USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 905 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 33 SER OG : rot -120:sc=-0.00704 USER MOD Set 1.2: A 35 THR OG1 : rot 180:sc= 0.00934 USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ -170:sc= 1.06 (180deg=0.709) USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -1.14 K(o=-1.1,f=-2.7!) USER MOD Single : A 32 ASN : amide:sc= 1.61 K(o=1.6,f=-0.057) USER MOD Single : A 37 LYS NZ :NH3+ -173:sc= 1.07 (180deg=0.796) USER MOD Single : A 39 GLN : amide:sc= -1.63! K(o=-1.6!,f=-0.066) USER MOD Single : A 44 HIS : no HD1:sc= 0.975 K(o=0.98,f=-5!) USER MOD Single : A 46 HIS : no HE2:sc= 1.06 K(o=1.1,f=-6!) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.904 USER MOD Single : A 52 GLN : amide:sc= -0.0777 K(o=-0.078,f=-0.75) USER MOD Single : A 53 SER OG : rot 75:sc= 1.24 USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.524 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.245 K(o=-0.24,f=-4.3!) USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 83 GLN : amide:sc= 1.18 K(o=1.2,f=-0.21) USER MOD Single : A 84 GLN : amide:sc= -0.0355 X(o=-0.035,f=-0.31) USER MOD Single : A 88 GLN : amide:sc= 0.881 K(o=0.88,f=-1.3!) USER MOD Single : A 91 LYS NZ :NH3+ 135:sc= 0.981 (180deg=0.557) USER MOD Single : A 94 LYS NZ :NH3+ -167:sc= -0.0337 (180deg=-0.272) USER MOD Single : A 99 CYS SG : rot 67:sc= -1.19! USER MOD Single : A 103 SER OG : rot -46:sc= 0.983 USER MOD Single : A 106 LYS NZ :NH3+ -171:sc= 1.24 (180deg=1.01) USER MOD Single : A 107 ASN : amide:sc= -1.3 K(o=-1.3,f=-8.8!) USER MOD Single : A 108 MET CE :methyl -171:sc= -0.622 (180deg=-0.908) USER MOD Single : A 113 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 115 ASN : amide:sc=-0.00143 X(o=-0.0014,f=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.00963 USER MOD Single : A 122 ASN : amide:sc=-0.00351 K(o=-0.0035,f=-1.4) USER MOD Single : A 123 THR OG1 : rot -11:sc= 0.401 USER MOD Single : A 130 ASN : amide:sc= -0.0798 X(o=-0.08,f=-0.065) USER MOD Single : A 132 LYS NZ :NH3+ 152:sc= -1.84! (180deg=-3.61!) USER MOD Single : A 135 GLN : amide:sc= -0.0485 K(o=-0.049,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 308 N VAL A 18 -1.266 9.885 7.193 1.00 0.00 N ATOM 309 CA VAL A 18 -2.361 9.424 6.339 1.00 0.00 C ATOM 310 C VAL A 18 -1.881 9.145 4.929 1.00 0.00 C ATOM 311 O VAL A 18 -2.667 8.767 4.077 1.00 0.00 O ATOM 312 CB VAL A 18 -3.533 10.423 6.263 1.00 0.00 C ATOM 313 CG1 VAL A 18 -4.595 10.067 7.288 1.00 0.00 C ATOM 314 CG2 VAL A 18 -3.044 11.845 6.451 1.00 0.00 C ATOM 0 HA VAL A 18 -2.720 8.507 6.805 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.981 10.358 5.271 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -5.417 10.780 7.223 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -4.970 9.063 7.090 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -4.162 10.102 8.288 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -3.889 12.531 6.393 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -2.566 11.939 7.426 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -2.325 12.089 5.669 1.00 0.00 H new ATOM 324 N HIS A 19 -0.594 9.336 4.678 1.00 0.00 N ATOM 325 CA HIS A 19 -0.018 8.954 3.401 1.00 0.00 C ATOM 326 C HIS A 19 0.335 7.474 3.428 1.00 0.00 C ATOM 327 O HIS A 19 0.352 6.802 2.396 1.00 0.00 O ATOM 328 CB HIS A 19 1.213 9.802 3.073 1.00 0.00 C ATOM 329 CG HIS A 19 0.878 11.213 2.700 1.00 0.00 C ATOM 330 ND1 HIS A 19 0.685 11.621 1.396 1.00 0.00 N ATOM 331 CD2 HIS A 19 0.689 12.314 3.466 1.00 0.00 C ATOM 332 CE1 HIS A 19 0.390 12.908 1.378 1.00 0.00 C ATOM 333 NE2 HIS A 19 0.384 13.350 2.620 1.00 0.00 N ATOM 0 H HIS A 19 0.065 9.750 5.337 1.00 0.00 H new ATOM 0 HA HIS A 19 -0.753 9.133 2.616 1.00 0.00 H new ATOM 0 HB2 HIS A 19 1.880 9.810 3.935 1.00 0.00 H new ATOM 0 HB3 HIS A 19 1.758 9.336 2.252 1.00 0.00 H new ATOM 0 HD2 HIS A 19 0.764 12.366 4.542 1.00 0.00 H new ATOM 0 HE1 HIS A 19 0.188 13.498 0.496 1.00 0.00 H new ATOM 0 HE2 HIS A 19 0.185 14.309 2.906 1.00 0.00 H new ATOM 342 N GLU A 20 0.597 6.967 4.624 1.00 0.00 N ATOM 343 CA GLU A 20 0.795 5.543 4.824 1.00 0.00 C ATOM 344 C GLU A 20 -0.559 4.879 5.003 1.00 0.00 C ATOM 345 O GLU A 20 -0.798 3.777 4.513 1.00 0.00 O ATOM 346 CB GLU A 20 1.686 5.263 6.042 1.00 0.00 C ATOM 347 CG GLU A 20 3.128 5.731 5.887 1.00 0.00 C ATOM 348 CD GLU A 20 3.259 7.238 5.824 1.00 0.00 C ATOM 349 OE1 GLU A 20 3.193 7.883 6.889 1.00 0.00 O ATOM 350 OE2 GLU A 20 3.412 7.776 4.709 1.00 0.00 O ATOM 0 H GLU A 20 0.677 7.526 5.473 1.00 0.00 H new ATOM 0 HA GLU A 20 1.301 5.134 3.949 1.00 0.00 H new ATOM 0 HB2 GLU A 20 1.251 5.749 6.915 1.00 0.00 H new ATOM 0 HB3 GLU A 20 1.684 4.191 6.240 1.00 0.00 H new ATOM 0 HG2 GLU A 20 3.718 5.356 6.723 1.00 0.00 H new ATOM 0 HG3 GLU A 20 3.549 5.297 4.980 1.00 0.00 H new ATOM 357 N LEU A 21 -1.454 5.577 5.692 1.00 0.00 N ATOM 358 CA LEU A 21 -2.825 5.115 5.849 1.00 0.00 C ATOM 359 C LEU A 21 -3.543 5.156 4.506 1.00 0.00 C ATOM 360 O LEU A 21 -4.467 4.383 4.259 1.00 0.00 O ATOM 361 CB LEU A 21 -3.574 5.975 6.872 1.00 0.00 C ATOM 362 CG LEU A 21 -2.946 6.035 8.268 1.00 0.00 C ATOM 363 CD1 LEU A 21 -3.752 6.949 9.177 1.00 0.00 C ATOM 364 CD2 LEU A 21 -2.846 4.644 8.873 1.00 0.00 C ATOM 0 H LEU A 21 -1.253 6.466 6.151 1.00 0.00 H new ATOM 0 HA LEU A 21 -2.804 4.088 6.214 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.649 6.990 6.482 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.591 5.594 6.966 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.939 6.441 8.171 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -3.291 6.979 10.164 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.774 7.954 8.756 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -4.770 6.570 9.264 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -2.397 4.710 9.864 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.843 4.210 8.954 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -2.226 4.014 8.235 1.00 0.00 H new ATOM 376 N ALA A 22 -3.105 6.063 3.633 1.00 0.00 N ATOM 377 CA ALA A 22 -3.650 6.162 2.286 1.00 0.00 C ATOM 378 C ALA A 22 -3.404 4.881 1.493 1.00 0.00 C ATOM 379 O ALA A 22 -4.094 4.609 0.516 1.00 0.00 O ATOM 380 CB ALA A 22 -3.052 7.344 1.538 1.00 0.00 C ATOM 0 H ALA A 22 -2.371 6.741 3.839 1.00 0.00 H new ATOM 0 HA ALA A 22 -4.725 6.313 2.386 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -3.477 7.393 0.536 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -3.278 8.266 2.074 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -1.971 7.221 1.468 1.00 0.00 H new ATOM 386 N ARG A 23 -2.409 4.104 1.909 1.00 0.00 N ATOM 387 CA ARG A 23 -2.119 2.830 1.264 1.00 0.00 C ATOM 388 C ARG A 23 -3.236 1.839 1.578 1.00 0.00 C ATOM 389 O ARG A 23 -3.651 1.053 0.723 1.00 0.00 O ATOM 390 CB ARG A 23 -0.762 2.289 1.728 1.00 0.00 C ATOM 391 CG ARG A 23 0.373 3.289 1.552 1.00 0.00 C ATOM 392 CD ARG A 23 1.712 2.726 2.008 1.00 0.00 C ATOM 393 NE ARG A 23 2.753 3.759 2.028 1.00 0.00 N ATOM 394 CZ ARG A 23 3.932 3.653 1.410 1.00 0.00 C ATOM 395 NH1 ARG A 23 4.240 2.561 0.723 1.00 0.00 N ATOM 396 NH2 ARG A 23 4.813 4.642 1.478 1.00 0.00 N ATOM 0 H ARG A 23 -1.792 4.334 2.688 1.00 0.00 H new ATOM 0 HA ARG A 23 -2.067 2.975 0.185 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -0.830 2.007 2.779 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -0.529 1.382 1.170 1.00 0.00 H new ATOM 0 HG2 ARG A 23 0.441 3.578 0.503 1.00 0.00 H new ATOM 0 HG3 ARG A 23 0.149 4.193 2.118 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.606 2.296 3.004 1.00 0.00 H new ATOM 0 HD3 ARG A 23 2.013 1.918 1.342 1.00 0.00 H new ATOM 0 HE ARG A 23 2.564 4.615 2.549 1.00 0.00 H new ATOM 0 HH11 ARG A 23 3.573 1.791 0.663 1.00 0.00 H new ATOM 0 HH12 ARG A 23 5.144 2.491 0.255 1.00 0.00 H new ATOM 0 HH21 ARG A 23 4.591 5.487 2.004 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.712 4.557 1.005 1.00 0.00 H new ATOM 410 N VAL A 24 -3.738 1.909 2.807 1.00 0.00 N ATOM 411 CA VAL A 24 -4.904 1.133 3.207 1.00 0.00 C ATOM 412 C VAL A 24 -6.138 1.657 2.484 1.00 0.00 C ATOM 413 O VAL A 24 -6.985 0.886 2.031 1.00 0.00 O ATOM 414 CB VAL A 24 -5.131 1.196 4.737 1.00 0.00 C ATOM 415 CG1 VAL A 24 -6.423 0.495 5.132 1.00 0.00 C ATOM 416 CG2 VAL A 24 -3.952 0.583 5.474 1.00 0.00 C ATOM 0 H VAL A 24 -3.353 2.498 3.545 1.00 0.00 H new ATOM 0 HA VAL A 24 -4.727 0.092 2.936 1.00 0.00 H new ATOM 0 HB VAL A 24 -5.216 2.245 5.020 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -6.555 0.556 6.212 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -7.265 0.978 4.636 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -6.376 -0.552 4.831 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -4.128 0.635 6.548 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -3.838 -0.459 5.175 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -3.043 1.132 5.228 1.00 0.00 H new ATOM 426 N LYS A 25 -6.215 2.977 2.353 1.00 0.00 N ATOM 427 CA LYS A 25 -7.317 3.607 1.643 1.00 0.00 C ATOM 428 C LYS A 25 -7.292 3.235 0.162 1.00 0.00 C ATOM 429 O LYS A 25 -8.337 3.118 -0.465 1.00 0.00 O ATOM 430 CB LYS A 25 -7.280 5.128 1.803 1.00 0.00 C ATOM 431 CG LYS A 25 -8.436 5.824 1.103 1.00 0.00 C ATOM 432 CD LYS A 25 -8.381 7.330 1.267 1.00 0.00 C ATOM 433 CE LYS A 25 -9.455 8.006 0.430 1.00 0.00 C ATOM 434 NZ LYS A 25 -9.281 7.725 -1.020 1.00 0.00 N ATOM 0 H LYS A 25 -5.527 3.629 2.730 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.244 3.238 2.081 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.301 5.377 2.864 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.339 5.508 1.405 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.419 5.575 0.042 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.379 5.451 1.503 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -8.515 7.591 2.317 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -7.398 7.697 0.970 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.438 7.662 0.752 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.424 9.082 0.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.921 8.332 -1.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -8.297 7.919 -1.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.503 6.727 -1.209 1.00 0.00 H new ATOM 448 N PHE A 26 -6.099 3.058 -0.400 1.00 0.00 N ATOM 449 CA PHE A 26 -5.979 2.590 -1.776 1.00 0.00 C ATOM 450 C PHE A 26 -6.647 1.229 -1.912 1.00 0.00 C ATOM 451 O PHE A 26 -7.405 0.990 -2.852 1.00 0.00 O ATOM 452 CB PHE A 26 -4.512 2.510 -2.219 1.00 0.00 C ATOM 453 CG PHE A 26 -4.336 1.822 -3.546 1.00 0.00 C ATOM 454 CD1 PHE A 26 -4.856 2.374 -4.707 1.00 0.00 C ATOM 455 CD2 PHE A 26 -3.676 0.607 -3.627 1.00 0.00 C ATOM 456 CE1 PHE A 26 -4.720 1.727 -5.921 1.00 0.00 C ATOM 457 CE2 PHE A 26 -3.543 -0.046 -4.837 1.00 0.00 C ATOM 458 CZ PHE A 26 -4.063 0.514 -5.985 1.00 0.00 C ATOM 0 H PHE A 26 -5.211 3.230 0.071 1.00 0.00 H new ATOM 0 HA PHE A 26 -6.479 3.309 -2.426 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -4.101 3.518 -2.281 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -3.938 1.978 -1.461 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -5.374 3.321 -4.662 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -3.260 0.165 -2.734 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.127 2.170 -6.818 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.031 -0.996 -4.884 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.957 0.005 -6.932 1.00 0.00 H new ATOM 468 N MET A 27 -6.366 0.348 -0.958 1.00 0.00 N ATOM 469 CA MET A 27 -7.030 -0.948 -0.895 1.00 0.00 C ATOM 470 C MET A 27 -8.541 -0.748 -0.806 1.00 0.00 C ATOM 471 O MET A 27 -9.297 -1.360 -1.557 1.00 0.00 O ATOM 472 CB MET A 27 -6.523 -1.749 0.307 1.00 0.00 C ATOM 473 CG MET A 27 -5.046 -2.100 0.225 1.00 0.00 C ATOM 474 SD MET A 27 -4.442 -2.925 1.711 1.00 0.00 S ATOM 475 CE MET A 27 -2.763 -3.313 1.224 1.00 0.00 C ATOM 0 H MET A 27 -5.683 0.508 -0.218 1.00 0.00 H new ATOM 0 HA MET A 27 -6.800 -1.510 -1.800 1.00 0.00 H new ATOM 0 HB2 MET A 27 -6.702 -1.176 1.217 1.00 0.00 H new ATOM 0 HB3 MET A 27 -7.102 -2.668 0.391 1.00 0.00 H new ATOM 0 HG2 MET A 27 -4.878 -2.745 -0.637 1.00 0.00 H new ATOM 0 HG3 MET A 27 -4.469 -1.190 0.060 1.00 0.00 H new ATOM 0 HE1 MET A 27 -2.257 -3.828 2.041 1.00 0.00 H new ATOM 0 HE2 MET A 27 -2.779 -3.956 0.344 1.00 0.00 H new ATOM 0 HE3 MET A 27 -2.230 -2.392 0.990 1.00 0.00 H new ATOM 485 N GLN A 28 -8.960 0.140 0.095 1.00 0.00 N ATOM 486 CA GLN A 28 -10.370 0.493 0.255 1.00 0.00 C ATOM 487 C GLN A 28 -10.987 0.904 -1.079 1.00 0.00 C ATOM 488 O GLN A 28 -12.012 0.359 -1.492 1.00 0.00 O ATOM 489 CB GLN A 28 -10.517 1.653 1.240 1.00 0.00 C ATOM 490 CG GLN A 28 -11.962 2.044 1.507 1.00 0.00 C ATOM 491 CD GLN A 28 -12.092 3.425 2.114 1.00 0.00 C ATOM 492 OE1 GLN A 28 -11.193 3.909 2.801 1.00 0.00 O ATOM 493 NE2 GLN A 28 -13.221 4.071 1.866 1.00 0.00 N ATOM 0 H GLN A 28 -8.334 0.633 0.732 1.00 0.00 H new ATOM 0 HA GLN A 28 -10.889 -0.387 0.635 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -10.043 1.381 2.183 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -9.981 2.519 0.852 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -12.522 2.008 0.573 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -12.414 1.313 2.178 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -13.942 3.635 1.291 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -13.369 5.004 2.249 1.00 0.00 H new ATOM 502 N ASP A 29 -10.355 1.872 -1.734 1.00 0.00 N ATOM 503 CA ASP A 29 -10.842 2.407 -3.000 1.00 0.00 C ATOM 504 C ASP A 29 -11.059 1.306 -4.025 1.00 0.00 C ATOM 505 O ASP A 29 -12.106 1.248 -4.656 1.00 0.00 O ATOM 506 CB ASP A 29 -9.875 3.452 -3.567 1.00 0.00 C ATOM 507 CG ASP A 29 -10.109 4.842 -3.008 1.00 0.00 C ATOM 508 OD1 ASP A 29 -11.053 5.521 -3.470 1.00 0.00 O ATOM 509 OD2 ASP A 29 -9.344 5.279 -2.125 1.00 0.00 O ATOM 0 H ASP A 29 -9.493 2.307 -1.403 1.00 0.00 H new ATOM 0 HA ASP A 29 -11.800 2.884 -2.795 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -8.851 3.147 -3.350 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -9.976 3.481 -4.652 1.00 0.00 H new ATOM 514 N VAL A 30 -10.080 0.423 -4.171 1.00 0.00 N ATOM 515 CA VAL A 30 -10.161 -0.642 -5.165 1.00 0.00 C ATOM 516 C VAL A 30 -11.331 -1.587 -4.881 1.00 0.00 C ATOM 517 O VAL A 30 -12.062 -1.969 -5.798 1.00 0.00 O ATOM 518 CB VAL A 30 -8.848 -1.448 -5.244 1.00 0.00 C ATOM 519 CG1 VAL A 30 -8.962 -2.562 -6.270 1.00 0.00 C ATOM 520 CG2 VAL A 30 -7.683 -0.533 -5.584 1.00 0.00 C ATOM 0 H VAL A 30 -9.224 0.422 -3.617 1.00 0.00 H new ATOM 0 HA VAL A 30 -10.329 -0.158 -6.127 1.00 0.00 H new ATOM 0 HB VAL A 30 -8.664 -1.898 -4.268 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.025 -3.118 -6.309 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -9.772 -3.235 -5.988 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -9.171 -2.134 -7.250 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.764 -1.117 -5.636 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.864 -0.056 -6.547 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -7.584 0.231 -4.813 1.00 0.00 H new ATOM 530 N VAL A 31 -11.523 -1.937 -3.612 1.00 0.00 N ATOM 531 CA VAL A 31 -12.603 -2.847 -3.222 1.00 0.00 C ATOM 532 C VAL A 31 -13.966 -2.147 -3.330 1.00 0.00 C ATOM 533 O VAL A 31 -15.019 -2.791 -3.324 1.00 0.00 O ATOM 534 CB VAL A 31 -12.412 -3.380 -1.780 1.00 0.00 C ATOM 535 CG1 VAL A 31 -13.365 -4.529 -1.497 1.00 0.00 C ATOM 536 CG2 VAL A 31 -10.980 -3.825 -1.545 1.00 0.00 C ATOM 0 H VAL A 31 -10.948 -1.607 -2.836 1.00 0.00 H new ATOM 0 HA VAL A 31 -12.572 -3.693 -3.908 1.00 0.00 H new ATOM 0 HB VAL A 31 -12.636 -2.562 -1.096 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.212 -4.886 -0.479 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.393 -4.185 -1.610 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -13.175 -5.341 -2.199 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -10.876 -4.194 -0.525 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -10.726 -4.620 -2.246 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -10.307 -2.981 -1.695 1.00 0.00 H new ATOM 546 N ASN A 32 -13.939 -0.822 -3.419 1.00 0.00 N ATOM 547 CA ASN A 32 -15.159 -0.039 -3.591 1.00 0.00 C ATOM 548 C ASN A 32 -15.278 0.467 -5.023 1.00 0.00 C ATOM 549 O ASN A 32 -16.249 1.133 -5.382 1.00 0.00 O ATOM 550 CB ASN A 32 -15.192 1.151 -2.625 1.00 0.00 C ATOM 551 CG ASN A 32 -15.526 0.755 -1.199 1.00 0.00 C ATOM 552 OD1 ASN A 32 -16.694 0.674 -0.822 1.00 0.00 O ATOM 553 ND2 ASN A 32 -14.505 0.513 -0.395 1.00 0.00 N ATOM 0 H ASN A 32 -13.085 -0.266 -3.375 1.00 0.00 H new ATOM 0 HA ASN A 32 -16.002 -0.694 -3.371 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -14.223 1.649 -2.639 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -15.927 1.875 -2.976 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -14.672 0.248 0.576 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -13.550 0.591 -0.745 1.00 0.00 H new ATOM 560 N SER A 33 -14.281 0.156 -5.836 1.00 0.00 N ATOM 561 CA SER A 33 -14.252 0.604 -7.214 1.00 0.00 C ATOM 562 C SER A 33 -14.587 -0.551 -8.146 1.00 0.00 C ATOM 563 O SER A 33 -14.554 -1.714 -7.747 1.00 0.00 O ATOM 564 CB SER A 33 -12.868 1.176 -7.551 1.00 0.00 C ATOM 565 OG SER A 33 -12.843 1.774 -8.839 1.00 0.00 O ATOM 0 H SER A 33 -13.478 -0.409 -5.560 1.00 0.00 H new ATOM 0 HA SER A 33 -14.997 1.388 -7.348 1.00 0.00 H new ATOM 0 HB2 SER A 33 -12.588 1.916 -6.801 1.00 0.00 H new ATOM 0 HB3 SER A 33 -12.125 0.380 -7.506 1.00 0.00 H new ATOM 0 HG SER A 33 -12.180 1.318 -9.399 1.00 0.00 H new ATOM 571 N ASP A 34 -14.898 -0.222 -9.387 1.00 0.00 N ATOM 572 CA ASP A 34 -15.227 -1.220 -10.396 1.00 0.00 C ATOM 573 C ASP A 34 -14.015 -2.091 -10.708 1.00 0.00 C ATOM 574 O ASP A 34 -14.152 -3.215 -11.194 1.00 0.00 O ATOM 575 CB ASP A 34 -15.732 -0.513 -11.657 1.00 0.00 C ATOM 576 CG ASP A 34 -16.028 -1.461 -12.797 1.00 0.00 C ATOM 577 OD1 ASP A 34 -17.115 -2.066 -12.804 1.00 0.00 O ATOM 578 OD2 ASP A 34 -15.175 -1.601 -13.700 1.00 0.00 O ATOM 0 H ASP A 34 -14.930 0.740 -9.726 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.012 -1.874 -10.015 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -16.636 0.046 -11.414 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -14.986 0.213 -11.982 1.00 0.00 H new ATOM 583 N THR A 35 -12.837 -1.566 -10.387 1.00 0.00 N ATOM 584 CA THR A 35 -11.576 -2.272 -10.568 1.00 0.00 C ATOM 585 C THR A 35 -11.648 -3.699 -10.020 1.00 0.00 C ATOM 586 O THR A 35 -11.279 -4.656 -10.705 1.00 0.00 O ATOM 587 CB THR A 35 -10.443 -1.503 -9.863 1.00 0.00 C ATOM 588 OG1 THR A 35 -10.501 -0.123 -10.246 1.00 0.00 O ATOM 589 CG2 THR A 35 -9.077 -2.076 -10.219 1.00 0.00 C ATOM 0 H THR A 35 -12.731 -0.632 -9.991 1.00 0.00 H new ATOM 0 HA THR A 35 -11.374 -2.331 -11.638 1.00 0.00 H new ATOM 0 HB THR A 35 -10.578 -1.601 -8.786 1.00 0.00 H new ATOM 0 HG1 THR A 35 -9.783 0.371 -9.798 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.300 -1.510 -9.705 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.029 -3.121 -9.911 1.00 0.00 H new ATOM 0 HG23 THR A 35 -8.923 -2.008 -11.296 1.00 0.00 H new ATOM 597 N PHE A 36 -12.143 -3.838 -8.794 1.00 0.00 N ATOM 598 CA PHE A 36 -12.286 -5.148 -8.172 1.00 0.00 C ATOM 599 C PHE A 36 -13.578 -5.234 -7.366 1.00 0.00 C ATOM 600 O PHE A 36 -13.613 -5.867 -6.313 1.00 0.00 O ATOM 601 CB PHE A 36 -11.084 -5.457 -7.270 1.00 0.00 C ATOM 602 CG PHE A 36 -9.908 -6.050 -7.999 1.00 0.00 C ATOM 603 CD1 PHE A 36 -9.874 -7.405 -8.292 1.00 0.00 C ATOM 604 CD2 PHE A 36 -8.839 -5.259 -8.388 1.00 0.00 C ATOM 605 CE1 PHE A 36 -8.798 -7.957 -8.960 1.00 0.00 C ATOM 606 CE2 PHE A 36 -7.760 -5.806 -9.056 1.00 0.00 C ATOM 607 CZ PHE A 36 -7.739 -7.157 -9.341 1.00 0.00 C ATOM 0 H PHE A 36 -12.452 -3.059 -8.212 1.00 0.00 H new ATOM 0 HA PHE A 36 -12.326 -5.890 -8.970 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -10.767 -4.538 -6.777 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -11.398 -6.147 -6.487 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -10.698 -8.036 -7.995 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -8.849 -4.202 -8.166 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -8.785 -9.013 -9.184 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -6.934 -5.178 -9.355 1.00 0.00 H new ATOM 0 HZ PHE A 36 -6.896 -7.587 -9.861 1.00 0.00 H new ATOM 617 N LYS A 37 -14.651 -4.633 -7.886 1.00 0.00 N ATOM 618 CA LYS A 37 -15.963 -4.680 -7.228 1.00 0.00 C ATOM 619 C LYS A 37 -16.456 -6.120 -7.023 1.00 0.00 C ATOM 620 O LYS A 37 -17.427 -6.358 -6.301 1.00 0.00 O ATOM 621 CB LYS A 37 -16.999 -3.905 -8.052 1.00 0.00 C ATOM 622 CG LYS A 37 -17.297 -4.529 -9.408 1.00 0.00 C ATOM 623 CD LYS A 37 -18.416 -3.792 -10.126 1.00 0.00 C ATOM 624 CE LYS A 37 -18.818 -4.496 -11.416 1.00 0.00 C ATOM 625 NZ LYS A 37 -17.702 -4.547 -12.398 1.00 0.00 N ATOM 0 H LYS A 37 -14.639 -4.108 -8.760 1.00 0.00 H new ATOM 0 HA LYS A 37 -15.844 -4.219 -6.247 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -17.926 -3.837 -7.482 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -16.642 -2.886 -8.202 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -16.397 -4.514 -10.023 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -17.575 -5.575 -9.275 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.282 -3.715 -9.468 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -18.096 -2.775 -10.351 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -19.146 -5.510 -11.188 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -19.668 -3.979 -11.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -18.051 -4.926 -13.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -17.327 -3.589 -12.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -16.947 -5.162 -12.033 1.00 0.00 H new ATOM 639 N GLY A 38 -15.795 -7.075 -7.668 1.00 0.00 N ATOM 640 CA GLY A 38 -16.194 -8.462 -7.555 1.00 0.00 C ATOM 641 C GLY A 38 -15.524 -9.175 -6.394 1.00 0.00 C ATOM 642 O GLY A 38 -16.031 -10.188 -5.911 1.00 0.00 O ATOM 0 H GLY A 38 -14.987 -6.910 -8.269 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -17.276 -8.515 -7.432 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -15.952 -8.981 -8.482 1.00 0.00 H new ATOM 646 N GLN A 39 -14.389 -8.655 -5.944 1.00 0.00 N ATOM 647 CA GLN A 39 -13.641 -9.283 -4.861 1.00 0.00 C ATOM 648 C GLN A 39 -13.567 -8.378 -3.639 1.00 0.00 C ATOM 649 O GLN A 39 -12.852 -7.379 -3.644 1.00 0.00 O ATOM 650 CB GLN A 39 -12.223 -9.647 -5.308 1.00 0.00 C ATOM 651 CG GLN A 39 -12.164 -10.729 -6.373 1.00 0.00 C ATOM 652 CD GLN A 39 -10.747 -11.201 -6.640 1.00 0.00 C ATOM 653 OE1 GLN A 39 -10.413 -11.606 -7.750 1.00 0.00 O ATOM 654 NE2 GLN A 39 -9.905 -11.158 -5.616 1.00 0.00 N ATOM 0 H GLN A 39 -13.967 -7.802 -6.311 1.00 0.00 H new ATOM 0 HA GLN A 39 -14.176 -10.194 -4.593 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -11.733 -8.751 -5.689 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -11.654 -9.977 -4.439 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -12.774 -11.577 -6.060 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -12.598 -10.349 -7.298 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -10.222 -10.815 -4.709 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -8.941 -11.468 -5.735 1.00 0.00 H new ATOM 663 N PRO A 40 -14.309 -8.712 -2.575 1.00 0.00 N ATOM 664 CA PRO A 40 -14.240 -7.986 -1.308 1.00 0.00 C ATOM 665 C PRO A 40 -12.959 -8.319 -0.547 1.00 0.00 C ATOM 666 O PRO A 40 -12.445 -7.505 0.221 1.00 0.00 O ATOM 667 CB PRO A 40 -15.469 -8.480 -0.526 1.00 0.00 C ATOM 668 CG PRO A 40 -16.261 -9.309 -1.487 1.00 0.00 C ATOM 669 CD PRO A 40 -15.288 -9.802 -2.519 1.00 0.00 C ATOM 0 HA PRO A 40 -14.233 -6.906 -1.454 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -15.169 -9.068 0.342 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -16.059 -7.642 -0.155 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -16.742 -10.143 -0.976 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -17.052 -8.719 -1.949 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -14.829 -10.746 -2.226 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -15.768 -9.967 -3.484 1.00 0.00 H new ATOM 677 N ILE A 41 -12.455 -9.528 -0.773 1.00 0.00 N ATOM 678 CA ILE A 41 -11.260 -10.011 -0.093 1.00 0.00 C ATOM 679 C ILE A 41 -10.201 -10.382 -1.129 1.00 0.00 C ATOM 680 O ILE A 41 -10.537 -10.770 -2.252 1.00 0.00 O ATOM 681 CB ILE A 41 -11.567 -11.255 0.782 1.00 0.00 C ATOM 682 CG1 ILE A 41 -12.876 -11.077 1.564 1.00 0.00 C ATOM 683 CG2 ILE A 41 -10.419 -11.529 1.745 1.00 0.00 C ATOM 684 CD1 ILE A 41 -12.892 -9.872 2.479 1.00 0.00 C ATOM 0 H ILE A 41 -12.861 -10.196 -1.428 1.00 0.00 H new ATOM 0 HA ILE A 41 -10.897 -9.214 0.556 1.00 0.00 H new ATOM 0 HB ILE A 41 -11.681 -12.109 0.114 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -13.701 -10.993 0.856 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -13.056 -11.973 2.158 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.653 -12.405 2.350 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -9.505 -11.712 1.179 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -10.276 -10.666 2.396 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -13.851 -9.819 2.994 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -12.091 -9.962 3.213 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -12.745 -8.966 1.890 1.00 0.00 H new ATOM 696 N PHE A 42 -8.931 -10.265 -0.767 1.00 0.00 N ATOM 697 CA PHE A 42 -7.852 -10.576 -1.693 1.00 0.00 C ATOM 698 C PHE A 42 -6.938 -11.662 -1.135 1.00 0.00 C ATOM 699 O PHE A 42 -7.254 -12.310 -0.136 1.00 0.00 O ATOM 700 CB PHE A 42 -7.030 -9.326 -2.006 1.00 0.00 C ATOM 701 CG PHE A 42 -7.774 -8.280 -2.781 1.00 0.00 C ATOM 702 CD1 PHE A 42 -8.158 -8.515 -4.090 1.00 0.00 C ATOM 703 CD2 PHE A 42 -8.072 -7.056 -2.209 1.00 0.00 C ATOM 704 CE1 PHE A 42 -8.831 -7.551 -4.813 1.00 0.00 C ATOM 705 CE2 PHE A 42 -8.745 -6.089 -2.924 1.00 0.00 C ATOM 706 CZ PHE A 42 -9.124 -6.334 -4.229 1.00 0.00 C ATOM 0 H PHE A 42 -8.624 -9.959 0.156 1.00 0.00 H new ATOM 0 HA PHE A 42 -8.308 -10.944 -2.612 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -6.682 -8.890 -1.070 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.144 -9.619 -2.570 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -7.928 -9.464 -4.551 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -7.774 -6.856 -1.190 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.128 -7.748 -5.833 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -8.976 -5.140 -2.464 1.00 0.00 H new ATOM 0 HZ PHE A 42 -9.648 -5.576 -4.792 1.00 0.00 H new ATOM 716 N ASP A 43 -5.816 -11.861 -1.811 1.00 0.00 N ATOM 717 CA ASP A 43 -4.809 -12.829 -1.397 1.00 0.00 C ATOM 718 C ASP A 43 -3.470 -12.115 -1.206 1.00 0.00 C ATOM 719 O ASP A 43 -3.302 -10.991 -1.678 1.00 0.00 O ATOM 720 CB ASP A 43 -4.689 -13.931 -2.457 1.00 0.00 C ATOM 721 CG ASP A 43 -3.602 -14.938 -2.148 1.00 0.00 C ATOM 722 OD1 ASP A 43 -3.828 -15.824 -1.299 1.00 0.00 O ATOM 723 OD2 ASP A 43 -2.514 -14.841 -2.749 1.00 0.00 O ATOM 0 H ASP A 43 -5.577 -11.355 -2.664 1.00 0.00 H new ATOM 0 HA ASP A 43 -5.101 -13.288 -0.452 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -5.643 -14.451 -2.542 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -4.488 -13.474 -3.426 1.00 0.00 H new ATOM 728 N HIS A 44 -2.529 -12.760 -0.521 1.00 0.00 N ATOM 729 CA HIS A 44 -1.214 -12.173 -0.260 1.00 0.00 C ATOM 730 C HIS A 44 -0.455 -11.879 -1.557 1.00 0.00 C ATOM 731 O HIS A 44 0.428 -11.017 -1.588 1.00 0.00 O ATOM 732 CB HIS A 44 -0.381 -13.083 0.650 1.00 0.00 C ATOM 733 CG HIS A 44 -0.857 -13.103 2.074 1.00 0.00 C ATOM 734 ND1 HIS A 44 -0.619 -14.149 2.938 1.00 0.00 N ATOM 735 CD2 HIS A 44 -1.550 -12.182 2.788 1.00 0.00 C ATOM 736 CE1 HIS A 44 -1.143 -13.871 4.116 1.00 0.00 C ATOM 737 NE2 HIS A 44 -1.716 -12.684 4.054 1.00 0.00 N ATOM 0 H HIS A 44 -2.653 -13.695 -0.134 1.00 0.00 H new ATOM 0 HA HIS A 44 -1.380 -11.224 0.250 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -0.403 -14.098 0.254 1.00 0.00 H new ATOM 0 HB3 HIS A 44 0.658 -12.754 0.627 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -1.906 -11.229 2.427 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -1.109 -14.509 4.987 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -2.202 -12.217 4.820 1.00 0.00 H new ATOM 746 N ALA A 45 -0.802 -12.583 -2.630 1.00 0.00 N ATOM 747 CA ALA A 45 -0.240 -12.279 -3.941 1.00 0.00 C ATOM 748 C ALA A 45 -0.652 -10.878 -4.378 1.00 0.00 C ATOM 749 O ALA A 45 0.105 -10.168 -5.042 1.00 0.00 O ATOM 750 CB ALA A 45 -0.682 -13.308 -4.967 1.00 0.00 C ATOM 0 H ALA A 45 -1.463 -13.360 -2.619 1.00 0.00 H new ATOM 0 HA ALA A 45 0.847 -12.317 -3.868 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -0.251 -13.062 -5.938 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -0.343 -14.297 -4.660 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -1.769 -13.304 -5.041 1.00 0.00 H new ATOM 756 N HIS A 46 -1.850 -10.473 -3.972 1.00 0.00 N ATOM 757 CA HIS A 46 -2.347 -9.138 -4.272 1.00 0.00 C ATOM 758 C HIS A 46 -1.780 -8.134 -3.279 1.00 0.00 C ATOM 759 O HIS A 46 -1.826 -6.930 -3.512 1.00 0.00 O ATOM 760 CB HIS A 46 -3.878 -9.089 -4.259 1.00 0.00 C ATOM 761 CG HIS A 46 -4.521 -9.782 -5.422 1.00 0.00 C ATOM 762 ND1 HIS A 46 -4.741 -9.170 -6.637 1.00 0.00 N ATOM 763 CD2 HIS A 46 -5.010 -11.037 -5.547 1.00 0.00 C ATOM 764 CE1 HIS A 46 -5.338 -10.014 -7.454 1.00 0.00 C ATOM 765 NE2 HIS A 46 -5.511 -11.156 -6.817 1.00 0.00 N ATOM 0 H HIS A 46 -2.495 -11.052 -3.434 1.00 0.00 H new ATOM 0 HA HIS A 46 -2.016 -8.877 -5.277 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -4.238 -9.542 -3.335 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -4.198 -8.047 -4.248 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -4.482 -8.211 -6.868 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -5.006 -11.804 -4.786 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.635 -9.806 -8.471 1.00 0.00 H new ATOM 774 N THR A 47 -1.253 -8.634 -2.166 1.00 0.00 N ATOM 775 CA THR A 47 -0.529 -7.789 -1.229 1.00 0.00 C ATOM 776 C THR A 47 0.673 -7.182 -1.929 1.00 0.00 C ATOM 777 O THR A 47 0.785 -5.964 -2.034 1.00 0.00 O ATOM 778 CB THR A 47 -0.053 -8.570 0.011 1.00 0.00 C ATOM 779 OG1 THR A 47 -1.188 -9.043 0.755 1.00 0.00 O ATOM 780 CG2 THR A 47 0.827 -7.699 0.901 1.00 0.00 C ATOM 0 H THR A 47 -1.314 -9.615 -1.894 1.00 0.00 H new ATOM 0 HA THR A 47 -1.212 -7.010 -0.889 1.00 0.00 H new ATOM 0 HB THR A 47 0.539 -9.421 -0.326 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.880 -9.540 1.541 1.00 0.00 H new ATOM 0 HG21 THR A 47 1.149 -8.274 1.769 1.00 0.00 H new ATOM 0 HG22 THR A 47 1.701 -7.370 0.339 1.00 0.00 H new ATOM 0 HG23 THR A 47 0.261 -6.829 1.233 1.00 0.00 H new ATOM 788 N ARG A 48 1.555 -8.042 -2.432 1.00 0.00 N ATOM 789 CA ARG A 48 2.724 -7.581 -3.174 1.00 0.00 C ATOM 790 C ARG A 48 2.291 -6.745 -4.371 1.00 0.00 C ATOM 791 O ARG A 48 2.913 -5.737 -4.687 1.00 0.00 O ATOM 792 CB ARG A 48 3.580 -8.757 -3.646 1.00 0.00 C ATOM 793 CG ARG A 48 4.836 -8.322 -4.385 1.00 0.00 C ATOM 794 CD ARG A 48 5.688 -9.507 -4.800 1.00 0.00 C ATOM 795 NE ARG A 48 6.897 -9.087 -5.505 1.00 0.00 N ATOM 796 CZ ARG A 48 8.130 -9.389 -5.104 1.00 0.00 C ATOM 797 NH1 ARG A 48 8.311 -10.100 -3.998 1.00 0.00 N ATOM 798 NH2 ARG A 48 9.182 -8.971 -5.798 1.00 0.00 N ATOM 0 H ARG A 48 1.483 -9.055 -2.340 1.00 0.00 H new ATOM 0 HA ARG A 48 3.326 -6.968 -2.503 1.00 0.00 H new ATOM 0 HB2 ARG A 48 3.864 -9.361 -2.784 1.00 0.00 H new ATOM 0 HB3 ARG A 48 2.983 -9.394 -4.299 1.00 0.00 H new ATOM 0 HG2 ARG A 48 4.557 -7.749 -5.269 1.00 0.00 H new ATOM 0 HG3 ARG A 48 5.421 -7.660 -3.747 1.00 0.00 H new ATOM 0 HD2 ARG A 48 5.964 -10.083 -3.917 1.00 0.00 H new ATOM 0 HD3 ARG A 48 5.104 -10.167 -5.441 1.00 0.00 H new ATOM 0 HE ARG A 48 6.790 -8.530 -6.353 1.00 0.00 H new ATOM 0 HH11 ARG A 48 7.506 -10.414 -3.456 1.00 0.00 H new ATOM 0 HH12 ARG A 48 9.255 -10.332 -3.690 1.00 0.00 H new ATOM 0 HH21 ARG A 48 9.048 -8.416 -6.643 1.00 0.00 H new ATOM 0 HH22 ARG A 48 10.124 -9.205 -5.486 1.00 0.00 H new ATOM 812 N GLU A 49 1.215 -7.173 -5.020 1.00 0.00 N ATOM 813 CA GLU A 49 0.638 -6.445 -6.144 1.00 0.00 C ATOM 814 C GLU A 49 0.357 -4.990 -5.758 1.00 0.00 C ATOM 815 O GLU A 49 0.848 -4.061 -6.399 1.00 0.00 O ATOM 816 CB GLU A 49 -0.651 -7.143 -6.586 1.00 0.00 C ATOM 817 CG GLU A 49 -1.380 -6.465 -7.733 1.00 0.00 C ATOM 818 CD GLU A 49 -2.679 -7.167 -8.071 1.00 0.00 C ATOM 819 OE1 GLU A 49 -3.689 -6.924 -7.378 1.00 0.00 O ATOM 820 OE2 GLU A 49 -2.692 -7.981 -9.016 1.00 0.00 O ATOM 0 H GLU A 49 0.719 -8.032 -4.783 1.00 0.00 H new ATOM 0 HA GLU A 49 1.348 -6.439 -6.971 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -0.412 -8.165 -6.879 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -1.325 -7.206 -5.732 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.586 -5.428 -7.469 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -0.737 -6.449 -8.613 1.00 0.00 H new ATOM 827 N PHE A 50 -0.408 -4.804 -4.690 1.00 0.00 N ATOM 828 CA PHE A 50 -0.771 -3.471 -4.219 1.00 0.00 C ATOM 829 C PHE A 50 0.433 -2.723 -3.656 1.00 0.00 C ATOM 830 O PHE A 50 0.636 -1.543 -3.958 1.00 0.00 O ATOM 831 CB PHE A 50 -1.872 -3.566 -3.158 1.00 0.00 C ATOM 832 CG PHE A 50 -3.256 -3.650 -3.736 1.00 0.00 C ATOM 833 CD1 PHE A 50 -3.536 -4.494 -4.799 1.00 0.00 C ATOM 834 CD2 PHE A 50 -4.277 -2.870 -3.219 1.00 0.00 C ATOM 835 CE1 PHE A 50 -4.805 -4.555 -5.337 1.00 0.00 C ATOM 836 CE2 PHE A 50 -5.548 -2.930 -3.751 1.00 0.00 C ATOM 837 CZ PHE A 50 -5.812 -3.771 -4.812 1.00 0.00 C ATOM 0 H PHE A 50 -0.792 -5.565 -4.129 1.00 0.00 H new ATOM 0 HA PHE A 50 -1.141 -2.909 -5.076 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -1.692 -4.444 -2.537 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.812 -2.696 -2.505 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.751 -5.111 -5.211 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -4.076 -2.208 -2.390 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -5.010 -5.215 -6.167 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -6.336 -2.319 -3.337 1.00 0.00 H new ATOM 0 HZ PHE A 50 -6.806 -3.816 -5.232 1.00 0.00 H new ATOM 847 N ILE A 51 1.230 -3.410 -2.847 1.00 0.00 N ATOM 848 CA ILE A 51 2.380 -2.790 -2.203 1.00 0.00 C ATOM 849 C ILE A 51 3.399 -2.308 -3.238 1.00 0.00 C ATOM 850 O ILE A 51 3.837 -1.156 -3.202 1.00 0.00 O ATOM 851 CB ILE A 51 3.062 -3.749 -1.196 1.00 0.00 C ATOM 852 CG1 ILE A 51 2.090 -4.105 -0.063 1.00 0.00 C ATOM 853 CG2 ILE A 51 4.331 -3.127 -0.628 1.00 0.00 C ATOM 854 CD1 ILE A 51 1.547 -2.900 0.679 1.00 0.00 C ATOM 0 H ILE A 51 1.101 -4.396 -2.622 1.00 0.00 H new ATOM 0 HA ILE A 51 2.006 -1.928 -1.650 1.00 0.00 H new ATOM 0 HB ILE A 51 3.338 -4.661 -1.725 1.00 0.00 H new ATOM 0 HG12 ILE A 51 1.256 -4.671 -0.477 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.598 -4.758 0.647 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.792 -3.819 0.077 1.00 0.00 H new ATOM 0 HG22 ILE A 51 5.028 -2.917 -1.439 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.083 -2.198 -0.114 1.00 0.00 H new ATOM 0 HD11 ILE A 51 0.868 -3.232 1.464 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.372 -2.344 1.124 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.010 -2.256 -0.017 1.00 0.00 H new ATOM 866 N GLN A 52 3.739 -3.180 -4.184 1.00 0.00 N ATOM 867 CA GLN A 52 4.731 -2.862 -5.207 1.00 0.00 C ATOM 868 C GLN A 52 4.233 -1.742 -6.117 1.00 0.00 C ATOM 869 O GLN A 52 5.015 -0.898 -6.551 1.00 0.00 O ATOM 870 CB GLN A 52 5.063 -4.108 -6.035 1.00 0.00 C ATOM 871 CG GLN A 52 6.220 -3.917 -7.003 1.00 0.00 C ATOM 872 CD GLN A 52 7.520 -3.578 -6.301 1.00 0.00 C ATOM 873 OE1 GLN A 52 7.749 -3.977 -5.161 1.00 0.00 O ATOM 874 NE2 GLN A 52 8.381 -2.842 -6.980 1.00 0.00 N ATOM 0 H GLN A 52 3.340 -4.116 -4.263 1.00 0.00 H new ATOM 0 HA GLN A 52 5.637 -2.521 -4.707 1.00 0.00 H new ATOM 0 HB2 GLN A 52 5.301 -4.929 -5.358 1.00 0.00 H new ATOM 0 HB3 GLN A 52 4.178 -4.405 -6.597 1.00 0.00 H new ATOM 0 HG2 GLN A 52 6.354 -4.828 -7.587 1.00 0.00 H new ATOM 0 HG3 GLN A 52 5.973 -3.121 -7.706 1.00 0.00 H new ATOM 0 HE21 GLN A 52 8.153 -2.531 -7.924 1.00 0.00 H new ATOM 0 HE22 GLN A 52 9.274 -2.585 -6.560 1.00 0.00 H new ATOM 883 N SER A 53 2.932 -1.724 -6.388 1.00 0.00 N ATOM 884 CA SER A 53 2.343 -0.685 -7.226 1.00 0.00 C ATOM 885 C SER A 53 2.498 0.692 -6.581 1.00 0.00 C ATOM 886 O SER A 53 2.713 1.690 -7.270 1.00 0.00 O ATOM 887 CB SER A 53 0.865 -0.978 -7.495 1.00 0.00 C ATOM 888 OG SER A 53 0.709 -2.175 -8.240 1.00 0.00 O ATOM 0 H SER A 53 2.267 -2.415 -6.041 1.00 0.00 H new ATOM 0 HA SER A 53 2.876 -0.682 -8.177 1.00 0.00 H new ATOM 0 HB2 SER A 53 0.330 -1.062 -6.549 1.00 0.00 H new ATOM 0 HB3 SER A 53 0.419 -0.146 -8.040 1.00 0.00 H new ATOM 0 HG SER A 53 0.860 -2.947 -7.655 1.00 0.00 H new ATOM 894 N PHE A 54 2.407 0.746 -5.256 1.00 0.00 N ATOM 895 CA PHE A 54 2.573 2.008 -4.551 1.00 0.00 C ATOM 896 C PHE A 54 4.039 2.429 -4.586 1.00 0.00 C ATOM 897 O PHE A 54 4.353 3.615 -4.693 1.00 0.00 O ATOM 898 CB PHE A 54 2.080 1.900 -3.105 1.00 0.00 C ATOM 899 CG PHE A 54 1.783 3.235 -2.476 1.00 0.00 C ATOM 900 CD1 PHE A 54 2.797 4.008 -1.932 1.00 0.00 C ATOM 901 CD2 PHE A 54 0.486 3.721 -2.439 1.00 0.00 C ATOM 902 CE1 PHE A 54 2.523 5.236 -1.360 1.00 0.00 C ATOM 903 CE2 PHE A 54 0.205 4.948 -1.869 1.00 0.00 C ATOM 904 CZ PHE A 54 1.225 5.707 -1.331 1.00 0.00 C ATOM 0 H PHE A 54 2.222 -0.059 -4.657 1.00 0.00 H new ATOM 0 HA PHE A 54 1.971 2.767 -5.052 1.00 0.00 H new ATOM 0 HB2 PHE A 54 1.180 1.286 -3.080 1.00 0.00 H new ATOM 0 HB3 PHE A 54 2.833 1.385 -2.509 1.00 0.00 H new ATOM 0 HD1 PHE A 54 3.814 3.646 -1.955 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -0.316 3.133 -2.861 1.00 0.00 H new ATOM 0 HE1 PHE A 54 3.322 5.826 -0.937 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -0.811 5.313 -1.844 1.00 0.00 H new ATOM 0 HZ PHE A 54 1.008 6.668 -0.888 1.00 0.00 H new ATOM 914 N ILE A 55 4.933 1.449 -4.517 1.00 0.00 N ATOM 915 CA ILE A 55 6.364 1.708 -4.622 1.00 0.00 C ATOM 916 C ILE A 55 6.714 2.170 -6.036 1.00 0.00 C ATOM 917 O ILE A 55 7.568 3.033 -6.230 1.00 0.00 O ATOM 918 CB ILE A 55 7.194 0.452 -4.266 1.00 0.00 C ATOM 919 CG1 ILE A 55 6.869 -0.016 -2.844 1.00 0.00 C ATOM 920 CG2 ILE A 55 8.686 0.734 -4.403 1.00 0.00 C ATOM 921 CD1 ILE A 55 7.577 -1.293 -2.441 1.00 0.00 C ATOM 0 H ILE A 55 4.691 0.466 -4.389 1.00 0.00 H new ATOM 0 HA ILE A 55 6.611 2.494 -3.909 1.00 0.00 H new ATOM 0 HB ILE A 55 6.930 -0.342 -4.965 1.00 0.00 H new ATOM 0 HG12 ILE A 55 7.137 0.774 -2.142 1.00 0.00 H new ATOM 0 HG13 ILE A 55 5.793 -0.166 -2.759 1.00 0.00 H new ATOM 0 HG21 ILE A 55 9.251 -0.163 -4.148 1.00 0.00 H new ATOM 0 HG22 ILE A 55 8.909 1.023 -5.430 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.967 1.543 -3.729 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.296 -1.559 -1.422 1.00 0.00 H new ATOM 0 HD12 ILE A 55 7.290 -2.097 -3.118 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.655 -1.143 -2.492 1.00 0.00 H new ATOM 933 N GLU A 56 6.032 1.603 -7.025 1.00 0.00 N ATOM 934 CA GLU A 56 6.227 1.997 -8.414 1.00 0.00 C ATOM 935 C GLU A 56 5.687 3.408 -8.649 1.00 0.00 C ATOM 936 O GLU A 56 6.115 4.103 -9.569 1.00 0.00 O ATOM 937 CB GLU A 56 5.544 1.003 -9.354 1.00 0.00 C ATOM 938 CG GLU A 56 5.830 1.261 -10.823 1.00 0.00 C ATOM 939 CD GLU A 56 5.157 0.264 -11.735 1.00 0.00 C ATOM 940 OE1 GLU A 56 5.757 -0.796 -12.012 1.00 0.00 O ATOM 941 OE2 GLU A 56 4.031 0.537 -12.191 1.00 0.00 O ATOM 0 H GLU A 56 5.338 0.868 -6.889 1.00 0.00 H new ATOM 0 HA GLU A 56 7.296 1.994 -8.626 1.00 0.00 H new ATOM 0 HB2 GLU A 56 5.869 -0.006 -9.101 1.00 0.00 H new ATOM 0 HB3 GLU A 56 4.467 1.041 -9.190 1.00 0.00 H new ATOM 0 HG2 GLU A 56 5.497 2.266 -11.082 1.00 0.00 H new ATOM 0 HG3 GLU A 56 6.907 1.229 -10.990 1.00 0.00 H new ATOM 948 N ARG A 57 4.759 3.834 -7.792 1.00 0.00 N ATOM 949 CA ARG A 57 4.195 5.179 -7.879 1.00 0.00 C ATOM 950 C ARG A 57 5.269 6.232 -7.582 1.00 0.00 C ATOM 951 O ARG A 57 5.066 7.426 -7.807 1.00 0.00 O ATOM 952 CB ARG A 57 3.013 5.334 -6.917 1.00 0.00 C ATOM 953 CG ARG A 57 2.194 6.593 -7.156 1.00 0.00 C ATOM 954 CD ARG A 57 1.050 6.727 -6.161 1.00 0.00 C ATOM 955 NE ARG A 57 0.164 5.559 -6.166 1.00 0.00 N ATOM 956 CZ ARG A 57 -0.820 5.367 -7.050 1.00 0.00 C ATOM 957 NH1 ARG A 57 -1.023 6.237 -8.030 1.00 0.00 N ATOM 958 NH2 ARG A 57 -1.600 4.297 -6.956 1.00 0.00 N ATOM 0 H ARG A 57 4.383 3.268 -7.031 1.00 0.00 H new ATOM 0 HA ARG A 57 3.832 5.332 -8.895 1.00 0.00 H new ATOM 0 HB2 ARG A 57 2.363 4.464 -7.011 1.00 0.00 H new ATOM 0 HB3 ARG A 57 3.387 5.343 -5.893 1.00 0.00 H new ATOM 0 HG2 ARG A 57 2.842 7.466 -7.083 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.793 6.578 -8.169 1.00 0.00 H new ATOM 0 HD2 ARG A 57 1.458 6.866 -5.160 1.00 0.00 H new ATOM 0 HD3 ARG A 57 0.471 7.620 -6.396 1.00 0.00 H new ATOM 0 HE ARG A 57 0.308 4.848 -5.449 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -0.426 7.060 -8.113 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -1.776 6.083 -8.701 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -1.449 3.620 -6.208 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -2.350 4.152 -7.631 1.00 0.00 H new ATOM 972 N ASP A 58 6.406 5.778 -7.064 1.00 0.00 N ATOM 973 CA ASP A 58 7.583 6.630 -6.914 1.00 0.00 C ATOM 974 C ASP A 58 7.984 7.205 -8.264 1.00 0.00 C ATOM 975 O ASP A 58 8.211 8.407 -8.398 1.00 0.00 O ATOM 976 CB ASP A 58 8.744 5.827 -6.315 1.00 0.00 C ATOM 977 CG ASP A 58 10.109 6.276 -6.810 1.00 0.00 C ATOM 978 OD1 ASP A 58 10.712 7.159 -6.176 1.00 0.00 O ATOM 979 OD2 ASP A 58 10.587 5.720 -7.830 1.00 0.00 O ATOM 0 H ASP A 58 6.538 4.820 -6.739 1.00 0.00 H new ATOM 0 HA ASP A 58 7.341 7.451 -6.239 1.00 0.00 H new ATOM 0 HB2 ASP A 58 8.713 5.914 -5.229 1.00 0.00 H new ATOM 0 HB3 ASP A 58 8.608 4.772 -6.555 1.00 0.00 H new ATOM 984 N ASP A 59 8.014 6.340 -9.273 1.00 0.00 N ATOM 985 CA ASP A 59 8.437 6.732 -10.609 1.00 0.00 C ATOM 986 C ASP A 59 7.418 7.680 -11.223 1.00 0.00 C ATOM 987 O ASP A 59 7.733 8.447 -12.127 1.00 0.00 O ATOM 988 CB ASP A 59 8.620 5.500 -11.499 1.00 0.00 C ATOM 989 CG ASP A 59 9.532 5.766 -12.681 1.00 0.00 C ATOM 990 OD1 ASP A 59 9.037 6.169 -13.752 1.00 0.00 O ATOM 991 OD2 ASP A 59 10.758 5.554 -12.542 1.00 0.00 O ATOM 0 H ASP A 59 7.749 5.359 -9.188 1.00 0.00 H new ATOM 0 HA ASP A 59 9.395 7.246 -10.533 1.00 0.00 H new ATOM 0 HB2 ASP A 59 9.031 4.684 -10.904 1.00 0.00 H new ATOM 0 HB3 ASP A 59 7.647 5.171 -11.862 1.00 0.00 H new ATOM 996 N THR A 60 6.193 7.631 -10.712 1.00 0.00 N ATOM 997 CA THR A 60 5.149 8.542 -11.145 1.00 0.00 C ATOM 998 C THR A 60 5.498 9.977 -10.749 1.00 0.00 C ATOM 999 O THR A 60 5.432 10.893 -11.567 1.00 0.00 O ATOM 1000 CB THR A 60 3.783 8.155 -10.539 1.00 0.00 C ATOM 1001 OG1 THR A 60 3.543 6.749 -10.720 1.00 0.00 O ATOM 1002 CG2 THR A 60 2.656 8.950 -11.181 1.00 0.00 C ATOM 0 H THR A 60 5.901 6.966 -9.995 1.00 0.00 H new ATOM 0 HA THR A 60 5.078 8.473 -12.230 1.00 0.00 H new ATOM 0 HB THR A 60 3.809 8.387 -9.474 1.00 0.00 H new ATOM 0 HG1 THR A 60 2.675 6.513 -10.331 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.705 8.658 -10.736 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.822 10.015 -11.016 1.00 0.00 H new ATOM 0 HG23 THR A 60 2.632 8.748 -12.252 1.00 0.00 H new ATOM 1010 N GLU A 61 5.898 10.157 -9.497 1.00 0.00 N ATOM 1011 CA GLU A 61 6.291 11.475 -9.008 1.00 0.00 C ATOM 1012 C GLU A 61 7.660 11.850 -9.559 1.00 0.00 C ATOM 1013 O GLU A 61 7.938 13.022 -9.829 1.00 0.00 O ATOM 1014 CB GLU A 61 6.315 11.514 -7.479 1.00 0.00 C ATOM 1015 CG GLU A 61 4.977 11.203 -6.833 1.00 0.00 C ATOM 1016 CD GLU A 61 4.949 11.560 -5.361 1.00 0.00 C ATOM 1017 OE1 GLU A 61 5.687 10.931 -4.574 1.00 0.00 O ATOM 1018 OE2 GLU A 61 4.187 12.479 -4.985 1.00 0.00 O ATOM 0 H GLU A 61 5.959 9.412 -8.803 1.00 0.00 H new ATOM 0 HA GLU A 61 5.552 12.197 -9.354 1.00 0.00 H new ATOM 0 HB2 GLU A 61 7.056 10.800 -7.119 1.00 0.00 H new ATOM 0 HB3 GLU A 61 6.642 12.502 -7.156 1.00 0.00 H new ATOM 0 HG2 GLU A 61 4.190 11.751 -7.352 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.758 10.142 -6.951 1.00 0.00 H new ATOM 1025 N LEU A 62 8.508 10.843 -9.724 1.00 0.00 N ATOM 1026 CA LEU A 62 9.826 11.028 -10.310 1.00 0.00 C ATOM 1027 C LEU A 62 9.704 11.454 -11.770 1.00 0.00 C ATOM 1028 O LEU A 62 10.540 12.198 -12.284 1.00 0.00 O ATOM 1029 CB LEU A 62 10.634 9.730 -10.206 1.00 0.00 C ATOM 1030 CG LEU A 62 12.076 9.803 -10.711 1.00 0.00 C ATOM 1031 CD1 LEU A 62 12.884 10.790 -9.885 1.00 0.00 C ATOM 1032 CD2 LEU A 62 12.717 8.425 -10.677 1.00 0.00 C ATOM 0 H LEU A 62 8.302 9.881 -9.457 1.00 0.00 H new ATOM 0 HA LEU A 62 10.345 11.814 -9.761 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.650 9.416 -9.162 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.112 8.953 -10.765 1.00 0.00 H new ATOM 0 HG LEU A 62 12.064 10.154 -11.743 1.00 0.00 H new ATOM 0 HD11 LEU A 62 13.907 10.827 -10.260 1.00 0.00 H new ATOM 0 HD12 LEU A 62 12.434 11.780 -9.959 1.00 0.00 H new ATOM 0 HD13 LEU A 62 12.891 10.472 -8.843 1.00 0.00 H new ATOM 0 HD21 LEU A 62 13.743 8.492 -11.039 1.00 0.00 H new ATOM 0 HD22 LEU A 62 12.717 8.049 -9.654 1.00 0.00 H new ATOM 0 HD23 LEU A 62 12.151 7.745 -11.314 1.00 0.00 H new ATOM 1044 N ASP A 63 8.648 10.987 -12.430 1.00 0.00 N ATOM 1045 CA ASP A 63 8.414 11.321 -13.829 1.00 0.00 C ATOM 1046 C ASP A 63 8.150 12.807 -13.982 1.00 0.00 C ATOM 1047 O ASP A 63 8.586 13.426 -14.953 1.00 0.00 O ATOM 1048 CB ASP A 63 7.245 10.521 -14.403 1.00 0.00 C ATOM 1049 CG ASP A 63 7.156 10.656 -15.910 1.00 0.00 C ATOM 1050 OD1 ASP A 63 7.986 10.038 -16.611 1.00 0.00 O ATOM 1051 OD2 ASP A 63 6.278 11.394 -16.399 1.00 0.00 O ATOM 0 H ASP A 63 7.942 10.377 -12.018 1.00 0.00 H new ATOM 0 HA ASP A 63 9.313 11.059 -14.387 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.359 9.470 -14.138 1.00 0.00 H new ATOM 0 HB3 ASP A 63 6.314 10.864 -13.952 1.00 0.00 H new ATOM 1056 N GLU A 64 7.453 13.379 -13.008 1.00 0.00 N ATOM 1057 CA GLU A 64 7.208 14.812 -12.990 1.00 0.00 C ATOM 1058 C GLU A 64 8.524 15.571 -12.891 1.00 0.00 C ATOM 1059 O GLU A 64 8.717 16.583 -13.556 1.00 0.00 O ATOM 1060 CB GLU A 64 6.306 15.200 -11.819 1.00 0.00 C ATOM 1061 CG GLU A 64 4.936 14.549 -11.856 1.00 0.00 C ATOM 1062 CD GLU A 64 4.016 15.103 -10.792 1.00 0.00 C ATOM 1063 OE1 GLU A 64 4.021 14.582 -9.660 1.00 0.00 O ATOM 1064 OE2 GLU A 64 3.298 16.083 -11.078 1.00 0.00 O ATOM 0 H GLU A 64 7.048 12.871 -12.221 1.00 0.00 H new ATOM 0 HA GLU A 64 6.705 15.077 -13.920 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.801 14.929 -10.887 1.00 0.00 H new ATOM 0 HB3 GLU A 64 6.183 16.283 -11.811 1.00 0.00 H new ATOM 0 HG2 GLU A 64 4.488 14.702 -12.838 1.00 0.00 H new ATOM 0 HG3 GLU A 64 5.042 13.473 -11.719 1.00 0.00 H new ATOM 1071 N LEU A 65 9.433 15.068 -12.067 1.00 0.00 N ATOM 1072 CA LEU A 65 10.736 15.698 -11.894 1.00 0.00 C ATOM 1073 C LEU A 65 11.566 15.578 -13.165 1.00 0.00 C ATOM 1074 O LEU A 65 12.290 16.503 -13.527 1.00 0.00 O ATOM 1075 CB LEU A 65 11.481 15.079 -10.710 1.00 0.00 C ATOM 1076 CG LEU A 65 10.819 15.295 -9.346 1.00 0.00 C ATOM 1077 CD1 LEU A 65 11.658 14.671 -8.249 1.00 0.00 C ATOM 1078 CD2 LEU A 65 10.608 16.778 -9.078 1.00 0.00 C ATOM 0 H LEU A 65 9.293 14.226 -11.508 1.00 0.00 H new ATOM 0 HA LEU A 65 10.576 16.756 -11.687 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.581 14.008 -10.883 1.00 0.00 H new ATOM 0 HB3 LEU A 65 12.489 15.492 -10.678 1.00 0.00 H new ATOM 0 HG LEU A 65 9.843 14.809 -9.357 1.00 0.00 H new ATOM 0 HD11 LEU A 65 11.175 14.832 -7.285 1.00 0.00 H new ATOM 0 HD12 LEU A 65 11.757 13.601 -8.431 1.00 0.00 H new ATOM 0 HD13 LEU A 65 12.646 15.130 -8.241 1.00 0.00 H new ATOM 0 HD21 LEU A 65 10.137 16.908 -8.104 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.570 17.290 -9.087 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.966 17.200 -9.851 1.00 0.00 H new ATOM 1267 N PRO A 75 17.412 19.303 -10.738 1.00 0.00 N ATOM 1268 CA PRO A 75 17.472 19.511 -9.297 1.00 0.00 C ATOM 1269 C PRO A 75 17.964 18.265 -8.579 1.00 0.00 C ATOM 1270 O PRO A 75 17.162 17.451 -8.131 1.00 0.00 O ATOM 1271 CB PRO A 75 16.021 19.797 -8.896 1.00 0.00 C ATOM 1272 CG PRO A 75 15.284 20.012 -10.177 1.00 0.00 C ATOM 1273 CD PRO A 75 16.027 19.231 -11.220 1.00 0.00 C ATOM 0 HA PRO A 75 18.160 20.314 -9.033 1.00 0.00 H new ATOM 0 HB2 PRO A 75 15.598 18.963 -8.336 1.00 0.00 H new ATOM 0 HB3 PRO A 75 15.958 20.676 -8.255 1.00 0.00 H new ATOM 0 HG2 PRO A 75 14.252 19.670 -10.095 1.00 0.00 H new ATOM 0 HG3 PRO A 75 15.249 21.071 -10.434 1.00 0.00 H new ATOM 0 HD2 PRO A 75 15.673 18.202 -11.287 1.00 0.00 H new ATOM 0 HD3 PRO A 75 15.918 19.671 -12.211 1.00 0.00 H new ATOM 1281 N SER A 76 19.278 18.105 -8.500 1.00 0.00 N ATOM 1282 CA SER A 76 19.871 16.945 -7.848 1.00 0.00 C ATOM 1283 C SER A 76 19.342 16.803 -6.421 1.00 0.00 C ATOM 1284 O SER A 76 18.952 15.719 -5.997 1.00 0.00 O ATOM 1285 CB SER A 76 21.399 17.064 -7.849 1.00 0.00 C ATOM 1286 OG SER A 76 22.012 15.885 -7.358 1.00 0.00 O ATOM 0 H SER A 76 19.955 18.766 -8.880 1.00 0.00 H new ATOM 0 HA SER A 76 19.592 16.050 -8.404 1.00 0.00 H new ATOM 0 HB2 SER A 76 21.749 17.262 -8.862 1.00 0.00 H new ATOM 0 HB3 SER A 76 21.699 17.914 -7.236 1.00 0.00 H new ATOM 0 HG SER A 76 22.986 15.992 -7.373 1.00 0.00 H new ATOM 1292 N ASN A 77 19.265 17.921 -5.710 1.00 0.00 N ATOM 1293 CA ASN A 77 18.833 17.917 -4.314 1.00 0.00 C ATOM 1294 C ASN A 77 17.365 17.507 -4.174 1.00 0.00 C ATOM 1295 O ASN A 77 16.949 17.039 -3.117 1.00 0.00 O ATOM 1296 CB ASN A 77 19.052 19.297 -3.676 1.00 0.00 C ATOM 1297 CG ASN A 77 18.214 20.395 -4.314 1.00 0.00 C ATOM 1298 OD1 ASN A 77 17.901 20.349 -5.506 1.00 0.00 O ATOM 1299 ND2 ASN A 77 17.852 21.395 -3.525 1.00 0.00 N ATOM 0 H ASN A 77 19.496 18.845 -6.076 1.00 0.00 H new ATOM 0 HA ASN A 77 19.441 17.178 -3.791 1.00 0.00 H new ATOM 0 HB2 ASN A 77 18.815 19.240 -2.614 1.00 0.00 H new ATOM 0 HB3 ASN A 77 20.106 19.562 -3.754 1.00 0.00 H new ATOM 0 HD21 ASN A 77 17.294 22.163 -3.898 1.00 0.00 H new ATOM 0 HD22 ASN A 77 18.131 21.397 -2.544 1.00 0.00 H new ATOM 1306 N ARG A 78 16.582 17.683 -5.235 1.00 0.00 N ATOM 1307 CA ARG A 78 15.163 17.337 -5.193 1.00 0.00 C ATOM 1308 C ARG A 78 14.910 15.968 -5.820 1.00 0.00 C ATOM 1309 O ARG A 78 14.188 15.145 -5.259 1.00 0.00 O ATOM 1310 CB ARG A 78 14.312 18.394 -5.908 1.00 0.00 C ATOM 1311 CG ARG A 78 14.540 19.809 -5.406 1.00 0.00 C ATOM 1312 CD ARG A 78 13.412 20.747 -5.821 1.00 0.00 C ATOM 1313 NE ARG A 78 13.106 20.667 -7.251 1.00 0.00 N ATOM 1314 CZ ARG A 78 12.782 21.723 -8.001 1.00 0.00 C ATOM 1315 NH1 ARG A 78 12.837 22.948 -7.489 1.00 0.00 N ATOM 1316 NH2 ARG A 78 12.432 21.559 -9.272 1.00 0.00 N ATOM 0 H ARG A 78 16.902 18.060 -6.127 1.00 0.00 H new ATOM 0 HA ARG A 78 14.872 17.303 -4.143 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.528 18.359 -6.976 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.259 18.141 -5.787 1.00 0.00 H new ATOM 0 HG2 ARG A 78 14.623 19.800 -4.319 1.00 0.00 H new ATOM 0 HG3 ARG A 78 15.486 20.184 -5.795 1.00 0.00 H new ATOM 0 HD2 ARG A 78 12.516 20.507 -5.248 1.00 0.00 H new ATOM 0 HD3 ARG A 78 13.686 21.772 -5.569 1.00 0.00 H new ATOM 0 HE ARG A 78 13.143 19.752 -7.700 1.00 0.00 H new ATOM 0 HH11 ARG A 78 13.127 23.083 -6.521 1.00 0.00 H new ATOM 0 HH12 ARG A 78 12.589 23.753 -8.064 1.00 0.00 H new ATOM 0 HH21 ARG A 78 12.410 20.624 -9.678 1.00 0.00 H new ATOM 0 HH22 ARG A 78 12.185 22.368 -9.842 1.00 0.00 H new ATOM 1330 N GLN A 79 15.508 15.725 -6.980 1.00 0.00 N ATOM 1331 CA GLN A 79 15.278 14.491 -7.720 1.00 0.00 C ATOM 1332 C GLN A 79 15.904 13.301 -6.998 1.00 0.00 C ATOM 1333 O GLN A 79 15.334 12.210 -6.969 1.00 0.00 O ATOM 1334 CB GLN A 79 15.823 14.608 -9.148 1.00 0.00 C ATOM 1335 CG GLN A 79 15.478 13.421 -10.031 1.00 0.00 C ATOM 1336 CD GLN A 79 15.847 13.632 -11.488 1.00 0.00 C ATOM 1337 OE1 GLN A 79 15.841 14.757 -11.993 1.00 0.00 O ATOM 1338 NE2 GLN A 79 16.170 12.549 -12.172 1.00 0.00 N ATOM 0 H GLN A 79 16.158 16.369 -7.430 1.00 0.00 H new ATOM 0 HA GLN A 79 14.202 14.324 -7.778 1.00 0.00 H new ATOM 0 HB2 GLN A 79 15.429 15.516 -9.605 1.00 0.00 H new ATOM 0 HB3 GLN A 79 16.907 14.716 -9.106 1.00 0.00 H new ATOM 0 HG2 GLN A 79 15.993 12.536 -9.657 1.00 0.00 H new ATOM 0 HG3 GLN A 79 14.409 13.221 -9.959 1.00 0.00 H new ATOM 0 HE21 GLN A 79 16.162 11.637 -11.716 1.00 0.00 H new ATOM 0 HE22 GLN A 79 16.427 12.625 -13.156 1.00 0.00 H new ATOM 1347 N VAL A 80 17.064 13.520 -6.395 1.00 0.00 N ATOM 1348 CA VAL A 80 17.715 12.469 -5.617 1.00 0.00 C ATOM 1349 C VAL A 80 16.963 12.252 -4.303 1.00 0.00 C ATOM 1350 O VAL A 80 16.915 11.140 -3.774 1.00 0.00 O ATOM 1351 CB VAL A 80 19.203 12.792 -5.337 1.00 0.00 C ATOM 1352 CG1 VAL A 80 19.837 11.746 -4.431 1.00 0.00 C ATOM 1353 CG2 VAL A 80 19.976 12.893 -6.646 1.00 0.00 C ATOM 0 H VAL A 80 17.571 14.404 -6.427 1.00 0.00 H new ATOM 0 HA VAL A 80 17.687 11.553 -6.208 1.00 0.00 H new ATOM 0 HB VAL A 80 19.246 13.752 -4.822 1.00 0.00 H new ATOM 0 HG11 VAL A 80 20.882 12.003 -4.254 1.00 0.00 H new ATOM 0 HG12 VAL A 80 19.305 11.717 -3.480 1.00 0.00 H new ATOM 0 HG13 VAL A 80 19.780 10.768 -4.909 1.00 0.00 H new ATOM 0 HG21 VAL A 80 21.021 13.121 -6.435 1.00 0.00 H new ATOM 0 HG22 VAL A 80 19.912 11.945 -7.181 1.00 0.00 H new ATOM 0 HG23 VAL A 80 19.549 13.686 -7.260 1.00 0.00 H new ATOM 1363 N LEU A 81 16.350 13.321 -3.806 1.00 0.00 N ATOM 1364 CA LEU A 81 15.544 13.246 -2.593 1.00 0.00 C ATOM 1365 C LEU A 81 14.279 12.431 -2.850 1.00 0.00 C ATOM 1366 O LEU A 81 13.793 11.722 -1.968 1.00 0.00 O ATOM 1367 CB LEU A 81 15.179 14.653 -2.113 1.00 0.00 C ATOM 1368 CG LEU A 81 14.393 14.717 -0.800 1.00 0.00 C ATOM 1369 CD1 LEU A 81 15.221 14.166 0.352 1.00 0.00 C ATOM 1370 CD2 LEU A 81 13.962 16.148 -0.512 1.00 0.00 C ATOM 0 H LEU A 81 16.396 14.250 -4.225 1.00 0.00 H new ATOM 0 HA LEU A 81 16.126 12.752 -1.816 1.00 0.00 H new ATOM 0 HB2 LEU A 81 16.098 15.228 -1.995 1.00 0.00 H new ATOM 0 HB3 LEU A 81 14.594 15.143 -2.891 1.00 0.00 H new ATOM 0 HG LEU A 81 13.501 14.099 -0.902 1.00 0.00 H new ATOM 0 HD11 LEU A 81 14.643 14.221 1.275 1.00 0.00 H new ATOM 0 HD12 LEU A 81 15.481 13.127 0.149 1.00 0.00 H new ATOM 0 HD13 LEU A 81 16.132 14.754 0.459 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.404 16.179 0.424 1.00 0.00 H new ATOM 0 HD22 LEU A 81 14.843 16.784 -0.430 1.00 0.00 H new ATOM 0 HD23 LEU A 81 13.329 16.508 -1.323 1.00 0.00 H new ATOM 1382 N LEU A 82 13.755 12.533 -4.063 1.00 0.00 N ATOM 1383 CA LEU A 82 12.598 11.748 -4.470 1.00 0.00 C ATOM 1384 C LEU A 82 12.973 10.271 -4.475 1.00 0.00 C ATOM 1385 O LEU A 82 12.254 9.432 -3.929 1.00 0.00 O ATOM 1386 CB LEU A 82 12.123 12.198 -5.862 1.00 0.00 C ATOM 1387 CG LEU A 82 10.688 11.808 -6.267 1.00 0.00 C ATOM 1388 CD1 LEU A 82 10.568 10.318 -6.544 1.00 0.00 C ATOM 1389 CD2 LEU A 82 9.697 12.228 -5.194 1.00 0.00 C ATOM 0 H LEU A 82 14.115 13.155 -4.786 1.00 0.00 H new ATOM 0 HA LEU A 82 11.780 11.902 -3.767 1.00 0.00 H new ATOM 0 HB2 LEU A 82 12.208 13.283 -5.915 1.00 0.00 H new ATOM 0 HB3 LEU A 82 12.808 11.788 -6.604 1.00 0.00 H new ATOM 0 HG LEU A 82 10.453 12.337 -7.191 1.00 0.00 H new ATOM 0 HD11 LEU A 82 9.542 10.082 -6.826 1.00 0.00 H new ATOM 0 HD12 LEU A 82 11.240 10.044 -7.357 1.00 0.00 H new ATOM 0 HD13 LEU A 82 10.835 9.759 -5.648 1.00 0.00 H new ATOM 0 HD21 LEU A 82 8.689 11.944 -5.498 1.00 0.00 H new ATOM 0 HD22 LEU A 82 9.946 11.733 -4.255 1.00 0.00 H new ATOM 0 HD23 LEU A 82 9.744 13.308 -5.058 1.00 0.00 H new ATOM 1401 N GLN A 83 14.135 9.975 -5.057 1.00 0.00 N ATOM 1402 CA GLN A 83 14.632 8.605 -5.153 1.00 0.00 C ATOM 1403 C GLN A 83 14.830 7.988 -3.766 1.00 0.00 C ATOM 1404 O GLN A 83 14.904 6.765 -3.629 1.00 0.00 O ATOM 1405 CB GLN A 83 15.957 8.564 -5.919 1.00 0.00 C ATOM 1406 CG GLN A 83 16.442 7.150 -6.200 1.00 0.00 C ATOM 1407 CD GLN A 83 17.913 7.078 -6.558 1.00 0.00 C ATOM 1408 OE1 GLN A 83 18.477 8.005 -7.143 1.00 0.00 O ATOM 1409 NE2 GLN A 83 18.550 5.981 -6.187 1.00 0.00 N ATOM 0 H GLN A 83 14.753 10.673 -5.472 1.00 0.00 H new ATOM 0 HA GLN A 83 13.884 8.024 -5.692 1.00 0.00 H new ATOM 0 HB2 GLN A 83 15.840 9.096 -6.863 1.00 0.00 H new ATOM 0 HB3 GLN A 83 16.717 9.095 -5.346 1.00 0.00 H new ATOM 0 HG2 GLN A 83 16.258 6.530 -5.323 1.00 0.00 H new ATOM 0 HG3 GLN A 83 15.856 6.728 -7.017 1.00 0.00 H new ATOM 0 HE21 GLN A 83 18.046 5.237 -5.705 1.00 0.00 H new ATOM 0 HE22 GLN A 83 19.546 5.879 -6.383 1.00 0.00 H new ATOM 1418 N GLN A 84 14.919 8.830 -2.739 1.00 0.00 N ATOM 1419 CA GLN A 84 15.097 8.336 -1.382 1.00 0.00 C ATOM 1420 C GLN A 84 13.932 7.440 -0.976 1.00 0.00 C ATOM 1421 O GLN A 84 14.132 6.453 -0.277 1.00 0.00 O ATOM 1422 CB GLN A 84 15.262 9.485 -0.382 1.00 0.00 C ATOM 1423 CG GLN A 84 16.534 10.300 -0.580 1.00 0.00 C ATOM 1424 CD GLN A 84 17.774 9.434 -0.711 1.00 0.00 C ATOM 1425 OE1 GLN A 84 18.398 9.059 0.283 1.00 0.00 O ATOM 1426 NE2 GLN A 84 18.155 9.134 -1.942 1.00 0.00 N ATOM 0 H GLN A 84 14.871 9.846 -2.821 1.00 0.00 H new ATOM 0 HA GLN A 84 16.013 7.746 -1.366 1.00 0.00 H new ATOM 0 HB2 GLN A 84 14.401 10.149 -0.462 1.00 0.00 H new ATOM 0 HB3 GLN A 84 15.258 9.077 0.629 1.00 0.00 H new ATOM 0 HG2 GLN A 84 16.430 10.915 -1.474 1.00 0.00 H new ATOM 0 HG3 GLN A 84 16.659 10.980 0.263 1.00 0.00 H new ATOM 0 HE21 GLN A 84 17.611 9.464 -2.739 1.00 0.00 H new ATOM 0 HE22 GLN A 84 18.993 8.573 -2.094 1.00 0.00 H new ATOM 1435 N ARG A 85 12.723 7.770 -1.432 1.00 0.00 N ATOM 1436 CA ARG A 85 11.565 6.912 -1.186 1.00 0.00 C ATOM 1437 C ARG A 85 11.741 5.583 -1.898 1.00 0.00 C ATOM 1438 O ARG A 85 11.562 4.521 -1.310 1.00 0.00 O ATOM 1439 CB ARG A 85 10.262 7.555 -1.664 1.00 0.00 C ATOM 1440 CG ARG A 85 9.689 8.589 -0.713 1.00 0.00 C ATOM 1441 CD ARG A 85 8.165 8.594 -0.765 1.00 0.00 C ATOM 1442 NE ARG A 85 7.640 8.932 -2.092 1.00 0.00 N ATOM 1443 CZ ARG A 85 7.065 8.052 -2.919 1.00 0.00 C ATOM 1444 NH1 ARG A 85 7.018 6.759 -2.606 1.00 0.00 N ATOM 1445 NH2 ARG A 85 6.533 8.466 -4.064 1.00 0.00 N ATOM 0 H ARG A 85 12.522 8.615 -1.967 1.00 0.00 H new ATOM 0 HA ARG A 85 11.501 6.763 -0.108 1.00 0.00 H new ATOM 0 HB2 ARG A 85 10.437 8.026 -2.631 1.00 0.00 H new ATOM 0 HB3 ARG A 85 9.520 6.772 -1.820 1.00 0.00 H new ATOM 0 HG2 ARG A 85 10.021 8.377 0.303 1.00 0.00 H new ATOM 0 HG3 ARG A 85 10.069 9.577 -0.973 1.00 0.00 H new ATOM 0 HD2 ARG A 85 7.793 7.612 -0.472 1.00 0.00 H new ATOM 0 HD3 ARG A 85 7.784 9.309 -0.036 1.00 0.00 H new ATOM 0 HE ARG A 85 7.718 9.900 -2.404 1.00 0.00 H new ATOM 0 HH11 ARG A 85 7.423 6.432 -1.729 1.00 0.00 H new ATOM 0 HH12 ARG A 85 6.577 6.096 -3.243 1.00 0.00 H new ATOM 0 HH21 ARG A 85 6.563 9.455 -4.312 1.00 0.00 H new ATOM 0 HH22 ARG A 85 6.095 7.795 -4.695 1.00 0.00 H new ATOM 1459 N ARG A 86 12.105 5.670 -3.167 1.00 0.00 N ATOM 1460 CA ARG A 86 12.310 4.504 -4.015 1.00 0.00 C ATOM 1461 C ARG A 86 13.221 3.485 -3.334 1.00 0.00 C ATOM 1462 O ARG A 86 12.847 2.328 -3.144 1.00 0.00 O ATOM 1463 CB ARG A 86 12.925 4.967 -5.335 1.00 0.00 C ATOM 1464 CG ARG A 86 12.981 3.914 -6.423 1.00 0.00 C ATOM 1465 CD ARG A 86 13.430 4.547 -7.729 1.00 0.00 C ATOM 1466 NE ARG A 86 13.436 3.609 -8.847 1.00 0.00 N ATOM 1467 CZ ARG A 86 12.821 3.844 -10.006 1.00 0.00 C ATOM 1468 NH1 ARG A 86 11.995 4.880 -10.126 1.00 0.00 N ATOM 1469 NH2 ARG A 86 12.997 3.016 -11.027 1.00 0.00 N ATOM 0 H ARG A 86 12.268 6.558 -3.642 1.00 0.00 H new ATOM 0 HA ARG A 86 11.352 4.017 -4.198 1.00 0.00 H new ATOM 0 HB2 ARG A 86 12.354 5.819 -5.705 1.00 0.00 H new ATOM 0 HB3 ARG A 86 13.937 5.321 -5.142 1.00 0.00 H new ATOM 0 HG2 ARG A 86 13.670 3.119 -6.138 1.00 0.00 H new ATOM 0 HG3 ARG A 86 12.000 3.455 -6.549 1.00 0.00 H new ATOM 0 HD2 ARG A 86 12.771 5.382 -7.967 1.00 0.00 H new ATOM 0 HD3 ARG A 86 14.432 4.958 -7.601 1.00 0.00 H new ATOM 0 HE ARG A 86 13.937 2.728 -8.736 1.00 0.00 H new ATOM 0 HH11 ARG A 86 11.831 5.497 -9.330 1.00 0.00 H new ATOM 0 HH12 ARG A 86 11.526 5.058 -11.014 1.00 0.00 H new ATOM 0 HH21 ARG A 86 13.602 2.201 -10.924 1.00 0.00 H new ATOM 0 HH22 ARG A 86 12.527 3.194 -11.915 1.00 0.00 H new ATOM 1483 N ASP A 87 14.405 3.932 -2.944 1.00 0.00 N ATOM 1484 CA ASP A 87 15.392 3.055 -2.325 1.00 0.00 C ATOM 1485 C ASP A 87 14.971 2.632 -0.919 1.00 0.00 C ATOM 1486 O ASP A 87 15.181 1.485 -0.524 1.00 0.00 O ATOM 1487 CB ASP A 87 16.766 3.732 -2.288 1.00 0.00 C ATOM 1488 CG ASP A 87 17.477 3.687 -3.628 1.00 0.00 C ATOM 1489 OD1 ASP A 87 16.989 4.303 -4.597 1.00 0.00 O ATOM 1490 OD2 ASP A 87 18.529 3.016 -3.724 1.00 0.00 O ATOM 0 H ASP A 87 14.708 4.901 -3.045 1.00 0.00 H new ATOM 0 HA ASP A 87 15.457 2.155 -2.936 1.00 0.00 H new ATOM 0 HB2 ASP A 87 16.647 4.771 -1.979 1.00 0.00 H new ATOM 0 HB3 ASP A 87 17.386 3.245 -1.536 1.00 0.00 H new ATOM 1495 N GLN A 88 14.364 3.545 -0.170 1.00 0.00 N ATOM 1496 CA GLN A 88 13.981 3.261 1.211 1.00 0.00 C ATOM 1497 C GLN A 88 12.809 2.284 1.281 1.00 0.00 C ATOM 1498 O GLN A 88 12.827 1.343 2.075 1.00 0.00 O ATOM 1499 CB GLN A 88 13.651 4.557 1.960 1.00 0.00 C ATOM 1500 CG GLN A 88 13.100 4.334 3.359 1.00 0.00 C ATOM 1501 CD GLN A 88 11.590 4.469 3.424 1.00 0.00 C ATOM 1502 OE1 GLN A 88 10.995 5.274 2.710 1.00 0.00 O ATOM 1503 NE2 GLN A 88 10.958 3.657 4.255 1.00 0.00 N ATOM 0 H GLN A 88 14.127 4.483 -0.492 1.00 0.00 H new ATOM 0 HA GLN A 88 14.834 2.787 1.697 1.00 0.00 H new ATOM 0 HB2 GLN A 88 14.552 5.166 2.027 1.00 0.00 H new ATOM 0 HB3 GLN A 88 12.924 5.126 1.380 1.00 0.00 H new ATOM 0 HG2 GLN A 88 13.387 3.340 3.703 1.00 0.00 H new ATOM 0 HG3 GLN A 88 13.554 5.052 4.042 1.00 0.00 H new ATOM 0 HE21 GLN A 88 11.488 3.003 4.831 1.00 0.00 H new ATOM 0 HE22 GLN A 88 9.940 3.685 4.320 1.00 0.00 H new ATOM 1512 N GLU A 89 11.798 2.493 0.454 1.00 0.00 N ATOM 1513 CA GLU A 89 10.631 1.623 0.467 1.00 0.00 C ATOM 1514 C GLU A 89 10.969 0.248 -0.102 1.00 0.00 C ATOM 1515 O GLU A 89 10.333 -0.744 0.248 1.00 0.00 O ATOM 1516 CB GLU A 89 9.461 2.268 -0.277 1.00 0.00 C ATOM 1517 CG GLU A 89 8.894 3.474 0.463 1.00 0.00 C ATOM 1518 CD GLU A 89 7.650 4.048 -0.184 1.00 0.00 C ATOM 1519 OE1 GLU A 89 6.615 3.347 -0.218 1.00 0.00 O ATOM 1520 OE2 GLU A 89 7.687 5.218 -0.622 1.00 0.00 O ATOM 0 H GLU A 89 11.760 3.250 -0.229 1.00 0.00 H new ATOM 0 HA GLU A 89 10.323 1.482 1.503 1.00 0.00 H new ATOM 0 HB2 GLU A 89 9.791 2.576 -1.269 1.00 0.00 H new ATOM 0 HB3 GLU A 89 8.673 1.529 -0.419 1.00 0.00 H new ATOM 0 HG2 GLU A 89 8.661 3.185 1.488 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.658 4.250 0.516 1.00 0.00 H new ATOM 1527 N LEU A 90 11.985 0.182 -0.958 1.00 0.00 N ATOM 1528 CA LEU A 90 12.502 -1.105 -1.414 1.00 0.00 C ATOM 1529 C LEU A 90 13.267 -1.790 -0.283 1.00 0.00 C ATOM 1530 O LEU A 90 13.228 -3.013 -0.141 1.00 0.00 O ATOM 1531 CB LEU A 90 13.405 -0.932 -2.638 1.00 0.00 C ATOM 1532 CG LEU A 90 12.677 -0.562 -3.933 1.00 0.00 C ATOM 1533 CD1 LEU A 90 13.673 -0.299 -5.050 1.00 0.00 C ATOM 1534 CD2 LEU A 90 11.708 -1.665 -4.336 1.00 0.00 C ATOM 0 H LEU A 90 12.463 0.995 -1.347 1.00 0.00 H new ATOM 0 HA LEU A 90 11.658 -1.731 -1.704 1.00 0.00 H new ATOM 0 HB2 LEU A 90 14.142 -0.159 -2.420 1.00 0.00 H new ATOM 0 HB3 LEU A 90 13.954 -1.860 -2.800 1.00 0.00 H new ATOM 0 HG LEU A 90 12.108 0.351 -3.756 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.136 -0.038 -5.962 1.00 0.00 H new ATOM 0 HD12 LEU A 90 14.329 0.524 -4.766 1.00 0.00 H new ATOM 0 HD13 LEU A 90 14.269 -1.195 -5.224 1.00 0.00 H new ATOM 0 HD21 LEU A 90 11.200 -1.384 -5.259 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.258 -2.593 -4.493 1.00 0.00 H new ATOM 0 HD23 LEU A 90 10.971 -1.809 -3.546 1.00 0.00 H new ATOM 1546 N LYS A 91 13.953 -0.985 0.522 1.00 0.00 N ATOM 1547 CA LYS A 91 14.628 -1.475 1.717 1.00 0.00 C ATOM 1548 C LYS A 91 13.619 -2.098 2.680 1.00 0.00 C ATOM 1549 O LYS A 91 13.802 -3.227 3.143 1.00 0.00 O ATOM 1550 CB LYS A 91 15.386 -0.326 2.396 1.00 0.00 C ATOM 1551 CG LYS A 91 15.846 -0.629 3.813 1.00 0.00 C ATOM 1552 CD LYS A 91 16.590 0.549 4.421 1.00 0.00 C ATOM 1553 CE LYS A 91 16.839 0.347 5.909 1.00 0.00 C ATOM 1554 NZ LYS A 91 15.578 0.408 6.697 1.00 0.00 N ATOM 0 H LYS A 91 14.056 0.018 0.366 1.00 0.00 H new ATOM 0 HA LYS A 91 15.344 -2.245 1.430 1.00 0.00 H new ATOM 0 HB2 LYS A 91 16.256 -0.073 1.791 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.744 0.555 2.416 1.00 0.00 H new ATOM 0 HG2 LYS A 91 14.983 -0.874 4.432 1.00 0.00 H new ATOM 0 HG3 LYS A 91 16.494 -1.506 3.807 1.00 0.00 H new ATOM 0 HD2 LYS A 91 17.542 0.683 3.907 1.00 0.00 H new ATOM 0 HD3 LYS A 91 16.014 1.462 4.269 1.00 0.00 H new ATOM 0 HE2 LYS A 91 17.320 -0.618 6.069 1.00 0.00 H new ATOM 0 HE3 LYS A 91 17.529 1.111 6.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 15.560 -0.372 7.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 15.528 1.316 7.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 14.764 0.323 6.056 1.00 0.00 H new ATOM 1568 N GLU A 92 12.547 -1.363 2.960 1.00 0.00 N ATOM 1569 CA GLU A 92 11.483 -1.850 3.832 1.00 0.00 C ATOM 1570 C GLU A 92 10.725 -3.005 3.185 1.00 0.00 C ATOM 1571 O GLU A 92 10.194 -3.870 3.875 1.00 0.00 O ATOM 1572 CB GLU A 92 10.518 -0.716 4.189 1.00 0.00 C ATOM 1573 CG GLU A 92 10.808 -0.063 5.535 1.00 0.00 C ATOM 1574 CD GLU A 92 12.219 0.477 5.650 1.00 0.00 C ATOM 1575 OE1 GLU A 92 13.134 -0.304 5.993 1.00 0.00 O ATOM 1576 OE2 GLU A 92 12.417 1.687 5.417 1.00 0.00 O ATOM 0 H GLU A 92 12.392 -0.424 2.594 1.00 0.00 H new ATOM 0 HA GLU A 92 11.945 -2.218 4.748 1.00 0.00 H new ATOM 0 HB2 GLU A 92 10.562 0.045 3.410 1.00 0.00 H new ATOM 0 HB3 GLU A 92 9.500 -1.106 4.197 1.00 0.00 H new ATOM 0 HG2 GLU A 92 10.101 0.751 5.695 1.00 0.00 H new ATOM 0 HG3 GLU A 92 10.640 -0.792 6.328 1.00 0.00 H new ATOM 1583 N PHE A 93 10.681 -3.016 1.860 1.00 0.00 N ATOM 1584 CA PHE A 93 10.068 -4.113 1.114 1.00 0.00 C ATOM 1585 C PHE A 93 10.797 -5.422 1.409 1.00 0.00 C ATOM 1586 O PHE A 93 10.179 -6.477 1.566 1.00 0.00 O ATOM 1587 CB PHE A 93 10.111 -3.801 -0.387 1.00 0.00 C ATOM 1588 CG PHE A 93 9.457 -4.833 -1.260 1.00 0.00 C ATOM 1589 CD1 PHE A 93 8.079 -4.868 -1.400 1.00 0.00 C ATOM 1590 CD2 PHE A 93 10.222 -5.760 -1.952 1.00 0.00 C ATOM 1591 CE1 PHE A 93 7.476 -5.808 -2.212 1.00 0.00 C ATOM 1592 CE2 PHE A 93 9.624 -6.701 -2.766 1.00 0.00 C ATOM 1593 CZ PHE A 93 8.250 -6.724 -2.896 1.00 0.00 C ATOM 0 H PHE A 93 11.064 -2.274 1.274 1.00 0.00 H new ATOM 0 HA PHE A 93 9.028 -4.222 1.423 1.00 0.00 H new ATOM 0 HB2 PHE A 93 9.627 -2.840 -0.559 1.00 0.00 H new ATOM 0 HB3 PHE A 93 11.152 -3.693 -0.692 1.00 0.00 H new ATOM 0 HD1 PHE A 93 7.470 -4.152 -0.868 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.297 -5.746 -1.853 1.00 0.00 H new ATOM 0 HE1 PHE A 93 6.401 -5.827 -2.312 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.230 -7.418 -3.300 1.00 0.00 H new ATOM 0 HZ PHE A 93 7.780 -7.459 -3.533 1.00 0.00 H new ATOM 1603 N LYS A 94 12.117 -5.334 1.502 1.00 0.00 N ATOM 1604 CA LYS A 94 12.954 -6.489 1.793 1.00 0.00 C ATOM 1605 C LYS A 94 12.906 -6.843 3.279 1.00 0.00 C ATOM 1606 O LYS A 94 12.947 -8.015 3.651 1.00 0.00 O ATOM 1607 CB LYS A 94 14.399 -6.200 1.376 1.00 0.00 C ATOM 1608 CG LYS A 94 15.371 -7.319 1.715 1.00 0.00 C ATOM 1609 CD LYS A 94 16.808 -6.911 1.444 1.00 0.00 C ATOM 1610 CE LYS A 94 17.787 -7.996 1.862 1.00 0.00 C ATOM 1611 NZ LYS A 94 17.716 -8.288 3.320 1.00 0.00 N ATOM 0 H LYS A 94 12.635 -4.464 1.378 1.00 0.00 H new ATOM 0 HA LYS A 94 12.572 -7.339 1.227 1.00 0.00 H new ATOM 0 HB2 LYS A 94 14.428 -6.019 0.301 1.00 0.00 H new ATOM 0 HB3 LYS A 94 14.731 -5.283 1.863 1.00 0.00 H new ATOM 0 HG2 LYS A 94 15.261 -7.592 2.765 1.00 0.00 H new ATOM 0 HG3 LYS A 94 15.127 -8.204 1.128 1.00 0.00 H new ATOM 0 HD2 LYS A 94 16.932 -6.698 0.382 1.00 0.00 H new ATOM 0 HD3 LYS A 94 17.033 -5.990 1.982 1.00 0.00 H new ATOM 0 HE2 LYS A 94 17.578 -8.907 1.301 1.00 0.00 H new ATOM 0 HE3 LYS A 94 18.800 -7.687 1.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 18.537 -8.863 3.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 17.721 -7.395 3.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 16.841 -8.810 3.527 1.00 0.00 H new ATOM 1625 N ALA A 95 12.822 -5.824 4.123 1.00 0.00 N ATOM 1626 CA ALA A 95 12.877 -6.021 5.566 1.00 0.00 C ATOM 1627 C ALA A 95 11.520 -6.425 6.137 1.00 0.00 C ATOM 1628 O ALA A 95 11.446 -7.071 7.186 1.00 0.00 O ATOM 1629 CB ALA A 95 13.382 -4.759 6.248 1.00 0.00 C ATOM 0 H ALA A 95 12.715 -4.852 3.834 1.00 0.00 H new ATOM 0 HA ALA A 95 13.571 -6.838 5.762 1.00 0.00 H new ATOM 0 HB1 ALA A 95 13.419 -4.918 7.326 1.00 0.00 H new ATOM 0 HB2 ALA A 95 14.381 -4.522 5.882 1.00 0.00 H new ATOM 0 HB3 ALA A 95 12.709 -3.931 6.026 1.00 0.00 H new ATOM 1635 N GLY A 96 10.458 -6.046 5.448 1.00 0.00 N ATOM 1636 CA GLY A 96 9.122 -6.339 5.917 1.00 0.00 C ATOM 1637 C GLY A 96 8.339 -5.074 6.194 1.00 0.00 C ATOM 1638 O GLY A 96 8.617 -4.364 7.161 1.00 0.00 O ATOM 0 H GLY A 96 10.498 -5.537 4.565 1.00 0.00 H new ATOM 0 HA2 GLY A 96 8.597 -6.937 5.172 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.178 -6.939 6.825 1.00 0.00 H new ATOM 1642 N PHE A 97 7.361 -4.790 5.348 1.00 0.00 N ATOM 1643 CA PHE A 97 6.584 -3.566 5.467 1.00 0.00 C ATOM 1644 C PHE A 97 5.299 -3.830 6.246 1.00 0.00 C ATOM 1645 O PHE A 97 4.718 -4.914 6.150 1.00 0.00 O ATOM 1646 CB PHE A 97 6.267 -3.002 4.078 1.00 0.00 C ATOM 1647 CG PHE A 97 5.690 -1.613 4.099 1.00 0.00 C ATOM 1648 CD1 PHE A 97 6.477 -0.528 4.452 1.00 0.00 C ATOM 1649 CD2 PHE A 97 4.361 -1.392 3.769 1.00 0.00 C ATOM 1650 CE1 PHE A 97 5.951 0.750 4.473 1.00 0.00 C ATOM 1651 CE2 PHE A 97 3.831 -0.116 3.788 1.00 0.00 C ATOM 1652 CZ PHE A 97 4.626 0.957 4.141 1.00 0.00 C ATOM 0 H PHE A 97 7.086 -5.391 4.571 1.00 0.00 H new ATOM 0 HA PHE A 97 7.172 -2.828 6.012 1.00 0.00 H new ATOM 0 HB2 PHE A 97 7.180 -2.996 3.482 1.00 0.00 H new ATOM 0 HB3 PHE A 97 5.564 -3.669 3.578 1.00 0.00 H new ATOM 0 HD1 PHE A 97 7.513 -0.683 4.714 1.00 0.00 H new ATOM 0 HD2 PHE A 97 3.733 -2.227 3.494 1.00 0.00 H new ATOM 0 HE1 PHE A 97 6.576 1.587 4.749 1.00 0.00 H new ATOM 0 HE2 PHE A 97 2.795 0.042 3.527 1.00 0.00 H new ATOM 0 HZ PHE A 97 4.213 1.955 4.157 1.00 0.00 H new ATOM 1662 N LEU A 98 4.869 -2.844 7.020 1.00 0.00 N ATOM 1663 CA LEU A 98 3.675 -2.975 7.845 1.00 0.00 C ATOM 1664 C LEU A 98 2.416 -2.876 6.985 1.00 0.00 C ATOM 1665 O LEU A 98 2.023 -1.787 6.565 1.00 0.00 O ATOM 1666 CB LEU A 98 3.664 -1.888 8.926 1.00 0.00 C ATOM 1667 CG LEU A 98 2.646 -2.089 10.050 1.00 0.00 C ATOM 1668 CD1 LEU A 98 3.015 -3.304 10.888 1.00 0.00 C ATOM 1669 CD2 LEU A 98 2.560 -0.845 10.921 1.00 0.00 C ATOM 0 H LEU A 98 5.332 -1.938 7.094 1.00 0.00 H new ATOM 0 HA LEU A 98 3.688 -3.953 8.325 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.659 -1.828 9.367 1.00 0.00 H new ATOM 0 HB3 LEU A 98 3.468 -0.928 8.449 1.00 0.00 H new ATOM 0 HG LEU A 98 1.667 -2.262 9.603 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.281 -3.434 11.684 1.00 0.00 H new ATOM 0 HD12 LEU A 98 3.026 -4.192 10.256 1.00 0.00 H new ATOM 0 HD13 LEU A 98 4.003 -3.158 11.326 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.831 -1.007 11.715 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.536 -0.640 11.361 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.251 0.005 10.312 1.00 0.00 H new ATOM 1681 N CYS A 99 1.802 -4.017 6.719 1.00 0.00 N ATOM 1682 CA CYS A 99 0.628 -4.081 5.860 1.00 0.00 C ATOM 1683 C CYS A 99 -0.501 -4.835 6.558 1.00 0.00 C ATOM 1684 O CYS A 99 -0.247 -5.715 7.380 1.00 0.00 O ATOM 1685 CB CYS A 99 0.980 -4.787 4.549 1.00 0.00 C ATOM 1686 SG CYS A 99 2.525 -4.229 3.795 1.00 0.00 S ATOM 0 H CYS A 99 2.099 -4.920 7.089 1.00 0.00 H new ATOM 0 HA CYS A 99 0.297 -3.064 5.648 1.00 0.00 H new ATOM 0 HB2 CYS A 99 1.046 -5.859 4.734 1.00 0.00 H new ATOM 0 HB3 CYS A 99 0.167 -4.635 3.839 1.00 0.00 H new ATOM 0 HG CYS A 99 3.525 -4.567 4.554 1.00 0.00 H new ATOM 1692 N PRO A 100 -1.764 -4.504 6.252 1.00 0.00 N ATOM 1693 CA PRO A 100 -2.910 -5.247 6.776 1.00 0.00 C ATOM 1694 C PRO A 100 -3.036 -6.608 6.099 1.00 0.00 C ATOM 1695 O PRO A 100 -2.618 -6.772 4.948 1.00 0.00 O ATOM 1696 CB PRO A 100 -4.103 -4.356 6.424 1.00 0.00 C ATOM 1697 CG PRO A 100 -3.663 -3.587 5.226 1.00 0.00 C ATOM 1698 CD PRO A 100 -2.176 -3.390 5.375 1.00 0.00 C ATOM 0 HA PRO A 100 -2.828 -5.452 7.843 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -4.991 -4.951 6.208 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -4.357 -3.691 7.249 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -3.894 -4.129 4.309 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -4.179 -2.628 5.168 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.668 -3.429 4.411 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -1.942 -2.422 5.819 1.00 0.00 H new ATOM 1706 N ASP A 101 -3.584 -7.588 6.808 1.00 0.00 N ATOM 1707 CA ASP A 101 -3.797 -8.899 6.210 1.00 0.00 C ATOM 1708 C ASP A 101 -4.921 -8.819 5.192 1.00 0.00 C ATOM 1709 O ASP A 101 -6.096 -8.707 5.544 1.00 0.00 O ATOM 1710 CB ASP A 101 -4.109 -9.970 7.258 1.00 0.00 C ATOM 1711 CG ASP A 101 -4.279 -11.341 6.624 1.00 0.00 C ATOM 1712 OD1 ASP A 101 -3.501 -11.676 5.703 1.00 0.00 O ATOM 1713 OD2 ASP A 101 -5.196 -12.087 7.030 1.00 0.00 O ATOM 0 H ASP A 101 -3.884 -7.503 7.779 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.871 -9.193 5.717 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -3.305 -10.006 7.993 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -5.019 -9.701 7.794 1.00 0.00 H new ATOM 1718 N LEU A 102 -4.540 -8.888 3.929 1.00 0.00 N ATOM 1719 CA LEU A 102 -5.460 -8.667 2.823 1.00 0.00 C ATOM 1720 C LEU A 102 -6.390 -9.867 2.628 1.00 0.00 C ATOM 1721 O LEU A 102 -7.198 -9.899 1.696 1.00 0.00 O ATOM 1722 CB LEU A 102 -4.650 -8.396 1.550 1.00 0.00 C ATOM 1723 CG LEU A 102 -5.351 -7.558 0.480 1.00 0.00 C ATOM 1724 CD1 LEU A 102 -5.748 -6.201 1.042 1.00 0.00 C ATOM 1725 CD2 LEU A 102 -4.445 -7.383 -0.728 1.00 0.00 C ATOM 0 H LEU A 102 -3.585 -9.099 3.639 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.088 -7.805 3.048 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -3.725 -7.892 1.831 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -4.370 -9.353 1.109 1.00 0.00 H new ATOM 0 HG LEU A 102 -6.255 -8.081 0.167 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -6.246 -5.618 0.267 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -6.427 -6.340 1.884 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.857 -5.672 1.378 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.956 -6.785 -1.482 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -3.528 -6.878 -0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -4.201 -8.360 -1.144 1.00 0.00 H new ATOM 1737 N SER A 103 -6.276 -10.852 3.512 1.00 0.00 N ATOM 1738 CA SER A 103 -7.112 -12.038 3.446 1.00 0.00 C ATOM 1739 C SER A 103 -7.914 -12.233 4.735 1.00 0.00 C ATOM 1740 O SER A 103 -8.525 -13.283 4.941 1.00 0.00 O ATOM 1741 CB SER A 103 -6.253 -13.269 3.155 1.00 0.00 C ATOM 1742 OG SER A 103 -5.592 -13.139 1.904 1.00 0.00 O ATOM 0 H SER A 103 -5.609 -10.849 4.284 1.00 0.00 H new ATOM 0 HA SER A 103 -7.826 -11.903 2.634 1.00 0.00 H new ATOM 0 HB2 SER A 103 -5.517 -13.400 3.948 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.879 -14.162 3.150 1.00 0.00 H new ATOM 0 HG SER A 103 -6.230 -12.829 1.228 1.00 0.00 H new ATOM 1748 N ASP A 104 -7.920 -11.224 5.601 1.00 0.00 N ATOM 1749 CA ASP A 104 -8.754 -11.264 6.802 1.00 0.00 C ATOM 1750 C ASP A 104 -10.088 -10.603 6.506 1.00 0.00 C ATOM 1751 O ASP A 104 -10.182 -9.379 6.449 1.00 0.00 O ATOM 1752 CB ASP A 104 -8.077 -10.566 7.984 1.00 0.00 C ATOM 1753 CG ASP A 104 -8.863 -10.726 9.275 1.00 0.00 C ATOM 1754 OD1 ASP A 104 -9.847 -9.981 9.485 1.00 0.00 O ATOM 1755 OD2 ASP A 104 -8.494 -11.584 10.101 1.00 0.00 O ATOM 0 H ASP A 104 -7.363 -10.376 5.497 1.00 0.00 H new ATOM 0 HA ASP A 104 -8.906 -12.307 7.079 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.075 -10.973 8.118 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -7.963 -9.505 7.760 1.00 0.00 H new ATOM 1760 N ALA A 105 -11.113 -11.420 6.320 1.00 0.00 N ATOM 1761 CA ALA A 105 -12.396 -10.956 5.798 1.00 0.00 C ATOM 1762 C ALA A 105 -13.020 -9.826 6.617 1.00 0.00 C ATOM 1763 O ALA A 105 -13.643 -8.929 6.049 1.00 0.00 O ATOM 1764 CB ALA A 105 -13.367 -12.121 5.692 1.00 0.00 C ATOM 0 H ALA A 105 -11.083 -12.419 6.524 1.00 0.00 H new ATOM 0 HA ALA A 105 -12.194 -10.542 4.810 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -14.321 -11.765 5.302 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -12.958 -12.875 5.019 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -13.519 -12.559 6.679 1.00 0.00 H new ATOM 1770 N LYS A 106 -12.864 -9.845 7.936 1.00 0.00 N ATOM 1771 CA LYS A 106 -13.516 -8.835 8.755 1.00 0.00 C ATOM 1772 C LYS A 106 -12.630 -7.605 8.921 1.00 0.00 C ATOM 1773 O LYS A 106 -13.125 -6.502 9.141 1.00 0.00 O ATOM 1774 CB LYS A 106 -13.932 -9.381 10.121 1.00 0.00 C ATOM 1775 CG LYS A 106 -15.112 -8.623 10.710 1.00 0.00 C ATOM 1776 CD LYS A 106 -15.456 -9.089 12.113 1.00 0.00 C ATOM 1777 CE LYS A 106 -16.827 -8.584 12.543 1.00 0.00 C ATOM 1778 NZ LYS A 106 -16.950 -7.104 12.435 1.00 0.00 N ATOM 0 H LYS A 106 -12.307 -10.529 8.448 1.00 0.00 H new ATOM 0 HA LYS A 106 -14.424 -8.541 8.228 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -14.192 -10.435 10.025 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -13.086 -9.322 10.806 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -14.883 -7.558 10.730 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -15.981 -8.750 10.064 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -15.439 -10.178 12.151 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -14.699 -8.734 12.812 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -17.593 -9.055 11.927 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -17.015 -8.887 13.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -17.839 -6.796 12.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -16.147 -6.653 12.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -16.950 -6.828 11.432 1.00 0.00 H new ATOM 1792 N ASN A 107 -11.321 -7.778 8.809 1.00 0.00 N ATOM 1793 CA ASN A 107 -10.427 -6.630 8.798 1.00 0.00 C ATOM 1794 C ASN A 107 -10.552 -5.920 7.463 1.00 0.00 C ATOM 1795 O ASN A 107 -10.450 -4.701 7.383 1.00 0.00 O ATOM 1796 CB ASN A 107 -8.976 -7.036 9.053 1.00 0.00 C ATOM 1797 CG ASN A 107 -8.414 -6.395 10.311 1.00 0.00 C ATOM 1798 OD1 ASN A 107 -7.231 -6.071 10.383 1.00 0.00 O ATOM 1799 ND2 ASN A 107 -9.253 -6.237 11.326 1.00 0.00 N ATOM 0 H ASN A 107 -10.861 -8.685 8.726 1.00 0.00 H new ATOM 0 HA ASN A 107 -10.716 -5.958 9.606 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -8.914 -8.121 9.141 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.365 -6.750 8.197 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -8.922 -5.835 12.203 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -10.229 -6.518 11.229 1.00 0.00 H new ATOM 1806 N MET A 108 -10.802 -6.704 6.422 1.00 0.00 N ATOM 1807 CA MET A 108 -11.097 -6.161 5.104 1.00 0.00 C ATOM 1808 C MET A 108 -12.437 -5.439 5.131 1.00 0.00 C ATOM 1809 O MET A 108 -12.682 -4.535 4.338 1.00 0.00 O ATOM 1810 CB MET A 108 -11.121 -7.271 4.051 1.00 0.00 C ATOM 1811 CG MET A 108 -9.777 -7.948 3.841 1.00 0.00 C ATOM 1812 SD MET A 108 -8.515 -6.813 3.244 1.00 0.00 S ATOM 1813 CE MET A 108 -9.246 -6.309 1.691 1.00 0.00 C ATOM 0 H MET A 108 -10.806 -7.723 6.467 1.00 0.00 H new ATOM 0 HA MET A 108 -10.311 -5.454 4.838 1.00 0.00 H new ATOM 0 HB2 MET A 108 -11.853 -8.022 4.346 1.00 0.00 H new ATOM 0 HB3 MET A 108 -11.458 -6.852 3.103 1.00 0.00 H new ATOM 0 HG2 MET A 108 -9.447 -8.391 4.781 1.00 0.00 H new ATOM 0 HG3 MET A 108 -9.893 -8.764 3.128 1.00 0.00 H new ATOM 0 HE1 MET A 108 -8.521 -5.730 1.119 1.00 0.00 H new ATOM 0 HE2 MET A 108 -9.535 -7.192 1.121 1.00 0.00 H new ATOM 0 HE3 MET A 108 -10.127 -5.698 1.885 1.00 0.00 H new ATOM 1823 N GLU A 109 -13.303 -5.851 6.052 1.00 0.00 N ATOM 1824 CA GLU A 109 -14.568 -5.165 6.281 1.00 0.00 C ATOM 1825 C GLU A 109 -14.305 -3.749 6.786 1.00 0.00 C ATOM 1826 O GLU A 109 -14.839 -2.779 6.249 1.00 0.00 O ATOM 1827 CB GLU A 109 -15.416 -5.956 7.286 1.00 0.00 C ATOM 1828 CG GLU A 109 -16.685 -5.249 7.732 1.00 0.00 C ATOM 1829 CD GLU A 109 -17.509 -6.092 8.685 1.00 0.00 C ATOM 1830 OE1 GLU A 109 -17.289 -6.013 9.914 1.00 0.00 O ATOM 1831 OE2 GLU A 109 -18.388 -6.841 8.209 1.00 0.00 O ATOM 0 H GLU A 109 -13.150 -6.660 6.654 1.00 0.00 H new ATOM 0 HA GLU A 109 -15.120 -5.099 5.343 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -15.686 -6.914 6.841 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -14.808 -6.173 8.164 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -16.423 -4.308 8.216 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -17.286 -5.001 6.857 1.00 0.00 H new ATOM 1838 N PHE A 110 -13.455 -3.636 7.803 1.00 0.00 N ATOM 1839 CA PHE A 110 -13.063 -2.333 8.331 1.00 0.00 C ATOM 1840 C PHE A 110 -12.295 -1.548 7.275 1.00 0.00 C ATOM 1841 O PHE A 110 -12.431 -0.335 7.165 1.00 0.00 O ATOM 1842 CB PHE A 110 -12.188 -2.483 9.580 1.00 0.00 C ATOM 1843 CG PHE A 110 -12.811 -3.293 10.678 1.00 0.00 C ATOM 1844 CD1 PHE A 110 -14.064 -2.973 11.174 1.00 0.00 C ATOM 1845 CD2 PHE A 110 -12.138 -4.378 11.217 1.00 0.00 C ATOM 1846 CE1 PHE A 110 -14.633 -3.719 12.187 1.00 0.00 C ATOM 1847 CE2 PHE A 110 -12.702 -5.128 12.229 1.00 0.00 C ATOM 1848 CZ PHE A 110 -13.952 -4.798 12.714 1.00 0.00 C ATOM 0 H PHE A 110 -13.025 -4.430 8.277 1.00 0.00 H new ATOM 0 HA PHE A 110 -13.973 -1.797 8.601 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -11.244 -2.946 9.294 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -11.953 -1.491 9.965 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -14.602 -2.131 10.764 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -11.160 -4.640 10.840 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -15.610 -3.459 12.567 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -12.167 -5.971 12.641 1.00 0.00 H new ATOM 0 HZ PHE A 110 -14.397 -5.384 13.505 1.00 0.00 H new ATOM 1858 N LEU A 111 -11.489 -2.265 6.505 1.00 0.00 N ATOM 1859 CA LEU A 111 -10.678 -1.672 5.453 1.00 0.00 C ATOM 1860 C LEU A 111 -11.558 -1.125 4.326 1.00 0.00 C ATOM 1861 O LEU A 111 -11.307 -0.045 3.804 1.00 0.00 O ATOM 1862 CB LEU A 111 -9.689 -2.724 4.927 1.00 0.00 C ATOM 1863 CG LEU A 111 -8.716 -2.269 3.835 1.00 0.00 C ATOM 1864 CD1 LEU A 111 -7.377 -2.969 4.001 1.00 0.00 C ATOM 1865 CD2 LEU A 111 -9.281 -2.562 2.455 1.00 0.00 C ATOM 0 H LEU A 111 -11.379 -3.275 6.593 1.00 0.00 H new ATOM 0 HA LEU A 111 -10.118 -0.830 5.860 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -9.105 -3.094 5.770 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -10.262 -3.567 4.542 1.00 0.00 H new ATOM 0 HG LEU A 111 -8.573 -1.193 3.932 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -6.694 -2.638 3.219 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.957 -2.725 4.977 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.518 -4.047 3.926 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -8.574 -2.231 1.694 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -9.450 -3.634 2.351 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.225 -2.032 2.328 1.00 0.00 H new ATOM 1877 N ARG A 112 -12.601 -1.865 3.970 1.00 0.00 N ATOM 1878 CA ARG A 112 -13.479 -1.466 2.876 1.00 0.00 C ATOM 1879 C ARG A 112 -14.424 -0.351 3.313 1.00 0.00 C ATOM 1880 O ARG A 112 -14.879 0.449 2.491 1.00 0.00 O ATOM 1881 CB ARG A 112 -14.297 -2.658 2.377 1.00 0.00 C ATOM 1882 CG ARG A 112 -14.996 -2.396 1.056 1.00 0.00 C ATOM 1883 CD ARG A 112 -15.918 -3.536 0.667 1.00 0.00 C ATOM 1884 NE ARG A 112 -16.363 -3.421 -0.722 1.00 0.00 N ATOM 1885 CZ ARG A 112 -17.634 -3.463 -1.106 1.00 0.00 C ATOM 1886 NH1 ARG A 112 -18.608 -3.525 -0.205 1.00 0.00 N ATOM 1887 NH2 ARG A 112 -17.937 -3.414 -2.396 1.00 0.00 N ATOM 0 H ARG A 112 -12.859 -2.742 4.421 1.00 0.00 H new ATOM 0 HA ARG A 112 -12.849 -1.099 2.066 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -13.640 -3.520 2.267 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -15.042 -2.919 3.129 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -15.571 -1.472 1.126 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -14.251 -2.249 0.274 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -15.402 -4.486 0.806 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -16.785 -3.545 1.328 1.00 0.00 H new ATOM 0 HE ARG A 112 -15.651 -3.301 -1.442 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -18.382 -3.541 0.790 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -19.582 -3.557 -0.508 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -17.195 -3.344 -3.092 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -18.912 -3.446 -2.692 1.00 0.00 H new ATOM 1901 N ASN A 113 -14.721 -0.310 4.602 1.00 0.00 N ATOM 1902 CA ASN A 113 -15.627 0.692 5.153 1.00 0.00 C ATOM 1903 C ASN A 113 -14.840 1.751 5.912 1.00 0.00 C ATOM 1904 O ASN A 113 -15.391 2.469 6.750 1.00 0.00 O ATOM 1905 CB ASN A 113 -16.649 0.038 6.087 1.00 0.00 C ATOM 1906 CG ASN A 113 -17.539 -0.973 5.382 1.00 0.00 C ATOM 1907 OD1 ASN A 113 -17.843 -0.836 4.196 1.00 0.00 O ATOM 1908 ND2 ASN A 113 -17.955 -1.997 6.109 1.00 0.00 N ATOM 0 H ASN A 113 -14.347 -0.962 5.292 1.00 0.00 H new ATOM 0 HA ASN A 113 -16.159 1.165 4.327 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -16.122 -0.457 6.903 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -17.272 0.813 6.534 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -18.551 -2.711 5.690 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -17.680 -2.072 7.088 1.00 0.00 H new ATOM 1915 N TRP A 114 -13.553 1.850 5.601 1.00 0.00 N ATOM 1916 CA TRP A 114 -12.658 2.766 6.293 1.00 0.00 C ATOM 1917 C TRP A 114 -13.108 4.210 6.082 1.00 0.00 C ATOM 1918 O TRP A 114 -13.031 4.753 4.981 1.00 0.00 O ATOM 1919 CB TRP A 114 -11.219 2.567 5.806 1.00 0.00 C ATOM 1920 CG TRP A 114 -10.180 3.135 6.727 1.00 0.00 C ATOM 1921 CD1 TRP A 114 -9.930 2.748 8.013 1.00 0.00 C ATOM 1922 CD2 TRP A 114 -9.236 4.168 6.428 1.00 0.00 C ATOM 1923 NE1 TRP A 114 -8.901 3.491 8.538 1.00 0.00 N ATOM 1924 CE2 TRP A 114 -8.455 4.367 7.582 1.00 0.00 C ATOM 1925 CE3 TRP A 114 -8.981 4.951 5.298 1.00 0.00 C ATOM 1926 CZ2 TRP A 114 -7.431 5.310 7.635 1.00 0.00 C ATOM 1927 CZ3 TRP A 114 -7.964 5.886 5.353 1.00 0.00 C ATOM 1928 CH2 TRP A 114 -7.202 6.060 6.514 1.00 0.00 C ATOM 0 H TRP A 114 -13.104 1.302 4.867 1.00 0.00 H new ATOM 0 HA TRP A 114 -12.692 2.552 7.361 1.00 0.00 H new ATOM 0 HB2 TRP A 114 -11.033 1.500 5.679 1.00 0.00 H new ATOM 0 HB3 TRP A 114 -11.111 3.028 4.824 1.00 0.00 H new ATOM 0 HD1 TRP A 114 -10.464 1.971 8.540 1.00 0.00 H new ATOM 0 HE1 TRP A 114 -8.529 3.405 9.484 1.00 0.00 H new ATOM 0 HE3 TRP A 114 -9.567 4.828 4.399 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 -6.839 5.444 8.529 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 -7.754 6.493 4.485 1.00 0.00 H new ATOM 0 HH2 TRP A 114 -6.417 6.802 6.525 1.00 0.00 H new ATOM 1939 N ASN A 115 -13.602 4.817 7.150 1.00 0.00 N ATOM 1940 CA ASN A 115 -14.121 6.179 7.096 1.00 0.00 C ATOM 1941 C ASN A 115 -12.975 7.190 7.059 1.00 0.00 C ATOM 1942 O ASN A 115 -13.177 8.373 6.785 1.00 0.00 O ATOM 1943 CB ASN A 115 -15.025 6.434 8.308 1.00 0.00 C ATOM 1944 CG ASN A 115 -15.828 7.720 8.203 1.00 0.00 C ATOM 1945 OD1 ASN A 115 -16.919 7.734 7.634 1.00 0.00 O ATOM 1946 ND2 ASN A 115 -15.310 8.801 8.770 1.00 0.00 N ATOM 0 H ASN A 115 -13.655 4.385 8.073 1.00 0.00 H new ATOM 0 HA ASN A 115 -14.706 6.299 6.185 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -15.711 5.595 8.423 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -14.411 6.470 9.208 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -15.819 9.684 8.744 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -14.402 8.749 9.232 1.00 0.00 H new ATOM 1953 N GLY A 116 -11.766 6.711 7.311 1.00 0.00 N ATOM 1954 CA GLY A 116 -10.620 7.592 7.376 1.00 0.00 C ATOM 1955 C GLY A 116 -10.380 8.082 8.785 1.00 0.00 C ATOM 1956 O GLY A 116 -10.381 9.283 9.046 1.00 0.00 O ATOM 0 H GLY A 116 -11.558 5.725 7.472 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.735 7.067 7.016 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -10.776 8.444 6.715 1.00 0.00 H new ATOM 1960 N THR A 117 -10.180 7.143 9.695 1.00 0.00 N ATOM 1961 CA THR A 117 -10.005 7.461 11.099 1.00 0.00 C ATOM 1962 C THR A 117 -8.925 6.572 11.701 1.00 0.00 C ATOM 1963 O THR A 117 -8.735 5.435 11.261 1.00 0.00 O ATOM 1964 CB THR A 117 -11.335 7.289 11.873 1.00 0.00 C ATOM 1965 OG1 THR A 117 -11.148 7.562 13.264 1.00 0.00 O ATOM 1966 CG2 THR A 117 -11.899 5.885 11.704 1.00 0.00 C ATOM 0 H THR A 117 -10.135 6.147 9.482 1.00 0.00 H new ATOM 0 HA THR A 117 -9.697 8.503 11.182 1.00 0.00 H new ATOM 0 HB THR A 117 -12.047 8.002 11.457 1.00 0.00 H new ATOM 0 HG1 THR A 117 -11.999 7.450 13.737 1.00 0.00 H new ATOM 0 HG21 THR A 117 -12.832 5.799 12.260 1.00 0.00 H new ATOM 0 HG22 THR A 117 -12.087 5.693 10.648 1.00 0.00 H new ATOM 0 HG23 THR A 117 -11.182 5.157 12.083 1.00 0.00 H new ATOM 1974 N PHE A 118 -8.221 7.087 12.700 1.00 0.00 N ATOM 1975 CA PHE A 118 -7.127 6.356 13.322 1.00 0.00 C ATOM 1976 C PHE A 118 -7.676 5.340 14.319 1.00 0.00 C ATOM 1977 O PHE A 118 -6.979 4.412 14.727 1.00 0.00 O ATOM 1978 CB PHE A 118 -6.162 7.332 14.008 1.00 0.00 C ATOM 1979 CG PHE A 118 -4.919 6.688 14.554 1.00 0.00 C ATOM 1980 CD1 PHE A 118 -3.910 6.268 13.702 1.00 0.00 C ATOM 1981 CD2 PHE A 118 -4.755 6.511 15.919 1.00 0.00 C ATOM 1982 CE1 PHE A 118 -2.762 5.683 14.200 1.00 0.00 C ATOM 1983 CE2 PHE A 118 -3.610 5.925 16.422 1.00 0.00 C ATOM 1984 CZ PHE A 118 -2.612 5.511 15.562 1.00 0.00 C ATOM 0 H PHE A 118 -8.389 8.011 13.097 1.00 0.00 H new ATOM 0 HA PHE A 118 -6.575 5.816 12.553 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -5.874 8.103 13.293 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -6.686 7.832 14.822 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -4.023 6.400 12.636 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -5.531 6.835 16.597 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -1.983 5.361 13.525 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -3.495 5.791 17.487 1.00 0.00 H new ATOM 0 HZ PHE A 118 -1.716 5.053 15.954 1.00 0.00 H new ATOM 1994 N GLY A 119 -8.940 5.512 14.694 1.00 0.00 N ATOM 1995 CA GLY A 119 -9.586 4.571 15.591 1.00 0.00 C ATOM 1996 C GLY A 119 -9.667 3.182 14.992 1.00 0.00 C ATOM 1997 O GLY A 119 -9.531 2.182 15.693 1.00 0.00 O ATOM 0 H GLY A 119 -9.529 6.288 14.392 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -9.035 4.529 16.531 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -10.590 4.924 15.825 1.00 0.00 H new ATOM 2001 N LEU A 120 -9.850 3.123 13.676 1.00 0.00 N ATOM 2002 CA LEU A 120 -9.945 1.850 12.973 1.00 0.00 C ATOM 2003 C LEU A 120 -8.575 1.210 12.798 1.00 0.00 C ATOM 2004 O LEU A 120 -8.460 0.106 12.278 1.00 0.00 O ATOM 2005 CB LEU A 120 -10.627 2.026 11.614 1.00 0.00 C ATOM 2006 CG LEU A 120 -12.137 2.259 11.678 1.00 0.00 C ATOM 2007 CD1 LEU A 120 -12.712 2.431 10.281 1.00 0.00 C ATOM 2008 CD2 LEU A 120 -12.816 1.102 12.396 1.00 0.00 C ATOM 0 H LEU A 120 -9.935 3.943 13.076 1.00 0.00 H new ATOM 0 HA LEU A 120 -10.555 1.184 13.583 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -10.165 2.868 11.098 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -10.436 1.139 11.010 1.00 0.00 H new ATOM 0 HG LEU A 120 -12.324 3.175 12.238 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -13.787 2.596 10.348 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -12.243 3.288 9.797 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -12.518 1.533 9.695 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -13.891 1.279 12.436 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -12.620 0.175 11.858 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -12.424 1.023 13.410 1.00 0.00 H new ATOM 2020 N LEU A 121 -7.536 1.895 13.245 1.00 0.00 N ATOM 2021 CA LEU A 121 -6.196 1.329 13.218 1.00 0.00 C ATOM 2022 C LEU A 121 -5.975 0.488 14.466 1.00 0.00 C ATOM 2023 O LEU A 121 -4.955 -0.186 14.608 1.00 0.00 O ATOM 2024 CB LEU A 121 -5.130 2.424 13.097 1.00 0.00 C ATOM 2025 CG LEU A 121 -4.824 2.888 11.666 1.00 0.00 C ATOM 2026 CD1 LEU A 121 -4.289 1.733 10.836 1.00 0.00 C ATOM 2027 CD2 LEU A 121 -6.054 3.489 11.005 1.00 0.00 C ATOM 0 H LEU A 121 -7.592 2.838 13.629 1.00 0.00 H new ATOM 0 HA LEU A 121 -6.103 0.692 12.338 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -5.452 3.287 13.680 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -4.207 2.061 13.549 1.00 0.00 H new ATOM 0 HG LEU A 121 -4.061 3.664 11.723 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -4.077 2.079 9.824 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -3.373 1.353 11.289 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -5.032 0.937 10.799 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -5.804 3.808 9.993 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -6.847 2.742 10.965 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -6.394 4.349 11.583 1.00 0.00 H new ATOM 2039 N ASN A 122 -6.948 0.542 15.366 1.00 0.00 N ATOM 2040 CA ASN A 122 -6.972 -0.338 16.524 1.00 0.00 C ATOM 2041 C ASN A 122 -7.696 -1.625 16.162 1.00 0.00 C ATOM 2042 O ASN A 122 -7.356 -2.703 16.651 1.00 0.00 O ATOM 2043 CB ASN A 122 -7.668 0.329 17.718 1.00 0.00 C ATOM 2044 CG ASN A 122 -6.848 1.441 18.345 1.00 0.00 C ATOM 2045 OD1 ASN A 122 -6.093 2.141 17.670 1.00 0.00 O ATOM 2046 ND2 ASN A 122 -6.987 1.613 19.651 1.00 0.00 N ATOM 0 H ASN A 122 -7.734 1.190 15.314 1.00 0.00 H new ATOM 0 HA ASN A 122 -5.944 -0.555 16.812 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -8.626 0.733 17.392 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -7.881 -0.427 18.474 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -6.459 2.344 20.128 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -7.622 1.015 20.180 1.00 0.00 H new ATOM 2053 N THR A 123 -8.688 -1.501 15.285 1.00 0.00 N ATOM 2054 CA THR A 123 -9.451 -2.647 14.822 1.00 0.00 C ATOM 2055 C THR A 123 -8.682 -3.388 13.731 1.00 0.00 C ATOM 2056 O THR A 123 -8.749 -4.614 13.620 1.00 0.00 O ATOM 2057 CB THR A 123 -10.833 -2.216 14.293 1.00 0.00 C ATOM 2058 OG1 THR A 123 -10.678 -1.275 13.225 1.00 0.00 O ATOM 2059 CG2 THR A 123 -11.658 -1.580 15.400 1.00 0.00 C ATOM 0 H THR A 123 -8.981 -0.611 14.881 1.00 0.00 H new ATOM 0 HA THR A 123 -9.603 -3.316 15.669 1.00 0.00 H new ATOM 0 HB THR A 123 -11.349 -3.105 13.929 1.00 0.00 H new ATOM 0 HG1 THR A 123 -9.746 -0.974 13.187 1.00 0.00 H new ATOM 0 HG21 THR A 123 -12.630 -1.283 15.005 1.00 0.00 H new ATOM 0 HG22 THR A 123 -11.799 -2.298 16.208 1.00 0.00 H new ATOM 0 HG23 THR A 123 -11.138 -0.702 15.782 1.00 0.00 H new ATOM 2067 N LEU A 124 -7.954 -2.629 12.921 1.00 0.00 N ATOM 2068 CA LEU A 124 -7.085 -3.205 11.909 1.00 0.00 C ATOM 2069 C LEU A 124 -5.830 -3.762 12.550 1.00 0.00 C ATOM 2070 O LEU A 124 -5.170 -3.086 13.339 1.00 0.00 O ATOM 2071 CB LEU A 124 -6.683 -2.165 10.863 1.00 0.00 C ATOM 2072 CG LEU A 124 -7.786 -1.713 9.913 1.00 0.00 C ATOM 2073 CD1 LEU A 124 -7.252 -0.644 8.975 1.00 0.00 C ATOM 2074 CD2 LEU A 124 -8.327 -2.891 9.121 1.00 0.00 C ATOM 0 H LEU A 124 -7.950 -1.609 12.948 1.00 0.00 H new ATOM 0 HA LEU A 124 -7.641 -4.004 11.418 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -6.295 -1.288 11.382 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -5.864 -2.573 10.270 1.00 0.00 H new ATOM 0 HG LEU A 124 -8.604 -1.294 10.499 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -8.045 -0.325 8.298 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -6.905 0.210 9.557 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -6.422 -1.049 8.396 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -9.113 -2.547 8.449 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -7.522 -3.338 8.539 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -8.735 -3.634 9.807 1.00 0.00 H new ATOM 2086 N ARG A 125 -5.501 -4.989 12.212 1.00 0.00 N ATOM 2087 CA ARG A 125 -4.284 -5.597 12.707 1.00 0.00 C ATOM 2088 C ARG A 125 -3.244 -5.628 11.601 1.00 0.00 C ATOM 2089 O ARG A 125 -3.101 -6.624 10.891 1.00 0.00 O ATOM 2090 CB ARG A 125 -4.540 -7.009 13.243 1.00 0.00 C ATOM 2091 CG ARG A 125 -5.569 -7.060 14.364 1.00 0.00 C ATOM 2092 CD ARG A 125 -6.863 -7.710 13.903 1.00 0.00 C ATOM 2093 NE ARG A 125 -6.661 -9.110 13.536 1.00 0.00 N ATOM 2094 CZ ARG A 125 -7.298 -9.724 12.541 1.00 0.00 C ATOM 2095 NH1 ARG A 125 -8.218 -9.082 11.839 1.00 0.00 N ATOM 2096 NH2 ARG A 125 -7.025 -10.987 12.256 1.00 0.00 N ATOM 0 H ARG A 125 -6.057 -5.585 11.598 1.00 0.00 H new ATOM 0 HA ARG A 125 -3.912 -4.996 13.537 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -4.877 -7.644 12.423 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -3.600 -7.427 13.605 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -5.162 -7.616 15.208 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -5.774 -6.049 14.717 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -7.606 -7.645 14.697 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -7.261 -7.163 13.048 1.00 0.00 H new ATOM 0 HE ARG A 125 -5.988 -9.652 14.078 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -8.442 -8.112 12.059 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -8.703 -9.558 11.078 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -6.325 -11.493 12.799 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -7.514 -11.455 11.493 1.00 0.00 H new ATOM 2110 N LEU A 126 -2.561 -4.506 11.422 1.00 0.00 N ATOM 2111 CA LEU A 126 -1.506 -4.413 10.429 1.00 0.00 C ATOM 2112 C LEU A 126 -0.297 -5.216 10.884 1.00 0.00 C ATOM 2113 O LEU A 126 0.248 -4.988 11.965 1.00 0.00 O ATOM 2114 CB LEU A 126 -1.121 -2.952 10.165 1.00 0.00 C ATOM 2115 CG LEU A 126 -1.944 -2.237 9.087 1.00 0.00 C ATOM 2116 CD1 LEU A 126 -3.383 -2.041 9.537 1.00 0.00 C ATOM 2117 CD2 LEU A 126 -1.306 -0.901 8.732 1.00 0.00 C ATOM 0 H LEU A 126 -2.720 -3.649 11.952 1.00 0.00 H new ATOM 0 HA LEU A 126 -1.875 -4.830 9.492 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -1.215 -2.396 11.098 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.070 -2.918 9.878 1.00 0.00 H new ATOM 0 HG LEU A 126 -1.955 -2.865 8.196 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.943 -1.532 8.753 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.838 -3.012 9.736 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.401 -1.439 10.446 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.902 -0.406 7.965 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -1.262 -0.271 9.621 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -0.297 -1.068 8.355 1.00 0.00 H new ATOM 2129 N ILE A 127 0.097 -6.166 10.059 1.00 0.00 N ATOM 2130 CA ILE A 127 1.196 -7.061 10.374 1.00 0.00 C ATOM 2131 C ILE A 127 2.419 -6.702 9.546 1.00 0.00 C ATOM 2132 O ILE A 127 2.369 -5.801 8.712 1.00 0.00 O ATOM 2133 CB ILE A 127 0.808 -8.531 10.103 1.00 0.00 C ATOM 2134 CG1 ILE A 127 0.289 -8.682 8.665 1.00 0.00 C ATOM 2135 CG2 ILE A 127 -0.234 -9.000 11.111 1.00 0.00 C ATOM 2136 CD1 ILE A 127 -0.115 -10.095 8.298 1.00 0.00 C ATOM 0 H ILE A 127 -0.335 -6.340 9.151 1.00 0.00 H new ATOM 0 HA ILE A 127 1.426 -6.949 11.434 1.00 0.00 H new ATOM 0 HB ILE A 127 1.693 -9.158 10.217 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.569 -8.023 8.529 1.00 0.00 H new ATOM 0 HG13 ILE A 127 1.062 -8.346 7.974 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.497 -10.038 10.906 1.00 0.00 H new ATOM 0 HG22 ILE A 127 0.173 -8.921 12.119 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -1.125 -8.377 11.030 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -0.470 -10.116 7.268 1.00 0.00 H new ATOM 0 HD12 ILE A 127 0.745 -10.757 8.399 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -0.911 -10.430 8.963 1.00 0.00 H new ATOM 2148 N ARG A 128 3.512 -7.402 9.766 1.00 0.00 N ATOM 2149 CA ARG A 128 4.712 -7.163 8.990 1.00 0.00 C ATOM 2150 C ARG A 128 4.779 -8.165 7.853 1.00 0.00 C ATOM 2151 O ARG A 128 4.790 -9.369 8.083 1.00 0.00 O ATOM 2152 CB ARG A 128 5.955 -7.273 9.871 1.00 0.00 C ATOM 2153 CG ARG A 128 7.227 -6.822 9.176 1.00 0.00 C ATOM 2154 CD ARG A 128 8.433 -6.940 10.091 1.00 0.00 C ATOM 2155 NE ARG A 128 8.215 -6.271 11.370 1.00 0.00 N ATOM 2156 CZ ARG A 128 9.180 -5.715 12.094 1.00 0.00 C ATOM 2157 NH1 ARG A 128 10.431 -5.693 11.647 1.00 0.00 N ATOM 2158 NH2 ARG A 128 8.888 -5.170 13.261 1.00 0.00 N ATOM 0 H ARG A 128 3.595 -8.136 10.470 1.00 0.00 H new ATOM 0 HA ARG A 128 4.679 -6.153 8.582 1.00 0.00 H new ATOM 0 HB2 ARG A 128 5.809 -6.674 10.770 1.00 0.00 H new ATOM 0 HB3 ARG A 128 6.073 -8.308 10.193 1.00 0.00 H new ATOM 0 HG2 ARG A 128 7.387 -7.424 8.282 1.00 0.00 H new ATOM 0 HG3 ARG A 128 7.117 -5.788 8.849 1.00 0.00 H new ATOM 0 HD2 ARG A 128 8.654 -7.993 10.265 1.00 0.00 H new ATOM 0 HD3 ARG A 128 9.305 -6.508 9.600 1.00 0.00 H new ATOM 0 HE ARG A 128 7.262 -6.228 11.730 1.00 0.00 H new ATOM 0 HH11 ARG A 128 10.656 -6.105 10.742 1.00 0.00 H new ATOM 0 HH12 ARG A 128 11.166 -5.264 12.209 1.00 0.00 H new ATOM 0 HH21 ARG A 128 7.926 -5.178 13.601 1.00 0.00 H new ATOM 0 HH22 ARG A 128 9.624 -4.741 13.822 1.00 0.00 H new ATOM 2172 N ILE A 129 4.791 -7.670 6.630 1.00 0.00 N ATOM 2173 CA ILE A 129 4.778 -8.537 5.466 1.00 0.00 C ATOM 2174 C ILE A 129 6.100 -8.463 4.707 1.00 0.00 C ATOM 2175 O ILE A 129 6.597 -7.381 4.392 1.00 0.00 O ATOM 2176 CB ILE A 129 3.600 -8.191 4.534 1.00 0.00 C ATOM 2177 CG1 ILE A 129 2.277 -8.549 5.225 1.00 0.00 C ATOM 2178 CG2 ILE A 129 3.729 -8.903 3.194 1.00 0.00 C ATOM 2179 CD1 ILE A 129 1.047 -8.293 4.382 1.00 0.00 C ATOM 0 H ILE A 129 4.810 -6.673 6.416 1.00 0.00 H new ATOM 0 HA ILE A 129 4.648 -9.560 5.819 1.00 0.00 H new ATOM 0 HB ILE A 129 3.615 -7.120 4.332 1.00 0.00 H new ATOM 0 HG12 ILE A 129 2.299 -9.602 5.504 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.196 -7.976 6.149 1.00 0.00 H new ATOM 0 HG21 ILE A 129 2.883 -8.639 2.559 1.00 0.00 H new ATOM 0 HG22 ILE A 129 4.656 -8.599 2.708 1.00 0.00 H new ATOM 0 HG23 ILE A 129 3.740 -9.981 3.354 1.00 0.00 H new ATOM 0 HD11 ILE A 129 0.156 -8.573 4.944 1.00 0.00 H new ATOM 0 HD12 ILE A 129 0.996 -7.235 4.124 1.00 0.00 H new ATOM 0 HD13 ILE A 129 1.101 -8.887 3.469 1.00 0.00 H new ATOM 2191 N ASN A 130 6.662 -9.629 4.436 1.00 0.00 N ATOM 2192 CA ASN A 130 7.949 -9.739 3.771 1.00 0.00 C ATOM 2193 C ASN A 130 7.781 -10.206 2.330 1.00 0.00 C ATOM 2194 O ASN A 130 7.077 -11.186 2.076 1.00 0.00 O ATOM 2195 CB ASN A 130 8.835 -10.727 4.536 1.00 0.00 C ATOM 2196 CG ASN A 130 10.221 -10.880 3.938 1.00 0.00 C ATOM 2197 OD1 ASN A 130 11.143 -10.156 4.297 1.00 0.00 O ATOM 2198 ND2 ASN A 130 10.381 -11.836 3.037 1.00 0.00 N ATOM 0 H ASN A 130 6.238 -10.527 4.671 1.00 0.00 H new ATOM 0 HA ASN A 130 8.418 -8.755 3.758 1.00 0.00 H new ATOM 0 HB2 ASN A 130 8.928 -10.395 5.570 1.00 0.00 H new ATOM 0 HB3 ASN A 130 8.347 -11.701 4.557 1.00 0.00 H new ATOM 0 HD21 ASN A 130 11.297 -11.991 2.615 1.00 0.00 H new ATOM 0 HD22 ASN A 130 9.589 -12.418 2.765 1.00 0.00 H new ATOM 2205 N ASP A 131 8.415 -9.479 1.407 1.00 0.00 N ATOM 2206 CA ASP A 131 8.522 -9.870 -0.006 1.00 0.00 C ATOM 2207 C ASP A 131 7.163 -9.918 -0.714 1.00 0.00 C ATOM 2208 O ASP A 131 6.793 -8.983 -1.419 1.00 0.00 O ATOM 2209 CB ASP A 131 9.248 -11.215 -0.144 1.00 0.00 C ATOM 2210 CG ASP A 131 9.566 -11.562 -1.583 1.00 0.00 C ATOM 2211 OD1 ASP A 131 10.460 -10.916 -2.173 1.00 0.00 O ATOM 2212 OD2 ASP A 131 8.937 -12.489 -2.131 1.00 0.00 O ATOM 0 H ASP A 131 8.874 -8.593 1.619 1.00 0.00 H new ATOM 0 HA ASP A 131 9.109 -9.096 -0.500 1.00 0.00 H new ATOM 0 HB2 ASP A 131 10.173 -11.184 0.431 1.00 0.00 H new ATOM 0 HB3 ASP A 131 8.630 -12.003 0.287 1.00 0.00 H new ATOM 2217 N LYS A 132 6.422 -11.003 -0.539 1.00 0.00 N ATOM 2218 CA LYS A 132 5.128 -11.148 -1.196 1.00 0.00 C ATOM 2219 C LYS A 132 3.992 -10.937 -0.211 1.00 0.00 C ATOM 2220 O LYS A 132 3.263 -9.949 -0.282 1.00 0.00 O ATOM 2221 CB LYS A 132 4.994 -12.528 -1.837 1.00 0.00 C ATOM 2222 CG LYS A 132 5.951 -12.768 -2.990 1.00 0.00 C ATOM 2223 CD LYS A 132 5.812 -14.172 -3.561 1.00 0.00 C ATOM 2224 CE LYS A 132 6.445 -15.234 -2.667 1.00 0.00 C ATOM 2225 NZ LYS A 132 5.698 -15.451 -1.396 1.00 0.00 N ATOM 0 H LYS A 132 6.691 -11.792 0.048 1.00 0.00 H new ATOM 0 HA LYS A 132 5.069 -10.387 -1.974 1.00 0.00 H new ATOM 0 HB2 LYS A 132 5.161 -13.289 -1.075 1.00 0.00 H new ATOM 0 HB3 LYS A 132 3.972 -12.654 -2.194 1.00 0.00 H new ATOM 0 HG2 LYS A 132 5.763 -12.036 -3.776 1.00 0.00 H new ATOM 0 HG3 LYS A 132 6.975 -12.614 -2.650 1.00 0.00 H new ATOM 0 HD2 LYS A 132 4.755 -14.401 -3.699 1.00 0.00 H new ATOM 0 HD3 LYS A 132 6.277 -14.207 -4.546 1.00 0.00 H new ATOM 0 HE2 LYS A 132 6.500 -16.175 -3.214 1.00 0.00 H new ATOM 0 HE3 LYS A 132 7.469 -14.941 -2.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 5.846 -16.427 -1.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 6.043 -14.788 -0.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 4.683 -15.290 -1.558 1.00 0.00 H new ATOM 2239 N GLY A 133 3.848 -11.880 0.703 1.00 0.00 N ATOM 2240 CA GLY A 133 2.789 -11.818 1.681 1.00 0.00 C ATOM 2241 C GLY A 133 3.130 -12.643 2.892 1.00 0.00 C ATOM 2242 O GLY A 133 2.254 -13.222 3.533 1.00 0.00 O ATOM 0 H GLY A 133 4.454 -12.696 0.784 1.00 0.00 H new ATOM 0 HA2 GLY A 133 2.621 -10.782 1.977 1.00 0.00 H new ATOM 0 HA3 GLY A 133 1.859 -12.178 1.240 1.00 0.00 H new ATOM 2246 N GLU A 134 4.415 -12.696 3.198 1.00 0.00 N ATOM 2247 CA GLU A 134 4.901 -13.499 4.306 1.00 0.00 C ATOM 2248 C GLU A 134 4.768 -12.726 5.608 1.00 0.00 C ATOM 2249 O GLU A 134 5.200 -11.577 5.702 1.00 0.00 O ATOM 2250 CB GLU A 134 6.357 -13.931 4.085 1.00 0.00 C ATOM 2251 CG GLU A 134 6.549 -14.934 2.951 1.00 0.00 C ATOM 2252 CD GLU A 134 6.622 -14.294 1.577 1.00 0.00 C ATOM 2253 OE1 GLU A 134 5.559 -14.048 0.963 1.00 0.00 O ATOM 2254 OE2 GLU A 134 7.746 -14.054 1.094 1.00 0.00 O ATOM 0 H GLU A 134 5.143 -12.190 2.692 1.00 0.00 H new ATOM 0 HA GLU A 134 4.292 -14.401 4.364 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.959 -13.046 3.878 1.00 0.00 H new ATOM 0 HB3 GLU A 134 6.739 -14.367 5.008 1.00 0.00 H new ATOM 0 HG2 GLU A 134 7.464 -15.499 3.128 1.00 0.00 H new ATOM 0 HG3 GLU A 134 5.726 -15.648 2.966 1.00 0.00 H new ATOM 2261 N GLN A 135 4.171 -13.357 6.604 1.00 0.00 N ATOM 2262 CA GLN A 135 3.891 -12.693 7.863 1.00 0.00 C ATOM 2263 C GLN A 135 5.091 -12.784 8.797 1.00 0.00 C ATOM 2264 O GLN A 135 5.393 -13.846 9.346 1.00 0.00 O ATOM 2265 CB GLN A 135 2.655 -13.310 8.514 1.00 0.00 C ATOM 2266 CG GLN A 135 2.148 -12.544 9.722 1.00 0.00 C ATOM 2267 CD GLN A 135 0.831 -13.089 10.233 1.00 0.00 C ATOM 2268 OE1 GLN A 135 0.034 -13.634 9.470 1.00 0.00 O ATOM 2269 NE2 GLN A 135 0.587 -12.938 11.524 1.00 0.00 N ATOM 0 H GLN A 135 3.870 -14.331 6.564 1.00 0.00 H new ATOM 0 HA GLN A 135 3.695 -11.639 7.667 1.00 0.00 H new ATOM 0 HB2 GLN A 135 1.858 -13.369 7.773 1.00 0.00 H new ATOM 0 HB3 GLN A 135 2.887 -14.332 8.815 1.00 0.00 H new ATOM 0 HG2 GLN A 135 2.892 -12.590 10.518 1.00 0.00 H new ATOM 0 HG3 GLN A 135 2.027 -11.493 9.459 1.00 0.00 H new ATOM 0 HE21 GLN A 135 1.274 -12.480 12.123 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -0.288 -13.279 11.921 1.00 0.00 H new ATOM 2278 N VAL A 136 5.777 -11.668 8.955 1.00 0.00 N ATOM 2279 CA VAL A 136 6.945 -11.601 9.813 1.00 0.00 C ATOM 2280 C VAL A 136 6.507 -11.403 11.258 1.00 0.00 C ATOM 2281 O VAL A 136 6.320 -10.273 11.714 1.00 0.00 O ATOM 2282 CB VAL A 136 7.889 -10.450 9.404 1.00 0.00 C ATOM 2283 CG1 VAL A 136 9.265 -10.637 10.024 1.00 0.00 C ATOM 2284 CG2 VAL A 136 7.980 -10.332 7.888 1.00 0.00 C ATOM 0 H VAL A 136 5.543 -10.788 8.496 1.00 0.00 H new ATOM 0 HA VAL A 136 7.489 -12.539 9.708 1.00 0.00 H new ATOM 0 HB VAL A 136 7.473 -9.517 9.784 1.00 0.00 H new ATOM 0 HG11 VAL A 136 9.914 -9.815 9.723 1.00 0.00 H new ATOM 0 HG12 VAL A 136 9.176 -10.650 11.110 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.692 -11.580 9.684 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.651 -9.514 7.626 1.00 0.00 H new ATOM 0 HG22 VAL A 136 8.365 -11.264 7.473 1.00 0.00 H new ATOM 0 HG23 VAL A 136 6.990 -10.134 7.478 1.00 0.00 H new ATOM 2294 N VAL A 137 6.306 -12.504 11.958 1.00 0.00 N ATOM 2295 CA VAL A 137 5.839 -12.456 13.331 1.00 0.00 C ATOM 2296 C VAL A 137 7.009 -12.433 14.303 1.00 0.00 C ATOM 2297 O VAL A 137 8.118 -12.845 13.964 1.00 0.00 O ATOM 2298 CB VAL A 137 4.920 -13.649 13.656 1.00 0.00 C ATOM 2299 CG1 VAL A 137 3.616 -13.533 12.888 1.00 0.00 C ATOM 2300 CG2 VAL A 137 5.610 -14.963 13.329 1.00 0.00 C ATOM 0 H VAL A 137 6.459 -13.445 11.597 1.00 0.00 H new ATOM 0 HA VAL A 137 5.265 -11.536 13.443 1.00 0.00 H new ATOM 0 HB VAL A 137 4.701 -13.633 14.724 1.00 0.00 H new ATOM 0 HG11 VAL A 137 2.976 -14.382 13.127 1.00 0.00 H new ATOM 0 HG12 VAL A 137 3.111 -12.608 13.167 1.00 0.00 H new ATOM 0 HG13 VAL A 137 3.823 -13.525 11.818 1.00 0.00 H new ATOM 0 HG21 VAL A 137 4.944 -15.793 13.566 1.00 0.00 H new ATOM 0 HG22 VAL A 137 5.859 -14.989 12.268 1.00 0.00 H new ATOM 0 HG23 VAL A 137 6.523 -15.051 13.918 1.00 0.00 H new