USER MOD reduce.3.24.130724 H: found=0, std=0, add=565, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 566 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 Single : A 603 LYS NZ :NH3+ -140:sc= -0.081 (180deg=-1.4) USER MOD Single : A 612 LYS NZ :NH3+ 162:sc= 1.27 (180deg=1.14) USER MOD Single : A 614 TYR OH : rot 180:sc= 0 USER MOD Single : A 618 TYR OH : rot 180:sc= 0 USER MOD Single : A 624 THR OG1 : rot 160:sc= 1.01 USER MOD Single : A 625 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 629 THR OG1 : rot 180:sc= 0 USER MOD Single : A 631 MET CE :methyl -179:sc= -0.723 (180deg=-0.729) USER MOD Single : A 632 MET CE :methyl 150:sc=-0.00257 (180deg=-0.545) USER MOD Single : A 635 TYR OH : rot 15:sc= 0.39 USER MOD Single : A 636 ASN : amide:sc= 0.799 K(o=0.8,f=-0.016) USER MOD Single : A 638 SER OG : rot 180:sc= 0.018 USER MOD Single : A 641 LYS NZ :NH3+ -157:sc= 1.36 (180deg=0.744) USER MOD Single : A 650 LYS NZ :NH3+ -121:sc= 0 (180deg=-0.0169) USER MOD Single : A 652 LYS NZ :NH3+ -143:sc= 0.443 (180deg=0.0655) USER MOD Single : A 662 TYR OH : rot 2:sc= 0.0176 USER MOD Single : A 664 LYS NZ :NH3+ -175:sc= -0.0285! (180deg=-0.4!) USER MOD ----------------------------------------------------------------- ATOM 324 N ARG A 601 -4.088 -2.438 2.819 1.00 0.00 N ATOM 325 CA ARG A 601 -2.803 -2.874 2.279 1.00 0.00 C ATOM 326 C ARG A 601 -2.070 -3.654 3.366 1.00 0.00 C ATOM 327 O ARG A 601 -2.381 -3.493 4.546 1.00 0.00 O ATOM 328 CB ARG A 601 -1.985 -1.654 1.800 1.00 0.00 C ATOM 329 CG ARG A 601 -1.639 -0.625 2.898 1.00 0.00 C ATOM 330 CD ARG A 601 -0.396 -0.968 3.740 1.00 0.00 C ATOM 331 NE ARG A 601 -0.343 -0.163 4.974 1.00 0.00 N ATOM 332 CZ ARG A 601 -0.995 -0.403 6.128 1.00 0.00 C ATOM 333 NH1 ARG A 601 -1.773 -1.476 6.299 1.00 0.00 N ATOM 334 NH2 ARG A 601 -0.870 0.459 7.138 1.00 0.00 N ATOM 0 HA ARG A 601 -2.949 -3.520 1.414 1.00 0.00 H new ATOM 0 HB2 ARG A 601 -1.057 -2.011 1.353 1.00 0.00 H new ATOM 0 HB3 ARG A 601 -2.544 -1.148 1.013 1.00 0.00 H new ATOM 0 HG2 ARG A 601 -1.485 0.347 2.429 1.00 0.00 H new ATOM 0 HG3 ARG A 601 -2.495 -0.525 3.565 1.00 0.00 H new ATOM 0 HD2 ARG A 601 -0.409 -2.028 3.995 1.00 0.00 H new ATOM 0 HD3 ARG A 601 0.504 -0.793 3.151 1.00 0.00 H new ATOM 0 HE ARG A 601 0.252 0.665 4.951 1.00 0.00 H new ATOM 0 HH11 ARG A 601 -1.889 -2.148 5.540 1.00 0.00 H new ATOM 0 HH12 ARG A 601 -2.251 -1.623 7.188 1.00 0.00 H new ATOM 0 HH21 ARG A 601 -0.286 1.288 7.031 1.00 0.00 H new ATOM 0 HH22 ARG A 601 -1.358 0.289 8.017 1.00 0.00 H new ATOM 348 N ASP A 602 -1.012 -4.371 2.995 1.00 0.00 N ATOM 349 CA ASP A 602 -0.141 -5.099 3.913 1.00 0.00 C ATOM 350 C ASP A 602 1.276 -5.002 3.382 1.00 0.00 C ATOM 351 O ASP A 602 1.423 -4.928 2.171 1.00 0.00 O ATOM 352 CB ASP A 602 -0.600 -6.568 3.954 1.00 0.00 C ATOM 353 CG ASP A 602 0.000 -7.390 5.096 1.00 0.00 C ATOM 354 OD1 ASP A 602 1.231 -7.281 5.299 1.00 0.00 O ATOM 355 OD2 ASP A 602 -0.767 -8.166 5.696 1.00 0.00 O ATOM 0 H ASP A 602 -0.729 -4.464 2.019 1.00 0.00 H new ATOM 0 HA ASP A 602 -0.183 -4.685 4.920 1.00 0.00 H new ATOM 0 HB2 ASP A 602 -1.687 -6.593 4.037 1.00 0.00 H new ATOM 0 HB3 ASP A 602 -0.342 -7.042 3.007 1.00 0.00 H new ATOM 360 N LYS A 603 2.305 -5.085 4.233 1.00 0.00 N ATOM 361 CA LYS A 603 3.680 -5.299 3.784 1.00 0.00 C ATOM 362 C LYS A 603 3.723 -6.497 2.827 1.00 0.00 C ATOM 363 O LYS A 603 4.366 -6.395 1.783 1.00 0.00 O ATOM 364 CB LYS A 603 4.608 -5.548 4.986 1.00 0.00 C ATOM 365 CG LYS A 603 5.326 -4.331 5.587 1.00 0.00 C ATOM 366 CD LYS A 603 4.406 -3.327 6.290 1.00 0.00 C ATOM 367 CE LYS A 603 3.919 -2.221 5.348 1.00 0.00 C ATOM 368 NZ LYS A 603 4.956 -1.187 5.102 1.00 0.00 N ATOM 0 H LYS A 603 2.207 -5.006 5.245 1.00 0.00 H new ATOM 0 HA LYS A 603 4.027 -4.406 3.264 1.00 0.00 H new ATOM 0 HB2 LYS A 603 4.019 -6.016 5.775 1.00 0.00 H new ATOM 0 HB3 LYS A 603 5.366 -6.271 4.683 1.00 0.00 H new ATOM 0 HG2 LYS A 603 6.071 -4.682 6.301 1.00 0.00 H new ATOM 0 HG3 LYS A 603 5.864 -3.815 4.792 1.00 0.00 H new ATOM 0 HD2 LYS A 603 3.546 -3.854 6.702 1.00 0.00 H new ATOM 0 HD3 LYS A 603 4.937 -2.878 7.129 1.00 0.00 H new ATOM 0 HE2 LYS A 603 3.619 -2.663 4.398 1.00 0.00 H new ATOM 0 HE3 LYS A 603 3.034 -1.749 5.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 603 4.513 -0.246 5.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 603 5.670 -1.225 5.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 603 5.413 -1.365 4.185 1.00 0.00 H new ATOM 382 N PHE A 604 2.991 -7.579 3.129 1.00 0.00 N ATOM 383 CA PHE A 604 2.857 -8.724 2.234 1.00 0.00 C ATOM 384 C PHE A 604 2.379 -8.289 0.843 1.00 0.00 C ATOM 385 O PHE A 604 2.968 -8.681 -0.163 1.00 0.00 O ATOM 386 CB PHE A 604 1.878 -9.760 2.820 1.00 0.00 C ATOM 387 CG PHE A 604 2.228 -10.405 4.154 1.00 0.00 C ATOM 388 CD1 PHE A 604 3.557 -10.730 4.497 1.00 0.00 C ATOM 389 CD2 PHE A 604 1.193 -10.727 5.056 1.00 0.00 C ATOM 390 CE1 PHE A 604 3.844 -11.363 5.718 1.00 0.00 C ATOM 391 CE2 PHE A 604 1.479 -11.359 6.278 1.00 0.00 C ATOM 392 CZ PHE A 604 2.807 -11.680 6.610 1.00 0.00 C ATOM 0 H PHE A 604 2.476 -7.679 4.004 1.00 0.00 H new ATOM 0 HA PHE A 604 3.842 -9.180 2.134 1.00 0.00 H new ATOM 0 HB2 PHE A 604 0.907 -9.277 2.928 1.00 0.00 H new ATOM 0 HB3 PHE A 604 1.757 -10.557 2.086 1.00 0.00 H new ATOM 0 HD1 PHE A 604 4.360 -10.490 3.816 1.00 0.00 H new ATOM 0 HD2 PHE A 604 0.171 -10.486 4.805 1.00 0.00 H new ATOM 0 HE1 PHE A 604 4.865 -11.606 5.971 1.00 0.00 H new ATOM 0 HE2 PHE A 604 0.679 -11.598 6.962 1.00 0.00 H new ATOM 0 HZ PHE A 604 3.029 -12.168 7.547 1.00 0.00 H new ATOM 402 N ARG A 605 1.325 -7.467 0.782 1.00 0.00 N ATOM 403 CA ARG A 605 0.826 -6.904 -0.466 1.00 0.00 C ATOM 404 C ARG A 605 1.859 -5.963 -1.084 1.00 0.00 C ATOM 405 O ARG A 605 2.114 -6.089 -2.270 1.00 0.00 O ATOM 406 CB ARG A 605 -0.516 -6.181 -0.260 1.00 0.00 C ATOM 407 CG ARG A 605 -1.756 -7.089 -0.345 1.00 0.00 C ATOM 408 CD ARG A 605 -2.259 -7.514 1.043 1.00 0.00 C ATOM 409 NE ARG A 605 -3.675 -7.931 1.042 1.00 0.00 N ATOM 410 CZ ARG A 605 -4.722 -7.087 1.064 1.00 0.00 C ATOM 411 NH1 ARG A 605 -4.517 -5.786 0.858 1.00 0.00 N ATOM 412 NH2 ARG A 605 -5.955 -7.537 1.290 1.00 0.00 N ATOM 0 H ARG A 605 0.796 -7.176 1.604 1.00 0.00 H new ATOM 0 HA ARG A 605 0.654 -7.729 -1.157 1.00 0.00 H new ATOM 0 HB2 ARG A 605 -0.505 -5.695 0.715 1.00 0.00 H new ATOM 0 HB3 ARG A 605 -0.607 -5.393 -1.008 1.00 0.00 H new ATOM 0 HG2 ARG A 605 -2.552 -6.565 -0.874 1.00 0.00 H new ATOM 0 HG3 ARG A 605 -1.515 -7.977 -0.930 1.00 0.00 H new ATOM 0 HD2 ARG A 605 -1.644 -8.336 1.410 1.00 0.00 H new ATOM 0 HD3 ARG A 605 -2.131 -6.685 1.739 1.00 0.00 H new ATOM 0 HE ARG A 605 -3.874 -8.931 1.023 1.00 0.00 H new ATOM 0 HH11 ARG A 605 -3.573 -5.439 0.686 1.00 0.00 H new ATOM 0 HH12 ARG A 605 -5.304 -5.137 0.873 1.00 0.00 H new ATOM 0 HH21 ARG A 605 -6.114 -8.532 1.449 1.00 0.00 H new ATOM 0 HH22 ARG A 605 -6.741 -6.887 1.304 1.00 0.00 H new ATOM 426 N LEU A 606 2.473 -5.051 -0.326 1.00 0.00 N ATOM 427 CA LEU A 606 3.400 -4.059 -0.851 1.00 0.00 C ATOM 428 C LEU A 606 4.574 -4.768 -1.531 1.00 0.00 C ATOM 429 O LEU A 606 4.995 -4.336 -2.605 1.00 0.00 O ATOM 430 CB LEU A 606 3.873 -3.091 0.255 1.00 0.00 C ATOM 431 CG LEU A 606 2.790 -2.233 0.963 1.00 0.00 C ATOM 432 CD1 LEU A 606 3.471 -1.202 1.866 1.00 0.00 C ATOM 433 CD2 LEU A 606 1.865 -1.501 -0.016 1.00 0.00 C ATOM 0 H LEU A 606 2.335 -4.984 0.682 1.00 0.00 H new ATOM 0 HA LEU A 606 2.887 -3.450 -1.595 1.00 0.00 H new ATOM 0 HB2 LEU A 606 4.390 -3.675 1.016 1.00 0.00 H new ATOM 0 HB3 LEU A 606 4.607 -2.414 -0.181 1.00 0.00 H new ATOM 0 HG LEU A 606 2.172 -2.919 1.542 1.00 0.00 H new ATOM 0 HD11 LEU A 606 2.713 -0.598 2.365 1.00 0.00 H new ATOM 0 HD12 LEU A 606 4.075 -1.716 2.614 1.00 0.00 H new ATOM 0 HD13 LEU A 606 4.111 -0.557 1.264 1.00 0.00 H new ATOM 0 HD21 LEU A 606 1.131 -0.920 0.542 1.00 0.00 H new ATOM 0 HD22 LEU A 606 2.455 -0.834 -0.644 1.00 0.00 H new ATOM 0 HD23 LEU A 606 1.350 -2.229 -0.643 1.00 0.00 H new ATOM 445 N LEU A 607 5.042 -5.893 -0.962 1.00 0.00 N ATOM 446 CA LEU A 607 6.002 -6.745 -1.644 1.00 0.00 C ATOM 447 C LEU A 607 5.374 -7.376 -2.896 1.00 0.00 C ATOM 448 O LEU A 607 5.961 -7.302 -3.972 1.00 0.00 O ATOM 449 CB LEU A 607 6.607 -7.819 -0.708 1.00 0.00 C ATOM 450 CG LEU A 607 7.690 -8.670 -1.419 1.00 0.00 C ATOM 451 CD1 LEU A 607 9.091 -8.148 -1.099 1.00 0.00 C ATOM 452 CD2 LEU A 607 7.587 -10.151 -1.033 1.00 0.00 C ATOM 0 H LEU A 607 4.766 -6.222 -0.037 1.00 0.00 H new ATOM 0 HA LEU A 607 6.831 -6.112 -1.960 1.00 0.00 H new ATOM 0 HB2 LEU A 607 7.043 -7.334 0.165 1.00 0.00 H new ATOM 0 HB3 LEU A 607 5.813 -8.472 -0.346 1.00 0.00 H new ATOM 0 HG LEU A 607 7.515 -8.582 -2.491 1.00 0.00 H new ATOM 0 HD11 LEU A 607 9.833 -8.762 -1.609 1.00 0.00 H new ATOM 0 HD12 LEU A 607 9.180 -7.115 -1.436 1.00 0.00 H new ATOM 0 HD13 LEU A 607 9.260 -8.195 -0.023 1.00 0.00 H new ATOM 0 HD21 LEU A 607 8.362 -10.717 -1.551 1.00 0.00 H new ATOM 0 HD22 LEU A 607 7.719 -10.256 0.044 1.00 0.00 H new ATOM 0 HD23 LEU A 607 6.607 -10.534 -1.318 1.00 0.00 H new ATOM 464 N LEU A 608 4.207 -8.019 -2.777 1.00 0.00 N ATOM 465 CA LEU A 608 3.634 -8.842 -3.835 1.00 0.00 C ATOM 466 C LEU A 608 3.314 -8.006 -5.075 1.00 0.00 C ATOM 467 O LEU A 608 3.534 -8.451 -6.196 1.00 0.00 O ATOM 468 CB LEU A 608 2.381 -9.529 -3.269 1.00 0.00 C ATOM 469 CG LEU A 608 1.646 -10.443 -4.258 1.00 0.00 C ATOM 470 CD1 LEU A 608 2.510 -11.636 -4.682 1.00 0.00 C ATOM 471 CD2 LEU A 608 0.353 -10.962 -3.616 1.00 0.00 C ATOM 0 H LEU A 608 3.633 -7.979 -1.935 1.00 0.00 H new ATOM 0 HA LEU A 608 4.351 -9.597 -4.157 1.00 0.00 H new ATOM 0 HB2 LEU A 608 2.669 -10.117 -2.397 1.00 0.00 H new ATOM 0 HB3 LEU A 608 1.689 -8.762 -2.922 1.00 0.00 H new ATOM 0 HG LEU A 608 1.420 -9.854 -5.147 1.00 0.00 H new ATOM 0 HD11 LEU A 608 1.953 -12.258 -5.382 1.00 0.00 H new ATOM 0 HD12 LEU A 608 3.419 -11.274 -5.162 1.00 0.00 H new ATOM 0 HD13 LEU A 608 2.773 -12.225 -3.803 1.00 0.00 H new ATOM 0 HD21 LEU A 608 -0.168 -11.611 -4.320 1.00 0.00 H new ATOM 0 HD22 LEU A 608 0.595 -11.525 -2.714 1.00 0.00 H new ATOM 0 HD23 LEU A 608 -0.288 -10.119 -3.357 1.00 0.00 H new ATOM 483 N GLU A 609 2.823 -6.788 -4.868 1.00 0.00 N ATOM 484 CA GLU A 609 2.514 -5.796 -5.877 1.00 0.00 C ATOM 485 C GLU A 609 3.801 -5.376 -6.591 1.00 0.00 C ATOM 486 O GLU A 609 3.826 -5.330 -7.821 1.00 0.00 O ATOM 487 CB GLU A 609 1.765 -4.635 -5.204 1.00 0.00 C ATOM 488 CG GLU A 609 0.425 -5.093 -4.582 1.00 0.00 C ATOM 489 CD GLU A 609 -0.712 -5.242 -5.594 1.00 0.00 C ATOM 490 OE1 GLU A 609 -1.250 -4.208 -6.038 1.00 0.00 O ATOM 491 OE2 GLU A 609 -1.049 -6.410 -5.910 1.00 0.00 O ATOM 0 H GLU A 609 2.619 -6.452 -3.927 1.00 0.00 H new ATOM 0 HA GLU A 609 1.858 -6.195 -6.650 1.00 0.00 H new ATOM 0 HB2 GLU A 609 2.394 -4.199 -4.428 1.00 0.00 H new ATOM 0 HB3 GLU A 609 1.575 -3.852 -5.938 1.00 0.00 H new ATOM 0 HG2 GLU A 609 0.577 -6.048 -4.079 1.00 0.00 H new ATOM 0 HG3 GLU A 609 0.126 -4.375 -3.819 1.00 0.00 H new ATOM 498 N LEU A 610 4.911 -5.190 -5.861 1.00 0.00 N ATOM 499 CA LEU A 610 6.190 -4.934 -6.510 1.00 0.00 C ATOM 500 C LEU A 610 6.648 -6.128 -7.342 1.00 0.00 C ATOM 501 O LEU A 610 7.305 -5.918 -8.355 1.00 0.00 O ATOM 502 CB LEU A 610 7.283 -4.576 -5.491 1.00 0.00 C ATOM 503 CG LEU A 610 7.283 -3.107 -5.049 1.00 0.00 C ATOM 504 CD1 LEU A 610 8.084 -2.997 -3.755 1.00 0.00 C ATOM 505 CD2 LEU A 610 7.962 -2.189 -6.063 1.00 0.00 C ATOM 0 H LEU A 610 4.943 -5.213 -4.842 1.00 0.00 H new ATOM 0 HA LEU A 610 6.033 -4.082 -7.172 1.00 0.00 H new ATOM 0 HB2 LEU A 610 7.162 -5.207 -4.611 1.00 0.00 H new ATOM 0 HB3 LEU A 610 8.256 -4.813 -5.922 1.00 0.00 H new ATOM 0 HG LEU A 610 6.243 -2.802 -4.937 1.00 0.00 H new ATOM 0 HD11 LEU A 610 8.097 -1.959 -3.422 1.00 0.00 H new ATOM 0 HD12 LEU A 610 7.623 -3.618 -2.987 1.00 0.00 H new ATOM 0 HD13 LEU A 610 9.106 -3.335 -3.930 1.00 0.00 H new ATOM 0 HD21 LEU A 610 7.934 -1.162 -5.700 1.00 0.00 H new ATOM 0 HD22 LEU A 610 8.999 -2.498 -6.197 1.00 0.00 H new ATOM 0 HD23 LEU A 610 7.439 -2.251 -7.017 1.00 0.00 H new ATOM 517 N ILE A 611 6.305 -7.369 -6.966 1.00 0.00 N ATOM 518 CA ILE A 611 6.659 -8.525 -7.790 1.00 0.00 C ATOM 519 C ILE A 611 5.923 -8.412 -9.127 1.00 0.00 C ATOM 520 O ILE A 611 6.551 -8.568 -10.169 1.00 0.00 O ATOM 521 CB ILE A 611 6.410 -9.883 -7.088 1.00 0.00 C ATOM 522 CG1 ILE A 611 7.221 -9.980 -5.781 1.00 0.00 C ATOM 523 CG2 ILE A 611 6.804 -11.069 -7.992 1.00 0.00 C ATOM 524 CD1 ILE A 611 6.793 -11.135 -4.884 1.00 0.00 C ATOM 0 H ILE A 611 5.793 -7.592 -6.113 1.00 0.00 H new ATOM 0 HA ILE A 611 7.735 -8.509 -7.964 1.00 0.00 H new ATOM 0 HB ILE A 611 5.343 -9.934 -6.871 1.00 0.00 H new ATOM 0 HG12 ILE A 611 8.277 -10.093 -6.026 1.00 0.00 H new ATOM 0 HG13 ILE A 611 7.119 -9.045 -5.230 1.00 0.00 H new ATOM 0 HG21 ILE A 611 6.616 -12.005 -7.467 1.00 0.00 H new ATOM 0 HG22 ILE A 611 6.213 -11.041 -8.907 1.00 0.00 H new ATOM 0 HG23 ILE A 611 7.863 -11.000 -8.242 1.00 0.00 H new ATOM 0 HD11 ILE A 611 7.406 -11.142 -3.983 1.00 0.00 H new ATOM 0 HD12 ILE A 611 5.745 -11.013 -4.609 1.00 0.00 H new ATOM 0 HD13 ILE A 611 6.921 -12.077 -5.418 1.00 0.00 H new ATOM 536 N LYS A 612 4.624 -8.092 -9.128 1.00 0.00 N ATOM 537 CA LYS A 612 3.847 -8.120 -10.371 1.00 0.00 C ATOM 538 C LYS A 612 4.206 -6.916 -11.232 1.00 0.00 C ATOM 539 O LYS A 612 4.219 -7.032 -12.455 1.00 0.00 O ATOM 540 CB LYS A 612 2.326 -8.235 -10.154 1.00 0.00 C ATOM 541 CG LYS A 612 1.772 -7.344 -9.037 1.00 0.00 C ATOM 542 CD LYS A 612 0.248 -7.323 -8.931 1.00 0.00 C ATOM 543 CE LYS A 612 -0.263 -8.590 -8.241 1.00 0.00 C ATOM 544 NZ LYS A 612 -1.583 -8.353 -7.626 1.00 0.00 N ATOM 0 H LYS A 612 4.097 -7.816 -8.299 1.00 0.00 H new ATOM 0 HA LYS A 612 4.122 -9.034 -10.897 1.00 0.00 H new ATOM 0 HB2 LYS A 612 1.819 -7.984 -11.086 1.00 0.00 H new ATOM 0 HB3 LYS A 612 2.082 -9.273 -9.928 1.00 0.00 H new ATOM 0 HG2 LYS A 612 2.184 -7.680 -8.085 1.00 0.00 H new ATOM 0 HG3 LYS A 612 2.125 -6.325 -9.195 1.00 0.00 H new ATOM 0 HD2 LYS A 612 -0.071 -6.444 -8.371 1.00 0.00 H new ATOM 0 HD3 LYS A 612 -0.190 -7.243 -9.926 1.00 0.00 H new ATOM 0 HE2 LYS A 612 -0.334 -9.401 -8.966 1.00 0.00 H new ATOM 0 HE3 LYS A 612 0.448 -8.906 -7.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 612 -2.046 -9.265 -7.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 612 -1.462 -7.834 -6.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 612 -2.173 -7.794 -8.275 1.00 0.00 H new ATOM 558 N GLU A 613 4.546 -5.785 -10.607 1.00 0.00 N ATOM 559 CA GLU A 613 4.939 -4.596 -11.339 1.00 0.00 C ATOM 560 C GLU A 613 6.360 -4.707 -11.915 1.00 0.00 C ATOM 561 O GLU A 613 6.730 -3.873 -12.738 1.00 0.00 O ATOM 562 CB GLU A 613 4.646 -3.329 -10.523 1.00 0.00 C ATOM 563 CG GLU A 613 5.829 -2.865 -9.688 1.00 0.00 C ATOM 564 CD GLU A 613 5.493 -1.611 -8.873 1.00 0.00 C ATOM 565 OE1 GLU A 613 4.942 -1.689 -7.752 1.00 0.00 O ATOM 566 OE2 GLU A 613 5.856 -0.506 -9.328 1.00 0.00 O ATOM 0 H GLU A 613 4.554 -5.676 -9.593 1.00 0.00 H new ATOM 0 HA GLU A 613 4.316 -4.506 -12.229 1.00 0.00 H new ATOM 0 HB2 GLU A 613 4.352 -2.528 -11.201 1.00 0.00 H new ATOM 0 HB3 GLU A 613 3.797 -3.517 -9.865 1.00 0.00 H new ATOM 0 HG2 GLU A 613 6.135 -3.665 -9.014 1.00 0.00 H new ATOM 0 HG3 GLU A 613 6.676 -2.658 -10.342 1.00 0.00 H new ATOM 573 N TYR A 614 7.127 -5.744 -11.539 1.00 0.00 N ATOM 574 CA TYR A 614 8.476 -5.975 -12.045 1.00 0.00 C ATOM 575 C TYR A 614 8.593 -7.269 -12.838 1.00 0.00 C ATOM 576 O TYR A 614 9.493 -7.380 -13.664 1.00 0.00 O ATOM 577 CB TYR A 614 9.517 -5.921 -10.921 1.00 0.00 C ATOM 578 CG TYR A 614 10.094 -4.534 -10.744 1.00 0.00 C ATOM 579 CD1 TYR A 614 11.061 -4.079 -11.660 1.00 0.00 C ATOM 580 CD2 TYR A 614 9.624 -3.675 -9.731 1.00 0.00 C ATOM 581 CE1 TYR A 614 11.570 -2.774 -11.568 1.00 0.00 C ATOM 582 CE2 TYR A 614 10.128 -2.366 -9.633 1.00 0.00 C ATOM 583 CZ TYR A 614 11.107 -1.912 -10.549 1.00 0.00 C ATOM 584 OH TYR A 614 11.593 -0.644 -10.454 1.00 0.00 O ATOM 0 H TYR A 614 6.818 -6.448 -10.869 1.00 0.00 H new ATOM 0 HA TYR A 614 8.685 -5.160 -12.738 1.00 0.00 H new ATOM 0 HB2 TYR A 614 9.058 -6.244 -9.987 1.00 0.00 H new ATOM 0 HB3 TYR A 614 10.322 -6.623 -11.139 1.00 0.00 H new ATOM 0 HD1 TYR A 614 11.414 -4.739 -12.439 1.00 0.00 H new ATOM 0 HD2 TYR A 614 8.878 -4.021 -9.031 1.00 0.00 H new ATOM 0 HE1 TYR A 614 12.312 -2.430 -12.273 1.00 0.00 H new ATOM 0 HE2 TYR A 614 9.768 -1.706 -8.858 1.00 0.00 H new ATOM 0 HH TYR A 614 11.168 -0.186 -9.699 1.00 0.00 H new ATOM 594 N GLU A 615 7.667 -8.214 -12.658 1.00 0.00 N ATOM 595 CA GLU A 615 7.541 -9.390 -13.494 1.00 0.00 C ATOM 596 C GLU A 615 7.500 -8.968 -14.961 1.00 0.00 C ATOM 597 O GLU A 615 8.406 -9.315 -15.721 1.00 0.00 O ATOM 598 CB GLU A 615 6.318 -10.210 -13.055 1.00 0.00 C ATOM 599 CG GLU A 615 6.725 -11.298 -12.044 1.00 0.00 C ATOM 600 CD GLU A 615 5.544 -12.089 -11.466 1.00 0.00 C ATOM 601 OE1 GLU A 615 4.465 -11.494 -11.256 1.00 0.00 O ATOM 602 OE2 GLU A 615 5.752 -13.293 -11.184 1.00 0.00 O ATOM 0 H GLU A 615 6.975 -8.174 -11.910 1.00 0.00 H new ATOM 0 HA GLU A 615 8.407 -10.042 -13.379 1.00 0.00 H new ATOM 0 HB2 GLU A 615 5.574 -9.551 -12.607 1.00 0.00 H new ATOM 0 HB3 GLU A 615 5.852 -10.672 -13.926 1.00 0.00 H new ATOM 0 HG2 GLU A 615 7.410 -11.992 -12.530 1.00 0.00 H new ATOM 0 HG3 GLU A 615 7.272 -10.831 -11.225 1.00 0.00 H new ATOM 609 N ASP A 616 6.508 -8.170 -15.360 1.00 0.00 N ATOM 610 CA ASP A 616 6.328 -7.778 -16.758 1.00 0.00 C ATOM 611 C ASP A 616 7.534 -6.985 -17.279 1.00 0.00 C ATOM 612 O ASP A 616 7.881 -7.078 -18.455 1.00 0.00 O ATOM 613 CB ASP A 616 5.029 -6.974 -16.896 1.00 0.00 C ATOM 614 CG ASP A 616 4.641 -6.775 -18.363 1.00 0.00 C ATOM 615 OD1 ASP A 616 4.424 -7.808 -19.036 1.00 0.00 O ATOM 616 OD2 ASP A 616 4.511 -5.601 -18.773 1.00 0.00 O ATOM 0 H ASP A 616 5.810 -7.779 -14.727 1.00 0.00 H new ATOM 0 HA ASP A 616 6.256 -8.677 -17.370 1.00 0.00 H new ATOM 0 HB2 ASP A 616 4.224 -7.490 -16.373 1.00 0.00 H new ATOM 0 HB3 ASP A 616 5.149 -6.003 -16.416 1.00 0.00 H new ATOM 621 N ASP A 617 8.230 -6.277 -16.380 1.00 0.00 N ATOM 622 CA ASP A 617 9.371 -5.423 -16.688 1.00 0.00 C ATOM 623 C ASP A 617 10.616 -6.234 -17.008 1.00 0.00 C ATOM 624 O ASP A 617 11.423 -5.846 -17.853 1.00 0.00 O ATOM 625 CB ASP A 617 9.654 -4.553 -15.467 1.00 0.00 C ATOM 626 CG ASP A 617 10.702 -3.465 -15.718 1.00 0.00 C ATOM 627 OD1 ASP A 617 10.471 -2.631 -16.620 1.00 0.00 O ATOM 628 OD2 ASP A 617 11.714 -3.467 -14.975 1.00 0.00 O ATOM 0 H ASP A 617 8.002 -6.287 -15.386 1.00 0.00 H new ATOM 0 HA ASP A 617 9.128 -4.822 -17.564 1.00 0.00 H new ATOM 0 HB2 ASP A 617 8.725 -4.083 -15.143 1.00 0.00 H new ATOM 0 HB3 ASP A 617 9.992 -5.189 -14.649 1.00 0.00 H new ATOM 633 N TYR A 618 10.764 -7.384 -16.343 1.00 0.00 N ATOM 634 CA TYR A 618 11.909 -8.266 -16.493 1.00 0.00 C ATOM 635 C TYR A 618 11.495 -9.531 -17.254 1.00 0.00 C ATOM 636 O TYR A 618 12.305 -10.449 -17.427 1.00 0.00 O ATOM 637 CB TYR A 618 12.535 -8.493 -15.112 1.00 0.00 C ATOM 638 CG TYR A 618 13.701 -7.571 -14.822 1.00 0.00 C ATOM 639 CD1 TYR A 618 13.454 -6.228 -14.489 1.00 0.00 C ATOM 640 CD2 TYR A 618 15.025 -8.041 -14.903 1.00 0.00 C ATOM 641 CE1 TYR A 618 14.518 -5.350 -14.229 1.00 0.00 C ATOM 642 CE2 TYR A 618 16.099 -7.177 -14.619 1.00 0.00 C ATOM 643 CZ TYR A 618 15.850 -5.825 -14.286 1.00 0.00 C ATOM 644 OH TYR A 618 16.895 -4.991 -14.022 1.00 0.00 O ATOM 0 H TYR A 618 10.074 -7.728 -15.675 1.00 0.00 H new ATOM 0 HA TYR A 618 12.694 -7.824 -17.106 1.00 0.00 H new ATOM 0 HB2 TYR A 618 11.771 -8.352 -14.347 1.00 0.00 H new ATOM 0 HB3 TYR A 618 12.872 -9.527 -15.039 1.00 0.00 H new ATOM 0 HD1 TYR A 618 12.437 -5.869 -14.433 1.00 0.00 H new ATOM 0 HD2 TYR A 618 15.217 -9.066 -15.183 1.00 0.00 H new ATOM 0 HE1 TYR A 618 14.321 -4.316 -13.986 1.00 0.00 H new ATOM 0 HE2 TYR A 618 17.113 -7.546 -14.655 1.00 0.00 H new ATOM 0 HH TYR A 618 17.737 -5.485 -14.106 1.00 0.00 H new ATOM 654 N GLY A 619 10.252 -9.559 -17.752 1.00 0.00 N ATOM 655 CA GLY A 619 9.786 -10.523 -18.745 1.00 0.00 C ATOM 656 C GLY A 619 9.343 -11.831 -18.099 1.00 0.00 C ATOM 657 O GLY A 619 9.621 -12.917 -18.613 1.00 0.00 O ATOM 0 H GLY A 619 9.531 -8.896 -17.467 1.00 0.00 H new ATOM 0 HA2 GLY A 619 8.955 -10.095 -19.306 1.00 0.00 H new ATOM 0 HA3 GLY A 619 10.584 -10.723 -19.460 1.00 0.00 H new ATOM 661 N GLY A 620 8.722 -11.706 -16.930 1.00 0.00 N ATOM 662 CA GLY A 620 8.089 -12.723 -16.119 1.00 0.00 C ATOM 663 C GLY A 620 8.981 -13.245 -14.993 1.00 0.00 C ATOM 664 O GLY A 620 8.970 -14.437 -14.692 1.00 0.00 O ATOM 0 H GLY A 620 8.646 -10.790 -16.487 1.00 0.00 H new ATOM 0 HA2 GLY A 620 7.174 -12.316 -15.688 1.00 0.00 H new ATOM 0 HA3 GLY A 620 7.798 -13.557 -16.758 1.00 0.00 H new ATOM 668 N ARG A 621 9.763 -12.351 -14.385 1.00 0.00 N ATOM 669 CA ARG A 621 10.577 -12.562 -13.187 1.00 0.00 C ATOM 670 C ARG A 621 10.790 -11.182 -12.573 1.00 0.00 C ATOM 671 O ARG A 621 10.766 -10.214 -13.323 1.00 0.00 O ATOM 672 CB ARG A 621 11.916 -13.219 -13.575 1.00 0.00 C ATOM 673 CG ARG A 621 12.771 -12.349 -14.522 1.00 0.00 C ATOM 674 CD ARG A 621 13.895 -13.099 -15.252 1.00 0.00 C ATOM 675 NE ARG A 621 13.403 -14.272 -16.000 1.00 0.00 N ATOM 676 CZ ARG A 621 12.525 -14.273 -17.016 1.00 0.00 C ATOM 677 NH1 ARG A 621 12.148 -13.156 -17.630 1.00 0.00 N ATOM 678 NH2 ARG A 621 11.990 -15.422 -17.426 1.00 0.00 N ATOM 0 H ARG A 621 9.850 -11.399 -14.740 1.00 0.00 H new ATOM 0 HA ARG A 621 10.093 -13.228 -12.473 1.00 0.00 H new ATOM 0 HB2 ARG A 621 12.486 -13.427 -12.670 1.00 0.00 H new ATOM 0 HB3 ARG A 621 11.717 -14.178 -14.054 1.00 0.00 H new ATOM 0 HG2 ARG A 621 12.115 -11.894 -15.265 1.00 0.00 H new ATOM 0 HG3 ARG A 621 13.212 -11.536 -13.945 1.00 0.00 H new ATOM 0 HD2 ARG A 621 14.394 -12.417 -15.940 1.00 0.00 H new ATOM 0 HD3 ARG A 621 14.642 -13.422 -14.527 1.00 0.00 H new ATOM 0 HE ARG A 621 13.769 -15.180 -15.714 1.00 0.00 H new ATOM 0 HH11 ARG A 621 12.528 -12.257 -17.333 1.00 0.00 H new ATOM 0 HH12 ARG A 621 11.478 -13.197 -18.398 1.00 0.00 H new ATOM 0 HH21 ARG A 621 12.248 -16.296 -16.969 1.00 0.00 H new ATOM 0 HH22 ARG A 621 11.323 -15.427 -18.197 1.00 0.00 H new ATOM 692 N ALA A 622 11.036 -11.068 -11.270 1.00 0.00 N ATOM 693 CA ALA A 622 11.181 -9.785 -10.589 1.00 0.00 C ATOM 694 C ALA A 622 12.456 -9.814 -9.735 1.00 0.00 C ATOM 695 O ALA A 622 12.526 -10.624 -8.811 1.00 0.00 O ATOM 696 CB ALA A 622 9.938 -9.514 -9.741 1.00 0.00 C ATOM 0 H ALA A 622 11.141 -11.872 -10.652 1.00 0.00 H new ATOM 0 HA ALA A 622 11.273 -8.975 -11.313 1.00 0.00 H new ATOM 0 HB1 ALA A 622 10.046 -8.556 -9.232 1.00 0.00 H new ATOM 0 HB2 ALA A 622 9.058 -9.486 -10.384 1.00 0.00 H new ATOM 0 HB3 ALA A 622 9.822 -10.306 -9.001 1.00 0.00 H new ATOM 702 N PRO A 623 13.483 -8.997 -10.033 1.00 0.00 N ATOM 703 CA PRO A 623 14.764 -9.039 -9.334 1.00 0.00 C ATOM 704 C PRO A 623 14.594 -8.695 -7.850 1.00 0.00 C ATOM 705 O PRO A 623 14.194 -7.582 -7.496 1.00 0.00 O ATOM 706 CB PRO A 623 15.686 -8.064 -10.071 1.00 0.00 C ATOM 707 CG PRO A 623 14.722 -7.127 -10.793 1.00 0.00 C ATOM 708 CD PRO A 623 13.503 -7.987 -11.079 1.00 0.00 C ATOM 0 HA PRO A 623 15.198 -10.039 -9.343 1.00 0.00 H new ATOM 0 HB2 PRO A 623 16.329 -7.521 -9.379 1.00 0.00 H new ATOM 0 HB3 PRO A 623 16.339 -8.583 -10.772 1.00 0.00 H new ATOM 0 HG2 PRO A 623 14.465 -6.267 -10.174 1.00 0.00 H new ATOM 0 HG3 PRO A 623 15.159 -6.739 -11.713 1.00 0.00 H new ATOM 0 HD2 PRO A 623 12.591 -7.391 -11.066 1.00 0.00 H new ATOM 0 HD3 PRO A 623 13.570 -8.446 -12.066 1.00 0.00 H new ATOM 716 N THR A 624 14.917 -9.651 -6.976 1.00 0.00 N ATOM 717 CA THR A 624 14.660 -9.608 -5.543 1.00 0.00 C ATOM 718 C THR A 624 15.430 -8.444 -4.902 1.00 0.00 C ATOM 719 O THR A 624 14.938 -7.794 -3.977 1.00 0.00 O ATOM 720 CB THR A 624 15.033 -10.980 -4.940 1.00 0.00 C ATOM 721 OG1 THR A 624 14.446 -12.007 -5.718 1.00 0.00 O ATOM 722 CG2 THR A 624 14.551 -11.114 -3.497 1.00 0.00 C ATOM 0 H THR A 624 15.384 -10.511 -7.264 1.00 0.00 H new ATOM 0 HA THR A 624 13.605 -9.424 -5.341 1.00 0.00 H new ATOM 0 HB THR A 624 16.120 -11.064 -4.945 1.00 0.00 H new ATOM 0 HG1 THR A 624 14.919 -12.850 -5.557 1.00 0.00 H new ATOM 0 HG21 THR A 624 14.833 -12.093 -3.109 1.00 0.00 H new ATOM 0 HG22 THR A 624 15.009 -10.336 -2.887 1.00 0.00 H new ATOM 0 HG23 THR A 624 13.467 -11.009 -3.464 1.00 0.00 H new ATOM 730 N ASN A 625 16.608 -8.122 -5.452 1.00 0.00 N ATOM 731 CA ASN A 625 17.383 -6.964 -5.035 1.00 0.00 C ATOM 732 C ASN A 625 16.604 -5.664 -5.236 1.00 0.00 C ATOM 733 O ASN A 625 16.582 -4.808 -4.351 1.00 0.00 O ATOM 734 CB ASN A 625 18.694 -6.892 -5.826 1.00 0.00 C ATOM 735 CG ASN A 625 19.507 -5.658 -5.442 1.00 0.00 C ATOM 736 OD1 ASN A 625 19.683 -4.756 -6.248 1.00 0.00 O ATOM 737 ND2 ASN A 625 20.011 -5.590 -4.216 1.00 0.00 N ATOM 0 H ASN A 625 17.044 -8.663 -6.199 1.00 0.00 H new ATOM 0 HA ASN A 625 17.596 -7.079 -3.972 1.00 0.00 H new ATOM 0 HB2 ASN A 625 19.283 -7.790 -5.640 1.00 0.00 H new ATOM 0 HB3 ASN A 625 18.476 -6.869 -6.894 1.00 0.00 H new ATOM 0 HD21 ASN A 625 20.556 -4.775 -3.933 1.00 0.00 H new ATOM 0 HD22 ASN A 625 19.854 -6.352 -3.557 1.00 0.00 H new ATOM 744 N ILE A 626 15.970 -5.517 -6.404 1.00 0.00 N ATOM 745 CA ILE A 626 15.234 -4.309 -6.727 1.00 0.00 C ATOM 746 C ILE A 626 13.962 -4.275 -5.891 1.00 0.00 C ATOM 747 O ILE A 626 13.632 -3.212 -5.387 1.00 0.00 O ATOM 748 CB ILE A 626 14.940 -4.217 -8.234 1.00 0.00 C ATOM 749 CG1 ILE A 626 16.210 -4.343 -9.111 1.00 0.00 C ATOM 750 CG2 ILE A 626 14.183 -2.923 -8.558 1.00 0.00 C ATOM 751 CD1 ILE A 626 17.286 -3.275 -8.868 1.00 0.00 C ATOM 0 H ILE A 626 15.957 -6.226 -7.137 1.00 0.00 H new ATOM 0 HA ILE A 626 15.839 -3.435 -6.485 1.00 0.00 H new ATOM 0 HB ILE A 626 14.310 -5.072 -8.480 1.00 0.00 H new ATOM 0 HG12 ILE A 626 16.652 -5.325 -8.942 1.00 0.00 H new ATOM 0 HG13 ILE A 626 15.913 -4.303 -10.159 1.00 0.00 H new ATOM 0 HG21 ILE A 626 13.984 -2.876 -9.629 1.00 0.00 H new ATOM 0 HG22 ILE A 626 13.239 -2.907 -8.013 1.00 0.00 H new ATOM 0 HG23 ILE A 626 14.787 -2.065 -8.263 1.00 0.00 H new ATOM 0 HD11 ILE A 626 18.132 -3.453 -9.532 1.00 0.00 H new ATOM 0 HD12 ILE A 626 16.870 -2.287 -9.068 1.00 0.00 H new ATOM 0 HD13 ILE A 626 17.621 -3.325 -7.832 1.00 0.00 H new ATOM 763 N LEU A 627 13.294 -5.415 -5.673 1.00 0.00 N ATOM 764 CA LEU A 627 12.170 -5.511 -4.741 1.00 0.00 C ATOM 765 C LEU A 627 12.528 -4.919 -3.379 1.00 0.00 C ATOM 766 O LEU A 627 11.760 -4.117 -2.849 1.00 0.00 O ATOM 767 CB LEU A 627 11.727 -6.974 -4.597 1.00 0.00 C ATOM 768 CG LEU A 627 10.607 -7.326 -5.590 1.00 0.00 C ATOM 769 CD1 LEU A 627 10.908 -8.609 -6.367 1.00 0.00 C ATOM 770 CD2 LEU A 627 9.300 -7.435 -4.815 1.00 0.00 C ATOM 0 H LEU A 627 13.519 -6.294 -6.139 1.00 0.00 H new ATOM 0 HA LEU A 627 11.341 -4.931 -5.146 1.00 0.00 H new ATOM 0 HB2 LEU A 627 12.581 -7.631 -4.762 1.00 0.00 H new ATOM 0 HB3 LEU A 627 11.381 -7.151 -3.579 1.00 0.00 H new ATOM 0 HG LEU A 627 10.529 -6.537 -6.338 1.00 0.00 H new ATOM 0 HD11 LEU A 627 10.089 -8.818 -7.056 1.00 0.00 H new ATOM 0 HD12 LEU A 627 11.833 -8.485 -6.930 1.00 0.00 H new ATOM 0 HD13 LEU A 627 11.016 -9.440 -5.670 1.00 0.00 H new ATOM 0 HD21 LEU A 627 8.490 -7.684 -5.501 1.00 0.00 H new ATOM 0 HD22 LEU A 627 9.389 -8.215 -4.059 1.00 0.00 H new ATOM 0 HD23 LEU A 627 9.084 -6.483 -4.330 1.00 0.00 H new ATOM 782 N ILE A 628 13.693 -5.283 -2.831 1.00 0.00 N ATOM 783 CA ILE A 628 14.189 -4.703 -1.585 1.00 0.00 C ATOM 784 C ILE A 628 14.379 -3.190 -1.770 1.00 0.00 C ATOM 785 O ILE A 628 13.763 -2.409 -1.042 1.00 0.00 O ATOM 786 CB ILE A 628 15.459 -5.442 -1.099 1.00 0.00 C ATOM 787 CG1 ILE A 628 15.129 -6.905 -0.708 1.00 0.00 C ATOM 788 CG2 ILE A 628 16.088 -4.711 0.100 1.00 0.00 C ATOM 789 CD1 ILE A 628 16.364 -7.814 -0.673 1.00 0.00 C ATOM 0 H ILE A 628 14.312 -5.984 -3.238 1.00 0.00 H new ATOM 0 HA ILE A 628 13.458 -4.837 -0.788 1.00 0.00 H new ATOM 0 HB ILE A 628 16.175 -5.452 -1.921 1.00 0.00 H new ATOM 0 HG12 ILE A 628 14.652 -6.914 0.272 1.00 0.00 H new ATOM 0 HG13 ILE A 628 14.408 -7.310 -1.418 1.00 0.00 H new ATOM 0 HG21 ILE A 628 16.979 -5.247 0.426 1.00 0.00 H new ATOM 0 HG22 ILE A 628 16.361 -3.698 -0.194 1.00 0.00 H new ATOM 0 HG23 ILE A 628 15.370 -4.670 0.919 1.00 0.00 H new ATOM 0 HD11 ILE A 628 16.065 -8.824 -0.393 1.00 0.00 H new ATOM 0 HD12 ILE A 628 16.829 -7.834 -1.659 1.00 0.00 H new ATOM 0 HD13 ILE A 628 17.077 -7.431 0.057 1.00 0.00 H new ATOM 801 N THR A 629 15.221 -2.773 -2.726 1.00 0.00 N ATOM 802 CA THR A 629 15.581 -1.364 -2.889 1.00 0.00 C ATOM 803 C THR A 629 14.329 -0.484 -3.088 1.00 0.00 C ATOM 804 O THR A 629 14.185 0.541 -2.425 1.00 0.00 O ATOM 805 CB THR A 629 16.681 -1.223 -3.969 1.00 0.00 C ATOM 806 OG1 THR A 629 17.705 -0.371 -3.498 1.00 0.00 O ATOM 807 CG2 THR A 629 16.232 -0.701 -5.339 1.00 0.00 C ATOM 0 H THR A 629 15.665 -3.397 -3.399 1.00 0.00 H new ATOM 0 HA THR A 629 16.026 -0.977 -1.972 1.00 0.00 H new ATOM 0 HB THR A 629 17.016 -2.247 -4.134 1.00 0.00 H new ATOM 0 HG1 THR A 629 18.400 -0.285 -4.183 1.00 0.00 H new ATOM 0 HG21 THR A 629 17.091 -0.647 -6.007 1.00 0.00 H new ATOM 0 HG22 THR A 629 15.487 -1.377 -5.760 1.00 0.00 H new ATOM 0 HG23 THR A 629 15.798 0.292 -5.225 1.00 0.00 H new ATOM 815 N GLU A 630 13.380 -0.930 -3.915 1.00 0.00 N ATOM 816 CA GLU A 630 12.104 -0.275 -4.156 1.00 0.00 C ATOM 817 C GLU A 630 11.281 -0.226 -2.873 1.00 0.00 C ATOM 818 O GLU A 630 10.738 0.823 -2.547 1.00 0.00 O ATOM 819 CB GLU A 630 11.331 -1.030 -5.249 1.00 0.00 C ATOM 820 CG GLU A 630 11.835 -0.726 -6.665 1.00 0.00 C ATOM 821 CD GLU A 630 11.306 0.628 -7.144 1.00 0.00 C ATOM 822 OE1 GLU A 630 11.996 1.638 -6.895 1.00 0.00 O ATOM 823 OE2 GLU A 630 10.168 0.653 -7.670 1.00 0.00 O ATOM 0 H GLU A 630 13.489 -1.790 -4.452 1.00 0.00 H new ATOM 0 HA GLU A 630 12.290 0.746 -4.488 1.00 0.00 H new ATOM 0 HB2 GLU A 630 11.408 -2.102 -5.065 1.00 0.00 H new ATOM 0 HB3 GLU A 630 10.274 -0.770 -5.183 1.00 0.00 H new ATOM 0 HG2 GLU A 630 12.925 -0.722 -6.676 1.00 0.00 H new ATOM 0 HG3 GLU A 630 11.512 -1.511 -7.348 1.00 0.00 H new ATOM 830 N MET A 631 11.193 -1.321 -2.110 1.00 0.00 N ATOM 831 CA MET A 631 10.429 -1.321 -0.867 1.00 0.00 C ATOM 832 C MET A 631 10.969 -0.284 0.132 1.00 0.00 C ATOM 833 O MET A 631 10.158 0.399 0.769 1.00 0.00 O ATOM 834 CB MET A 631 10.483 -2.697 -0.200 1.00 0.00 C ATOM 835 CG MET A 631 9.467 -3.724 -0.701 1.00 0.00 C ATOM 836 SD MET A 631 7.752 -3.392 -0.209 1.00 0.00 S ATOM 837 CE MET A 631 7.655 -4.417 1.265 1.00 0.00 C ATOM 0 H MET A 631 11.640 -2.211 -2.333 1.00 0.00 H new ATOM 0 HA MET A 631 9.402 -1.067 -1.131 1.00 0.00 H new ATOM 0 HB2 MET A 631 11.483 -3.107 -0.339 1.00 0.00 H new ATOM 0 HB3 MET A 631 10.338 -2.565 0.872 1.00 0.00 H new ATOM 0 HG2 MET A 631 9.518 -3.765 -1.789 1.00 0.00 H new ATOM 0 HG3 MET A 631 9.753 -4.709 -0.331 1.00 0.00 H new ATOM 0 HE1 MET A 631 6.654 -4.347 1.691 1.00 0.00 H new ATOM 0 HE2 MET A 631 7.866 -5.454 1.002 1.00 0.00 H new ATOM 0 HE3 MET A 631 8.386 -4.072 1.997 1.00 0.00 H new ATOM 847 N MET A 632 12.302 -0.160 0.291 1.00 0.00 N ATOM 848 CA MET A 632 12.878 0.760 1.287 1.00 0.00 C ATOM 849 C MET A 632 12.754 2.213 0.830 1.00 0.00 C ATOM 850 O MET A 632 12.867 3.126 1.652 1.00 0.00 O ATOM 851 CB MET A 632 14.341 0.456 1.689 1.00 0.00 C ATOM 852 CG MET A 632 15.113 -0.517 0.801 1.00 0.00 C ATOM 853 SD MET A 632 16.912 -0.535 1.022 1.00 0.00 S ATOM 854 CE MET A 632 16.997 -1.032 2.757 1.00 0.00 C ATOM 0 H MET A 632 12.992 -0.680 -0.252 1.00 0.00 H new ATOM 0 HA MET A 632 12.283 0.597 2.186 1.00 0.00 H new ATOM 0 HB2 MET A 632 14.888 1.398 1.716 1.00 0.00 H new ATOM 0 HB3 MET A 632 14.339 0.060 2.704 1.00 0.00 H new ATOM 0 HG2 MET A 632 14.734 -1.523 0.982 1.00 0.00 H new ATOM 0 HG3 MET A 632 14.897 -0.278 -0.240 1.00 0.00 H new ATOM 0 HE1 MET A 632 17.915 -1.593 2.930 1.00 0.00 H new ATOM 0 HE2 MET A 632 16.989 -0.145 3.390 1.00 0.00 H new ATOM 0 HE3 MET A 632 16.138 -1.658 2.999 1.00 0.00 H new ATOM 864 N ASP A 633 12.489 2.421 -0.458 1.00 0.00 N ATOM 865 CA ASP A 633 12.289 3.724 -1.046 1.00 0.00 C ATOM 866 C ASP A 633 10.821 4.099 -0.922 1.00 0.00 C ATOM 867 O ASP A 633 10.452 5.090 -0.293 1.00 0.00 O ATOM 868 CB ASP A 633 12.710 3.633 -2.513 1.00 0.00 C ATOM 869 CG ASP A 633 12.758 5.024 -3.140 1.00 0.00 C ATOM 870 OD1 ASP A 633 13.815 5.681 -3.009 1.00 0.00 O ATOM 871 OD2 ASP A 633 11.715 5.427 -3.705 1.00 0.00 O ATOM 0 H ASP A 633 12.407 1.660 -1.132 1.00 0.00 H new ATOM 0 HA ASP A 633 12.879 4.490 -0.543 1.00 0.00 H new ATOM 0 HB2 ASP A 633 13.689 3.159 -2.588 1.00 0.00 H new ATOM 0 HB3 ASP A 633 12.008 3.004 -3.061 1.00 0.00 H new ATOM 876 N ARG A 634 9.974 3.252 -1.505 1.00 0.00 N ATOM 877 CA ARG A 634 8.606 3.587 -1.846 1.00 0.00 C ATOM 878 C ARG A 634 7.675 3.351 -0.671 1.00 0.00 C ATOM 879 O ARG A 634 6.641 4.009 -0.572 1.00 0.00 O ATOM 880 CB ARG A 634 8.196 2.725 -3.044 1.00 0.00 C ATOM 881 CG ARG A 634 9.014 3.069 -4.304 1.00 0.00 C ATOM 882 CD ARG A 634 8.700 2.170 -5.505 1.00 0.00 C ATOM 883 NE ARG A 634 7.267 1.888 -5.697 1.00 0.00 N ATOM 884 CZ ARG A 634 6.768 1.142 -6.693 1.00 0.00 C ATOM 885 NH1 ARG A 634 7.518 0.757 -7.717 1.00 0.00 N ATOM 886 NH2 ARG A 634 5.498 0.744 -6.651 1.00 0.00 N ATOM 0 H ARG A 634 10.231 2.297 -1.755 1.00 0.00 H new ATOM 0 HA ARG A 634 8.536 4.645 -2.099 1.00 0.00 H new ATOM 0 HB2 ARG A 634 8.333 1.672 -2.798 1.00 0.00 H new ATOM 0 HB3 ARG A 634 7.135 2.869 -3.249 1.00 0.00 H new ATOM 0 HG2 ARG A 634 8.824 4.107 -4.578 1.00 0.00 H new ATOM 0 HG3 ARG A 634 10.076 2.991 -4.070 1.00 0.00 H new ATOM 0 HD2 ARG A 634 9.089 2.641 -6.408 1.00 0.00 H new ATOM 0 HD3 ARG A 634 9.231 1.225 -5.385 1.00 0.00 H new ATOM 0 HE ARG A 634 6.610 2.287 -5.027 1.00 0.00 H new ATOM 0 HH11 ARG A 634 8.500 1.028 -7.760 1.00 0.00 H new ATOM 0 HH12 ARG A 634 7.112 0.190 -8.461 1.00 0.00 H new ATOM 0 HH21 ARG A 634 4.907 1.007 -5.862 1.00 0.00 H new ATOM 0 HH22 ARG A 634 5.116 0.176 -7.408 1.00 0.00 H new ATOM 900 N TYR A 635 8.034 2.418 0.217 1.00 0.00 N ATOM 901 CA TYR A 635 7.194 2.002 1.331 1.00 0.00 C ATOM 902 C TYR A 635 7.974 1.998 2.655 1.00 0.00 C ATOM 903 O TYR A 635 7.432 1.590 3.684 1.00 0.00 O ATOM 904 CB TYR A 635 6.597 0.634 0.979 1.00 0.00 C ATOM 905 CG TYR A 635 5.887 0.569 -0.375 1.00 0.00 C ATOM 906 CD1 TYR A 635 4.813 1.431 -0.683 1.00 0.00 C ATOM 907 CD2 TYR A 635 6.330 -0.340 -1.353 1.00 0.00 C ATOM 908 CE1 TYR A 635 4.191 1.377 -1.947 1.00 0.00 C ATOM 909 CE2 TYR A 635 5.696 -0.423 -2.603 1.00 0.00 C ATOM 910 CZ TYR A 635 4.624 0.438 -2.911 1.00 0.00 C ATOM 911 OH TYR A 635 4.026 0.362 -4.136 1.00 0.00 O ATOM 0 H TYR A 635 8.928 1.928 0.177 1.00 0.00 H new ATOM 0 HA TYR A 635 6.382 2.713 1.486 1.00 0.00 H new ATOM 0 HB2 TYR A 635 7.395 -0.108 0.990 1.00 0.00 H new ATOM 0 HB3 TYR A 635 5.889 0.352 1.758 1.00 0.00 H new ATOM 0 HD1 TYR A 635 4.465 2.138 0.056 1.00 0.00 H new ATOM 0 HD2 TYR A 635 7.170 -0.984 -1.139 1.00 0.00 H new ATOM 0 HE1 TYR A 635 3.382 2.054 -2.179 1.00 0.00 H new ATOM 0 HE2 TYR A 635 6.031 -1.148 -3.330 1.00 0.00 H new ATOM 0 HH TYR A 635 3.484 1.165 -4.286 1.00 0.00 H new ATOM 921 N ASN A 636 9.232 2.461 2.604 1.00 0.00 N ATOM 922 CA ASN A 636 10.255 2.516 3.641 1.00 0.00 C ATOM 923 C ASN A 636 10.285 1.301 4.569 1.00 0.00 C ATOM 924 O ASN A 636 10.378 1.415 5.790 1.00 0.00 O ATOM 925 CB ASN A 636 10.235 3.872 4.353 1.00 0.00 C ATOM 926 CG ASN A 636 11.577 4.194 5.011 1.00 0.00 C ATOM 927 OD1 ASN A 636 11.637 4.516 6.190 1.00 0.00 O ATOM 928 ND2 ASN A 636 12.677 4.157 4.264 1.00 0.00 N ATOM 0 H ASN A 636 9.590 2.849 1.731 1.00 0.00 H new ATOM 0 HA ASN A 636 11.221 2.442 3.141 1.00 0.00 H new ATOM 0 HB2 ASN A 636 9.986 4.654 3.636 1.00 0.00 H new ATOM 0 HB3 ASN A 636 9.451 3.872 5.110 1.00 0.00 H new ATOM 0 HD21 ASN A 636 13.580 4.398 4.673 1.00 0.00 H new ATOM 0 HD22 ASN A 636 12.618 3.887 3.282 1.00 0.00 H new ATOM 935 N VAL A 637 10.236 0.117 3.961 1.00 0.00 N ATOM 936 CA VAL A 637 10.396 -1.161 4.641 1.00 0.00 C ATOM 937 C VAL A 637 11.885 -1.518 4.577 1.00 0.00 C ATOM 938 O VAL A 637 12.446 -1.612 3.487 1.00 0.00 O ATOM 939 CB VAL A 637 9.489 -2.208 3.966 1.00 0.00 C ATOM 940 CG1 VAL A 637 9.536 -3.551 4.693 1.00 0.00 C ATOM 941 CG2 VAL A 637 8.020 -1.763 3.938 1.00 0.00 C ATOM 0 H VAL A 637 10.080 0.021 2.958 1.00 0.00 H new ATOM 0 HA VAL A 637 10.094 -1.122 5.688 1.00 0.00 H new ATOM 0 HB VAL A 637 9.872 -2.310 2.951 1.00 0.00 H new ATOM 0 HG11 VAL A 637 8.883 -4.262 4.186 1.00 0.00 H new ATOM 0 HG12 VAL A 637 10.558 -3.931 4.690 1.00 0.00 H new ATOM 0 HG13 VAL A 637 9.200 -3.420 5.722 1.00 0.00 H new ATOM 0 HG21 VAL A 637 7.416 -2.531 3.454 1.00 0.00 H new ATOM 0 HG22 VAL A 637 7.666 -1.613 4.958 1.00 0.00 H new ATOM 0 HG23 VAL A 637 7.933 -0.829 3.383 1.00 0.00 H new ATOM 951 N SER A 638 12.535 -1.668 5.735 1.00 0.00 N ATOM 952 CA SER A 638 13.953 -1.983 5.853 1.00 0.00 C ATOM 953 C SER A 638 14.228 -3.361 5.262 1.00 0.00 C ATOM 954 O SER A 638 13.365 -4.231 5.329 1.00 0.00 O ATOM 955 CB SER A 638 14.339 -1.963 7.338 1.00 0.00 C ATOM 956 OG SER A 638 13.749 -0.862 8.006 1.00 0.00 O ATOM 0 H SER A 638 12.072 -1.570 6.639 1.00 0.00 H new ATOM 0 HA SER A 638 14.544 -1.246 5.308 1.00 0.00 H new ATOM 0 HB2 SER A 638 14.021 -2.892 7.812 1.00 0.00 H new ATOM 0 HB3 SER A 638 15.424 -1.911 7.434 1.00 0.00 H new ATOM 0 HG SER A 638 14.010 -0.874 8.951 1.00 0.00 H new ATOM 962 N GLU A 639 15.444 -3.588 4.760 1.00 0.00 N ATOM 963 CA GLU A 639 15.838 -4.805 4.059 1.00 0.00 C ATOM 964 C GLU A 639 15.494 -6.067 4.853 1.00 0.00 C ATOM 965 O GLU A 639 14.953 -7.000 4.273 1.00 0.00 O ATOM 966 CB GLU A 639 17.329 -4.690 3.707 1.00 0.00 C ATOM 967 CG GLU A 639 17.940 -5.972 3.132 1.00 0.00 C ATOM 968 CD GLU A 639 19.282 -5.681 2.449 1.00 0.00 C ATOM 969 OE1 GLU A 639 20.200 -5.214 3.160 1.00 0.00 O ATOM 970 OE2 GLU A 639 19.360 -5.883 1.216 1.00 0.00 O ATOM 0 H GLU A 639 16.201 -2.908 4.834 1.00 0.00 H new ATOM 0 HA GLU A 639 15.268 -4.906 3.136 1.00 0.00 H new ATOM 0 HB2 GLU A 639 17.459 -3.884 2.985 1.00 0.00 H new ATOM 0 HB3 GLU A 639 17.882 -4.408 4.603 1.00 0.00 H new ATOM 0 HG2 GLU A 639 18.084 -6.700 3.930 1.00 0.00 H new ATOM 0 HG3 GLU A 639 17.251 -6.418 2.414 1.00 0.00 H new ATOM 977 N GLU A 640 15.673 -6.054 6.178 1.00 0.00 N ATOM 978 CA GLU A 640 15.331 -7.191 7.046 1.00 0.00 C ATOM 979 C GLU A 640 13.823 -7.473 6.955 1.00 0.00 C ATOM 980 O GLU A 640 13.358 -8.605 6.805 1.00 0.00 O ATOM 981 CB GLU A 640 15.720 -6.823 8.492 1.00 0.00 C ATOM 982 CG GLU A 640 15.450 -7.941 9.514 1.00 0.00 C ATOM 983 CD GLU A 640 15.374 -7.389 10.941 1.00 0.00 C ATOM 984 OE1 GLU A 640 16.413 -6.914 11.444 1.00 0.00 O ATOM 985 OE2 GLU A 640 14.252 -7.414 11.504 1.00 0.00 O ATOM 0 H GLU A 640 16.059 -5.255 6.681 1.00 0.00 H new ATOM 0 HA GLU A 640 15.868 -8.087 6.734 1.00 0.00 H new ATOM 0 HB2 GLU A 640 16.779 -6.568 8.519 1.00 0.00 H new ATOM 0 HB3 GLU A 640 15.169 -5.931 8.790 1.00 0.00 H new ATOM 0 HG2 GLU A 640 14.515 -8.444 9.267 1.00 0.00 H new ATOM 0 HG3 GLU A 640 16.240 -8.690 9.454 1.00 0.00 H new ATOM 992 N LYS A 641 13.061 -6.386 7.042 1.00 0.00 N ATOM 993 CA LYS A 641 11.614 -6.341 7.045 1.00 0.00 C ATOM 994 C LYS A 641 11.006 -6.566 5.672 1.00 0.00 C ATOM 995 O LYS A 641 9.801 -6.755 5.574 1.00 0.00 O ATOM 996 CB LYS A 641 11.193 -4.973 7.603 1.00 0.00 C ATOM 997 CG LYS A 641 9.976 -5.127 8.510 1.00 0.00 C ATOM 998 CD LYS A 641 10.428 -5.347 9.952 1.00 0.00 C ATOM 999 CE LYS A 641 11.503 -6.426 10.147 1.00 0.00 C ATOM 1000 NZ LYS A 641 11.687 -6.816 11.553 1.00 0.00 N ATOM 0 H LYS A 641 13.472 -5.455 7.117 1.00 0.00 H new ATOM 0 HA LYS A 641 11.242 -7.155 7.667 1.00 0.00 H new ATOM 0 HB2 LYS A 641 12.018 -4.530 8.161 1.00 0.00 H new ATOM 0 HB3 LYS A 641 10.961 -4.293 6.783 1.00 0.00 H new ATOM 0 HG2 LYS A 641 9.350 -4.237 8.448 1.00 0.00 H new ATOM 0 HG3 LYS A 641 9.368 -5.968 8.178 1.00 0.00 H new ATOM 0 HD2 LYS A 641 10.809 -4.404 10.344 1.00 0.00 H new ATOM 0 HD3 LYS A 641 9.557 -5.613 10.551 1.00 0.00 H new ATOM 0 HE2 LYS A 641 11.233 -7.307 9.565 1.00 0.00 H new ATOM 0 HE3 LYS A 641 12.451 -6.061 9.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 641 12.636 -7.223 11.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 641 11.586 -5.979 12.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 641 10.970 -7.523 11.814 1.00 0.00 H new ATOM 1014 N VAL A 642 11.827 -6.533 4.628 1.00 0.00 N ATOM 1015 CA VAL A 642 11.493 -7.049 3.303 1.00 0.00 C ATOM 1016 C VAL A 642 11.886 -8.520 3.184 1.00 0.00 C ATOM 1017 O VAL A 642 11.056 -9.303 2.732 1.00 0.00 O ATOM 1018 CB VAL A 642 12.117 -6.222 2.157 1.00 0.00 C ATOM 1019 CG1 VAL A 642 11.516 -6.669 0.817 1.00 0.00 C ATOM 1020 CG2 VAL A 642 11.845 -4.720 2.264 1.00 0.00 C ATOM 0 H VAL A 642 12.766 -6.138 4.680 1.00 0.00 H new ATOM 0 HA VAL A 642 10.412 -6.958 3.197 1.00 0.00 H new ATOM 0 HB VAL A 642 13.191 -6.393 2.225 1.00 0.00 H new ATOM 0 HG11 VAL A 642 11.956 -6.086 0.008 1.00 0.00 H new ATOM 0 HG12 VAL A 642 11.727 -7.726 0.658 1.00 0.00 H new ATOM 0 HG13 VAL A 642 10.437 -6.513 0.832 1.00 0.00 H new ATOM 0 HG21 VAL A 642 12.314 -4.205 1.426 1.00 0.00 H new ATOM 0 HG22 VAL A 642 10.770 -4.543 2.244 1.00 0.00 H new ATOM 0 HG23 VAL A 642 12.258 -4.341 3.199 1.00 0.00 H new ATOM 1030 N GLU A 643 13.098 -8.921 3.589 1.00 0.00 N ATOM 1031 CA GLU A 643 13.570 -10.304 3.493 1.00 0.00 C ATOM 1032 C GLU A 643 12.598 -11.270 4.168 1.00 0.00 C ATOM 1033 O GLU A 643 12.367 -12.374 3.669 1.00 0.00 O ATOM 1034 CB GLU A 643 14.967 -10.461 4.110 1.00 0.00 C ATOM 1035 CG GLU A 643 16.092 -10.006 3.173 1.00 0.00 C ATOM 1036 CD GLU A 643 17.455 -10.336 3.787 1.00 0.00 C ATOM 1037 OE1 GLU A 643 17.789 -9.715 4.821 1.00 0.00 O ATOM 1038 OE2 GLU A 643 18.126 -11.238 3.235 1.00 0.00 O ATOM 0 H GLU A 643 13.784 -8.286 3.997 1.00 0.00 H new ATOM 0 HA GLU A 643 13.627 -10.549 2.432 1.00 0.00 H new ATOM 0 HB2 GLU A 643 15.016 -9.885 5.034 1.00 0.00 H new ATOM 0 HB3 GLU A 643 15.125 -11.506 4.377 1.00 0.00 H new ATOM 0 HG2 GLU A 643 15.992 -10.498 2.206 1.00 0.00 H new ATOM 0 HG3 GLU A 643 16.015 -8.934 2.994 1.00 0.00 H new ATOM 1045 N GLU A 644 11.973 -10.851 5.271 1.00 0.00 N ATOM 1046 CA GLU A 644 10.950 -11.675 5.889 1.00 0.00 C ATOM 1047 C GLU A 644 9.737 -11.834 4.966 1.00 0.00 C ATOM 1048 O GLU A 644 9.215 -12.931 4.839 1.00 0.00 O ATOM 1049 CB GLU A 644 10.579 -11.166 7.284 1.00 0.00 C ATOM 1050 CG GLU A 644 9.519 -10.062 7.285 1.00 0.00 C ATOM 1051 CD GLU A 644 9.108 -9.657 8.702 1.00 0.00 C ATOM 1052 OE1 GLU A 644 8.180 -10.306 9.234 1.00 0.00 O ATOM 1053 OE2 GLU A 644 9.717 -8.704 9.243 1.00 0.00 O ATOM 0 H GLU A 644 12.157 -9.965 5.741 1.00 0.00 H new ATOM 0 HA GLU A 644 11.363 -12.673 6.035 1.00 0.00 H new ATOM 0 HB2 GLU A 644 10.216 -12.003 7.880 1.00 0.00 H new ATOM 0 HB3 GLU A 644 11.478 -10.792 7.774 1.00 0.00 H new ATOM 0 HG2 GLU A 644 9.905 -9.190 6.757 1.00 0.00 H new ATOM 0 HG3 GLU A 644 8.641 -10.403 6.737 1.00 0.00 H new ATOM 1060 N LEU A 645 9.290 -10.780 4.280 1.00 0.00 N ATOM 1061 CA LEU A 645 8.146 -10.848 3.374 1.00 0.00 C ATOM 1062 C LEU A 645 8.485 -11.827 2.264 1.00 0.00 C ATOM 1063 O LEU A 645 7.682 -12.700 1.937 1.00 0.00 O ATOM 1064 CB LEU A 645 7.768 -9.473 2.806 1.00 0.00 C ATOM 1065 CG LEU A 645 7.638 -8.389 3.884 1.00 0.00 C ATOM 1066 CD1 LEU A 645 7.542 -7.024 3.208 1.00 0.00 C ATOM 1067 CD2 LEU A 645 6.461 -8.601 4.845 1.00 0.00 C ATOM 0 H LEU A 645 9.714 -9.854 4.339 1.00 0.00 H new ATOM 0 HA LEU A 645 7.271 -11.190 3.927 1.00 0.00 H new ATOM 0 HB2 LEU A 645 8.522 -9.167 2.081 1.00 0.00 H new ATOM 0 HB3 LEU A 645 6.824 -9.556 2.268 1.00 0.00 H new ATOM 0 HG LEU A 645 8.531 -8.448 4.506 1.00 0.00 H new ATOM 0 HD11 LEU A 645 7.449 -6.248 3.967 1.00 0.00 H new ATOM 0 HD12 LEU A 645 8.440 -6.847 2.616 1.00 0.00 H new ATOM 0 HD13 LEU A 645 6.668 -7.001 2.557 1.00 0.00 H new ATOM 0 HD21 LEU A 645 6.438 -7.793 5.576 1.00 0.00 H new ATOM 0 HD22 LEU A 645 5.528 -8.607 4.282 1.00 0.00 H new ATOM 0 HD23 LEU A 645 6.579 -9.554 5.361 1.00 0.00 H new ATOM 1079 N ILE A 646 9.714 -11.711 1.751 1.00 0.00 N ATOM 1080 CA ILE A 646 10.259 -12.592 0.741 1.00 0.00 C ATOM 1081 C ILE A 646 10.174 -14.031 1.248 1.00 0.00 C ATOM 1082 O ILE A 646 9.661 -14.879 0.519 1.00 0.00 O ATOM 1083 CB ILE A 646 11.689 -12.137 0.346 1.00 0.00 C ATOM 1084 CG1 ILE A 646 11.631 -10.704 -0.230 1.00 0.00 C ATOM 1085 CG2 ILE A 646 12.306 -13.120 -0.667 1.00 0.00 C ATOM 1086 CD1 ILE A 646 12.982 -10.020 -0.475 1.00 0.00 C ATOM 0 H ILE A 646 10.365 -10.981 2.041 1.00 0.00 H new ATOM 0 HA ILE A 646 9.678 -12.545 -0.180 1.00 0.00 H new ATOM 0 HB ILE A 646 12.326 -12.132 1.231 1.00 0.00 H new ATOM 0 HG12 ILE A 646 11.086 -10.735 -1.174 1.00 0.00 H new ATOM 0 HG13 ILE A 646 11.051 -10.083 0.453 1.00 0.00 H new ATOM 0 HG21 ILE A 646 13.309 -12.786 -0.933 1.00 0.00 H new ATOM 0 HG22 ILE A 646 12.360 -14.114 -0.223 1.00 0.00 H new ATOM 0 HG23 ILE A 646 11.686 -13.157 -1.563 1.00 0.00 H new ATOM 0 HD11 ILE A 646 12.816 -9.021 -0.879 1.00 0.00 H new ATOM 0 HD12 ILE A 646 13.528 -9.945 0.466 1.00 0.00 H new ATOM 0 HD13 ILE A 646 13.563 -10.607 -1.186 1.00 0.00 H new ATOM 1098 N ARG A 647 10.612 -14.339 2.480 1.00 0.00 N ATOM 1099 CA ARG A 647 10.596 -15.748 2.892 1.00 0.00 C ATOM 1100 C ARG A 647 9.188 -16.213 3.247 1.00 0.00 C ATOM 1101 O ARG A 647 8.818 -17.314 2.855 1.00 0.00 O ATOM 1102 CB ARG A 647 11.631 -16.083 3.981 1.00 0.00 C ATOM 1103 CG ARG A 647 11.591 -15.260 5.277 1.00 0.00 C ATOM 1104 CD ARG A 647 11.686 -16.084 6.567 1.00 0.00 C ATOM 1105 NE ARG A 647 10.366 -16.596 6.982 1.00 0.00 N ATOM 1106 CZ ARG A 647 9.819 -17.787 6.698 1.00 0.00 C ATOM 1107 NH1 ARG A 647 10.479 -18.740 6.049 1.00 0.00 N ATOM 1108 NH2 ARG A 647 8.570 -18.062 7.056 1.00 0.00 N ATOM 0 H ARG A 647 10.962 -13.675 3.171 1.00 0.00 H new ATOM 0 HA ARG A 647 10.913 -16.324 2.023 1.00 0.00 H new ATOM 0 HB2 ARG A 647 11.512 -17.133 4.246 1.00 0.00 H new ATOM 0 HB3 ARG A 647 12.624 -15.975 3.545 1.00 0.00 H new ATOM 0 HG2 ARG A 647 12.411 -14.542 5.260 1.00 0.00 H new ATOM 0 HG3 ARG A 647 10.665 -14.685 5.297 1.00 0.00 H new ATOM 0 HD2 ARG A 647 12.370 -16.919 6.417 1.00 0.00 H new ATOM 0 HD3 ARG A 647 12.105 -15.468 7.363 1.00 0.00 H new ATOM 0 HE ARG A 647 9.801 -15.968 7.554 1.00 0.00 H new ATOM 0 HH11 ARG A 647 11.440 -18.580 5.746 1.00 0.00 H new ATOM 0 HH12 ARG A 647 10.025 -19.632 5.853 1.00 0.00 H new ATOM 0 HH21 ARG A 647 8.016 -17.364 7.552 1.00 0.00 H new ATOM 0 HH22 ARG A 647 8.164 -18.971 6.835 1.00 0.00 H new ATOM 1122 N ILE A 648 8.389 -15.392 3.926 1.00 0.00 N ATOM 1123 CA ILE A 648 7.034 -15.725 4.347 1.00 0.00 C ATOM 1124 C ILE A 648 6.191 -16.027 3.112 1.00 0.00 C ATOM 1125 O ILE A 648 5.613 -17.109 3.038 1.00 0.00 O ATOM 1126 CB ILE A 648 6.450 -14.584 5.205 1.00 0.00 C ATOM 1127 CG1 ILE A 648 7.235 -14.455 6.536 1.00 0.00 C ATOM 1128 CG2 ILE A 648 4.959 -14.775 5.522 1.00 0.00 C ATOM 1129 CD1 ILE A 648 7.076 -13.084 7.189 1.00 0.00 C ATOM 0 H ILE A 648 8.676 -14.454 4.205 1.00 0.00 H new ATOM 0 HA ILE A 648 7.036 -16.616 4.974 1.00 0.00 H new ATOM 0 HB ILE A 648 6.550 -13.674 4.613 1.00 0.00 H new ATOM 0 HG12 ILE A 648 6.894 -15.224 7.229 1.00 0.00 H new ATOM 0 HG13 ILE A 648 8.292 -14.642 6.348 1.00 0.00 H new ATOM 0 HG21 ILE A 648 4.606 -13.941 6.128 1.00 0.00 H new ATOM 0 HG22 ILE A 648 4.391 -14.814 4.592 1.00 0.00 H new ATOM 0 HG23 ILE A 648 4.820 -15.706 6.071 1.00 0.00 H new ATOM 0 HD11 ILE A 648 7.648 -13.054 8.116 1.00 0.00 H new ATOM 0 HD12 ILE A 648 7.443 -12.313 6.511 1.00 0.00 H new ATOM 0 HD13 ILE A 648 6.023 -12.904 7.406 1.00 0.00 H new ATOM 1141 N LEU A 649 6.112 -15.114 2.132 1.00 0.00 N ATOM 1142 CA LEU A 649 5.292 -15.363 0.954 1.00 0.00 C ATOM 1143 C LEU A 649 5.775 -16.572 0.135 1.00 0.00 C ATOM 1144 O LEU A 649 4.973 -17.224 -0.538 1.00 0.00 O ATOM 1145 CB LEU A 649 5.143 -14.100 0.090 1.00 0.00 C ATOM 1146 CG LEU A 649 4.124 -13.087 0.632 1.00 0.00 C ATOM 1147 CD1 LEU A 649 4.755 -12.036 1.536 1.00 0.00 C ATOM 1148 CD2 LEU A 649 3.406 -12.370 -0.521 1.00 0.00 C ATOM 0 H LEU A 649 6.598 -14.217 2.137 1.00 0.00 H new ATOM 0 HA LEU A 649 4.299 -15.626 1.318 1.00 0.00 H new ATOM 0 HB2 LEU A 649 6.115 -13.613 0.007 1.00 0.00 H new ATOM 0 HB3 LEU A 649 4.847 -14.394 -0.917 1.00 0.00 H new ATOM 0 HG LEU A 649 3.415 -13.665 1.225 1.00 0.00 H new ATOM 0 HD11 LEU A 649 3.985 -11.349 1.888 1.00 0.00 H new ATOM 0 HD12 LEU A 649 5.223 -12.525 2.391 1.00 0.00 H new ATOM 0 HD13 LEU A 649 5.509 -11.481 0.978 1.00 0.00 H new ATOM 0 HD21 LEU A 649 2.688 -11.657 -0.115 1.00 0.00 H new ATOM 0 HD22 LEU A 649 4.137 -11.841 -1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 649 2.882 -13.103 -1.135 1.00 0.00 H new ATOM 1160 N LYS A 650 7.070 -16.887 0.209 1.00 0.00 N ATOM 1161 CA LYS A 650 7.652 -18.089 -0.414 1.00 0.00 C ATOM 1162 C LYS A 650 7.127 -19.332 0.293 1.00 0.00 C ATOM 1163 O LYS A 650 6.698 -20.293 -0.337 1.00 0.00 O ATOM 1164 CB LYS A 650 9.200 -18.068 -0.446 1.00 0.00 C ATOM 1165 CG LYS A 650 9.740 -17.177 -1.578 1.00 0.00 C ATOM 1166 CD LYS A 650 11.244 -16.864 -1.588 1.00 0.00 C ATOM 1167 CE LYS A 650 12.178 -18.038 -1.884 1.00 0.00 C ATOM 1168 NZ LYS A 650 12.532 -18.806 -0.673 1.00 0.00 N ATOM 0 H LYS A 650 7.753 -16.315 0.705 1.00 0.00 H new ATOM 0 HA LYS A 650 7.339 -18.105 -1.458 1.00 0.00 H new ATOM 0 HB2 LYS A 650 9.578 -17.708 0.511 1.00 0.00 H new ATOM 0 HB3 LYS A 650 9.574 -19.084 -0.574 1.00 0.00 H new ATOM 0 HG2 LYS A 650 9.491 -17.653 -2.526 1.00 0.00 H new ATOM 0 HG3 LYS A 650 9.201 -16.230 -1.545 1.00 0.00 H new ATOM 0 HD2 LYS A 650 11.427 -16.086 -2.329 1.00 0.00 H new ATOM 0 HD3 LYS A 650 11.514 -16.449 -0.617 1.00 0.00 H new ATOM 0 HE2 LYS A 650 11.701 -18.703 -2.604 1.00 0.00 H new ATOM 0 HE3 LYS A 650 13.089 -17.663 -2.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 650 13.564 -18.798 -0.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 650 12.078 -18.374 0.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 650 12.203 -19.787 -0.776 1.00 0.00 H new ATOM 1182 N ASP A 651 7.121 -19.265 1.618 1.00 0.00 N ATOM 1183 CA ASP A 651 6.695 -20.327 2.540 1.00 0.00 C ATOM 1184 C ASP A 651 5.208 -20.618 2.345 1.00 0.00 C ATOM 1185 O ASP A 651 4.772 -21.765 2.343 1.00 0.00 O ATOM 1186 CB ASP A 651 6.944 -19.912 4.009 1.00 0.00 C ATOM 1187 CG ASP A 651 7.790 -20.893 4.823 1.00 0.00 C ATOM 1188 OD1 ASP A 651 7.835 -22.093 4.489 1.00 0.00 O ATOM 1189 OD2 ASP A 651 8.418 -20.398 5.794 1.00 0.00 O ATOM 0 H ASP A 651 7.428 -18.427 2.111 1.00 0.00 H new ATOM 0 HA ASP A 651 7.279 -21.221 2.322 1.00 0.00 H new ATOM 0 HB2 ASP A 651 7.434 -18.939 4.018 1.00 0.00 H new ATOM 0 HB3 ASP A 651 5.981 -19.788 4.504 1.00 0.00 H new ATOM 1194 N LYS A 652 4.431 -19.551 2.133 1.00 0.00 N ATOM 1195 CA LYS A 652 3.007 -19.610 1.823 1.00 0.00 C ATOM 1196 C LYS A 652 2.722 -20.286 0.478 1.00 0.00 C ATOM 1197 O LYS A 652 1.560 -20.584 0.209 1.00 0.00 O ATOM 1198 CB LYS A 652 2.455 -18.175 1.798 1.00 0.00 C ATOM 1199 CG LYS A 652 2.216 -17.573 3.193 1.00 0.00 C ATOM 1200 CD LYS A 652 2.494 -16.063 3.204 1.00 0.00 C ATOM 1201 CE LYS A 652 1.547 -15.297 4.140 1.00 0.00 C ATOM 1202 NZ LYS A 652 1.761 -13.830 4.105 1.00 0.00 N ATOM 0 H LYS A 652 4.790 -18.597 2.175 1.00 0.00 H new ATOM 0 HA LYS A 652 2.521 -20.210 2.592 1.00 0.00 H new ATOM 0 HB2 LYS A 652 3.152 -17.538 1.253 1.00 0.00 H new ATOM 0 HB3 LYS A 652 1.516 -18.167 1.244 1.00 0.00 H new ATOM 0 HG2 LYS A 652 1.186 -17.758 3.500 1.00 0.00 H new ATOM 0 HG3 LYS A 652 2.859 -18.069 3.920 1.00 0.00 H new ATOM 0 HD2 LYS A 652 3.525 -15.889 3.513 1.00 0.00 H new ATOM 0 HD3 LYS A 652 2.394 -15.671 2.192 1.00 0.00 H new ATOM 0 HE2 LYS A 652 0.516 -15.515 3.863 1.00 0.00 H new ATOM 0 HE3 LYS A 652 1.685 -15.655 5.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 652 1.633 -13.438 5.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 652 2.726 -13.628 3.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 652 1.074 -13.394 3.457 1.00 0.00 H new ATOM 1216 N GLY A 653 3.726 -20.466 -0.393 1.00 0.00 N ATOM 1217 CA GLY A 653 3.493 -20.806 -1.787 1.00 0.00 C ATOM 1218 C GLY A 653 2.750 -19.687 -2.516 1.00 0.00 C ATOM 1219 O GLY A 653 2.114 -19.954 -3.531 1.00 0.00 O ATOM 0 H GLY A 653 4.711 -20.379 -0.145 1.00 0.00 H new ATOM 0 HA2 GLY A 653 4.446 -20.995 -2.281 1.00 0.00 H new ATOM 0 HA3 GLY A 653 2.915 -21.728 -1.847 1.00 0.00 H new ATOM 1223 N ALA A 654 2.792 -18.446 -2.003 1.00 0.00 N ATOM 1224 CA ALA A 654 2.257 -17.290 -2.707 1.00 0.00 C ATOM 1225 C ALA A 654 3.245 -16.841 -3.782 1.00 0.00 C ATOM 1226 O ALA A 654 2.835 -16.422 -4.867 1.00 0.00 O ATOM 1227 CB ALA A 654 1.973 -16.154 -1.719 1.00 0.00 C ATOM 0 H ALA A 654 3.197 -18.226 -1.093 1.00 0.00 H new ATOM 0 HA ALA A 654 1.318 -17.563 -3.188 1.00 0.00 H new ATOM 0 HB1 ALA A 654 1.573 -15.295 -2.258 1.00 0.00 H new ATOM 0 HB2 ALA A 654 1.246 -16.489 -0.979 1.00 0.00 H new ATOM 0 HB3 ALA A 654 2.897 -15.869 -1.217 1.00 0.00 H new ATOM 1233 N ILE A 655 4.550 -16.927 -3.493 1.00 0.00 N ATOM 1234 CA ILE A 655 5.595 -16.554 -4.437 1.00 0.00 C ATOM 1235 C ILE A 655 6.636 -17.660 -4.458 1.00 0.00 C ATOM 1236 O ILE A 655 6.593 -18.598 -3.660 1.00 0.00 O ATOM 1237 CB ILE A 655 6.184 -15.164 -4.112 1.00 0.00 C ATOM 1238 CG1 ILE A 655 6.921 -15.144 -2.770 1.00 0.00 C ATOM 1239 CG2 ILE A 655 5.045 -14.145 -4.143 1.00 0.00 C ATOM 1240 CD1 ILE A 655 7.588 -13.807 -2.427 1.00 0.00 C ATOM 0 H ILE A 655 4.904 -17.258 -2.596 1.00 0.00 H new ATOM 0 HA ILE A 655 5.180 -16.454 -5.440 1.00 0.00 H new ATOM 0 HB ILE A 655 6.933 -14.908 -4.861 1.00 0.00 H new ATOM 0 HG12 ILE A 655 6.215 -15.396 -1.979 1.00 0.00 H new ATOM 0 HG13 ILE A 655 7.683 -15.924 -2.777 1.00 0.00 H new ATOM 0 HG21 ILE A 655 5.437 -13.154 -3.916 1.00 0.00 H new ATOM 0 HG22 ILE A 655 4.591 -14.137 -5.134 1.00 0.00 H new ATOM 0 HG23 ILE A 655 4.294 -14.416 -3.401 1.00 0.00 H new ATOM 0 HD11 ILE A 655 8.085 -13.886 -1.460 1.00 0.00 H new ATOM 0 HD12 ILE A 655 8.322 -13.559 -3.194 1.00 0.00 H new ATOM 0 HD13 ILE A 655 6.831 -13.024 -2.383 1.00 0.00 H new ATOM 1252 N PHE A 656 7.586 -17.526 -5.370 1.00 0.00 N ATOM 1253 CA PHE A 656 8.715 -18.411 -5.484 1.00 0.00 C ATOM 1254 C PHE A 656 9.900 -17.643 -6.055 1.00 0.00 C ATOM 1255 O PHE A 656 9.753 -16.498 -6.477 1.00 0.00 O ATOM 1256 CB PHE A 656 8.328 -19.625 -6.335 1.00 0.00 C ATOM 1257 CG PHE A 656 9.061 -20.851 -5.855 1.00 0.00 C ATOM 1258 CD1 PHE A 656 8.671 -21.448 -4.641 1.00 0.00 C ATOM 1259 CD2 PHE A 656 10.184 -21.321 -6.554 1.00 0.00 C ATOM 1260 CE1 PHE A 656 9.400 -22.540 -4.138 1.00 0.00 C ATOM 1261 CE2 PHE A 656 10.914 -22.410 -6.047 1.00 0.00 C ATOM 1262 CZ PHE A 656 10.518 -23.022 -4.843 1.00 0.00 C ATOM 0 H PHE A 656 7.586 -16.778 -6.064 1.00 0.00 H new ATOM 0 HA PHE A 656 9.013 -18.787 -4.505 1.00 0.00 H new ATOM 0 HB2 PHE A 656 7.252 -19.790 -6.278 1.00 0.00 H new ATOM 0 HB3 PHE A 656 8.567 -19.436 -7.382 1.00 0.00 H new ATOM 0 HD1 PHE A 656 7.817 -21.069 -4.099 1.00 0.00 H new ATOM 0 HD2 PHE A 656 10.486 -20.848 -7.477 1.00 0.00 H new ATOM 0 HE1 PHE A 656 9.102 -23.008 -3.212 1.00 0.00 H new ATOM 0 HE2 PHE A 656 11.778 -22.777 -6.581 1.00 0.00 H new ATOM 0 HZ PHE A 656 11.074 -23.864 -4.459 1.00 0.00 H new ATOM 1272 N GLU A 657 11.073 -18.274 -6.065 1.00 0.00 N ATOM 1273 CA GLU A 657 12.328 -17.657 -6.470 1.00 0.00 C ATOM 1274 C GLU A 657 12.975 -18.552 -7.536 1.00 0.00 C ATOM 1275 O GLU A 657 13.841 -19.363 -7.210 1.00 0.00 O ATOM 1276 CB GLU A 657 13.168 -17.399 -5.208 1.00 0.00 C ATOM 1277 CG GLU A 657 14.373 -16.462 -5.414 1.00 0.00 C ATOM 1278 CD GLU A 657 14.453 -15.356 -4.351 1.00 0.00 C ATOM 1279 OE1 GLU A 657 14.229 -15.680 -3.160 1.00 0.00 O ATOM 1280 OE2 GLU A 657 14.723 -14.193 -4.747 1.00 0.00 O ATOM 0 H GLU A 657 11.176 -19.249 -5.785 1.00 0.00 H new ATOM 0 HA GLU A 657 12.205 -16.681 -6.940 1.00 0.00 H new ATOM 0 HB2 GLU A 657 12.522 -16.974 -4.440 1.00 0.00 H new ATOM 0 HB3 GLU A 657 13.530 -18.354 -4.828 1.00 0.00 H new ATOM 0 HG2 GLU A 657 15.292 -17.048 -5.392 1.00 0.00 H new ATOM 0 HG3 GLU A 657 14.309 -16.006 -6.402 1.00 0.00 H new ATOM 1287 N PRO A 658 12.520 -18.473 -8.805 1.00 0.00 N ATOM 1288 CA PRO A 658 12.965 -19.356 -9.885 1.00 0.00 C ATOM 1289 C PRO A 658 14.453 -19.256 -10.219 1.00 0.00 C ATOM 1290 O PRO A 658 14.995 -20.167 -10.843 1.00 0.00 O ATOM 1291 CB PRO A 658 12.123 -18.982 -11.105 1.00 0.00 C ATOM 1292 CG PRO A 658 11.597 -17.586 -10.794 1.00 0.00 C ATOM 1293 CD PRO A 658 11.410 -17.661 -9.284 1.00 0.00 C ATOM 0 HA PRO A 658 12.830 -20.390 -9.569 1.00 0.00 H new ATOM 0 HB2 PRO A 658 12.721 -18.987 -12.016 1.00 0.00 H new ATOM 0 HB3 PRO A 658 11.307 -19.689 -11.256 1.00 0.00 H new ATOM 0 HG2 PRO A 658 12.304 -16.808 -11.082 1.00 0.00 H new ATOM 0 HG3 PRO A 658 10.662 -17.375 -11.313 1.00 0.00 H new ATOM 0 HD2 PRO A 658 11.425 -16.668 -8.835 1.00 0.00 H new ATOM 0 HD3 PRO A 658 10.452 -18.112 -9.027 1.00 0.00 H new ATOM 1301 N ALA A 659 15.112 -18.167 -9.819 1.00 0.00 N ATOM 1302 CA ALA A 659 16.558 -18.040 -9.907 1.00 0.00 C ATOM 1303 C ALA A 659 17.111 -17.286 -8.702 1.00 0.00 C ATOM 1304 O ALA A 659 16.375 -16.605 -7.992 1.00 0.00 O ATOM 1305 CB ALA A 659 16.945 -17.339 -11.215 1.00 0.00 C ATOM 0 H ALA A 659 14.651 -17.348 -9.424 1.00 0.00 H new ATOM 0 HA ALA A 659 16.996 -19.038 -9.904 1.00 0.00 H new ATOM 0 HB1 ALA A 659 18.030 -17.248 -11.272 1.00 0.00 H new ATOM 0 HB2 ALA A 659 16.585 -17.924 -12.061 1.00 0.00 H new ATOM 0 HB3 ALA A 659 16.496 -16.346 -11.242 1.00 0.00 H new ATOM 1311 N ARG A 660 18.439 -17.372 -8.550 1.00 0.00 N ATOM 1312 CA ARG A 660 19.333 -16.910 -7.476 1.00 0.00 C ATOM 1313 C ARG A 660 19.258 -15.424 -7.065 1.00 0.00 C ATOM 1314 O ARG A 660 20.167 -14.931 -6.403 1.00 0.00 O ATOM 1315 CB ARG A 660 20.773 -17.309 -7.866 1.00 0.00 C ATOM 1316 CG ARG A 660 21.273 -16.630 -9.156 1.00 0.00 C ATOM 1317 CD ARG A 660 22.708 -17.058 -9.487 1.00 0.00 C ATOM 1318 NE ARG A 660 23.139 -16.537 -10.798 1.00 0.00 N ATOM 1319 CZ ARG A 660 22.967 -17.121 -11.996 1.00 0.00 C ATOM 1320 NH1 ARG A 660 22.362 -18.306 -12.101 1.00 0.00 N ATOM 1321 NH2 ARG A 660 23.400 -16.511 -13.100 1.00 0.00 N ATOM 0 H ARG A 660 18.987 -17.830 -9.278 1.00 0.00 H new ATOM 0 HA ARG A 660 18.983 -17.404 -6.570 1.00 0.00 H new ATOM 0 HB2 ARG A 660 21.446 -17.055 -7.047 1.00 0.00 H new ATOM 0 HB3 ARG A 660 20.820 -18.391 -7.993 1.00 0.00 H new ATOM 0 HG2 ARG A 660 20.614 -16.887 -9.985 1.00 0.00 H new ATOM 0 HG3 ARG A 660 21.231 -15.547 -9.040 1.00 0.00 H new ATOM 0 HD2 ARG A 660 23.384 -16.698 -8.711 1.00 0.00 H new ATOM 0 HD3 ARG A 660 22.773 -18.146 -9.487 1.00 0.00 H new ATOM 0 HE ARG A 660 23.619 -15.637 -10.795 1.00 0.00 H new ATOM 0 HH11 ARG A 660 22.023 -18.781 -11.265 1.00 0.00 H new ATOM 0 HH12 ARG A 660 22.239 -18.736 -13.018 1.00 0.00 H new ATOM 0 HH21 ARG A 660 23.861 -15.603 -13.034 1.00 0.00 H new ATOM 0 HH22 ARG A 660 23.271 -16.952 -14.011 1.00 0.00 H new ATOM 1335 N GLY A 661 18.215 -14.705 -7.462 1.00 0.00 N ATOM 1336 CA GLY A 661 17.934 -13.331 -7.083 1.00 0.00 C ATOM 1337 C GLY A 661 16.711 -12.783 -7.815 1.00 0.00 C ATOM 1338 O GLY A 661 16.664 -11.581 -8.072 1.00 0.00 O ATOM 0 H GLY A 661 17.507 -15.087 -8.089 1.00 0.00 H new ATOM 0 HA2 GLY A 661 17.769 -13.277 -6.007 1.00 0.00 H new ATOM 0 HA3 GLY A 661 18.800 -12.708 -7.304 1.00 0.00 H new ATOM 1342 N TYR A 662 15.759 -13.648 -8.196 1.00 0.00 N ATOM 1343 CA TYR A 662 14.595 -13.287 -8.989 1.00 0.00 C ATOM 1344 C TYR A 662 13.372 -13.987 -8.420 1.00 0.00 C ATOM 1345 O TYR A 662 13.250 -15.204 -8.554 1.00 0.00 O ATOM 1346 CB TYR A 662 14.796 -13.690 -10.453 1.00 0.00 C ATOM 1347 CG TYR A 662 15.668 -12.741 -11.244 1.00 0.00 C ATOM 1348 CD1 TYR A 662 15.093 -11.588 -11.804 1.00 0.00 C ATOM 1349 CD2 TYR A 662 17.044 -12.995 -11.411 1.00 0.00 C ATOM 1350 CE1 TYR A 662 15.886 -10.687 -12.532 1.00 0.00 C ATOM 1351 CE2 TYR A 662 17.845 -12.095 -12.136 1.00 0.00 C ATOM 1352 CZ TYR A 662 17.266 -10.932 -12.699 1.00 0.00 C ATOM 1353 OH TYR A 662 18.024 -10.041 -13.397 1.00 0.00 O ATOM 0 H TYR A 662 15.786 -14.638 -7.951 1.00 0.00 H new ATOM 0 HA TYR A 662 14.454 -12.207 -8.949 1.00 0.00 H new ATOM 0 HB2 TYR A 662 15.239 -14.685 -10.486 1.00 0.00 H new ATOM 0 HB3 TYR A 662 13.821 -13.758 -10.936 1.00 0.00 H new ATOM 0 HD1 TYR A 662 14.038 -11.394 -11.674 1.00 0.00 H new ATOM 0 HD2 TYR A 662 17.484 -13.883 -10.981 1.00 0.00 H new ATOM 0 HE1 TYR A 662 15.439 -9.804 -12.965 1.00 0.00 H new ATOM 0 HE2 TYR A 662 18.900 -12.290 -12.263 1.00 0.00 H new ATOM 0 HH TYR A 662 17.464 -9.290 -13.685 1.00 0.00 H new ATOM 1363 N LEU A 663 12.475 -13.212 -7.811 1.00 0.00 N ATOM 1364 CA LEU A 663 11.158 -13.652 -7.387 1.00 0.00 C ATOM 1365 C LEU A 663 10.217 -13.809 -8.588 1.00 0.00 C ATOM 1366 O LEU A 663 10.455 -13.279 -9.676 1.00 0.00 O ATOM 1367 CB LEU A 663 10.578 -12.647 -6.369 1.00 0.00 C ATOM 1368 CG LEU A 663 11.031 -12.885 -4.913 1.00 0.00 C ATOM 1369 CD1 LEU A 663 10.468 -11.773 -4.015 1.00 0.00 C ATOM 1370 CD2 LEU A 663 10.559 -14.253 -4.405 1.00 0.00 C ATOM 0 H LEU A 663 12.656 -12.232 -7.595 1.00 0.00 H new ATOM 0 HA LEU A 663 11.252 -14.628 -6.911 1.00 0.00 H new ATOM 0 HB2 LEU A 663 10.866 -11.639 -6.667 1.00 0.00 H new ATOM 0 HB3 LEU A 663 9.490 -12.693 -6.411 1.00 0.00 H new ATOM 0 HG LEU A 663 12.120 -12.869 -4.882 1.00 0.00 H new ATOM 0 HD11 LEU A 663 10.787 -11.940 -2.986 1.00 0.00 H new ATOM 0 HD12 LEU A 663 10.838 -10.807 -4.358 1.00 0.00 H new ATOM 0 HD13 LEU A 663 9.379 -11.783 -4.063 1.00 0.00 H new ATOM 0 HD21 LEU A 663 10.892 -14.394 -3.377 1.00 0.00 H new ATOM 0 HD22 LEU A 663 9.471 -14.300 -4.443 1.00 0.00 H new ATOM 0 HD23 LEU A 663 10.978 -15.039 -5.033 1.00 0.00 H new ATOM 1382 N LYS A 664 9.119 -14.528 -8.351 1.00 0.00 N ATOM 1383 CA LYS A 664 7.991 -14.775 -9.239 1.00 0.00 C ATOM 1384 C LYS A 664 6.771 -15.034 -8.363 1.00 0.00 C ATOM 1385 O LYS A 664 6.920 -15.571 -7.264 1.00 0.00 O ATOM 1386 CB LYS A 664 8.343 -16.000 -10.103 1.00 0.00 C ATOM 1387 CG LYS A 664 7.158 -16.583 -10.876 1.00 0.00 C ATOM 1388 CD LYS A 664 7.510 -17.896 -11.585 1.00 0.00 C ATOM 1389 CE LYS A 664 6.299 -18.430 -12.366 1.00 0.00 C ATOM 1390 NZ LYS A 664 5.135 -18.670 -11.486 1.00 0.00 N ATOM 0 H LYS A 664 8.989 -14.992 -7.452 1.00 0.00 H new ATOM 0 HA LYS A 664 7.777 -13.934 -9.898 1.00 0.00 H new ATOM 0 HB2 LYS A 664 9.122 -15.719 -10.812 1.00 0.00 H new ATOM 0 HB3 LYS A 664 8.761 -16.776 -9.461 1.00 0.00 H new ATOM 0 HG2 LYS A 664 6.329 -16.755 -10.189 1.00 0.00 H new ATOM 0 HG3 LYS A 664 6.816 -15.856 -11.613 1.00 0.00 H new ATOM 0 HD2 LYS A 664 8.346 -17.735 -12.265 1.00 0.00 H new ATOM 0 HD3 LYS A 664 7.832 -18.636 -10.853 1.00 0.00 H new ATOM 0 HE2 LYS A 664 6.025 -17.716 -13.143 1.00 0.00 H new ATOM 0 HE3 LYS A 664 6.572 -19.358 -12.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 664 4.369 -19.108 -12.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 664 5.411 -19.305 -10.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 664 4.805 -17.766 -11.092 1.00 0.00 H new ATOM 1404 N ILE A 665 5.574 -14.692 -8.843 1.00 0.00 N ATOM 1405 CA ILE A 665 4.337 -15.088 -8.187 1.00 0.00 C ATOM 1406 C ILE A 665 4.047 -16.549 -8.550 1.00 0.00 C ATOM 1407 O ILE A 665 3.967 -16.891 -9.734 1.00 0.00 O ATOM 1408 CB ILE A 665 3.170 -14.128 -8.501 1.00 0.00 C ATOM 1409 CG1 ILE A 665 3.572 -12.688 -8.110 1.00 0.00 C ATOM 1410 CG2 ILE A 665 1.929 -14.596 -7.715 1.00 0.00 C ATOM 1411 CD1 ILE A 665 2.505 -11.618 -8.361 1.00 0.00 C ATOM 0 H ILE A 665 5.440 -14.138 -9.689 1.00 0.00 H new ATOM 0 HA ILE A 665 4.453 -15.017 -7.105 1.00 0.00 H new ATOM 0 HB ILE A 665 2.937 -14.135 -9.566 1.00 0.00 H new ATOM 0 HG12 ILE A 665 3.833 -12.676 -7.052 1.00 0.00 H new ATOM 0 HG13 ILE A 665 4.471 -12.417 -8.663 1.00 0.00 H new ATOM 0 HG21 ILE A 665 1.093 -13.929 -7.924 1.00 0.00 H new ATOM 0 HG22 ILE A 665 1.668 -15.610 -8.017 1.00 0.00 H new ATOM 0 HG23 ILE A 665 2.147 -14.580 -6.647 1.00 0.00 H new ATOM 0 HD11 ILE A 665 2.887 -10.644 -8.053 1.00 0.00 H new ATOM 0 HD12 ILE A 665 2.258 -11.592 -9.422 1.00 0.00 H new ATOM 0 HD13 ILE A 665 1.610 -11.855 -7.786 1.00 0.00 H new ATOM 1423 N VAL A 666 3.924 -17.370 -7.499 1.00 0.00 N ATOM 1424 CA VAL A 666 4.018 -18.830 -7.421 1.00 0.00 C ATOM 1425 C VAL A 666 4.553 -19.477 -8.703 1.00 0.00 C ATOM 1426 O VAL A 666 5.773 -19.345 -8.951 1.00 0.00 O ATOM 1427 CB VAL A 666 2.732 -19.427 -6.805 1.00 0.00 C ATOM 1428 CG1 VAL A 666 1.442 -19.145 -7.589 1.00 0.00 C ATOM 1429 CG2 VAL A 666 2.882 -20.930 -6.524 1.00 0.00 C ATOM 1430 OXT VAL A 666 3.782 -20.020 -9.522 1.00 0.00 O ATOM 0 H VAL A 666 3.734 -16.979 -6.576 1.00 0.00 H new ATOM 0 HA VAL A 666 4.804 -19.100 -6.715 1.00 0.00 H new ATOM 0 HB VAL A 666 2.616 -18.896 -5.860 1.00 0.00 H new ATOM 0 HG11 VAL A 666 0.597 -19.605 -7.077 1.00 0.00 H new ATOM 0 HG12 VAL A 666 1.284 -18.068 -7.655 1.00 0.00 H new ATOM 0 HG13 VAL A 666 1.528 -19.561 -8.593 1.00 0.00 H new ATOM 0 HG21 VAL A 666 1.958 -21.313 -6.092 1.00 0.00 H new ATOM 0 HG22 VAL A 666 3.092 -21.455 -7.456 1.00 0.00 H new ATOM 0 HG23 VAL A 666 3.703 -21.089 -5.825 1.00 0.00 H new