N ATOM 742 CA THR A 487 1.152 6.866 -11.382 1.00 0.00 C ATOM 743 C THR A 487 0.354 6.980 -10.096 1.00 0.00 C ATOM 744 O THR A 487 -0.833 7.305 -10.137 1.00 0.00 O ATOM 745 CB THR A 487 1.028 5.464 -11.994 1.00 0.00 C ATOM 746 OG1 THR A 487 1.749 5.405 -13.207 1.00 0.00 O ATOM 747 CG2 THR A 487 -0.424 5.094 -12.314 1.00 0.00 C ATOM 0 H THR A 487 3.216 6.564 -11.048 1.00 0.00 H new ATOM 0 HA THR A 487 0.700 7.573 -12.078 1.00 0.00 H new ATOM 0 HB THR A 487 1.422 4.767 -11.254 1.00 0.00 H new ATOM 0 HG1 THR A 487 1.668 4.508 -13.592 1.00 0.00 H new ATOM 0 HG21 THR A 487 -0.458 4.093 -12.745 1.00 0.00 H new ATOM 0 HG22 THR A 487 -1.015 5.115 -11.398 1.00 0.00 H new ATOM 0 HG23 THR A 487 -0.833 5.810 -13.027 1.00 0.00 H new ATOM 755 N LEU A 488 0.999 6.847 -8.939 1.00 0.00 N ATOM 756 CA LEU A 488 0.394 7.215 -7.663 1.00 0.00 C ATOM 757 C LEU A 488 0.017 8.696 -7.667 1.00 0.00 C ATOM 758 O LEU A 488 -0.946 9.129 -7.041 1.00 0.00 O ATOM 759 CB LEU A 488 1.434 6.939 -6.572 1.00 0.00 C ATOM 760 CG LEU A 488 1.549 5.445 -6.268 1.00 0.00 C ATOM 761 CD1 LEU A 488 2.865 5.193 -5.543 1.00 0.00 C ATOM 762 CD2 LEU A 488 0.363 4.974 -5.425 1.00 0.00 C ATOM 0 H LEU A 488 1.949 6.484 -8.860 1.00 0.00 H new ATOM 0 HA LEU A 488 -0.514 6.639 -7.486 1.00 0.00 H new ATOM 0 HB2 LEU A 488 2.404 7.322 -6.888 1.00 0.00 H new ATOM 0 HB3 LEU A 488 1.160 7.476 -5.664 1.00 0.00 H new ATOM 0 HG LEU A 488 1.534 4.879 -7.199 1.00 0.00 H new ATOM 0 HD11 LEU A 488 2.960 4.130 -5.320 1.00 0.00 H new ATOM 0 HD12 LEU A 488 3.695 5.506 -6.176 1.00 0.00 H new ATOM 0 HD13 LEU A 488 2.883 5.762 -4.613 1.00 0.00 H new ATOM 0 HD21 LEU A 488 0.463 3.908 -5.219 1.00 0.00 H new ATOM 0 HD22 LEU A 488 0.343 5.525 -4.485 1.00 0.00 H new ATOM 0 HD23 LEU A 488 -0.564 5.153 -5.969 1.00 0.00 H new ATOM 774 N GLU A 489 0.755 9.489 -8.433 1.00 0.00 N ATOM 775 CA GLU A 489 0.561 10.895 -8.601 1.00 0.00 C ATOM 776 C GLU A 489 -0.621 11.200 -9.549 1.00 0.00 C ATOM 777 O GLU A 489 -1.324 12.187 -9.352 1.00 0.00 O ATOM 778 CB GLU A 489 1.933 11.380 -9.023 1.00 0.00 C ATOM 779 CG GLU A 489 1.938 12.823 -9.461 1.00 0.00 C ATOM 780 CD GLU A 489 3.300 13.500 -9.248 1.00 0.00 C ATOM 781 OE1 GLU A 489 3.648 13.775 -8.072 1.00 0.00 O ATOM 782 OE2 GLU A 489 4.027 13.760 -10.234 1.00 0.00 O ATOM 0 H GLU A 489 1.543 9.135 -8.976 1.00 0.00 H new ATOM 0 HA GLU A 489 0.242 11.433 -7.708 1.00 0.00 H new ATOM 0 HB2 GLU A 489 2.628 11.256 -8.192 1.00 0.00 H new ATOM 0 HB3 GLU A 489 2.298 10.757 -9.840 1.00 0.00 H new ATOM 0 HG2 GLU A 489 1.669 12.880 -10.516 1.00 0.00 H new ATOM 0 HG3 GLU A 489 1.174 13.369 -8.908 1.00 0.00 H new ATOM 789 N LYS A 490 -0.948 10.318 -10.507 1.00 0.00 N ATOM 790 CA LYS A 490 -2.185 10.383 -11.293 1.00 0.00 C ATOM 791 C LYS A 490 -3.422 9.952 -10.492 1.00 0.00 C ATOM 792 O LYS A 490 -4.531 10.378 -10.821 1.00 0.00 O ATOM 793 CB LYS A 490 -2.040 9.538 -12.557 1.00 0.00 C ATOM 794 CG LYS A 490 -0.779 9.770 -13.378 1.00 0.00 C ATOM 795 CD LYS A 490 -0.502 11.219 -13.747 1.00 0.00 C ATOM 796 CE LYS A 490 0.969 11.302 -14.171 1.00 0.00 C ATOM 797 NZ LYS A 490 1.364 12.634 -14.690 1.00 0.00 N ATOM 0 H LYS A 490 -0.351 9.530 -10.759 1.00 0.00 H new ATOM 0 HA LYS A 490 -2.342 11.426 -11.566 1.00 0.00 H new ATOM 0 HB2 LYS A 490 -2.075 8.486 -12.272 1.00 0.00 H new ATOM 0 HB3 LYS A 490 -2.904 9.725 -13.195 1.00 0.00 H new ATOM 0 HG2 LYS A 490 0.074 9.385 -12.820 1.00 0.00 H new ATOM 0 HG3 LYS A 490 -0.850 9.186 -14.295 1.00 0.00 H new ATOM 0 HD2 LYS A 490 -1.155 11.542 -14.557 1.00 0.00 H new ATOM 0 HD3 LYS A 490 -0.696 11.876 -12.900 1.00 0.00 H new ATOM 0 HE2 LYS A 490 1.599 11.053 -13.317 1.00 0.00 H new ATOM 0 HE3 LYS A 490 1.160 10.551 -14.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 2.387 12.644 -14.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 0.848 12.830 -15.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 1.134 13.363 -13.985 1.00 0.00 H new ATOM 811 N LYS A 491 -3.247 9.149 -9.428 1.00 0.00 N ATOM 812 CA LYS A 491 -4.280 8.834 -8.431 1.00 0.00 C ATOM 813 C LYS A 491 -4.530 10.062 -7.568 1.00 0.00 C ATOM 814 O LYS A 491 -5.651 10.563 -7.481 1.00 0.00 O ATOM 815 CB LYS A 491 -3.906 7.542 -7.662 1.00 0.00 C ATOM 816 CG LYS A 491 -3.906 6.251 -8.497 1.00 0.00 C ATOM 817 CD LYS A 491 -5.305 5.774 -8.897 1.00 0.00 C ATOM 818 CE LYS A 491 -5.218 4.372 -9.514 1.00 0.00 C ATOM 819 NZ LYS A 491 -6.559 3.748 -9.644 1.00 0.00 N ATOM 0 H LYS A 491 -2.357 8.689 -9.234 1.00 0.00 H new ATOM 0 HA LYS A 491 -5.235 8.604 -8.903 1.00 0.00 H new ATOM 0 HB2 LYS A 491 -2.915 7.673 -7.227 1.00 0.00 H new ATOM 0 HB3 LYS A 491 -4.604 7.418 -6.834 1.00 0.00 H new ATOM 0 HG2 LYS A 491 -3.316 6.413 -9.399 1.00 0.00 H new ATOM 0 HG3 LYS A 491 -3.412 5.462 -7.930 1.00 0.00 H new ATOM 0 HD2 LYS A 491 -5.957 5.757 -8.024 1.00 0.00 H new ATOM 0 HD3 LYS A 491 -5.746 6.469 -9.611 1.00 0.00 H new ATOM 0 HE2 LYS A 491 -4.748 4.434 -10.496 1.00 0.00 H new ATOM 0 HE3 LYS A 491 -4.581 3.740 -8.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 491 -6.494 2.910 -10.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 491 -6.903 3.465 -8.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 491 -7.221 4.432 -10.063 1.00 0.00 H new ATOM 833 N GLY A 492 -3.450 10.588 -7.020 1.00 0.00 N ATOM 834 CA GLY A 492 -3.344 11.909 -6.444 1.00 0.00 C ATOM 835 C GLY A 492 -2.620 11.994 -5.128 1.00 0.00 C ATOM 836 O GLY A 492 -2.920 12.817 -4.266 1.00 0.00 O ATOM 0 H GLY A 492 -2.573 10.070 -6.964 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -2.836 12.557 -7.159 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -4.349 12.308 -6.310 1.00 0.00 H new ATOM 840 N VAL A 493 -1.606 11.149 -5.033 1.00 0.00 N ATOM 841 CA VAL A 493 -0.575 11.210 -4.026 1.00 0.00 C ATOM 842 C VAL A 493 0.190 12.530 -4.155 1.00 0.00 C ATOM 843 O VAL A 493 0.480 13.213 -3.182 1.00 0.00 O ATOM 844 CB VAL A 493 0.271 9.953 -4.184 1.00 0.00 C ATOM 845 CG1 VAL A 493 1.508 10.097 -3.360 1.00 0.00 C ATOM 846 CG2 VAL A 493 -0.592 8.764 -3.752 1.00 0.00 C ATOM 0 H VAL A 493 -1.480 10.374 -5.684 1.00 0.00 H new ATOM 0 HA VAL A 493 -0.966 11.216 -3.008 1.00 0.00 H new ATOM 0 HB VAL A 493 0.590 9.794 -5.214 1.00 0.00 H new ATOM 0 HG11 VAL A 493 2.122 9.202 -3.465 1.00 0.00 H new ATOM 0 HG12 VAL A 493 2.072 10.966 -3.699 1.00 0.00 H new ATOM 0 HG13 VAL A 493 1.235 10.228 -2.313 1.00 0.00 H new ATOM 0 HG21 VAL A 493 -0.018 7.843 -3.852 1.00 0.00 H new ATOM 0 HG22 VAL A 493 -0.894 8.893 -2.713 1.00 0.00 H new ATOM 0 HG23 VAL A 493 -1.479 8.709 -4.384 1.00 0.00 H new ATOM 856 N LEU A 494 0.445 12.912 -5.404 1.00 0.00 N ATOM 857 CA LEU A 494 0.930 14.201 -5.906 1.00 0.00 C ATOM 858 C LEU A 494 2.152 14.835 -5.226 1.00 0.00 C ATOM 859 O LEU A 494 2.393 16.044 -5.256 1.00 0.00 O ATOM 860 CB LEU A 494 -0.258 15.145 -6.068 1.00 0.00 C ATOM 861 CG LEU A 494 -0.906 14.759 -7.401 1.00 0.00 C ATOM 862 CD1 LEU A 494 -2.396 14.822 -7.294 1.00 0.00 C ATOM 863 CD2 LEU A 494 -0.347 15.593 -8.542 1.00 0.00 C ATOM 0 H LEU A 494 0.302 12.258 -6.174 1.00 0.00 H new ATOM 0 HA LEU A 494 1.378 13.984 -6.876 1.00 0.00 H new ATOM 0 HB2 LEU A 494 -0.962 15.036 -5.243 1.00 0.00 H new ATOM 0 HB3 LEU A 494 0.066 16.186 -6.075 1.00 0.00 H new ATOM 0 HG LEU A 494 -0.654 13.725 -7.636 1.00 0.00 H new ATOM 0 HD11 LEU A 494 -2.841 14.545 -8.249 1.00 0.00 H new ATOM 0 HD12 LEU A 494 -2.735 14.131 -6.522 1.00 0.00 H new ATOM 0 HD13 LEU A 494 -2.699 15.836 -7.033 1.00 0.00 H new ATOM 0 HD21 LEU A 494 -0.825 15.298 -9.476 1.00 0.00 H new ATOM 0 HD22 LEU A 494 -0.543 16.648 -8.352 1.00 0.00 H new ATOM 0 HD23 LEU A 494 0.728 15.432 -8.618 1.00 0.00 H new ATOM 875 N ALA A 495 2.909 13.961 -4.595 1.00 0.00 N ATOM 876 CA ALA A 495 4.006 14.258 -3.678 1.00 0.00 C ATOM 877 C ALA A 495 5.004 13.118 -3.672 1.00 0.00 C ATOM 878 O ALA A 495 4.647 12.022 -3.242 1.00 0.00 O ATOM 879 CB ALA A 495 3.453 14.407 -2.258 1.00 0.00 C ATOM 0 H ALA A 495 2.771 12.957 -4.712 1.00 0.00 H new ATOM 0 HA ALA A 495 4.492 15.178 -4.003 1.00 0.00 H new ATOM 0 HB1 ALA A 495 4.270 14.629 -1.571 1.00 0.00 H new ATOM 0 HB2 ALA A 495 2.727 15.220 -2.234 1.00 0.00 H new ATOM 0 HB3 ALA A 495 2.968 13.478 -1.957 1.00 0.00 H new ATOM 885 N LEU A 496 6.250 13.375 -4.085 1.00 0.00 N ATOM 886 CA LEU A 496 7.329 12.386 -4.096 1.00 0.00 C ATOM 887 C LEU A 496 7.424 11.657 -2.773 1.00 0.00 C ATOM 888 O LEU A 496 7.350 10.433 -2.745 1.00 0.00 O ATOM 889 CB LEU A 496 8.635 13.058 -4.494 1.00 0.00 C ATOM 890 CG LEU A 496 9.895 12.172 -4.338 1.00 0.00 C ATOM 891 CD1 LEU A 496 10.908 12.543 -5.412 1.00 0.00 C ATOM 892 CD2 LEU A 496 10.619 12.344 -2.997 1.00 0.00 C ATOM 0 H LEU A 496 6.540 14.292 -4.426 1.00 0.00 H new ATOM 0 HA LEU A 496 7.108 11.622 -4.841 1.00 0.00 H new ATOM 0 HB2 LEU A 496 8.560 13.379 -5.533 1.00 0.00 H new ATOM 0 HB3 LEU A 496 8.763 13.957 -3.891 1.00 0.00 H new ATOM 0 HG LEU A 496 9.537 11.145 -4.413 1.00 0.00 H new ATOM 0 HD11 LEU A 496 11.796 11.921 -5.305 1.00 0.00 H new ATOM 0 HD12 LEU A 496 10.469 12.383 -6.397 1.00 0.00 H new ATOM 0 HD13 LEU A 496 11.185 13.592 -5.305 1.00 0.00 H new ATOM 0 HD21 LEU A 496 11.490 11.689 -2.967 1.00 0.00 H new ATOM 0 HD22 LEU A 496 10.940 13.380 -2.887 1.00 0.00 H new ATOM 0 HD23 LEU A 496 9.942 12.085 -2.182 1.00 0.00 H new ATOM 904 N GLY A 497 7.494 12.397 -1.669 1.00 0.00 N ATOM 905 CA GLY A 497 7.635 11.784 -0.357 1.00 0.00 C ATOM 906 C GLY A 497 6.346 11.292 0.289 1.00 0.00 C ATOM 907 O GLY A 497 6.228 11.185 1.508 1.00 0.00 O ATOM 0 H GLY A 497 7.455 13.416 -1.659 1.00 0.00 H new ATOM 0 HA2 GLY A 497 8.320 10.941 -0.443 1.00 0.00 H new ATOM 0 HA3 GLY A 497 8.101 12.507 0.312 1.00 0.00 H new ATOM 911 N ALA A 498 5.411 10.938 -0.584 1.00 0.00 N ATOM 912 CA ALA A 498 4.218 10.153 -0.319 1.00 0.00 C ATOM 913 C ALA A 498 4.211 8.957 -1.287 1.00 0.00 C ATOM 914 O ALA A 498 4.144 7.811 -0.857 1.00 0.00 O ATOM 915 CB ALA A 498 2.982 11.034 -0.440 1.00 0.00 C ATOM 0 H ALA A 498 5.474 11.213 -1.564 1.00 0.00 H new ATOM 0 HA ALA A 498 4.212 9.763 0.699 1.00 0.00 H new ATOM 0 HB1 ALA A 498 2.090 10.440 -0.240 1.00 0.00 H new ATOM 0 HB2 ALA A 498 3.044 11.849 0.281 1.00 0.00 H new ATOM 0 HB3 ALA A 498 2.925 11.445 -1.448 1.00 0.00 H new ATOM 921 N ARG A 499 4.397 9.193 -2.591 1.00 0.00 N ATOM 922 CA ARG A 499 4.494 8.126 -3.615 1.00 0.00 C ATOM 923 C ARG A 499 5.699 7.185 -3.464 1.00 0.00 C ATOM 924 O ARG A 499 5.586 6.015 -3.781 1.00 0.00 O ATOM 925 CB ARG A 499 4.394 8.667 -5.049 1.00 0.00 C ATOM 926 CG ARG A 499 5.422 9.738 -5.429 1.00 0.00 C ATOM 927 CD ARG A 499 4.941 10.484 -6.677 1.00 0.00 C ATOM 928 NE ARG A 499 5.337 11.892 -6.826 1.00 0.00 N ATOM 929 CZ ARG A 499 6.421 12.374 -7.401 1.00 0.00 C ATOM 930 NH1 ARG A 499 7.493 11.671 -7.626 1.00 0.00 N ATOM 931 NH2 ARG A 499 6.417 13.614 -7.781 1.00 0.00 N ATOM 0 H ARG A 499 4.486 10.133 -2.976 1.00 0.00 H new ATOM 0 HA ARG A 499 3.617 7.509 -3.421 1.00 0.00 H new ATOM 0 HB2 ARG A 499 4.495 7.831 -5.741 1.00 0.00 H new ATOM 0 HB3 ARG A 499 3.396 9.081 -5.193 1.00 0.00 H new ATOM 0 HG2 ARG A 499 5.558 10.437 -4.604 1.00 0.00 H new ATOM 0 HG3 ARG A 499 6.391 9.277 -5.618 1.00 0.00 H new ATOM 0 HD2 ARG A 499 5.299 9.941 -7.551 1.00 0.00 H new ATOM 0 HD3 ARG A 499 3.852 10.438 -6.697 1.00 0.00 H new ATOM 0 HE ARG A 499 4.694 12.581 -6.436 1.00 0.00 H new ATOM 0 HH11 ARG A 499 7.525 10.689 -7.353 1.00 0.00 H new ATOM 0 HH12 ARG A 499 8.301 12.102 -8.075 1.00 0.00 H new ATOM 0 HH21 ARG A 499 5.589 14.190 -7.632 1.00 0.00 H new ATOM 0 HH22 ARG A 499 7.242 14.013 -8.229 1.00 0.00 H new ATOM 945 N ARG A 500 6.833 7.622 -2.916 1.00 0.00 N ATOM 946 CA ARG A 500 8.096 6.870 -2.751 1.00 0.00 C ATOM 947 C ARG A 500 8.017 6.051 -1.472 1.00 0.00 C ATOM 948 O ARG A 500 8.396 4.887 -1.400 1.00 0.00 O ATOM 949 CB ARG A 500 9.185 7.941 -2.679 1.00 0.00 C ATOM 950 CG ARG A 500 10.507 7.386 -2.189 1.00 0.00 C ATOM 951 CD ARG A 500 11.528 8.512 -2.258 1.00 0.00 C ATOM 952 NE ARG A 500 12.857 8.066 -1.792 1.00 0.00 N ATOM 953 CZ ARG A 500 13.773 8.770 -1.149 1.00 0.00 C ATOM 954 NH1 ARG A 500 13.599 10.024 -0.836 1.00 0.00 N ATOM 955 NH2 ARG A 500 14.900 8.219 -0.799 1.00 0.00 N ATOM 0 H ARG A 500 6.908 8.571 -2.549 1.00 0.00 H new ATOM 0 HA ARG A 500 8.298 6.170 -3.562 1.00 0.00 H new ATOM 0 HB2 ARG A 500 9.323 8.383 -3.666 1.00 0.00 H new ATOM 0 HB3 ARG A 500 8.861 8.741 -2.014 1.00 0.00 H new ATOM 0 HG2 ARG A 500 10.413 7.016 -1.168 1.00 0.00 H new ATOM 0 HG3 ARG A 500 10.822 6.544 -2.806 1.00 0.00 H new ATOM 0 HD2 ARG A 500 11.603 8.874 -3.283 1.00 0.00 H new ATOM 0 HD3 ARG A 500 11.189 9.350 -1.648 1.00 0.00 H new ATOM 0 HE ARG A 500 13.098 7.095 -1.991 1.00 0.00 H new ATOM 0 HH11 ARG A 500 12.731 10.497 -1.088 1.00 0.00 H new ATOM 0 HH12 ARG A 500 14.331 10.532 -0.339 1.00 0.00 H new ATOM 0 HH21 ARG A 500 15.079 7.240 -1.021 1.00 0.00 H new ATOM 0 HH22 ARG A 500 15.603 8.767 -0.303 1.00 0.00 H new ATOM 969 N LYS A 501 7.435 6.680 -0.462 1.00 0.00 N ATOM 970 CA LYS A 501 6.985 6.060 0.770 1.00 0.00 C ATOM 971 C LYS A 501 5.943 4.968 0.501 1.00 0.00 C ATOM 972 O LYS A 501 5.921 3.934 1.169 1.00 0.00 O ATOM 973 CB LYS A 501 6.402 7.220 1.564 1.00 0.00 C ATOM 974 CG LYS A 501 7.419 8.211 2.156 1.00 0.00 C ATOM 975 CD LYS A 501 8.452 7.585 3.104 1.00 0.00 C ATOM 976 CE LYS A 501 9.413 8.678 3.594 1.00 0.00 C ATOM 977 NZ LYS A 501 10.415 8.141 4.553 1.00 0.00 N ATOM 0 H LYS A 501 7.256 7.684 -0.483 1.00 0.00 H new ATOM 0 HA LYS A 501 7.787 5.552 1.306 1.00 0.00 H new ATOM 0 HB2 LYS A 501 5.722 7.772 0.916 1.00 0.00 H new ATOM 0 HB3 LYS A 501 5.805 6.812 2.380 1.00 0.00 H new ATOM 0 HG2 LYS A 501 7.947 8.700 1.337 1.00 0.00 H new ATOM 0 HG3 LYS A 501 6.877 8.988 2.695 1.00 0.00 H new ATOM 0 HD2 LYS A 501 7.950 7.118 3.952 1.00 0.00 H new ATOM 0 HD3 LYS A 501 9.006 6.800 2.590 1.00 0.00 H new ATOM 0 HE2 LYS A 501 9.927 9.120 2.740 1.00 0.00 H new ATOM 0 HE3 LYS A 501 8.844 9.476 4.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 11.046 8.908 4.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 9.926 7.742 5.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 10.975 7.397 4.090 1.00 0.00 H new ATOM 991 N LEU A 502 5.140 5.145 -0.546 1.00 0.00 N ATOM 992 CA LEU A 502 4.257 4.121 -1.057 1.00 0.00 C ATOM 993 C LEU A 502 5.011 3.014 -1.799 1.00 0.00 C ATOM 994 O LEU A 502 4.630 1.860 -1.667 1.00 0.00 O ATOM 995 CB LEU A 502 3.211 4.771 -1.972 1.00 0.00 C ATOM 996 CG LEU A 502 1.838 5.115 -1.362 1.00 0.00 C ATOM 997 CD1 LEU A 502 1.824 5.324 0.148 1.00 0.00 C ATOM 998 CD2 LEU A 502 1.275 6.401 -1.972 1.00 0.00 C ATOM 0 H LEU A 502 5.090 6.021 -1.066 1.00 0.00 H new ATOM 0 HA LEU A 502 3.766 3.644 -0.209 1.00 0.00 H new ATOM 0 HB2 LEU A 502 3.640 5.690 -2.371 1.00 0.00 H new ATOM 0 HB3 LEU A 502 3.044 4.103 -2.817 1.00 0.00 H new ATOM 0 HG LEU A 502 1.238 4.234 -1.591 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.811 5.561 0.473 1.00 0.00 H new ATOM 0 HD12 LEU A 502 2.161 4.414 0.644 1.00 0.00 H new ATOM 0 HD13 LEU A 502 2.490 6.147 0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 502 0.306 6.622 -1.525 1.00 0.00 H new ATOM 0 HD22 LEU A 502 1.960 7.226 -1.778 1.00 0.00 H new ATOM 0 HD23 LEU A 502 1.157 6.272 -3.048 1.00 0.00 H new ATOM 1010 N LEU A 503 6.102 3.303 -2.520 1.00 0.00 N ATOM 1011 CA LEU A 503 6.900 2.317 -3.221 1.00 0.00 C ATOM 1012 C LEU A 503 7.548 1.353 -2.224 1.00 0.00 C ATOM 1013 O LEU A 503 7.628 0.151 -2.489 1.00 0.00 O ATOM 1014 CB LEU A 503 7.939 3.062 -4.085 1.00 0.00 C ATOM 1015 CG LEU A 503 7.426 3.673 -5.402 1.00 0.00 C ATOM 1016 CD1 LEU A 503 5.932 3.551 -5.709 1.00 0.00 C ATOM 1017 CD2 LEU A 503 7.953 5.041 -5.826 1.00 0.00 C ATOM 0 H LEU A 503 6.454 4.254 -2.628 1.00 0.00 H new ATOM 0 HA LEU A 503 6.277 1.709 -3.877 1.00 0.00 H new ATOM 0 HB2 LEU A 503 8.372 3.861 -3.484 1.00 0.00 H new ATOM 0 HB3 LEU A 503 8.746 2.368 -4.322 1.00 0.00 H new ATOM 0 HG LEU A 503 7.935 2.956 -6.046 1.00 0.00 H new ATOM 0 HD11 LEU A 503 5.717 4.026 -6.666 1.00 0.00 H new ATOM 0 HD12 LEU A 503 5.655 2.498 -5.756 1.00 0.00 H new ATOM 0 HD13 LEU A 503 5.358 4.042 -4.924 1.00 0.00 H new ATOM 0 HD21 LEU A 503 7.496 5.330 -6.772 1.00 0.00 H new ATOM 0 HD22 LEU A 503 7.705 5.779 -5.063 1.00 0.00 H new ATOM 0 HD23 LEU A 503 9.035 4.993 -5.946 1.00 0.00 H new ATOM 1029 N LYS A 504 7.921 1.870 -1.041 1.00 0.00 N ATOM 1030 CA LYS A 504 8.311 1.065 0.120 1.00 0.00 C ATOM 1031 C LYS A 504 7.176 0.121 0.507 1.00 0.00 C ATOM 1032 O LYS A 504 7.331 -1.097 0.484 1.00 0.00 O ATOM 1033 CB LYS A 504 8.698 1.971 1.305 1.00 0.00 C ATOM 1034 CG LYS A 504 9.053 1.258 2.625 1.00 0.00 C ATOM 1035 CD LYS A 504 8.505 2.011 3.854 1.00 0.00 C ATOM 1036 CE LYS A 504 7.033 1.653 4.148 1.00 0.00 C ATOM 1037 NZ LYS A 504 6.926 0.473 5.049 1.00 0.00 N ATOM 0 H LYS A 504 7.959 2.874 -0.866 1.00 0.00 H new ATOM 0 HA LYS A 504 9.184 0.468 -0.145 1.00 0.00 H new ATOM 0 HB2 LYS A 504 9.551 2.580 1.005 1.00 0.00 H new ATOM 0 HB3 LYS A 504 7.871 2.654 1.497 1.00 0.00 H new ATOM 0 HG2 LYS A 504 8.649 0.246 2.610 1.00 0.00 H new ATOM 0 HG3 LYS A 504 10.136 1.168 2.708 1.00 0.00 H new ATOM 0 HD2 LYS A 504 9.116 1.774 4.725 1.00 0.00 H new ATOM 0 HD3 LYS A 504 8.590 3.085 3.688 1.00 0.00 H new ATOM 0 HE2 LYS A 504 6.534 2.507 4.606 1.00 0.00 H new ATOM 0 HE3 LYS A 504 6.514 1.445 3.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 504 5.923 0.261 5.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 504 7.380 -0.348 4.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 504 7.400 0.681 5.951 1.00 0.00 H new ATOM 1051 N ALA A 505 6.034 0.705 0.870 1.00 0.00 N ATOM 1052 CA ALA A 505 4.849 0.017 1.365 1.00 0.00 C ATOM 1053 C ALA A 505 4.457 -1.133 0.421 1.00 0.00 C ATOM 1054 O ALA A 505 4.312 -2.292 0.827 1.00 0.00 O ATOM 1055 CB ALA A 505 3.766 1.091 1.530 1.00 0.00 C ATOM 0 H ALA A 505 5.908 1.716 0.824 1.00 0.00 H new ATOM 0 HA ALA A 505 5.017 -0.466 2.327 1.00 0.00 H new ATOM 0 HB1 ALA A 505 2.850 0.630 1.901 1.00 0.00 H new ATOM 0 HB2 ALA A 505 4.106 1.845 2.240 1.00 0.00 H new ATOM 0 HB3 ALA A 505 3.571 1.562 0.567 1.00 0.00 H new ATOM 1061 N PHE A 506 4.402 -0.790 -0.869 1.00 0.00 N ATOM 1062 CA PHE A 506 4.119 -1.674 -1.976 1.00 0.00 C ATOM 1063 C PHE A 506 5.115 -2.793 -2.035 1.00 0.00 C ATOM 1064 O PHE A 506 4.709 -3.919 -1.804 1.00 0.00 O ATOM 1065 CB PHE A 506 4.046 -0.935 -3.314 1.00 0.00 C ATOM 1066 CG PHE A 506 2.900 0.040 -3.454 1.00 0.00 C ATOM 1067 CD1 PHE A 506 1.870 0.109 -2.496 1.00 0.00 C ATOM 1068 CD2 PHE A 506 2.856 0.869 -4.582 1.00 0.00 C ATOM 1069 CE1 PHE A 506 0.866 1.081 -2.599 1.00 0.00 C ATOM 1070 CE2 PHE A 506 1.812 1.793 -4.722 1.00 0.00 C ATOM 1071 CZ PHE A 506 0.845 1.935 -3.710 1.00 0.00 C ATOM 0 H PHE A 506 4.565 0.170 -1.174 1.00 0.00 H new ATOM 0 HA PHE A 506 3.131 -2.098 -1.797 1.00 0.00 H new ATOM 0 HB2 PHE A 506 4.981 -0.395 -3.463 1.00 0.00 H new ATOM 0 HB3 PHE A 506 3.973 -1.672 -4.114 1.00 0.00 H new ATOM 0 HD1 PHE A 506 1.854 -0.593 -1.675 1.00 0.00 H new ATOM 0 HD2 PHE A 506 3.622 0.796 -5.340 1.00 0.00 H new ATOM 0 HE1 PHE A 506 0.115 1.171 -1.829 1.00 0.00 H new ATOM 0 HE2 PHE A 506 1.749 2.400 -5.613 1.00 0.00 H new ATOM 0 HZ PHE A 506 0.088 2.701 -3.789 1.00 0.00 H new ATOM 1081 N GLY A 507 6.395 -2.560 -2.326 1.00 0.00 N ATOM 1082 CA GLY A 507 7.220 -3.718 -2.587 1.00 0.00 C ATOM 1083 C GLY A 507 7.553 -4.606 -1.392 1.00 0.00 C ATOM 1084 O GLY A 507 8.000 -5.729 -1.610 1.00 0.00 O ATOM 0 H GLY A 507 6.849 -1.649 -2.383 1.00 0.00 H new ATOM 0 HA2 GLY A 507 6.719 -4.330 -3.337 1.00 0.00 H new ATOM 0 HA3 GLY A 507 8.156 -3.376 -3.028 1.00 0.00 H new ATOM 1088 N ILE A 508 7.284 -4.170 -0.153 1.00 0.00 N ATOM 1089 CA ILE A 508 7.273 -5.091 0.986 1.00 0.00 C ATOM 1090 C ILE A 508 6.068 -6.014 0.793 1.00 0.00 C ATOM 1091 O ILE A 508 6.262 -7.218 0.744 1.00 0.00 O ATOM 1092 CB ILE A 508 7.237 -4.382 2.359 1.00 0.00 C ATOM 1093 CG1 ILE A 508 8.647 -3.998 2.864 1.00 0.00 C ATOM 1094 CG2 ILE A 508 6.664 -5.312 3.453 1.00 0.00 C ATOM 1095 CD1 ILE A 508 9.310 -2.823 2.148 1.00 0.00 C ATOM 0 H ILE A 508 7.074 -3.200 0.081 1.00 0.00 H new ATOM 0 HA ILE A 508 8.206 -5.654 1.004 1.00 0.00 H new ATOM 0 HB ILE A 508 6.621 -3.497 2.200 1.00 0.00 H new ATOM 0 HG12 ILE A 508 8.581 -3.762 3.926 1.00 0.00 H new ATOM 0 HG13 ILE A 508 9.296 -4.869 2.771 1.00 0.00 H new ATOM 0 HG21 ILE A 508 6.651 -4.786 4.408 1.00 0.00 H new ATOM 0 HG22 ILE A 508 5.649 -5.605 3.186 1.00 0.00 H new ATOM 0 HG23 ILE A 508 7.288 -6.202 3.538 1.00 0.00 H new ATOM 0 HD11 ILE A 508 10.293 -2.640 2.582 1.00 0.00 H new ATOM 0 HD12 ILE A 508 9.418 -3.057 1.089 1.00 0.00 H new ATOM 0 HD13 ILE A 508 8.692 -1.932 2.262 1.00 0.00 H new ATOM 1107 N VAL A 509 4.841 -5.506 0.622 1.00 0.00 N ATOM 1108 CA VAL A 509 3.671 -6.380 0.449 1.00 0.00 C ATOM 1109 C VAL A 509 3.770 -7.163 -0.861 1.00 0.00 C ATOM 1110 O VAL A 509 3.334 -8.304 -0.914 1.00 0.00 O ATOM 1111 CB VAL A 509 2.357 -5.602 0.620 1.00 0.00 C ATOM 1112 CG1 VAL A 509 2.082 -4.621 -0.490 1.00 0.00 C ATOM 1113 CG2 VAL A 509 1.128 -6.497 0.727 1.00 0.00 C ATOM 0 H VAL A 509 4.632 -4.508 0.600 1.00 0.00 H new ATOM 0 HA VAL A 509 3.664 -7.126 1.244 1.00 0.00 H new ATOM 0 HB VAL A 509 2.518 -5.069 1.557 1.00 0.00 H new ATOM 0 HG11 VAL A 509 1.138 -4.111 -0.299 1.00 0.00 H new ATOM 0 HG12 VAL A 509 2.888 -3.888 -0.536 1.00 0.00 H new ATOM 0 HG13 VAL A 509 2.021 -5.153 -1.439 1.00 0.00 H new ATOM 0 HG21 VAL A 509 0.238 -5.880 0.846 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.035 -7.097 -0.178 1.00 0.00 H new ATOM 0 HG23 VAL A 509 1.231 -7.155 1.590 1.00 0.00 H new ATOM 1123 N ILE A 510 4.434 -6.631 -1.893 1.00 0.00 N ATOM 1124 CA ILE A 510 4.811 -7.375 -3.103 1.00 0.00 C ATOM 1125 C ILE A 510 5.657 -8.603 -2.784 1.00 0.00 C ATOM 1126 O ILE A 510 5.366 -9.686 -3.280 1.00 0.00 O ATOM 1127 CB ILE A 510 5.431 -6.508 -4.189 1.00 0.00 C ATOM 1128 CG1 ILE A 510 4.303 -5.574 -4.692 1.00 0.00 C ATOM 1129 CG2 ILE A 510 6.035 -7.325 -5.350 1.00 0.00 C ATOM 1130 CD1 ILE A 510 4.699 -4.635 -5.827 1.00 0.00 C ATOM 0 H ILE A 510 4.730 -5.655 -1.913 1.00 0.00 H new ATOM 0 HA ILE A 510 3.873 -7.735 -3.527 1.00 0.00 H new ATOM 0 HB ILE A 510 6.271 -5.948 -3.779 1.00 0.00 H new ATOM 0 HG12 ILE A 510 3.465 -6.187 -5.024 1.00 0.00 H new ATOM 0 HG13 ILE A 510 3.947 -4.976 -3.853 1.00 0.00 H new ATOM 0 HG21 ILE A 510 6.460 -6.647 -6.090 1.00 0.00 H new ATOM 0 HG22 ILE A 510 6.817 -7.980 -4.966 1.00 0.00 H new ATOM 0 HG23 ILE A 510 5.255 -7.927 -5.816 1.00 0.00 H new ATOM 0 HD11 ILE A 510 3.842 -4.023 -6.108 1.00 0.00 H new ATOM 0 HD12 ILE A 510 5.514 -3.990 -5.498 1.00 0.00 H new ATOM 0 HD13 ILE A 510 5.025 -5.221 -6.687 1.00 0.00 H new ATOM 1142 N ASP A 511 6.627 -8.491 -1.879 1.00 0.00 N ATOM 1143 CA ASP A 511 7.553 -9.557 -1.450 1.00 0.00 C ATOM 1144 C ASP A 511 6.971 -10.618 -0.559 1.00 0.00 C ATOM 1145 O ASP A 511 7.644 -11.420 0.087 1.00 0.00 O ATOM 1146 CB ASP A 511 8.716 -8.905 -0.728 1.00 0.00 C ATOM 1147 CG ASP A 511 10.012 -9.734 -0.686 1.00 0.00 C ATOM 1148 OD1 ASP A 511 10.357 -10.376 -1.708 1.00 0.00 O ATOM 1149 OD2 ASP A 511 10.717 -9.707 0.352 1.00 0.00 O ATOM 0 H ASP A 511 6.804 -7.611 -1.395 1.00 0.00 H new ATOM 0 HA ASP A 511 7.843 -10.080 -2.361 1.00 0.00 H new ATOM 0 HB2 ASP A 511 8.930 -7.950 -1.207 1.00 0.00 H new ATOM 0 HB3 ASP A 511 8.411 -8.687 0.295 1.00 0.00 H new ATOM 1154 N TYR A 512 5.667 -10.572 -0.576 1.00 0.00 N ATOM 1155 CA TYR A 512 4.779 -11.203 0.322 1.00 0.00 C ATOM 1156 C TYR A 512 3.521 -11.634 -0.426 1.00 0.00 C ATOM 1157 O TYR A 512 2.877 -12.589 -0.033 1.00 0.00 O ATOM 1158 CB TYR A 512 4.425 -10.151 1.357 1.00 0.00 C ATOM 1159 CG TYR A 512 5.068 -10.088 2.725 1.00 0.00 C ATOM 1160 CD1 TYR A 512 6.306 -9.437 2.848 1.00 0.00 C ATOM 1161 CD2 TYR A 512 4.378 -10.490 3.879 1.00 0.00 C ATOM 1162 CE1 TYR A 512 6.881 -9.194 4.105 1.00 0.00 C ATOM 1163 CE2 TYR A 512 4.976 -10.326 5.146 1.00 0.00 C ATOM 1164 CZ TYR A 512 6.227 -9.677 5.262 1.00 0.00 C ATOM 1165 OH TYR A 512 6.770 -9.460 6.492 1.00 0.00 O ATOM 0 H TYR A 512 5.168 -10.040 -1.289 1.00 0.00 H new ATOM 0 HA TYR A 512 5.221 -12.088 0.780 1.00 0.00 H new ATOM 0 HB2 TYR A 512 4.603 -9.184 0.887 1.00 0.00 H new ATOM 0 HB3 TYR A 512 3.351 -10.231 1.524 1.00 0.00 H new ATOM 0 HD1 TYR A 512 6.826 -9.117 1.957 1.00 0.00 H new ATOM 0 HD2 TYR A 512 3.392 -10.924 3.797 1.00 0.00 H new ATOM 0 HE1 TYR A 512 7.808 -8.647 4.187 1.00 0.00 H new ATOM 0 HE2 TYR A 512 4.477 -10.697 6.029 1.00 0.00 H new ATOM 0 HH TYR A 512 6.194 -9.856 7.179 1.00 0.00 H new ATOM 1175 N LYS A 513 3.166 -10.976 -1.533 1.00 0.00 N ATOM 1176 CA LYS A 513 1.992 -11.273 -2.347 1.00 0.00 C ATOM 1177 C LYS A 513 2.407 -12.043 -3.582 1.00 0.00 C ATOM 1178 O LYS A 513 1.821 -13.069 -3.911 1.00 0.00 O ATOM 1179 CB LYS A 513 1.337 -9.922 -2.625 1.00 0.00 C ATOM 1180 CG LYS A 513 0.292 -9.841 -3.731 1.00 0.00 C ATOM 1181 CD LYS A 513 0.912 -9.815 -5.130 1.00 0.00 C ATOM 1182 CE LYS A 513 -0.097 -9.392 -6.198 1.00 0.00 C ATOM 1183 NZ LYS A 513 -1.076 -10.462 -6.523 1.00 0.00 N ATOM 0 H LYS A 513 3.710 -10.194 -1.897 1.00 0.00 H new ATOM 0 HA LYS A 513 1.266 -11.920 -1.855 1.00 0.00 H new ATOM 0 HB2 LYS A 513 0.870 -9.582 -1.701 1.00 0.00 H new ATOM 0 HB3 LYS A 513 2.128 -9.211 -2.862 1.00 0.00 H new ATOM 0 HG2 LYS A 513 -0.381 -10.695 -3.652 1.00 0.00 H new ATOM 0 HG3 LYS A 513 -0.312 -8.945 -3.589 1.00 0.00 H new ATOM 0 HD2 LYS A 513 1.758 -9.128 -5.139 1.00 0.00 H new ATOM 0 HD3 LYS A 513 1.302 -10.804 -5.372 1.00 0.00 H new ATOM 0 HE2 LYS A 513 -0.633 -8.508 -5.854 1.00 0.00 H new ATOM 0 HE3 LYS A 513 0.438 -9.108 -7.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 -1.377 -10.368 -7.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 -0.633 -11.392 -6.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 -1.904 -10.376 -5.900 1.00 0.00 H new ATOM 1197 N GLU A 514 3.477 -11.575 -4.225 1.00 0.00 N ATOM 1198 CA GLU A 514 4.209 -12.320 -5.245 1.00 0.00 C ATOM 1199 C GLU A 514 4.883 -13.563 -4.609 1.00 0.00 C ATOM 1200 O GLU A 514 5.430 -14.409 -5.318 1.00 0.00 O ATOM 1201 CB GLU A 514 5.227 -11.347 -5.875 1.00 0.00 C ATOM 1202 CG GLU A 514 5.590 -11.748 -7.307 1.00 0.00 C ATOM 1203 CD GLU A 514 6.570 -10.751 -7.957 1.00 0.00 C ATOM 1204 OE1 GLU A 514 6.116 -9.717 -8.504 1.00 0.00 O ATOM 1205 OE2 GLU A 514 7.798 -11.013 -7.957 1.00 0.00 O ATOM 0 H GLU A 514 3.865 -10.649 -4.047 1.00 0.00 H new ATOM 0 HA GLU A 514 3.548 -12.698 -6.025 1.00 0.00 H new ATOM 0 HB2 GLU A 514 4.813 -10.338 -5.874 1.00 0.00 H new ATOM 0 HB3 GLU A 514 6.130 -11.322 -5.265 1.00 0.00 H new ATOM 0 HG2 GLU A 514 6.035 -12.743 -7.303 1.00 0.00 H new ATOM 0 HG3 GLU A 514 4.682 -11.808 -7.908 1.00 0.00 H new ATOM 1212 N ARG A 515 4.832 -13.677 -3.262 1.00 0.00 N ATOM 1213 CA ARG A 515 5.421 -14.778 -2.462 1.00 0.00 C ATOM 1214 C ARG A 515 4.396 -15.651 -1.741 1.00 0.00 C ATOM 1215 O ARG A 515 4.622 -16.857 -1.683 1.00 0.00 O ATOM 1216 CB ARG A 515 6.450 -14.259 -1.454 1.00 0.00 C ATOM 1217 CG ARG A 515 7.836 -13.940 -2.035 1.00 0.00 C ATOM 1218 CD ARG A 515 7.792 -12.949 -3.200 1.00 0.00 C ATOM 1219 NE ARG A 515 9.068 -12.248 -3.362 1.00 0.00 N ATOM 1220 CZ ARG A 515 9.673 -11.883 -4.473 1.00 0.00 C ATOM 1221 NH1 ARG A 515 9.296 -12.297 -5.647 1.00 0.00 N ATOM 1222 NH2 ARG A 515 10.673 -11.060 -4.393 1.00 0.00 N ATOM 0 H ARG A 515 4.364 -12.981 -2.681 1.00 0.00 H new ATOM 0 HA ARG A 515 5.914 -15.413 -3.198 1.00 0.00 H new ATOM 0 HB2 ARG A 515 6.054 -13.357 -0.987 1.00 0.00 H new ATOM 0 HB3 ARG A 515 6.567 -15.002 -0.665 1.00 0.00 H new ATOM 0 HG2 ARG A 515 8.468 -13.534 -1.245 1.00 0.00 H new ATOM 0 HG3 ARG A 515 8.302 -14.866 -2.372 1.00 0.00 H new ATOM 0 HD2 ARG A 515 7.549 -13.480 -4.120 1.00 0.00 H new ATOM 0 HD3 ARG A 515 6.997 -12.223 -3.031 1.00 0.00 H new ATOM 0 HE ARG A 515 9.554 -12.010 -2.497 1.00 0.00 H new ATOM 0 HH11 ARG A 515 8.501 -12.931 -5.733 1.00 0.00 H new ATOM 0 HH12 ARG A 515 9.795 -11.988 -6.481 1.00 0.00 H new ATOM 0 HH21 ARG A 515 10.974 -10.711 -3.483 1.00 0.00 H new ATOM 0 HH22 ARG A 515 11.158 -10.763 -5.240 1.00 0.00 H new ATOM 1236 N ASP A 516 3.321 -15.054 -1.202 1.00 0.00 N ATOM 1237 CA ASP A 516 2.083 -15.679 -0.653 1.00 0.00 C ATOM 1238 C ASP A 516 2.034 -15.731 0.900 1.00 0.00 C ATOM 1239 O ASP A 516 1.398 -16.580 1.524 1.00 0.00 O ATOM 1240 CB ASP A 516 1.791 -17.034 -1.318 1.00 0.00 C ATOM 1241 CG ASP A 516 0.362 -17.565 -1.094 1.00 0.00 C ATOM 1242 OD1 ASP A 516 -0.613 -16.790 -1.226 1.00 0.00 O ATOM 1243 OD2 ASP A 516 0.208 -18.784 -0.834 1.00 0.00 O ATOM 0 H ASP A 516 3.281 -14.037 -1.128 1.00 0.00 H new ATOM 0 HA ASP A 516 1.264 -15.012 -0.920 1.00 0.00 H new ATOM 0 HB2 ASP A 516 1.967 -16.943 -2.390 1.00 0.00 H new ATOM 0 HB3 ASP A 516 2.501 -17.770 -0.940 1.00 0.00 H new ATOM 1248 N LEU A 517 2.751 -14.793 1.510 1.00 0.00 N ATOM 1249 CA LEU A 517 3.038 -14.482 2.915 1.00 0.00 C ATOM 1250 C LEU A 517 1.889 -13.743 3.624 1.00 0.00 C ATOM 1251 O LEU A 517 1.799 -13.764 4.854 1.00 0.00 O ATOM 1252 CB LEU A 517 4.283 -13.571 2.849 1.00 0.00 C ATOM 1253 CG LEU A 517 5.546 -14.219 2.246 1.00 0.00 C ATOM 1254 CD1 LEU A 517 6.803 -13.448 2.650 1.00 0.00 C ATOM 1255 CD2 LEU A 517 5.780 -15.680 2.635 1.00 0.00 C ATOM 0 H LEU A 517 3.231 -14.110 0.923 1.00 0.00 H new ATOM 0 HA LEU A 517 3.183 -15.397 3.490 1.00 0.00 H new ATOM 0 HB2 LEU A 517 4.034 -12.686 2.263 1.00 0.00 H new ATOM 0 HB3 LEU A 517 4.517 -13.230 3.858 1.00 0.00 H new ATOM 0 HG LEU A 517 5.362 -14.183 1.172 1.00 0.00 H new ATOM 0 HD11 LEU A 517 7.679 -13.926 2.212 1.00 0.00 H new ATOM 0 HD12 LEU A 517 6.731 -12.421 2.291 1.00 0.00 H new ATOM 0 HD13 LEU A 517 6.896 -13.447 3.736 1.00 0.00 H new ATOM 0 HD21 LEU A 517 6.692 -16.041 2.160 1.00 0.00 H new ATOM 0 HD22 LEU A 517 5.880 -15.757 3.718 1.00 0.00 H new ATOM 0 HD23 LEU A 517 4.935 -16.284 2.305 1.00 0.00 H new ATOM 1267 N ILE A 518 1.014 -13.099 2.846 1.00 0.00 N ATOM 1268 CA ILE A 518 -0.263 -12.504 3.271 1.00 0.00 C ATOM 1269 C ILE A 518 -1.201 -13.566 3.903 1.00 0.00 C ATOM 1270 O ILE A 518 -0.996 -14.766 3.739 1.00 0.00 O ATOM 1271 CB ILE A 518 -0.930 -11.847 2.037 1.00 0.00 C ATOM 1272 CG1 ILE A 518 -0.029 -11.003 1.117 1.00 0.00 C ATOM 1273 CG2 ILE A 518 -2.145 -10.989 2.409 1.00 0.00 C ATOM 1274 CD1 ILE A 518 0.716 -9.868 1.813 1.00 0.00 C ATOM 0 H ILE A 518 1.184 -12.970 1.849 1.00 0.00 H new ATOM 0 HA ILE A 518 -0.074 -11.753 4.038 1.00 0.00 H new ATOM 0 HB ILE A 518 -1.218 -12.730 1.467 1.00 0.00 H new ATOM 0 HG12 ILE A 518 0.700 -11.661 0.644 1.00 0.00 H new ATOM 0 HG13 ILE A 518 -0.642 -10.581 0.320 1.00 0.00 H new ATOM 0 HG21 ILE A 518 -2.573 -10.553 1.506 1.00 0.00 H new ATOM 0 HG22 ILE A 518 -2.893 -11.611 2.901 1.00 0.00 H new ATOM 0 HG23 ILE A 518 -1.834 -10.192 3.085 1.00 0.00 H new ATOM 0 HD11 ILE A 518 1.324 -9.331 1.085 1.00 0.00 H new ATOM 0 HD12 ILE A 518 -0.003 -9.182 2.262 1.00 0.00 H new ATOM 0 HD13 ILE A 518 1.360 -10.279 2.591 1.00 0.00 H new ATOM 1286 N ASP A 519 -2.284 -13.153 4.570 1.00 0.00 N ATOM 1287 CA ASP A 519 -3.307 -14.027 5.190 1.00 0.00 C ATOM 1288 C ASP A 519 -4.221 -14.819 4.229 1.00 0.00 C ATOM 1289 O ASP A 519 -5.125 -15.511 4.699 1.00 0.00 O ATOM 1290 CB ASP A 519 -4.161 -13.205 6.176 1.00 0.00 C ATOM 1291 CG ASP A 519 -3.477 -12.762 7.485 1.00 0.00 C ATOM 1292 OD1 ASP A 519 -2.424 -13.326 7.867 1.00 0.00 O ATOM 1293 OD2 ASP A 519 -4.044 -11.870 8.167 1.00 0.00 O ATOM 0 H ASP A 519 -2.487 -12.162 4.703 1.00 0.00 H new ATOM 0 HA ASP A 519 -2.731 -14.800 5.698 1.00 0.00 H new ATOM 0 HB2 ASP A 519 -4.514 -12.313 5.658 1.00 0.00 H new ATOM 0 HB3 ASP A 519 -5.042 -13.793 6.435 1.00 0.00 H new ATOM 1298 N ARG A 520 -4.023 -14.745 2.902 1.00 0.00 N ATOM 1299 CA ARG A 520 -4.786 -15.394 1.813 1.00 0.00 C ATOM 1300 C ARG A 520 -6.227 -14.892 1.651 1.00 0.00 C ATOM 1301 O ARG A 520 -6.747 -14.864 0.540 1.00 0.00 O ATOM 1302 CB ARG A 520 -4.715 -16.924 1.925 1.00 0.00 C ATOM 1303 CG ARG A 520 -3.474 -17.539 1.258 1.00 0.00 C ATOM 1304 CD ARG A 520 -2.152 -17.221 1.963 1.00 0.00 C ATOM 1305 NE ARG A 520 -2.122 -17.789 3.328 1.00 0.00 N ATOM 1306 CZ ARG A 520 -1.073 -18.021 4.098 1.00 0.00 C ATOM 1307 NH1 ARG A 520 0.149 -17.774 3.731 1.00 0.00 N ATOM 1308 NH2 ARG A 520 -1.240 -18.537 5.284 1.00 0.00 N ATOM 0 H ARG A 520 -3.260 -14.182 2.527 1.00 0.00 H new ATOM 0 HA ARG A 520 -4.291 -15.092 0.890 1.00 0.00 H new ATOM 0 HB2 ARG A 520 -4.725 -17.202 2.979 1.00 0.00 H new ATOM 0 HB3 ARG A 520 -5.609 -17.354 1.473 1.00 0.00 H new ATOM 0 HG2 ARG A 520 -3.598 -18.621 1.216 1.00 0.00 H new ATOM 0 HG3 ARG A 520 -3.417 -17.185 0.229 1.00 0.00 H new ATOM 0 HD2 ARG A 520 -1.322 -17.622 1.382 1.00 0.00 H new ATOM 0 HD3 ARG A 520 -2.014 -16.141 2.013 1.00 0.00 H new ATOM 0 HE ARG A 520 -3.028 -18.033 3.727 1.00 0.00 H new ATOM 0 HH11 ARG A 520 0.335 -17.382 2.808 1.00 0.00 H new ATOM 0 HH12 ARG A 520 0.922 -17.973 4.366 1.00 0.00 H new ATOM 0 HH21 ARG A 520 -2.178 -18.761 5.615 1.00 0.00 H new ATOM 0 HH22 ARG A 520 -0.432 -18.717 5.880 1.00 0.00 H new ATOM 1322 N SER A 521 -6.816 -14.368 2.719 1.00 0.00 N ATOM 1323 CA SER A 521 -8.096 -13.645 2.744 1.00 0.00 C ATOM 1324 C SER A 521 -7.990 -12.163 2.339 1.00 0.00 C ATOM 1325 O SER A 521 -8.998 -11.453 2.318 1.00 0.00 O ATOM 1326 CB SER A 521 -8.724 -13.747 4.142 1.00 0.00 C ATOM 1327 OG SER A 521 -8.937 -15.107 4.493 1.00 0.00 O ATOM 0 H SER A 521 -6.396 -14.436 3.646 1.00 0.00 H new ATOM 0 HA SER A 521 -8.726 -14.125 1.995 1.00 0.00 H new ATOM 0 HB2 SER A 521 -8.072 -13.274 4.876 1.00 0.00 H new ATOM 0 HB3 SER A 521 -9.671 -13.207 4.162 1.00 0.00 H new ATOM 0 HG SER A 521 -9.336 -15.156 5.387 1.00 0.00 H new ATOM 1333 N ALA A 522 -6.786 -11.666 2.020 1.00 0.00 N ATOM 1334 CA ALA A 522 -6.586 -10.273 1.584 1.00 0.00 C ATOM 1335 C ALA A 522 -6.860 -10.113 0.093 1.00 0.00 C ATOM 1336 O ALA A 522 -7.227 -9.047 -0.388 1.00 0.00 O ATOM 1337 CB ALA A 522 -5.145 -9.867 1.843 1.00 0.00 C ATOM 0 H ALA A 522 -5.926 -12.214 2.056 1.00 0.00 H new ATOM 0 HA ALA A 522 -7.279 -9.645 2.144 1.00 0.00 H new ATOM 0 HB1 ALA A 522 -4.994 -8.837 1.521 1.00 0.00 H new ATOM 0 HB2 ALA A 522 -4.929 -9.950 2.908 1.00 0.00 H new ATOM 0 HB3 ALA A 522 -4.476 -10.523 1.285 1.00 0.00 H new ATOM 1343 N TYR A 523 -6.661 -11.195 -0.633 1.00 0.00 N ATOM 1344 CA TYR A 523 -6.896 -11.344 -2.047 1.00 0.00 C ATOM 1345 C TYR A 523 -8.395 -11.218 -2.426 1.00 0.00 C ATOM 1346 O TYR A 523 -8.702 -11.258 -3.639 1.00 0.00 O ATOM 1347 CB TYR A 523 -6.309 -12.734 -2.340 1.00 0.00 C ATOM 1348 CG TYR A 523 -4.792 -12.865 -2.294 1.00 0.00 C ATOM 1349 CD1 TYR A 523 -4.145 -13.226 -1.096 1.00 0.00 C ATOM 1350 CD2 TYR A 523 -4.028 -12.705 -3.467 1.00 0.00 C ATOM 1351 CE1 TYR A 523 -2.757 -13.434 -1.063 1.00 0.00 C ATOM 1352 CE2 TYR A 523 -2.630 -12.898 -3.439 1.00 0.00 C ATOM 1353 CZ TYR A 523 -1.990 -13.262 -2.233 1.00 0.00 C ATOM 1354 OH TYR A 523 -0.647 -13.463 -2.188 1.00 0.00 O ATOM 1355 OXT TYR A 523 -9.257 -11.055 -1.525 1.00 0.00 O ATOM 0 H TYR A 523 -6.304 -12.054 -0.214 1.00 0.00 H new ATOM 0 HA TYR A 523 -6.435 -10.557 -2.644 1.00 0.00 H new ATOM 0 HB2 TYR A 523 -6.732 -13.439 -1.624 1.00 0.00 H new ATOM 0 HB3 TYR A 523 -6.646 -13.043 -3.329 1.00 0.00 H new ATOM 0 HD1 TYR A 523 -4.724 -13.344 -0.192 1.00 0.00 H new ATOM 0 HD2 TYR A 523 -4.514 -12.433 -4.392 1.00 0.00 H new ATOM 0 HE1 TYR A 523 -2.277 -13.726 -0.141 1.00 0.00 H new ATOM 0 HE2 TYR A 523 -2.049 -12.767 -4.340 1.00 0.00 H new ATOM 0 HH TYR A 523 -0.241 -13.149 -3.023 1.00 0.00 H new