USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 881 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 515 SER OG : rot 69:sc= -0.0229 USER MOD Set 1.2: A 549 ASN : amide:sc= -1.02 K(o=-1,f=1.3) USER MOD Single : A 500 SER OG : rot 106:sc= 1.97 USER MOD Single : A 501 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 502 ASN : amide:sc= -1.71 K(o=-1.7,f=-2.2) USER MOD Single : A 516 THR OG1 : rot -103:sc= 0.411 USER MOD Single : A 522 THR OG1 : rot -65:sc= -0.0465 USER MOD Single : A 525 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 527 SER OG : rot 60:sc= 1.26 USER MOD Single : A 532 HIS : no HE2:sc= 0.244 K(o=0.24,f=-4!) USER MOD Single : A 537 THR OG1 : rot -51:sc= -0.598 USER MOD Single : A 538 CYS SG : rot 180:sc= -0.87! USER MOD Single : A 539 ASN : amide:sc= -3.11! C(o=-3.1!,f=-19!) USER MOD Single : A 543 THR OG1 : rot 180:sc= 0 USER MOD Single : A 544 THR OG1 : rot 180:sc= 0 USER MOD Single : A 545 SER OG : rot 130:sc= -1.64 USER MOD Single : A 547 MET CE :methyl -105:sc= -0.0296 (180deg=-0.695) USER MOD Single : A 554 THR OG1 : rot 180:sc= -0.558 USER MOD Single : A 559 LYS NZ :NH3+ 162:sc=-0.00171 (180deg=-0.168) USER MOD Single : A 560 THR OG1 : rot 180:sc= 0.00067 USER MOD Single : A 574 TYR OH : rot 180:sc= 0 USER MOD Single : A 575 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 577 GLN : amide:sc= -2.4! K(o=-2.4!,f=-0.14) USER MOD Single : A 580 GLN : amide:sc= -0.0717 X(o=-0.072,f=-0.22) USER MOD Single : A 587 THR OG1 : rot 180:sc= 0 USER MOD Single : A 589 SER OG : rot 180:sc= 0 USER MOD Single : A 593 HIS : no HD1:sc= -4.88! C(o=-4.9!,f=-9.4!) USER MOD Single : A 595 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 596 THR OG1 : rot 180:sc= 0.0209 USER MOD Single : A 597 SER OG : rot -160:sc= -0.134 USER MOD Single : A 605 SER OG : rot 180:sc= 0 USER MOD Single : A 606 CYS SG : rot -54:sc= -0.116 USER MOD ----------------------------------------------------------------- ATOM 112 N ILE A 490 -13.018 1.733 -10.127 1.00 0.00 N ATOM 113 CA ILE A 490 -11.988 2.376 -9.318 1.00 0.00 C ATOM 114 C ILE A 490 -11.687 3.773 -9.851 1.00 0.00 C ATOM 115 O ILE A 490 -11.384 4.689 -9.087 1.00 0.00 O ATOM 116 CB ILE A 490 -10.708 1.536 -9.335 1.00 0.00 C ATOM 117 CG1 ILE A 490 -10.976 0.171 -8.677 1.00 0.00 C ATOM 118 CG2 ILE A 490 -9.597 2.272 -8.579 1.00 0.00 C ATOM 119 CD1 ILE A 490 -10.795 0.266 -7.158 1.00 0.00 C ATOM 0 HA ILE A 490 -12.354 2.458 -8.295 1.00 0.00 H new ATOM 0 HB ILE A 490 -10.393 1.379 -10.366 1.00 0.00 H new ATOM 0 HG12 ILE A 490 -11.988 -0.159 -8.909 1.00 0.00 H new ATOM 0 HG13 ILE A 490 -10.295 -0.576 -9.085 1.00 0.00 H new ATOM 0 HG21 ILE A 490 -8.688 1.671 -8.593 1.00 0.00 H new ATOM 0 HG22 ILE A 490 -9.405 3.232 -9.058 1.00 0.00 H new ATOM 0 HG23 ILE A 490 -9.907 2.437 -7.547 1.00 0.00 H new ATOM 0 HD11 ILE A 490 -10.988 -0.707 -6.707 1.00 0.00 H new ATOM 0 HD12 ILE A 490 -9.774 0.575 -6.932 1.00 0.00 H new ATOM 0 HD13 ILE A 490 -11.494 0.998 -6.753 1.00 0.00 H new ATOM 131 N LEU A 491 -11.776 3.930 -11.168 1.00 0.00 N ATOM 132 CA LEU A 491 -11.512 5.221 -11.793 1.00 0.00 C ATOM 133 C LEU A 491 -12.605 6.221 -11.421 1.00 0.00 C ATOM 134 O LEU A 491 -12.360 7.184 -10.693 1.00 0.00 O ATOM 135 CB LEU A 491 -11.445 5.057 -13.317 1.00 0.00 C ATOM 136 CG LEU A 491 -10.454 6.068 -13.913 1.00 0.00 C ATOM 137 CD1 LEU A 491 -9.016 5.573 -13.717 1.00 0.00 C ATOM 138 CD2 LEU A 491 -10.732 6.227 -15.410 1.00 0.00 C ATOM 0 H LEU A 491 -12.027 3.186 -11.819 1.00 0.00 H new ATOM 0 HA LEU A 491 -10.555 5.599 -11.433 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -11.137 4.042 -13.568 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -12.434 5.206 -13.751 1.00 0.00 H new ATOM 0 HG LEU A 491 -10.575 7.026 -13.408 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -8.321 6.297 -14.143 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -8.813 5.458 -12.652 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -8.891 4.612 -14.216 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -10.030 6.944 -15.836 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -10.613 5.264 -15.906 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -11.751 6.586 -15.555 1.00 0.00 H new ATOM 150 N GLY A 492 -13.814 5.981 -11.920 1.00 0.00 N ATOM 151 CA GLY A 492 -14.935 6.865 -11.623 1.00 0.00 C ATOM 152 C GLY A 492 -14.987 7.177 -10.132 1.00 0.00 C ATOM 153 O GLY A 492 -15.319 8.292 -9.730 1.00 0.00 O ATOM 0 H GLY A 492 -14.041 5.191 -12.525 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -14.837 7.790 -12.191 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -15.868 6.396 -11.935 1.00 0.00 H new ATOM 157 N LEU A 493 -14.647 6.183 -9.318 1.00 0.00 N ATOM 158 CA LEU A 493 -14.647 6.357 -7.871 1.00 0.00 C ATOM 159 C LEU A 493 -13.307 6.924 -7.412 1.00 0.00 C ATOM 160 O LEU A 493 -13.176 7.404 -6.287 1.00 0.00 O ATOM 161 CB LEU A 493 -14.904 5.010 -7.183 1.00 0.00 C ATOM 162 CG LEU A 493 -15.448 5.242 -5.766 1.00 0.00 C ATOM 163 CD1 LEU A 493 -16.970 5.405 -5.812 1.00 0.00 C ATOM 164 CD2 LEU A 493 -15.098 4.043 -4.879 1.00 0.00 C ATOM 0 H LEU A 493 -14.369 5.254 -9.634 1.00 0.00 H new ATOM 0 HA LEU A 493 -15.439 7.055 -7.599 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -15.617 4.425 -7.764 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -13.980 4.433 -7.137 1.00 0.00 H new ATOM 0 HG LEU A 493 -14.998 6.147 -5.357 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -17.349 5.569 -4.803 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -17.226 6.259 -6.439 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -17.420 4.503 -6.226 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -15.485 4.209 -3.874 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -15.545 3.140 -5.295 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -14.015 3.926 -4.836 1.00 0.00 H new ATOM 176 N GLY A 494 -12.315 6.864 -8.297 1.00 0.00 N ATOM 177 CA GLY A 494 -10.987 7.375 -7.979 1.00 0.00 C ATOM 178 C GLY A 494 -10.945 8.893 -8.102 1.00 0.00 C ATOM 179 O GLY A 494 -9.954 9.528 -7.742 1.00 0.00 O ATOM 0 H GLY A 494 -12.405 6.469 -9.233 1.00 0.00 H new ATOM 0 HA2 GLY A 494 -10.713 7.080 -6.966 1.00 0.00 H new ATOM 0 HA3 GLY A 494 -10.252 6.931 -8.650 1.00 0.00 H new ATOM 183 N ILE A 495 -12.029 9.471 -8.613 1.00 0.00 N ATOM 184 CA ILE A 495 -12.114 10.920 -8.780 1.00 0.00 C ATOM 185 C ILE A 495 -13.273 11.483 -7.960 1.00 0.00 C ATOM 186 O ILE A 495 -13.278 12.661 -7.601 1.00 0.00 O ATOM 187 CB ILE A 495 -12.315 11.266 -10.256 1.00 0.00 C ATOM 188 CG1 ILE A 495 -12.528 12.775 -10.402 1.00 0.00 C ATOM 189 CG2 ILE A 495 -13.541 10.525 -10.793 1.00 0.00 C ATOM 190 CD1 ILE A 495 -12.369 13.175 -11.869 1.00 0.00 C ATOM 0 H ILE A 495 -12.858 8.961 -8.918 1.00 0.00 H new ATOM 0 HA ILE A 495 -11.183 11.364 -8.429 1.00 0.00 H new ATOM 0 HB ILE A 495 -11.433 10.966 -10.822 1.00 0.00 H new ATOM 0 HG12 ILE A 495 -13.521 13.049 -10.045 1.00 0.00 H new ATOM 0 HG13 ILE A 495 -11.808 13.315 -9.787 1.00 0.00 H new ATOM 0 HG21 ILE A 495 -13.684 10.772 -11.845 1.00 0.00 H new ATOM 0 HG22 ILE A 495 -13.391 9.450 -10.690 1.00 0.00 H new ATOM 0 HG23 ILE A 495 -14.423 10.824 -10.227 1.00 0.00 H new ATOM 0 HD11 ILE A 495 -12.521 14.249 -11.972 1.00 0.00 H new ATOM 0 HD12 ILE A 495 -11.367 12.916 -12.210 1.00 0.00 H new ATOM 0 HD13 ILE A 495 -13.106 12.645 -12.473 1.00 0.00 H new ATOM 202 N ALA A 496 -14.252 10.633 -7.670 1.00 0.00 N ATOM 203 CA ALA A 496 -15.416 11.051 -6.894 1.00 0.00 C ATOM 204 C ALA A 496 -15.097 11.080 -5.403 1.00 0.00 C ATOM 205 O ALA A 496 -15.237 12.112 -4.746 1.00 0.00 O ATOM 206 CB ALA A 496 -16.576 10.089 -7.141 1.00 0.00 C ATOM 0 H ALA A 496 -14.264 9.655 -7.959 1.00 0.00 H new ATOM 0 HA ALA A 496 -15.692 12.056 -7.213 1.00 0.00 H new ATOM 0 HB1 ALA A 496 -17.442 10.406 -6.559 1.00 0.00 H new ATOM 0 HB2 ALA A 496 -16.831 10.091 -8.201 1.00 0.00 H new ATOM 0 HB3 ALA A 496 -16.285 9.083 -6.839 1.00 0.00 H new ATOM 212 N PHE A 497 -14.673 9.937 -4.872 1.00 0.00 N ATOM 213 CA PHE A 497 -14.342 9.837 -3.454 1.00 0.00 C ATOM 214 C PHE A 497 -13.258 10.843 -3.072 1.00 0.00 C ATOM 215 O PHE A 497 -12.762 10.833 -1.945 1.00 0.00 O ATOM 216 CB PHE A 497 -13.903 8.406 -3.108 1.00 0.00 C ATOM 217 CG PHE A 497 -12.417 8.238 -3.317 1.00 0.00 C ATOM 218 CD1 PHE A 497 -11.795 8.784 -4.444 1.00 0.00 C ATOM 219 CD2 PHE A 497 -11.661 7.524 -2.378 1.00 0.00 C ATOM 220 CE1 PHE A 497 -10.418 8.617 -4.634 1.00 0.00 C ATOM 221 CE2 PHE A 497 -10.286 7.359 -2.566 1.00 0.00 C ATOM 222 CZ PHE A 497 -9.664 7.904 -3.693 1.00 0.00 C ATOM 0 H PHE A 497 -14.551 9.072 -5.398 1.00 0.00 H new ATOM 0 HA PHE A 497 -15.236 10.075 -2.877 1.00 0.00 H new ATOM 0 HB2 PHE A 497 -14.157 8.183 -2.072 1.00 0.00 H new ATOM 0 HB3 PHE A 497 -14.445 7.694 -3.730 1.00 0.00 H new ATOM 0 HD1 PHE A 497 -12.377 9.335 -5.168 1.00 0.00 H new ATOM 0 HD2 PHE A 497 -12.141 7.101 -1.508 1.00 0.00 H new ATOM 0 HE1 PHE A 497 -9.938 9.037 -5.505 1.00 0.00 H new ATOM 0 HE2 PHE A 497 -9.704 6.810 -1.840 1.00 0.00 H new ATOM 0 HZ PHE A 497 -8.602 7.775 -3.838 1.00 0.00 H new ATOM 232 N ALA A 498 -12.895 11.710 -4.016 1.00 0.00 N ATOM 233 CA ALA A 498 -11.870 12.720 -3.765 1.00 0.00 C ATOM 234 C ALA A 498 -12.051 13.339 -2.380 1.00 0.00 C ATOM 235 O ALA A 498 -11.141 13.977 -1.851 1.00 0.00 O ATOM 236 CB ALA A 498 -11.947 13.817 -4.829 1.00 0.00 C ATOM 0 H ALA A 498 -13.293 11.733 -4.955 1.00 0.00 H new ATOM 0 HA ALA A 498 -10.894 12.237 -3.809 1.00 0.00 H new ATOM 0 HB1 ALA A 498 -11.180 14.566 -4.635 1.00 0.00 H new ATOM 0 HB2 ALA A 498 -11.787 13.380 -5.815 1.00 0.00 H new ATOM 0 HB3 ALA A 498 -12.930 14.287 -4.796 1.00 0.00 H new ATOM 242 N GLY A 499 -13.226 13.129 -1.793 1.00 0.00 N ATOM 243 CA GLY A 499 -13.514 13.652 -0.461 1.00 0.00 C ATOM 244 C GLY A 499 -12.422 13.248 0.525 1.00 0.00 C ATOM 245 O GLY A 499 -12.468 13.614 1.699 1.00 0.00 O ATOM 0 H GLY A 499 -13.991 12.603 -2.216 1.00 0.00 H new ATOM 0 HA2 GLY A 499 -13.591 14.739 -0.500 1.00 0.00 H new ATOM 0 HA3 GLY A 499 -14.478 13.276 -0.118 1.00 0.00 H new ATOM 249 N SER A 500 -11.448 12.480 0.036 1.00 0.00 N ATOM 250 CA SER A 500 -10.341 12.009 0.866 1.00 0.00 C ATOM 251 C SER A 500 -9.904 13.076 1.871 1.00 0.00 C ATOM 252 O SER A 500 -9.219 12.771 2.847 1.00 0.00 O ATOM 253 CB SER A 500 -9.157 11.625 -0.024 1.00 0.00 C ATOM 254 OG SER A 500 -8.190 12.668 -0.002 1.00 0.00 O ATOM 0 H SER A 500 -11.404 12.170 -0.935 1.00 0.00 H new ATOM 0 HA SER A 500 -10.683 11.138 1.424 1.00 0.00 H new ATOM 0 HB2 SER A 500 -8.712 10.694 0.327 1.00 0.00 H new ATOM 0 HB3 SER A 500 -9.497 11.451 -1.045 1.00 0.00 H new ATOM 0 HG SER A 500 -7.423 12.392 0.542 1.00 0.00 H new ATOM 260 N LYS A 501 -10.307 14.321 1.637 1.00 0.00 N ATOM 261 CA LYS A 501 -9.952 15.405 2.543 1.00 0.00 C ATOM 262 C LYS A 501 -10.811 15.326 3.803 1.00 0.00 C ATOM 263 O LYS A 501 -11.045 16.329 4.476 1.00 0.00 O ATOM 264 CB LYS A 501 -10.167 16.759 1.854 1.00 0.00 C ATOM 265 CG LYS A 501 -8.937 17.113 1.014 1.00 0.00 C ATOM 266 CD LYS A 501 -8.623 15.964 0.053 1.00 0.00 C ATOM 267 CE LYS A 501 -7.615 16.433 -1.000 1.00 0.00 C ATOM 268 NZ LYS A 501 -8.337 17.120 -2.107 1.00 0.00 N ATOM 0 H LYS A 501 -10.873 14.601 0.836 1.00 0.00 H new ATOM 0 HA LYS A 501 -8.901 15.309 2.816 1.00 0.00 H new ATOM 0 HB2 LYS A 501 -11.053 16.718 1.220 1.00 0.00 H new ATOM 0 HB3 LYS A 501 -10.345 17.533 2.600 1.00 0.00 H new ATOM 0 HG2 LYS A 501 -9.119 18.030 0.453 1.00 0.00 H new ATOM 0 HG3 LYS A 501 -8.082 17.301 1.664 1.00 0.00 H new ATOM 0 HD2 LYS A 501 -8.219 15.116 0.605 1.00 0.00 H new ATOM 0 HD3 LYS A 501 -9.538 15.622 -0.432 1.00 0.00 H new ATOM 0 HE2 LYS A 501 -6.890 17.110 -0.549 1.00 0.00 H new ATOM 0 HE3 LYS A 501 -7.056 15.582 -1.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 -7.653 17.439 -2.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 -9.012 16.460 -2.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 -8.851 17.941 -1.729 1.00 0.00 H new ATOM 282 N ASN A 502 -11.271 14.115 4.113 1.00 0.00 N ATOM 283 CA ASN A 502 -12.100 13.890 5.291 1.00 0.00 C ATOM 284 C ASN A 502 -11.758 12.544 5.923 1.00 0.00 C ATOM 285 O ASN A 502 -11.865 11.500 5.280 1.00 0.00 O ATOM 286 CB ASN A 502 -13.580 13.913 4.903 1.00 0.00 C ATOM 287 CG ASN A 502 -13.884 15.159 4.078 1.00 0.00 C ATOM 288 OD1 ASN A 502 -13.607 16.276 4.513 1.00 0.00 O ATOM 289 ND2 ASN A 502 -14.443 15.031 2.905 1.00 0.00 N ATOM 0 H ASN A 502 -11.083 13.276 3.564 1.00 0.00 H new ATOM 0 HA ASN A 502 -11.906 14.684 6.012 1.00 0.00 H new ATOM 0 HB2 ASN A 502 -13.828 13.019 4.331 1.00 0.00 H new ATOM 0 HB3 ASN A 502 -14.200 13.900 5.800 1.00 0.00 H new ATOM 0 HD21 ASN A 502 -14.651 15.859 2.346 1.00 0.00 H new ATOM 0 HD22 ASN A 502 -14.671 14.103 2.547 1.00 0.00 H new ATOM 296 N ASP A 503 -11.343 12.578 7.185 1.00 0.00 N ATOM 297 CA ASP A 503 -10.982 11.356 7.897 1.00 0.00 C ATOM 298 C ASP A 503 -12.085 10.308 7.784 1.00 0.00 C ATOM 299 O ASP A 503 -11.926 9.177 8.243 1.00 0.00 O ATOM 300 CB ASP A 503 -10.730 11.670 9.373 1.00 0.00 C ATOM 301 CG ASP A 503 -12.028 12.117 10.039 1.00 0.00 C ATOM 302 OD1 ASP A 503 -12.892 12.611 9.333 1.00 0.00 O ATOM 303 OD2 ASP A 503 -12.138 11.958 11.243 1.00 0.00 O ATOM 0 H ASP A 503 -11.248 13.433 7.734 1.00 0.00 H new ATOM 0 HA ASP A 503 -10.075 10.956 7.443 1.00 0.00 H new ATOM 0 HB2 ASP A 503 -10.337 10.788 9.879 1.00 0.00 H new ATOM 0 HB3 ASP A 503 -9.977 12.452 9.464 1.00 0.00 H new ATOM 308 N GLU A 504 -13.205 10.685 7.174 1.00 0.00 N ATOM 309 CA GLU A 504 -14.323 9.761 7.017 1.00 0.00 C ATOM 310 C GLU A 504 -14.097 8.845 5.819 1.00 0.00 C ATOM 311 O GLU A 504 -14.314 7.635 5.902 1.00 0.00 O ATOM 312 CB GLU A 504 -15.625 10.545 6.827 1.00 0.00 C ATOM 313 CG GLU A 504 -16.818 9.617 7.063 1.00 0.00 C ATOM 314 CD GLU A 504 -18.118 10.409 6.979 1.00 0.00 C ATOM 315 OE1 GLU A 504 -18.492 11.004 7.976 1.00 0.00 O ATOM 316 OE2 GLU A 504 -18.722 10.409 5.919 1.00 0.00 O ATOM 0 H GLU A 504 -13.362 11.614 6.784 1.00 0.00 H new ATOM 0 HA GLU A 504 -14.395 9.150 7.917 1.00 0.00 H new ATOM 0 HB2 GLU A 504 -15.661 11.385 7.521 1.00 0.00 H new ATOM 0 HB3 GLU A 504 -15.668 10.961 5.821 1.00 0.00 H new ATOM 0 HG2 GLU A 504 -16.820 8.818 6.321 1.00 0.00 H new ATOM 0 HG3 GLU A 504 -16.733 9.144 8.041 1.00 0.00 H new ATOM 323 N VAL A 505 -13.663 9.428 4.708 1.00 0.00 N ATOM 324 CA VAL A 505 -13.413 8.654 3.498 1.00 0.00 C ATOM 325 C VAL A 505 -12.245 7.694 3.709 1.00 0.00 C ATOM 326 O VAL A 505 -12.407 6.476 3.627 1.00 0.00 O ATOM 327 CB VAL A 505 -13.108 9.604 2.333 1.00 0.00 C ATOM 328 CG1 VAL A 505 -12.326 8.865 1.243 1.00 0.00 C ATOM 329 CG2 VAL A 505 -14.419 10.129 1.744 1.00 0.00 C ATOM 0 H VAL A 505 -13.478 10.427 4.620 1.00 0.00 H new ATOM 0 HA VAL A 505 -14.302 8.069 3.264 1.00 0.00 H new ATOM 0 HB VAL A 505 -12.510 10.437 2.703 1.00 0.00 H new ATOM 0 HG11 VAL A 505 -12.114 9.548 0.420 1.00 0.00 H new ATOM 0 HG12 VAL A 505 -11.388 8.493 1.656 1.00 0.00 H new ATOM 0 HG13 VAL A 505 -12.918 8.027 0.875 1.00 0.00 H new ATOM 0 HG21 VAL A 505 -14.201 10.804 0.916 1.00 0.00 H new ATOM 0 HG22 VAL A 505 -15.016 9.292 1.382 1.00 0.00 H new ATOM 0 HG23 VAL A 505 -14.974 10.666 2.513 1.00 0.00 H new ATOM 339 N LEU A 506 -11.067 8.249 3.978 1.00 0.00 N ATOM 340 CA LEU A 506 -9.880 7.428 4.194 1.00 0.00 C ATOM 341 C LEU A 506 -10.030 6.577 5.452 1.00 0.00 C ATOM 342 O LEU A 506 -9.373 5.547 5.597 1.00 0.00 O ATOM 343 CB LEU A 506 -8.641 8.323 4.316 1.00 0.00 C ATOM 344 CG LEU A 506 -8.671 9.086 5.653 1.00 0.00 C ATOM 345 CD1 LEU A 506 -7.729 8.416 6.658 1.00 0.00 C ATOM 346 CD2 LEU A 506 -8.219 10.533 5.427 1.00 0.00 C ATOM 0 H LEU A 506 -10.909 9.254 4.051 1.00 0.00 H new ATOM 0 HA LEU A 506 -9.763 6.762 3.339 1.00 0.00 H new ATOM 0 HB2 LEU A 506 -7.737 7.717 4.254 1.00 0.00 H new ATOM 0 HB3 LEU A 506 -8.609 9.029 3.486 1.00 0.00 H new ATOM 0 HG LEU A 506 -9.687 9.074 6.046 1.00 0.00 H new ATOM 0 HD11 LEU A 506 -7.756 8.962 7.601 1.00 0.00 H new ATOM 0 HD12 LEU A 506 -8.047 7.387 6.825 1.00 0.00 H new ATOM 0 HD13 LEU A 506 -6.713 8.422 6.264 1.00 0.00 H new ATOM 0 HD21 LEU A 506 -8.240 11.073 6.374 1.00 0.00 H new ATOM 0 HD22 LEU A 506 -7.204 10.539 5.028 1.00 0.00 H new ATOM 0 HD23 LEU A 506 -8.890 11.017 4.718 1.00 0.00 H new ATOM 358 N GLY A 507 -10.899 7.013 6.357 1.00 0.00 N ATOM 359 CA GLY A 507 -11.123 6.282 7.599 1.00 0.00 C ATOM 360 C GLY A 507 -11.703 4.898 7.326 1.00 0.00 C ATOM 361 O GLY A 507 -11.272 3.907 7.916 1.00 0.00 O ATOM 0 H GLY A 507 -11.456 7.862 6.256 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -10.183 6.185 8.142 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -11.803 6.845 8.238 1.00 0.00 H new ATOM 365 N LEU A 508 -12.687 4.837 6.432 1.00 0.00 N ATOM 366 CA LEU A 508 -13.324 3.567 6.090 1.00 0.00 C ATOM 367 C LEU A 508 -12.555 2.860 4.975 1.00 0.00 C ATOM 368 O LEU A 508 -12.392 1.637 4.992 1.00 0.00 O ATOM 369 CB LEU A 508 -14.770 3.814 5.639 1.00 0.00 C ATOM 370 CG LEU A 508 -15.687 3.944 6.865 1.00 0.00 C ATOM 371 CD1 LEU A 508 -16.912 4.787 6.502 1.00 0.00 C ATOM 372 CD2 LEU A 508 -16.150 2.553 7.314 1.00 0.00 C ATOM 0 H LEU A 508 -13.059 5.646 5.934 1.00 0.00 H new ATOM 0 HA LEU A 508 -13.321 2.931 6.975 1.00 0.00 H new ATOM 0 HB2 LEU A 508 -14.822 4.722 5.037 1.00 0.00 H new ATOM 0 HB3 LEU A 508 -15.108 2.993 5.007 1.00 0.00 H new ATOM 0 HG LEU A 508 -15.136 4.425 7.674 1.00 0.00 H new ATOM 0 HD11 LEU A 508 -17.562 4.878 7.372 1.00 0.00 H new ATOM 0 HD12 LEU A 508 -16.590 5.779 6.184 1.00 0.00 H new ATOM 0 HD13 LEU A 508 -17.458 4.305 5.691 1.00 0.00 H new ATOM 0 HD21 LEU A 508 -16.800 2.649 8.184 1.00 0.00 H new ATOM 0 HD22 LEU A 508 -16.697 2.072 6.503 1.00 0.00 H new ATOM 0 HD23 LEU A 508 -15.282 1.947 7.575 1.00 0.00 H new ATOM 384 N LEU A 509 -12.094 3.633 3.999 1.00 0.00 N ATOM 385 CA LEU A 509 -11.355 3.069 2.876 1.00 0.00 C ATOM 386 C LEU A 509 -10.154 2.259 3.362 1.00 0.00 C ATOM 387 O LEU A 509 -9.680 1.364 2.664 1.00 0.00 O ATOM 388 CB LEU A 509 -10.882 4.193 1.945 1.00 0.00 C ATOM 389 CG LEU A 509 -10.828 3.685 0.496 1.00 0.00 C ATOM 390 CD1 LEU A 509 -12.206 3.846 -0.157 1.00 0.00 C ATOM 391 CD2 LEU A 509 -9.792 4.494 -0.294 1.00 0.00 C ATOM 0 H LEU A 509 -12.217 4.645 3.962 1.00 0.00 H new ATOM 0 HA LEU A 509 -12.021 2.401 2.330 1.00 0.00 H new ATOM 0 HB2 LEU A 509 -11.559 5.045 2.016 1.00 0.00 H new ATOM 0 HB3 LEU A 509 -9.897 4.542 2.254 1.00 0.00 H new ATOM 0 HG LEU A 509 -10.546 2.632 0.494 1.00 0.00 H new ATOM 0 HD11 LEU A 509 -12.166 3.485 -1.185 1.00 0.00 H new ATOM 0 HD12 LEU A 509 -12.943 3.269 0.402 1.00 0.00 H new ATOM 0 HD13 LEU A 509 -12.490 4.898 -0.153 1.00 0.00 H new ATOM 0 HD21 LEU A 509 -9.755 4.133 -1.322 1.00 0.00 H new ATOM 0 HD22 LEU A 509 -10.073 5.547 -0.290 1.00 0.00 H new ATOM 0 HD23 LEU A 509 -8.811 4.378 0.167 1.00 0.00 H new ATOM 403 N LEU A 510 -9.665 2.576 4.558 1.00 0.00 N ATOM 404 CA LEU A 510 -8.517 1.861 5.107 1.00 0.00 C ATOM 405 C LEU A 510 -8.894 0.419 5.451 1.00 0.00 C ATOM 406 O LEU A 510 -8.395 -0.518 4.828 1.00 0.00 O ATOM 407 CB LEU A 510 -7.977 2.586 6.353 1.00 0.00 C ATOM 408 CG LEU A 510 -6.610 3.210 6.046 1.00 0.00 C ATOM 409 CD1 LEU A 510 -6.776 4.388 5.085 1.00 0.00 C ATOM 410 CD2 LEU A 510 -5.972 3.701 7.348 1.00 0.00 C ATOM 0 H LEU A 510 -10.039 3.312 5.158 1.00 0.00 H new ATOM 0 HA LEU A 510 -7.733 1.840 4.350 1.00 0.00 H new ATOM 0 HB2 LEU A 510 -8.678 3.360 6.665 1.00 0.00 H new ATOM 0 HB3 LEU A 510 -7.888 1.884 7.182 1.00 0.00 H new ATOM 0 HG LEU A 510 -5.970 2.459 5.583 1.00 0.00 H new ATOM 0 HD11 LEU A 510 -5.800 4.825 4.873 1.00 0.00 H new ATOM 0 HD12 LEU A 510 -7.227 4.039 4.156 1.00 0.00 H new ATOM 0 HD13 LEU A 510 -7.419 5.141 5.540 1.00 0.00 H new ATOM 0 HD21 LEU A 510 -5.000 4.145 7.132 1.00 0.00 H new ATOM 0 HD22 LEU A 510 -6.617 4.448 7.810 1.00 0.00 H new ATOM 0 HD23 LEU A 510 -5.843 2.860 8.030 1.00 0.00 H new ATOM 422 N PRO A 511 -9.755 0.219 6.417 1.00 0.00 N ATOM 423 CA PRO A 511 -10.186 -1.144 6.822 1.00 0.00 C ATOM 424 C PRO A 511 -10.515 -2.005 5.605 1.00 0.00 C ATOM 425 O PRO A 511 -10.353 -3.225 5.630 1.00 0.00 O ATOM 426 CB PRO A 511 -11.434 -0.921 7.695 1.00 0.00 C ATOM 427 CG PRO A 511 -11.673 0.562 7.745 1.00 0.00 C ATOM 428 CD PRO A 511 -10.411 1.253 7.222 1.00 0.00 C ATOM 0 HA PRO A 511 -9.400 -1.676 7.358 1.00 0.00 H new ATOM 0 HB2 PRO A 511 -12.297 -1.437 7.274 1.00 0.00 H new ATOM 0 HB3 PRO A 511 -11.281 -1.321 8.697 1.00 0.00 H new ATOM 0 HG2 PRO A 511 -12.537 0.831 7.137 1.00 0.00 H new ATOM 0 HG3 PRO A 511 -11.889 0.881 8.765 1.00 0.00 H new ATOM 0 HD2 PRO A 511 -10.654 2.131 6.624 1.00 0.00 H new ATOM 0 HD3 PRO A 511 -9.772 1.590 8.038 1.00 0.00 H new ATOM 436 N ILE A 512 -10.974 -1.354 4.539 1.00 0.00 N ATOM 437 CA ILE A 512 -11.320 -2.064 3.313 1.00 0.00 C ATOM 438 C ILE A 512 -10.073 -2.297 2.462 1.00 0.00 C ATOM 439 O ILE A 512 -9.907 -3.361 1.867 1.00 0.00 O ATOM 440 CB ILE A 512 -12.341 -1.257 2.511 1.00 0.00 C ATOM 441 CG1 ILE A 512 -13.567 -0.972 3.382 1.00 0.00 C ATOM 442 CG2 ILE A 512 -12.771 -2.056 1.279 1.00 0.00 C ATOM 443 CD1 ILE A 512 -14.451 0.069 2.695 1.00 0.00 C ATOM 0 H ILE A 512 -11.114 -0.344 4.500 1.00 0.00 H new ATOM 0 HA ILE A 512 -11.751 -3.028 3.583 1.00 0.00 H new ATOM 0 HB ILE A 512 -11.890 -0.316 2.197 1.00 0.00 H new ATOM 0 HG12 ILE A 512 -14.130 -1.891 3.547 1.00 0.00 H new ATOM 0 HG13 ILE A 512 -13.254 -0.609 4.361 1.00 0.00 H new ATOM 0 HG21 ILE A 512 -13.499 -1.480 0.708 1.00 0.00 H new ATOM 0 HG22 ILE A 512 -11.900 -2.260 0.656 1.00 0.00 H new ATOM 0 HG23 ILE A 512 -13.220 -2.998 1.595 1.00 0.00 H new ATOM 0 HD11 ILE A 512 -15.324 0.272 3.316 1.00 0.00 H new ATOM 0 HD12 ILE A 512 -13.885 0.990 2.553 1.00 0.00 H new ATOM 0 HD13 ILE A 512 -14.775 -0.311 1.726 1.00 0.00 H new ATOM 455 N ALA A 513 -9.203 -1.294 2.408 1.00 0.00 N ATOM 456 CA ALA A 513 -7.975 -1.399 1.624 1.00 0.00 C ATOM 457 C ALA A 513 -6.875 -2.086 2.430 1.00 0.00 C ATOM 458 O ALA A 513 -5.831 -2.447 1.887 1.00 0.00 O ATOM 459 CB ALA A 513 -7.504 -0.007 1.204 1.00 0.00 C ATOM 0 H ALA A 513 -9.323 -0.405 2.893 1.00 0.00 H new ATOM 0 HA ALA A 513 -8.186 -1.997 0.737 1.00 0.00 H new ATOM 0 HB1 ALA A 513 -6.588 -0.094 0.620 1.00 0.00 H new ATOM 0 HB2 ALA A 513 -8.275 0.471 0.600 1.00 0.00 H new ATOM 0 HB3 ALA A 513 -7.312 0.596 2.092 1.00 0.00 H new ATOM 465 N ALA A 514 -7.114 -2.259 3.726 1.00 0.00 N ATOM 466 CA ALA A 514 -6.133 -2.901 4.594 1.00 0.00 C ATOM 467 C ALA A 514 -6.229 -4.419 4.488 1.00 0.00 C ATOM 468 O ALA A 514 -5.662 -5.144 5.306 1.00 0.00 O ATOM 469 CB ALA A 514 -6.363 -2.475 6.045 1.00 0.00 C ATOM 0 H ALA A 514 -7.971 -1.966 4.195 1.00 0.00 H new ATOM 0 HA ALA A 514 -5.138 -2.590 4.275 1.00 0.00 H new ATOM 0 HB1 ALA A 514 -5.627 -2.958 6.687 1.00 0.00 H new ATOM 0 HB2 ALA A 514 -6.261 -1.393 6.127 1.00 0.00 H new ATOM 0 HB3 ALA A 514 -7.365 -2.770 6.356 1.00 0.00 H new ATOM 475 N SER A 515 -6.947 -4.895 3.476 1.00 0.00 N ATOM 476 CA SER A 515 -7.108 -6.332 3.274 1.00 0.00 C ATOM 477 C SER A 515 -7.324 -7.042 4.607 1.00 0.00 C ATOM 478 O SER A 515 -6.508 -7.862 5.024 1.00 0.00 O ATOM 479 CB SER A 515 -5.870 -6.905 2.585 1.00 0.00 C ATOM 480 OG SER A 515 -4.798 -6.960 3.517 1.00 0.00 O ATOM 0 H SER A 515 -7.424 -4.313 2.787 1.00 0.00 H new ATOM 0 HA SER A 515 -7.983 -6.494 2.644 1.00 0.00 H new ATOM 0 HB2 SER A 515 -6.083 -7.902 2.199 1.00 0.00 H new ATOM 0 HB3 SER A 515 -5.594 -6.285 1.732 1.00 0.00 H new ATOM 0 HG SER A 515 -4.992 -7.636 4.199 1.00 0.00 H new ATOM 486 N THR A 516 -8.428 -6.716 5.273 1.00 0.00 N ATOM 487 CA THR A 516 -8.739 -7.327 6.560 1.00 0.00 C ATOM 488 C THR A 516 -9.284 -8.739 6.370 1.00 0.00 C ATOM 489 O THR A 516 -9.085 -9.609 7.216 1.00 0.00 O ATOM 490 CB THR A 516 -9.767 -6.474 7.307 1.00 0.00 C ATOM 491 OG1 THR A 516 -10.822 -6.125 6.421 1.00 0.00 O ATOM 492 CG2 THR A 516 -9.097 -5.203 7.832 1.00 0.00 C ATOM 0 H THR A 516 -9.116 -6.038 4.946 1.00 0.00 H new ATOM 0 HA THR A 516 -7.821 -7.384 7.144 1.00 0.00 H new ATOM 0 HB THR A 516 -10.168 -7.041 8.147 1.00 0.00 H new ATOM 0 HG1 THR A 516 -10.716 -5.193 6.137 1.00 0.00 H new ATOM 0 HG21 THR A 516 -9.831 -4.598 8.363 1.00 0.00 H new ATOM 0 HG22 THR A 516 -8.288 -5.472 8.512 1.00 0.00 H new ATOM 0 HG23 THR A 516 -8.693 -4.632 6.996 1.00 0.00 H new ATOM 500 N ASP A 517 -9.971 -8.961 5.253 1.00 0.00 N ATOM 501 CA ASP A 517 -10.537 -10.275 4.967 1.00 0.00 C ATOM 502 C ASP A 517 -11.071 -10.337 3.539 1.00 0.00 C ATOM 503 O ASP A 517 -12.161 -10.852 3.297 1.00 0.00 O ATOM 504 CB ASP A 517 -11.670 -10.580 5.949 1.00 0.00 C ATOM 505 CG ASP A 517 -12.009 -12.066 5.907 1.00 0.00 C ATOM 506 OD1 ASP A 517 -11.757 -12.682 4.885 1.00 0.00 O ATOM 507 OD2 ASP A 517 -12.517 -12.566 6.898 1.00 0.00 O ATOM 0 H ASP A 517 -10.148 -8.256 4.538 1.00 0.00 H new ATOM 0 HA ASP A 517 -9.747 -11.018 5.077 1.00 0.00 H new ATOM 0 HB2 ASP A 517 -11.374 -10.294 6.958 1.00 0.00 H new ATOM 0 HB3 ASP A 517 -12.551 -9.990 5.696 1.00 0.00 H new ATOM 512 N LEU A 518 -10.294 -9.813 2.595 1.00 0.00 N ATOM 513 CA LEU A 518 -10.698 -9.820 1.193 1.00 0.00 C ATOM 514 C LEU A 518 -9.467 -9.841 0.286 1.00 0.00 C ATOM 515 O LEU A 518 -8.406 -9.346 0.664 1.00 0.00 O ATOM 516 CB LEU A 518 -11.539 -8.574 0.888 1.00 0.00 C ATOM 517 CG LEU A 518 -10.849 -7.325 1.467 1.00 0.00 C ATOM 518 CD1 LEU A 518 -10.787 -6.225 0.405 1.00 0.00 C ATOM 519 CD2 LEU A 518 -11.639 -6.813 2.675 1.00 0.00 C ATOM 0 H LEU A 518 -9.387 -9.381 2.774 1.00 0.00 H new ATOM 0 HA LEU A 518 -11.292 -10.714 1.005 1.00 0.00 H new ATOM 0 HB2 LEU A 518 -11.666 -8.464 -0.189 1.00 0.00 H new ATOM 0 HB3 LEU A 518 -12.535 -8.682 1.317 1.00 0.00 H new ATOM 0 HG LEU A 518 -9.838 -7.590 1.775 1.00 0.00 H new ATOM 0 HD11 LEU A 518 -10.298 -5.344 0.821 1.00 0.00 H new ATOM 0 HD12 LEU A 518 -10.221 -6.582 -0.456 1.00 0.00 H new ATOM 0 HD13 LEU A 518 -11.798 -5.964 0.092 1.00 0.00 H new ATOM 0 HD21 LEU A 518 -11.148 -5.929 3.083 1.00 0.00 H new ATOM 0 HD22 LEU A 518 -12.652 -6.555 2.365 1.00 0.00 H new ATOM 0 HD23 LEU A 518 -11.680 -7.590 3.439 1.00 0.00 H new ATOM 531 N PRO A 519 -9.582 -10.401 -0.894 1.00 0.00 N ATOM 532 CA PRO A 519 -8.447 -10.480 -1.855 1.00 0.00 C ATOM 533 C PRO A 519 -7.685 -9.156 -1.942 1.00 0.00 C ATOM 534 O PRO A 519 -8.275 -8.082 -1.830 1.00 0.00 O ATOM 535 CB PRO A 519 -9.103 -10.832 -3.203 1.00 0.00 C ATOM 536 CG PRO A 519 -10.583 -10.938 -2.955 1.00 0.00 C ATOM 537 CD PRO A 519 -10.791 -11.021 -1.443 1.00 0.00 C ATOM 0 HA PRO A 519 -7.707 -11.219 -1.547 1.00 0.00 H new ATOM 0 HB2 PRO A 519 -8.890 -10.065 -3.948 1.00 0.00 H new ATOM 0 HB3 PRO A 519 -8.708 -11.771 -3.591 1.00 0.00 H new ATOM 0 HG2 PRO A 519 -11.104 -10.073 -3.367 1.00 0.00 H new ATOM 0 HG3 PRO A 519 -10.992 -11.820 -3.447 1.00 0.00 H new ATOM 0 HD2 PRO A 519 -11.691 -10.490 -1.132 1.00 0.00 H new ATOM 0 HD3 PRO A 519 -10.899 -12.053 -1.109 1.00 0.00 H new ATOM 545 N ILE A 520 -6.374 -9.247 -2.139 1.00 0.00 N ATOM 546 CA ILE A 520 -5.541 -8.052 -2.238 1.00 0.00 C ATOM 547 C ILE A 520 -5.763 -7.351 -3.574 1.00 0.00 C ATOM 548 O ILE A 520 -5.638 -6.130 -3.674 1.00 0.00 O ATOM 549 CB ILE A 520 -4.065 -8.430 -2.097 1.00 0.00 C ATOM 550 CG1 ILE A 520 -3.884 -9.330 -0.872 1.00 0.00 C ATOM 551 CG2 ILE A 520 -3.225 -7.163 -1.923 1.00 0.00 C ATOM 552 CD1 ILE A 520 -2.399 -9.652 -0.687 1.00 0.00 C ATOM 0 H ILE A 520 -5.868 -10.128 -2.233 1.00 0.00 H new ATOM 0 HA ILE A 520 -5.820 -7.371 -1.434 1.00 0.00 H new ATOM 0 HB ILE A 520 -3.741 -8.961 -2.992 1.00 0.00 H new ATOM 0 HG12 ILE A 520 -4.272 -8.834 0.017 1.00 0.00 H new ATOM 0 HG13 ILE A 520 -4.453 -10.251 -0.997 1.00 0.00 H new ATOM 0 HG21 ILE A 520 -2.174 -7.434 -1.823 1.00 0.00 H new ATOM 0 HG22 ILE A 520 -3.352 -6.520 -2.794 1.00 0.00 H new ATOM 0 HG23 ILE A 520 -3.549 -6.631 -1.028 1.00 0.00 H new ATOM 0 HD11 ILE A 520 -2.272 -10.293 0.185 1.00 0.00 H new ATOM 0 HD12 ILE A 520 -2.025 -10.166 -1.572 1.00 0.00 H new ATOM 0 HD13 ILE A 520 -1.841 -8.727 -0.542 1.00 0.00 H new ATOM 564 N GLU A 521 -6.090 -8.130 -4.600 1.00 0.00 N ATOM 565 CA GLU A 521 -6.326 -7.572 -5.928 1.00 0.00 C ATOM 566 C GLU A 521 -7.122 -6.274 -5.835 1.00 0.00 C ATOM 567 O GLU A 521 -6.948 -5.368 -6.650 1.00 0.00 O ATOM 568 CB GLU A 521 -7.088 -8.580 -6.790 1.00 0.00 C ATOM 569 CG GLU A 521 -6.142 -9.702 -7.225 1.00 0.00 C ATOM 570 CD GLU A 521 -6.927 -10.800 -7.934 1.00 0.00 C ATOM 571 OE1 GLU A 521 -7.623 -11.536 -7.253 1.00 0.00 O ATOM 572 OE2 GLU A 521 -6.821 -10.890 -9.146 1.00 0.00 O ATOM 0 H GLU A 521 -6.197 -9.143 -4.539 1.00 0.00 H new ATOM 0 HA GLU A 521 -5.360 -7.358 -6.386 1.00 0.00 H new ATOM 0 HB2 GLU A 521 -7.926 -8.994 -6.229 1.00 0.00 H new ATOM 0 HB3 GLU A 521 -7.506 -8.083 -7.665 1.00 0.00 H new ATOM 0 HG2 GLU A 521 -5.375 -9.305 -7.890 1.00 0.00 H new ATOM 0 HG3 GLU A 521 -5.629 -10.114 -6.356 1.00 0.00 H new ATOM 579 N THR A 522 -7.995 -6.191 -4.836 1.00 0.00 N ATOM 580 CA THR A 522 -8.815 -4.999 -4.646 1.00 0.00 C ATOM 581 C THR A 522 -8.058 -3.952 -3.836 1.00 0.00 C ATOM 582 O THR A 522 -8.209 -2.751 -4.059 1.00 0.00 O ATOM 583 CB THR A 522 -10.113 -5.368 -3.926 1.00 0.00 C ATOM 584 OG1 THR A 522 -9.803 -5.945 -2.665 1.00 0.00 O ATOM 585 CG2 THR A 522 -10.900 -6.371 -4.768 1.00 0.00 C ATOM 0 H THR A 522 -8.153 -6.929 -4.150 1.00 0.00 H new ATOM 0 HA THR A 522 -9.051 -4.582 -5.625 1.00 0.00 H new ATOM 0 HB THR A 522 -10.715 -4.471 -3.779 1.00 0.00 H new ATOM 0 HG1 THR A 522 -9.333 -6.794 -2.800 1.00 0.00 H new ATOM 0 HG21 THR A 522 -11.824 -6.632 -4.253 1.00 0.00 H new ATOM 0 HG22 THR A 522 -11.136 -5.928 -5.735 1.00 0.00 H new ATOM 0 HG23 THR A 522 -10.301 -7.270 -4.917 1.00 0.00 H new ATOM 593 N ALA A 523 -7.245 -4.415 -2.891 1.00 0.00 N ATOM 594 CA ALA A 523 -6.471 -3.508 -2.052 1.00 0.00 C ATOM 595 C ALA A 523 -5.409 -2.788 -2.876 1.00 0.00 C ATOM 596 O ALA A 523 -5.165 -1.596 -2.689 1.00 0.00 O ATOM 597 CB ALA A 523 -5.799 -4.288 -0.921 1.00 0.00 C ATOM 0 H ALA A 523 -7.106 -5.405 -2.688 1.00 0.00 H new ATOM 0 HA ALA A 523 -7.150 -2.767 -1.630 1.00 0.00 H new ATOM 0 HB1 ALA A 523 -5.223 -3.603 -0.299 1.00 0.00 H new ATOM 0 HB2 ALA A 523 -6.561 -4.777 -0.313 1.00 0.00 H new ATOM 0 HB3 ALA A 523 -5.134 -5.041 -1.344 1.00 0.00 H new ATOM 603 N ALA A 524 -4.781 -3.521 -3.789 1.00 0.00 N ATOM 604 CA ALA A 524 -3.744 -2.944 -4.637 1.00 0.00 C ATOM 605 C ALA A 524 -4.293 -1.759 -5.425 1.00 0.00 C ATOM 606 O ALA A 524 -3.672 -0.698 -5.482 1.00 0.00 O ATOM 607 CB ALA A 524 -3.214 -4.002 -5.606 1.00 0.00 C ATOM 0 H ALA A 524 -4.970 -4.509 -3.960 1.00 0.00 H new ATOM 0 HA ALA A 524 -2.932 -2.596 -3.999 1.00 0.00 H new ATOM 0 HB1 ALA A 524 -2.440 -3.563 -6.236 1.00 0.00 H new ATOM 0 HB2 ALA A 524 -2.794 -4.835 -5.042 1.00 0.00 H new ATOM 0 HB3 ALA A 524 -4.030 -4.363 -6.232 1.00 0.00 H new ATOM 613 N MET A 525 -5.460 -1.948 -6.032 1.00 0.00 N ATOM 614 CA MET A 525 -6.083 -0.887 -6.815 1.00 0.00 C ATOM 615 C MET A 525 -6.602 0.219 -5.902 1.00 0.00 C ATOM 616 O MET A 525 -6.388 1.403 -6.162 1.00 0.00 O ATOM 617 CB MET A 525 -7.239 -1.457 -7.641 1.00 0.00 C ATOM 618 CG MET A 525 -6.682 -2.237 -8.834 1.00 0.00 C ATOM 619 SD MET A 525 -5.639 -3.590 -8.237 1.00 0.00 S ATOM 620 CE MET A 525 -5.393 -4.407 -9.833 1.00 0.00 C ATOM 0 H MET A 525 -5.990 -2.819 -5.998 1.00 0.00 H new ATOM 0 HA MET A 525 -5.333 -0.466 -7.484 1.00 0.00 H new ATOM 0 HB2 MET A 525 -7.854 -2.110 -7.022 1.00 0.00 H new ATOM 0 HB3 MET A 525 -7.883 -0.650 -7.990 1.00 0.00 H new ATOM 0 HG2 MET A 525 -7.499 -2.633 -9.437 1.00 0.00 H new ATOM 0 HG3 MET A 525 -6.103 -1.574 -9.477 1.00 0.00 H new ATOM 0 HE1 MET A 525 -4.764 -5.287 -9.698 1.00 0.00 H new ATOM 0 HE2 MET A 525 -6.358 -4.709 -10.240 1.00 0.00 H new ATOM 0 HE3 MET A 525 -4.908 -3.717 -10.524 1.00 0.00 H new ATOM 630 N ALA A 526 -7.287 -0.174 -4.833 1.00 0.00 N ATOM 631 CA ALA A 526 -7.834 0.795 -3.890 1.00 0.00 C ATOM 632 C ALA A 526 -6.714 1.595 -3.230 1.00 0.00 C ATOM 633 O ALA A 526 -6.914 2.739 -2.824 1.00 0.00 O ATOM 634 CB ALA A 526 -8.650 0.075 -2.816 1.00 0.00 C ATOM 0 H ALA A 526 -7.476 -1.149 -4.599 1.00 0.00 H new ATOM 0 HA ALA A 526 -8.480 1.481 -4.438 1.00 0.00 H new ATOM 0 HB1 ALA A 526 -9.055 0.806 -2.116 1.00 0.00 H new ATOM 0 HB2 ALA A 526 -9.469 -0.470 -3.286 1.00 0.00 H new ATOM 0 HB3 ALA A 526 -8.009 -0.625 -2.280 1.00 0.00 H new ATOM 640 N SER A 527 -5.537 0.986 -3.129 1.00 0.00 N ATOM 641 CA SER A 527 -4.392 1.653 -2.518 1.00 0.00 C ATOM 642 C SER A 527 -3.791 2.676 -3.477 1.00 0.00 C ATOM 643 O SER A 527 -3.474 3.798 -3.083 1.00 0.00 O ATOM 644 CB SER A 527 -3.330 0.622 -2.136 1.00 0.00 C ATOM 645 OG SER A 527 -3.827 -0.198 -1.087 1.00 0.00 O ATOM 0 H SER A 527 -5.351 0.039 -3.459 1.00 0.00 H new ATOM 0 HA SER A 527 -4.734 2.171 -1.622 1.00 0.00 H new ATOM 0 HB2 SER A 527 -3.073 0.010 -3.001 1.00 0.00 H new ATOM 0 HB3 SER A 527 -2.416 1.125 -1.818 1.00 0.00 H new ATOM 0 HG SER A 527 -4.640 -0.656 -1.387 1.00 0.00 H new ATOM 651 N LEU A 528 -3.637 2.280 -4.737 1.00 0.00 N ATOM 652 CA LEU A 528 -3.071 3.170 -5.743 1.00 0.00 C ATOM 653 C LEU A 528 -3.880 4.462 -5.829 1.00 0.00 C ATOM 654 O LEU A 528 -3.324 5.558 -5.762 1.00 0.00 O ATOM 655 CB LEU A 528 -3.061 2.474 -7.108 1.00 0.00 C ATOM 656 CG LEU A 528 -2.355 3.362 -8.149 1.00 0.00 C ATOM 657 CD1 LEU A 528 -1.456 2.500 -9.039 1.00 0.00 C ATOM 658 CD2 LEU A 528 -3.399 4.065 -9.024 1.00 0.00 C ATOM 0 H LEU A 528 -3.894 1.356 -5.083 1.00 0.00 H new ATOM 0 HA LEU A 528 -2.049 3.415 -5.455 1.00 0.00 H new ATOM 0 HB2 LEU A 528 -2.551 1.514 -7.032 1.00 0.00 H new ATOM 0 HB3 LEU A 528 -4.083 2.268 -7.427 1.00 0.00 H new ATOM 0 HG LEU A 528 -1.752 4.106 -7.629 1.00 0.00 H new ATOM 0 HD11 LEU A 528 -0.958 3.132 -9.774 1.00 0.00 H new ATOM 0 HD12 LEU A 528 -0.708 2.000 -8.424 1.00 0.00 H new ATOM 0 HD13 LEU A 528 -2.061 1.753 -9.553 1.00 0.00 H new ATOM 0 HD21 LEU A 528 -2.895 4.692 -9.759 1.00 0.00 H new ATOM 0 HD22 LEU A 528 -4.005 3.319 -9.538 1.00 0.00 H new ATOM 0 HD23 LEU A 528 -4.041 4.685 -8.398 1.00 0.00 H new ATOM 670 N ALA A 529 -5.192 4.323 -5.974 1.00 0.00 N ATOM 671 CA ALA A 529 -6.068 5.485 -6.065 1.00 0.00 C ATOM 672 C ALA A 529 -5.917 6.365 -4.829 1.00 0.00 C ATOM 673 O ALA A 529 -5.895 7.593 -4.927 1.00 0.00 O ATOM 674 CB ALA A 529 -7.524 5.033 -6.197 1.00 0.00 C ATOM 0 H ALA A 529 -5.671 3.424 -6.031 1.00 0.00 H new ATOM 0 HA ALA A 529 -5.786 6.062 -6.946 1.00 0.00 H new ATOM 0 HB1 ALA A 529 -8.172 5.907 -6.264 1.00 0.00 H new ATOM 0 HB2 ALA A 529 -7.637 4.428 -7.096 1.00 0.00 H new ATOM 0 HB3 ALA A 529 -7.802 4.442 -5.324 1.00 0.00 H new ATOM 680 N LEU A 530 -5.813 5.730 -3.667 1.00 0.00 N ATOM 681 CA LEU A 530 -5.665 6.463 -2.415 1.00 0.00 C ATOM 682 C LEU A 530 -4.361 7.260 -2.413 1.00 0.00 C ATOM 683 O LEU A 530 -4.217 8.234 -1.676 1.00 0.00 O ATOM 684 CB LEU A 530 -5.675 5.480 -1.234 1.00 0.00 C ATOM 685 CG LEU A 530 -6.461 6.074 -0.061 1.00 0.00 C ATOM 686 CD1 LEU A 530 -6.471 5.078 1.102 1.00 0.00 C ATOM 687 CD2 LEU A 530 -5.801 7.379 0.393 1.00 0.00 C ATOM 0 H LEU A 530 -5.828 4.715 -3.566 1.00 0.00 H new ATOM 0 HA LEU A 530 -6.499 7.158 -2.316 1.00 0.00 H new ATOM 0 HB2 LEU A 530 -6.124 4.535 -1.541 1.00 0.00 H new ATOM 0 HB3 LEU A 530 -4.653 5.262 -0.924 1.00 0.00 H new ATOM 0 HG LEU A 530 -7.484 6.277 -0.378 1.00 0.00 H new ATOM 0 HD11 LEU A 530 -7.030 5.500 1.937 1.00 0.00 H new ATOM 0 HD12 LEU A 530 -6.943 4.149 0.782 1.00 0.00 H new ATOM 0 HD13 LEU A 530 -5.447 4.875 1.416 1.00 0.00 H new ATOM 0 HD21 LEU A 530 -6.362 7.799 1.228 1.00 0.00 H new ATOM 0 HD22 LEU A 530 -4.777 7.178 0.709 1.00 0.00 H new ATOM 0 HD23 LEU A 530 -5.793 8.090 -0.434 1.00 0.00 H new ATOM 699 N ALA A 531 -3.412 6.835 -3.239 1.00 0.00 N ATOM 700 CA ALA A 531 -2.124 7.514 -3.321 1.00 0.00 C ATOM 701 C ALA A 531 -2.201 8.717 -4.259 1.00 0.00 C ATOM 702 O ALA A 531 -1.608 9.762 -3.991 1.00 0.00 O ATOM 703 CB ALA A 531 -1.056 6.540 -3.822 1.00 0.00 C ATOM 0 H ALA A 531 -3.508 6.029 -3.857 1.00 0.00 H new ATOM 0 HA ALA A 531 -1.859 7.868 -2.325 1.00 0.00 H new ATOM 0 HB1 ALA A 531 -0.096 7.052 -3.882 1.00 0.00 H new ATOM 0 HB2 ALA A 531 -0.977 5.700 -3.132 1.00 0.00 H new ATOM 0 HB3 ALA A 531 -1.333 6.173 -4.810 1.00 0.00 H new ATOM 709 N HIS A 532 -2.929 8.560 -5.359 1.00 0.00 N ATOM 710 CA HIS A 532 -3.069 9.638 -6.332 1.00 0.00 C ATOM 711 C HIS A 532 -4.104 10.661 -5.870 1.00 0.00 C ATOM 712 O HIS A 532 -4.161 11.775 -6.388 1.00 0.00 O ATOM 713 CB HIS A 532 -3.482 9.063 -7.691 1.00 0.00 C ATOM 714 CG HIS A 532 -3.099 10.023 -8.786 1.00 0.00 C ATOM 715 ND1 HIS A 532 -3.620 11.305 -8.861 1.00 0.00 N ATOM 716 CD2 HIS A 532 -2.247 9.901 -9.855 1.00 0.00 C ATOM 717 CE1 HIS A 532 -3.080 11.898 -9.943 1.00 0.00 C ATOM 718 NE2 HIS A 532 -2.236 11.086 -10.584 1.00 0.00 N ATOM 0 H HIS A 532 -3.428 7.703 -5.599 1.00 0.00 H new ATOM 0 HA HIS A 532 -2.106 10.140 -6.425 1.00 0.00 H new ATOM 0 HB2 HIS A 532 -2.997 8.100 -7.852 1.00 0.00 H new ATOM 0 HB3 HIS A 532 -4.557 8.885 -7.710 1.00 0.00 H new ATOM 0 HD1 HIS A 532 -4.290 11.723 -8.215 1.00 0.00 H new ATOM 0 HD2 HIS A 532 -1.672 9.019 -10.094 1.00 0.00 H new ATOM 0 HE1 HIS A 532 -3.303 12.908 -10.254 1.00 0.00 H new ATOM 726 N VAL A 533 -4.924 10.276 -4.895 1.00 0.00 N ATOM 727 CA VAL A 533 -5.954 11.173 -4.377 1.00 0.00 C ATOM 728 C VAL A 533 -5.396 12.025 -3.237 1.00 0.00 C ATOM 729 O VAL A 533 -5.778 13.184 -3.071 1.00 0.00 O ATOM 730 CB VAL A 533 -7.161 10.353 -3.892 1.00 0.00 C ATOM 731 CG1 VAL A 533 -6.986 9.965 -2.421 1.00 0.00 C ATOM 732 CG2 VAL A 533 -8.445 11.176 -4.048 1.00 0.00 C ATOM 0 H VAL A 533 -4.896 9.358 -4.451 1.00 0.00 H new ATOM 0 HA VAL A 533 -6.277 11.840 -5.176 1.00 0.00 H new ATOM 0 HB VAL A 533 -7.229 9.447 -4.495 1.00 0.00 H new ATOM 0 HG11 VAL A 533 -7.849 9.385 -2.093 1.00 0.00 H new ATOM 0 HG12 VAL A 533 -6.082 9.367 -2.308 1.00 0.00 H new ATOM 0 HG13 VAL A 533 -6.903 10.867 -1.814 1.00 0.00 H new ATOM 0 HG21 VAL A 533 -9.297 10.590 -3.703 1.00 0.00 H new ATOM 0 HG22 VAL A 533 -8.367 12.087 -3.455 1.00 0.00 H new ATOM 0 HG23 VAL A 533 -8.585 11.437 -5.097 1.00 0.00 H new ATOM 742 N PHE A 534 -4.488 11.442 -2.456 1.00 0.00 N ATOM 743 CA PHE A 534 -3.881 12.153 -1.334 1.00 0.00 C ATOM 744 C PHE A 534 -2.524 12.726 -1.736 1.00 0.00 C ATOM 745 O PHE A 534 -1.847 13.365 -0.929 1.00 0.00 O ATOM 746 CB PHE A 534 -3.709 11.197 -0.143 1.00 0.00 C ATOM 747 CG PHE A 534 -4.581 11.644 1.008 1.00 0.00 C ATOM 748 CD1 PHE A 534 -4.109 12.606 1.910 1.00 0.00 C ATOM 749 CD2 PHE A 534 -5.858 11.097 1.172 1.00 0.00 C ATOM 750 CE1 PHE A 534 -4.916 13.018 2.976 1.00 0.00 C ATOM 751 CE2 PHE A 534 -6.664 11.510 2.239 1.00 0.00 C ATOM 752 CZ PHE A 534 -6.193 12.470 3.140 1.00 0.00 C ATOM 0 H PHE A 534 -4.158 10.485 -2.579 1.00 0.00 H new ATOM 0 HA PHE A 534 -4.537 12.975 -1.046 1.00 0.00 H new ATOM 0 HB2 PHE A 534 -3.975 10.182 -0.439 1.00 0.00 H new ATOM 0 HB3 PHE A 534 -2.665 11.175 0.168 1.00 0.00 H new ATOM 0 HD1 PHE A 534 -3.124 13.029 1.783 1.00 0.00 H new ATOM 0 HD2 PHE A 534 -6.222 10.356 0.475 1.00 0.00 H new ATOM 0 HE1 PHE A 534 -4.553 13.759 3.673 1.00 0.00 H new ATOM 0 HE2 PHE A 534 -7.650 11.087 2.366 1.00 0.00 H new ATOM 0 HZ PHE A 534 -6.815 12.789 3.963 1.00 0.00 H new ATOM 762 N VAL A 535 -2.130 12.492 -2.981 1.00 0.00 N ATOM 763 CA VAL A 535 -0.850 12.990 -3.471 1.00 0.00 C ATOM 764 C VAL A 535 -0.699 14.475 -3.157 1.00 0.00 C ATOM 765 O VAL A 535 0.408 15.012 -3.164 1.00 0.00 O ATOM 766 CB VAL A 535 -0.750 12.774 -4.981 1.00 0.00 C ATOM 767 CG1 VAL A 535 -1.776 13.656 -5.694 1.00 0.00 C ATOM 768 CG2 VAL A 535 0.657 13.143 -5.458 1.00 0.00 C ATOM 0 H VAL A 535 -2.673 11.965 -3.665 1.00 0.00 H new ATOM 0 HA VAL A 535 -0.052 12.441 -2.972 1.00 0.00 H new ATOM 0 HB VAL A 535 -0.950 11.727 -5.210 1.00 0.00 H new ATOM 0 HG11 VAL A 535 -1.704 13.501 -6.770 1.00 0.00 H new ATOM 0 HG12 VAL A 535 -2.779 13.394 -5.356 1.00 0.00 H new ATOM 0 HG13 VAL A 535 -1.578 14.703 -5.464 1.00 0.00 H new ATOM 0 HG21 VAL A 535 0.728 12.989 -6.535 1.00 0.00 H new ATOM 0 HG22 VAL A 535 0.857 14.189 -5.227 1.00 0.00 H new ATOM 0 HG23 VAL A 535 1.389 12.514 -4.952 1.00 0.00 H new ATOM 778 N GLY A 536 -1.820 15.132 -2.878 1.00 0.00 N ATOM 779 CA GLY A 536 -1.800 16.556 -2.560 1.00 0.00 C ATOM 780 C GLY A 536 -1.266 16.790 -1.152 1.00 0.00 C ATOM 781 O GLY A 536 -0.229 17.431 -0.970 1.00 0.00 O ATOM 0 H GLY A 536 -2.747 14.706 -2.865 1.00 0.00 H new ATOM 0 HA2 GLY A 536 -1.178 17.085 -3.282 1.00 0.00 H new ATOM 0 HA3 GLY A 536 -2.806 16.966 -2.645 1.00 0.00 H new ATOM 785 N THR A 537 -1.979 16.270 -0.159 1.00 0.00 N ATOM 786 CA THR A 537 -1.570 16.426 1.233 1.00 0.00 C ATOM 787 C THR A 537 -0.788 15.202 1.700 1.00 0.00 C ATOM 788 O THR A 537 -0.626 14.236 0.955 1.00 0.00 O ATOM 789 CB THR A 537 -2.804 16.617 2.119 1.00 0.00 C ATOM 790 OG1 THR A 537 -3.354 15.347 2.441 1.00 0.00 O ATOM 791 CG2 THR A 537 -3.847 17.451 1.375 1.00 0.00 C ATOM 0 H THR A 537 -2.840 15.739 -0.291 1.00 0.00 H new ATOM 0 HA THR A 537 -0.928 17.304 1.310 1.00 0.00 H new ATOM 0 HB THR A 537 -2.516 17.133 3.035 1.00 0.00 H new ATOM 0 HG1 THR A 537 -3.476 14.826 1.620 1.00 0.00 H new ATOM 0 HG21 THR A 537 -4.724 17.585 2.008 1.00 0.00 H new ATOM 0 HG22 THR A 537 -3.425 18.425 1.128 1.00 0.00 H new ATOM 0 HG23 THR A 537 -4.136 16.938 0.458 1.00 0.00 H new ATOM 799 N CYS A 538 -0.306 15.251 2.938 1.00 0.00 N ATOM 800 CA CYS A 538 0.459 14.143 3.502 1.00 0.00 C ATOM 801 C CYS A 538 -0.318 13.479 4.634 1.00 0.00 C ATOM 802 O CYS A 538 -1.185 14.097 5.251 1.00 0.00 O ATOM 803 CB CYS A 538 1.799 14.657 4.033 1.00 0.00 C ATOM 804 SG CYS A 538 2.712 13.291 4.793 1.00 0.00 S ATOM 0 H CYS A 538 -0.431 16.043 3.568 1.00 0.00 H new ATOM 0 HA CYS A 538 0.635 13.407 2.718 1.00 0.00 H new ATOM 0 HB2 CYS A 538 2.382 15.090 3.220 1.00 0.00 H new ATOM 0 HB3 CYS A 538 1.633 15.449 4.764 1.00 0.00 H new ATOM 0 HG CYS A 538 3.851 13.727 5.242 1.00 0.00 H new ATOM 810 N ASN A 539 -0.002 12.217 4.898 1.00 0.00 N ATOM 811 CA ASN A 539 -0.679 11.478 5.958 1.00 0.00 C ATOM 812 C ASN A 539 -0.004 10.128 6.184 1.00 0.00 C ATOM 813 O ASN A 539 0.151 9.336 5.254 1.00 0.00 O ATOM 814 CB ASN A 539 -2.149 11.267 5.589 1.00 0.00 C ATOM 815 CG ASN A 539 -2.805 10.309 6.577 1.00 0.00 C ATOM 816 OD1 ASN A 539 -2.433 9.137 6.646 1.00 0.00 O ATOM 817 ND2 ASN A 539 -3.763 10.739 7.352 1.00 0.00 N ATOM 0 H ASN A 539 0.712 11.687 4.398 1.00 0.00 H new ATOM 0 HA ASN A 539 -0.618 12.058 6.879 1.00 0.00 H new ATOM 0 HB2 ASN A 539 -2.674 12.222 5.594 1.00 0.00 H new ATOM 0 HB3 ASN A 539 -2.224 10.867 4.578 1.00 0.00 H new ATOM 0 HD21 ASN A 539 -4.205 10.104 8.017 1.00 0.00 H new ATOM 0 HD22 ASN A 539 -4.069 11.710 7.293 1.00 0.00 H new ATOM 824 N GLY A 540 0.396 9.873 7.425 1.00 0.00 N ATOM 825 CA GLY A 540 1.054 8.616 7.763 1.00 0.00 C ATOM 826 C GLY A 540 0.039 7.485 7.908 1.00 0.00 C ATOM 827 O GLY A 540 0.328 6.335 7.579 1.00 0.00 O ATOM 0 H GLY A 540 0.277 10.515 8.209 1.00 0.00 H new ATOM 0 HA2 GLY A 540 1.778 8.362 6.989 1.00 0.00 H new ATOM 0 HA3 GLY A 540 1.609 8.732 8.694 1.00 0.00 H new ATOM 831 N ASP A 541 -1.147 7.820 8.404 1.00 0.00 N ATOM 832 CA ASP A 541 -2.196 6.823 8.590 1.00 0.00 C ATOM 833 C ASP A 541 -2.286 5.904 7.374 1.00 0.00 C ATOM 834 O ASP A 541 -2.514 4.703 7.507 1.00 0.00 O ATOM 835 CB ASP A 541 -3.544 7.514 8.813 1.00 0.00 C ATOM 836 CG ASP A 541 -4.530 6.543 9.454 1.00 0.00 C ATOM 837 OD1 ASP A 541 -4.181 5.384 9.598 1.00 0.00 O ATOM 838 OD2 ASP A 541 -5.621 6.975 9.789 1.00 0.00 O ATOM 0 H ASP A 541 -1.405 8.767 8.683 1.00 0.00 H new ATOM 0 HA ASP A 541 -1.948 6.223 9.466 1.00 0.00 H new ATOM 0 HB2 ASP A 541 -3.413 8.387 9.453 1.00 0.00 H new ATOM 0 HB3 ASP A 541 -3.940 7.872 7.863 1.00 0.00 H new ATOM 843 N ILE A 542 -2.105 6.480 6.189 1.00 0.00 N ATOM 844 CA ILE A 542 -2.168 5.703 4.956 1.00 0.00 C ATOM 845 C ILE A 542 -1.047 4.668 4.915 1.00 0.00 C ATOM 846 O ILE A 542 -1.253 3.532 4.491 1.00 0.00 O ATOM 847 CB ILE A 542 -2.055 6.632 3.746 1.00 0.00 C ATOM 848 CG1 ILE A 542 -3.254 7.582 3.718 1.00 0.00 C ATOM 849 CG2 ILE A 542 -2.035 5.800 2.462 1.00 0.00 C ATOM 850 CD1 ILE A 542 -3.001 8.691 2.694 1.00 0.00 C ATOM 0 H ILE A 542 -1.915 7.473 6.057 1.00 0.00 H new ATOM 0 HA ILE A 542 -3.126 5.184 4.925 1.00 0.00 H new ATOM 0 HB ILE A 542 -1.134 7.210 3.818 1.00 0.00 H new ATOM 0 HG12 ILE A 542 -4.160 7.034 3.460 1.00 0.00 H new ATOM 0 HG13 ILE A 542 -3.413 8.014 4.706 1.00 0.00 H new ATOM 0 HG21 ILE A 542 -1.954 6.463 1.600 1.00 0.00 H new ATOM 0 HG22 ILE A 542 -1.181 5.123 2.480 1.00 0.00 H new ATOM 0 HG23 ILE A 542 -2.955 5.221 2.389 1.00 0.00 H new ATOM 0 HD11 ILE A 542 -3.855 9.369 2.673 1.00 0.00 H new ATOM 0 HD12 ILE A 542 -2.105 9.245 2.972 1.00 0.00 H new ATOM 0 HD13 ILE A 542 -2.863 8.250 1.707 1.00 0.00 H new ATOM 862 N THR A 543 0.140 5.071 5.357 1.00 0.00 N ATOM 863 CA THR A 543 1.287 4.170 5.367 1.00 0.00 C ATOM 864 C THR A 543 1.078 3.047 6.379 1.00 0.00 C ATOM 865 O THR A 543 1.545 1.926 6.183 1.00 0.00 O ATOM 866 CB THR A 543 2.558 4.946 5.719 1.00 0.00 C ATOM 867 OG1 THR A 543 2.631 6.116 4.915 1.00 0.00 O ATOM 868 CG2 THR A 543 3.785 4.070 5.460 1.00 0.00 C ATOM 0 H THR A 543 0.332 6.008 5.710 1.00 0.00 H new ATOM 0 HA THR A 543 1.391 3.734 4.373 1.00 0.00 H new ATOM 0 HB THR A 543 2.533 5.226 6.772 1.00 0.00 H new ATOM 0 HG1 THR A 543 3.443 6.617 5.139 1.00 0.00 H new ATOM 0 HG21 THR A 543 4.688 4.626 5.712 1.00 0.00 H new ATOM 0 HG22 THR A 543 3.728 3.172 6.076 1.00 0.00 H new ATOM 0 HG23 THR A 543 3.814 3.787 4.408 1.00 0.00 H new ATOM 876 N THR A 544 0.373 3.359 7.459 1.00 0.00 N ATOM 877 CA THR A 544 0.106 2.371 8.498 1.00 0.00 C ATOM 878 C THR A 544 -0.714 1.216 7.936 1.00 0.00 C ATOM 879 O THR A 544 -0.490 0.056 8.280 1.00 0.00 O ATOM 880 CB THR A 544 -0.653 3.023 9.657 1.00 0.00 C ATOM 881 OG1 THR A 544 0.164 4.022 10.252 1.00 0.00 O ATOM 882 CG2 THR A 544 -1.006 1.961 10.699 1.00 0.00 C ATOM 0 H THR A 544 -0.022 4.282 7.638 1.00 0.00 H new ATOM 0 HA THR A 544 1.058 1.984 8.861 1.00 0.00 H new ATOM 0 HB THR A 544 -1.570 3.479 9.282 1.00 0.00 H new ATOM 0 HG1 THR A 544 -0.320 4.442 10.993 1.00 0.00 H new ATOM 0 HG21 THR A 544 -1.546 2.426 11.524 1.00 0.00 H new ATOM 0 HG22 THR A 544 -1.632 1.196 10.241 1.00 0.00 H new ATOM 0 HG23 THR A 544 -0.091 1.503 11.076 1.00 0.00 H new ATOM 890 N SER A 545 -1.665 1.543 7.067 1.00 0.00 N ATOM 891 CA SER A 545 -2.513 0.525 6.458 1.00 0.00 C ATOM 892 C SER A 545 -1.752 -0.213 5.360 1.00 0.00 C ATOM 893 O SER A 545 -1.610 -1.435 5.401 1.00 0.00 O ATOM 894 CB SER A 545 -3.769 1.180 5.873 1.00 0.00 C ATOM 895 OG SER A 545 -3.704 2.584 6.087 1.00 0.00 O ATOM 0 H SER A 545 -1.867 2.498 6.770 1.00 0.00 H new ATOM 0 HA SER A 545 -2.805 -0.194 7.223 1.00 0.00 H new ATOM 0 HB2 SER A 545 -3.843 0.965 4.807 1.00 0.00 H new ATOM 0 HB3 SER A 545 -4.662 0.769 6.344 1.00 0.00 H new ATOM 0 HG SER A 545 -3.881 3.052 5.244 1.00 0.00 H new ATOM 901 N ILE A 546 -1.267 0.543 4.383 1.00 0.00 N ATOM 902 CA ILE A 546 -0.520 -0.036 3.272 1.00 0.00 C ATOM 903 C ILE A 546 0.587 -0.950 3.796 1.00 0.00 C ATOM 904 O ILE A 546 0.822 -2.028 3.251 1.00 0.00 O ATOM 905 CB ILE A 546 0.064 1.100 2.406 1.00 0.00 C ATOM 906 CG1 ILE A 546 -0.719 1.202 1.093 1.00 0.00 C ATOM 907 CG2 ILE A 546 1.542 0.844 2.089 1.00 0.00 C ATOM 908 CD1 ILE A 546 -0.392 2.528 0.405 1.00 0.00 C ATOM 0 H ILE A 546 -1.377 1.556 4.337 1.00 0.00 H new ATOM 0 HA ILE A 546 -1.187 -0.641 2.658 1.00 0.00 H new ATOM 0 HB ILE A 546 -0.019 2.032 2.966 1.00 0.00 H new ATOM 0 HG12 ILE A 546 -0.463 0.368 0.439 1.00 0.00 H new ATOM 0 HG13 ILE A 546 -1.789 1.136 1.289 1.00 0.00 H new ATOM 0 HG21 ILE A 546 1.929 1.659 1.478 1.00 0.00 H new ATOM 0 HG22 ILE A 546 2.109 0.786 3.018 1.00 0.00 H new ATOM 0 HG23 ILE A 546 1.640 -0.096 1.545 1.00 0.00 H new ATOM 0 HD11 ILE A 546 -0.949 2.600 -0.529 1.00 0.00 H new ATOM 0 HD12 ILE A 546 -0.670 3.355 1.058 1.00 0.00 H new ATOM 0 HD13 ILE A 546 0.676 2.575 0.195 1.00 0.00 H new ATOM 920 N MET A 547 1.263 -0.514 4.852 1.00 0.00 N ATOM 921 CA MET A 547 2.342 -1.305 5.433 1.00 0.00 C ATOM 922 C MET A 547 1.784 -2.540 6.131 1.00 0.00 C ATOM 923 O MET A 547 2.403 -3.604 6.118 1.00 0.00 O ATOM 924 CB MET A 547 3.133 -0.458 6.432 1.00 0.00 C ATOM 925 CG MET A 547 4.309 -1.271 6.986 1.00 0.00 C ATOM 926 SD MET A 547 5.662 -0.150 7.425 1.00 0.00 S ATOM 927 CE MET A 547 6.473 -0.113 5.806 1.00 0.00 C ATOM 0 H MET A 547 1.086 0.375 5.320 1.00 0.00 H new ATOM 0 HA MET A 547 3.005 -1.627 4.630 1.00 0.00 H new ATOM 0 HB2 MET A 547 3.501 0.445 5.946 1.00 0.00 H new ATOM 0 HB3 MET A 547 2.483 -0.139 7.247 1.00 0.00 H new ATOM 0 HG2 MET A 547 3.993 -1.838 7.862 1.00 0.00 H new ATOM 0 HG3 MET A 547 4.647 -1.994 6.244 1.00 0.00 H new ATOM 0 HE1 MET A 547 7.379 -0.717 5.839 1.00 0.00 H new ATOM 0 HE2 MET A 547 5.797 -0.514 5.051 1.00 0.00 H new ATOM 0 HE3 MET A 547 6.732 0.915 5.552 1.00 0.00 H new ATOM 937 N ASP A 548 0.610 -2.395 6.738 1.00 0.00 N ATOM 938 CA ASP A 548 -0.020 -3.512 7.434 1.00 0.00 C ATOM 939 C ASP A 548 -0.116 -4.723 6.512 1.00 0.00 C ATOM 940 O ASP A 548 0.416 -5.791 6.815 1.00 0.00 O ATOM 941 CB ASP A 548 -1.420 -3.113 7.908 1.00 0.00 C ATOM 942 CG ASP A 548 -1.916 -4.100 8.958 1.00 0.00 C ATOM 943 OD1 ASP A 548 -2.270 -5.206 8.582 1.00 0.00 O ATOM 944 OD2 ASP A 548 -1.936 -3.736 10.123 1.00 0.00 O ATOM 0 H ASP A 548 0.080 -1.524 6.762 1.00 0.00 H new ATOM 0 HA ASP A 548 0.591 -3.772 8.298 1.00 0.00 H new ATOM 0 HB2 ASP A 548 -1.398 -2.106 8.325 1.00 0.00 H new ATOM 0 HB3 ASP A 548 -2.107 -3.093 7.062 1.00 0.00 H new ATOM 949 N ASN A 549 -0.793 -4.544 5.382 1.00 0.00 N ATOM 950 CA ASN A 549 -0.948 -5.628 4.419 1.00 0.00 C ATOM 951 C ASN A 549 0.417 -6.155 3.991 1.00 0.00 C ATOM 952 O ASN A 549 0.614 -7.363 3.857 1.00 0.00 O ATOM 953 CB ASN A 549 -1.715 -5.130 3.192 1.00 0.00 C ATOM 954 CG ASN A 549 -1.883 -6.263 2.186 1.00 0.00 C ATOM 955 OD1 ASN A 549 -1.467 -6.139 1.034 1.00 0.00 O ATOM 956 ND2 ASN A 549 -2.473 -7.368 2.553 1.00 0.00 N ATOM 0 H ASN A 549 -1.239 -3.667 5.112 1.00 0.00 H new ATOM 0 HA ASN A 549 -1.507 -6.436 4.891 1.00 0.00 H new ATOM 0 HB2 ASN A 549 -2.692 -4.752 3.493 1.00 0.00 H new ATOM 0 HB3 ASN A 549 -1.180 -4.300 2.731 1.00 0.00 H new ATOM 0 HD21 ASN A 549 -2.590 -8.130 1.885 1.00 0.00 H new ATOM 0 HD22 ASN A 549 -2.817 -7.470 3.508 1.00 0.00 H new ATOM 963 N PHE A 550 1.358 -5.240 3.781 1.00 0.00 N ATOM 964 CA PHE A 550 2.704 -5.625 3.371 1.00 0.00 C ATOM 965 C PHE A 550 3.299 -6.614 4.371 1.00 0.00 C ATOM 966 O PHE A 550 3.706 -7.717 4.002 1.00 0.00 O ATOM 967 CB PHE A 550 3.594 -4.375 3.281 1.00 0.00 C ATOM 968 CG PHE A 550 4.527 -4.480 2.092 1.00 0.00 C ATOM 969 CD1 PHE A 550 5.136 -5.701 1.778 1.00 0.00 C ATOM 970 CD2 PHE A 550 4.783 -3.349 1.306 1.00 0.00 C ATOM 971 CE1 PHE A 550 5.998 -5.791 0.680 1.00 0.00 C ATOM 972 CE2 PHE A 550 5.645 -3.440 0.207 1.00 0.00 C ATOM 973 CZ PHE A 550 6.253 -4.661 -0.106 1.00 0.00 C ATOM 0 H PHE A 550 1.216 -4.236 3.887 1.00 0.00 H new ATOM 0 HA PHE A 550 2.653 -6.104 2.393 1.00 0.00 H new ATOM 0 HB2 PHE A 550 2.973 -3.484 3.188 1.00 0.00 H new ATOM 0 HB3 PHE A 550 4.173 -4.265 4.198 1.00 0.00 H new ATOM 0 HD1 PHE A 550 4.940 -6.574 2.384 1.00 0.00 H new ATOM 0 HD2 PHE A 550 4.315 -2.406 1.548 1.00 0.00 H new ATOM 0 HE1 PHE A 550 6.467 -6.733 0.438 1.00 0.00 H new ATOM 0 HE2 PHE A 550 5.841 -2.568 -0.399 1.00 0.00 H new ATOM 0 HZ PHE A 550 6.919 -4.731 -0.954 1.00 0.00 H new ATOM 983 N LEU A 551 3.346 -6.211 5.636 1.00 0.00 N ATOM 984 CA LEU A 551 3.895 -7.068 6.682 1.00 0.00 C ATOM 985 C LEU A 551 3.313 -8.475 6.588 1.00 0.00 C ATOM 986 O LEU A 551 3.970 -9.452 6.947 1.00 0.00 O ATOM 987 CB LEU A 551 3.583 -6.475 8.061 1.00 0.00 C ATOM 988 CG LEU A 551 4.515 -5.287 8.342 1.00 0.00 C ATOM 989 CD1 LEU A 551 3.828 -4.310 9.299 1.00 0.00 C ATOM 990 CD2 LEU A 551 5.814 -5.790 8.981 1.00 0.00 C ATOM 0 H LEU A 551 3.013 -5.303 5.961 1.00 0.00 H new ATOM 0 HA LEU A 551 4.975 -7.126 6.546 1.00 0.00 H new ATOM 0 HB2 LEU A 551 2.543 -6.150 8.100 1.00 0.00 H new ATOM 0 HB3 LEU A 551 3.708 -7.237 8.831 1.00 0.00 H new ATOM 0 HG LEU A 551 4.742 -4.781 7.404 1.00 0.00 H new ATOM 0 HD11 LEU A 551 4.491 -3.468 9.497 1.00 0.00 H new ATOM 0 HD12 LEU A 551 2.905 -3.947 8.847 1.00 0.00 H new ATOM 0 HD13 LEU A 551 3.598 -4.819 10.235 1.00 0.00 H new ATOM 0 HD21 LEU A 551 6.473 -4.945 9.179 1.00 0.00 H new ATOM 0 HD22 LEU A 551 5.586 -6.299 9.917 1.00 0.00 H new ATOM 0 HD23 LEU A 551 6.309 -6.484 8.302 1.00 0.00 H new ATOM 1002 N GLU A 552 2.079 -8.574 6.104 1.00 0.00 N ATOM 1003 CA GLU A 552 1.426 -9.872 5.971 1.00 0.00 C ATOM 1004 C GLU A 552 1.846 -10.556 4.673 1.00 0.00 C ATOM 1005 O GLU A 552 2.353 -11.677 4.688 1.00 0.00 O ATOM 1006 CB GLU A 552 -0.094 -9.698 5.990 1.00 0.00 C ATOM 1007 CG GLU A 552 -0.532 -9.176 7.359 1.00 0.00 C ATOM 1008 CD GLU A 552 -1.961 -8.650 7.283 1.00 0.00 C ATOM 1009 OE1 GLU A 552 -2.797 -9.340 6.725 1.00 0.00 O ATOM 1010 OE2 GLU A 552 -2.199 -7.563 7.785 1.00 0.00 O ATOM 0 H GLU A 552 1.516 -7.780 5.800 1.00 0.00 H new ATOM 0 HA GLU A 552 1.730 -10.496 6.811 1.00 0.00 H new ATOM 0 HB2 GLU A 552 -0.401 -9.002 5.209 1.00 0.00 H new ATOM 0 HB3 GLU A 552 -0.582 -10.650 5.779 1.00 0.00 H new ATOM 0 HG2 GLU A 552 -0.468 -9.974 8.099 1.00 0.00 H new ATOM 0 HG3 GLU A 552 0.140 -8.382 7.687 1.00 0.00 H new ATOM 1017 N ARG A 553 1.633 -9.866 3.552 1.00 0.00 N ATOM 1018 CA ARG A 553 1.992 -10.403 2.239 1.00 0.00 C ATOM 1019 C ARG A 553 1.893 -11.925 2.218 1.00 0.00 C ATOM 1020 O ARG A 553 2.906 -12.624 2.251 1.00 0.00 O ATOM 1021 CB ARG A 553 3.416 -9.981 1.875 1.00 0.00 C ATOM 1022 CG ARG A 553 3.702 -10.359 0.420 1.00 0.00 C ATOM 1023 CD ARG A 553 5.124 -9.934 0.053 1.00 0.00 C ATOM 1024 NE ARG A 553 6.092 -10.857 0.635 1.00 0.00 N ATOM 1025 CZ ARG A 553 7.357 -10.496 0.826 1.00 0.00 C ATOM 1026 NH1 ARG A 553 8.158 -10.362 -0.196 1.00 0.00 N ATOM 1027 NH2 ARG A 553 7.798 -10.277 2.034 1.00 0.00 N ATOM 0 H ARG A 553 1.215 -8.936 3.527 1.00 0.00 H new ATOM 0 HA ARG A 553 1.289 -10.002 1.509 1.00 0.00 H new ATOM 0 HB2 ARG A 553 3.535 -8.906 2.013 1.00 0.00 H new ATOM 0 HB3 ARG A 553 4.132 -10.469 2.536 1.00 0.00 H new ATOM 0 HG2 ARG A 553 3.585 -11.434 0.283 1.00 0.00 H new ATOM 0 HG3 ARG A 553 2.984 -9.874 -0.241 1.00 0.00 H new ATOM 0 HD2 ARG A 553 5.237 -9.913 -1.031 1.00 0.00 H new ATOM 0 HD3 ARG A 553 5.313 -8.923 0.413 1.00 0.00 H new ATOM 0 HE ARG A 553 5.793 -11.796 0.900 1.00 0.00 H new ATOM 0 HH11 ARG A 553 7.813 -10.534 -1.140 1.00 0.00 H new ATOM 0 HH12 ARG A 553 9.129 -10.085 -0.050 1.00 0.00 H new ATOM 0 HH21 ARG A 553 7.172 -10.383 2.832 1.00 0.00 H new ATOM 0 HH22 ARG A 553 8.769 -10.000 2.180 1.00 0.00 H new ATOM 1041 N THR A 554 0.667 -12.433 2.162 1.00 0.00 N ATOM 1042 CA THR A 554 0.450 -13.875 2.135 1.00 0.00 C ATOM 1043 C THR A 554 0.920 -14.463 0.810 1.00 0.00 C ATOM 1044 O THR A 554 1.023 -13.752 -0.190 1.00 0.00 O ATOM 1045 CB THR A 554 -1.036 -14.181 2.339 1.00 0.00 C ATOM 1046 OG1 THR A 554 -1.813 -13.284 1.557 1.00 0.00 O ATOM 1047 CG2 THR A 554 -1.394 -14.011 3.815 1.00 0.00 C ATOM 0 H THR A 554 -0.185 -11.873 2.135 1.00 0.00 H new ATOM 0 HA THR A 554 1.027 -14.328 2.941 1.00 0.00 H new ATOM 0 HB THR A 554 -1.242 -15.206 2.032 1.00 0.00 H new ATOM 0 HG1 THR A 554 -2.765 -13.479 1.685 1.00 0.00 H new ATOM 0 HG21 THR A 554 -2.452 -14.229 3.960 1.00 0.00 H new ATOM 0 HG22 THR A 554 -0.797 -14.697 4.416 1.00 0.00 H new ATOM 0 HG23 THR A 554 -1.189 -12.986 4.123 1.00 0.00 H new ATOM 1055 N ALA A 555 1.198 -15.764 0.809 1.00 0.00 N ATOM 1056 CA ALA A 555 1.653 -16.442 -0.403 1.00 0.00 C ATOM 1057 C ALA A 555 0.845 -15.967 -1.603 1.00 0.00 C ATOM 1058 O ALA A 555 1.259 -16.125 -2.751 1.00 0.00 O ATOM 1059 CB ALA A 555 1.495 -17.956 -0.246 1.00 0.00 C ATOM 0 H ALA A 555 1.117 -16.367 1.628 1.00 0.00 H new ATOM 0 HA ALA A 555 2.705 -16.205 -0.563 1.00 0.00 H new ATOM 0 HB1 ALA A 555 1.836 -18.454 -1.154 1.00 0.00 H new ATOM 0 HB2 ALA A 555 2.090 -18.298 0.601 1.00 0.00 H new ATOM 0 HB3 ALA A 555 0.446 -18.196 -0.073 1.00 0.00 H new ATOM 1065 N ILE A 556 -0.306 -15.374 -1.316 1.00 0.00 N ATOM 1066 CA ILE A 556 -1.185 -14.858 -2.355 1.00 0.00 C ATOM 1067 C ILE A 556 -0.401 -13.935 -3.292 1.00 0.00 C ATOM 1068 O ILE A 556 -0.892 -13.540 -4.348 1.00 0.00 O ATOM 1069 CB ILE A 556 -2.351 -14.107 -1.677 1.00 0.00 C ATOM 1070 CG1 ILE A 556 -3.654 -14.895 -1.852 1.00 0.00 C ATOM 1071 CG2 ILE A 556 -2.528 -12.703 -2.267 1.00 0.00 C ATOM 1072 CD1 ILE A 556 -4.678 -14.417 -0.821 1.00 0.00 C ATOM 0 H ILE A 556 -0.654 -15.238 -0.367 1.00 0.00 H new ATOM 0 HA ILE A 556 -1.586 -15.674 -2.956 1.00 0.00 H new ATOM 0 HB ILE A 556 -2.114 -14.011 -0.617 1.00 0.00 H new ATOM 0 HG12 ILE A 556 -4.044 -14.755 -2.860 1.00 0.00 H new ATOM 0 HG13 ILE A 556 -3.467 -15.962 -1.728 1.00 0.00 H new ATOM 0 HG21 ILE A 556 -3.357 -12.201 -1.768 1.00 0.00 H new ATOM 0 HG22 ILE A 556 -1.614 -12.128 -2.119 1.00 0.00 H new ATOM 0 HG23 ILE A 556 -2.740 -12.781 -3.333 1.00 0.00 H new ATOM 0 HD11 ILE A 556 -5.606 -14.976 -0.943 1.00 0.00 H new ATOM 0 HD12 ILE A 556 -4.286 -14.579 0.183 1.00 0.00 H new ATOM 0 HD13 ILE A 556 -4.873 -13.355 -0.967 1.00 0.00 H new ATOM 1084 N GLU A 557 0.822 -13.603 -2.893 1.00 0.00 N ATOM 1085 CA GLU A 557 1.668 -12.729 -3.699 1.00 0.00 C ATOM 1086 C GLU A 557 2.189 -13.460 -4.934 1.00 0.00 C ATOM 1087 O GLU A 557 2.666 -12.833 -5.879 1.00 0.00 O ATOM 1088 CB GLU A 557 2.851 -12.228 -2.864 1.00 0.00 C ATOM 1089 CG GLU A 557 3.493 -13.402 -2.109 1.00 0.00 C ATOM 1090 CD GLU A 557 5.007 -13.221 -2.040 1.00 0.00 C ATOM 1091 OE1 GLU A 557 5.440 -12.102 -1.823 1.00 0.00 O ATOM 1092 OE2 GLU A 557 5.709 -14.204 -2.207 1.00 0.00 O ATOM 0 H GLU A 557 1.248 -13.923 -2.023 1.00 0.00 H new ATOM 0 HA GLU A 557 1.065 -11.881 -4.025 1.00 0.00 H new ATOM 0 HB2 GLU A 557 3.589 -11.753 -3.511 1.00 0.00 H new ATOM 0 HB3 GLU A 557 2.513 -11.471 -2.157 1.00 0.00 H new ATOM 0 HG2 GLU A 557 3.081 -13.465 -1.102 1.00 0.00 H new ATOM 0 HG3 GLU A 557 3.254 -14.340 -2.610 1.00 0.00 H new ATOM 1099 N LEU A 558 2.106 -14.789 -4.918 1.00 0.00 N ATOM 1100 CA LEU A 558 2.584 -15.588 -6.044 1.00 0.00 C ATOM 1101 C LEU A 558 2.162 -14.965 -7.374 1.00 0.00 C ATOM 1102 O LEU A 558 2.707 -15.300 -8.426 1.00 0.00 O ATOM 1103 CB LEU A 558 2.059 -17.030 -5.937 1.00 0.00 C ATOM 1104 CG LEU A 558 0.612 -17.127 -6.444 1.00 0.00 C ATOM 1105 CD1 LEU A 558 0.148 -18.582 -6.370 1.00 0.00 C ATOM 1106 CD2 LEU A 558 -0.301 -16.266 -5.571 1.00 0.00 C ATOM 0 H LEU A 558 1.717 -15.331 -4.146 1.00 0.00 H new ATOM 0 HA LEU A 558 3.673 -15.608 -6.009 1.00 0.00 H new ATOM 0 HB2 LEU A 558 2.697 -17.697 -6.517 1.00 0.00 H new ATOM 0 HB3 LEU A 558 2.108 -17.363 -4.900 1.00 0.00 H new ATOM 0 HG LEU A 558 0.567 -16.774 -7.474 1.00 0.00 H new ATOM 0 HD11 LEU A 558 -0.879 -18.655 -6.729 1.00 0.00 H new ATOM 0 HD12 LEU A 558 0.795 -19.202 -6.991 1.00 0.00 H new ATOM 0 HD13 LEU A 558 0.197 -18.927 -5.337 1.00 0.00 H new ATOM 0 HD21 LEU A 558 -1.326 -16.338 -5.935 1.00 0.00 H new ATOM 0 HD22 LEU A 558 -0.256 -16.618 -4.540 1.00 0.00 H new ATOM 0 HD23 LEU A 558 0.027 -15.228 -5.615 1.00 0.00 H new ATOM 1118 N LYS A 559 1.190 -14.060 -7.321 1.00 0.00 N ATOM 1119 CA LYS A 559 0.708 -13.402 -8.528 1.00 0.00 C ATOM 1120 C LYS A 559 1.713 -12.355 -9.001 1.00 0.00 C ATOM 1121 O LYS A 559 2.269 -11.607 -8.196 1.00 0.00 O ATOM 1122 CB LYS A 559 -0.647 -12.737 -8.255 1.00 0.00 C ATOM 1123 CG LYS A 559 -1.488 -12.725 -9.537 1.00 0.00 C ATOM 1124 CD LYS A 559 -2.675 -11.765 -9.371 1.00 0.00 C ATOM 1125 CE LYS A 559 -2.268 -10.358 -9.815 1.00 0.00 C ATOM 1126 NZ LYS A 559 -2.227 -10.300 -11.304 1.00 0.00 N ATOM 0 H LYS A 559 0.724 -13.768 -6.462 1.00 0.00 H new ATOM 0 HA LYS A 559 0.589 -14.152 -9.310 1.00 0.00 H new ATOM 0 HB2 LYS A 559 -1.175 -13.276 -7.468 1.00 0.00 H new ATOM 0 HB3 LYS A 559 -0.497 -11.718 -7.898 1.00 0.00 H new ATOM 0 HG2 LYS A 559 -0.874 -12.416 -10.383 1.00 0.00 H new ATOM 0 HG3 LYS A 559 -1.849 -13.730 -9.756 1.00 0.00 H new ATOM 0 HD2 LYS A 559 -3.522 -12.113 -9.963 1.00 0.00 H new ATOM 0 HD3 LYS A 559 -2.999 -11.749 -8.330 1.00 0.00 H new ATOM 0 HE2 LYS A 559 -2.977 -9.624 -9.431 1.00 0.00 H new ATOM 0 HE3 LYS A 559 -1.291 -10.103 -9.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 -2.255 -9.308 -11.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 -1.351 -10.744 -11.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 -3.047 -10.807 -11.694 1.00 0.00 H new ATOM 1140 N THR A 560 1.946 -12.312 -10.309 1.00 0.00 N ATOM 1141 CA THR A 560 2.892 -11.357 -10.878 1.00 0.00 C ATOM 1142 C THR A 560 2.230 -9.996 -11.078 1.00 0.00 C ATOM 1143 O THR A 560 1.029 -9.842 -10.862 1.00 0.00 O ATOM 1144 CB THR A 560 3.411 -11.874 -12.221 1.00 0.00 C ATOM 1145 OG1 THR A 560 2.313 -12.133 -13.085 1.00 0.00 O ATOM 1146 CG2 THR A 560 4.206 -13.164 -12.001 1.00 0.00 C ATOM 0 H THR A 560 1.497 -12.923 -10.991 1.00 0.00 H new ATOM 0 HA THR A 560 3.725 -11.244 -10.184 1.00 0.00 H new ATOM 0 HB THR A 560 4.059 -11.123 -12.673 1.00 0.00 H new ATOM 0 HG1 THR A 560 2.645 -12.463 -13.946 1.00 0.00 H new ATOM 0 HG21 THR A 560 4.575 -13.532 -12.958 1.00 0.00 H new ATOM 0 HG22 THR A 560 5.049 -12.964 -11.340 1.00 0.00 H new ATOM 0 HG23 THR A 560 3.560 -13.916 -11.548 1.00 0.00 H new ATOM 1154 N ASP A 561 3.025 -9.016 -11.495 1.00 0.00 N ATOM 1155 CA ASP A 561 2.511 -7.671 -11.726 1.00 0.00 C ATOM 1156 C ASP A 561 1.961 -7.071 -10.435 1.00 0.00 C ATOM 1157 O ASP A 561 1.440 -5.956 -10.431 1.00 0.00 O ATOM 1158 CB ASP A 561 1.406 -7.710 -12.786 1.00 0.00 C ATOM 1159 CG ASP A 561 1.158 -6.309 -13.336 1.00 0.00 C ATOM 1160 OD1 ASP A 561 0.630 -5.491 -12.601 1.00 0.00 O ATOM 1161 OD2 ASP A 561 1.498 -6.076 -14.484 1.00 0.00 O ATOM 0 H ASP A 561 4.022 -9.127 -11.679 1.00 0.00 H new ATOM 0 HA ASP A 561 3.332 -7.046 -12.078 1.00 0.00 H new ATOM 0 HB2 ASP A 561 1.691 -8.382 -13.596 1.00 0.00 H new ATOM 0 HB3 ASP A 561 0.488 -8.106 -12.352 1.00 0.00 H new ATOM 1166 N TRP A 562 2.079 -7.817 -9.341 1.00 0.00 N ATOM 1167 CA TRP A 562 1.589 -7.341 -8.051 1.00 0.00 C ATOM 1168 C TRP A 562 2.599 -6.396 -7.408 1.00 0.00 C ATOM 1169 O TRP A 562 2.249 -5.300 -6.974 1.00 0.00 O ATOM 1170 CB TRP A 562 1.331 -8.524 -7.116 1.00 0.00 C ATOM 1171 CG TRP A 562 0.739 -8.026 -5.837 1.00 0.00 C ATOM 1172 CD1 TRP A 562 -0.554 -7.669 -5.668 1.00 0.00 C ATOM 1173 CD2 TRP A 562 1.392 -7.822 -4.551 1.00 0.00 C ATOM 1174 NE1 TRP A 562 -0.737 -7.258 -4.360 1.00 0.00 N ATOM 1175 CE2 TRP A 562 0.433 -7.334 -3.631 1.00 0.00 C ATOM 1176 CE3 TRP A 562 2.709 -8.010 -4.096 1.00 0.00 C ATOM 1177 CZ2 TRP A 562 0.769 -7.044 -2.308 1.00 0.00 C ATOM 1178 CZ3 TRP A 562 3.051 -7.719 -2.765 1.00 0.00 C ATOM 1179 CH2 TRP A 562 2.083 -7.237 -1.873 1.00 0.00 C ATOM 0 H TRP A 562 2.505 -8.744 -9.320 1.00 0.00 H new ATOM 0 HA TRP A 562 0.657 -6.802 -8.219 1.00 0.00 H new ATOM 0 HB2 TRP A 562 0.655 -9.235 -7.590 1.00 0.00 H new ATOM 0 HB3 TRP A 562 2.262 -9.054 -6.916 1.00 0.00 H new ATOM 0 HD1 TRP A 562 -1.319 -7.700 -6.430 1.00 0.00 H new ATOM 0 HE1 TRP A 562 -1.628 -6.938 -3.980 1.00 0.00 H new ATOM 0 HE3 TRP A 562 3.463 -8.381 -4.775 1.00 0.00 H new ATOM 0 HZ2 TRP A 562 0.019 -6.673 -1.625 1.00 0.00 H new ATOM 0 HZ3 TRP A 562 4.066 -7.868 -2.427 1.00 0.00 H new ATOM 0 HH2 TRP A 562 2.352 -7.015 -0.851 1.00 0.00 H new ATOM 1190 N VAL A 563 3.854 -6.830 -7.352 1.00 0.00 N ATOM 1191 CA VAL A 563 4.907 -6.015 -6.758 1.00 0.00 C ATOM 1192 C VAL A 563 5.111 -4.731 -7.556 1.00 0.00 C ATOM 1193 O VAL A 563 5.526 -3.709 -7.010 1.00 0.00 O ATOM 1194 CB VAL A 563 6.217 -6.804 -6.714 1.00 0.00 C ATOM 1195 CG1 VAL A 563 6.590 -7.251 -8.128 1.00 0.00 C ATOM 1196 CG2 VAL A 563 7.327 -5.915 -6.151 1.00 0.00 C ATOM 0 H VAL A 563 4.165 -7.734 -7.708 1.00 0.00 H new ATOM 0 HA VAL A 563 4.606 -5.753 -5.744 1.00 0.00 H new ATOM 0 HB VAL A 563 6.094 -7.680 -6.077 1.00 0.00 H new ATOM 0 HG11 VAL A 563 7.523 -7.813 -8.098 1.00 0.00 H new ATOM 0 HG12 VAL A 563 5.798 -7.883 -8.530 1.00 0.00 H new ATOM 0 HG13 VAL A 563 6.714 -6.376 -8.765 1.00 0.00 H new ATOM 0 HG21 VAL A 563 8.261 -6.476 -6.119 1.00 0.00 H new ATOM 0 HG22 VAL A 563 7.451 -5.040 -6.789 1.00 0.00 H new ATOM 0 HG23 VAL A 563 7.061 -5.595 -5.143 1.00 0.00 H new ATOM 1206 N ARG A 564 4.819 -4.791 -8.851 1.00 0.00 N ATOM 1207 CA ARG A 564 4.977 -3.624 -9.711 1.00 0.00 C ATOM 1208 C ARG A 564 4.048 -2.500 -9.266 1.00 0.00 C ATOM 1209 O ARG A 564 4.494 -1.387 -8.987 1.00 0.00 O ATOM 1210 CB ARG A 564 4.667 -3.997 -11.162 1.00 0.00 C ATOM 1211 CG ARG A 564 5.721 -4.980 -11.675 1.00 0.00 C ATOM 1212 CD ARG A 564 5.599 -5.116 -13.193 1.00 0.00 C ATOM 1213 NE ARG A 564 6.330 -6.290 -13.655 1.00 0.00 N ATOM 1214 CZ ARG A 564 7.597 -6.492 -13.308 1.00 0.00 C ATOM 1215 NH1 ARG A 564 8.417 -5.481 -13.215 1.00 0.00 N ATOM 1216 NH2 ARG A 564 8.020 -7.701 -13.056 1.00 0.00 N ATOM 0 H ARG A 564 4.475 -5.626 -9.324 1.00 0.00 H new ATOM 0 HA ARG A 564 6.009 -3.280 -9.636 1.00 0.00 H new ATOM 0 HB2 ARG A 564 3.675 -4.444 -11.229 1.00 0.00 H new ATOM 0 HB3 ARG A 564 4.656 -3.102 -11.784 1.00 0.00 H new ATOM 0 HG2 ARG A 564 6.719 -4.630 -11.410 1.00 0.00 H new ATOM 0 HG3 ARG A 564 5.588 -5.952 -11.201 1.00 0.00 H new ATOM 0 HD2 ARG A 564 4.549 -5.198 -13.475 1.00 0.00 H new ATOM 0 HD3 ARG A 564 5.990 -4.221 -13.678 1.00 0.00 H new ATOM 0 HE ARG A 564 5.861 -6.968 -14.255 1.00 0.00 H new ATOM 0 HH11 ARG A 564 8.086 -4.536 -13.409 1.00 0.00 H new ATOM 0 HH12 ARG A 564 9.389 -5.636 -12.949 1.00 0.00 H new ATOM 0 HH21 ARG A 564 7.378 -8.491 -13.125 1.00 0.00 H new ATOM 0 HH22 ARG A 564 8.992 -7.856 -12.790 1.00 0.00 H new ATOM 1230 N PHE A 565 2.755 -2.798 -9.198 1.00 0.00 N ATOM 1231 CA PHE A 565 1.773 -1.803 -8.784 1.00 0.00 C ATOM 1232 C PHE A 565 2.073 -1.319 -7.367 1.00 0.00 C ATOM 1233 O PHE A 565 2.044 -0.119 -7.092 1.00 0.00 O ATOM 1234 CB PHE A 565 0.361 -2.407 -8.842 1.00 0.00 C ATOM 1235 CG PHE A 565 -0.373 -1.881 -10.055 1.00 0.00 C ATOM 1236 CD1 PHE A 565 0.247 -1.899 -11.311 1.00 0.00 C ATOM 1237 CD2 PHE A 565 -1.673 -1.374 -9.923 1.00 0.00 C ATOM 1238 CE1 PHE A 565 -0.433 -1.411 -12.433 1.00 0.00 C ATOM 1239 CE2 PHE A 565 -2.351 -0.888 -11.046 1.00 0.00 C ATOM 1240 CZ PHE A 565 -1.732 -0.905 -12.301 1.00 0.00 C ATOM 0 H PHE A 565 2.365 -3.713 -9.422 1.00 0.00 H new ATOM 0 HA PHE A 565 1.828 -0.953 -9.464 1.00 0.00 H new ATOM 0 HB2 PHE A 565 0.422 -3.494 -8.886 1.00 0.00 H new ATOM 0 HB3 PHE A 565 -0.189 -2.155 -7.935 1.00 0.00 H new ATOM 0 HD1 PHE A 565 1.249 -2.289 -11.414 1.00 0.00 H new ATOM 0 HD2 PHE A 565 -2.151 -1.359 -8.955 1.00 0.00 H new ATOM 0 HE1 PHE A 565 0.045 -1.425 -13.401 1.00 0.00 H new ATOM 0 HE2 PHE A 565 -3.353 -0.499 -10.944 1.00 0.00 H new ATOM 0 HZ PHE A 565 -2.256 -0.528 -13.167 1.00 0.00 H new ATOM 1250 N LEU A 566 2.359 -2.260 -6.473 1.00 0.00 N ATOM 1251 CA LEU A 566 2.660 -1.916 -5.088 1.00 0.00 C ATOM 1252 C LEU A 566 3.879 -0.999 -5.017 1.00 0.00 C ATOM 1253 O LEU A 566 3.969 -0.138 -4.142 1.00 0.00 O ATOM 1254 CB LEU A 566 2.922 -3.192 -4.279 1.00 0.00 C ATOM 1255 CG LEU A 566 2.653 -2.930 -2.790 1.00 0.00 C ATOM 1256 CD1 LEU A 566 1.167 -3.150 -2.484 1.00 0.00 C ATOM 1257 CD2 LEU A 566 3.491 -3.892 -1.943 1.00 0.00 C ATOM 0 H LEU A 566 2.389 -3.258 -6.680 1.00 0.00 H new ATOM 0 HA LEU A 566 1.803 -1.391 -4.666 1.00 0.00 H new ATOM 0 HB2 LEU A 566 2.282 -3.998 -4.637 1.00 0.00 H new ATOM 0 HB3 LEU A 566 3.953 -3.517 -4.420 1.00 0.00 H new ATOM 0 HG LEU A 566 2.923 -1.901 -2.553 1.00 0.00 H new ATOM 0 HD11 LEU A 566 0.982 -2.963 -1.426 1.00 0.00 H new ATOM 0 HD12 LEU A 566 0.567 -2.466 -3.084 1.00 0.00 H new ATOM 0 HD13 LEU A 566 0.894 -4.178 -2.724 1.00 0.00 H new ATOM 0 HD21 LEU A 566 3.300 -3.706 -0.886 1.00 0.00 H new ATOM 0 HD22 LEU A 566 3.221 -4.920 -2.185 1.00 0.00 H new ATOM 0 HD23 LEU A 566 4.549 -3.735 -2.154 1.00 0.00 H new ATOM 1269 N ALA A 567 4.813 -1.189 -5.943 1.00 0.00 N ATOM 1270 CA ALA A 567 6.020 -0.371 -5.974 1.00 0.00 C ATOM 1271 C ALA A 567 5.675 1.076 -6.308 1.00 0.00 C ATOM 1272 O ALA A 567 6.049 1.998 -5.582 1.00 0.00 O ATOM 1273 CB ALA A 567 7.000 -0.918 -7.014 1.00 0.00 C ATOM 0 H ALA A 567 4.759 -1.896 -6.676 1.00 0.00 H new ATOM 0 HA ALA A 567 6.484 -0.406 -4.988 1.00 0.00 H new ATOM 0 HB1 ALA A 567 7.898 -0.300 -7.029 1.00 0.00 H new ATOM 0 HB2 ALA A 567 7.269 -1.942 -6.757 1.00 0.00 H new ATOM 0 HB3 ALA A 567 6.532 -0.902 -7.998 1.00 0.00 H new ATOM 1279 N LEU A 568 4.960 1.270 -7.411 1.00 0.00 N ATOM 1280 CA LEU A 568 4.569 2.611 -7.831 1.00 0.00 C ATOM 1281 C LEU A 568 3.831 3.327 -6.702 1.00 0.00 C ATOM 1282 O LEU A 568 4.092 4.496 -6.422 1.00 0.00 O ATOM 1283 CB LEU A 568 3.668 2.532 -9.071 1.00 0.00 C ATOM 1284 CG LEU A 568 4.524 2.584 -10.341 1.00 0.00 C ATOM 1285 CD1 LEU A 568 5.451 1.369 -10.386 1.00 0.00 C ATOM 1286 CD2 LEU A 568 3.609 2.571 -11.568 1.00 0.00 C ATOM 0 H LEU A 568 4.641 0.522 -8.027 1.00 0.00 H new ATOM 0 HA LEU A 568 5.469 3.174 -8.077 1.00 0.00 H new ATOM 0 HB2 LEU A 568 3.087 1.610 -9.051 1.00 0.00 H new ATOM 0 HB3 LEU A 568 2.956 3.358 -9.067 1.00 0.00 H new ATOM 0 HG LEU A 568 5.123 3.495 -10.338 1.00 0.00 H new ATOM 0 HD11 LEU A 568 6.059 1.408 -11.290 1.00 0.00 H new ATOM 0 HD12 LEU A 568 6.101 1.375 -9.511 1.00 0.00 H new ATOM 0 HD13 LEU A 568 4.855 0.456 -10.389 1.00 0.00 H new ATOM 0 HD21 LEU A 568 4.214 2.608 -12.474 1.00 0.00 H new ATOM 0 HD22 LEU A 568 3.012 1.659 -11.567 1.00 0.00 H new ATOM 0 HD23 LEU A 568 2.948 3.437 -11.538 1.00 0.00 H new ATOM 1298 N ALA A 569 2.910 2.618 -6.057 1.00 0.00 N ATOM 1299 CA ALA A 569 2.143 3.200 -4.962 1.00 0.00 C ATOM 1300 C ALA A 569 3.075 3.782 -3.904 1.00 0.00 C ATOM 1301 O ALA A 569 2.932 4.937 -3.504 1.00 0.00 O ATOM 1302 CB ALA A 569 1.246 2.136 -4.326 1.00 0.00 C ATOM 0 H ALA A 569 2.678 1.648 -6.271 1.00 0.00 H new ATOM 0 HA ALA A 569 1.524 4.002 -5.365 1.00 0.00 H new ATOM 0 HB1 ALA A 569 0.677 2.580 -3.509 1.00 0.00 H new ATOM 0 HB2 ALA A 569 0.559 1.744 -5.076 1.00 0.00 H new ATOM 0 HB3 ALA A 569 1.862 1.324 -3.939 1.00 0.00 H new ATOM 1308 N LEU A 570 4.030 2.974 -3.455 1.00 0.00 N ATOM 1309 CA LEU A 570 4.982 3.419 -2.443 1.00 0.00 C ATOM 1310 C LEU A 570 5.952 4.438 -3.035 1.00 0.00 C ATOM 1311 O LEU A 570 6.664 5.127 -2.305 1.00 0.00 O ATOM 1312 CB LEU A 570 5.762 2.216 -1.895 1.00 0.00 C ATOM 1313 CG LEU A 570 4.981 1.565 -0.745 1.00 0.00 C ATOM 1314 CD1 LEU A 570 5.366 0.088 -0.635 1.00 0.00 C ATOM 1315 CD2 LEU A 570 5.318 2.274 0.571 1.00 0.00 C ATOM 0 H LEU A 570 4.165 2.014 -3.773 1.00 0.00 H new ATOM 0 HA LEU A 570 4.431 3.892 -1.630 1.00 0.00 H new ATOM 0 HB2 LEU A 570 5.930 1.489 -2.689 1.00 0.00 H new ATOM 0 HB3 LEU A 570 6.743 2.537 -1.544 1.00 0.00 H new ATOM 0 HG LEU A 570 3.913 1.650 -0.943 1.00 0.00 H new ATOM 0 HD11 LEU A 570 4.811 -0.373 0.182 1.00 0.00 H new ATOM 0 HD12 LEU A 570 5.127 -0.421 -1.569 1.00 0.00 H new ATOM 0 HD13 LEU A 570 6.435 0.004 -0.440 1.00 0.00 H new ATOM 0 HD21 LEU A 570 4.763 1.811 1.386 1.00 0.00 H new ATOM 0 HD22 LEU A 570 6.387 2.190 0.766 1.00 0.00 H new ATOM 0 HD23 LEU A 570 5.044 3.327 0.498 1.00 0.00 H new ATOM 1327 N GLY A 571 5.976 4.525 -4.361 1.00 0.00 N ATOM 1328 CA GLY A 571 6.864 5.463 -5.039 1.00 0.00 C ATOM 1329 C GLY A 571 6.248 6.857 -5.090 1.00 0.00 C ATOM 1330 O GLY A 571 6.900 7.848 -4.759 1.00 0.00 O ATOM 0 H GLY A 571 5.396 3.962 -4.983 1.00 0.00 H new ATOM 0 HA2 GLY A 571 7.822 5.503 -4.520 1.00 0.00 H new ATOM 0 HA3 GLY A 571 7.065 5.113 -6.051 1.00 0.00 H new ATOM 1334 N ILE A 572 4.988 6.925 -5.507 1.00 0.00 N ATOM 1335 CA ILE A 572 4.292 8.203 -5.596 1.00 0.00 C ATOM 1336 C ILE A 572 3.892 8.691 -4.207 1.00 0.00 C ATOM 1337 O ILE A 572 3.758 9.892 -3.975 1.00 0.00 O ATOM 1338 CB ILE A 572 3.044 8.055 -6.466 1.00 0.00 C ATOM 1339 CG1 ILE A 572 2.348 9.413 -6.594 1.00 0.00 C ATOM 1340 CG2 ILE A 572 2.087 7.052 -5.822 1.00 0.00 C ATOM 1341 CD1 ILE A 572 1.337 9.361 -7.741 1.00 0.00 C ATOM 0 H ILE A 572 4.432 6.117 -5.787 1.00 0.00 H new ATOM 0 HA ILE A 572 4.964 8.934 -6.046 1.00 0.00 H new ATOM 0 HB ILE A 572 3.332 7.698 -7.455 1.00 0.00 H new ATOM 0 HG12 ILE A 572 1.843 9.664 -5.661 1.00 0.00 H new ATOM 0 HG13 ILE A 572 3.084 10.195 -6.779 1.00 0.00 H new ATOM 0 HG21 ILE A 572 1.197 6.947 -6.443 1.00 0.00 H new ATOM 0 HG22 ILE A 572 2.581 6.085 -5.730 1.00 0.00 H new ATOM 0 HG23 ILE A 572 1.799 7.408 -4.833 1.00 0.00 H new ATOM 0 HD11 ILE A 572 0.841 10.327 -7.833 1.00 0.00 H new ATOM 0 HD12 ILE A 572 1.854 9.129 -8.672 1.00 0.00 H new ATOM 0 HD13 ILE A 572 0.594 8.590 -7.537 1.00 0.00 H new ATOM 1353 N LEU A 573 3.707 7.751 -3.286 1.00 0.00 N ATOM 1354 CA LEU A 573 3.328 8.098 -1.922 1.00 0.00 C ATOM 1355 C LEU A 573 4.474 8.823 -1.225 1.00 0.00 C ATOM 1356 O LEU A 573 4.278 9.871 -0.610 1.00 0.00 O ATOM 1357 CB LEU A 573 2.967 6.828 -1.144 1.00 0.00 C ATOM 1358 CG LEU A 573 2.450 7.196 0.253 1.00 0.00 C ATOM 1359 CD1 LEU A 573 1.127 7.962 0.140 1.00 0.00 C ATOM 1360 CD2 LEU A 573 2.229 5.913 1.059 1.00 0.00 C ATOM 0 H LEU A 573 3.812 6.751 -3.457 1.00 0.00 H new ATOM 0 HA LEU A 573 2.461 8.758 -1.954 1.00 0.00 H new ATOM 0 HB2 LEU A 573 2.207 6.264 -1.685 1.00 0.00 H new ATOM 0 HB3 LEU A 573 3.842 6.183 -1.059 1.00 0.00 H new ATOM 0 HG LEU A 573 3.183 7.828 0.754 1.00 0.00 H new ATOM 0 HD11 LEU A 573 0.769 8.218 1.137 1.00 0.00 H new ATOM 0 HD12 LEU A 573 1.283 8.875 -0.435 1.00 0.00 H new ATOM 0 HD13 LEU A 573 0.387 7.338 -0.362 1.00 0.00 H new ATOM 0 HD21 LEU A 573 1.861 6.167 2.053 1.00 0.00 H new ATOM 0 HD22 LEU A 573 1.497 5.286 0.551 1.00 0.00 H new ATOM 0 HD23 LEU A 573 3.171 5.372 1.148 1.00 0.00 H new ATOM 1372 N TYR A 574 5.674 8.259 -1.331 1.00 0.00 N ATOM 1373 CA TYR A 574 6.854 8.857 -0.714 1.00 0.00 C ATOM 1374 C TYR A 574 7.570 9.767 -1.712 1.00 0.00 C ATOM 1375 O TYR A 574 8.767 10.028 -1.582 1.00 0.00 O ATOM 1376 CB TYR A 574 7.808 7.751 -0.238 1.00 0.00 C ATOM 1377 CG TYR A 574 7.500 7.393 1.199 1.00 0.00 C ATOM 1378 CD1 TYR A 574 6.195 7.050 1.571 1.00 0.00 C ATOM 1379 CD2 TYR A 574 8.522 7.402 2.158 1.00 0.00 C ATOM 1380 CE1 TYR A 574 5.911 6.717 2.900 1.00 0.00 C ATOM 1381 CE2 TYR A 574 8.236 7.070 3.488 1.00 0.00 C ATOM 1382 CZ TYR A 574 6.932 6.727 3.859 1.00 0.00 C ATOM 1383 OH TYR A 574 6.651 6.399 5.170 1.00 0.00 O ATOM 0 H TYR A 574 5.855 7.392 -1.837 1.00 0.00 H new ATOM 0 HA TYR A 574 6.540 9.454 0.142 1.00 0.00 H new ATOM 0 HB2 TYR A 574 7.704 6.871 -0.872 1.00 0.00 H new ATOM 0 HB3 TYR A 574 8.841 8.087 -0.325 1.00 0.00 H new ATOM 0 HD1 TYR A 574 5.407 7.042 0.832 1.00 0.00 H new ATOM 0 HD2 TYR A 574 9.530 7.665 1.871 1.00 0.00 H new ATOM 0 HE1 TYR A 574 4.904 6.452 3.187 1.00 0.00 H new ATOM 0 HE2 TYR A 574 9.023 7.079 4.228 1.00 0.00 H new ATOM 0 HH TYR A 574 7.471 6.455 5.704 1.00 0.00 H new ATOM 1393 N MET A 575 6.831 10.249 -2.705 1.00 0.00 N ATOM 1394 CA MET A 575 7.407 11.129 -3.715 1.00 0.00 C ATOM 1395 C MET A 575 8.175 12.269 -3.054 1.00 0.00 C ATOM 1396 O MET A 575 7.631 12.999 -2.226 1.00 0.00 O ATOM 1397 CB MET A 575 6.301 11.704 -4.603 1.00 0.00 C ATOM 1398 CG MET A 575 6.921 12.362 -5.839 1.00 0.00 C ATOM 1399 SD MET A 575 5.723 13.500 -6.579 1.00 0.00 S ATOM 1400 CE MET A 575 6.358 13.427 -8.272 1.00 0.00 C ATOM 0 H MET A 575 5.839 10.047 -2.832 1.00 0.00 H new ATOM 0 HA MET A 575 8.096 10.546 -4.327 1.00 0.00 H new ATOM 0 HB2 MET A 575 5.616 10.912 -4.906 1.00 0.00 H new ATOM 0 HB3 MET A 575 5.716 12.435 -4.045 1.00 0.00 H new ATOM 0 HG2 MET A 575 7.827 12.900 -5.562 1.00 0.00 H new ATOM 0 HG3 MET A 575 7.211 11.601 -6.563 1.00 0.00 H new ATOM 0 HE1 MET A 575 5.755 14.068 -8.915 1.00 0.00 H new ATOM 0 HE2 MET A 575 7.393 13.768 -8.287 1.00 0.00 H new ATOM 0 HE3 MET A 575 6.309 12.400 -8.635 1.00 0.00 H new ATOM 1410 N GLY A 576 9.443 12.416 -3.426 1.00 0.00 N ATOM 1411 CA GLY A 576 10.278 13.471 -2.861 1.00 0.00 C ATOM 1412 C GLY A 576 10.260 13.425 -1.336 1.00 0.00 C ATOM 1413 O GLY A 576 9.514 14.163 -0.693 1.00 0.00 O ATOM 0 H GLY A 576 9.912 11.823 -4.111 1.00 0.00 H new ATOM 0 HA2 GLY A 576 11.301 13.361 -3.220 1.00 0.00 H new ATOM 0 HA3 GLY A 576 9.923 14.443 -3.203 1.00 0.00 H new ATOM 1417 N GLN A 577 11.087 12.552 -0.764 1.00 0.00 N ATOM 1418 CA GLN A 577 11.163 12.414 0.689 1.00 0.00 C ATOM 1419 C GLN A 577 12.603 12.594 1.164 1.00 0.00 C ATOM 1420 O GLN A 577 13.467 13.032 0.404 1.00 0.00 O ATOM 1421 CB GLN A 577 10.652 11.031 1.108 1.00 0.00 C ATOM 1422 CG GLN A 577 9.121 11.015 1.067 1.00 0.00 C ATOM 1423 CD GLN A 577 8.556 11.681 2.317 1.00 0.00 C ATOM 1424 OE1 GLN A 577 7.342 11.694 2.520 1.00 0.00 O ATOM 1425 NE2 GLN A 577 9.370 12.238 3.172 1.00 0.00 N ATOM 0 H GLN A 577 11.711 11.933 -1.281 1.00 0.00 H new ATOM 0 HA GLN A 577 10.541 13.184 1.146 1.00 0.00 H new ATOM 0 HB2 GLN A 577 11.052 10.267 0.441 1.00 0.00 H new ATOM 0 HB3 GLN A 577 11.002 10.792 2.112 1.00 0.00 H new ATOM 0 HG2 GLN A 577 8.768 11.536 0.177 1.00 0.00 H new ATOM 0 HG3 GLN A 577 8.762 9.988 0.999 1.00 0.00 H new ATOM 0 HE21 GLN A 577 10.376 12.226 3.001 1.00 0.00 H new ATOM 0 HE22 GLN A 577 9.001 12.685 4.011 1.00 0.00 H new ATOM 1434 N GLY A 578 12.853 12.256 2.426 1.00 0.00 N ATOM 1435 CA GLY A 578 14.191 12.386 2.994 1.00 0.00 C ATOM 1436 C GLY A 578 14.457 11.284 4.013 1.00 0.00 C ATOM 1437 O GLY A 578 14.174 10.112 3.763 1.00 0.00 O ATOM 0 H GLY A 578 12.152 11.892 3.071 1.00 0.00 H new ATOM 0 HA2 GLY A 578 14.935 12.339 2.198 1.00 0.00 H new ATOM 0 HA3 GLY A 578 14.295 13.361 3.470 1.00 0.00 H new ATOM 1441 N GLU A 579 15.004 11.666 5.163 1.00 0.00 N ATOM 1442 CA GLU A 579 15.304 10.700 6.213 1.00 0.00 C ATOM 1443 C GLU A 579 14.114 9.778 6.451 1.00 0.00 C ATOM 1444 O GLU A 579 14.258 8.700 7.028 1.00 0.00 O ATOM 1445 CB GLU A 579 15.655 11.430 7.511 1.00 0.00 C ATOM 1446 CG GLU A 579 16.769 12.444 7.243 1.00 0.00 C ATOM 1447 CD GLU A 579 17.298 12.997 8.561 1.00 0.00 C ATOM 1448 OE1 GLU A 579 16.754 13.984 9.027 1.00 0.00 O ATOM 1449 OE2 GLU A 579 18.241 12.427 9.085 1.00 0.00 O ATOM 0 H GLU A 579 15.247 12.630 5.390 1.00 0.00 H new ATOM 0 HA GLU A 579 16.155 10.099 5.893 1.00 0.00 H new ATOM 0 HB2 GLU A 579 14.774 11.937 7.905 1.00 0.00 H new ATOM 0 HB3 GLU A 579 15.975 10.714 8.268 1.00 0.00 H new ATOM 0 HG2 GLU A 579 17.578 11.970 6.687 1.00 0.00 H new ATOM 0 HG3 GLU A 579 16.391 13.257 6.624 1.00 0.00 H new ATOM 1456 N GLN A 580 12.938 10.207 6.004 1.00 0.00 N ATOM 1457 CA GLN A 580 11.731 9.407 6.175 1.00 0.00 C ATOM 1458 C GLN A 580 11.909 8.032 5.541 1.00 0.00 C ATOM 1459 O GLN A 580 11.391 7.034 6.042 1.00 0.00 O ATOM 1460 CB GLN A 580 10.536 10.117 5.535 1.00 0.00 C ATOM 1461 CG GLN A 580 9.234 9.524 6.081 1.00 0.00 C ATOM 1462 CD GLN A 580 8.963 10.062 7.482 1.00 0.00 C ATOM 1463 OE1 GLN A 580 9.283 9.405 8.472 1.00 0.00 O ATOM 1464 NE2 GLN A 580 8.390 11.225 7.625 1.00 0.00 N ATOM 0 H GLN A 580 12.796 11.096 5.525 1.00 0.00 H new ATOM 0 HA GLN A 580 11.547 9.283 7.242 1.00 0.00 H new ATOM 0 HB2 GLN A 580 10.578 11.185 5.748 1.00 0.00 H new ATOM 0 HB3 GLN A 580 10.572 10.006 4.451 1.00 0.00 H new ATOM 0 HG2 GLN A 580 8.405 9.775 5.419 1.00 0.00 H new ATOM 0 HG3 GLN A 580 9.303 8.436 6.107 1.00 0.00 H new ATOM 0 HE21 GLN A 580 8.126 11.768 6.803 1.00 0.00 H new ATOM 0 HE22 GLN A 580 8.206 11.592 8.559 1.00 0.00 H new ATOM 1473 N VAL A 581 12.645 7.989 4.436 1.00 0.00 N ATOM 1474 CA VAL A 581 12.886 6.731 3.739 1.00 0.00 C ATOM 1475 C VAL A 581 13.804 5.833 4.562 1.00 0.00 C ATOM 1476 O VAL A 581 13.522 4.649 4.752 1.00 0.00 O ATOM 1477 CB VAL A 581 13.521 7.006 2.375 1.00 0.00 C ATOM 1478 CG1 VAL A 581 13.903 5.681 1.710 1.00 0.00 C ATOM 1479 CG2 VAL A 581 12.517 7.747 1.488 1.00 0.00 C ATOM 0 H VAL A 581 13.082 8.804 4.006 1.00 0.00 H new ATOM 0 HA VAL A 581 11.932 6.223 3.598 1.00 0.00 H new ATOM 0 HB VAL A 581 14.414 7.616 2.508 1.00 0.00 H new ATOM 0 HG11 VAL A 581 14.355 5.879 0.738 1.00 0.00 H new ATOM 0 HG12 VAL A 581 14.616 5.150 2.341 1.00 0.00 H new ATOM 0 HG13 VAL A 581 13.010 5.070 1.577 1.00 0.00 H new ATOM 0 HG21 VAL A 581 12.967 7.944 0.515 1.00 0.00 H new ATOM 0 HG22 VAL A 581 11.625 7.134 1.358 1.00 0.00 H new ATOM 0 HG23 VAL A 581 12.243 8.691 1.959 1.00 0.00 H new ATOM 1489 N ASP A 582 14.901 6.402 5.050 1.00 0.00 N ATOM 1490 CA ASP A 582 15.852 5.640 5.851 1.00 0.00 C ATOM 1491 C ASP A 582 15.131 4.888 6.966 1.00 0.00 C ATOM 1492 O ASP A 582 15.460 3.743 7.269 1.00 0.00 O ATOM 1493 CB ASP A 582 16.896 6.580 6.458 1.00 0.00 C ATOM 1494 CG ASP A 582 17.484 7.477 5.375 1.00 0.00 C ATOM 1495 OD1 ASP A 582 17.395 7.108 4.215 1.00 0.00 O ATOM 1496 OD2 ASP A 582 18.016 8.519 5.720 1.00 0.00 O ATOM 0 H ASP A 582 15.152 7.380 4.907 1.00 0.00 H new ATOM 0 HA ASP A 582 16.348 4.918 5.203 1.00 0.00 H new ATOM 0 HB2 ASP A 582 16.439 7.189 7.238 1.00 0.00 H new ATOM 0 HB3 ASP A 582 17.688 6.000 6.931 1.00 0.00 H new ATOM 1501 N ASP A 583 14.146 5.542 7.574 1.00 0.00 N ATOM 1502 CA ASP A 583 13.388 4.926 8.657 1.00 0.00 C ATOM 1503 C ASP A 583 12.591 3.728 8.147 1.00 0.00 C ATOM 1504 O ASP A 583 12.646 2.644 8.728 1.00 0.00 O ATOM 1505 CB ASP A 583 12.432 5.950 9.272 1.00 0.00 C ATOM 1506 CG ASP A 583 13.206 7.188 9.708 1.00 0.00 C ATOM 1507 OD1 ASP A 583 14.368 7.045 10.050 1.00 0.00 O ATOM 1508 OD2 ASP A 583 12.626 8.261 9.695 1.00 0.00 O ATOM 0 H ASP A 583 13.856 6.491 7.338 1.00 0.00 H new ATOM 0 HA ASP A 583 14.092 4.581 9.414 1.00 0.00 H new ATOM 0 HB2 ASP A 583 11.666 6.226 8.547 1.00 0.00 H new ATOM 0 HB3 ASP A 583 11.918 5.512 10.128 1.00 0.00 H new ATOM 1513 N VAL A 584 11.849 3.932 7.063 1.00 0.00 N ATOM 1514 CA VAL A 584 11.043 2.858 6.489 1.00 0.00 C ATOM 1515 C VAL A 584 11.917 1.659 6.134 1.00 0.00 C ATOM 1516 O VAL A 584 11.530 0.512 6.357 1.00 0.00 O ATOM 1517 CB VAL A 584 10.321 3.360 5.237 1.00 0.00 C ATOM 1518 CG1 VAL A 584 9.598 2.194 4.558 1.00 0.00 C ATOM 1519 CG2 VAL A 584 9.301 4.430 5.634 1.00 0.00 C ATOM 0 H VAL A 584 11.788 4.822 6.568 1.00 0.00 H new ATOM 0 HA VAL A 584 10.308 2.545 7.230 1.00 0.00 H new ATOM 0 HB VAL A 584 11.048 3.786 4.546 1.00 0.00 H new ATOM 0 HG11 VAL A 584 9.084 2.554 3.666 1.00 0.00 H new ATOM 0 HG12 VAL A 584 10.323 1.431 4.276 1.00 0.00 H new ATOM 0 HG13 VAL A 584 8.871 1.766 5.248 1.00 0.00 H new ATOM 0 HG21 VAL A 584 8.785 4.789 4.743 1.00 0.00 H new ATOM 0 HG22 VAL A 584 8.575 4.002 6.326 1.00 0.00 H new ATOM 0 HG23 VAL A 584 9.815 5.262 6.116 1.00 0.00 H new ATOM 1529 N LEU A 585 13.093 1.929 5.579 1.00 0.00 N ATOM 1530 CA LEU A 585 14.008 0.860 5.196 1.00 0.00 C ATOM 1531 C LEU A 585 14.428 0.047 6.417 1.00 0.00 C ATOM 1532 O LEU A 585 14.274 -1.174 6.443 1.00 0.00 O ATOM 1533 CB LEU A 585 15.249 1.446 4.521 1.00 0.00 C ATOM 1534 CG LEU A 585 14.854 2.119 3.202 1.00 0.00 C ATOM 1535 CD1 LEU A 585 16.067 2.852 2.625 1.00 0.00 C ATOM 1536 CD2 LEU A 585 14.370 1.060 2.199 1.00 0.00 C ATOM 0 H LEU A 585 13.433 2.871 5.385 1.00 0.00 H new ATOM 0 HA LEU A 585 13.491 0.203 4.496 1.00 0.00 H new ATOM 0 HB2 LEU A 585 15.725 2.171 5.181 1.00 0.00 H new ATOM 0 HB3 LEU A 585 15.978 0.658 4.334 1.00 0.00 H new ATOM 0 HG LEU A 585 14.049 2.830 3.387 1.00 0.00 H new ATOM 0 HD11 LEU A 585 15.790 3.332 1.687 1.00 0.00 H new ATOM 0 HD12 LEU A 585 16.406 3.608 3.333 1.00 0.00 H new ATOM 0 HD13 LEU A 585 16.871 2.139 2.444 1.00 0.00 H new ATOM 0 HD21 LEU A 585 14.091 1.545 1.264 1.00 0.00 H new ATOM 0 HD22 LEU A 585 15.170 0.344 2.012 1.00 0.00 H new ATOM 0 HD23 LEU A 585 13.505 0.539 2.609 1.00 0.00 H new ATOM 1548 N GLU A 586 14.959 0.731 7.426 1.00 0.00 N ATOM 1549 CA GLU A 586 15.398 0.058 8.644 1.00 0.00 C ATOM 1550 C GLU A 586 14.359 -0.965 9.097 1.00 0.00 C ATOM 1551 O GLU A 586 14.671 -2.142 9.275 1.00 0.00 O ATOM 1552 CB GLU A 586 15.627 1.084 9.756 1.00 0.00 C ATOM 1553 CG GLU A 586 16.919 1.855 9.483 1.00 0.00 C ATOM 1554 CD GLU A 586 17.180 2.853 10.606 1.00 0.00 C ATOM 1555 OE1 GLU A 586 16.360 2.929 11.506 1.00 0.00 O ATOM 1556 OE2 GLU A 586 18.196 3.526 10.550 1.00 0.00 O ATOM 0 H GLU A 586 15.095 1.742 7.425 1.00 0.00 H new ATOM 0 HA GLU A 586 16.333 -0.461 8.432 1.00 0.00 H new ATOM 0 HB2 GLU A 586 14.784 1.773 9.808 1.00 0.00 H new ATOM 0 HB3 GLU A 586 15.688 0.582 10.721 1.00 0.00 H new ATOM 0 HG2 GLU A 586 17.755 1.161 9.401 1.00 0.00 H new ATOM 0 HG3 GLU A 586 16.845 2.379 8.530 1.00 0.00 H new ATOM 1563 N THR A 587 13.124 -0.507 9.281 1.00 0.00 N ATOM 1564 CA THR A 587 12.049 -1.393 9.714 1.00 0.00 C ATOM 1565 C THR A 587 11.961 -2.614 8.804 1.00 0.00 C ATOM 1566 O THR A 587 11.929 -3.750 9.276 1.00 0.00 O ATOM 1567 CB THR A 587 10.716 -0.643 9.695 1.00 0.00 C ATOM 1568 OG1 THR A 587 10.828 0.537 10.479 1.00 0.00 O ATOM 1569 CG2 THR A 587 9.616 -1.538 10.268 1.00 0.00 C ATOM 0 H THR A 587 12.845 0.464 9.138 1.00 0.00 H new ATOM 0 HA THR A 587 12.264 -1.726 10.729 1.00 0.00 H new ATOM 0 HB THR A 587 10.463 -0.375 8.669 1.00 0.00 H new ATOM 0 HG1 THR A 587 9.975 1.020 10.467 1.00 0.00 H new ATOM 0 HG21 THR A 587 8.667 -1.002 10.254 1.00 0.00 H new ATOM 0 HG22 THR A 587 9.531 -2.442 9.665 1.00 0.00 H new ATOM 0 HG23 THR A 587 9.865 -1.808 11.294 1.00 0.00 H new ATOM 1577 N ILE A 588 11.920 -2.371 7.498 1.00 0.00 N ATOM 1578 CA ILE A 588 11.835 -3.459 6.530 1.00 0.00 C ATOM 1579 C ILE A 588 13.076 -4.343 6.605 1.00 0.00 C ATOM 1580 O ILE A 588 13.016 -5.538 6.316 1.00 0.00 O ATOM 1581 CB ILE A 588 11.694 -2.891 5.117 1.00 0.00 C ATOM 1582 CG1 ILE A 588 10.383 -2.108 5.011 1.00 0.00 C ATOM 1583 CG2 ILE A 588 11.685 -4.035 4.103 1.00 0.00 C ATOM 1584 CD1 ILE A 588 10.367 -1.316 3.702 1.00 0.00 C ATOM 0 H ILE A 588 11.944 -1.438 7.088 1.00 0.00 H new ATOM 0 HA ILE A 588 10.959 -4.063 6.767 1.00 0.00 H new ATOM 0 HB ILE A 588 12.534 -2.228 4.908 1.00 0.00 H new ATOM 0 HG12 ILE A 588 9.535 -2.792 5.045 1.00 0.00 H new ATOM 0 HG13 ILE A 588 10.281 -1.431 5.859 1.00 0.00 H new ATOM 0 HG21 ILE A 588 11.584 -3.628 3.097 1.00 0.00 H new ATOM 0 HG22 ILE A 588 12.618 -4.594 4.177 1.00 0.00 H new ATOM 0 HG23 ILE A 588 10.846 -4.699 4.311 1.00 0.00 H new ATOM 0 HD11 ILE A 588 9.434 -0.758 3.626 1.00 0.00 H new ATOM 0 HD12 ILE A 588 11.207 -0.622 3.687 1.00 0.00 H new ATOM 0 HD13 ILE A 588 10.449 -2.003 2.860 1.00 0.00 H new ATOM 1596 N SER A 589 14.199 -3.749 6.994 1.00 0.00 N ATOM 1597 CA SER A 589 15.449 -4.493 7.102 1.00 0.00 C ATOM 1598 C SER A 589 15.517 -5.237 8.432 1.00 0.00 C ATOM 1599 O SER A 589 16.260 -6.209 8.573 1.00 0.00 O ATOM 1600 CB SER A 589 16.638 -3.539 6.988 1.00 0.00 C ATOM 1601 OG SER A 589 16.772 -3.114 5.638 1.00 0.00 O ATOM 0 H SER A 589 14.270 -2.761 7.238 1.00 0.00 H new ATOM 0 HA SER A 589 15.488 -5.219 6.290 1.00 0.00 H new ATOM 0 HB2 SER A 589 16.491 -2.678 7.640 1.00 0.00 H new ATOM 0 HB3 SER A 589 17.551 -4.036 7.317 1.00 0.00 H new ATOM 0 HG SER A 589 17.533 -2.501 5.562 1.00 0.00 H new ATOM 1607 N ALA A 590 14.736 -4.775 9.403 1.00 0.00 N ATOM 1608 CA ALA A 590 14.716 -5.405 10.717 1.00 0.00 C ATOM 1609 C ALA A 590 14.034 -6.769 10.648 1.00 0.00 C ATOM 1610 O ALA A 590 14.600 -7.780 11.064 1.00 0.00 O ATOM 1611 CB ALA A 590 13.972 -4.513 11.712 1.00 0.00 C ATOM 0 H ALA A 590 14.113 -3.973 9.306 1.00 0.00 H new ATOM 0 HA ALA A 590 15.745 -5.542 11.049 1.00 0.00 H new ATOM 0 HB1 ALA A 590 13.961 -4.991 12.692 1.00 0.00 H new ATOM 0 HB2 ALA A 590 14.476 -3.549 11.784 1.00 0.00 H new ATOM 0 HB3 ALA A 590 12.948 -4.363 11.371 1.00 0.00 H new ATOM 1617 N ILE A 591 12.816 -6.787 10.119 1.00 0.00 N ATOM 1618 CA ILE A 591 12.062 -8.030 9.999 1.00 0.00 C ATOM 1619 C ILE A 591 12.759 -8.994 9.044 1.00 0.00 C ATOM 1620 O ILE A 591 13.345 -8.579 8.044 1.00 0.00 O ATOM 1621 CB ILE A 591 10.651 -7.732 9.490 1.00 0.00 C ATOM 1622 CG1 ILE A 591 10.737 -6.963 8.168 1.00 0.00 C ATOM 1623 CG2 ILE A 591 9.904 -6.885 10.522 1.00 0.00 C ATOM 1624 CD1 ILE A 591 9.327 -6.641 7.671 1.00 0.00 C ATOM 0 H ILE A 591 12.332 -5.961 9.768 1.00 0.00 H new ATOM 0 HA ILE A 591 12.005 -8.496 10.983 1.00 0.00 H new ATOM 0 HB ILE A 591 10.117 -8.669 9.333 1.00 0.00 H new ATOM 0 HG12 ILE A 591 11.304 -6.042 8.307 1.00 0.00 H new ATOM 0 HG13 ILE A 591 11.269 -7.556 7.424 1.00 0.00 H new ATOM 0 HG21 ILE A 591 8.898 -6.673 10.159 1.00 0.00 H new ATOM 0 HG22 ILE A 591 9.842 -7.430 11.464 1.00 0.00 H new ATOM 0 HG23 ILE A 591 10.438 -5.948 10.679 1.00 0.00 H new ATOM 0 HD11 ILE A 591 9.389 -6.094 6.730 1.00 0.00 H new ATOM 0 HD12 ILE A 591 8.775 -7.568 7.516 1.00 0.00 H new ATOM 0 HD13 ILE A 591 8.810 -6.031 8.412 1.00 0.00 H new ATOM 1636 N GLU A 592 12.691 -10.284 9.361 1.00 0.00 N ATOM 1637 CA GLU A 592 13.319 -11.302 8.524 1.00 0.00 C ATOM 1638 C GLU A 592 12.646 -11.362 7.157 1.00 0.00 C ATOM 1639 O GLU A 592 11.706 -12.128 6.949 1.00 0.00 O ATOM 1640 CB GLU A 592 13.220 -12.669 9.204 1.00 0.00 C ATOM 1641 CG GLU A 592 14.167 -13.653 8.512 1.00 0.00 C ATOM 1642 CD GLU A 592 13.966 -15.054 9.077 1.00 0.00 C ATOM 1643 OE1 GLU A 592 14.542 -15.343 10.112 1.00 0.00 O ATOM 1644 OE2 GLU A 592 13.237 -15.819 8.466 1.00 0.00 O ATOM 0 H GLU A 592 12.211 -10.647 10.185 1.00 0.00 H new ATOM 0 HA GLU A 592 14.368 -11.038 8.388 1.00 0.00 H new ATOM 0 HB2 GLU A 592 13.477 -12.581 10.260 1.00 0.00 H new ATOM 0 HB3 GLU A 592 12.196 -13.038 9.155 1.00 0.00 H new ATOM 0 HG2 GLU A 592 13.981 -13.655 7.438 1.00 0.00 H new ATOM 0 HG3 GLU A 592 15.201 -13.338 8.656 1.00 0.00 H new ATOM 1651 N HIS A 593 13.134 -10.545 6.227 1.00 0.00 N ATOM 1652 CA HIS A 593 12.574 -10.508 4.879 1.00 0.00 C ATOM 1653 C HIS A 593 13.690 -10.446 3.837 1.00 0.00 C ATOM 1654 O HIS A 593 14.033 -9.371 3.347 1.00 0.00 O ATOM 1655 CB HIS A 593 11.667 -9.284 4.727 1.00 0.00 C ATOM 1656 CG HIS A 593 10.375 -9.524 5.460 1.00 0.00 C ATOM 1657 ND1 HIS A 593 10.338 -9.878 6.799 1.00 0.00 N ATOM 1658 CD2 HIS A 593 9.065 -9.466 5.051 1.00 0.00 C ATOM 1659 CE1 HIS A 593 9.046 -10.019 7.146 1.00 0.00 C ATOM 1660 NE2 HIS A 593 8.228 -9.780 6.117 1.00 0.00 N ATOM 0 H HIS A 593 13.912 -9.903 6.381 1.00 0.00 H new ATOM 0 HA HIS A 593 11.993 -11.416 4.721 1.00 0.00 H new ATOM 0 HB2 HIS A 593 12.164 -8.398 5.124 1.00 0.00 H new ATOM 0 HB3 HIS A 593 11.469 -9.093 3.672 1.00 0.00 H new ATOM 0 HD2 HIS A 593 8.735 -9.215 4.054 1.00 0.00 H new ATOM 0 HE1 HIS A 593 8.711 -10.292 8.136 1.00 0.00 H new ATOM 0 HE2 HIS A 593 7.209 -9.819 6.114 1.00 0.00 H new ATOM 1668 N PRO A 594 14.254 -11.574 3.490 1.00 0.00 N ATOM 1669 CA PRO A 594 15.348 -11.647 2.484 1.00 0.00 C ATOM 1670 C PRO A 594 14.833 -11.406 1.065 1.00 0.00 C ATOM 1671 O PRO A 594 15.601 -11.061 0.168 1.00 0.00 O ATOM 1672 CB PRO A 594 15.927 -13.067 2.637 1.00 0.00 C ATOM 1673 CG PRO A 594 15.151 -13.744 3.733 1.00 0.00 C ATOM 1674 CD PRO A 594 13.909 -12.898 4.016 1.00 0.00 C ATOM 0 HA PRO A 594 16.100 -10.875 2.649 1.00 0.00 H new ATOM 0 HB2 PRO A 594 15.839 -13.622 1.703 1.00 0.00 H new ATOM 0 HB3 PRO A 594 16.988 -13.026 2.884 1.00 0.00 H new ATOM 0 HG2 PRO A 594 14.866 -14.752 3.433 1.00 0.00 H new ATOM 0 HG3 PRO A 594 15.761 -13.839 4.631 1.00 0.00 H new ATOM 0 HD2 PRO A 594 13.027 -13.306 3.522 1.00 0.00 H new ATOM 0 HD3 PRO A 594 13.688 -12.858 5.083 1.00 0.00 H new ATOM 1682 N MET A 595 13.529 -11.582 0.874 1.00 0.00 N ATOM 1683 CA MET A 595 12.925 -11.371 -0.436 1.00 0.00 C ATOM 1684 C MET A 595 12.723 -9.879 -0.687 1.00 0.00 C ATOM 1685 O MET A 595 13.262 -9.322 -1.644 1.00 0.00 O ATOM 1686 CB MET A 595 11.575 -12.102 -0.516 1.00 0.00 C ATOM 1687 CG MET A 595 11.759 -13.462 -1.196 1.00 0.00 C ATOM 1688 SD MET A 595 11.875 -13.228 -2.987 1.00 0.00 S ATOM 1689 CE MET A 595 12.338 -14.926 -3.411 1.00 0.00 C ATOM 0 H MET A 595 12.876 -11.868 1.603 1.00 0.00 H new ATOM 0 HA MET A 595 13.592 -11.771 -1.199 1.00 0.00 H new ATOM 0 HB2 MET A 595 11.165 -12.238 0.485 1.00 0.00 H new ATOM 0 HB3 MET A 595 10.858 -11.500 -1.075 1.00 0.00 H new ATOM 0 HG2 MET A 595 12.660 -13.949 -0.823 1.00 0.00 H new ATOM 0 HG3 MET A 595 10.921 -14.117 -0.957 1.00 0.00 H new ATOM 0 HE1 MET A 595 12.464 -15.010 -4.490 1.00 0.00 H new ATOM 0 HE2 MET A 595 13.274 -15.182 -2.915 1.00 0.00 H new ATOM 0 HE3 MET A 595 11.555 -15.609 -3.083 1.00 0.00 H new ATOM 1699 N THR A 596 11.948 -9.237 0.181 1.00 0.00 N ATOM 1700 CA THR A 596 11.685 -7.808 0.046 1.00 0.00 C ATOM 1701 C THR A 596 12.985 -7.049 -0.199 1.00 0.00 C ATOM 1702 O THR A 596 12.980 -5.950 -0.753 1.00 0.00 O ATOM 1703 CB THR A 596 11.016 -7.276 1.314 1.00 0.00 C ATOM 1704 OG1 THR A 596 9.845 -8.034 1.586 1.00 0.00 O ATOM 1705 CG2 THR A 596 10.641 -5.805 1.119 1.00 0.00 C ATOM 0 H THR A 596 11.494 -9.679 0.980 1.00 0.00 H new ATOM 0 HA THR A 596 11.020 -7.659 -0.805 1.00 0.00 H new ATOM 0 HB THR A 596 11.708 -7.363 2.152 1.00 0.00 H new ATOM 0 HG1 THR A 596 9.417 -7.694 2.400 1.00 0.00 H new ATOM 0 HG21 THR A 596 10.164 -5.428 2.024 1.00 0.00 H new ATOM 0 HG22 THR A 596 11.540 -5.224 0.914 1.00 0.00 H new ATOM 0 HG23 THR A 596 9.951 -5.714 0.280 1.00 0.00 H new ATOM 1713 N SER A 597 14.096 -7.642 0.224 1.00 0.00 N ATOM 1714 CA SER A 597 15.400 -7.013 0.053 1.00 0.00 C ATOM 1715 C SER A 597 15.531 -6.419 -1.348 1.00 0.00 C ATOM 1716 O SER A 597 16.348 -5.529 -1.580 1.00 0.00 O ATOM 1717 CB SER A 597 16.510 -8.042 0.278 1.00 0.00 C ATOM 1718 OG SER A 597 16.278 -8.719 1.506 1.00 0.00 O ATOM 0 H SER A 597 14.120 -8.552 0.685 1.00 0.00 H new ATOM 0 HA SER A 597 15.493 -6.211 0.785 1.00 0.00 H new ATOM 0 HB2 SER A 597 16.533 -8.756 -0.546 1.00 0.00 H new ATOM 0 HB3 SER A 597 17.481 -7.548 0.299 1.00 0.00 H new ATOM 0 HG SER A 597 17.111 -9.133 1.814 1.00 0.00 H new ATOM 1724 N ALA A 598 14.720 -6.919 -2.275 1.00 0.00 N ATOM 1725 CA ALA A 598 14.754 -6.432 -3.649 1.00 0.00 C ATOM 1726 C ALA A 598 14.318 -4.970 -3.715 1.00 0.00 C ATOM 1727 O ALA A 598 14.880 -4.179 -4.472 1.00 0.00 O ATOM 1728 CB ALA A 598 13.832 -7.280 -4.526 1.00 0.00 C ATOM 0 H ALA A 598 14.036 -7.656 -2.102 1.00 0.00 H new ATOM 0 HA ALA A 598 15.778 -6.509 -4.015 1.00 0.00 H new ATOM 0 HB1 ALA A 598 13.863 -6.910 -5.551 1.00 0.00 H new ATOM 0 HB2 ALA A 598 14.163 -8.318 -4.505 1.00 0.00 H new ATOM 0 HB3 ALA A 598 12.811 -7.217 -4.148 1.00 0.00 H new ATOM 1734 N ILE A 599 13.315 -4.616 -2.917 1.00 0.00 N ATOM 1735 CA ILE A 599 12.817 -3.246 -2.896 1.00 0.00 C ATOM 1736 C ILE A 599 13.723 -2.363 -2.041 1.00 0.00 C ATOM 1737 O ILE A 599 13.811 -1.155 -2.257 1.00 0.00 O ATOM 1738 CB ILE A 599 11.392 -3.213 -2.338 1.00 0.00 C ATOM 1739 CG1 ILE A 599 10.511 -4.177 -3.139 1.00 0.00 C ATOM 1740 CG2 ILE A 599 10.827 -1.796 -2.453 1.00 0.00 C ATOM 1741 CD1 ILE A 599 9.103 -4.203 -2.541 1.00 0.00 C ATOM 0 H ILE A 599 12.835 -5.253 -2.282 1.00 0.00 H new ATOM 0 HA ILE A 599 12.813 -2.865 -3.917 1.00 0.00 H new ATOM 0 HB ILE A 599 11.407 -3.513 -1.290 1.00 0.00 H new ATOM 0 HG12 ILE A 599 10.468 -3.865 -4.182 1.00 0.00 H new ATOM 0 HG13 ILE A 599 10.942 -5.178 -3.123 1.00 0.00 H new ATOM 0 HG21 ILE A 599 9.812 -1.775 -2.055 1.00 0.00 H new ATOM 0 HG22 ILE A 599 11.453 -1.107 -1.886 1.00 0.00 H new ATOM 0 HG23 ILE A 599 10.812 -1.494 -3.500 1.00 0.00 H new ATOM 0 HD11 ILE A 599 8.478 -4.889 -3.112 1.00 0.00 H new ATOM 0 HD12 ILE A 599 9.154 -4.536 -1.504 1.00 0.00 H new ATOM 0 HD13 ILE A 599 8.673 -3.202 -2.580 1.00 0.00 H new ATOM 1753 N GLU A 600 14.395 -2.978 -1.073 1.00 0.00 N ATOM 1754 CA GLU A 600 15.295 -2.240 -0.193 1.00 0.00 C ATOM 1755 C GLU A 600 16.506 -1.736 -0.969 1.00 0.00 C ATOM 1756 O GLU A 600 16.818 -0.546 -0.949 1.00 0.00 O ATOM 1757 CB GLU A 600 15.756 -3.142 0.956 1.00 0.00 C ATOM 1758 CG GLU A 600 16.816 -2.416 1.795 1.00 0.00 C ATOM 1759 CD GLU A 600 18.208 -2.685 1.230 1.00 0.00 C ATOM 1760 OE1 GLU A 600 18.751 -3.739 1.522 1.00 0.00 O ATOM 1761 OE2 GLU A 600 18.711 -1.834 0.516 1.00 0.00 O ATOM 0 H GLU A 600 14.335 -3.977 -0.879 1.00 0.00 H new ATOM 0 HA GLU A 600 14.758 -1.383 0.213 1.00 0.00 H new ATOM 0 HB2 GLU A 600 14.906 -3.412 1.582 1.00 0.00 H new ATOM 0 HB3 GLU A 600 16.167 -4.070 0.559 1.00 0.00 H new ATOM 0 HG2 GLU A 600 16.617 -1.344 1.798 1.00 0.00 H new ATOM 0 HG3 GLU A 600 16.764 -2.752 2.830 1.00 0.00 H new ATOM 1768 N VAL A 601 17.184 -2.651 -1.656 1.00 0.00 N ATOM 1769 CA VAL A 601 18.360 -2.288 -2.439 1.00 0.00 C ATOM 1770 C VAL A 601 17.975 -1.341 -3.571 1.00 0.00 C ATOM 1771 O VAL A 601 18.769 -0.494 -3.982 1.00 0.00 O ATOM 1772 CB VAL A 601 19.008 -3.544 -3.020 1.00 0.00 C ATOM 1773 CG1 VAL A 601 18.067 -4.178 -4.047 1.00 0.00 C ATOM 1774 CG2 VAL A 601 20.325 -3.169 -3.704 1.00 0.00 C ATOM 0 H VAL A 601 16.942 -3.641 -1.686 1.00 0.00 H new ATOM 0 HA VAL A 601 19.070 -1.784 -1.783 1.00 0.00 H new ATOM 0 HB VAL A 601 19.202 -4.255 -2.217 1.00 0.00 H new ATOM 0 HG11 VAL A 601 18.530 -5.074 -4.461 1.00 0.00 H new ATOM 0 HG12 VAL A 601 17.128 -4.446 -3.563 1.00 0.00 H new ATOM 0 HG13 VAL A 601 17.872 -3.467 -4.850 1.00 0.00 H new ATOM 0 HG21 VAL A 601 20.788 -4.065 -4.119 1.00 0.00 H new ATOM 0 HG22 VAL A 601 20.129 -2.458 -4.506 1.00 0.00 H new ATOM 0 HG23 VAL A 601 20.998 -2.717 -2.975 1.00 0.00 H new ATOM 1784 N LEU A 602 16.751 -1.491 -4.070 1.00 0.00 N ATOM 1785 CA LEU A 602 16.269 -0.643 -5.155 1.00 0.00 C ATOM 1786 C LEU A 602 15.973 0.763 -4.643 1.00 0.00 C ATOM 1787 O LEU A 602 16.690 1.713 -4.957 1.00 0.00 O ATOM 1788 CB LEU A 602 15.000 -1.246 -5.763 1.00 0.00 C ATOM 1789 CG LEU A 602 14.673 -0.549 -7.091 1.00 0.00 C ATOM 1790 CD1 LEU A 602 15.435 -1.224 -8.235 1.00 0.00 C ATOM 1791 CD2 LEU A 602 13.169 -0.644 -7.362 1.00 0.00 C ATOM 0 H LEU A 602 16.080 -2.186 -3.743 1.00 0.00 H new ATOM 0 HA LEU A 602 17.044 -0.583 -5.919 1.00 0.00 H new ATOM 0 HB2 LEU A 602 15.138 -2.315 -5.928 1.00 0.00 H new ATOM 0 HB3 LEU A 602 14.166 -1.135 -5.070 1.00 0.00 H new ATOM 0 HG LEU A 602 14.970 0.498 -7.027 1.00 0.00 H new ATOM 0 HD11 LEU A 602 15.198 -0.724 -9.174 1.00 0.00 H new ATOM 0 HD12 LEU A 602 16.507 -1.156 -8.048 1.00 0.00 H new ATOM 0 HD13 LEU A 602 15.143 -2.272 -8.298 1.00 0.00 H new ATOM 0 HD21 LEU A 602 12.937 -0.149 -8.305 1.00 0.00 H new ATOM 0 HD22 LEU A 602 12.875 -1.692 -7.421 1.00 0.00 H new ATOM 0 HD23 LEU A 602 12.622 -0.159 -6.554 1.00 0.00 H new ATOM 1803 N VAL A 603 14.914 0.886 -3.849 1.00 0.00 N ATOM 1804 CA VAL A 603 14.534 2.182 -3.296 1.00 0.00 C ATOM 1805 C VAL A 603 15.655 2.744 -2.428 1.00 0.00 C ATOM 1806 O VAL A 603 15.658 3.928 -2.090 1.00 0.00 O ATOM 1807 CB VAL A 603 13.261 2.038 -2.462 1.00 0.00 C ATOM 1808 CG1 VAL A 603 12.856 3.404 -1.904 1.00 0.00 C ATOM 1809 CG2 VAL A 603 12.133 1.496 -3.344 1.00 0.00 C ATOM 0 H VAL A 603 14.308 0.112 -3.576 1.00 0.00 H new ATOM 0 HA VAL A 603 14.352 2.870 -4.121 1.00 0.00 H new ATOM 0 HB VAL A 603 13.445 1.349 -1.638 1.00 0.00 H new ATOM 0 HG11 VAL A 603 11.948 3.300 -1.310 1.00 0.00 H new ATOM 0 HG12 VAL A 603 13.658 3.793 -1.276 1.00 0.00 H new ATOM 0 HG13 VAL A 603 12.673 4.094 -2.728 1.00 0.00 H new ATOM 0 HG21 VAL A 603 11.225 1.393 -2.750 1.00 0.00 H new ATOM 0 HG22 VAL A 603 11.952 2.186 -4.168 1.00 0.00 H new ATOM 0 HG23 VAL A 603 12.419 0.522 -3.742 1.00 0.00 H new ATOM 1819 N GLY A 604 16.606 1.885 -2.071 1.00 0.00 N ATOM 1820 CA GLY A 604 17.730 2.306 -1.241 1.00 0.00 C ATOM 1821 C GLY A 604 18.779 3.034 -2.075 1.00 0.00 C ATOM 1822 O GLY A 604 18.881 4.260 -2.030 1.00 0.00 O ATOM 0 H GLY A 604 16.621 0.901 -2.341 1.00 0.00 H new ATOM 0 HA2 GLY A 604 17.375 2.960 -0.445 1.00 0.00 H new ATOM 0 HA3 GLY A 604 18.180 1.436 -0.762 1.00 0.00 H new ATOM 1826 N SER A 605 19.558 2.271 -2.835 1.00 0.00 N ATOM 1827 CA SER A 605 20.597 2.855 -3.675 1.00 0.00 C ATOM 1828 C SER A 605 20.030 4.006 -4.501 1.00 0.00 C ATOM 1829 O SER A 605 20.732 4.970 -4.802 1.00 0.00 O ATOM 1830 CB SER A 605 21.174 1.790 -4.608 1.00 0.00 C ATOM 1831 OG SER A 605 21.946 0.870 -3.848 1.00 0.00 O ATOM 0 H SER A 605 19.491 1.255 -2.887 1.00 0.00 H new ATOM 0 HA SER A 605 21.388 3.239 -3.031 1.00 0.00 H new ATOM 0 HB2 SER A 605 20.369 1.268 -5.125 1.00 0.00 H new ATOM 0 HB3 SER A 605 21.793 2.257 -5.374 1.00 0.00 H new ATOM 0 HG SER A 605 22.316 0.184 -4.442 1.00 0.00 H new ATOM 1837 N CYS A 606 18.755 3.895 -4.864 1.00 0.00 N ATOM 1838 CA CYS A 606 18.102 4.932 -5.656 1.00 0.00 C ATOM 1839 C CYS A 606 17.470 5.982 -4.747 1.00 0.00 C ATOM 1840 O CYS A 606 16.310 6.356 -4.927 1.00 0.00 O ATOM 1841 CB CYS A 606 17.022 4.308 -6.543 1.00 0.00 C ATOM 1842 SG CYS A 606 16.355 5.569 -7.657 1.00 0.00 S ATOM 0 H CYS A 606 18.158 3.104 -4.624 1.00 0.00 H new ATOM 0 HA CYS A 606 18.854 5.413 -6.281 1.00 0.00 H new ATOM 0 HB2 CYS A 606 17.441 3.483 -7.119 1.00 0.00 H new ATOM 0 HB3 CYS A 606 16.225 3.893 -5.926 1.00 0.00 H new ATOM 0 HG CYS A 606 15.960 6.595 -6.964 1.00 0.00 H new ATOM 1848 N ALA A 607 18.239 6.452 -3.771 1.00 0.00 N ATOM 1849 CA ALA A 607 17.743 7.458 -2.839 1.00 0.00 C ATOM 1850 C ALA A 607 18.893 8.061 -2.038 1.00 0.00 C ATOM 1851 O ALA A 607 19.541 9.009 -2.481 1.00 0.00 O ATOM 1852 CB ALA A 607 16.726 6.828 -1.885 1.00 0.00 C ATOM 0 H ALA A 607 19.201 6.155 -3.605 1.00 0.00 H new ATOM 0 HA ALA A 607 17.261 8.251 -3.411 1.00 0.00 H new ATOM 0 HB1 ALA A 607 16.360 7.585 -1.192 1.00 0.00 H new ATOM 0 HB2 ALA A 607 15.890 6.426 -2.458 1.00 0.00 H new ATOM 0 HB3 ALA A 607 17.202 6.023 -1.325 1.00 0.00 H new