USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=20 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 115 ASN : amide:sc= 1.07 K(o=2.3,f=-2.2!) USER MOD Set 1.2: A 117 THR OG1 : rot 96:sc= 1.21 USER MOD Set 2.1: A 44 HIS : no HE2:sc= 1.96 K(o=2.7,f=-12!) USER MOD Set 2.2: A 103 SER OG : rot -115:sc= 0.747 USER MOD Set 3.1: A 33 SER OG : rot -110:sc= 0.316 USER MOD Set 3.2: A 35 THR OG1 : rot 180:sc= 0.305 USER MOD Single : A 19 HIS : no HE2:sc= 0.519 K(o=0.52,f=-4.2!) USER MOD Single : A 25 LYS NZ :NH3+ -153:sc= 0.06 (180deg=-0.809) USER MOD Single : A 27 MET CE :methyl -169:sc= 0 (180deg=-0.121) USER MOD Single : A 28 GLN : amide:sc= -0.301 K(o=-0.3,f=-1.7) USER MOD Single : A 32 ASN : amide:sc= -0.851 K(o=-0.85,f=-8.3!) USER MOD Single : A 37 LYS NZ :NH3+ -162:sc= -0.048 (180deg=-0.318) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 46 HIS : no HE2:sc= 0.433 K(o=0.43,f=-5.5!) USER MOD Single : A 47 THR OG1 : rot 49:sc= 0.229 USER MOD Single : A 52 GLN : amide:sc= -0.0672 K(o=-0.067,f=-0.68) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -170:sc= -1.42! USER MOD Single : A 76 SER OG : rot 180:sc= 0.0204 USER MOD Single : A 77 ASN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 83 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 84 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -172:sc=-0.00788 (180deg=-0.0955) USER MOD Single : A 99 CYS SG : rot 72:sc= -0.71 USER MOD Single : A 106 LYS NZ :NH3+ -121:sc= 0.825 (180deg=-0.322) USER MOD Single : A 107 ASN : amide:sc= -0.327! C(o=-0.33!,f=-11!) USER MOD Single : A 108 MET CE :methyl 169:sc= -1.23 (180deg=-1.58) USER MOD Single : A 113 ASN : amide:sc= -0.119 X(o=-0.12,f=0.23) USER MOD Single : A 122 ASN : amide:sc= -1.19! K(o=-1.2!,f=-0.017) USER MOD Single : A 123 THR OG1 : rot -21:sc= 0.69 USER MOD Single : A 130 ASN : amide:sc= -0.553 K(o=-0.55,f=-2.7!) USER MOD Single : A 132 LYS NZ :NH3+ -154:sc= -0.115 (180deg=-0.682) USER MOD Single : A 135 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD ----------------------------------------------------------------- ATOM 308 N VAL A 18 0.973 8.978 5.434 1.00 0.00 N ATOM 309 CA VAL A 18 0.519 8.593 4.106 1.00 0.00 C ATOM 310 C VAL A 18 1.148 7.265 3.696 1.00 0.00 C ATOM 311 O VAL A 18 0.536 6.468 2.992 1.00 0.00 O ATOM 312 CB VAL A 18 0.868 9.683 3.062 1.00 0.00 C ATOM 313 CG1 VAL A 18 0.441 9.271 1.661 1.00 0.00 C ATOM 314 CG2 VAL A 18 0.227 11.008 3.442 1.00 0.00 C ATOM 0 HA VAL A 18 -0.565 8.482 4.140 1.00 0.00 H new ATOM 0 HB VAL A 18 1.951 9.803 3.058 1.00 0.00 H new ATOM 0 HG11 VAL A 18 0.701 10.059 0.955 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.952 8.350 1.381 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.637 9.108 1.642 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.482 11.762 2.698 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -0.856 10.890 3.482 1.00 0.00 H new ATOM 0 HG23 VAL A 18 0.594 11.323 4.419 1.00 0.00 H new ATOM 324 N HIS A 19 2.367 7.021 4.173 1.00 0.00 N ATOM 325 CA HIS A 19 3.070 5.771 3.880 1.00 0.00 C ATOM 326 C HIS A 19 2.226 4.575 4.304 1.00 0.00 C ATOM 327 O HIS A 19 2.180 3.562 3.614 1.00 0.00 O ATOM 328 CB HIS A 19 4.419 5.708 4.606 1.00 0.00 C ATOM 329 CG HIS A 19 5.362 6.812 4.248 1.00 0.00 C ATOM 330 ND1 HIS A 19 6.261 6.734 3.210 1.00 0.00 N ATOM 331 CD2 HIS A 19 5.542 8.031 4.805 1.00 0.00 C ATOM 332 CE1 HIS A 19 6.949 7.855 3.145 1.00 0.00 C ATOM 333 NE2 HIS A 19 6.533 8.663 4.099 1.00 0.00 N ATOM 0 H HIS A 19 2.888 7.670 4.763 1.00 0.00 H new ATOM 0 HA HIS A 19 3.244 5.739 2.804 1.00 0.00 H new ATOM 0 HB2 HIS A 19 4.241 5.732 5.681 1.00 0.00 H new ATOM 0 HB3 HIS A 19 4.894 4.753 4.383 1.00 0.00 H new ATOM 0 HD1 HIS A 19 6.377 5.934 2.588 1.00 0.00 H new ATOM 0 HD2 HIS A 19 5.004 8.433 5.651 1.00 0.00 H new ATOM 0 HE1 HIS A 19 7.726 8.076 2.428 1.00 0.00 H new ATOM 342 N GLU A 20 1.549 4.720 5.435 1.00 0.00 N ATOM 343 CA GLU A 20 0.773 3.634 6.013 1.00 0.00 C ATOM 344 C GLU A 20 -0.686 3.707 5.570 1.00 0.00 C ATOM 345 O GLU A 20 -1.202 2.798 4.915 1.00 0.00 O ATOM 346 CB GLU A 20 0.840 3.709 7.543 1.00 0.00 C ATOM 347 CG GLU A 20 2.242 3.925 8.089 1.00 0.00 C ATOM 348 CD GLU A 20 2.251 4.190 9.581 1.00 0.00 C ATOM 349 OE1 GLU A 20 1.662 5.204 10.009 1.00 0.00 O ATOM 350 OE2 GLU A 20 2.843 3.385 10.331 1.00 0.00 O ATOM 0 H GLU A 20 1.523 5.586 5.973 1.00 0.00 H new ATOM 0 HA GLU A 20 1.196 2.691 5.666 1.00 0.00 H new ATOM 0 HB2 GLU A 20 0.198 4.521 7.885 1.00 0.00 H new ATOM 0 HB3 GLU A 20 0.437 2.786 7.960 1.00 0.00 H new ATOM 0 HG2 GLU A 20 2.850 3.046 7.876 1.00 0.00 H new ATOM 0 HG3 GLU A 20 2.704 4.766 7.571 1.00 0.00 H new ATOM 357 N LEU A 21 -1.334 4.817 5.906 1.00 0.00 N ATOM 358 CA LEU A 21 -2.782 4.941 5.772 1.00 0.00 C ATOM 359 C LEU A 21 -3.234 4.980 4.315 1.00 0.00 C ATOM 360 O LEU A 21 -4.318 4.501 3.993 1.00 0.00 O ATOM 361 CB LEU A 21 -3.277 6.191 6.506 1.00 0.00 C ATOM 362 CG LEU A 21 -2.863 6.285 7.978 1.00 0.00 C ATOM 363 CD1 LEU A 21 -3.366 7.582 8.590 1.00 0.00 C ATOM 364 CD2 LEU A 21 -3.385 5.090 8.759 1.00 0.00 C ATOM 0 H LEU A 21 -0.876 5.650 6.276 1.00 0.00 H new ATOM 0 HA LEU A 21 -3.220 4.051 6.223 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -2.905 7.072 5.983 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.365 6.221 6.448 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.774 6.278 8.029 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -3.063 7.632 9.636 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.943 8.428 8.048 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -4.454 7.617 8.525 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.080 5.176 9.802 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.473 5.064 8.700 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -2.977 4.172 8.336 1.00 0.00 H new ATOM 376 N ALA A 22 -2.412 5.533 3.432 1.00 0.00 N ATOM 377 CA ALA A 22 -2.796 5.648 2.027 1.00 0.00 C ATOM 378 C ALA A 22 -2.816 4.283 1.354 1.00 0.00 C ATOM 379 O ALA A 22 -3.611 4.046 0.445 1.00 0.00 O ATOM 380 CB ALA A 22 -1.880 6.600 1.278 1.00 0.00 C ATOM 0 H ALA A 22 -1.489 5.904 3.656 1.00 0.00 H new ATOM 0 HA ALA A 22 -3.805 6.060 1.996 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -2.194 6.662 0.236 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -1.933 7.589 1.733 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -0.855 6.233 1.327 1.00 0.00 H new ATOM 386 N ARG A 23 -1.951 3.381 1.811 1.00 0.00 N ATOM 387 CA ARG A 23 -1.954 2.012 1.310 1.00 0.00 C ATOM 388 C ARG A 23 -3.262 1.335 1.700 1.00 0.00 C ATOM 389 O ARG A 23 -3.872 0.618 0.906 1.00 0.00 O ATOM 390 CB ARG A 23 -0.776 1.209 1.875 1.00 0.00 C ATOM 391 CG ARG A 23 0.597 1.759 1.519 1.00 0.00 C ATOM 392 CD ARG A 23 1.694 0.828 2.019 1.00 0.00 C ATOM 393 NE ARG A 23 3.040 1.379 1.836 1.00 0.00 N ATOM 394 CZ ARG A 23 4.142 0.630 1.742 1.00 0.00 C ATOM 395 NH1 ARG A 23 4.048 -0.696 1.765 1.00 0.00 N ATOM 396 NH2 ARG A 23 5.338 1.199 1.641 1.00 0.00 N ATOM 0 H ARG A 23 -1.245 3.572 2.522 1.00 0.00 H new ATOM 0 HA ARG A 23 -1.855 2.044 0.225 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -0.867 1.171 2.961 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -0.846 0.183 1.513 1.00 0.00 H new ATOM 0 HG2 ARG A 23 0.678 1.878 0.439 1.00 0.00 H new ATOM 0 HG3 ARG A 23 0.724 2.748 1.959 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.533 0.621 3.077 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.623 -0.124 1.493 1.00 0.00 H new ATOM 0 HE ARG A 23 3.141 2.392 1.777 1.00 0.00 H new ATOM 0 HH11 ARG A 23 3.135 -1.141 1.854 1.00 0.00 H new ATOM 0 HH12 ARG A 23 4.889 -1.268 1.693 1.00 0.00 H new ATOM 0 HH21 ARG A 23 5.420 2.216 1.635 1.00 0.00 H new ATOM 0 HH22 ARG A 23 6.174 0.619 1.570 1.00 0.00 H new ATOM 410 N VAL A 24 -3.687 1.591 2.931 1.00 0.00 N ATOM 411 CA VAL A 24 -4.938 1.055 3.450 1.00 0.00 C ATOM 412 C VAL A 24 -6.130 1.690 2.736 1.00 0.00 C ATOM 413 O VAL A 24 -7.082 1.003 2.366 1.00 0.00 O ATOM 414 CB VAL A 24 -5.051 1.298 4.973 1.00 0.00 C ATOM 415 CG1 VAL A 24 -6.331 0.697 5.528 1.00 0.00 C ATOM 416 CG2 VAL A 24 -3.841 0.728 5.693 1.00 0.00 C ATOM 0 H VAL A 24 -3.176 2.173 3.595 1.00 0.00 H new ATOM 0 HA VAL A 24 -4.944 -0.019 3.266 1.00 0.00 H new ATOM 0 HB VAL A 24 -5.082 2.374 5.142 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -6.385 0.883 6.601 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -7.190 1.154 5.037 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -6.338 -0.377 5.345 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -3.937 0.908 6.764 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -3.780 -0.345 5.509 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -2.937 1.211 5.323 1.00 0.00 H new ATOM 426 N LYS A 25 -6.054 3.003 2.531 1.00 0.00 N ATOM 427 CA LYS A 25 -7.094 3.739 1.820 1.00 0.00 C ATOM 428 C LYS A 25 -7.269 3.157 0.422 1.00 0.00 C ATOM 429 O LYS A 25 -8.391 2.936 -0.029 1.00 0.00 O ATOM 430 CB LYS A 25 -6.729 5.235 1.748 1.00 0.00 C ATOM 431 CG LYS A 25 -7.874 6.166 1.340 1.00 0.00 C ATOM 432 CD LYS A 25 -8.259 6.008 -0.124 1.00 0.00 C ATOM 433 CE LYS A 25 -9.341 6.991 -0.536 1.00 0.00 C ATOM 434 NZ LYS A 25 -9.841 6.718 -1.909 1.00 0.00 N ATOM 0 H LYS A 25 -5.277 3.581 2.850 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.037 3.644 2.358 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -6.356 5.549 2.723 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -5.911 5.359 1.039 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.744 5.963 1.965 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.582 7.199 1.526 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.378 6.155 -0.749 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -8.608 4.990 -0.300 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.170 6.937 0.170 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -8.947 8.006 -0.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.200 7.599 -2.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.065 6.347 -2.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.608 6.017 -1.866 1.00 0.00 H new ATOM 448 N PHE A 26 -6.151 2.908 -0.253 1.00 0.00 N ATOM 449 CA PHE A 26 -6.176 2.327 -1.588 1.00 0.00 C ATOM 450 C PHE A 26 -6.929 1.000 -1.578 1.00 0.00 C ATOM 451 O PHE A 26 -7.778 0.752 -2.433 1.00 0.00 O ATOM 452 CB PHE A 26 -4.747 2.129 -2.106 1.00 0.00 C ATOM 453 CG PHE A 26 -4.679 1.535 -3.483 1.00 0.00 C ATOM 454 CD1 PHE A 26 -4.938 2.312 -4.603 1.00 0.00 C ATOM 455 CD2 PHE A 26 -4.359 0.200 -3.660 1.00 0.00 C ATOM 456 CE1 PHE A 26 -4.880 1.765 -5.870 1.00 0.00 C ATOM 457 CE2 PHE A 26 -4.299 -0.350 -4.923 1.00 0.00 C ATOM 458 CZ PHE A 26 -4.559 0.432 -6.030 1.00 0.00 C ATOM 0 H PHE A 26 -5.215 3.101 0.105 1.00 0.00 H new ATOM 0 HA PHE A 26 -6.697 3.012 -2.257 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -4.235 3.091 -2.110 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -4.206 1.483 -1.415 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -5.188 3.356 -4.483 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -4.154 -0.418 -2.799 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.085 2.379 -6.734 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.048 -1.393 -5.046 1.00 0.00 H new ATOM 0 HZ PHE A 26 -4.511 0.002 -7.020 1.00 0.00 H new ATOM 468 N MET A 27 -6.626 0.163 -0.594 1.00 0.00 N ATOM 469 CA MET A 27 -7.290 -1.128 -0.445 1.00 0.00 C ATOM 470 C MET A 27 -8.782 -0.944 -0.188 1.00 0.00 C ATOM 471 O MET A 27 -9.610 -1.556 -0.862 1.00 0.00 O ATOM 472 CB MET A 27 -6.651 -1.919 0.693 1.00 0.00 C ATOM 473 CG MET A 27 -5.202 -2.284 0.428 1.00 0.00 C ATOM 474 SD MET A 27 -4.399 -3.014 1.864 1.00 0.00 S ATOM 475 CE MET A 27 -2.772 -3.367 1.207 1.00 0.00 C ATOM 0 H MET A 27 -5.921 0.356 0.117 1.00 0.00 H new ATOM 0 HA MET A 27 -7.170 -1.685 -1.374 1.00 0.00 H new ATOM 0 HB2 MET A 27 -6.709 -1.334 1.611 1.00 0.00 H new ATOM 0 HB3 MET A 27 -7.224 -2.831 0.859 1.00 0.00 H new ATOM 0 HG2 MET A 27 -5.154 -2.984 -0.406 1.00 0.00 H new ATOM 0 HG3 MET A 27 -4.656 -1.391 0.126 1.00 0.00 H new ATOM 0 HE1 MET A 27 -2.224 -3.994 1.910 1.00 0.00 H new ATOM 0 HE2 MET A 27 -2.869 -3.889 0.255 1.00 0.00 H new ATOM 0 HE3 MET A 27 -2.230 -2.433 1.055 1.00 0.00 H new ATOM 485 N GLN A 28 -9.113 -0.088 0.777 1.00 0.00 N ATOM 486 CA GLN A 28 -10.505 0.228 1.093 1.00 0.00 C ATOM 487 C GLN A 28 -11.247 0.672 -0.161 1.00 0.00 C ATOM 488 O GLN A 28 -12.343 0.196 -0.458 1.00 0.00 O ATOM 489 CB GLN A 28 -10.571 1.348 2.133 1.00 0.00 C ATOM 490 CG GLN A 28 -11.988 1.727 2.536 1.00 0.00 C ATOM 491 CD GLN A 28 -12.059 3.069 3.236 1.00 0.00 C ATOM 492 OE1 GLN A 28 -11.102 3.506 3.870 1.00 0.00 O ATOM 493 NE2 GLN A 28 -13.197 3.736 3.123 1.00 0.00 N ATOM 0 H GLN A 28 -8.432 0.402 1.357 1.00 0.00 H new ATOM 0 HA GLN A 28 -10.975 -0.671 1.493 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -10.021 1.039 3.022 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -10.068 2.230 1.737 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -12.619 1.752 1.648 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -12.392 0.957 3.193 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -13.969 3.340 2.588 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -13.301 4.646 3.571 1.00 0.00 H new ATOM 502 N ASP A 29 -10.626 1.586 -0.890 1.00 0.00 N ATOM 503 CA ASP A 29 -11.207 2.134 -2.107 1.00 0.00 C ATOM 504 C ASP A 29 -11.445 1.036 -3.135 1.00 0.00 C ATOM 505 O ASP A 29 -12.556 0.867 -3.618 1.00 0.00 O ATOM 506 CB ASP A 29 -10.285 3.211 -2.687 1.00 0.00 C ATOM 507 CG ASP A 29 -10.899 3.942 -3.865 1.00 0.00 C ATOM 508 OD1 ASP A 29 -11.560 4.978 -3.640 1.00 0.00 O ATOM 509 OD2 ASP A 29 -10.696 3.502 -5.016 1.00 0.00 O ATOM 0 H ASP A 29 -9.709 1.968 -0.657 1.00 0.00 H new ATOM 0 HA ASP A 29 -12.169 2.583 -1.859 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -10.040 3.931 -1.906 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -9.348 2.750 -3.000 1.00 0.00 H new ATOM 514 N VAL A 30 -10.404 0.265 -3.429 1.00 0.00 N ATOM 515 CA VAL A 30 -10.479 -0.793 -4.437 1.00 0.00 C ATOM 516 C VAL A 30 -11.566 -1.823 -4.112 1.00 0.00 C ATOM 517 O VAL A 30 -12.316 -2.239 -4.995 1.00 0.00 O ATOM 518 CB VAL A 30 -9.112 -1.502 -4.592 1.00 0.00 C ATOM 519 CG1 VAL A 30 -9.232 -2.753 -5.444 1.00 0.00 C ATOM 520 CG2 VAL A 30 -8.091 -0.554 -5.200 1.00 0.00 C ATOM 0 H VAL A 30 -9.491 0.352 -2.982 1.00 0.00 H new ATOM 0 HA VAL A 30 -10.744 -0.314 -5.379 1.00 0.00 H new ATOM 0 HB VAL A 30 -8.777 -1.799 -3.598 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.255 -3.227 -5.533 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -9.931 -3.446 -4.976 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -9.597 -2.484 -6.435 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -7.135 -1.067 -5.303 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -8.436 -0.229 -6.182 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -7.969 0.314 -4.552 1.00 0.00 H new ATOM 530 N VAL A 31 -11.659 -2.210 -2.844 1.00 0.00 N ATOM 531 CA VAL A 31 -12.632 -3.214 -2.416 1.00 0.00 C ATOM 532 C VAL A 31 -14.058 -2.663 -2.458 1.00 0.00 C ATOM 533 O VAL A 31 -15.013 -3.389 -2.743 1.00 0.00 O ATOM 534 CB VAL A 31 -12.319 -3.716 -0.984 1.00 0.00 C ATOM 535 CG1 VAL A 31 -13.376 -4.698 -0.494 1.00 0.00 C ATOM 536 CG2 VAL A 31 -10.944 -4.361 -0.935 1.00 0.00 C ATOM 0 H VAL A 31 -11.073 -1.845 -2.093 1.00 0.00 H new ATOM 0 HA VAL A 31 -12.557 -4.048 -3.113 1.00 0.00 H new ATOM 0 HB VAL A 31 -12.330 -2.851 -0.321 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.125 -5.030 0.513 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.350 -4.209 -0.483 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -13.410 -5.559 -1.162 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -10.741 -4.708 0.078 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -10.915 -5.207 -1.621 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -10.189 -3.631 -1.227 1.00 0.00 H new ATOM 546 N ASN A 32 -14.198 -1.372 -2.192 1.00 0.00 N ATOM 547 CA ASN A 32 -15.519 -0.762 -2.086 1.00 0.00 C ATOM 548 C ASN A 32 -15.868 0.039 -3.336 1.00 0.00 C ATOM 549 O ASN A 32 -16.884 0.737 -3.376 1.00 0.00 O ATOM 550 CB ASN A 32 -15.593 0.127 -0.844 1.00 0.00 C ATOM 551 CG ASN A 32 -15.358 -0.656 0.436 1.00 0.00 C ATOM 552 OD1 ASN A 32 -15.627 -1.855 0.503 1.00 0.00 O ATOM 553 ND2 ASN A 32 -14.865 0.018 1.464 1.00 0.00 N ATOM 0 H ASN A 32 -13.420 -0.729 -2.046 1.00 0.00 H new ATOM 0 HA ASN A 32 -16.251 -1.564 -1.993 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -14.851 0.922 -0.923 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -16.571 0.607 -0.800 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -14.695 -0.456 2.351 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -14.655 1.012 1.369 1.00 0.00 H new ATOM 560 N SER A 33 -15.031 -0.069 -4.354 1.00 0.00 N ATOM 561 CA SER A 33 -15.276 0.586 -5.628 1.00 0.00 C ATOM 562 C SER A 33 -15.295 -0.449 -6.740 1.00 0.00 C ATOM 563 O SER A 33 -14.579 -1.447 -6.675 1.00 0.00 O ATOM 564 CB SER A 33 -14.200 1.642 -5.904 1.00 0.00 C ATOM 565 OG SER A 33 -14.357 2.230 -7.185 1.00 0.00 O ATOM 0 H SER A 33 -14.167 -0.610 -4.322 1.00 0.00 H new ATOM 0 HA SER A 33 -16.244 1.086 -5.588 1.00 0.00 H new ATOM 0 HB2 SER A 33 -14.247 2.418 -5.140 1.00 0.00 H new ATOM 0 HB3 SER A 33 -13.214 1.184 -5.833 1.00 0.00 H new ATOM 0 HG SER A 33 -13.629 1.936 -7.771 1.00 0.00 H new ATOM 571 N ASP A 34 -16.100 -0.194 -7.766 1.00 0.00 N ATOM 572 CA ASP A 34 -16.273 -1.123 -8.886 1.00 0.00 C ATOM 573 C ASP A 34 -14.976 -1.338 -9.676 1.00 0.00 C ATOM 574 O ASP A 34 -14.960 -2.054 -10.681 1.00 0.00 O ATOM 575 CB ASP A 34 -17.367 -0.607 -9.830 1.00 0.00 C ATOM 576 CG ASP A 34 -17.071 0.776 -10.364 1.00 0.00 C ATOM 577 OD1 ASP A 34 -16.343 0.894 -11.375 1.00 0.00 O ATOM 578 OD2 ASP A 34 -17.570 1.761 -9.778 1.00 0.00 O ATOM 0 H ASP A 34 -16.652 0.660 -7.848 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.563 -2.084 -8.462 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -17.477 -1.299 -10.665 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -18.320 -0.592 -9.301 1.00 0.00 H new ATOM 583 N THR A 35 -13.898 -0.703 -9.233 1.00 0.00 N ATOM 584 CA THR A 35 -12.588 -0.894 -9.826 1.00 0.00 C ATOM 585 C THR A 35 -12.191 -2.376 -9.800 1.00 0.00 C ATOM 586 O THR A 35 -11.874 -2.960 -10.837 1.00 0.00 O ATOM 587 CB THR A 35 -11.538 -0.049 -9.079 1.00 0.00 C ATOM 588 OG1 THR A 35 -12.021 1.298 -8.942 1.00 0.00 O ATOM 589 CG2 THR A 35 -10.209 -0.042 -9.820 1.00 0.00 C ATOM 0 H THR A 35 -13.911 -0.044 -8.455 1.00 0.00 H new ATOM 0 HA THR A 35 -12.630 -0.568 -10.865 1.00 0.00 H new ATOM 0 HB THR A 35 -11.376 -0.490 -8.096 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.356 1.837 -8.466 1.00 0.00 H new ATOM 0 HG21 THR A 35 -9.488 0.562 -9.269 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.836 -1.062 -9.907 1.00 0.00 H new ATOM 0 HG23 THR A 35 -10.350 0.379 -10.815 1.00 0.00 H new ATOM 597 N PHE A 36 -12.234 -2.979 -8.615 1.00 0.00 N ATOM 598 CA PHE A 36 -11.945 -4.405 -8.465 1.00 0.00 C ATOM 599 C PHE A 36 -12.888 -5.026 -7.442 1.00 0.00 C ATOM 600 O PHE A 36 -12.561 -6.023 -6.802 1.00 0.00 O ATOM 601 CB PHE A 36 -10.491 -4.632 -8.035 1.00 0.00 C ATOM 602 CG PHE A 36 -9.479 -4.317 -9.102 1.00 0.00 C ATOM 603 CD1 PHE A 36 -9.312 -5.163 -10.186 1.00 0.00 C ATOM 604 CD2 PHE A 36 -8.696 -3.177 -9.019 1.00 0.00 C ATOM 605 CE1 PHE A 36 -8.384 -4.878 -11.168 1.00 0.00 C ATOM 606 CE2 PHE A 36 -7.765 -2.886 -9.999 1.00 0.00 C ATOM 607 CZ PHE A 36 -7.609 -3.738 -11.075 1.00 0.00 C ATOM 0 H PHE A 36 -12.466 -2.503 -7.743 1.00 0.00 H new ATOM 0 HA PHE A 36 -12.095 -4.883 -9.433 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -10.282 -4.018 -7.159 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -10.371 -5.672 -7.731 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -9.915 -6.056 -10.264 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -8.814 -2.508 -8.179 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -8.264 -5.546 -12.008 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -7.161 -1.994 -9.923 1.00 0.00 H new ATOM 0 HZ PHE A 36 -6.883 -3.513 -11.842 1.00 0.00 H new ATOM 617 N LYS A 37 -14.080 -4.451 -7.342 1.00 0.00 N ATOM 618 CA LYS A 37 -15.072 -4.863 -6.352 1.00 0.00 C ATOM 619 C LYS A 37 -15.585 -6.278 -6.631 1.00 0.00 C ATOM 620 O LYS A 37 -16.264 -6.885 -5.797 1.00 0.00 O ATOM 621 CB LYS A 37 -16.227 -3.862 -6.352 1.00 0.00 C ATOM 622 CG LYS A 37 -17.217 -4.040 -5.221 1.00 0.00 C ATOM 623 CD LYS A 37 -18.252 -2.933 -5.229 1.00 0.00 C ATOM 624 CE LYS A 37 -19.335 -3.187 -4.201 1.00 0.00 C ATOM 625 NZ LYS A 37 -20.133 -4.398 -4.527 1.00 0.00 N ATOM 0 H LYS A 37 -14.388 -3.687 -7.943 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.601 -4.877 -5.369 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -15.816 -2.854 -6.302 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -16.760 -3.942 -7.299 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -17.712 -5.007 -5.314 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -16.689 -4.043 -4.267 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -17.768 -1.978 -5.023 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -18.699 -2.857 -6.220 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -18.881 -3.305 -3.217 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -19.995 -2.321 -4.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -21.030 -4.375 -4.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -20.331 -4.419 -5.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -19.597 -5.249 -4.261 1.00 0.00 H new ATOM 639 N GLY A 38 -15.262 -6.798 -7.809 1.00 0.00 N ATOM 640 CA GLY A 38 -15.601 -8.168 -8.134 1.00 0.00 C ATOM 641 C GLY A 38 -14.797 -9.152 -7.307 1.00 0.00 C ATOM 642 O GLY A 38 -15.160 -10.330 -7.193 1.00 0.00 O ATOM 0 H GLY A 38 -14.770 -6.293 -8.546 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -16.665 -8.331 -7.962 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -15.418 -8.347 -9.194 1.00 0.00 H new ATOM 646 N GLN A 39 -13.699 -8.671 -6.741 1.00 0.00 N ATOM 647 CA GLN A 39 -12.852 -9.472 -5.869 1.00 0.00 C ATOM 648 C GLN A 39 -12.852 -8.881 -4.463 1.00 0.00 C ATOM 649 O GLN A 39 -12.091 -7.963 -4.168 1.00 0.00 O ATOM 650 CB GLN A 39 -11.426 -9.529 -6.420 1.00 0.00 C ATOM 651 CG GLN A 39 -11.334 -10.169 -7.794 1.00 0.00 C ATOM 652 CD GLN A 39 -9.963 -10.027 -8.421 1.00 0.00 C ATOM 653 OE1 GLN A 39 -8.945 -9.959 -7.734 1.00 0.00 O ATOM 654 NE2 GLN A 39 -9.925 -9.980 -9.742 1.00 0.00 N ATOM 0 H GLN A 39 -13.370 -7.714 -6.873 1.00 0.00 H new ATOM 0 HA GLN A 39 -13.247 -10.487 -5.827 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -11.024 -8.517 -6.471 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.798 -10.087 -5.725 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -11.583 -11.227 -7.714 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -12.077 -9.716 -8.451 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -10.790 -10.039 -10.280 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -9.031 -9.884 -10.223 1.00 0.00 H new ATOM 663 N PRO A 40 -13.729 -9.386 -3.582 1.00 0.00 N ATOM 664 CA PRO A 40 -13.873 -8.868 -2.218 1.00 0.00 C ATOM 665 C PRO A 40 -12.644 -9.145 -1.358 1.00 0.00 C ATOM 666 O PRO A 40 -12.342 -8.396 -0.429 1.00 0.00 O ATOM 667 CB PRO A 40 -15.093 -9.619 -1.663 1.00 0.00 C ATOM 668 CG PRO A 40 -15.754 -10.237 -2.850 1.00 0.00 C ATOM 669 CD PRO A 40 -14.661 -10.490 -3.844 1.00 0.00 C ATOM 0 HA PRO A 40 -13.989 -7.784 -2.212 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -14.792 -10.379 -0.942 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -15.770 -8.939 -1.146 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -16.257 -11.165 -2.578 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -16.513 -9.573 -3.264 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -14.191 -11.462 -3.692 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -15.033 -10.472 -4.869 1.00 0.00 H new ATOM 677 N ILE A 41 -11.944 -10.227 -1.663 1.00 0.00 N ATOM 678 CA ILE A 41 -10.758 -10.602 -0.909 1.00 0.00 C ATOM 679 C ILE A 41 -9.555 -10.688 -1.838 1.00 0.00 C ATOM 680 O ILE A 41 -9.653 -11.229 -2.942 1.00 0.00 O ATOM 681 CB ILE A 41 -10.926 -11.962 -0.193 1.00 0.00 C ATOM 682 CG1 ILE A 41 -12.274 -12.049 0.533 1.00 0.00 C ATOM 683 CG2 ILE A 41 -9.788 -12.173 0.796 1.00 0.00 C ATOM 684 CD1 ILE A 41 -12.457 -11.019 1.626 1.00 0.00 C ATOM 0 H ILE A 41 -12.177 -10.861 -2.428 1.00 0.00 H new ATOM 0 HA ILE A 41 -10.606 -9.832 -0.153 1.00 0.00 H new ATOM 0 HB ILE A 41 -10.900 -12.746 -0.949 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -13.075 -11.934 -0.197 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -12.377 -13.044 0.966 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -9.914 -13.133 1.296 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -8.837 -12.163 0.264 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -9.797 -11.374 1.537 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -13.435 -11.149 2.089 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -11.679 -11.146 2.379 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -12.388 -10.019 1.199 1.00 0.00 H new ATOM 696 N PHE A 42 -8.425 -10.161 -1.397 1.00 0.00 N ATOM 697 CA PHE A 42 -7.211 -10.198 -2.194 1.00 0.00 C ATOM 698 C PHE A 42 -6.158 -11.068 -1.525 1.00 0.00 C ATOM 699 O PHE A 42 -6.187 -11.281 -0.315 1.00 0.00 O ATOM 700 CB PHE A 42 -6.671 -8.786 -2.425 1.00 0.00 C ATOM 701 CG PHE A 42 -7.556 -7.945 -3.298 1.00 0.00 C ATOM 702 CD1 PHE A 42 -7.552 -8.117 -4.673 1.00 0.00 C ATOM 703 CD2 PHE A 42 -8.395 -6.992 -2.748 1.00 0.00 C ATOM 704 CE1 PHE A 42 -8.367 -7.350 -5.483 1.00 0.00 C ATOM 705 CE2 PHE A 42 -9.213 -6.222 -3.552 1.00 0.00 C ATOM 706 CZ PHE A 42 -9.199 -6.401 -4.922 1.00 0.00 C ATOM 0 H PHE A 42 -8.323 -9.703 -0.492 1.00 0.00 H new ATOM 0 HA PHE A 42 -7.454 -10.634 -3.163 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -6.546 -8.291 -1.462 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -5.682 -8.853 -2.879 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -6.904 -8.859 -5.116 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -8.411 -6.848 -1.678 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.354 -7.492 -6.553 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -9.863 -5.481 -3.110 1.00 0.00 H new ATOM 0 HZ PHE A 42 -9.837 -5.800 -5.553 1.00 0.00 H new ATOM 716 N ASP A 43 -5.236 -11.574 -2.323 1.00 0.00 N ATOM 717 CA ASP A 43 -4.194 -12.464 -1.830 1.00 0.00 C ATOM 718 C ASP A 43 -2.930 -11.692 -1.457 1.00 0.00 C ATOM 719 O ASP A 43 -2.863 -10.468 -1.607 1.00 0.00 O ATOM 720 CB ASP A 43 -3.873 -13.523 -2.883 1.00 0.00 C ATOM 721 CG ASP A 43 -3.527 -12.909 -4.221 1.00 0.00 C ATOM 722 OD1 ASP A 43 -4.455 -12.631 -5.009 1.00 0.00 O ATOM 723 OD2 ASP A 43 -2.336 -12.687 -4.488 1.00 0.00 O ATOM 0 H ASP A 43 -5.185 -11.383 -3.324 1.00 0.00 H new ATOM 0 HA ASP A 43 -4.565 -12.951 -0.928 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -3.039 -14.135 -2.539 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -4.729 -14.188 -3.000 1.00 0.00 H new ATOM 728 N HIS A 44 -1.927 -12.423 -0.984 1.00 0.00 N ATOM 729 CA HIS A 44 -0.683 -11.828 -0.498 1.00 0.00 C ATOM 730 C HIS A 44 0.207 -11.401 -1.662 1.00 0.00 C ATOM 731 O HIS A 44 1.041 -10.502 -1.528 1.00 0.00 O ATOM 732 CB HIS A 44 0.062 -12.817 0.412 1.00 0.00 C ATOM 733 CG HIS A 44 -0.674 -13.158 1.679 1.00 0.00 C ATOM 734 ND1 HIS A 44 -0.151 -12.952 2.935 1.00 0.00 N ATOM 735 CD2 HIS A 44 -1.900 -13.701 1.876 1.00 0.00 C ATOM 736 CE1 HIS A 44 -1.019 -13.349 3.845 1.00 0.00 C ATOM 737 NE2 HIS A 44 -2.091 -13.807 3.232 1.00 0.00 N ATOM 0 H HIS A 44 -1.951 -13.441 -0.926 1.00 0.00 H new ATOM 0 HA HIS A 44 -0.933 -10.939 0.082 1.00 0.00 H new ATOM 0 HB2 HIS A 44 0.251 -13.735 -0.144 1.00 0.00 H new ATOM 0 HB3 HIS A 44 1.033 -12.396 0.671 1.00 0.00 H new ATOM 0 HD1 HIS A 44 0.767 -12.553 3.132 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -2.599 -13.996 1.107 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -0.875 -13.306 4.914 1.00 0.00 H new ATOM 746 N ALA A 45 0.014 -12.030 -2.814 1.00 0.00 N ATOM 747 CA ALA A 45 0.753 -11.659 -4.009 1.00 0.00 C ATOM 748 C ALA A 45 0.172 -10.379 -4.588 1.00 0.00 C ATOM 749 O ALA A 45 0.902 -9.495 -5.039 1.00 0.00 O ATOM 750 CB ALA A 45 0.729 -12.784 -5.032 1.00 0.00 C ATOM 0 H ALA A 45 -0.646 -12.797 -2.944 1.00 0.00 H new ATOM 0 HA ALA A 45 1.795 -11.483 -3.743 1.00 0.00 H new ATOM 0 HB1 ALA A 45 1.289 -12.483 -5.917 1.00 0.00 H new ATOM 0 HB2 ALA A 45 1.183 -13.677 -4.602 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -0.302 -13.000 -5.311 1.00 0.00 H new ATOM 756 N HIS A 46 -1.154 -10.279 -4.550 1.00 0.00 N ATOM 757 CA HIS A 46 -1.841 -9.048 -4.917 1.00 0.00 C ATOM 758 C HIS A 46 -1.496 -7.935 -3.940 1.00 0.00 C ATOM 759 O HIS A 46 -1.599 -6.757 -4.273 1.00 0.00 O ATOM 760 CB HIS A 46 -3.357 -9.248 -4.973 1.00 0.00 C ATOM 761 CG HIS A 46 -3.869 -9.504 -6.357 1.00 0.00 C ATOM 762 ND1 HIS A 46 -4.314 -10.731 -6.785 1.00 0.00 N ATOM 763 CD2 HIS A 46 -3.999 -8.673 -7.414 1.00 0.00 C ATOM 764 CE1 HIS A 46 -4.692 -10.644 -8.045 1.00 0.00 C ATOM 765 NE2 HIS A 46 -4.512 -9.404 -8.456 1.00 0.00 N ATOM 0 H HIS A 46 -1.774 -11.038 -4.268 1.00 0.00 H new ATOM 0 HA HIS A 46 -1.502 -8.765 -5.913 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.630 -10.086 -4.331 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -3.849 -8.363 -4.569 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -4.347 -11.577 -6.217 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -3.745 -7.623 -7.435 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.084 -11.454 -8.642 1.00 0.00 H new ATOM 774 N THR A 47 -1.091 -8.315 -2.732 1.00 0.00 N ATOM 775 CA THR A 47 -0.570 -7.355 -1.775 1.00 0.00 C ATOM 776 C THR A 47 0.679 -6.694 -2.344 1.00 0.00 C ATOM 777 O THR A 47 0.731 -5.476 -2.492 1.00 0.00 O ATOM 778 CB THR A 47 -0.221 -8.014 -0.426 1.00 0.00 C ATOM 779 OG1 THR A 47 -1.397 -8.585 0.165 1.00 0.00 O ATOM 780 CG2 THR A 47 0.407 -6.999 0.522 1.00 0.00 C ATOM 0 H THR A 47 -1.115 -9.278 -2.397 1.00 0.00 H new ATOM 0 HA THR A 47 -1.349 -6.613 -1.597 1.00 0.00 H new ATOM 0 HB THR A 47 0.503 -8.808 -0.607 1.00 0.00 H new ATOM 0 HG1 THR A 47 -1.868 -9.127 -0.502 1.00 0.00 H new ATOM 0 HG21 THR A 47 0.646 -7.484 1.468 1.00 0.00 H new ATOM 0 HG22 THR A 47 1.320 -6.602 0.077 1.00 0.00 H new ATOM 0 HG23 THR A 47 -0.295 -6.184 0.699 1.00 0.00 H new ATOM 788 N ARG A 48 1.673 -7.514 -2.684 1.00 0.00 N ATOM 789 CA ARG A 48 2.911 -7.016 -3.276 1.00 0.00 C ATOM 790 C ARG A 48 2.609 -6.204 -4.532 1.00 0.00 C ATOM 791 O ARG A 48 3.221 -5.165 -4.770 1.00 0.00 O ATOM 792 CB ARG A 48 3.849 -8.175 -3.622 1.00 0.00 C ATOM 793 CG ARG A 48 5.276 -7.732 -3.916 1.00 0.00 C ATOM 794 CD ARG A 48 6.170 -8.910 -4.272 1.00 0.00 C ATOM 795 NE ARG A 48 7.586 -8.608 -4.050 1.00 0.00 N ATOM 796 CZ ARG A 48 8.561 -8.861 -4.923 1.00 0.00 C ATOM 797 NH1 ARG A 48 8.281 -9.365 -6.119 1.00 0.00 N ATOM 798 NH2 ARG A 48 9.823 -8.603 -4.595 1.00 0.00 N ATOM 0 H ARG A 48 1.644 -8.526 -2.559 1.00 0.00 H new ATOM 0 HA ARG A 48 3.403 -6.373 -2.545 1.00 0.00 H new ATOM 0 HB2 ARG A 48 3.860 -8.883 -2.794 1.00 0.00 H new ATOM 0 HB3 ARG A 48 3.455 -8.705 -4.489 1.00 0.00 H new ATOM 0 HG2 ARG A 48 5.273 -7.017 -4.738 1.00 0.00 H new ATOM 0 HG3 ARG A 48 5.683 -7.216 -3.046 1.00 0.00 H new ATOM 0 HD2 ARG A 48 5.885 -9.776 -3.674 1.00 0.00 H new ATOM 0 HD3 ARG A 48 6.016 -9.180 -5.317 1.00 0.00 H new ATOM 0 HE ARG A 48 7.844 -8.173 -3.164 1.00 0.00 H new ATOM 0 HH11 ARG A 48 7.314 -9.562 -6.376 1.00 0.00 H new ATOM 0 HH12 ARG A 48 9.033 -9.556 -6.781 1.00 0.00 H new ATOM 0 HH21 ARG A 48 10.042 -8.213 -3.678 1.00 0.00 H new ATOM 0 HH22 ARG A 48 10.572 -8.795 -5.260 1.00 0.00 H new ATOM 812 N GLU A 49 1.655 -6.688 -5.321 1.00 0.00 N ATOM 813 CA GLU A 49 1.238 -6.008 -6.542 1.00 0.00 C ATOM 814 C GLU A 49 0.704 -4.606 -6.242 1.00 0.00 C ATOM 815 O GLU A 49 1.227 -3.613 -6.746 1.00 0.00 O ATOM 816 CB GLU A 49 0.161 -6.826 -7.260 1.00 0.00 C ATOM 817 CG GLU A 49 -0.304 -6.204 -8.566 1.00 0.00 C ATOM 818 CD GLU A 49 -1.506 -6.913 -9.150 1.00 0.00 C ATOM 819 OE1 GLU A 49 -1.322 -7.913 -9.873 1.00 0.00 O ATOM 820 OE2 GLU A 49 -2.642 -6.476 -8.885 1.00 0.00 O ATOM 0 H GLU A 49 1.153 -7.556 -5.134 1.00 0.00 H new ATOM 0 HA GLU A 49 2.112 -5.912 -7.186 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.548 -7.825 -7.460 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -0.696 -6.944 -6.597 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -0.551 -5.156 -8.398 1.00 0.00 H new ATOM 0 HG3 GLU A 49 0.513 -6.227 -9.287 1.00 0.00 H new ATOM 827 N PHE A 50 -0.331 -4.534 -5.410 1.00 0.00 N ATOM 828 CA PHE A 50 -0.969 -3.261 -5.094 1.00 0.00 C ATOM 829 C PHE A 50 -0.037 -2.335 -4.325 1.00 0.00 C ATOM 830 O PHE A 50 -0.059 -1.120 -4.531 1.00 0.00 O ATOM 831 CB PHE A 50 -2.268 -3.477 -4.316 1.00 0.00 C ATOM 832 CG PHE A 50 -3.445 -3.807 -5.193 1.00 0.00 C ATOM 833 CD1 PHE A 50 -3.579 -3.213 -6.439 1.00 0.00 C ATOM 834 CD2 PHE A 50 -4.424 -4.694 -4.771 1.00 0.00 C ATOM 835 CE1 PHE A 50 -4.660 -3.496 -7.248 1.00 0.00 C ATOM 836 CE2 PHE A 50 -5.511 -4.980 -5.576 1.00 0.00 C ATOM 837 CZ PHE A 50 -5.629 -4.379 -6.815 1.00 0.00 C ATOM 0 H PHE A 50 -0.745 -5.341 -4.943 1.00 0.00 H new ATOM 0 HA PHE A 50 -1.207 -2.779 -6.042 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.122 -4.284 -3.598 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -2.493 -2.577 -3.743 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.826 -2.519 -6.781 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -4.336 -5.166 -3.804 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.748 -3.028 -8.217 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -6.267 -5.672 -5.237 1.00 0.00 H new ATOM 0 HZ PHE A 50 -6.479 -4.600 -7.444 1.00 0.00 H new ATOM 847 N ILE A 51 0.784 -2.896 -3.444 1.00 0.00 N ATOM 848 CA ILE A 51 1.758 -2.093 -2.722 1.00 0.00 C ATOM 849 C ILE A 51 2.755 -1.475 -3.702 1.00 0.00 C ATOM 850 O ILE A 51 3.039 -0.277 -3.644 1.00 0.00 O ATOM 851 CB ILE A 51 2.521 -2.901 -1.647 1.00 0.00 C ATOM 852 CG1 ILE A 51 1.582 -3.311 -0.504 1.00 0.00 C ATOM 853 CG2 ILE A 51 3.689 -2.091 -1.104 1.00 0.00 C ATOM 854 CD1 ILE A 51 0.825 -2.154 0.114 1.00 0.00 C ATOM 0 H ILE A 51 0.794 -3.890 -3.216 1.00 0.00 H new ATOM 0 HA ILE A 51 1.202 -1.310 -2.206 1.00 0.00 H new ATOM 0 HB ILE A 51 2.909 -3.806 -2.114 1.00 0.00 H new ATOM 0 HG12 ILE A 51 0.866 -4.042 -0.880 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.165 -3.807 0.272 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.216 -2.674 -0.348 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.373 -1.849 -1.917 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.316 -1.170 -0.657 1.00 0.00 H new ATOM 0 HD11 ILE A 51 0.183 -2.525 0.913 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.533 -1.432 0.522 1.00 0.00 H new ATOM 0 HD13 ILE A 51 0.213 -1.671 -0.648 1.00 0.00 H new ATOM 866 N GLN A 52 3.259 -2.298 -4.619 1.00 0.00 N ATOM 867 CA GLN A 52 4.219 -1.844 -5.618 1.00 0.00 C ATOM 868 C GLN A 52 3.586 -0.814 -6.545 1.00 0.00 C ATOM 869 O GLN A 52 4.244 0.134 -6.961 1.00 0.00 O ATOM 870 CB GLN A 52 4.755 -3.029 -6.430 1.00 0.00 C ATOM 871 CG GLN A 52 5.769 -2.642 -7.500 1.00 0.00 C ATOM 872 CD GLN A 52 6.984 -1.930 -6.933 1.00 0.00 C ATOM 873 OE1 GLN A 52 7.381 -2.160 -5.792 1.00 0.00 O ATOM 874 NE2 GLN A 52 7.587 -1.061 -7.727 1.00 0.00 N ATOM 0 H GLN A 52 3.016 -3.286 -4.689 1.00 0.00 H new ATOM 0 HA GLN A 52 5.053 -1.374 -5.097 1.00 0.00 H new ATOM 0 HB2 GLN A 52 5.217 -3.743 -5.748 1.00 0.00 H new ATOM 0 HB3 GLN A 52 3.917 -3.538 -6.906 1.00 0.00 H new ATOM 0 HG2 GLN A 52 6.093 -3.539 -8.027 1.00 0.00 H new ATOM 0 HG3 GLN A 52 5.286 -1.997 -8.235 1.00 0.00 H new ATOM 0 HE21 GLN A 52 7.229 -0.896 -8.668 1.00 0.00 H new ATOM 0 HE22 GLN A 52 8.410 -0.556 -7.399 1.00 0.00 H new ATOM 883 N SER A 53 2.308 -1.005 -6.860 1.00 0.00 N ATOM 884 CA SER A 53 1.568 -0.057 -7.687 1.00 0.00 C ATOM 885 C SER A 53 1.610 1.336 -7.063 1.00 0.00 C ATOM 886 O SER A 53 1.895 2.328 -7.740 1.00 0.00 O ATOM 887 CB SER A 53 0.117 -0.526 -7.854 1.00 0.00 C ATOM 888 OG SER A 53 -0.659 0.423 -8.569 1.00 0.00 O ATOM 0 H SER A 53 1.762 -1.810 -6.554 1.00 0.00 H new ATOM 0 HA SER A 53 2.035 -0.008 -8.671 1.00 0.00 H new ATOM 0 HB2 SER A 53 0.101 -1.481 -8.380 1.00 0.00 H new ATOM 0 HB3 SER A 53 -0.327 -0.695 -6.873 1.00 0.00 H new ATOM 0 HG SER A 53 -1.577 0.093 -8.659 1.00 0.00 H new ATOM 894 N PHE A 54 1.358 1.394 -5.760 1.00 0.00 N ATOM 895 CA PHE A 54 1.374 2.652 -5.027 1.00 0.00 C ATOM 896 C PHE A 54 2.764 3.290 -5.079 1.00 0.00 C ATOM 897 O PHE A 54 2.901 4.489 -5.328 1.00 0.00 O ATOM 898 CB PHE A 54 0.950 2.413 -3.573 1.00 0.00 C ATOM 899 CG PHE A 54 0.834 3.669 -2.754 1.00 0.00 C ATOM 900 CD1 PHE A 54 -0.289 4.474 -2.853 1.00 0.00 C ATOM 901 CD2 PHE A 54 1.848 4.040 -1.884 1.00 0.00 C ATOM 902 CE1 PHE A 54 -0.399 5.628 -2.100 1.00 0.00 C ATOM 903 CE2 PHE A 54 1.742 5.192 -1.128 1.00 0.00 C ATOM 904 CZ PHE A 54 0.618 5.987 -1.237 1.00 0.00 C ATOM 0 H PHE A 54 1.139 0.578 -5.188 1.00 0.00 H new ATOM 0 HA PHE A 54 0.668 3.338 -5.495 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -0.010 1.897 -3.566 1.00 0.00 H new ATOM 0 HB3 PHE A 54 1.673 1.748 -3.099 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -1.087 4.197 -3.526 1.00 0.00 H new ATOM 0 HD2 PHE A 54 2.730 3.422 -1.796 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -1.279 6.248 -2.186 1.00 0.00 H new ATOM 0 HE2 PHE A 54 2.537 5.470 -0.453 1.00 0.00 H new ATOM 0 HZ PHE A 54 0.534 6.888 -0.648 1.00 0.00 H new ATOM 914 N ILE A 55 3.792 2.475 -4.865 1.00 0.00 N ATOM 915 CA ILE A 55 5.170 2.959 -4.856 1.00 0.00 C ATOM 916 C ILE A 55 5.615 3.370 -6.261 1.00 0.00 C ATOM 917 O ILE A 55 6.394 4.309 -6.431 1.00 0.00 O ATOM 918 CB ILE A 55 6.140 1.883 -4.314 1.00 0.00 C ATOM 919 CG1 ILE A 55 5.631 1.322 -2.984 1.00 0.00 C ATOM 920 CG2 ILE A 55 7.535 2.466 -4.139 1.00 0.00 C ATOM 921 CD1 ILE A 55 6.508 0.232 -2.402 1.00 0.00 C ATOM 0 H ILE A 55 3.697 1.474 -4.695 1.00 0.00 H new ATOM 0 HA ILE A 55 5.199 3.828 -4.198 1.00 0.00 H new ATOM 0 HB ILE A 55 6.189 1.069 -5.038 1.00 0.00 H new ATOM 0 HG12 ILE A 55 5.554 2.136 -2.263 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.625 0.927 -3.128 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.206 1.696 -3.757 1.00 0.00 H new ATOM 0 HG22 ILE A 55 7.903 2.823 -5.101 1.00 0.00 H new ATOM 0 HG23 ILE A 55 7.497 3.296 -3.434 1.00 0.00 H new ATOM 0 HD11 ILE A 55 6.082 -0.114 -1.461 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.566 -0.601 -3.102 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.508 0.626 -2.224 1.00 0.00 H new ATOM 933 N GLU A 56 5.110 2.663 -7.259 1.00 0.00 N ATOM 934 CA GLU A 56 5.477 2.902 -8.648 1.00 0.00 C ATOM 935 C GLU A 56 4.935 4.245 -9.132 1.00 0.00 C ATOM 936 O GLU A 56 5.536 4.902 -9.980 1.00 0.00 O ATOM 937 CB GLU A 56 4.940 1.769 -9.529 1.00 0.00 C ATOM 938 CG GLU A 56 5.520 1.744 -10.933 1.00 0.00 C ATOM 939 CD GLU A 56 7.016 1.516 -10.933 1.00 0.00 C ATOM 940 OE1 GLU A 56 7.446 0.359 -10.721 1.00 0.00 O ATOM 941 OE2 GLU A 56 7.768 2.487 -11.126 1.00 0.00 O ATOM 0 H GLU A 56 4.436 1.909 -7.131 1.00 0.00 H new ATOM 0 HA GLU A 56 6.564 2.929 -8.718 1.00 0.00 H new ATOM 0 HB2 GLU A 56 5.150 0.816 -9.044 1.00 0.00 H new ATOM 0 HB3 GLU A 56 3.856 1.860 -9.597 1.00 0.00 H new ATOM 0 HG2 GLU A 56 5.035 0.957 -11.510 1.00 0.00 H new ATOM 0 HG3 GLU A 56 5.299 2.687 -11.432 1.00 0.00 H new ATOM 948 N ARG A 57 3.800 4.655 -8.582 1.00 0.00 N ATOM 949 CA ARG A 57 3.167 5.898 -9.000 1.00 0.00 C ATOM 950 C ARG A 57 3.856 7.115 -8.388 1.00 0.00 C ATOM 951 O ARG A 57 3.692 8.234 -8.870 1.00 0.00 O ATOM 952 CB ARG A 57 1.676 5.873 -8.672 1.00 0.00 C ATOM 953 CG ARG A 57 0.939 4.790 -9.441 1.00 0.00 C ATOM 954 CD ARG A 57 -0.558 4.817 -9.199 1.00 0.00 C ATOM 955 NE ARG A 57 -1.234 3.775 -9.971 1.00 0.00 N ATOM 956 CZ ARG A 57 -2.083 4.015 -10.968 1.00 0.00 C ATOM 957 NH1 ARG A 57 -2.409 5.263 -11.286 1.00 0.00 N ATOM 958 NH2 ARG A 57 -2.602 3.002 -11.649 1.00 0.00 N ATOM 0 H ARG A 57 3.302 4.149 -7.850 1.00 0.00 H new ATOM 0 HA ARG A 57 3.275 5.985 -10.081 1.00 0.00 H new ATOM 0 HB2 ARG A 57 1.543 5.711 -7.602 1.00 0.00 H new ATOM 0 HB3 ARG A 57 1.238 6.844 -8.904 1.00 0.00 H new ATOM 0 HG2 ARG A 57 1.133 4.911 -10.507 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.332 3.815 -9.154 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.761 4.677 -8.137 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -0.956 5.794 -9.473 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.043 2.802 -9.730 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -2.008 6.043 -10.765 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.060 5.441 -12.051 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.350 2.043 -11.408 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.253 3.182 -12.414 1.00 0.00 H new ATOM 972 N ASP A 58 4.646 6.897 -7.342 1.00 0.00 N ATOM 973 CA ASP A 58 5.472 7.968 -6.783 1.00 0.00 C ATOM 974 C ASP A 58 6.643 8.226 -7.719 1.00 0.00 C ATOM 975 O ASP A 58 7.037 9.366 -7.963 1.00 0.00 O ATOM 976 CB ASP A 58 5.994 7.587 -5.396 1.00 0.00 C ATOM 977 CG ASP A 58 6.663 8.744 -4.675 1.00 0.00 C ATOM 978 OD1 ASP A 58 5.971 9.734 -4.344 1.00 0.00 O ATOM 979 OD2 ASP A 58 7.876 8.650 -4.407 1.00 0.00 O ATOM 0 H ASP A 58 4.734 5.999 -6.866 1.00 0.00 H new ATOM 0 HA ASP A 58 4.866 8.868 -6.682 1.00 0.00 H new ATOM 0 HB2 ASP A 58 5.166 7.219 -4.791 1.00 0.00 H new ATOM 0 HB3 ASP A 58 6.706 6.767 -5.494 1.00 0.00 H new ATOM 984 N ASP A 59 7.164 7.136 -8.276 1.00 0.00 N ATOM 985 CA ASP A 59 8.258 7.195 -9.240 1.00 0.00 C ATOM 986 C ASP A 59 7.789 7.852 -10.529 1.00 0.00 C ATOM 987 O ASP A 59 8.584 8.355 -11.309 1.00 0.00 O ATOM 988 CB ASP A 59 8.777 5.787 -9.535 1.00 0.00 C ATOM 989 CG ASP A 59 9.991 5.775 -10.450 1.00 0.00 C ATOM 990 OD1 ASP A 59 9.813 5.727 -11.686 1.00 0.00 O ATOM 991 OD2 ASP A 59 11.127 5.783 -9.929 1.00 0.00 O ATOM 0 H ASP A 59 6.841 6.190 -8.072 1.00 0.00 H new ATOM 0 HA ASP A 59 9.066 7.790 -8.813 1.00 0.00 H new ATOM 0 HB2 ASP A 59 9.033 5.297 -8.596 1.00 0.00 H new ATOM 0 HB3 ASP A 59 7.980 5.201 -9.993 1.00 0.00 H new ATOM 996 N THR A 60 6.482 7.863 -10.737 1.00 0.00 N ATOM 997 CA THR A 60 5.907 8.499 -11.908 1.00 0.00 C ATOM 998 C THR A 60 6.170 10.007 -11.882 1.00 0.00 C ATOM 999 O THR A 60 6.308 10.643 -12.930 1.00 0.00 O ATOM 1000 CB THR A 60 4.395 8.216 -11.992 1.00 0.00 C ATOM 1001 OG1 THR A 60 4.173 6.806 -11.865 1.00 0.00 O ATOM 1002 CG2 THR A 60 3.810 8.706 -13.308 1.00 0.00 C ATOM 0 H THR A 60 5.800 7.438 -10.109 1.00 0.00 H new ATOM 0 HA THR A 60 6.384 8.081 -12.795 1.00 0.00 H new ATOM 0 HB THR A 60 3.899 8.752 -11.183 1.00 0.00 H new ATOM 0 HG1 THR A 60 3.238 6.602 -12.074 1.00 0.00 H new ATOM 0 HG21 THR A 60 2.742 8.490 -13.334 1.00 0.00 H new ATOM 0 HG22 THR A 60 3.966 9.781 -13.397 1.00 0.00 H new ATOM 0 HG23 THR A 60 4.303 8.198 -14.137 1.00 0.00 H new ATOM 1010 N GLU A 61 6.273 10.567 -10.680 1.00 0.00 N ATOM 1011 CA GLU A 61 6.623 11.972 -10.526 1.00 0.00 C ATOM 1012 C GLU A 61 8.140 12.119 -10.583 1.00 0.00 C ATOM 1013 O GLU A 61 8.673 13.136 -11.032 1.00 0.00 O ATOM 1014 CB GLU A 61 6.080 12.513 -9.202 1.00 0.00 C ATOM 1015 CG GLU A 61 6.332 13.996 -8.993 1.00 0.00 C ATOM 1016 CD GLU A 61 5.753 14.507 -7.693 1.00 0.00 C ATOM 1017 OE1 GLU A 61 6.462 14.470 -6.665 1.00 0.00 O ATOM 1018 OE2 GLU A 61 4.586 14.953 -7.690 1.00 0.00 O ATOM 0 H GLU A 61 6.119 10.070 -9.803 1.00 0.00 H new ATOM 0 HA GLU A 61 6.176 12.549 -11.335 1.00 0.00 H new ATOM 0 HB2 GLU A 61 5.007 12.327 -9.158 1.00 0.00 H new ATOM 0 HB3 GLU A 61 6.534 11.958 -8.381 1.00 0.00 H new ATOM 0 HG2 GLU A 61 7.406 14.184 -9.007 1.00 0.00 H new ATOM 0 HG3 GLU A 61 5.900 14.555 -9.823 1.00 0.00 H new ATOM 1025 N LEU A 62 8.817 11.070 -10.143 1.00 0.00 N ATOM 1026 CA LEU A 62 10.269 11.011 -10.148 1.00 0.00 C ATOM 1027 C LEU A 62 10.800 10.970 -11.580 1.00 0.00 C ATOM 1028 O LEU A 62 11.700 11.728 -11.944 1.00 0.00 O ATOM 1029 CB LEU A 62 10.710 9.774 -9.360 1.00 0.00 C ATOM 1030 CG LEU A 62 12.214 9.551 -9.226 1.00 0.00 C ATOM 1031 CD1 LEU A 62 12.895 10.779 -8.645 1.00 0.00 C ATOM 1032 CD2 LEU A 62 12.469 8.334 -8.350 1.00 0.00 C ATOM 0 H LEU A 62 8.372 10.231 -9.771 1.00 0.00 H new ATOM 0 HA LEU A 62 10.678 11.904 -9.676 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.284 9.838 -8.359 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.276 8.894 -9.835 1.00 0.00 H new ATOM 0 HG LEU A 62 12.634 9.376 -10.216 1.00 0.00 H new ATOM 0 HD11 LEU A 62 13.966 10.595 -8.559 1.00 0.00 H new ATOM 0 HD12 LEU A 62 12.725 11.633 -9.300 1.00 0.00 H new ATOM 0 HD13 LEU A 62 12.483 10.991 -7.658 1.00 0.00 H new ATOM 0 HD21 LEU A 62 13.543 8.174 -8.254 1.00 0.00 H new ATOM 0 HD22 LEU A 62 12.037 8.499 -7.363 1.00 0.00 H new ATOM 0 HD23 LEU A 62 12.010 7.456 -8.805 1.00 0.00 H new ATOM 1044 N ASP A 63 10.223 10.095 -12.394 1.00 0.00 N ATOM 1045 CA ASP A 63 10.613 9.979 -13.792 1.00 0.00 C ATOM 1046 C ASP A 63 10.109 11.173 -14.591 1.00 0.00 C ATOM 1047 O ASP A 63 10.637 11.488 -15.651 1.00 0.00 O ATOM 1048 CB ASP A 63 10.091 8.672 -14.393 1.00 0.00 C ATOM 1049 CG ASP A 63 10.485 8.505 -15.848 1.00 0.00 C ATOM 1050 OD1 ASP A 63 11.683 8.639 -16.167 1.00 0.00 O ATOM 1051 OD2 ASP A 63 9.597 8.242 -16.680 1.00 0.00 O ATOM 0 H ASP A 63 9.482 9.455 -12.109 1.00 0.00 H new ATOM 0 HA ASP A 63 11.702 9.968 -13.841 1.00 0.00 H new ATOM 0 HB2 ASP A 63 10.476 7.831 -13.817 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.005 8.645 -14.308 1.00 0.00 H new ATOM 1056 N GLU A 64 9.094 11.853 -14.070 1.00 0.00 N ATOM 1057 CA GLU A 64 8.604 13.076 -14.694 1.00 0.00 C ATOM 1058 C GLU A 64 9.728 14.111 -14.692 1.00 0.00 C ATOM 1059 O GLU A 64 9.956 14.807 -15.681 1.00 0.00 O ATOM 1060 CB GLU A 64 7.373 13.594 -13.939 1.00 0.00 C ATOM 1061 CG GLU A 64 6.419 14.443 -14.774 1.00 0.00 C ATOM 1062 CD GLU A 64 6.968 15.811 -15.124 1.00 0.00 C ATOM 1063 OE1 GLU A 64 7.246 16.601 -14.198 1.00 0.00 O ATOM 1064 OE2 GLU A 64 7.108 16.113 -16.327 1.00 0.00 O ATOM 0 H GLU A 64 8.597 11.580 -13.222 1.00 0.00 H new ATOM 0 HA GLU A 64 8.303 12.879 -15.723 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.824 12.741 -13.541 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.709 14.183 -13.086 1.00 0.00 H new ATOM 0 HG2 GLU A 64 6.183 13.909 -15.695 1.00 0.00 H new ATOM 0 HG3 GLU A 64 5.483 14.566 -14.228 1.00 0.00 H new ATOM 1071 N LEU A 65 10.449 14.172 -13.576 1.00 0.00 N ATOM 1072 CA LEU A 65 11.626 15.025 -13.460 1.00 0.00 C ATOM 1073 C LEU A 65 12.741 14.501 -14.360 1.00 0.00 C ATOM 1074 O LEU A 65 13.449 15.266 -15.017 1.00 0.00 O ATOM 1075 CB LEU A 65 12.123 15.048 -12.009 1.00 0.00 C ATOM 1076 CG LEU A 65 11.088 15.463 -10.962 1.00 0.00 C ATOM 1077 CD1 LEU A 65 11.655 15.292 -9.559 1.00 0.00 C ATOM 1078 CD2 LEU A 65 10.649 16.901 -11.190 1.00 0.00 C ATOM 0 H LEU A 65 10.236 13.637 -12.734 1.00 0.00 H new ATOM 0 HA LEU A 65 11.352 16.035 -13.766 1.00 0.00 H new ATOM 0 HB2 LEU A 65 12.492 14.055 -11.755 1.00 0.00 H new ATOM 0 HB3 LEU A 65 12.971 15.730 -11.945 1.00 0.00 H new ATOM 0 HG LEU A 65 10.215 14.818 -11.062 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.907 15.591 -8.825 1.00 0.00 H new ATOM 0 HD12 LEU A 65 11.922 14.247 -9.399 1.00 0.00 H new ATOM 0 HD13 LEU A 65 12.543 15.915 -9.447 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.913 17.180 -10.437 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.513 17.561 -11.115 1.00 0.00 H new ATOM 0 HD23 LEU A 65 10.206 16.993 -12.182 1.00 0.00 H new ATOM 1267 N PRO A 75 15.123 19.398 -10.513 1.00 0.00 N ATOM 1268 CA PRO A 75 15.630 19.794 -9.198 1.00 0.00 C ATOM 1269 C PRO A 75 16.668 18.813 -8.674 1.00 0.00 C ATOM 1270 O PRO A 75 16.350 17.660 -8.374 1.00 0.00 O ATOM 1271 CB PRO A 75 14.388 19.779 -8.306 1.00 0.00 C ATOM 1272 CG PRO A 75 13.233 19.863 -9.245 1.00 0.00 C ATOM 1273 CD PRO A 75 13.672 19.167 -10.498 1.00 0.00 C ATOM 0 HA PRO A 75 16.129 20.763 -9.229 1.00 0.00 H new ATOM 0 HB2 PRO A 75 14.344 18.869 -7.707 1.00 0.00 H new ATOM 0 HB3 PRO A 75 14.392 20.618 -7.610 1.00 0.00 H new ATOM 0 HG2 PRO A 75 12.350 19.385 -8.822 1.00 0.00 H new ATOM 0 HG3 PRO A 75 12.968 20.901 -9.447 1.00 0.00 H new ATOM 0 HD2 PRO A 75 13.433 18.104 -10.474 1.00 0.00 H new ATOM 0 HD3 PRO A 75 13.188 19.583 -11.382 1.00 0.00 H new ATOM 1281 N SER A 76 17.901 19.282 -8.560 1.00 0.00 N ATOM 1282 CA SER A 76 19.015 18.447 -8.144 1.00 0.00 C ATOM 1283 C SER A 76 18.785 17.840 -6.760 1.00 0.00 C ATOM 1284 O SER A 76 19.239 16.734 -6.479 1.00 0.00 O ATOM 1285 CB SER A 76 20.305 19.269 -8.166 1.00 0.00 C ATOM 1286 OG SER A 76 20.106 20.547 -7.576 1.00 0.00 O ATOM 0 H SER A 76 18.156 20.250 -8.753 1.00 0.00 H new ATOM 0 HA SER A 76 19.101 17.617 -8.846 1.00 0.00 H new ATOM 0 HB2 SER A 76 21.089 18.735 -7.630 1.00 0.00 H new ATOM 0 HB3 SER A 76 20.647 19.389 -9.194 1.00 0.00 H new ATOM 0 HG SER A 76 20.945 21.053 -7.600 1.00 0.00 H new ATOM 1292 N ASN A 77 18.076 18.558 -5.900 1.00 0.00 N ATOM 1293 CA ASN A 77 17.777 18.050 -4.568 1.00 0.00 C ATOM 1294 C ASN A 77 16.506 17.207 -4.581 1.00 0.00 C ATOM 1295 O ASN A 77 16.509 16.069 -4.119 1.00 0.00 O ATOM 1296 CB ASN A 77 17.634 19.197 -3.564 1.00 0.00 C ATOM 1297 CG ASN A 77 17.433 18.703 -2.138 1.00 0.00 C ATOM 1298 OD1 ASN A 77 17.935 17.646 -1.754 1.00 0.00 O ATOM 1299 ND2 ASN A 77 16.696 19.465 -1.346 1.00 0.00 N ATOM 0 H ASN A 77 17.700 19.485 -6.098 1.00 0.00 H new ATOM 0 HA ASN A 77 18.611 17.420 -4.259 1.00 0.00 H new ATOM 0 HB2 ASN A 77 18.524 19.825 -3.605 1.00 0.00 H new ATOM 0 HB3 ASN A 77 16.789 19.823 -3.851 1.00 0.00 H new ATOM 0 HD21 ASN A 77 16.527 19.183 -0.380 1.00 0.00 H new ATOM 0 HD22 ASN A 77 16.297 20.334 -1.701 1.00 0.00 H new ATOM 1306 N ARG A 78 15.426 17.759 -5.136 1.00 0.00 N ATOM 1307 CA ARG A 78 14.131 17.077 -5.136 1.00 0.00 C ATOM 1308 C ARG A 78 14.191 15.724 -5.839 1.00 0.00 C ATOM 1309 O ARG A 78 13.639 14.750 -5.338 1.00 0.00 O ATOM 1310 CB ARG A 78 13.040 17.941 -5.776 1.00 0.00 C ATOM 1311 CG ARG A 78 12.382 18.914 -4.809 1.00 0.00 C ATOM 1312 CD ARG A 78 11.226 19.658 -5.466 1.00 0.00 C ATOM 1313 NE ARG A 78 10.418 20.386 -4.488 1.00 0.00 N ATOM 1314 CZ ARG A 78 9.470 21.275 -4.800 1.00 0.00 C ATOM 1315 NH1 ARG A 78 9.200 21.556 -6.072 1.00 0.00 N ATOM 1316 NH2 ARG A 78 8.783 21.870 -3.835 1.00 0.00 N ATOM 0 H ARG A 78 15.422 18.673 -5.590 1.00 0.00 H new ATOM 0 HA ARG A 78 13.879 16.906 -4.089 1.00 0.00 H new ATOM 0 HB2 ARG A 78 13.473 18.503 -6.604 1.00 0.00 H new ATOM 0 HB3 ARG A 78 12.275 17.290 -6.199 1.00 0.00 H new ATOM 0 HG2 ARG A 78 12.018 18.371 -3.937 1.00 0.00 H new ATOM 0 HG3 ARG A 78 13.122 19.631 -4.453 1.00 0.00 H new ATOM 0 HD2 ARG A 78 11.618 20.357 -6.205 1.00 0.00 H new ATOM 0 HD3 ARG A 78 10.595 18.948 -6.001 1.00 0.00 H new ATOM 0 HE ARG A 78 10.590 20.203 -3.499 1.00 0.00 H new ATOM 0 HH11 ARG A 78 9.718 21.092 -6.818 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.475 22.236 -6.301 1.00 0.00 H new ATOM 0 HH21 ARG A 78 8.979 21.649 -2.859 1.00 0.00 H new ATOM 0 HH22 ARG A 78 8.059 22.549 -4.069 1.00 0.00 H new ATOM 1330 N GLN A 79 14.863 15.658 -6.986 1.00 0.00 N ATOM 1331 CA GLN A 79 14.948 14.406 -7.734 1.00 0.00 C ATOM 1332 C GLN A 79 15.660 13.338 -6.911 1.00 0.00 C ATOM 1333 O GLN A 79 15.183 12.212 -6.794 1.00 0.00 O ATOM 1334 CB GLN A 79 15.673 14.610 -9.068 1.00 0.00 C ATOM 1335 CG GLN A 79 15.769 13.340 -9.904 1.00 0.00 C ATOM 1336 CD GLN A 79 16.526 13.540 -11.204 1.00 0.00 C ATOM 1337 OE1 GLN A 79 16.516 14.623 -11.784 1.00 0.00 O ATOM 1338 NE2 GLN A 79 17.184 12.492 -11.674 1.00 0.00 N ATOM 0 H GLN A 79 15.351 16.445 -7.413 1.00 0.00 H new ATOM 0 HA GLN A 79 13.932 14.072 -7.943 1.00 0.00 H new ATOM 0 HB2 GLN A 79 15.152 15.376 -9.643 1.00 0.00 H new ATOM 0 HB3 GLN A 79 16.678 14.985 -8.874 1.00 0.00 H new ATOM 0 HG2 GLN A 79 16.262 12.563 -9.319 1.00 0.00 H new ATOM 0 HG3 GLN A 79 14.764 12.982 -10.127 1.00 0.00 H new ATOM 0 HE21 GLN A 79 17.168 11.609 -11.163 1.00 0.00 H new ATOM 0 HE22 GLN A 79 17.707 12.567 -12.547 1.00 0.00 H new ATOM 1347 N VAL A 80 16.790 13.707 -6.323 1.00 0.00 N ATOM 1348 CA VAL A 80 17.567 12.770 -5.520 1.00 0.00 C ATOM 1349 C VAL A 80 16.809 12.392 -4.252 1.00 0.00 C ATOM 1350 O VAL A 80 16.755 11.221 -3.876 1.00 0.00 O ATOM 1351 CB VAL A 80 18.951 13.350 -5.150 1.00 0.00 C ATOM 1352 CG1 VAL A 80 19.726 12.390 -4.257 1.00 0.00 C ATOM 1353 CG2 VAL A 80 19.746 13.661 -6.408 1.00 0.00 C ATOM 0 H VAL A 80 17.188 14.644 -6.386 1.00 0.00 H new ATOM 0 HA VAL A 80 17.723 11.876 -6.124 1.00 0.00 H new ATOM 0 HB VAL A 80 18.794 14.275 -4.595 1.00 0.00 H new ATOM 0 HG11 VAL A 80 20.696 12.823 -4.012 1.00 0.00 H new ATOM 0 HG12 VAL A 80 19.165 12.214 -3.339 1.00 0.00 H new ATOM 0 HG13 VAL A 80 19.873 11.445 -4.780 1.00 0.00 H new ATOM 0 HG21 VAL A 80 20.719 14.069 -6.132 1.00 0.00 H new ATOM 0 HG22 VAL A 80 19.886 12.747 -6.985 1.00 0.00 H new ATOM 0 HG23 VAL A 80 19.204 14.391 -7.010 1.00 0.00 H new ATOM 1363 N LEU A 81 16.205 13.385 -3.612 1.00 0.00 N ATOM 1364 CA LEU A 81 15.440 13.156 -2.394 1.00 0.00 C ATOM 1365 C LEU A 81 14.242 12.249 -2.671 1.00 0.00 C ATOM 1366 O LEU A 81 13.956 11.344 -1.896 1.00 0.00 O ATOM 1367 CB LEU A 81 14.972 14.488 -1.795 1.00 0.00 C ATOM 1368 CG LEU A 81 14.268 14.383 -0.438 1.00 0.00 C ATOM 1369 CD1 LEU A 81 15.197 13.768 0.600 1.00 0.00 C ATOM 1370 CD2 LEU A 81 13.789 15.754 0.017 1.00 0.00 C ATOM 0 H LEU A 81 16.230 14.358 -3.917 1.00 0.00 H new ATOM 0 HA LEU A 81 16.089 12.659 -1.673 1.00 0.00 H new ATOM 0 HB2 LEU A 81 15.836 15.143 -1.688 1.00 0.00 H new ATOM 0 HB3 LEU A 81 14.294 14.967 -2.501 1.00 0.00 H new ATOM 0 HG LEU A 81 13.400 13.733 -0.547 1.00 0.00 H new ATOM 0 HD11 LEU A 81 14.680 13.701 1.557 1.00 0.00 H new ATOM 0 HD12 LEU A 81 15.493 12.770 0.277 1.00 0.00 H new ATOM 0 HD13 LEU A 81 16.084 14.392 0.710 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.291 15.664 0.982 1.00 0.00 H new ATOM 0 HD22 LEU A 81 14.643 16.425 0.111 1.00 0.00 H new ATOM 0 HD23 LEU A 81 13.090 16.157 -0.716 1.00 0.00 H new ATOM 1382 N LEU A 82 13.556 12.490 -3.785 1.00 0.00 N ATOM 1383 CA LEU A 82 12.413 11.671 -4.179 1.00 0.00 C ATOM 1384 C LEU A 82 12.874 10.258 -4.538 1.00 0.00 C ATOM 1385 O LEU A 82 12.232 9.270 -4.173 1.00 0.00 O ATOM 1386 CB LEU A 82 11.680 12.328 -5.357 1.00 0.00 C ATOM 1387 CG LEU A 82 10.434 11.597 -5.867 1.00 0.00 C ATOM 1388 CD1 LEU A 82 9.424 11.393 -4.751 1.00 0.00 C ATOM 1389 CD2 LEU A 82 9.796 12.375 -7.005 1.00 0.00 C ATOM 0 H LEU A 82 13.772 13.248 -4.432 1.00 0.00 H new ATOM 0 HA LEU A 82 11.719 11.597 -3.342 1.00 0.00 H new ATOM 0 HB2 LEU A 82 11.389 13.336 -5.061 1.00 0.00 H new ATOM 0 HB3 LEU A 82 12.382 12.429 -6.185 1.00 0.00 H new ATOM 0 HG LEU A 82 10.745 10.618 -6.232 1.00 0.00 H new ATOM 0 HD11 LEU A 82 8.550 10.872 -5.142 1.00 0.00 H new ATOM 0 HD12 LEU A 82 9.875 10.799 -3.956 1.00 0.00 H new ATOM 0 HD13 LEU A 82 9.121 12.361 -4.353 1.00 0.00 H new ATOM 0 HD21 LEU A 82 8.912 11.844 -7.358 1.00 0.00 H new ATOM 0 HD22 LEU A 82 9.508 13.365 -6.652 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.510 12.475 -7.823 1.00 0.00 H new ATOM 1401 N GLN A 83 13.998 10.173 -5.242 1.00 0.00 N ATOM 1402 CA GLN A 83 14.611 8.888 -5.571 1.00 0.00 C ATOM 1403 C GLN A 83 14.928 8.093 -4.302 1.00 0.00 C ATOM 1404 O GLN A 83 14.576 6.917 -4.189 1.00 0.00 O ATOM 1405 CB GLN A 83 15.884 9.115 -6.396 1.00 0.00 C ATOM 1406 CG GLN A 83 16.645 7.842 -6.731 1.00 0.00 C ATOM 1407 CD GLN A 83 17.842 8.100 -7.626 1.00 0.00 C ATOM 1408 OE1 GLN A 83 17.830 9.012 -8.455 1.00 0.00 O ATOM 1409 NE2 GLN A 83 18.891 7.314 -7.453 1.00 0.00 N ATOM 0 H GLN A 83 14.506 10.983 -5.598 1.00 0.00 H new ATOM 0 HA GLN A 83 13.904 8.306 -6.162 1.00 0.00 H new ATOM 0 HB2 GLN A 83 15.617 9.620 -7.324 1.00 0.00 H new ATOM 0 HB3 GLN A 83 16.545 9.786 -5.847 1.00 0.00 H new ATOM 0 HG2 GLN A 83 16.981 7.369 -5.808 1.00 0.00 H new ATOM 0 HG3 GLN A 83 15.972 7.139 -7.223 1.00 0.00 H new ATOM 0 HE21 GLN A 83 18.861 6.570 -6.756 1.00 0.00 H new ATOM 0 HE22 GLN A 83 19.730 7.452 -8.017 1.00 0.00 H new ATOM 1418 N GLN A 84 15.575 8.750 -3.342 1.00 0.00 N ATOM 1419 CA GLN A 84 15.930 8.110 -2.079 1.00 0.00 C ATOM 1420 C GLN A 84 14.694 7.885 -1.214 1.00 0.00 C ATOM 1421 O GLN A 84 14.676 7.002 -0.356 1.00 0.00 O ATOM 1422 CB GLN A 84 16.952 8.952 -1.313 1.00 0.00 C ATOM 1423 CG GLN A 84 18.281 9.098 -2.033 1.00 0.00 C ATOM 1424 CD GLN A 84 19.290 9.897 -1.236 1.00 0.00 C ATOM 1425 OE1 GLN A 84 18.929 10.782 -0.459 1.00 0.00 O ATOM 1426 NE2 GLN A 84 20.563 9.588 -1.418 1.00 0.00 N ATOM 0 H GLN A 84 15.864 9.725 -3.415 1.00 0.00 H new ATOM 0 HA GLN A 84 16.373 7.142 -2.312 1.00 0.00 H new ATOM 0 HB2 GLN A 84 16.534 9.943 -1.135 1.00 0.00 H new ATOM 0 HB3 GLN A 84 17.125 8.499 -0.337 1.00 0.00 H new ATOM 0 HG2 GLN A 84 18.689 8.108 -2.240 1.00 0.00 H new ATOM 0 HG3 GLN A 84 18.117 9.583 -2.995 1.00 0.00 H new ATOM 0 HE21 GLN A 84 20.820 8.848 -2.071 1.00 0.00 H new ATOM 0 HE22 GLN A 84 21.288 10.090 -0.905 1.00 0.00 H new ATOM 1435 N ARG A 85 13.667 8.691 -1.442 1.00 0.00 N ATOM 1436 CA ARG A 85 12.407 8.542 -0.732 1.00 0.00 C ATOM 1437 C ARG A 85 11.755 7.223 -1.122 1.00 0.00 C ATOM 1438 O ARG A 85 11.304 6.459 -0.265 1.00 0.00 O ATOM 1439 CB ARG A 85 11.464 9.701 -1.056 1.00 0.00 C ATOM 1440 CG ARG A 85 10.302 9.823 -0.089 1.00 0.00 C ATOM 1441 CD ARG A 85 9.015 10.210 -0.798 1.00 0.00 C ATOM 1442 NE ARG A 85 8.554 9.157 -1.703 1.00 0.00 N ATOM 1443 CZ ARG A 85 8.037 7.995 -1.299 1.00 0.00 C ATOM 1444 NH1 ARG A 85 7.917 7.727 -0.005 1.00 0.00 N ATOM 1445 NH2 ARG A 85 7.644 7.102 -2.195 1.00 0.00 N ATOM 0 H ARG A 85 13.683 9.457 -2.116 1.00 0.00 H new ATOM 0 HA ARG A 85 12.607 8.549 0.339 1.00 0.00 H new ATOM 0 HB2 ARG A 85 12.030 10.632 -1.051 1.00 0.00 H new ATOM 0 HB3 ARG A 85 11.074 9.571 -2.066 1.00 0.00 H new ATOM 0 HG2 ARG A 85 10.160 8.875 0.430 1.00 0.00 H new ATOM 0 HG3 ARG A 85 10.537 10.569 0.670 1.00 0.00 H new ATOM 0 HD2 ARG A 85 8.241 10.418 -0.059 1.00 0.00 H new ATOM 0 HD3 ARG A 85 9.173 11.130 -1.361 1.00 0.00 H new ATOM 0 HE ARG A 85 8.633 9.321 -2.707 1.00 0.00 H new ATOM 0 HH11 ARG A 85 8.221 8.411 0.688 1.00 0.00 H new ATOM 0 HH12 ARG A 85 7.521 6.837 0.297 1.00 0.00 H new ATOM 0 HH21 ARG A 85 7.737 7.303 -3.191 1.00 0.00 H new ATOM 0 HH22 ARG A 85 7.248 6.213 -1.889 1.00 0.00 H new ATOM 1459 N ARG A 86 11.716 6.957 -2.426 1.00 0.00 N ATOM 1460 CA ARG A 86 11.189 5.696 -2.924 1.00 0.00 C ATOM 1461 C ARG A 86 12.113 4.556 -2.524 1.00 0.00 C ATOM 1462 O ARG A 86 11.662 3.446 -2.246 1.00 0.00 O ATOM 1463 CB ARG A 86 11.025 5.720 -4.446 1.00 0.00 C ATOM 1464 CG ARG A 86 10.338 4.472 -4.974 1.00 0.00 C ATOM 1465 CD ARG A 86 10.274 4.435 -6.489 1.00 0.00 C ATOM 1466 NE ARG A 86 9.457 3.314 -6.951 1.00 0.00 N ATOM 1467 CZ ARG A 86 9.590 2.716 -8.135 1.00 0.00 C ATOM 1468 NH1 ARG A 86 10.523 3.113 -8.990 1.00 0.00 N ATOM 1469 NH2 ARG A 86 8.778 1.722 -8.464 1.00 0.00 N ATOM 0 H ARG A 86 12.042 7.596 -3.151 1.00 0.00 H new ATOM 0 HA ARG A 86 10.205 5.544 -2.481 1.00 0.00 H new ATOM 0 HB2 ARG A 86 10.447 6.599 -4.733 1.00 0.00 H new ATOM 0 HB3 ARG A 86 12.005 5.817 -4.913 1.00 0.00 H new ATOM 0 HG2 ARG A 86 10.869 3.591 -4.615 1.00 0.00 H new ATOM 0 HG3 ARG A 86 9.327 4.421 -4.570 1.00 0.00 H new ATOM 0 HD2 ARG A 86 9.858 5.371 -6.862 1.00 0.00 H new ATOM 0 HD3 ARG A 86 11.281 4.348 -6.897 1.00 0.00 H new ATOM 0 HE ARG A 86 8.734 2.965 -6.323 1.00 0.00 H new ATOM 0 HH11 ARG A 86 11.146 3.882 -8.744 1.00 0.00 H new ATOM 0 HH12 ARG A 86 10.617 2.649 -9.894 1.00 0.00 H new ATOM 0 HH21 ARG A 86 8.055 1.417 -7.812 1.00 0.00 H new ATOM 0 HH22 ARG A 86 8.876 1.262 -9.369 1.00 0.00 H new ATOM 1483 N ASP A 87 13.410 4.846 -2.497 1.00 0.00 N ATOM 1484 CA ASP A 87 14.413 3.886 -2.047 1.00 0.00 C ATOM 1485 C ASP A 87 14.083 3.397 -0.639 1.00 0.00 C ATOM 1486 O ASP A 87 14.076 2.193 -0.373 1.00 0.00 O ATOM 1487 CB ASP A 87 15.802 4.530 -2.073 1.00 0.00 C ATOM 1488 CG ASP A 87 16.892 3.616 -1.553 1.00 0.00 C ATOM 1489 OD1 ASP A 87 17.132 3.604 -0.329 1.00 0.00 O ATOM 1490 OD2 ASP A 87 17.535 2.924 -2.369 1.00 0.00 O ATOM 0 H ASP A 87 13.794 5.746 -2.784 1.00 0.00 H new ATOM 0 HA ASP A 87 14.409 3.030 -2.721 1.00 0.00 H new ATOM 0 HB2 ASP A 87 16.040 4.824 -3.095 1.00 0.00 H new ATOM 0 HB3 ASP A 87 15.784 5.441 -1.475 1.00 0.00 H new ATOM 1495 N GLN A 88 13.786 4.339 0.252 1.00 0.00 N ATOM 1496 CA GLN A 88 13.405 4.005 1.617 1.00 0.00 C ATOM 1497 C GLN A 88 12.098 3.220 1.629 1.00 0.00 C ATOM 1498 O GLN A 88 11.963 2.234 2.356 1.00 0.00 O ATOM 1499 CB GLN A 88 13.242 5.264 2.468 1.00 0.00 C ATOM 1500 CG GLN A 88 13.015 4.956 3.938 1.00 0.00 C ATOM 1501 CD GLN A 88 12.493 6.139 4.725 1.00 0.00 C ATOM 1502 OE1 GLN A 88 12.753 7.291 4.392 1.00 0.00 O ATOM 1503 NE2 GLN A 88 11.760 5.855 5.789 1.00 0.00 N ATOM 0 H GLN A 88 13.802 5.339 0.051 1.00 0.00 H new ATOM 0 HA GLN A 88 14.202 3.394 2.040 1.00 0.00 H new ATOM 0 HB2 GLN A 88 14.132 5.884 2.365 1.00 0.00 H new ATOM 0 HB3 GLN A 88 12.402 5.846 2.090 1.00 0.00 H new ATOM 0 HG2 GLN A 88 12.308 4.131 4.024 1.00 0.00 H new ATOM 0 HG3 GLN A 88 13.953 4.620 4.380 1.00 0.00 H new ATOM 0 HE21 GLN A 88 11.567 4.883 6.031 1.00 0.00 H new ATOM 0 HE22 GLN A 88 11.388 6.608 6.367 1.00 0.00 H new ATOM 1512 N GLU A 89 11.143 3.671 0.818 1.00 0.00 N ATOM 1513 CA GLU A 89 9.832 3.033 0.721 1.00 0.00 C ATOM 1514 C GLU A 89 9.985 1.563 0.329 1.00 0.00 C ATOM 1515 O GLU A 89 9.358 0.679 0.917 1.00 0.00 O ATOM 1516 CB GLU A 89 8.983 3.763 -0.325 1.00 0.00 C ATOM 1517 CG GLU A 89 7.488 3.510 -0.208 1.00 0.00 C ATOM 1518 CD GLU A 89 6.859 4.268 0.945 1.00 0.00 C ATOM 1519 OE1 GLU A 89 6.946 5.512 0.953 1.00 0.00 O ATOM 1520 OE2 GLU A 89 6.277 3.631 1.842 1.00 0.00 O ATOM 0 H GLU A 89 11.255 4.484 0.213 1.00 0.00 H new ATOM 0 HA GLU A 89 9.339 3.087 1.692 1.00 0.00 H new ATOM 0 HB2 GLU A 89 9.166 4.834 -0.240 1.00 0.00 H new ATOM 0 HB3 GLU A 89 9.314 3.461 -1.319 1.00 0.00 H new ATOM 0 HG2 GLU A 89 7.000 3.800 -1.138 1.00 0.00 H new ATOM 0 HG3 GLU A 89 7.313 2.442 -0.075 1.00 0.00 H new ATOM 1527 N LEU A 90 10.839 1.316 -0.660 1.00 0.00 N ATOM 1528 CA LEU A 90 11.101 -0.036 -1.136 1.00 0.00 C ATOM 1529 C LEU A 90 11.821 -0.860 -0.076 1.00 0.00 C ATOM 1530 O LEU A 90 11.430 -1.988 0.212 1.00 0.00 O ATOM 1531 CB LEU A 90 11.935 -0.001 -2.419 1.00 0.00 C ATOM 1532 CG LEU A 90 11.229 0.594 -3.640 1.00 0.00 C ATOM 1533 CD1 LEU A 90 12.192 0.703 -4.813 1.00 0.00 C ATOM 1534 CD2 LEU A 90 10.022 -0.251 -4.019 1.00 0.00 C ATOM 0 H LEU A 90 11.364 2.041 -1.149 1.00 0.00 H new ATOM 0 HA LEU A 90 10.140 -0.506 -1.347 1.00 0.00 H new ATOM 0 HB2 LEU A 90 12.842 0.573 -2.228 1.00 0.00 H new ATOM 0 HB3 LEU A 90 12.246 -1.018 -2.659 1.00 0.00 H new ATOM 0 HG LEU A 90 10.884 1.596 -3.385 1.00 0.00 H new ATOM 0 HD11 LEU A 90 11.673 1.128 -5.672 1.00 0.00 H new ATOM 0 HD12 LEU A 90 13.028 1.347 -4.539 1.00 0.00 H new ATOM 0 HD13 LEU A 90 12.567 -0.288 -5.069 1.00 0.00 H new ATOM 0 HD21 LEU A 90 9.531 0.185 -4.889 1.00 0.00 H new ATOM 0 HD22 LEU A 90 10.347 -1.264 -4.256 1.00 0.00 H new ATOM 0 HD23 LEU A 90 9.322 -0.281 -3.184 1.00 0.00 H new ATOM 1546 N LYS A 91 12.867 -0.288 0.513 1.00 0.00 N ATOM 1547 CA LYS A 91 13.646 -0.984 1.531 1.00 0.00 C ATOM 1548 C LYS A 91 12.778 -1.309 2.745 1.00 0.00 C ATOM 1549 O LYS A 91 12.920 -2.368 3.358 1.00 0.00 O ATOM 1550 CB LYS A 91 14.851 -0.143 1.961 1.00 0.00 C ATOM 1551 CG LYS A 91 15.740 -0.828 2.988 1.00 0.00 C ATOM 1552 CD LYS A 91 16.916 0.048 3.373 1.00 0.00 C ATOM 1553 CE LYS A 91 17.805 -0.631 4.401 1.00 0.00 C ATOM 1554 NZ LYS A 91 18.973 0.212 4.759 1.00 0.00 N ATOM 0 H LYS A 91 13.194 0.655 0.303 1.00 0.00 H new ATOM 0 HA LYS A 91 14.007 -1.917 1.098 1.00 0.00 H new ATOM 0 HB2 LYS A 91 15.447 0.098 1.081 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.495 0.801 2.374 1.00 0.00 H new ATOM 0 HG2 LYS A 91 15.155 -1.066 3.877 1.00 0.00 H new ATOM 0 HG3 LYS A 91 16.105 -1.772 2.584 1.00 0.00 H new ATOM 0 HD2 LYS A 91 17.501 0.284 2.484 1.00 0.00 H new ATOM 0 HD3 LYS A 91 16.551 0.993 3.774 1.00 0.00 H new ATOM 0 HE2 LYS A 91 17.224 -0.848 5.298 1.00 0.00 H new ATOM 0 HE3 LYS A 91 18.153 -1.586 4.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 19.557 -0.284 5.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 19.541 0.398 3.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 18.641 1.113 5.158 1.00 0.00 H new ATOM 1568 N GLU A 92 11.872 -0.398 3.076 1.00 0.00 N ATOM 1569 CA GLU A 92 10.966 -0.591 4.199 1.00 0.00 C ATOM 1570 C GLU A 92 10.015 -1.745 3.906 1.00 0.00 C ATOM 1571 O GLU A 92 9.728 -2.570 4.769 1.00 0.00 O ATOM 1572 CB GLU A 92 10.171 0.690 4.458 1.00 0.00 C ATOM 1573 CG GLU A 92 9.532 0.743 5.833 1.00 0.00 C ATOM 1574 CD GLU A 92 10.557 0.887 6.937 1.00 0.00 C ATOM 1575 OE1 GLU A 92 11.312 -0.076 7.187 1.00 0.00 O ATOM 1576 OE2 GLU A 92 10.620 1.967 7.555 1.00 0.00 O ATOM 0 H GLU A 92 11.745 0.484 2.580 1.00 0.00 H new ATOM 0 HA GLU A 92 11.550 -0.829 5.088 1.00 0.00 H new ATOM 0 HB2 GLU A 92 10.833 1.548 4.341 1.00 0.00 H new ATOM 0 HB3 GLU A 92 9.392 0.783 3.701 1.00 0.00 H new ATOM 0 HG2 GLU A 92 8.835 1.580 5.875 1.00 0.00 H new ATOM 0 HG3 GLU A 92 8.950 -0.164 5.996 1.00 0.00 H new ATOM 1583 N PHE A 93 9.551 -1.802 2.665 1.00 0.00 N ATOM 1584 CA PHE A 93 8.640 -2.848 2.222 1.00 0.00 C ATOM 1585 C PHE A 93 9.372 -4.185 2.086 1.00 0.00 C ATOM 1586 O PHE A 93 8.778 -5.251 2.236 1.00 0.00 O ATOM 1587 CB PHE A 93 8.010 -2.433 0.889 1.00 0.00 C ATOM 1588 CG PHE A 93 7.045 -3.432 0.320 1.00 0.00 C ATOM 1589 CD1 PHE A 93 5.980 -3.901 1.072 1.00 0.00 C ATOM 1590 CD2 PHE A 93 7.199 -3.892 -0.978 1.00 0.00 C ATOM 1591 CE1 PHE A 93 5.088 -4.810 0.541 1.00 0.00 C ATOM 1592 CE2 PHE A 93 6.311 -4.802 -1.514 1.00 0.00 C ATOM 1593 CZ PHE A 93 5.254 -5.261 -0.754 1.00 0.00 C ATOM 0 H PHE A 93 9.794 -1.127 1.940 1.00 0.00 H new ATOM 0 HA PHE A 93 7.854 -2.979 2.965 1.00 0.00 H new ATOM 0 HB2 PHE A 93 7.492 -1.484 1.026 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.805 -2.261 0.164 1.00 0.00 H new ATOM 0 HD1 PHE A 93 5.847 -3.551 2.085 1.00 0.00 H new ATOM 0 HD2 PHE A 93 8.023 -3.534 -1.577 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.262 -5.168 1.137 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.443 -5.155 -2.526 1.00 0.00 H new ATOM 0 HZ PHE A 93 4.557 -5.972 -1.172 1.00 0.00 H new ATOM 1603 N LYS A 94 10.664 -4.113 1.805 1.00 0.00 N ATOM 1604 CA LYS A 94 11.499 -5.301 1.680 1.00 0.00 C ATOM 1605 C LYS A 94 11.803 -5.892 3.057 1.00 0.00 C ATOM 1606 O LYS A 94 11.840 -7.112 3.229 1.00 0.00 O ATOM 1607 CB LYS A 94 12.793 -4.941 0.930 1.00 0.00 C ATOM 1608 CG LYS A 94 13.814 -6.069 0.820 1.00 0.00 C ATOM 1609 CD LYS A 94 14.846 -6.001 1.938 1.00 0.00 C ATOM 1610 CE LYS A 94 15.899 -7.089 1.800 1.00 0.00 C ATOM 1611 NZ LYS A 94 15.317 -8.449 1.932 1.00 0.00 N ATOM 0 H LYS A 94 11.162 -3.235 1.658 1.00 0.00 H new ATOM 0 HA LYS A 94 10.964 -6.060 1.109 1.00 0.00 H new ATOM 0 HB2 LYS A 94 12.532 -4.610 -0.075 1.00 0.00 H new ATOM 0 HB3 LYS A 94 13.262 -4.095 1.433 1.00 0.00 H new ATOM 0 HG2 LYS A 94 13.301 -7.030 0.856 1.00 0.00 H new ATOM 0 HG3 LYS A 94 14.318 -6.012 -0.145 1.00 0.00 H new ATOM 0 HD2 LYS A 94 15.329 -5.024 1.928 1.00 0.00 H new ATOM 0 HD3 LYS A 94 14.346 -6.099 2.901 1.00 0.00 H new ATOM 0 HE2 LYS A 94 16.390 -6.997 0.831 1.00 0.00 H new ATOM 0 HE3 LYS A 94 16.667 -6.948 2.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 16.082 -9.152 1.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 14.756 -8.503 2.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.704 -8.645 1.115 1.00 0.00 H new ATOM 1625 N ALA A 95 12.014 -5.020 4.035 1.00 0.00 N ATOM 1626 CA ALA A 95 12.318 -5.455 5.392 1.00 0.00 C ATOM 1627 C ALA A 95 11.048 -5.857 6.135 1.00 0.00 C ATOM 1628 O ALA A 95 11.034 -6.843 6.872 1.00 0.00 O ATOM 1629 CB ALA A 95 13.051 -4.357 6.147 1.00 0.00 C ATOM 0 H ALA A 95 11.980 -4.008 3.914 1.00 0.00 H new ATOM 0 HA ALA A 95 12.965 -6.330 5.332 1.00 0.00 H new ATOM 0 HB1 ALA A 95 13.272 -4.696 7.159 1.00 0.00 H new ATOM 0 HB2 ALA A 95 13.982 -4.121 5.632 1.00 0.00 H new ATOM 0 HB3 ALA A 95 12.425 -3.466 6.191 1.00 0.00 H new ATOM 1635 N GLY A 96 9.984 -5.096 5.926 1.00 0.00 N ATOM 1636 CA GLY A 96 8.735 -5.358 6.607 1.00 0.00 C ATOM 1637 C GLY A 96 7.991 -4.080 6.928 1.00 0.00 C ATOM 1638 O GLY A 96 8.439 -3.282 7.752 1.00 0.00 O ATOM 0 H GLY A 96 9.965 -4.297 5.292 1.00 0.00 H new ATOM 0 HA2 GLY A 96 8.109 -5.997 5.984 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.931 -5.906 7.529 1.00 0.00 H new ATOM 1642 N PHE A 97 6.857 -3.879 6.275 1.00 0.00 N ATOM 1643 CA PHE A 97 6.070 -2.674 6.469 1.00 0.00 C ATOM 1644 C PHE A 97 4.707 -3.025 7.061 1.00 0.00 C ATOM 1645 O PHE A 97 4.214 -4.138 6.880 1.00 0.00 O ATOM 1646 CB PHE A 97 5.898 -1.934 5.137 1.00 0.00 C ATOM 1647 CG PHE A 97 5.264 -0.580 5.284 1.00 0.00 C ATOM 1648 CD1 PHE A 97 6.018 0.506 5.692 1.00 0.00 C ATOM 1649 CD2 PHE A 97 3.914 -0.397 5.031 1.00 0.00 C ATOM 1650 CE1 PHE A 97 5.442 1.751 5.842 1.00 0.00 C ATOM 1651 CE2 PHE A 97 3.332 0.846 5.182 1.00 0.00 C ATOM 1652 CZ PHE A 97 4.097 1.920 5.587 1.00 0.00 C ATOM 0 H PHE A 97 6.461 -4.538 5.604 1.00 0.00 H new ATOM 0 HA PHE A 97 6.595 -2.020 7.165 1.00 0.00 H new ATOM 0 HB2 PHE A 97 6.874 -1.821 4.664 1.00 0.00 H new ATOM 0 HB3 PHE A 97 5.288 -2.542 4.468 1.00 0.00 H new ATOM 0 HD1 PHE A 97 7.071 0.378 5.896 1.00 0.00 H new ATOM 0 HD2 PHE A 97 3.311 -1.235 4.713 1.00 0.00 H new ATOM 0 HE1 PHE A 97 6.043 2.591 6.158 1.00 0.00 H new ATOM 0 HE2 PHE A 97 2.279 0.977 4.983 1.00 0.00 H new ATOM 0 HZ PHE A 97 3.643 2.893 5.704 1.00 0.00 H new ATOM 1662 N LEU A 98 4.107 -2.071 7.761 1.00 0.00 N ATOM 1663 CA LEU A 98 2.795 -2.264 8.365 1.00 0.00 C ATOM 1664 C LEU A 98 1.717 -2.331 7.284 1.00 0.00 C ATOM 1665 O LEU A 98 1.280 -1.304 6.764 1.00 0.00 O ATOM 1666 CB LEU A 98 2.495 -1.119 9.337 1.00 0.00 C ATOM 1667 CG LEU A 98 1.237 -1.293 10.189 1.00 0.00 C ATOM 1668 CD1 LEU A 98 1.405 -2.458 11.151 1.00 0.00 C ATOM 1669 CD2 LEU A 98 0.928 -0.011 10.947 1.00 0.00 C ATOM 0 H LEU A 98 4.512 -1.149 7.925 1.00 0.00 H new ATOM 0 HA LEU A 98 2.796 -3.206 8.914 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.350 -0.997 10.002 1.00 0.00 H new ATOM 0 HB3 LEU A 98 2.401 -0.195 8.766 1.00 0.00 H new ATOM 0 HG LEU A 98 0.398 -1.512 9.529 1.00 0.00 H new ATOM 0 HD11 LEU A 98 0.501 -2.568 11.750 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.580 -3.374 10.586 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.254 -2.268 11.807 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.030 -0.151 11.549 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.766 0.237 11.598 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.766 0.801 10.238 1.00 0.00 H new ATOM 1681 N CYS A 99 1.315 -3.542 6.933 1.00 0.00 N ATOM 1682 CA CYS A 99 0.303 -3.748 5.907 1.00 0.00 C ATOM 1683 C CYS A 99 -0.798 -4.659 6.442 1.00 0.00 C ATOM 1684 O CYS A 99 -0.521 -5.602 7.185 1.00 0.00 O ATOM 1685 CB CYS A 99 0.936 -4.361 4.654 1.00 0.00 C ATOM 1686 SG CYS A 99 2.379 -3.459 4.034 1.00 0.00 S ATOM 0 H CYS A 99 1.676 -4.402 7.346 1.00 0.00 H new ATOM 0 HA CYS A 99 -0.132 -2.785 5.640 1.00 0.00 H new ATOM 0 HB2 CYS A 99 1.230 -5.387 4.874 1.00 0.00 H new ATOM 0 HB3 CYS A 99 0.184 -4.407 3.866 1.00 0.00 H new ATOM 0 HG CYS A 99 3.386 -3.649 4.834 1.00 0.00 H new ATOM 1692 N PRO A 100 -2.062 -4.384 6.093 1.00 0.00 N ATOM 1693 CA PRO A 100 -3.192 -5.180 6.566 1.00 0.00 C ATOM 1694 C PRO A 100 -3.305 -6.527 5.859 1.00 0.00 C ATOM 1695 O PRO A 100 -2.958 -6.660 4.685 1.00 0.00 O ATOM 1696 CB PRO A 100 -4.401 -4.303 6.247 1.00 0.00 C ATOM 1697 CG PRO A 100 -3.980 -3.484 5.079 1.00 0.00 C ATOM 1698 CD PRO A 100 -2.491 -3.280 5.214 1.00 0.00 C ATOM 0 HA PRO A 100 -3.094 -5.430 7.622 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -5.277 -4.908 6.011 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -4.668 -3.673 7.096 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -4.219 -3.990 4.144 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -4.503 -2.528 5.067 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.992 -3.323 4.246 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -2.258 -2.308 5.650 1.00 0.00 H new ATOM 1706 N ASP A 101 -3.783 -7.522 6.591 1.00 0.00 N ATOM 1707 CA ASP A 101 -4.024 -8.844 6.027 1.00 0.00 C ATOM 1708 C ASP A 101 -5.221 -8.806 5.086 1.00 0.00 C ATOM 1709 O ASP A 101 -6.351 -8.560 5.511 1.00 0.00 O ATOM 1710 CB ASP A 101 -4.257 -9.865 7.142 1.00 0.00 C ATOM 1711 CG ASP A 101 -4.714 -11.216 6.623 1.00 0.00 C ATOM 1712 OD1 ASP A 101 -4.425 -11.549 5.450 1.00 0.00 O ATOM 1713 OD2 ASP A 101 -5.363 -11.949 7.393 1.00 0.00 O ATOM 0 H ASP A 101 -4.013 -7.439 7.581 1.00 0.00 H new ATOM 0 HA ASP A 101 -3.144 -9.145 5.460 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -3.335 -9.993 7.709 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -5.004 -9.476 7.833 1.00 0.00 H new ATOM 1718 N LEU A 102 -4.965 -9.043 3.812 1.00 0.00 N ATOM 1719 CA LEU A 102 -6.008 -8.974 2.805 1.00 0.00 C ATOM 1720 C LEU A 102 -6.741 -10.297 2.660 1.00 0.00 C ATOM 1721 O LEU A 102 -7.838 -10.335 2.113 1.00 0.00 O ATOM 1722 CB LEU A 102 -5.429 -8.583 1.449 1.00 0.00 C ATOM 1723 CG LEU A 102 -4.817 -7.188 1.365 1.00 0.00 C ATOM 1724 CD1 LEU A 102 -4.453 -6.877 -0.074 1.00 0.00 C ATOM 1725 CD2 LEU A 102 -5.775 -6.143 1.917 1.00 0.00 C ATOM 0 H LEU A 102 -4.043 -9.285 3.450 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.715 -8.214 3.139 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -4.665 -9.311 1.178 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -6.220 -8.658 0.702 1.00 0.00 H new ATOM 0 HG LEU A 102 -3.912 -7.162 1.972 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -4.016 -5.880 -0.131 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -3.732 -7.611 -0.434 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -5.349 -6.916 -0.693 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -5.317 -5.156 1.847 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -6.700 -6.156 1.340 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -5.996 -6.367 2.961 1.00 0.00 H new ATOM 1737 N SER A 103 -6.152 -11.374 3.165 1.00 0.00 N ATOM 1738 CA SER A 103 -6.697 -12.704 2.934 1.00 0.00 C ATOM 1739 C SER A 103 -7.706 -13.078 4.009 1.00 0.00 C ATOM 1740 O SER A 103 -8.003 -14.253 4.226 1.00 0.00 O ATOM 1741 CB SER A 103 -5.571 -13.743 2.854 1.00 0.00 C ATOM 1742 OG SER A 103 -4.660 -13.635 3.941 1.00 0.00 O ATOM 0 H SER A 103 -5.304 -11.353 3.732 1.00 0.00 H new ATOM 0 HA SER A 103 -7.220 -12.693 1.978 1.00 0.00 H new ATOM 0 HB2 SER A 103 -6.003 -14.744 2.843 1.00 0.00 H new ATOM 0 HB3 SER A 103 -5.030 -13.618 1.916 1.00 0.00 H new ATOM 0 HG SER A 103 -3.778 -13.373 3.604 1.00 0.00 H new ATOM 1748 N ASP A 104 -8.253 -12.069 4.664 1.00 0.00 N ATOM 1749 CA ASP A 104 -9.250 -12.292 5.686 1.00 0.00 C ATOM 1750 C ASP A 104 -10.491 -11.453 5.414 1.00 0.00 C ATOM 1751 O ASP A 104 -10.407 -10.233 5.262 1.00 0.00 O ATOM 1752 CB ASP A 104 -8.686 -11.974 7.065 1.00 0.00 C ATOM 1753 CG ASP A 104 -9.669 -12.305 8.159 1.00 0.00 C ATOM 1754 OD1 ASP A 104 -9.854 -13.504 8.455 1.00 0.00 O ATOM 1755 OD2 ASP A 104 -10.274 -11.373 8.710 1.00 0.00 O ATOM 0 H ASP A 104 -8.021 -11.089 4.504 1.00 0.00 H new ATOM 0 HA ASP A 104 -9.532 -13.345 5.664 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.765 -12.537 7.220 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.426 -10.917 7.117 1.00 0.00 H new ATOM 1760 N ALA A 105 -11.641 -12.112 5.362 1.00 0.00 N ATOM 1761 CA ALA A 105 -12.894 -11.442 5.041 1.00 0.00 C ATOM 1762 C ALA A 105 -13.359 -10.571 6.199 1.00 0.00 C ATOM 1763 O ALA A 105 -14.039 -9.563 6.001 1.00 0.00 O ATOM 1764 CB ALA A 105 -13.963 -12.463 4.682 1.00 0.00 C ATOM 0 H ALA A 105 -11.732 -13.112 5.539 1.00 0.00 H new ATOM 0 HA ALA A 105 -12.723 -10.796 4.180 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -14.894 -11.947 4.445 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -13.638 -13.041 3.817 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -14.125 -13.133 5.527 1.00 0.00 H new ATOM 1770 N LYS A 106 -12.977 -10.959 7.407 1.00 0.00 N ATOM 1771 CA LYS A 106 -13.337 -10.208 8.601 1.00 0.00 C ATOM 1772 C LYS A 106 -12.576 -8.887 8.608 1.00 0.00 C ATOM 1773 O LYS A 106 -13.094 -7.851 9.025 1.00 0.00 O ATOM 1774 CB LYS A 106 -12.996 -11.010 9.861 1.00 0.00 C ATOM 1775 CG LYS A 106 -13.242 -12.505 9.728 1.00 0.00 C ATOM 1776 CD LYS A 106 -12.808 -13.251 10.979 1.00 0.00 C ATOM 1777 CE LYS A 106 -12.793 -14.756 10.761 1.00 0.00 C ATOM 1778 NZ LYS A 106 -11.714 -15.177 9.823 1.00 0.00 N ATOM 0 H LYS A 106 -12.416 -11.792 7.587 1.00 0.00 H new ATOM 0 HA LYS A 106 -14.410 -10.017 8.593 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.948 -10.845 10.111 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -13.587 -10.628 10.694 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -14.301 -12.686 9.543 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -12.698 -12.890 8.866 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -11.814 -12.917 11.275 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -13.484 -13.009 11.800 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -12.657 -15.259 11.718 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -13.759 -15.074 10.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -12.134 -15.668 9.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -11.195 -14.339 9.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -11.059 -15.819 10.313 1.00 0.00 H new ATOM 1792 N ASN A 107 -11.338 -8.939 8.134 1.00 0.00 N ATOM 1793 CA ASN A 107 -10.495 -7.757 8.060 1.00 0.00 C ATOM 1794 C ASN A 107 -10.984 -6.824 6.960 1.00 0.00 C ATOM 1795 O ASN A 107 -10.950 -5.602 7.110 1.00 0.00 O ATOM 1796 CB ASN A 107 -9.039 -8.144 7.810 1.00 0.00 C ATOM 1797 CG ASN A 107 -8.084 -7.054 8.247 1.00 0.00 C ATOM 1798 OD1 ASN A 107 -8.346 -6.344 9.215 1.00 0.00 O ATOM 1799 ND2 ASN A 107 -6.976 -6.911 7.544 1.00 0.00 N ATOM 0 H ASN A 107 -10.895 -9.793 7.794 1.00 0.00 H new ATOM 0 HA ASN A 107 -10.555 -7.237 9.016 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -8.810 -9.064 8.347 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.895 -8.350 6.749 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.300 -6.190 7.798 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -6.796 -7.521 6.747 1.00 0.00 H new ATOM 1806 N MET A 108 -11.441 -7.403 5.853 1.00 0.00 N ATOM 1807 CA MET A 108 -12.056 -6.618 4.786 1.00 0.00 C ATOM 1808 C MET A 108 -13.290 -5.887 5.304 1.00 0.00 C ATOM 1809 O MET A 108 -13.603 -4.778 4.860 1.00 0.00 O ATOM 1810 CB MET A 108 -12.422 -7.505 3.596 1.00 0.00 C ATOM 1811 CG MET A 108 -11.225 -7.884 2.742 1.00 0.00 C ATOM 1812 SD MET A 108 -10.418 -6.442 2.024 1.00 0.00 S ATOM 1813 CE MET A 108 -9.069 -7.206 1.131 1.00 0.00 C ATOM 0 H MET A 108 -11.398 -8.406 5.672 1.00 0.00 H new ATOM 0 HA MET A 108 -11.330 -5.879 4.448 1.00 0.00 H new ATOM 0 HB2 MET A 108 -12.901 -8.413 3.962 1.00 0.00 H new ATOM 0 HB3 MET A 108 -13.153 -6.986 2.976 1.00 0.00 H new ATOM 0 HG2 MET A 108 -10.507 -8.435 3.350 1.00 0.00 H new ATOM 0 HG3 MET A 108 -11.547 -8.553 1.944 1.00 0.00 H new ATOM 0 HE1 MET A 108 -8.599 -6.468 0.481 1.00 0.00 H new ATOM 0 HE2 MET A 108 -8.333 -7.587 1.839 1.00 0.00 H new ATOM 0 HE3 MET A 108 -9.452 -8.029 0.528 1.00 0.00 H new ATOM 1823 N GLU A 109 -13.987 -6.508 6.251 1.00 0.00 N ATOM 1824 CA GLU A 109 -15.096 -5.851 6.923 1.00 0.00 C ATOM 1825 C GLU A 109 -14.601 -4.585 7.612 1.00 0.00 C ATOM 1826 O GLU A 109 -15.183 -3.518 7.447 1.00 0.00 O ATOM 1827 CB GLU A 109 -15.752 -6.783 7.944 1.00 0.00 C ATOM 1828 CG GLU A 109 -16.887 -6.127 8.715 1.00 0.00 C ATOM 1829 CD GLU A 109 -17.470 -7.021 9.787 1.00 0.00 C ATOM 1830 OE1 GLU A 109 -16.934 -7.030 10.916 1.00 0.00 O ATOM 1831 OE2 GLU A 109 -18.474 -7.705 9.512 1.00 0.00 O ATOM 0 H GLU A 109 -13.803 -7.460 6.567 1.00 0.00 H new ATOM 0 HA GLU A 109 -15.845 -5.589 6.176 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -16.134 -7.664 7.428 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -14.996 -7.129 8.649 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -16.523 -5.208 9.175 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -17.676 -5.844 8.018 1.00 0.00 H new ATOM 1838 N PHE A 110 -13.502 -4.708 8.357 1.00 0.00 N ATOM 1839 CA PHE A 110 -12.907 -3.563 9.048 1.00 0.00 C ATOM 1840 C PHE A 110 -12.510 -2.461 8.067 1.00 0.00 C ATOM 1841 O PHE A 110 -12.588 -1.280 8.395 1.00 0.00 O ATOM 1842 CB PHE A 110 -11.692 -3.989 9.875 1.00 0.00 C ATOM 1843 CG PHE A 110 -12.048 -4.732 11.130 1.00 0.00 C ATOM 1844 CD1 PHE A 110 -12.555 -4.054 12.226 1.00 0.00 C ATOM 1845 CD2 PHE A 110 -11.880 -6.103 11.214 1.00 0.00 C ATOM 1846 CE1 PHE A 110 -12.886 -4.729 13.384 1.00 0.00 C ATOM 1847 CE2 PHE A 110 -12.209 -6.785 12.368 1.00 0.00 C ATOM 1848 CZ PHE A 110 -12.714 -6.097 13.455 1.00 0.00 C ATOM 0 H PHE A 110 -13.006 -5.588 8.498 1.00 0.00 H new ATOM 0 HA PHE A 110 -13.666 -3.165 9.721 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -11.048 -4.618 9.261 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -11.114 -3.103 10.139 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -12.693 -2.984 12.174 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -11.487 -6.646 10.367 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -13.279 -4.188 14.232 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -12.072 -7.855 12.421 1.00 0.00 H new ATOM 0 HZ PHE A 110 -12.974 -6.629 14.359 1.00 0.00 H new ATOM 1858 N LEU A 111 -12.089 -2.844 6.865 1.00 0.00 N ATOM 1859 CA LEU A 111 -11.778 -1.867 5.823 1.00 0.00 C ATOM 1860 C LEU A 111 -13.022 -1.076 5.434 1.00 0.00 C ATOM 1861 O LEU A 111 -12.942 0.100 5.100 1.00 0.00 O ATOM 1862 CB LEU A 111 -11.178 -2.548 4.590 1.00 0.00 C ATOM 1863 CG LEU A 111 -9.676 -2.824 4.671 1.00 0.00 C ATOM 1864 CD1 LEU A 111 -9.210 -3.614 3.461 1.00 0.00 C ATOM 1865 CD2 LEU A 111 -8.907 -1.516 4.771 1.00 0.00 C ATOM 0 H LEU A 111 -11.956 -3.817 6.588 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.038 -1.176 6.227 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -11.697 -3.492 4.426 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -11.371 -1.923 3.718 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.483 -3.417 5.565 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -8.139 -3.800 3.538 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -9.741 -4.565 3.421 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -9.415 -3.045 2.554 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -7.839 -1.725 4.828 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -9.111 -0.906 3.891 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -9.220 -0.978 5.666 1.00 0.00 H new ATOM 1877 N ARG A 112 -14.175 -1.727 5.494 1.00 0.00 N ATOM 1878 CA ARG A 112 -15.440 -1.055 5.217 1.00 0.00 C ATOM 1879 C ARG A 112 -15.932 -0.270 6.432 1.00 0.00 C ATOM 1880 O ARG A 112 -16.970 0.389 6.376 1.00 0.00 O ATOM 1881 CB ARG A 112 -16.499 -2.065 4.768 1.00 0.00 C ATOM 1882 CG ARG A 112 -16.179 -2.699 3.427 1.00 0.00 C ATOM 1883 CD ARG A 112 -17.306 -3.585 2.925 1.00 0.00 C ATOM 1884 NE ARG A 112 -17.081 -3.999 1.541 1.00 0.00 N ATOM 1885 CZ ARG A 112 -17.755 -4.969 0.926 1.00 0.00 C ATOM 1886 NH1 ARG A 112 -18.715 -5.629 1.560 1.00 0.00 N ATOM 1887 NH2 ARG A 112 -17.475 -5.277 -0.335 1.00 0.00 N ATOM 0 H ARG A 112 -14.263 -2.715 5.731 1.00 0.00 H new ATOM 0 HA ARG A 112 -15.268 -0.345 4.408 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -16.590 -2.847 5.522 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -17.466 -1.567 4.707 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -15.982 -1.916 2.695 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -15.267 -3.290 3.515 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -17.389 -4.466 3.561 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -18.252 -3.049 2.997 1.00 0.00 H new ATOM 0 HE ARG A 112 -16.359 -3.512 1.010 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -18.942 -5.395 2.526 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -19.226 -6.371 1.081 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -16.743 -4.770 -0.833 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -17.992 -6.020 -0.805 1.00 0.00 H new ATOM 1901 N ASN A 113 -15.188 -0.342 7.529 1.00 0.00 N ATOM 1902 CA ASN A 113 -15.514 0.429 8.725 1.00 0.00 C ATOM 1903 C ASN A 113 -14.557 1.603 8.886 1.00 0.00 C ATOM 1904 O ASN A 113 -14.924 2.644 9.428 1.00 0.00 O ATOM 1905 CB ASN A 113 -15.457 -0.441 9.988 1.00 0.00 C ATOM 1906 CG ASN A 113 -16.583 -1.457 10.074 1.00 0.00 C ATOM 1907 OD1 ASN A 113 -16.446 -2.596 9.634 1.00 0.00 O ATOM 1908 ND2 ASN A 113 -17.705 -1.057 10.648 1.00 0.00 N ATOM 0 H ASN A 113 -14.356 -0.925 7.616 1.00 0.00 H new ATOM 0 HA ASN A 113 -16.531 0.800 8.600 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -14.502 -0.965 10.016 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -15.492 0.204 10.866 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -18.491 -1.701 10.736 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -17.785 -0.104 11.003 1.00 0.00 H new ATOM 1915 N TRP A 114 -13.326 1.427 8.415 1.00 0.00 N ATOM 1916 CA TRP A 114 -12.302 2.452 8.542 1.00 0.00 C ATOM 1917 C TRP A 114 -12.677 3.692 7.740 1.00 0.00 C ATOM 1918 O TRP A 114 -12.997 3.611 6.556 1.00 0.00 O ATOM 1919 CB TRP A 114 -10.941 1.914 8.089 1.00 0.00 C ATOM 1920 CG TRP A 114 -9.813 2.882 8.305 1.00 0.00 C ATOM 1921 CD1 TRP A 114 -9.379 3.378 9.500 1.00 0.00 C ATOM 1922 CD2 TRP A 114 -8.972 3.462 7.303 1.00 0.00 C ATOM 1923 NE1 TRP A 114 -8.328 4.239 9.300 1.00 0.00 N ATOM 1924 CE2 TRP A 114 -8.054 4.302 7.962 1.00 0.00 C ATOM 1925 CE3 TRP A 114 -8.901 3.351 5.913 1.00 0.00 C ATOM 1926 CZ2 TRP A 114 -7.086 5.031 7.278 1.00 0.00 C ATOM 1927 CZ3 TRP A 114 -7.939 4.075 5.235 1.00 0.00 C ATOM 1928 CH2 TRP A 114 -7.040 4.901 5.917 1.00 0.00 C ATOM 0 H TRP A 114 -13.015 0.579 7.940 1.00 0.00 H new ATOM 0 HA TRP A 114 -12.231 2.732 9.593 1.00 0.00 H new ATOM 0 HB2 TRP A 114 -10.726 0.991 8.628 1.00 0.00 H new ATOM 0 HB3 TRP A 114 -10.994 1.660 7.030 1.00 0.00 H new ATOM 0 HD1 TRP A 114 -9.801 3.130 10.463 1.00 0.00 H new ATOM 0 HE1 TRP A 114 -7.832 4.749 10.031 1.00 0.00 H new ATOM 0 HE3 TRP A 114 -9.586 2.711 5.377 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 -6.396 5.676 7.802 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 -7.880 4.002 4.159 1.00 0.00 H new ATOM 0 HH2 TRP A 114 -6.295 5.447 5.358 1.00 0.00 H new ATOM 1939 N ASN A 115 -12.655 4.834 8.406 1.00 0.00 N ATOM 1940 CA ASN A 115 -12.993 6.099 7.771 1.00 0.00 C ATOM 1941 C ASN A 115 -11.882 7.122 7.989 1.00 0.00 C ATOM 1942 O ASN A 115 -12.040 8.307 7.686 1.00 0.00 O ATOM 1943 CB ASN A 115 -14.317 6.634 8.330 1.00 0.00 C ATOM 1944 CG ASN A 115 -14.224 7.058 9.786 1.00 0.00 C ATOM 1945 OD1 ASN A 115 -13.415 6.531 10.559 1.00 0.00 O ATOM 1946 ND2 ASN A 115 -15.061 8.008 10.174 1.00 0.00 N ATOM 0 H ASN A 115 -12.405 4.912 9.392 1.00 0.00 H new ATOM 0 HA ASN A 115 -13.103 5.929 6.700 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -14.640 7.485 7.730 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -15.083 5.865 8.230 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -15.053 8.330 11.142 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -15.713 8.417 9.505 1.00 0.00 H new ATOM 1953 N GLY A 116 -10.754 6.655 8.508 1.00 0.00 N ATOM 1954 CA GLY A 116 -9.648 7.545 8.802 1.00 0.00 C ATOM 1955 C GLY A 116 -9.274 7.534 10.271 1.00 0.00 C ATOM 1956 O GLY A 116 -8.208 8.014 10.651 1.00 0.00 O ATOM 0 H GLY A 116 -10.585 5.674 8.731 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.782 7.254 8.207 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.912 8.560 8.504 1.00 0.00 H new ATOM 1960 N THR A 117 -10.161 6.986 11.094 1.00 0.00 N ATOM 1961 CA THR A 117 -9.922 6.871 12.529 1.00 0.00 C ATOM 1962 C THR A 117 -8.636 6.088 12.812 1.00 0.00 C ATOM 1963 O THR A 117 -8.483 4.947 12.376 1.00 0.00 O ATOM 1964 CB THR A 117 -11.121 6.188 13.221 1.00 0.00 C ATOM 1965 OG1 THR A 117 -12.320 6.927 12.946 1.00 0.00 O ATOM 1966 CG2 THR A 117 -10.914 6.101 14.724 1.00 0.00 C ATOM 0 H THR A 117 -11.059 6.611 10.789 1.00 0.00 H new ATOM 0 HA THR A 117 -9.806 7.877 12.932 1.00 0.00 H new ATOM 0 HB THR A 117 -11.208 5.175 12.828 1.00 0.00 H new ATOM 0 HG1 THR A 117 -12.784 6.525 12.182 1.00 0.00 H new ATOM 0 HG21 THR A 117 -11.775 5.615 15.182 1.00 0.00 H new ATOM 0 HG22 THR A 117 -10.016 5.521 14.935 1.00 0.00 H new ATOM 0 HG23 THR A 117 -10.802 7.105 15.135 1.00 0.00 H new ATOM 1974 N PHE A 118 -7.723 6.711 13.552 1.00 0.00 N ATOM 1975 CA PHE A 118 -6.399 6.143 13.801 1.00 0.00 C ATOM 1976 C PHE A 118 -6.471 4.949 14.749 1.00 0.00 C ATOM 1977 O PHE A 118 -5.693 4.002 14.629 1.00 0.00 O ATOM 1978 CB PHE A 118 -5.464 7.209 14.375 1.00 0.00 C ATOM 1979 CG PHE A 118 -5.309 8.416 13.491 1.00 0.00 C ATOM 1980 CD1 PHE A 118 -4.358 8.435 12.483 1.00 0.00 C ATOM 1981 CD2 PHE A 118 -6.115 9.529 13.669 1.00 0.00 C ATOM 1982 CE1 PHE A 118 -4.214 9.544 11.669 1.00 0.00 C ATOM 1983 CE2 PHE A 118 -5.975 10.639 12.858 1.00 0.00 C ATOM 1984 CZ PHE A 118 -5.024 10.646 11.857 1.00 0.00 C ATOM 0 H PHE A 118 -7.877 7.617 13.994 1.00 0.00 H new ATOM 0 HA PHE A 118 -6.005 5.793 12.847 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -5.843 7.527 15.346 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -4.483 6.766 14.545 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -3.723 7.575 12.331 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -6.861 9.529 14.450 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -3.469 9.548 10.887 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -6.609 11.501 13.007 1.00 0.00 H new ATOM 0 HZ PHE A 118 -4.914 11.513 11.222 1.00 0.00 H new ATOM 1994 N GLY A 119 -7.408 4.997 15.687 1.00 0.00 N ATOM 1995 CA GLY A 119 -7.576 3.902 16.629 1.00 0.00 C ATOM 1996 C GLY A 119 -8.072 2.631 15.962 1.00 0.00 C ATOM 1997 O GLY A 119 -7.929 1.535 16.506 1.00 0.00 O ATOM 0 H GLY A 119 -8.056 5.774 15.814 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.625 3.702 17.122 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -8.281 4.200 17.405 1.00 0.00 H new ATOM 2001 N LEU A 120 -8.629 2.779 14.766 1.00 0.00 N ATOM 2002 CA LEU A 120 -9.190 1.655 14.030 1.00 0.00 C ATOM 2003 C LEU A 120 -8.071 0.856 13.356 1.00 0.00 C ATOM 2004 O LEU A 120 -8.280 -0.260 12.894 1.00 0.00 O ATOM 2005 CB LEU A 120 -10.201 2.175 12.996 1.00 0.00 C ATOM 2006 CG LEU A 120 -11.349 1.222 12.628 1.00 0.00 C ATOM 2007 CD1 LEU A 120 -12.526 2.011 12.081 1.00 0.00 C ATOM 2008 CD2 LEU A 120 -10.904 0.189 11.603 1.00 0.00 C ATOM 0 H LEU A 120 -8.704 3.674 14.283 1.00 0.00 H new ATOM 0 HA LEU A 120 -9.709 0.988 14.718 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -10.633 3.101 13.376 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -9.659 2.426 12.084 1.00 0.00 H new ATOM 0 HG LEU A 120 -11.651 0.696 13.534 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -13.334 1.327 11.823 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -12.874 2.716 12.836 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -12.215 2.558 11.191 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -11.739 -0.470 11.364 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -10.571 0.695 10.697 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -10.083 -0.400 12.013 1.00 0.00 H new ATOM 2020 N LEU A 121 -6.868 1.416 13.338 1.00 0.00 N ATOM 2021 CA LEU A 121 -5.716 0.727 12.750 1.00 0.00 C ATOM 2022 C LEU A 121 -5.221 -0.372 13.682 1.00 0.00 C ATOM 2023 O LEU A 121 -4.316 -1.132 13.346 1.00 0.00 O ATOM 2024 CB LEU A 121 -4.569 1.699 12.440 1.00 0.00 C ATOM 2025 CG LEU A 121 -4.715 2.524 11.155 1.00 0.00 C ATOM 2026 CD1 LEU A 121 -4.980 1.622 9.961 1.00 0.00 C ATOM 2027 CD2 LEU A 121 -5.817 3.558 11.293 1.00 0.00 C ATOM 0 H LEU A 121 -6.661 2.339 13.720 1.00 0.00 H new ATOM 0 HA LEU A 121 -6.047 0.284 11.811 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.465 2.386 13.280 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -3.642 1.128 12.378 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.775 3.049 10.988 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -5.080 2.229 9.061 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -4.150 0.927 9.839 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -5.901 1.062 10.125 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -5.899 4.128 10.368 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -6.763 3.056 11.495 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -5.582 4.233 12.116 1.00 0.00 H new ATOM 2039 N ASN A 122 -5.814 -0.436 14.863 1.00 0.00 N ATOM 2040 CA ASN A 122 -5.496 -1.485 15.817 1.00 0.00 C ATOM 2041 C ASN A 122 -6.557 -2.574 15.765 1.00 0.00 C ATOM 2042 O ASN A 122 -6.306 -3.720 16.133 1.00 0.00 O ATOM 2043 CB ASN A 122 -5.383 -0.909 17.230 1.00 0.00 C ATOM 2044 CG ASN A 122 -4.213 0.049 17.379 1.00 0.00 C ATOM 2045 OD1 ASN A 122 -4.284 1.024 18.128 1.00 0.00 O ATOM 2046 ND2 ASN A 122 -3.125 -0.222 16.668 1.00 0.00 N ATOM 0 H ASN A 122 -6.519 0.227 15.184 1.00 0.00 H new ATOM 0 HA ASN A 122 -4.534 -1.922 15.551 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -6.308 -0.389 17.481 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -5.272 -1.726 17.943 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -2.309 0.387 16.731 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -3.105 -1.040 16.058 1.00 0.00 H new ATOM 2053 N THR A 123 -7.745 -2.208 15.295 1.00 0.00 N ATOM 2054 CA THR A 123 -8.823 -3.164 15.119 1.00 0.00 C ATOM 2055 C THR A 123 -8.710 -3.808 13.740 1.00 0.00 C ATOM 2056 O THR A 123 -9.051 -4.978 13.546 1.00 0.00 O ATOM 2057 CB THR A 123 -10.198 -2.487 15.289 1.00 0.00 C ATOM 2058 OG1 THR A 123 -10.363 -1.453 14.315 1.00 0.00 O ATOM 2059 CG2 THR A 123 -10.325 -1.880 16.676 1.00 0.00 C ATOM 0 H THR A 123 -7.982 -1.252 15.029 1.00 0.00 H new ATOM 0 HA THR A 123 -8.737 -3.934 15.885 1.00 0.00 H new ATOM 0 HB THR A 123 -10.968 -3.247 15.154 1.00 0.00 H new ATOM 0 HG1 THR A 123 -9.485 -1.176 13.980 1.00 0.00 H new ATOM 0 HG21 THR A 123 -11.302 -1.407 16.778 1.00 0.00 H new ATOM 0 HG22 THR A 123 -10.221 -2.663 17.427 1.00 0.00 H new ATOM 0 HG23 THR A 123 -9.543 -1.134 16.820 1.00 0.00 H new ATOM 2067 N LEU A 124 -8.232 -3.013 12.789 1.00 0.00 N ATOM 2068 CA LEU A 124 -7.844 -3.506 11.479 1.00 0.00 C ATOM 2069 C LEU A 124 -6.569 -4.324 11.631 1.00 0.00 C ATOM 2070 O LEU A 124 -5.624 -3.883 12.287 1.00 0.00 O ATOM 2071 CB LEU A 124 -7.596 -2.319 10.539 1.00 0.00 C ATOM 2072 CG LEU A 124 -8.480 -2.244 9.293 1.00 0.00 C ATOM 2073 CD1 LEU A 124 -8.281 -0.908 8.590 1.00 0.00 C ATOM 2074 CD2 LEU A 124 -8.167 -3.385 8.340 1.00 0.00 C ATOM 0 H LEU A 124 -8.104 -2.008 12.908 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.634 -4.128 11.059 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -7.728 -1.399 11.108 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -6.555 -2.349 10.218 1.00 0.00 H new ATOM 0 HG LEU A 124 -9.521 -2.332 9.605 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -8.915 -0.865 7.704 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -8.548 -0.097 9.267 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -7.237 -0.804 8.294 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -8.808 -3.311 7.461 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -7.123 -3.327 8.034 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -8.346 -4.337 8.841 1.00 0.00 H new ATOM 2086 N ARG A 125 -6.533 -5.513 11.048 1.00 0.00 N ATOM 2087 CA ARG A 125 -5.374 -6.379 11.202 1.00 0.00 C ATOM 2088 C ARG A 125 -4.245 -5.950 10.278 1.00 0.00 C ATOM 2089 O ARG A 125 -4.068 -6.506 9.193 1.00 0.00 O ATOM 2090 CB ARG A 125 -5.718 -7.849 10.945 1.00 0.00 C ATOM 2091 CG ARG A 125 -6.847 -8.378 11.810 1.00 0.00 C ATOM 2092 CD ARG A 125 -6.693 -9.867 12.083 1.00 0.00 C ATOM 2093 NE ARG A 125 -6.481 -10.654 10.864 1.00 0.00 N ATOM 2094 CZ ARG A 125 -6.923 -11.903 10.707 1.00 0.00 C ATOM 2095 NH1 ARG A 125 -7.718 -12.448 11.622 1.00 0.00 N ATOM 2096 NH2 ARG A 125 -6.602 -12.598 9.619 1.00 0.00 N ATOM 0 H ARG A 125 -7.282 -5.896 10.471 1.00 0.00 H new ATOM 0 HA ARG A 125 -5.047 -6.282 12.237 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -5.990 -7.970 9.896 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -4.828 -8.455 11.116 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -6.868 -7.835 12.755 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -7.801 -8.195 11.316 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -5.852 -10.022 12.760 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -7.584 -10.231 12.594 1.00 0.00 H new ATOM 0 HE ARG A 125 -5.968 -10.223 10.095 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -7.991 -11.911 12.445 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -8.055 -13.403 11.501 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -6.015 -12.176 8.899 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -6.943 -13.553 9.505 1.00 0.00 H new ATOM 2110 N LEU A 126 -3.516 -4.929 10.695 1.00 0.00 N ATOM 2111 CA LEU A 126 -2.306 -4.521 10.006 1.00 0.00 C ATOM 2112 C LEU A 126 -1.108 -5.172 10.670 1.00 0.00 C ATOM 2113 O LEU A 126 -0.831 -4.934 11.845 1.00 0.00 O ATOM 2114 CB LEU A 126 -2.141 -2.996 9.999 1.00 0.00 C ATOM 2115 CG LEU A 126 -2.917 -2.249 8.911 1.00 0.00 C ATOM 2116 CD1 LEU A 126 -4.403 -2.215 9.224 1.00 0.00 C ATOM 2117 CD2 LEU A 126 -2.375 -0.840 8.743 1.00 0.00 C ATOM 0 H LEU A 126 -3.744 -4.365 11.513 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.379 -4.845 8.968 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.452 -2.611 10.970 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.082 -2.764 9.888 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.784 -2.787 7.972 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.929 -1.678 8.434 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.785 -3.234 9.287 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.563 -1.708 10.176 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.938 -0.324 7.966 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.474 -0.298 9.683 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.324 -0.886 8.459 1.00 0.00 H new ATOM 2129 N ILE A 127 -0.415 -6.005 9.920 1.00 0.00 N ATOM 2130 CA ILE A 127 0.718 -6.742 10.448 1.00 0.00 C ATOM 2131 C ILE A 127 2.009 -6.264 9.801 1.00 0.00 C ATOM 2132 O ILE A 127 2.019 -5.271 9.074 1.00 0.00 O ATOM 2133 CB ILE A 127 0.553 -8.262 10.222 1.00 0.00 C ATOM 2134 CG1 ILE A 127 0.353 -8.567 8.731 1.00 0.00 C ATOM 2135 CG2 ILE A 127 -0.616 -8.793 11.039 1.00 0.00 C ATOM 2136 CD1 ILE A 127 0.223 -10.044 8.420 1.00 0.00 C ATOM 0 H ILE A 127 -0.617 -6.190 8.937 1.00 0.00 H new ATOM 0 HA ILE A 127 0.763 -6.557 11.521 1.00 0.00 H new ATOM 0 HB ILE A 127 1.463 -8.763 10.553 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.542 -8.052 8.381 1.00 0.00 H new ATOM 0 HG13 ILE A 127 1.195 -8.160 8.171 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.721 -9.865 10.870 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -0.434 -8.608 12.098 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -1.532 -8.287 10.735 1.00 0.00 H new ATOM 0 HD11 ILE A 127 0.084 -10.179 7.347 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.127 -10.564 8.737 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -0.636 -10.453 8.951 1.00 0.00 H new ATOM 2148 N ARG A 128 3.094 -6.972 10.058 1.00 0.00 N ATOM 2149 CA ARG A 128 4.375 -6.622 9.474 1.00 0.00 C ATOM 2150 C ARG A 128 4.598 -7.474 8.234 1.00 0.00 C ATOM 2151 O ARG A 128 4.894 -8.660 8.333 1.00 0.00 O ATOM 2152 CB ARG A 128 5.504 -6.839 10.490 1.00 0.00 C ATOM 2153 CG ARG A 128 5.244 -6.172 11.834 1.00 0.00 C ATOM 2154 CD ARG A 128 6.410 -6.348 12.796 1.00 0.00 C ATOM 2155 NE ARG A 128 6.794 -7.750 12.956 1.00 0.00 N ATOM 2156 CZ ARG A 128 6.702 -8.432 14.099 1.00 0.00 C ATOM 2157 NH1 ARG A 128 6.180 -7.864 15.181 1.00 0.00 N ATOM 2158 NH2 ARG A 128 7.124 -9.687 14.153 1.00 0.00 N ATOM 0 H ARG A 128 3.113 -7.791 10.666 1.00 0.00 H new ATOM 0 HA ARG A 128 4.376 -5.568 9.195 1.00 0.00 H new ATOM 0 HB2 ARG A 128 5.643 -7.909 10.645 1.00 0.00 H new ATOM 0 HB3 ARG A 128 6.435 -6.453 10.075 1.00 0.00 H new ATOM 0 HG2 ARG A 128 5.059 -5.109 11.681 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.342 -6.592 12.278 1.00 0.00 H new ATOM 0 HD2 ARG A 128 7.266 -5.779 12.433 1.00 0.00 H new ATOM 0 HD3 ARG A 128 6.141 -5.935 13.768 1.00 0.00 H new ATOM 0 HE ARG A 128 7.157 -8.240 12.138 1.00 0.00 H new ATOM 0 HH11 ARG A 128 5.847 -6.901 15.141 1.00 0.00 H new ATOM 0 HH12 ARG A 128 6.113 -8.391 16.052 1.00 0.00 H new ATOM 0 HH21 ARG A 128 7.518 -10.129 13.322 1.00 0.00 H new ATOM 0 HH22 ARG A 128 7.055 -10.211 15.025 1.00 0.00 H new ATOM 2172 N ILE A 129 4.414 -6.866 7.073 1.00 0.00 N ATOM 2173 CA ILE A 129 4.465 -7.582 5.807 1.00 0.00 C ATOM 2174 C ILE A 129 5.652 -7.129 4.967 1.00 0.00 C ATOM 2175 O ILE A 129 5.874 -5.930 4.784 1.00 0.00 O ATOM 2176 CB ILE A 129 3.155 -7.374 5.011 1.00 0.00 C ATOM 2177 CG1 ILE A 129 2.018 -8.183 5.642 1.00 0.00 C ATOM 2178 CG2 ILE A 129 3.327 -7.736 3.542 1.00 0.00 C ATOM 2179 CD1 ILE A 129 0.691 -8.042 4.922 1.00 0.00 C ATOM 0 H ILE A 129 4.226 -5.868 6.981 1.00 0.00 H new ATOM 0 HA ILE A 129 4.583 -8.642 6.032 1.00 0.00 H new ATOM 0 HB ILE A 129 2.899 -6.315 5.056 1.00 0.00 H new ATOM 0 HG12 ILE A 129 2.301 -9.236 5.660 1.00 0.00 H new ATOM 0 HG13 ILE A 129 1.893 -7.869 6.678 1.00 0.00 H new ATOM 0 HG21 ILE A 129 2.386 -7.577 3.015 1.00 0.00 H new ATOM 0 HG22 ILE A 129 4.100 -7.108 3.101 1.00 0.00 H new ATOM 0 HG23 ILE A 129 3.618 -8.783 3.457 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -0.063 -8.644 5.428 1.00 0.00 H new ATOM 0 HD12 ILE A 129 0.384 -6.996 4.927 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.797 -8.384 3.893 1.00 0.00 H new ATOM 2191 N ASN A 130 6.412 -8.089 4.464 1.00 0.00 N ATOM 2192 CA ASN A 130 7.531 -7.784 3.590 1.00 0.00 C ATOM 2193 C ASN A 130 7.320 -8.418 2.223 1.00 0.00 C ATOM 2194 O ASN A 130 6.747 -9.507 2.115 1.00 0.00 O ATOM 2195 CB ASN A 130 8.862 -8.258 4.196 1.00 0.00 C ATOM 2196 CG ASN A 130 9.126 -9.745 4.009 1.00 0.00 C ATOM 2197 OD1 ASN A 130 8.716 -10.573 4.822 1.00 0.00 O ATOM 2198 ND2 ASN A 130 9.843 -10.092 2.949 1.00 0.00 N ATOM 0 H ASN A 130 6.274 -9.083 4.646 1.00 0.00 H new ATOM 0 HA ASN A 130 7.581 -6.701 3.477 1.00 0.00 H new ATOM 0 HB2 ASN A 130 9.678 -7.694 3.744 1.00 0.00 H new ATOM 0 HB3 ASN A 130 8.868 -8.028 5.262 1.00 0.00 H new ATOM 0 HD21 ASN A 130 10.071 -11.073 2.787 1.00 0.00 H new ATOM 0 HD22 ASN A 130 10.166 -9.378 2.296 1.00 0.00 H new ATOM 2205 N ASP A 131 7.762 -7.702 1.192 1.00 0.00 N ATOM 2206 CA ASP A 131 7.738 -8.180 -0.194 1.00 0.00 C ATOM 2207 C ASP A 131 6.411 -8.821 -0.597 1.00 0.00 C ATOM 2208 O ASP A 131 5.414 -8.138 -0.809 1.00 0.00 O ATOM 2209 CB ASP A 131 8.876 -9.170 -0.454 1.00 0.00 C ATOM 2210 CG ASP A 131 10.175 -8.497 -0.838 1.00 0.00 C ATOM 2211 OD1 ASP A 131 10.340 -8.161 -2.030 1.00 0.00 O ATOM 2212 OD2 ASP A 131 11.043 -8.332 0.039 1.00 0.00 O ATOM 0 H ASP A 131 8.151 -6.765 1.293 1.00 0.00 H new ATOM 0 HA ASP A 131 7.869 -7.290 -0.809 1.00 0.00 H new ATOM 0 HB2 ASP A 131 9.037 -9.772 0.440 1.00 0.00 H new ATOM 0 HB3 ASP A 131 8.580 -9.854 -1.249 1.00 0.00 H new ATOM 2217 N LYS A 132 6.402 -10.143 -0.672 1.00 0.00 N ATOM 2218 CA LYS A 132 5.291 -10.883 -1.254 1.00 0.00 C ATOM 2219 C LYS A 132 4.206 -11.157 -0.213 1.00 0.00 C ATOM 2220 O LYS A 132 3.753 -12.288 -0.037 1.00 0.00 O ATOM 2221 CB LYS A 132 5.838 -12.181 -1.866 1.00 0.00 C ATOM 2222 CG LYS A 132 4.822 -13.009 -2.637 1.00 0.00 C ATOM 2223 CD LYS A 132 5.496 -14.188 -3.321 1.00 0.00 C ATOM 2224 CE LYS A 132 4.510 -15.303 -3.618 1.00 0.00 C ATOM 2225 NZ LYS A 132 3.959 -15.882 -2.367 1.00 0.00 N ATOM 0 H LYS A 132 7.162 -10.732 -0.332 1.00 0.00 H new ATOM 0 HA LYS A 132 4.821 -10.290 -2.038 1.00 0.00 H new ATOM 0 HB2 LYS A 132 6.662 -11.930 -2.535 1.00 0.00 H new ATOM 0 HB3 LYS A 132 6.252 -12.795 -1.066 1.00 0.00 H new ATOM 0 HG2 LYS A 132 4.049 -13.370 -1.958 1.00 0.00 H new ATOM 0 HG3 LYS A 132 4.327 -12.385 -3.381 1.00 0.00 H new ATOM 0 HD2 LYS A 132 5.958 -13.854 -4.250 1.00 0.00 H new ATOM 0 HD3 LYS A 132 6.296 -14.569 -2.686 1.00 0.00 H new ATOM 0 HE2 LYS A 132 3.696 -14.918 -4.232 1.00 0.00 H new ATOM 0 HE3 LYS A 132 5.004 -16.084 -4.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 3.664 -16.864 -2.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 4.688 -15.865 -1.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 3.138 -15.323 -2.058 1.00 0.00 H new ATOM 2239 N GLY A 133 3.801 -10.101 0.480 1.00 0.00 N ATOM 2240 CA GLY A 133 2.717 -10.199 1.435 1.00 0.00 C ATOM 2241 C GLY A 133 3.021 -11.144 2.579 1.00 0.00 C ATOM 2242 O GLY A 133 2.109 -11.691 3.193 1.00 0.00 O ATOM 0 H GLY A 133 4.209 -9.170 0.395 1.00 0.00 H new ATOM 0 HA2 GLY A 133 2.503 -9.208 1.836 1.00 0.00 H new ATOM 0 HA3 GLY A 133 1.817 -10.537 0.921 1.00 0.00 H new ATOM 2246 N GLU A 134 4.294 -11.331 2.881 1.00 0.00 N ATOM 2247 CA GLU A 134 4.688 -12.313 3.877 1.00 0.00 C ATOM 2248 C GLU A 134 4.845 -11.652 5.238 1.00 0.00 C ATOM 2249 O GLU A 134 5.399 -10.557 5.341 1.00 0.00 O ATOM 2250 CB GLU A 134 5.987 -13.002 3.459 1.00 0.00 C ATOM 2251 CG GLU A 134 6.201 -14.344 4.136 1.00 0.00 C ATOM 2252 CD GLU A 134 5.032 -15.283 3.917 1.00 0.00 C ATOM 2253 OE1 GLU A 134 4.827 -15.727 2.766 1.00 0.00 O ATOM 2254 OE2 GLU A 134 4.306 -15.570 4.891 1.00 0.00 O ATOM 0 H GLU A 134 5.067 -10.820 2.455 1.00 0.00 H new ATOM 0 HA GLU A 134 3.906 -13.069 3.951 1.00 0.00 H new ATOM 0 HB2 GLU A 134 5.983 -13.145 2.378 1.00 0.00 H new ATOM 0 HB3 GLU A 134 6.828 -12.348 3.691 1.00 0.00 H new ATOM 0 HG2 GLU A 134 7.112 -14.803 3.751 1.00 0.00 H new ATOM 0 HG3 GLU A 134 6.348 -14.191 5.205 1.00 0.00 H new ATOM 2261 N GLN A 135 4.344 -12.312 6.275 1.00 0.00 N ATOM 2262 CA GLN A 135 4.410 -11.770 7.621 1.00 0.00 C ATOM 2263 C GLN A 135 5.812 -11.949 8.193 1.00 0.00 C ATOM 2264 O GLN A 135 6.349 -13.057 8.231 1.00 0.00 O ATOM 2265 CB GLN A 135 3.371 -12.440 8.527 1.00 0.00 C ATOM 2266 CG GLN A 135 3.327 -11.858 9.932 1.00 0.00 C ATOM 2267 CD GLN A 135 2.226 -12.454 10.790 1.00 0.00 C ATOM 2268 OE1 GLN A 135 1.175 -12.857 10.290 1.00 0.00 O ATOM 2269 NE2 GLN A 135 2.462 -12.506 12.092 1.00 0.00 N ATOM 0 H GLN A 135 3.889 -13.222 6.207 1.00 0.00 H new ATOM 0 HA GLN A 135 4.185 -10.705 7.576 1.00 0.00 H new ATOM 0 HB2 GLN A 135 2.386 -12.343 8.071 1.00 0.00 H new ATOM 0 HB3 GLN A 135 3.589 -13.506 8.590 1.00 0.00 H new ATOM 0 HG2 GLN A 135 4.288 -12.025 10.418 1.00 0.00 H new ATOM 0 HG3 GLN A 135 3.185 -10.779 9.868 1.00 0.00 H new ATOM 0 HE21 GLN A 135 3.347 -12.161 12.464 1.00 0.00 H new ATOM 0 HE22 GLN A 135 1.759 -12.891 12.723 1.00 0.00 H new ATOM 2278 N VAL A 136 6.393 -10.846 8.632 1.00 0.00 N ATOM 2279 CA VAL A 136 7.737 -10.851 9.181 1.00 0.00 C ATOM 2280 C VAL A 136 7.706 -11.263 10.646 1.00 0.00 C ATOM 2281 O VAL A 136 7.337 -10.474 11.518 1.00 0.00 O ATOM 2282 CB VAL A 136 8.393 -9.458 9.061 1.00 0.00 C ATOM 2283 CG1 VAL A 136 9.871 -9.525 9.416 1.00 0.00 C ATOM 2284 CG2 VAL A 136 8.196 -8.884 7.667 1.00 0.00 C ATOM 0 H VAL A 136 5.950 -9.928 8.618 1.00 0.00 H new ATOM 0 HA VAL A 136 8.326 -11.568 8.609 1.00 0.00 H new ATOM 0 HB VAL A 136 7.904 -8.791 9.771 1.00 0.00 H new ATOM 0 HG11 VAL A 136 10.313 -8.533 9.325 1.00 0.00 H new ATOM 0 HG12 VAL A 136 9.983 -9.879 10.441 1.00 0.00 H new ATOM 0 HG13 VAL A 136 10.377 -10.211 8.737 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.667 -7.903 7.608 1.00 0.00 H new ATOM 0 HG22 VAL A 136 8.650 -9.549 6.932 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.130 -8.788 7.460 1.00 0.00 H new ATOM 2294 N VAL A 137 8.067 -12.510 10.911 1.00 0.00 N ATOM 2295 CA VAL A 137 8.101 -13.019 12.276 1.00 0.00 C ATOM 2296 C VAL A 137 9.335 -12.519 13.019 1.00 0.00 C ATOM 2297 O VAL A 137 9.255 -12.120 14.180 1.00 0.00 O ATOM 2298 CB VAL A 137 8.064 -14.562 12.315 1.00 0.00 C ATOM 2299 CG1 VAL A 137 6.680 -15.072 11.940 1.00 0.00 C ATOM 2300 CG2 VAL A 137 9.119 -15.164 11.393 1.00 0.00 C ATOM 0 H VAL A 137 8.340 -13.188 10.200 1.00 0.00 H new ATOM 0 HA VAL A 137 7.208 -12.641 12.773 1.00 0.00 H new ATOM 0 HB VAL A 137 8.289 -14.876 13.334 1.00 0.00 H new ATOM 0 HG11 VAL A 137 6.672 -16.161 11.973 1.00 0.00 H new ATOM 0 HG12 VAL A 137 5.945 -14.683 12.645 1.00 0.00 H new ATOM 0 HG13 VAL A 137 6.429 -14.738 10.933 1.00 0.00 H new ATOM 0 HG21 VAL A 137 9.068 -16.252 11.443 1.00 0.00 H new ATOM 0 HG22 VAL A 137 8.936 -14.838 10.369 1.00 0.00 H new ATOM 0 HG23 VAL A 137 10.109 -14.833 11.707 1.00 0.00 H new