USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=19 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= 0.922 K(o=1.2,f=-6.8!) USER MOD Set 1.2: A 117 THR OG1 : rot -160:sc= 0.321 USER MOD Set 2.1: A 44 HIS : no HD1:sc= 0.819 K(o=2,f=-6.7!) USER MOD Set 2.2: A 103 SER OG : rot 34:sc= 1.22 USER MOD Set 3.1: A 33 SER OG : rot -117:sc= 0.306 USER MOD Set 3.2: A 35 THR OG1 : rot 180:sc= 0.292 USER MOD Single : A 19 HIS : no HD1:sc= 1.26 K(o=1.3,f=-4.7!) USER MOD Single : A 25 LYS NZ :NH3+ -160:sc= 1.19 (180deg=0.715) USER MOD Single : A 27 MET CE :methyl -125:sc= -0.127 (180deg=-1.13) USER MOD Single : A 28 GLN : amide:sc= 0.622 K(o=0.62,f=-1.7) USER MOD Single : A 32 ASN : amide:sc= -1.39 K(o=-1.4,f=-4.6!) USER MOD Single : A 37 LYS NZ :NH3+ -154:sc= 1.27 (180deg=0.632) USER MOD Single : A 39 GLN : amide:sc=-0.00434 K(o=-0.0043,f=-0.83) USER MOD Single : A 46 HIS : no HE2:sc= 0.789 K(o=0.79,f=-5.2!) USER MOD Single : A 47 THR OG1 : rot -170:sc= -1.36 USER MOD Single : A 52 GLN : amide:sc= -1.16! X(o=-1.2!,f=-1.1) USER MOD Single : A 53 SER OG : rot 80:sc= 1.28 USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.0682 USER MOD Single : A 76 SER OG : rot 180:sc= 0.0372 USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 84 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 91 LYS NZ :NH3+ 167:sc= -0.0108 (180deg=-0.181) USER MOD Single : A 94 LYS NZ :NH3+ -151:sc= 0.236 (180deg=-0.876) USER MOD Single : A 99 CYS SG : rot 180:sc= -1.46! USER MOD Single : A 106 LYS NZ :NH3+ 161:sc= -1.84! (180deg=-2.35!) USER MOD Single : A 107 ASN : amide:sc= -0.0662 K(o=-0.066,f=-0.91) USER MOD Single : A 108 MET CE :methyl 152:sc= -2.04 (180deg=-5.26!) USER MOD Single : A 113 ASN : amide:sc= -2.44! K(o=-2.4!,f=0) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 123 THR OG1 : rot -30:sc= 0.466 USER MOD Single : A 130 ASN : amide:sc= -0.284 K(o=-0.28,f=-4.4!) USER MOD Single : A 132 LYS NZ :NH3+ -129:sc= 1.19 (180deg=0.0161) USER MOD Single : A 135 GLN : amide:sc= -0.698 X(o=-0.7,f=-0.92) USER MOD ----------------------------------------------------------------- ATOM 308 N VAL A 18 0.699 9.329 5.972 1.00 0.00 N ATOM 309 CA VAL A 18 -0.079 9.278 4.746 1.00 0.00 C ATOM 310 C VAL A 18 0.429 8.158 3.851 1.00 0.00 C ATOM 311 O VAL A 18 -0.355 7.408 3.278 1.00 0.00 O ATOM 312 CB VAL A 18 -0.028 10.617 3.983 1.00 0.00 C ATOM 313 CG1 VAL A 18 -0.807 10.535 2.680 1.00 0.00 C ATOM 314 CG2 VAL A 18 -0.574 11.730 4.856 1.00 0.00 C ATOM 0 HA VAL A 18 -1.116 9.086 5.021 1.00 0.00 H new ATOM 0 HB VAL A 18 1.012 10.833 3.738 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.754 11.493 2.163 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.378 9.758 2.048 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -1.849 10.295 2.893 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -0.535 12.673 4.310 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.607 11.509 5.124 1.00 0.00 H new ATOM 0 HG23 VAL A 18 0.027 11.810 5.762 1.00 0.00 H new ATOM 324 N HIS A 19 1.749 8.027 3.768 1.00 0.00 N ATOM 325 CA HIS A 19 2.364 6.980 2.957 1.00 0.00 C ATOM 326 C HIS A 19 1.974 5.592 3.467 1.00 0.00 C ATOM 327 O HIS A 19 2.020 4.618 2.722 1.00 0.00 O ATOM 328 CB HIS A 19 3.887 7.134 2.933 1.00 0.00 C ATOM 329 CG HIS A 19 4.422 7.637 1.621 1.00 0.00 C ATOM 330 ND1 HIS A 19 4.964 8.896 1.450 1.00 0.00 N ATOM 331 CD2 HIS A 19 4.509 7.031 0.409 1.00 0.00 C ATOM 332 CE1 HIS A 19 5.357 9.037 0.197 1.00 0.00 C ATOM 333 NE2 HIS A 19 5.093 7.923 -0.455 1.00 0.00 N ATOM 0 H HIS A 19 2.413 8.631 4.251 1.00 0.00 H new ATOM 0 HA HIS A 19 1.992 7.085 1.938 1.00 0.00 H new ATOM 0 HB2 HIS A 19 4.187 7.821 3.725 1.00 0.00 H new ATOM 0 HB3 HIS A 19 4.345 6.170 3.157 1.00 0.00 H new ATOM 0 HD2 HIS A 19 4.179 6.031 0.169 1.00 0.00 H new ATOM 0 HE1 HIS A 19 5.818 9.919 -0.223 1.00 0.00 H new ATOM 0 HE2 HIS A 19 5.290 7.752 -1.441 1.00 0.00 H new ATOM 342 N GLU A 20 1.595 5.511 4.741 1.00 0.00 N ATOM 343 CA GLU A 20 1.083 4.271 5.312 1.00 0.00 C ATOM 344 C GLU A 20 -0.389 4.077 4.952 1.00 0.00 C ATOM 345 O GLU A 20 -0.750 3.145 4.228 1.00 0.00 O ATOM 346 CB GLU A 20 1.222 4.275 6.842 1.00 0.00 C ATOM 347 CG GLU A 20 2.651 4.380 7.347 1.00 0.00 C ATOM 348 CD GLU A 20 2.726 4.392 8.861 1.00 0.00 C ATOM 349 OE1 GLU A 20 2.491 5.461 9.470 1.00 0.00 O ATOM 350 OE2 GLU A 20 3.012 3.333 9.454 1.00 0.00 O ATOM 0 H GLU A 20 1.634 6.291 5.397 1.00 0.00 H new ATOM 0 HA GLU A 20 1.671 3.453 4.897 1.00 0.00 H new ATOM 0 HB2 GLU A 20 0.646 5.109 7.244 1.00 0.00 H new ATOM 0 HB3 GLU A 20 0.777 3.361 7.236 1.00 0.00 H new ATOM 0 HG2 GLU A 20 3.232 3.542 6.963 1.00 0.00 H new ATOM 0 HG3 GLU A 20 3.107 5.290 6.956 1.00 0.00 H new ATOM 357 N LEU A 21 -1.231 4.984 5.443 1.00 0.00 N ATOM 358 CA LEU A 21 -2.682 4.831 5.343 1.00 0.00 C ATOM 359 C LEU A 21 -3.171 4.847 3.898 1.00 0.00 C ATOM 360 O LEU A 21 -4.118 4.142 3.560 1.00 0.00 O ATOM 361 CB LEU A 21 -3.393 5.924 6.149 1.00 0.00 C ATOM 362 CG LEU A 21 -3.055 5.957 7.641 1.00 0.00 C ATOM 363 CD1 LEU A 21 -3.770 7.113 8.321 1.00 0.00 C ATOM 364 CD2 LEU A 21 -3.427 4.639 8.305 1.00 0.00 C ATOM 0 H LEU A 21 -0.932 5.837 5.916 1.00 0.00 H new ATOM 0 HA LEU A 21 -2.927 3.854 5.759 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.145 6.893 5.715 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.469 5.792 6.039 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.980 6.103 7.746 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -3.519 7.123 9.382 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.457 8.053 7.866 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -4.847 6.994 8.204 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.179 4.683 9.365 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.496 4.463 8.190 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -2.873 3.826 7.836 1.00 0.00 H new ATOM 376 N ALA A 22 -2.530 5.642 3.047 1.00 0.00 N ATOM 377 CA ALA A 22 -2.933 5.739 1.643 1.00 0.00 C ATOM 378 C ALA A 22 -2.842 4.388 0.931 1.00 0.00 C ATOM 379 O ALA A 22 -3.618 4.109 0.018 1.00 0.00 O ATOM 380 CB ALA A 22 -2.097 6.775 0.911 1.00 0.00 C ATOM 0 H ALA A 22 -1.733 6.227 3.300 1.00 0.00 H new ATOM 0 HA ALA A 22 -3.976 6.054 1.629 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -2.415 6.829 -0.130 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.230 7.749 1.382 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -1.046 6.491 0.955 1.00 0.00 H new ATOM 386 N ARG A 23 -1.901 3.547 1.353 1.00 0.00 N ATOM 387 CA ARG A 23 -1.746 2.226 0.750 1.00 0.00 C ATOM 388 C ARG A 23 -2.912 1.330 1.159 1.00 0.00 C ATOM 389 O ARG A 23 -3.465 0.585 0.343 1.00 0.00 O ATOM 390 CB ARG A 23 -0.410 1.589 1.157 1.00 0.00 C ATOM 391 CG ARG A 23 0.797 2.472 0.870 1.00 0.00 C ATOM 392 CD ARG A 23 2.110 1.737 1.101 1.00 0.00 C ATOM 393 NE ARG A 23 3.264 2.642 1.045 1.00 0.00 N ATOM 394 CZ ARG A 23 4.108 2.726 0.012 1.00 0.00 C ATOM 395 NH1 ARG A 23 3.919 1.978 -1.070 1.00 0.00 N ATOM 396 NH2 ARG A 23 5.145 3.556 0.061 1.00 0.00 N ATOM 0 H ARG A 23 -1.241 3.754 2.102 1.00 0.00 H new ATOM 0 HA ARG A 23 -1.746 2.338 -0.334 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -0.436 1.358 2.222 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -0.292 0.643 0.629 1.00 0.00 H new ATOM 0 HG2 ARG A 23 0.754 2.821 -0.162 1.00 0.00 H new ATOM 0 HG3 ARG A 23 0.759 3.356 1.507 1.00 0.00 H new ATOM 0 HD2 ARG A 23 2.083 1.244 2.073 1.00 0.00 H new ATOM 0 HD3 ARG A 23 2.225 0.956 0.350 1.00 0.00 H new ATOM 0 HE ARG A 23 3.433 3.247 1.848 1.00 0.00 H new ATOM 0 HH11 ARG A 23 3.127 1.336 -1.115 1.00 0.00 H new ATOM 0 HH12 ARG A 23 4.566 2.045 -1.856 1.00 0.00 H new ATOM 0 HH21 ARG A 23 5.299 4.132 0.889 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.787 3.617 -0.729 1.00 0.00 H new ATOM 410 N VAL A 24 -3.298 1.431 2.425 1.00 0.00 N ATOM 411 CA VAL A 24 -4.444 0.692 2.939 1.00 0.00 C ATOM 412 C VAL A 24 -5.730 1.225 2.316 1.00 0.00 C ATOM 413 O VAL A 24 -6.656 0.467 2.022 1.00 0.00 O ATOM 414 CB VAL A 24 -4.536 0.792 4.478 1.00 0.00 C ATOM 415 CG1 VAL A 24 -5.712 -0.015 5.013 1.00 0.00 C ATOM 416 CG2 VAL A 24 -3.236 0.331 5.118 1.00 0.00 C ATOM 0 H VAL A 24 -2.833 2.019 3.116 1.00 0.00 H new ATOM 0 HA VAL A 24 -4.312 -0.356 2.672 1.00 0.00 H new ATOM 0 HB VAL A 24 -4.702 1.837 4.739 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -5.751 0.075 6.099 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -6.639 0.365 4.584 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -5.589 -1.063 4.740 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -3.317 0.408 6.202 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -3.041 -0.705 4.841 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -2.416 0.960 4.770 1.00 0.00 H new ATOM 426 N LYS A 25 -5.769 2.535 2.103 1.00 0.00 N ATOM 427 CA LYS A 25 -6.911 3.170 1.468 1.00 0.00 C ATOM 428 C LYS A 25 -7.100 2.646 0.051 1.00 0.00 C ATOM 429 O LYS A 25 -8.226 2.413 -0.376 1.00 0.00 O ATOM 430 CB LYS A 25 -6.754 4.692 1.442 1.00 0.00 C ATOM 431 CG LYS A 25 -7.905 5.393 0.737 1.00 0.00 C ATOM 432 CD LYS A 25 -7.738 6.899 0.741 1.00 0.00 C ATOM 433 CE LYS A 25 -8.779 7.564 -0.147 1.00 0.00 C ATOM 434 NZ LYS A 25 -8.627 7.160 -1.572 1.00 0.00 N ATOM 0 H LYS A 25 -5.020 3.177 2.362 1.00 0.00 H new ATOM 0 HA LYS A 25 -7.794 2.924 2.058 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -6.681 5.062 2.465 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -5.819 4.947 0.943 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.971 5.038 -0.291 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.843 5.131 1.225 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.829 7.276 1.760 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.738 7.159 0.393 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.777 7.299 0.202 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -8.689 8.647 -0.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.099 7.857 -2.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -7.617 7.116 -1.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.059 6.225 -1.716 1.00 0.00 H new ATOM 448 N PHE A 26 -6.000 2.452 -0.673 1.00 0.00 N ATOM 449 CA PHE A 26 -6.082 1.912 -2.025 1.00 0.00 C ATOM 450 C PHE A 26 -6.734 0.536 -1.997 1.00 0.00 C ATOM 451 O PHE A 26 -7.593 0.236 -2.823 1.00 0.00 O ATOM 452 CB PHE A 26 -4.702 1.834 -2.690 1.00 0.00 C ATOM 453 CG PHE A 26 -4.758 1.270 -4.085 1.00 0.00 C ATOM 454 CD1 PHE A 26 -5.347 1.987 -5.117 1.00 0.00 C ATOM 455 CD2 PHE A 26 -4.247 0.012 -4.358 1.00 0.00 C ATOM 456 CE1 PHE A 26 -5.421 1.460 -6.395 1.00 0.00 C ATOM 457 CE2 PHE A 26 -4.322 -0.520 -5.631 1.00 0.00 C ATOM 458 CZ PHE A 26 -4.908 0.203 -6.651 1.00 0.00 C ATOM 0 H PHE A 26 -5.054 2.658 -0.351 1.00 0.00 H new ATOM 0 HA PHE A 26 -6.695 2.590 -2.619 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -4.263 2.831 -2.723 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -4.044 1.216 -2.079 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -5.753 2.968 -4.921 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -3.785 -0.560 -3.567 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.879 2.030 -7.190 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.921 -1.503 -5.829 1.00 0.00 H new ATOM 0 HZ PHE A 26 -4.965 -0.213 -7.646 1.00 0.00 H new ATOM 468 N MET A 27 -6.332 -0.287 -1.030 1.00 0.00 N ATOM 469 CA MET A 27 -6.969 -1.588 -0.815 1.00 0.00 C ATOM 470 C MET A 27 -8.473 -1.418 -0.639 1.00 0.00 C ATOM 471 O MET A 27 -9.265 -2.085 -1.303 1.00 0.00 O ATOM 472 CB MET A 27 -6.380 -2.280 0.414 1.00 0.00 C ATOM 473 CG MET A 27 -4.949 -2.749 0.230 1.00 0.00 C ATOM 474 SD MET A 27 -4.272 -3.470 1.734 1.00 0.00 S ATOM 475 CE MET A 27 -2.739 -4.159 1.129 1.00 0.00 C ATOM 0 H MET A 27 -5.571 -0.078 -0.384 1.00 0.00 H new ATOM 0 HA MET A 27 -6.780 -2.208 -1.691 1.00 0.00 H new ATOM 0 HB2 MET A 27 -6.421 -1.593 1.260 1.00 0.00 H new ATOM 0 HB3 MET A 27 -7.003 -3.137 0.669 1.00 0.00 H new ATOM 0 HG2 MET A 27 -4.910 -3.485 -0.573 1.00 0.00 H new ATOM 0 HG3 MET A 27 -4.329 -1.907 -0.078 1.00 0.00 H new ATOM 0 HE1 MET A 27 -2.694 -5.220 1.377 1.00 0.00 H new ATOM 0 HE2 MET A 27 -2.687 -4.037 0.047 1.00 0.00 H new ATOM 0 HE3 MET A 27 -1.899 -3.642 1.593 1.00 0.00 H new ATOM 485 N GLN A 28 -8.848 -0.508 0.255 1.00 0.00 N ATOM 486 CA GLN A 28 -10.249 -0.177 0.496 1.00 0.00 C ATOM 487 C GLN A 28 -10.947 0.225 -0.800 1.00 0.00 C ATOM 488 O GLN A 28 -11.988 -0.328 -1.156 1.00 0.00 O ATOM 489 CB GLN A 28 -10.345 0.974 1.494 1.00 0.00 C ATOM 490 CG GLN A 28 -11.767 1.315 1.898 1.00 0.00 C ATOM 491 CD GLN A 28 -11.871 2.673 2.557 1.00 0.00 C ATOM 492 OE1 GLN A 28 -11.143 3.604 2.213 1.00 0.00 O ATOM 493 NE2 GLN A 28 -12.766 2.790 3.519 1.00 0.00 N ATOM 0 H GLN A 28 -8.192 0.019 0.831 1.00 0.00 H new ATOM 0 HA GLN A 28 -10.741 -1.062 0.900 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.775 0.717 2.387 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -9.878 1.858 1.061 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -12.407 1.292 1.016 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -12.140 0.553 2.582 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -13.349 1.993 3.773 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -12.875 3.678 4.009 1.00 0.00 H new ATOM 502 N ASP A 29 -10.354 1.188 -1.500 1.00 0.00 N ATOM 503 CA ASP A 29 -10.924 1.713 -2.738 1.00 0.00 C ATOM 504 C ASP A 29 -11.150 0.600 -3.754 1.00 0.00 C ATOM 505 O ASP A 29 -12.182 0.557 -4.413 1.00 0.00 O ATOM 506 CB ASP A 29 -10.021 2.792 -3.351 1.00 0.00 C ATOM 507 CG ASP A 29 -10.022 4.093 -2.566 1.00 0.00 C ATOM 508 OD1 ASP A 29 -11.119 4.613 -2.262 1.00 0.00 O ATOM 509 OD2 ASP A 29 -8.927 4.620 -2.276 1.00 0.00 O ATOM 0 H ASP A 29 -9.472 1.624 -1.229 1.00 0.00 H new ATOM 0 HA ASP A 29 -11.885 2.161 -2.485 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -9.001 2.412 -3.410 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -10.346 2.991 -4.372 1.00 0.00 H new ATOM 514 N VAL A 30 -10.185 -0.303 -3.866 1.00 0.00 N ATOM 515 CA VAL A 30 -10.275 -1.406 -4.818 1.00 0.00 C ATOM 516 C VAL A 30 -11.461 -2.322 -4.507 1.00 0.00 C ATOM 517 O VAL A 30 -12.178 -2.746 -5.415 1.00 0.00 O ATOM 518 CB VAL A 30 -8.968 -2.232 -4.844 1.00 0.00 C ATOM 519 CG1 VAL A 30 -9.124 -3.481 -5.693 1.00 0.00 C ATOM 520 CG2 VAL A 30 -7.822 -1.391 -5.372 1.00 0.00 C ATOM 0 H VAL A 30 -9.330 -0.295 -3.310 1.00 0.00 H new ATOM 0 HA VAL A 30 -10.430 -0.963 -5.802 1.00 0.00 H new ATOM 0 HB VAL A 30 -8.747 -2.538 -3.821 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.189 -4.041 -5.692 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -9.920 -4.103 -5.283 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -9.376 -3.197 -6.715 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.909 -1.987 -5.384 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -8.051 -1.058 -6.384 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -7.681 -0.523 -4.728 1.00 0.00 H new ATOM 530 N VAL A 31 -11.672 -2.604 -3.225 1.00 0.00 N ATOM 531 CA VAL A 31 -12.757 -3.488 -2.797 1.00 0.00 C ATOM 532 C VAL A 31 -14.118 -2.812 -2.973 1.00 0.00 C ATOM 533 O VAL A 31 -15.108 -3.457 -3.325 1.00 0.00 O ATOM 534 CB VAL A 31 -12.589 -3.908 -1.318 1.00 0.00 C ATOM 535 CG1 VAL A 31 -13.679 -4.884 -0.898 1.00 0.00 C ATOM 536 CG2 VAL A 31 -11.216 -4.514 -1.081 1.00 0.00 C ATOM 0 H VAL A 31 -11.106 -2.234 -2.461 1.00 0.00 H new ATOM 0 HA VAL A 31 -12.711 -4.377 -3.427 1.00 0.00 H new ATOM 0 HB VAL A 31 -12.681 -3.011 -0.706 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.536 -5.162 0.146 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.655 -4.413 -1.018 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -13.628 -5.777 -1.521 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -11.121 -4.802 -0.034 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -11.093 -5.394 -1.712 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -10.447 -3.781 -1.327 1.00 0.00 H new ATOM 546 N ASN A 32 -14.152 -1.509 -2.738 1.00 0.00 N ATOM 547 CA ASN A 32 -15.395 -0.746 -2.801 1.00 0.00 C ATOM 548 C ASN A 32 -15.743 -0.370 -4.234 1.00 0.00 C ATOM 549 O ASN A 32 -16.904 -0.116 -4.556 1.00 0.00 O ATOM 550 CB ASN A 32 -15.287 0.523 -1.948 1.00 0.00 C ATOM 551 CG ASN A 32 -15.404 0.257 -0.458 1.00 0.00 C ATOM 552 OD1 ASN A 32 -15.074 -0.823 0.030 1.00 0.00 O ATOM 553 ND2 ASN A 32 -15.869 1.256 0.277 1.00 0.00 N ATOM 0 H ASN A 32 -13.330 -0.953 -2.501 1.00 0.00 H new ATOM 0 HA ASN A 32 -16.190 -1.380 -2.409 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -14.332 1.008 -2.150 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -16.068 1.221 -2.248 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -15.964 1.145 1.286 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -16.132 2.136 -0.166 1.00 0.00 H new ATOM 560 N SER A 33 -14.740 -0.335 -5.089 1.00 0.00 N ATOM 561 CA SER A 33 -14.938 0.053 -6.473 1.00 0.00 C ATOM 562 C SER A 33 -15.246 -1.168 -7.327 1.00 0.00 C ATOM 563 O SER A 33 -14.770 -2.268 -7.048 1.00 0.00 O ATOM 564 CB SER A 33 -13.696 0.772 -7.003 1.00 0.00 C ATOM 565 OG SER A 33 -13.856 1.158 -8.357 1.00 0.00 O ATOM 0 H SER A 33 -13.777 -0.571 -4.850 1.00 0.00 H new ATOM 0 HA SER A 33 -15.786 0.735 -6.525 1.00 0.00 H new ATOM 0 HB2 SER A 33 -13.497 1.654 -6.394 1.00 0.00 H new ATOM 0 HB3 SER A 33 -12.829 0.118 -6.910 1.00 0.00 H new ATOM 0 HG SER A 33 -13.198 0.688 -8.911 1.00 0.00 H new ATOM 571 N ASP A 34 -16.024 -0.963 -8.386 1.00 0.00 N ATOM 572 CA ASP A 34 -16.408 -2.048 -9.286 1.00 0.00 C ATOM 573 C ASP A 34 -15.203 -2.578 -10.065 1.00 0.00 C ATOM 574 O ASP A 34 -15.319 -3.548 -10.815 1.00 0.00 O ATOM 575 CB ASP A 34 -17.500 -1.585 -10.255 1.00 0.00 C ATOM 576 CG ASP A 34 -18.848 -1.406 -9.582 1.00 0.00 C ATOM 577 OD1 ASP A 34 -19.105 -0.316 -9.033 1.00 0.00 O ATOM 578 OD2 ASP A 34 -19.662 -2.354 -9.604 1.00 0.00 O ATOM 0 H ASP A 34 -16.403 -0.052 -8.643 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.801 -2.860 -8.674 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -17.199 -0.642 -10.710 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -17.596 -2.312 -11.061 1.00 0.00 H new ATOM 583 N THR A 35 -14.055 -1.935 -9.881 1.00 0.00 N ATOM 584 CA THR A 35 -12.805 -2.380 -10.480 1.00 0.00 C ATOM 585 C THR A 35 -12.484 -3.818 -10.062 1.00 0.00 C ATOM 586 O THR A 35 -12.131 -4.652 -10.895 1.00 0.00 O ATOM 587 CB THR A 35 -11.649 -1.441 -10.073 1.00 0.00 C ATOM 588 OG1 THR A 35 -11.986 -0.092 -10.430 1.00 0.00 O ATOM 589 CG2 THR A 35 -10.343 -1.835 -10.752 1.00 0.00 C ATOM 0 H THR A 35 -13.966 -1.092 -9.313 1.00 0.00 H new ATOM 0 HA THR A 35 -12.919 -2.351 -11.564 1.00 0.00 H new ATOM 0 HB THR A 35 -11.507 -1.523 -8.995 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.255 0.507 -10.171 1.00 0.00 H new ATOM 0 HG21 THR A 35 -9.552 -1.152 -10.442 1.00 0.00 H new ATOM 0 HG22 THR A 35 -10.077 -2.853 -10.466 1.00 0.00 H new ATOM 0 HG23 THR A 35 -10.465 -1.782 -11.834 1.00 0.00 H new ATOM 597 N PHE A 36 -12.626 -4.107 -8.773 1.00 0.00 N ATOM 598 CA PHE A 36 -12.394 -5.457 -8.266 1.00 0.00 C ATOM 599 C PHE A 36 -13.480 -5.870 -7.282 1.00 0.00 C ATOM 600 O PHE A 36 -13.312 -6.828 -6.532 1.00 0.00 O ATOM 601 CB PHE A 36 -11.027 -5.564 -7.590 1.00 0.00 C ATOM 602 CG PHE A 36 -9.887 -5.823 -8.535 1.00 0.00 C ATOM 603 CD1 PHE A 36 -9.557 -7.120 -8.897 1.00 0.00 C ATOM 604 CD2 PHE A 36 -9.139 -4.777 -9.049 1.00 0.00 C ATOM 605 CE1 PHE A 36 -8.503 -7.368 -9.754 1.00 0.00 C ATOM 606 CE2 PHE A 36 -8.085 -5.020 -9.910 1.00 0.00 C ATOM 607 CZ PHE A 36 -7.767 -6.317 -10.261 1.00 0.00 C ATOM 0 H PHE A 36 -12.899 -3.429 -8.062 1.00 0.00 H new ATOM 0 HA PHE A 36 -12.420 -6.131 -9.123 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -10.830 -4.640 -7.047 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -11.061 -6.366 -6.853 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -10.131 -7.946 -8.504 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -9.382 -3.761 -8.774 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -8.255 -8.383 -10.027 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -7.511 -4.196 -10.308 1.00 0.00 H new ATOM 0 HZ PHE A 36 -6.943 -6.509 -10.932 1.00 0.00 H new ATOM 617 N LYS A 37 -14.600 -5.157 -7.309 1.00 0.00 N ATOM 618 CA LYS A 37 -15.730 -5.454 -6.431 1.00 0.00 C ATOM 619 C LYS A 37 -16.200 -6.897 -6.618 1.00 0.00 C ATOM 620 O LYS A 37 -16.722 -7.516 -5.690 1.00 0.00 O ATOM 621 CB LYS A 37 -16.888 -4.501 -6.721 1.00 0.00 C ATOM 622 CG LYS A 37 -17.948 -4.476 -5.632 1.00 0.00 C ATOM 623 CD LYS A 37 -19.156 -3.660 -6.057 1.00 0.00 C ATOM 624 CE LYS A 37 -19.957 -4.375 -7.134 1.00 0.00 C ATOM 625 NZ LYS A 37 -21.074 -3.539 -7.644 1.00 0.00 N ATOM 0 H LYS A 37 -14.752 -4.364 -7.933 1.00 0.00 H new ATOM 0 HA LYS A 37 -15.400 -5.322 -5.401 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -16.493 -3.494 -6.854 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -17.355 -4.787 -7.663 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -18.258 -5.495 -5.400 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -17.525 -4.056 -4.719 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.793 -3.472 -5.192 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -18.829 -2.689 -6.429 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -19.297 -4.641 -7.960 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -20.356 -5.306 -6.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -21.827 -4.154 -8.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -21.451 -2.955 -6.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -20.726 -2.923 -8.406 1.00 0.00 H new ATOM 639 N GLY A 38 -16.002 -7.426 -7.825 1.00 0.00 N ATOM 640 CA GLY A 38 -16.392 -8.794 -8.123 1.00 0.00 C ATOM 641 C GLY A 38 -15.621 -9.816 -7.307 1.00 0.00 C ATOM 642 O GLY A 38 -16.049 -10.964 -7.176 1.00 0.00 O ATOM 0 H GLY A 38 -15.576 -6.927 -8.606 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -17.459 -8.913 -7.932 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -16.235 -8.989 -9.184 1.00 0.00 H new ATOM 646 N GLN A 39 -14.483 -9.406 -6.765 1.00 0.00 N ATOM 647 CA GLN A 39 -13.697 -10.263 -5.891 1.00 0.00 C ATOM 648 C GLN A 39 -13.696 -9.683 -4.482 1.00 0.00 C ATOM 649 O GLN A 39 -12.913 -8.788 -4.173 1.00 0.00 O ATOM 650 CB GLN A 39 -12.260 -10.408 -6.408 1.00 0.00 C ATOM 651 CG GLN A 39 -12.172 -10.899 -7.845 1.00 0.00 C ATOM 652 CD GLN A 39 -10.748 -11.202 -8.273 1.00 0.00 C ATOM 653 OE1 GLN A 39 -9.914 -11.611 -7.463 1.00 0.00 O ATOM 654 NE2 GLN A 39 -10.456 -10.995 -9.545 1.00 0.00 N ATOM 0 H GLN A 39 -14.082 -8.480 -6.917 1.00 0.00 H new ATOM 0 HA GLN A 39 -14.147 -11.256 -5.876 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -11.757 -9.444 -6.332 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -11.720 -11.101 -5.763 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -12.779 -11.797 -7.956 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -12.594 -10.145 -8.509 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -11.175 -10.656 -10.185 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -9.512 -11.174 -9.887 1.00 0.00 H new ATOM 663 N PRO A 40 -14.596 -10.176 -3.615 1.00 0.00 N ATOM 664 CA PRO A 40 -14.777 -9.636 -2.262 1.00 0.00 C ATOM 665 C PRO A 40 -13.527 -9.762 -1.397 1.00 0.00 C ATOM 666 O PRO A 40 -13.277 -8.927 -0.528 1.00 0.00 O ATOM 667 CB PRO A 40 -15.915 -10.482 -1.677 1.00 0.00 C ATOM 668 CG PRO A 40 -15.950 -11.715 -2.512 1.00 0.00 C ATOM 669 CD PRO A 40 -15.516 -11.293 -3.886 1.00 0.00 C ATOM 0 HA PRO A 40 -14.991 -8.568 -2.291 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -15.731 -10.720 -0.629 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -16.865 -9.949 -1.720 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -15.284 -12.479 -2.109 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -16.952 -12.144 -2.533 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -15.020 -12.104 -4.419 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -16.362 -10.980 -4.498 1.00 0.00 H new ATOM 677 N ILE A 41 -12.749 -10.812 -1.628 1.00 0.00 N ATOM 678 CA ILE A 41 -11.541 -11.045 -0.851 1.00 0.00 C ATOM 679 C ILE A 41 -10.323 -11.056 -1.763 1.00 0.00 C ATOM 680 O ILE A 41 -10.406 -11.469 -2.922 1.00 0.00 O ATOM 681 CB ILE A 41 -11.594 -12.385 -0.075 1.00 0.00 C ATOM 682 CG1 ILE A 41 -12.889 -12.511 0.724 1.00 0.00 C ATOM 683 CG2 ILE A 41 -10.402 -12.515 0.863 1.00 0.00 C ATOM 684 CD1 ILE A 41 -13.152 -11.348 1.655 1.00 0.00 C ATOM 0 H ILE A 41 -12.933 -11.513 -2.345 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.468 -10.232 -0.129 1.00 0.00 H new ATOM 0 HB ILE A 41 -11.558 -13.188 -0.811 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -13.725 -12.604 0.030 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -12.856 -13.431 1.308 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.461 -13.463 1.397 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -9.479 -12.481 0.285 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -10.412 -11.694 1.580 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -14.090 -11.512 2.186 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -12.337 -11.266 2.374 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -13.219 -10.427 1.076 1.00 0.00 H new ATOM 696 N PHE A 42 -9.202 -10.595 -1.238 1.00 0.00 N ATOM 697 CA PHE A 42 -7.944 -10.619 -1.959 1.00 0.00 C ATOM 698 C PHE A 42 -6.972 -11.549 -1.240 1.00 0.00 C ATOM 699 O PHE A 42 -7.401 -12.445 -0.513 1.00 0.00 O ATOM 700 CB PHE A 42 -7.387 -9.196 -2.087 1.00 0.00 C ATOM 701 CG PHE A 42 -8.194 -8.329 -3.014 1.00 0.00 C ATOM 702 CD1 PHE A 42 -9.381 -7.753 -2.595 1.00 0.00 C ATOM 703 CD2 PHE A 42 -7.768 -8.106 -4.313 1.00 0.00 C ATOM 704 CE1 PHE A 42 -10.127 -6.970 -3.453 1.00 0.00 C ATOM 705 CE2 PHE A 42 -8.510 -7.324 -5.174 1.00 0.00 C ATOM 706 CZ PHE A 42 -9.691 -6.757 -4.744 1.00 0.00 C ATOM 0 H PHE A 42 -9.139 -10.195 -0.302 1.00 0.00 H new ATOM 0 HA PHE A 42 -8.096 -11.001 -2.969 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -7.357 -8.734 -1.100 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.359 -9.245 -2.447 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -9.727 -7.918 -1.585 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -6.845 -8.549 -4.656 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -11.051 -6.525 -3.114 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -8.166 -7.156 -6.184 1.00 0.00 H new ATOM 0 HZ PHE A 42 -10.274 -6.147 -5.418 1.00 0.00 H new ATOM 716 N ASP A 43 -5.678 -11.362 -1.439 1.00 0.00 N ATOM 717 CA ASP A 43 -4.689 -12.229 -0.817 1.00 0.00 C ATOM 718 C ASP A 43 -3.355 -11.505 -0.726 1.00 0.00 C ATOM 719 O ASP A 43 -3.216 -10.403 -1.256 1.00 0.00 O ATOM 720 CB ASP A 43 -4.542 -13.521 -1.628 1.00 0.00 C ATOM 721 CG ASP A 43 -3.831 -14.615 -0.860 1.00 0.00 C ATOM 722 OD1 ASP A 43 -4.512 -15.388 -0.160 1.00 0.00 O ATOM 723 OD2 ASP A 43 -2.589 -14.696 -0.945 1.00 0.00 O ATOM 0 H ASP A 43 -5.288 -10.622 -2.023 1.00 0.00 H new ATOM 0 HA ASP A 43 -5.018 -12.486 0.190 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -5.530 -13.874 -1.924 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -3.991 -13.309 -2.544 1.00 0.00 H new ATOM 728 N HIS A 44 -2.377 -12.132 -0.082 1.00 0.00 N ATOM 729 CA HIS A 44 -1.042 -11.556 0.062 1.00 0.00 C ATOM 730 C HIS A 44 -0.384 -11.390 -1.307 1.00 0.00 C ATOM 731 O HIS A 44 0.517 -10.567 -1.483 1.00 0.00 O ATOM 732 CB HIS A 44 -0.172 -12.432 0.970 1.00 0.00 C ATOM 733 CG HIS A 44 -0.558 -12.379 2.420 1.00 0.00 C ATOM 734 ND1 HIS A 44 0.335 -12.065 3.423 1.00 0.00 N ATOM 735 CD2 HIS A 44 -1.741 -12.618 3.039 1.00 0.00 C ATOM 736 CE1 HIS A 44 -0.282 -12.109 4.591 1.00 0.00 C ATOM 737 NE2 HIS A 44 -1.541 -12.443 4.385 1.00 0.00 N ATOM 0 H HIS A 44 -2.484 -13.048 0.353 1.00 0.00 H new ATOM 0 HA HIS A 44 -1.139 -10.573 0.523 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -0.231 -13.465 0.626 1.00 0.00 H new ATOM 0 HB3 HIS A 44 0.868 -12.121 0.870 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -2.669 -12.895 2.561 1.00 0.00 H new ATOM 0 HE1 HIS A 44 0.169 -11.906 5.551 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -2.251 -12.553 5.109 1.00 0.00 H new ATOM 746 N ALA A 45 -0.853 -12.170 -2.278 1.00 0.00 N ATOM 747 CA ALA A 45 -0.420 -12.019 -3.662 1.00 0.00 C ATOM 748 C ALA A 45 -0.861 -10.674 -4.213 1.00 0.00 C ATOM 749 O ALA A 45 -0.136 -10.034 -4.965 1.00 0.00 O ATOM 750 CB ALA A 45 -0.966 -13.153 -4.514 1.00 0.00 C ATOM 0 H ALA A 45 -1.535 -12.914 -2.130 1.00 0.00 H new ATOM 0 HA ALA A 45 0.669 -12.060 -3.692 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -0.634 -13.026 -5.544 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -0.601 -14.105 -4.130 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -2.055 -13.142 -4.480 1.00 0.00 H new ATOM 756 N HIS A 46 -2.038 -10.228 -3.804 1.00 0.00 N ATOM 757 CA HIS A 46 -2.533 -8.933 -4.236 1.00 0.00 C ATOM 758 C HIS A 46 -1.942 -7.835 -3.365 1.00 0.00 C ATOM 759 O HIS A 46 -1.964 -6.662 -3.730 1.00 0.00 O ATOM 760 CB HIS A 46 -4.060 -8.878 -4.213 1.00 0.00 C ATOM 761 CG HIS A 46 -4.708 -9.750 -5.247 1.00 0.00 C ATOM 762 ND1 HIS A 46 -4.503 -9.604 -6.604 1.00 0.00 N ATOM 763 CD2 HIS A 46 -5.566 -10.786 -5.113 1.00 0.00 C ATOM 764 CE1 HIS A 46 -5.211 -10.507 -7.253 1.00 0.00 C ATOM 765 NE2 HIS A 46 -5.863 -11.234 -6.373 1.00 0.00 N ATOM 0 H HIS A 46 -2.662 -10.739 -3.180 1.00 0.00 H new ATOM 0 HA HIS A 46 -2.218 -8.777 -5.268 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -4.411 -9.177 -3.226 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -4.380 -7.848 -4.366 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -3.898 -8.906 -7.037 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -5.947 -11.186 -4.185 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.249 -10.629 -8.325 1.00 0.00 H new ATOM 774 N THR A 47 -1.415 -8.224 -2.205 1.00 0.00 N ATOM 775 CA THR A 47 -0.677 -7.302 -1.357 1.00 0.00 C ATOM 776 C THR A 47 0.543 -6.782 -2.099 1.00 0.00 C ATOM 777 O THR A 47 0.653 -5.587 -2.358 1.00 0.00 O ATOM 778 CB THR A 47 -0.214 -7.968 -0.048 1.00 0.00 C ATOM 779 OG1 THR A 47 -1.346 -8.417 0.709 1.00 0.00 O ATOM 780 CG2 THR A 47 0.627 -7.004 0.781 1.00 0.00 C ATOM 0 H THR A 47 -1.488 -9.172 -1.835 1.00 0.00 H new ATOM 0 HA THR A 47 -1.351 -6.483 -1.107 1.00 0.00 H new ATOM 0 HB THR A 47 0.403 -8.830 -0.302 1.00 0.00 H new ATOM 0 HG1 THR A 47 -1.053 -8.693 1.603 1.00 0.00 H new ATOM 0 HG21 THR A 47 0.943 -7.496 1.701 1.00 0.00 H new ATOM 0 HG22 THR A 47 1.505 -6.704 0.210 1.00 0.00 H new ATOM 0 HG23 THR A 47 0.035 -6.122 1.026 1.00 0.00 H new ATOM 788 N ARG A 48 1.445 -7.692 -2.461 1.00 0.00 N ATOM 789 CA ARG A 48 2.648 -7.320 -3.194 1.00 0.00 C ATOM 790 C ARG A 48 2.275 -6.598 -4.483 1.00 0.00 C ATOM 791 O ARG A 48 2.870 -5.582 -4.824 1.00 0.00 O ATOM 792 CB ARG A 48 3.505 -8.552 -3.498 1.00 0.00 C ATOM 793 CG ARG A 48 2.769 -9.644 -4.254 1.00 0.00 C ATOM 794 CD ARG A 48 3.689 -10.785 -4.649 1.00 0.00 C ATOM 795 NE ARG A 48 3.012 -11.739 -5.524 1.00 0.00 N ATOM 796 CZ ARG A 48 2.890 -11.579 -6.842 1.00 0.00 C ATOM 797 NH1 ARG A 48 3.440 -10.529 -7.445 1.00 0.00 N ATOM 798 NH2 ARG A 48 2.225 -12.476 -7.560 1.00 0.00 N ATOM 0 H ARG A 48 1.364 -8.688 -2.258 1.00 0.00 H new ATOM 0 HA ARG A 48 3.236 -6.646 -2.571 1.00 0.00 H new ATOM 0 HB2 ARG A 48 4.374 -8.243 -4.080 1.00 0.00 H new ATOM 0 HB3 ARG A 48 3.879 -8.962 -2.560 1.00 0.00 H new ATOM 0 HG2 ARG A 48 1.959 -10.030 -3.635 1.00 0.00 H new ATOM 0 HG3 ARG A 48 2.313 -9.220 -5.149 1.00 0.00 H new ATOM 0 HD2 ARG A 48 4.569 -10.386 -5.155 1.00 0.00 H new ATOM 0 HD3 ARG A 48 4.041 -11.297 -3.753 1.00 0.00 H new ATOM 0 HE ARG A 48 2.609 -12.576 -5.102 1.00 0.00 H new ATOM 0 HH11 ARG A 48 3.958 -9.841 -6.899 1.00 0.00 H new ATOM 0 HH12 ARG A 48 3.343 -10.412 -8.454 1.00 0.00 H new ATOM 0 HH21 ARG A 48 1.808 -13.287 -7.103 1.00 0.00 H new ATOM 0 HH22 ARG A 48 2.131 -12.354 -8.568 1.00 0.00 H new ATOM 812 N GLU A 49 1.266 -7.123 -5.165 1.00 0.00 N ATOM 813 CA GLU A 49 0.738 -6.513 -6.375 1.00 0.00 C ATOM 814 C GLU A 49 0.445 -5.026 -6.172 1.00 0.00 C ATOM 815 O GLU A 49 1.043 -4.166 -6.825 1.00 0.00 O ATOM 816 CB GLU A 49 -0.539 -7.242 -6.787 1.00 0.00 C ATOM 817 CG GLU A 49 -0.313 -8.446 -7.684 1.00 0.00 C ATOM 818 CD GLU A 49 -1.609 -9.168 -7.994 1.00 0.00 C ATOM 819 OE1 GLU A 49 -2.662 -8.500 -8.082 1.00 0.00 O ATOM 820 OE2 GLU A 49 -1.590 -10.409 -8.128 1.00 0.00 O ATOM 0 H GLU A 49 0.791 -7.984 -4.894 1.00 0.00 H new ATOM 0 HA GLU A 49 1.489 -6.598 -7.160 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.063 -7.567 -5.888 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -1.194 -6.539 -7.301 1.00 0.00 H new ATOM 0 HG2 GLU A 49 0.155 -8.124 -8.614 1.00 0.00 H new ATOM 0 HG3 GLU A 49 0.380 -9.135 -7.201 1.00 0.00 H new ATOM 827 N PHE A 50 -0.456 -4.727 -5.246 1.00 0.00 N ATOM 828 CA PHE A 50 -0.906 -3.358 -5.038 1.00 0.00 C ATOM 829 C PHE A 50 0.142 -2.506 -4.328 1.00 0.00 C ATOM 830 O PHE A 50 0.319 -1.335 -4.663 1.00 0.00 O ATOM 831 CB PHE A 50 -2.221 -3.341 -4.257 1.00 0.00 C ATOM 832 CG PHE A 50 -3.397 -3.826 -5.057 1.00 0.00 C ATOM 833 CD1 PHE A 50 -3.457 -3.600 -6.424 1.00 0.00 C ATOM 834 CD2 PHE A 50 -4.447 -4.492 -4.445 1.00 0.00 C ATOM 835 CE1 PHE A 50 -4.540 -4.027 -7.165 1.00 0.00 C ATOM 836 CE2 PHE A 50 -5.532 -4.923 -5.183 1.00 0.00 C ATOM 837 CZ PHE A 50 -5.579 -4.690 -6.544 1.00 0.00 C ATOM 0 H PHE A 50 -0.889 -5.413 -4.628 1.00 0.00 H new ATOM 0 HA PHE A 50 -1.067 -2.920 -6.023 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.115 -3.962 -3.368 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -2.418 -2.325 -3.914 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.646 -3.083 -6.915 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -4.417 -4.676 -3.381 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.574 -3.843 -8.229 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -6.344 -5.442 -4.696 1.00 0.00 H new ATOM 0 HZ PHE A 50 -6.428 -5.026 -7.121 1.00 0.00 H new ATOM 847 N ILE A 51 0.845 -3.085 -3.360 1.00 0.00 N ATOM 848 CA ILE A 51 1.834 -2.330 -2.603 1.00 0.00 C ATOM 849 C ILE A 51 2.980 -1.875 -3.504 1.00 0.00 C ATOM 850 O ILE A 51 3.373 -0.707 -3.469 1.00 0.00 O ATOM 851 CB ILE A 51 2.397 -3.120 -1.399 1.00 0.00 C ATOM 852 CG1 ILE A 51 1.294 -3.398 -0.370 1.00 0.00 C ATOM 853 CG2 ILE A 51 3.536 -2.350 -0.749 1.00 0.00 C ATOM 854 CD1 ILE A 51 0.585 -2.152 0.125 1.00 0.00 C ATOM 0 H ILE A 51 0.750 -4.062 -3.084 1.00 0.00 H new ATOM 0 HA ILE A 51 1.314 -1.457 -2.208 1.00 0.00 H new ATOM 0 HB ILE A 51 2.778 -4.074 -1.764 1.00 0.00 H new ATOM 0 HG12 ILE A 51 0.559 -4.070 -0.813 1.00 0.00 H new ATOM 0 HG13 ILE A 51 1.730 -3.919 0.483 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.923 -2.918 0.097 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.333 -2.195 -1.477 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.170 -1.384 -0.401 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -0.180 -2.432 0.849 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.307 -1.487 0.599 1.00 0.00 H new ATOM 0 HD13 ILE A 51 0.118 -1.640 -0.717 1.00 0.00 H new ATOM 866 N GLN A 52 3.496 -2.787 -4.331 1.00 0.00 N ATOM 867 CA GLN A 52 4.580 -2.450 -5.250 1.00 0.00 C ATOM 868 C GLN A 52 4.115 -1.404 -6.255 1.00 0.00 C ATOM 869 O GLN A 52 4.866 -0.497 -6.607 1.00 0.00 O ATOM 870 CB GLN A 52 5.095 -3.687 -5.991 1.00 0.00 C ATOM 871 CG GLN A 52 5.703 -4.753 -5.089 1.00 0.00 C ATOM 872 CD GLN A 52 6.904 -4.262 -4.302 1.00 0.00 C ATOM 873 OE1 GLN A 52 7.648 -3.386 -4.746 1.00 0.00 O ATOM 874 NE2 GLN A 52 7.106 -4.836 -3.126 1.00 0.00 N ATOM 0 H GLN A 52 3.182 -3.756 -4.382 1.00 0.00 H new ATOM 0 HA GLN A 52 5.400 -2.044 -4.657 1.00 0.00 H new ATOM 0 HB2 GLN A 52 4.271 -4.129 -6.551 1.00 0.00 H new ATOM 0 HB3 GLN A 52 5.844 -3.374 -6.719 1.00 0.00 H new ATOM 0 HG2 GLN A 52 4.942 -5.107 -4.394 1.00 0.00 H new ATOM 0 HG3 GLN A 52 6.001 -5.607 -5.698 1.00 0.00 H new ATOM 0 HE21 GLN A 52 6.466 -5.558 -2.794 1.00 0.00 H new ATOM 0 HE22 GLN A 52 7.901 -4.556 -2.552 1.00 0.00 H new ATOM 883 N SER A 53 2.866 -1.524 -6.698 1.00 0.00 N ATOM 884 CA SER A 53 2.291 -0.560 -7.629 1.00 0.00 C ATOM 885 C SER A 53 2.202 0.826 -6.985 1.00 0.00 C ATOM 886 O SER A 53 2.440 1.848 -7.636 1.00 0.00 O ATOM 887 CB SER A 53 0.907 -1.027 -8.090 1.00 0.00 C ATOM 888 OG SER A 53 0.983 -2.294 -8.728 1.00 0.00 O ATOM 0 H SER A 53 2.235 -2.278 -6.427 1.00 0.00 H new ATOM 0 HA SER A 53 2.943 -0.490 -8.500 1.00 0.00 H new ATOM 0 HB2 SER A 53 0.236 -1.087 -7.233 1.00 0.00 H new ATOM 0 HB3 SER A 53 0.483 -0.295 -8.777 1.00 0.00 H new ATOM 0 HG SER A 53 1.040 -2.999 -8.050 1.00 0.00 H new ATOM 894 N PHE A 54 1.883 0.861 -5.698 1.00 0.00 N ATOM 895 CA PHE A 54 1.820 2.121 -4.975 1.00 0.00 C ATOM 896 C PHE A 54 3.219 2.723 -4.864 1.00 0.00 C ATOM 897 O PHE A 54 3.383 3.938 -4.887 1.00 0.00 O ATOM 898 CB PHE A 54 1.207 1.923 -3.585 1.00 0.00 C ATOM 899 CG PHE A 54 0.713 3.201 -2.966 1.00 0.00 C ATOM 900 CD1 PHE A 54 1.565 4.013 -2.234 1.00 0.00 C ATOM 901 CD2 PHE A 54 -0.607 3.593 -3.123 1.00 0.00 C ATOM 902 CE1 PHE A 54 1.110 5.190 -1.671 1.00 0.00 C ATOM 903 CE2 PHE A 54 -1.068 4.768 -2.562 1.00 0.00 C ATOM 904 CZ PHE A 54 -0.208 5.567 -1.835 1.00 0.00 C ATOM 0 H PHE A 54 1.665 0.037 -5.138 1.00 0.00 H new ATOM 0 HA PHE A 54 1.180 2.809 -5.527 1.00 0.00 H new ATOM 0 HB2 PHE A 54 0.378 1.219 -3.658 1.00 0.00 H new ATOM 0 HB3 PHE A 54 1.951 1.473 -2.928 1.00 0.00 H new ATOM 0 HD1 PHE A 54 2.597 3.722 -2.102 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -1.284 2.972 -3.691 1.00 0.00 H new ATOM 0 HE1 PHE A 54 1.784 5.814 -1.103 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -2.099 5.061 -2.692 1.00 0.00 H new ATOM 0 HZ PHE A 54 -0.566 6.486 -1.395 1.00 0.00 H new ATOM 914 N ILE A 55 4.225 1.857 -4.769 1.00 0.00 N ATOM 915 CA ILE A 55 5.617 2.297 -4.755 1.00 0.00 C ATOM 916 C ILE A 55 5.999 2.869 -6.121 1.00 0.00 C ATOM 917 O ILE A 55 6.861 3.743 -6.230 1.00 0.00 O ATOM 918 CB ILE A 55 6.574 1.137 -4.388 1.00 0.00 C ATOM 919 CG1 ILE A 55 6.201 0.549 -3.023 1.00 0.00 C ATOM 920 CG2 ILE A 55 8.024 1.610 -4.381 1.00 0.00 C ATOM 921 CD1 ILE A 55 7.034 -0.648 -2.623 1.00 0.00 C ATOM 0 H ILE A 55 4.102 0.847 -4.701 1.00 0.00 H new ATOM 0 HA ILE A 55 5.715 3.071 -3.994 1.00 0.00 H new ATOM 0 HB ILE A 55 6.472 0.360 -5.145 1.00 0.00 H new ATOM 0 HG12 ILE A 55 6.307 1.323 -2.263 1.00 0.00 H new ATOM 0 HG13 ILE A 55 5.150 0.259 -3.038 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.677 0.777 -4.120 1.00 0.00 H new ATOM 0 HG22 ILE A 55 8.290 1.984 -5.370 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.143 2.408 -3.648 1.00 0.00 H new ATOM 0 HD11 ILE A 55 6.710 -1.007 -1.646 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.909 -1.441 -3.360 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.084 -0.360 -2.574 1.00 0.00 H new ATOM 933 N GLU A 56 5.349 2.367 -7.168 1.00 0.00 N ATOM 934 CA GLU A 56 5.550 2.887 -8.516 1.00 0.00 C ATOM 935 C GLU A 56 4.929 4.272 -8.650 1.00 0.00 C ATOM 936 O GLU A 56 5.333 5.062 -9.499 1.00 0.00 O ATOM 937 CB GLU A 56 4.943 1.954 -9.564 1.00 0.00 C ATOM 938 CG GLU A 56 5.522 0.553 -9.552 1.00 0.00 C ATOM 939 CD GLU A 56 4.944 -0.311 -10.651 1.00 0.00 C ATOM 940 OE1 GLU A 56 3.725 -0.575 -10.624 1.00 0.00 O ATOM 941 OE2 GLU A 56 5.705 -0.734 -11.545 1.00 0.00 O ATOM 0 H GLU A 56 4.679 1.601 -7.108 1.00 0.00 H new ATOM 0 HA GLU A 56 6.624 2.953 -8.688 1.00 0.00 H new ATOM 0 HB2 GLU A 56 3.867 1.893 -9.401 1.00 0.00 H new ATOM 0 HB3 GLU A 56 5.092 2.389 -10.552 1.00 0.00 H new ATOM 0 HG2 GLU A 56 6.605 0.608 -9.666 1.00 0.00 H new ATOM 0 HG3 GLU A 56 5.326 0.089 -8.586 1.00 0.00 H new ATOM 948 N ARG A 57 3.939 4.559 -7.815 1.00 0.00 N ATOM 949 CA ARG A 57 3.319 5.881 -7.796 1.00 0.00 C ATOM 950 C ARG A 57 4.300 6.945 -7.307 1.00 0.00 C ATOM 951 O ARG A 57 4.198 8.114 -7.683 1.00 0.00 O ATOM 952 CB ARG A 57 2.058 5.880 -6.934 1.00 0.00 C ATOM 953 CG ARG A 57 0.902 5.126 -7.567 1.00 0.00 C ATOM 954 CD ARG A 57 -0.366 5.241 -6.738 1.00 0.00 C ATOM 955 NE ARG A 57 -1.535 4.754 -7.467 1.00 0.00 N ATOM 956 CZ ARG A 57 -2.790 4.869 -7.036 1.00 0.00 C ATOM 957 NH1 ARG A 57 -3.047 5.415 -5.856 1.00 0.00 N ATOM 958 NH2 ARG A 57 -3.790 4.440 -7.793 1.00 0.00 N ATOM 0 H ARG A 57 3.548 3.898 -7.144 1.00 0.00 H new ATOM 0 HA ARG A 57 3.036 6.127 -8.819 1.00 0.00 H new ATOM 0 HB2 ARG A 57 2.288 5.434 -5.966 1.00 0.00 H new ATOM 0 HB3 ARG A 57 1.753 6.909 -6.747 1.00 0.00 H new ATOM 0 HG2 ARG A 57 0.718 5.515 -8.568 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.170 4.075 -7.678 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.250 4.673 -5.815 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -0.522 6.282 -6.454 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.380 4.296 -8.365 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -2.281 5.750 -5.272 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.011 5.500 -5.532 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -3.598 4.023 -8.704 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.752 4.527 -7.465 1.00 0.00 H new ATOM 972 N ASP A 58 5.257 6.539 -6.476 1.00 0.00 N ATOM 973 CA ASP A 58 6.324 7.443 -6.046 1.00 0.00 C ATOM 974 C ASP A 58 7.242 7.758 -7.223 1.00 0.00 C ATOM 975 O ASP A 58 7.877 8.810 -7.275 1.00 0.00 O ATOM 976 CB ASP A 58 7.142 6.836 -4.899 1.00 0.00 C ATOM 977 CG ASP A 58 6.334 6.645 -3.626 1.00 0.00 C ATOM 978 OD1 ASP A 58 6.013 7.655 -2.957 1.00 0.00 O ATOM 979 OD2 ASP A 58 6.020 5.484 -3.288 1.00 0.00 O ATOM 0 H ASP A 58 5.317 5.597 -6.089 1.00 0.00 H new ATOM 0 HA ASP A 58 5.862 8.362 -5.684 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.542 5.873 -5.216 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.995 7.481 -4.688 1.00 0.00 H new ATOM 984 N ASP A 59 7.291 6.835 -8.179 1.00 0.00 N ATOM 985 CA ASP A 59 8.075 7.024 -9.397 1.00 0.00 C ATOM 986 C ASP A 59 7.396 8.033 -10.316 1.00 0.00 C ATOM 987 O ASP A 59 8.040 8.670 -11.144 1.00 0.00 O ATOM 988 CB ASP A 59 8.272 5.690 -10.123 1.00 0.00 C ATOM 989 CG ASP A 59 8.882 5.850 -11.503 1.00 0.00 C ATOM 990 OD1 ASP A 59 10.119 5.986 -11.604 1.00 0.00 O ATOM 991 OD2 ASP A 59 8.125 5.824 -12.497 1.00 0.00 O ATOM 0 H ASP A 59 6.795 5.945 -8.134 1.00 0.00 H new ATOM 0 HA ASP A 59 9.054 7.412 -9.118 1.00 0.00 H new ATOM 0 HB2 ASP A 59 8.913 5.046 -9.521 1.00 0.00 H new ATOM 0 HB3 ASP A 59 7.310 5.186 -10.213 1.00 0.00 H new ATOM 996 N THR A 60 6.093 8.198 -10.146 1.00 0.00 N ATOM 997 CA THR A 60 5.344 9.167 -10.926 1.00 0.00 C ATOM 998 C THR A 60 5.844 10.581 -10.633 1.00 0.00 C ATOM 999 O THR A 60 5.934 11.422 -11.528 1.00 0.00 O ATOM 1000 CB THR A 60 3.837 9.063 -10.631 1.00 0.00 C ATOM 1001 OG1 THR A 60 3.430 7.689 -10.711 1.00 0.00 O ATOM 1002 CG2 THR A 60 3.027 9.892 -11.619 1.00 0.00 C ATOM 0 H THR A 60 5.534 7.672 -9.474 1.00 0.00 H new ATOM 0 HA THR A 60 5.500 8.949 -11.982 1.00 0.00 H new ATOM 0 HB THR A 60 3.654 9.449 -9.628 1.00 0.00 H new ATOM 0 HG1 THR A 60 2.471 7.620 -10.522 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.966 9.800 -11.387 1.00 0.00 H new ATOM 0 HG22 THR A 60 3.325 10.938 -11.547 1.00 0.00 H new ATOM 0 HG23 THR A 60 3.210 9.532 -12.632 1.00 0.00 H new ATOM 1010 N GLU A 61 6.205 10.825 -9.378 1.00 0.00 N ATOM 1011 CA GLU A 61 6.763 12.112 -8.987 1.00 0.00 C ATOM 1012 C GLU A 61 8.234 12.182 -9.375 1.00 0.00 C ATOM 1013 O GLU A 61 8.811 13.262 -9.506 1.00 0.00 O ATOM 1014 CB GLU A 61 6.608 12.335 -7.487 1.00 0.00 C ATOM 1015 CG GLU A 61 5.177 12.206 -6.999 1.00 0.00 C ATOM 1016 CD GLU A 61 4.976 12.841 -5.644 1.00 0.00 C ATOM 1017 OE1 GLU A 61 5.505 12.310 -4.647 1.00 0.00 O ATOM 1018 OE2 GLU A 61 4.306 13.894 -5.579 1.00 0.00 O ATOM 0 H GLU A 61 6.121 10.151 -8.617 1.00 0.00 H new ATOM 0 HA GLU A 61 6.217 12.897 -9.510 1.00 0.00 H new ATOM 0 HB2 GLU A 61 7.231 11.616 -6.955 1.00 0.00 H new ATOM 0 HB3 GLU A 61 6.981 13.328 -7.235 1.00 0.00 H new ATOM 0 HG2 GLU A 61 4.506 12.673 -7.720 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.906 11.151 -6.948 1.00 0.00 H new ATOM 1025 N LEU A 62 8.833 11.016 -9.553 1.00 0.00 N ATOM 1026 CA LEU A 62 10.201 10.914 -10.036 1.00 0.00 C ATOM 1027 C LEU A 62 10.248 11.302 -11.514 1.00 0.00 C ATOM 1028 O LEU A 62 11.177 11.962 -11.973 1.00 0.00 O ATOM 1029 CB LEU A 62 10.707 9.484 -9.826 1.00 0.00 C ATOM 1030 CG LEU A 62 12.143 9.201 -10.268 1.00 0.00 C ATOM 1031 CD1 LEU A 62 13.117 10.130 -9.568 1.00 0.00 C ATOM 1032 CD2 LEU A 62 12.494 7.750 -9.979 1.00 0.00 C ATOM 0 H LEU A 62 8.388 10.117 -9.368 1.00 0.00 H new ATOM 0 HA LEU A 62 10.847 11.594 -9.481 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.622 9.243 -8.766 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.044 8.805 -10.362 1.00 0.00 H new ATOM 0 HG LEU A 62 12.219 9.380 -11.341 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.132 9.909 -9.899 1.00 0.00 H new ATOM 0 HD12 LEU A 62 12.873 11.164 -9.812 1.00 0.00 H new ATOM 0 HD13 LEU A 62 13.047 9.985 -8.490 1.00 0.00 H new ATOM 0 HD21 LEU A 62 13.518 7.553 -10.296 1.00 0.00 H new ATOM 0 HD22 LEU A 62 12.402 7.559 -8.910 1.00 0.00 H new ATOM 0 HD23 LEU A 62 11.814 7.096 -10.524 1.00 0.00 H new ATOM 1044 N ASP A 63 9.214 10.904 -12.241 1.00 0.00 N ATOM 1045 CA ASP A 63 9.069 11.263 -13.643 1.00 0.00 C ATOM 1046 C ASP A 63 8.675 12.734 -13.774 1.00 0.00 C ATOM 1047 O ASP A 63 8.896 13.359 -14.808 1.00 0.00 O ATOM 1048 CB ASP A 63 8.023 10.368 -14.309 1.00 0.00 C ATOM 1049 CG ASP A 63 7.940 10.578 -15.808 1.00 0.00 C ATOM 1050 OD1 ASP A 63 8.827 10.083 -16.529 1.00 0.00 O ATOM 1051 OD2 ASP A 63 6.974 11.214 -16.271 1.00 0.00 O ATOM 0 H ASP A 63 8.456 10.326 -11.878 1.00 0.00 H new ATOM 0 HA ASP A 63 10.025 11.115 -14.146 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.262 9.324 -14.106 1.00 0.00 H new ATOM 0 HB3 ASP A 63 7.047 10.564 -13.864 1.00 0.00 H new ATOM 1056 N GLU A 64 8.092 13.284 -12.714 1.00 0.00 N ATOM 1057 CA GLU A 64 7.791 14.712 -12.666 1.00 0.00 C ATOM 1058 C GLU A 64 9.074 15.529 -12.636 1.00 0.00 C ATOM 1059 O GLU A 64 9.118 16.654 -13.137 1.00 0.00 O ATOM 1060 CB GLU A 64 6.922 15.050 -11.457 1.00 0.00 C ATOM 1061 CG GLU A 64 5.447 14.824 -11.710 1.00 0.00 C ATOM 1062 CD GLU A 64 4.966 15.601 -12.913 1.00 0.00 C ATOM 1063 OE1 GLU A 64 4.683 16.811 -12.770 1.00 0.00 O ATOM 1064 OE2 GLU A 64 4.892 15.017 -14.011 1.00 0.00 O ATOM 0 H GLU A 64 7.819 12.766 -11.879 1.00 0.00 H new ATOM 0 HA GLU A 64 7.235 14.966 -13.568 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.237 14.443 -10.608 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.083 16.092 -11.180 1.00 0.00 H new ATOM 0 HG2 GLU A 64 5.262 13.761 -11.864 1.00 0.00 H new ATOM 0 HG3 GLU A 64 4.876 15.122 -10.831 1.00 0.00 H new ATOM 1071 N LEU A 65 10.114 14.953 -12.050 1.00 0.00 N ATOM 1072 CA LEU A 65 11.436 15.559 -12.066 1.00 0.00 C ATOM 1073 C LEU A 65 12.005 15.510 -13.475 1.00 0.00 C ATOM 1074 O LEU A 65 12.714 16.416 -13.908 1.00 0.00 O ATOM 1075 CB LEU A 65 12.366 14.835 -11.093 1.00 0.00 C ATOM 1076 CG LEU A 65 12.010 14.999 -9.618 1.00 0.00 C ATOM 1077 CD1 LEU A 65 12.880 14.099 -8.765 1.00 0.00 C ATOM 1078 CD2 LEU A 65 12.177 16.447 -9.195 1.00 0.00 C ATOM 0 H LEU A 65 10.066 14.062 -11.555 1.00 0.00 H new ATOM 0 HA LEU A 65 11.353 16.599 -11.751 1.00 0.00 H new ATOM 0 HB2 LEU A 65 12.365 13.772 -11.336 1.00 0.00 H new ATOM 0 HB3 LEU A 65 13.383 15.196 -11.248 1.00 0.00 H new ATOM 0 HG LEU A 65 10.968 14.712 -9.476 1.00 0.00 H new ATOM 0 HD11 LEU A 65 12.616 14.226 -7.715 1.00 0.00 H new ATOM 0 HD12 LEU A 65 12.724 13.060 -9.056 1.00 0.00 H new ATOM 0 HD13 LEU A 65 13.928 14.362 -8.910 1.00 0.00 H new ATOM 0 HD21 LEU A 65 11.920 16.550 -8.141 1.00 0.00 H new ATOM 0 HD22 LEU A 65 13.212 16.754 -9.348 1.00 0.00 H new ATOM 0 HD23 LEU A 65 11.519 17.079 -9.792 1.00 0.00 H new ATOM 1267 N PRO A 75 17.255 16.678 -14.360 1.00 0.00 N ATOM 1268 CA PRO A 75 18.037 17.023 -13.167 1.00 0.00 C ATOM 1269 C PRO A 75 18.740 15.811 -12.572 1.00 0.00 C ATOM 1270 O PRO A 75 18.099 14.954 -11.965 1.00 0.00 O ATOM 1271 CB PRO A 75 16.994 17.546 -12.177 1.00 0.00 C ATOM 1272 CG PRO A 75 15.814 17.909 -13.010 1.00 0.00 C ATOM 1273 CD PRO A 75 15.824 16.964 -14.177 1.00 0.00 C ATOM 0 HA PRO A 75 18.822 17.742 -13.402 1.00 0.00 H new ATOM 0 HB2 PRO A 75 16.736 16.787 -11.438 1.00 0.00 H new ATOM 0 HB3 PRO A 75 17.370 18.410 -11.628 1.00 0.00 H new ATOM 0 HG2 PRO A 75 14.890 17.815 -12.440 1.00 0.00 H new ATOM 0 HG3 PRO A 75 15.877 18.944 -13.346 1.00 0.00 H new ATOM 0 HD2 PRO A 75 15.255 16.058 -13.967 1.00 0.00 H new ATOM 0 HD3 PRO A 75 15.386 17.417 -15.067 1.00 0.00 H new ATOM 1281 N SER A 76 20.053 15.748 -12.747 1.00 0.00 N ATOM 1282 CA SER A 76 20.838 14.621 -12.265 1.00 0.00 C ATOM 1283 C SER A 76 20.692 14.463 -10.752 1.00 0.00 C ATOM 1284 O SER A 76 20.330 13.398 -10.259 1.00 0.00 O ATOM 1285 CB SER A 76 22.309 14.833 -12.616 1.00 0.00 C ATOM 1286 OG SER A 76 22.456 15.415 -13.903 1.00 0.00 O ATOM 0 H SER A 76 20.598 16.468 -13.221 1.00 0.00 H new ATOM 0 HA SER A 76 20.470 13.714 -12.745 1.00 0.00 H new ATOM 0 HB2 SER A 76 22.774 15.476 -11.869 1.00 0.00 H new ATOM 0 HB3 SER A 76 22.833 13.878 -12.585 1.00 0.00 H new ATOM 0 HG SER A 76 23.408 15.540 -14.099 1.00 0.00 H new ATOM 1292 N ASN A 77 20.941 15.549 -10.030 1.00 0.00 N ATOM 1293 CA ASN A 77 20.958 15.523 -8.570 1.00 0.00 C ATOM 1294 C ASN A 77 19.554 15.358 -8.003 1.00 0.00 C ATOM 1295 O ASN A 77 19.321 14.533 -7.123 1.00 0.00 O ATOM 1296 CB ASN A 77 21.581 16.814 -8.034 1.00 0.00 C ATOM 1297 CG ASN A 77 21.652 16.855 -6.518 1.00 0.00 C ATOM 1298 OD1 ASN A 77 21.851 15.836 -5.858 1.00 0.00 O ATOM 1299 ND2 ASN A 77 21.483 18.041 -5.956 1.00 0.00 N ATOM 0 H ASN A 77 21.135 16.465 -10.434 1.00 0.00 H new ATOM 0 HA ASN A 77 21.556 14.668 -8.255 1.00 0.00 H new ATOM 0 HB2 ASN A 77 22.586 16.922 -8.442 1.00 0.00 H new ATOM 0 HB3 ASN A 77 21.000 17.665 -8.388 1.00 0.00 H new ATOM 0 HD21 ASN A 77 21.516 18.134 -4.941 1.00 0.00 H new ATOM 0 HD22 ASN A 77 21.320 18.863 -6.538 1.00 0.00 H new ATOM 1306 N ARG A 78 18.616 16.135 -8.531 1.00 0.00 N ATOM 1307 CA ARG A 78 17.258 16.160 -8.000 1.00 0.00 C ATOM 1308 C ARG A 78 16.563 14.816 -8.192 1.00 0.00 C ATOM 1309 O ARG A 78 15.820 14.362 -7.321 1.00 0.00 O ATOM 1310 CB ARG A 78 16.445 17.269 -8.664 1.00 0.00 C ATOM 1311 CG ARG A 78 17.122 18.628 -8.609 1.00 0.00 C ATOM 1312 CD ARG A 78 16.200 19.732 -9.097 1.00 0.00 C ATOM 1313 NE ARG A 78 16.894 21.012 -9.213 1.00 0.00 N ATOM 1314 CZ ARG A 78 16.876 21.961 -8.277 1.00 0.00 C ATOM 1315 NH1 ARG A 78 16.270 21.749 -7.114 1.00 0.00 N ATOM 1316 NH2 ARG A 78 17.482 23.117 -8.503 1.00 0.00 N ATOM 0 H ARG A 78 18.770 16.756 -9.326 1.00 0.00 H new ATOM 0 HA ARG A 78 17.324 16.359 -6.930 1.00 0.00 H new ATOM 0 HB2 ARG A 78 16.264 17.003 -9.706 1.00 0.00 H new ATOM 0 HB3 ARG A 78 15.471 17.336 -8.179 1.00 0.00 H new ATOM 0 HG2 ARG A 78 17.433 18.839 -7.586 1.00 0.00 H new ATOM 0 HG3 ARG A 78 18.025 18.610 -9.220 1.00 0.00 H new ATOM 0 HD2 ARG A 78 15.784 19.456 -10.066 1.00 0.00 H new ATOM 0 HD3 ARG A 78 15.361 19.835 -8.408 1.00 0.00 H new ATOM 0 HE ARG A 78 17.426 21.191 -10.064 1.00 0.00 H new ATOM 0 HH11 ARG A 78 15.814 20.855 -6.932 1.00 0.00 H new ATOM 0 HH12 ARG A 78 16.261 22.480 -6.403 1.00 0.00 H new ATOM 0 HH21 ARG A 78 17.959 23.278 -9.390 1.00 0.00 H new ATOM 0 HH22 ARG A 78 17.471 23.846 -7.790 1.00 0.00 H new ATOM 1330 N GLN A 79 16.818 14.179 -9.329 1.00 0.00 N ATOM 1331 CA GLN A 79 16.216 12.888 -9.629 1.00 0.00 C ATOM 1332 C GLN A 79 16.752 11.819 -8.680 1.00 0.00 C ATOM 1333 O GLN A 79 16.011 10.945 -8.222 1.00 0.00 O ATOM 1334 CB GLN A 79 16.492 12.505 -11.083 1.00 0.00 C ATOM 1335 CG GLN A 79 15.756 11.260 -11.541 1.00 0.00 C ATOM 1336 CD GLN A 79 16.010 10.937 -12.998 1.00 0.00 C ATOM 1337 OE1 GLN A 79 15.279 11.383 -13.882 1.00 0.00 O ATOM 1338 NE2 GLN A 79 17.046 10.159 -13.264 1.00 0.00 N ATOM 0 H GLN A 79 17.437 14.536 -10.057 1.00 0.00 H new ATOM 0 HA GLN A 79 15.138 12.961 -9.488 1.00 0.00 H new ATOM 0 HB2 GLN A 79 16.212 13.338 -11.727 1.00 0.00 H new ATOM 0 HB3 GLN A 79 17.563 12.349 -11.210 1.00 0.00 H new ATOM 0 HG2 GLN A 79 16.063 10.414 -10.926 1.00 0.00 H new ATOM 0 HG3 GLN A 79 14.686 11.396 -11.384 1.00 0.00 H new ATOM 0 HE21 GLN A 79 17.629 9.809 -12.504 1.00 0.00 H new ATOM 0 HE22 GLN A 79 17.262 9.909 -14.229 1.00 0.00 H new ATOM 1347 N VAL A 80 18.038 11.908 -8.370 1.00 0.00 N ATOM 1348 CA VAL A 80 18.663 10.977 -7.435 1.00 0.00 C ATOM 1349 C VAL A 80 18.170 11.239 -6.011 1.00 0.00 C ATOM 1350 O VAL A 80 18.007 10.311 -5.216 1.00 0.00 O ATOM 1351 CB VAL A 80 20.206 11.070 -7.484 1.00 0.00 C ATOM 1352 CG1 VAL A 80 20.845 10.177 -6.429 1.00 0.00 C ATOM 1353 CG2 VAL A 80 20.712 10.693 -8.867 1.00 0.00 C ATOM 0 H VAL A 80 18.669 12.613 -8.750 1.00 0.00 H new ATOM 0 HA VAL A 80 18.376 9.969 -7.735 1.00 0.00 H new ATOM 0 HB VAL A 80 20.489 12.101 -7.270 1.00 0.00 H new ATOM 0 HG11 VAL A 80 21.930 10.263 -6.488 1.00 0.00 H new ATOM 0 HG12 VAL A 80 20.509 10.486 -5.439 1.00 0.00 H new ATOM 0 HG13 VAL A 80 20.554 9.141 -6.604 1.00 0.00 H new ATOM 0 HG21 VAL A 80 21.800 10.763 -8.888 1.00 0.00 H new ATOM 0 HG22 VAL A 80 20.409 9.672 -9.099 1.00 0.00 H new ATOM 0 HG23 VAL A 80 20.291 11.374 -9.607 1.00 0.00 H new ATOM 1363 N LEU A 81 17.916 12.504 -5.704 1.00 0.00 N ATOM 1364 CA LEU A 81 17.390 12.892 -4.400 1.00 0.00 C ATOM 1365 C LEU A 81 16.040 12.222 -4.137 1.00 0.00 C ATOM 1366 O LEU A 81 15.782 11.728 -3.035 1.00 0.00 O ATOM 1367 CB LEU A 81 17.249 14.413 -4.319 1.00 0.00 C ATOM 1368 CG LEU A 81 16.731 14.952 -2.986 1.00 0.00 C ATOM 1369 CD1 LEU A 81 17.662 14.558 -1.851 1.00 0.00 C ATOM 1370 CD2 LEU A 81 16.580 16.463 -3.055 1.00 0.00 C ATOM 0 H LEU A 81 18.066 13.284 -6.344 1.00 0.00 H new ATOM 0 HA LEU A 81 18.092 12.560 -3.635 1.00 0.00 H new ATOM 0 HB2 LEU A 81 18.221 14.863 -4.520 1.00 0.00 H new ATOM 0 HB3 LEU A 81 16.576 14.741 -5.111 1.00 0.00 H new ATOM 0 HG LEU A 81 15.753 14.513 -2.790 1.00 0.00 H new ATOM 0 HD11 LEU A 81 17.276 14.951 -0.911 1.00 0.00 H new ATOM 0 HD12 LEU A 81 17.724 13.471 -1.792 1.00 0.00 H new ATOM 0 HD13 LEU A 81 18.655 14.969 -2.036 1.00 0.00 H new ATOM 0 HD21 LEU A 81 16.210 16.836 -2.100 1.00 0.00 H new ATOM 0 HD22 LEU A 81 17.548 16.916 -3.271 1.00 0.00 H new ATOM 0 HD23 LEU A 81 15.874 16.722 -3.844 1.00 0.00 H new ATOM 1382 N LEU A 82 15.183 12.209 -5.154 1.00 0.00 N ATOM 1383 CA LEU A 82 13.902 11.513 -5.072 1.00 0.00 C ATOM 1384 C LEU A 82 14.158 10.030 -4.825 1.00 0.00 C ATOM 1385 O LEU A 82 13.552 9.416 -3.944 1.00 0.00 O ATOM 1386 CB LEU A 82 13.112 11.717 -6.379 1.00 0.00 C ATOM 1387 CG LEU A 82 11.604 11.378 -6.364 1.00 0.00 C ATOM 1388 CD1 LEU A 82 11.350 9.892 -6.154 1.00 0.00 C ATOM 1389 CD2 LEU A 82 10.876 12.194 -5.307 1.00 0.00 C ATOM 0 H LEU A 82 15.353 12.673 -6.046 1.00 0.00 H new ATOM 0 HA LEU A 82 13.312 11.916 -4.249 1.00 0.00 H new ATOM 0 HB2 LEU A 82 13.219 12.760 -6.677 1.00 0.00 H new ATOM 0 HB3 LEU A 82 13.584 11.114 -7.155 1.00 0.00 H new ATOM 0 HG LEU A 82 11.210 11.641 -7.346 1.00 0.00 H new ATOM 0 HD11 LEU A 82 10.276 9.703 -6.151 1.00 0.00 H new ATOM 0 HD12 LEU A 82 11.816 9.326 -6.961 1.00 0.00 H new ATOM 0 HD13 LEU A 82 11.776 9.581 -5.200 1.00 0.00 H new ATOM 0 HD21 LEU A 82 9.817 11.938 -5.316 1.00 0.00 H new ATOM 0 HD22 LEU A 82 11.295 11.974 -4.325 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.994 13.256 -5.522 1.00 0.00 H new ATOM 1401 N GLN A 83 15.081 9.477 -5.603 1.00 0.00 N ATOM 1402 CA GLN A 83 15.446 8.073 -5.508 1.00 0.00 C ATOM 1403 C GLN A 83 15.850 7.694 -4.085 1.00 0.00 C ATOM 1404 O GLN A 83 15.375 6.699 -3.554 1.00 0.00 O ATOM 1405 CB GLN A 83 16.588 7.766 -6.476 1.00 0.00 C ATOM 1406 CG GLN A 83 17.114 6.345 -6.381 1.00 0.00 C ATOM 1407 CD GLN A 83 18.291 6.098 -7.304 1.00 0.00 C ATOM 1408 OE1 GLN A 83 18.388 6.690 -8.380 1.00 0.00 O ATOM 1409 NE2 GLN A 83 19.197 5.232 -6.889 1.00 0.00 N ATOM 0 H GLN A 83 15.596 9.992 -6.317 1.00 0.00 H new ATOM 0 HA GLN A 83 14.572 7.479 -5.776 1.00 0.00 H new ATOM 0 HB2 GLN A 83 16.246 7.948 -7.495 1.00 0.00 H new ATOM 0 HB3 GLN A 83 17.408 8.459 -6.286 1.00 0.00 H new ATOM 0 HG2 GLN A 83 17.413 6.140 -5.353 1.00 0.00 H new ATOM 0 HG3 GLN A 83 16.313 5.647 -6.625 1.00 0.00 H new ATOM 0 HE21 GLN A 83 19.080 4.762 -5.991 1.00 0.00 H new ATOM 0 HE22 GLN A 83 20.014 5.033 -7.466 1.00 0.00 H new ATOM 1418 N GLN A 84 16.709 8.501 -3.472 1.00 0.00 N ATOM 1419 CA GLN A 84 17.213 8.213 -2.128 1.00 0.00 C ATOM 1420 C GLN A 84 16.093 8.238 -1.086 1.00 0.00 C ATOM 1421 O GLN A 84 16.072 7.418 -0.166 1.00 0.00 O ATOM 1422 CB GLN A 84 18.313 9.204 -1.750 1.00 0.00 C ATOM 1423 CG GLN A 84 19.555 9.085 -2.619 1.00 0.00 C ATOM 1424 CD GLN A 84 20.640 10.066 -2.230 1.00 0.00 C ATOM 1425 OE1 GLN A 84 20.363 11.163 -1.743 1.00 0.00 O ATOM 1426 NE2 GLN A 84 21.886 9.673 -2.439 1.00 0.00 N ATOM 0 H GLN A 84 17.073 9.361 -3.882 1.00 0.00 H new ATOM 0 HA GLN A 84 17.630 7.206 -2.140 1.00 0.00 H new ATOM 0 HB2 GLN A 84 17.921 10.218 -1.826 1.00 0.00 H new ATOM 0 HB3 GLN A 84 18.591 9.047 -0.708 1.00 0.00 H new ATOM 0 HG2 GLN A 84 19.947 8.070 -2.548 1.00 0.00 H new ATOM 0 HG3 GLN A 84 19.281 9.248 -3.661 1.00 0.00 H new ATOM 0 HE21 GLN A 84 22.070 8.756 -2.845 1.00 0.00 H new ATOM 0 HE22 GLN A 84 22.662 10.288 -2.194 1.00 0.00 H new ATOM 1435 N ARG A 85 15.164 9.176 -1.233 1.00 0.00 N ATOM 1436 CA ARG A 85 14.012 9.262 -0.336 1.00 0.00 C ATOM 1437 C ARG A 85 13.106 8.046 -0.518 1.00 0.00 C ATOM 1438 O ARG A 85 12.694 7.397 0.454 1.00 0.00 O ATOM 1439 CB ARG A 85 13.229 10.549 -0.607 1.00 0.00 C ATOM 1440 CG ARG A 85 13.940 11.809 -0.137 1.00 0.00 C ATOM 1441 CD ARG A 85 13.289 13.066 -0.694 1.00 0.00 C ATOM 1442 NE ARG A 85 11.838 13.082 -0.485 1.00 0.00 N ATOM 1443 CZ ARG A 85 11.025 14.023 -0.973 1.00 0.00 C ATOM 1444 NH1 ARG A 85 11.523 15.084 -1.601 1.00 0.00 N ATOM 1445 NH2 ARG A 85 9.712 13.914 -0.809 1.00 0.00 N ATOM 0 H ARG A 85 15.184 9.888 -1.963 1.00 0.00 H new ATOM 0 HA ARG A 85 14.371 9.278 0.693 1.00 0.00 H new ATOM 0 HB2 ARG A 85 13.037 10.629 -1.677 1.00 0.00 H new ATOM 0 HB3 ARG A 85 12.259 10.484 -0.114 1.00 0.00 H new ATOM 0 HG2 ARG A 85 13.930 11.847 0.952 1.00 0.00 H new ATOM 0 HG3 ARG A 85 14.985 11.773 -0.446 1.00 0.00 H new ATOM 0 HD2 ARG A 85 13.732 13.942 -0.220 1.00 0.00 H new ATOM 0 HD3 ARG A 85 13.501 13.140 -1.761 1.00 0.00 H new ATOM 0 HE ARG A 85 11.425 12.330 0.066 1.00 0.00 H new ATOM 0 HH11 ARG A 85 12.532 15.183 -1.713 1.00 0.00 H new ATOM 0 HH12 ARG A 85 10.896 15.798 -1.971 1.00 0.00 H new ATOM 0 HH21 ARG A 85 9.325 13.112 -0.311 1.00 0.00 H new ATOM 0 HH22 ARG A 85 9.090 14.632 -1.181 1.00 0.00 H new ATOM 1459 N ARG A 86 12.819 7.739 -1.776 1.00 0.00 N ATOM 1460 CA ARG A 86 11.998 6.591 -2.135 1.00 0.00 C ATOM 1461 C ARG A 86 12.655 5.300 -1.644 1.00 0.00 C ATOM 1462 O ARG A 86 11.989 4.405 -1.126 1.00 0.00 O ATOM 1463 CB ARG A 86 11.820 6.561 -3.657 1.00 0.00 C ATOM 1464 CG ARG A 86 10.847 5.513 -4.167 1.00 0.00 C ATOM 1465 CD ARG A 86 10.767 5.555 -5.684 1.00 0.00 C ATOM 1466 NE ARG A 86 9.812 4.591 -6.225 1.00 0.00 N ATOM 1467 CZ ARG A 86 10.019 3.888 -7.339 1.00 0.00 C ATOM 1468 NH1 ARG A 86 11.152 4.021 -8.019 1.00 0.00 N ATOM 1469 NH2 ARG A 86 9.089 3.055 -7.781 1.00 0.00 N ATOM 0 H ARG A 86 13.149 8.279 -2.576 1.00 0.00 H new ATOM 0 HA ARG A 86 11.020 6.675 -1.661 1.00 0.00 H new ATOM 0 HB2 ARG A 86 11.480 7.542 -3.988 1.00 0.00 H new ATOM 0 HB3 ARG A 86 12.792 6.388 -4.118 1.00 0.00 H new ATOM 0 HG2 ARG A 86 11.166 4.523 -3.841 1.00 0.00 H new ATOM 0 HG3 ARG A 86 9.859 5.687 -3.740 1.00 0.00 H new ATOM 0 HD2 ARG A 86 10.483 6.558 -6.001 1.00 0.00 H new ATOM 0 HD3 ARG A 86 11.754 5.356 -6.101 1.00 0.00 H new ATOM 0 HE ARG A 86 8.937 4.447 -5.722 1.00 0.00 H new ATOM 0 HH11 ARG A 86 11.872 4.665 -7.690 1.00 0.00 H new ATOM 0 HH12 ARG A 86 11.302 3.480 -8.870 1.00 0.00 H new ATOM 0 HH21 ARG A 86 8.213 2.951 -7.269 1.00 0.00 H new ATOM 0 HH22 ARG A 86 9.249 2.518 -8.633 1.00 0.00 H new ATOM 1483 N ASP A 87 13.974 5.236 -1.796 1.00 0.00 N ATOM 1484 CA ASP A 87 14.764 4.092 -1.352 1.00 0.00 C ATOM 1485 C ASP A 87 14.683 3.919 0.157 1.00 0.00 C ATOM 1486 O ASP A 87 14.637 2.798 0.652 1.00 0.00 O ATOM 1487 CB ASP A 87 16.225 4.261 -1.780 1.00 0.00 C ATOM 1488 CG ASP A 87 17.134 3.183 -1.222 1.00 0.00 C ATOM 1489 OD1 ASP A 87 17.134 2.057 -1.761 1.00 0.00 O ATOM 1490 OD2 ASP A 87 17.873 3.465 -0.250 1.00 0.00 O ATOM 0 H ASP A 87 14.526 5.976 -2.230 1.00 0.00 H new ATOM 0 HA ASP A 87 14.352 3.198 -1.820 1.00 0.00 H new ATOM 0 HB2 ASP A 87 16.283 4.250 -2.868 1.00 0.00 H new ATOM 0 HB3 ASP A 87 16.584 5.237 -1.452 1.00 0.00 H new ATOM 1495 N GLN A 88 14.647 5.031 0.886 1.00 0.00 N ATOM 1496 CA GLN A 88 14.572 4.972 2.340 1.00 0.00 C ATOM 1497 C GLN A 88 13.306 4.255 2.781 1.00 0.00 C ATOM 1498 O GLN A 88 13.356 3.353 3.622 1.00 0.00 O ATOM 1499 CB GLN A 88 14.611 6.368 2.965 1.00 0.00 C ATOM 1500 CG GLN A 88 14.505 6.338 4.483 1.00 0.00 C ATOM 1501 CD GLN A 88 14.361 7.713 5.101 1.00 0.00 C ATOM 1502 OE1 GLN A 88 14.862 8.706 4.571 1.00 0.00 O ATOM 1503 NE2 GLN A 88 13.672 7.782 6.228 1.00 0.00 N ATOM 0 H GLN A 88 14.668 5.974 0.498 1.00 0.00 H new ATOM 0 HA GLN A 88 15.444 4.417 2.685 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.539 6.863 2.680 1.00 0.00 H new ATOM 0 HB3 GLN A 88 13.794 6.965 2.560 1.00 0.00 H new ATOM 0 HG2 GLN A 88 13.648 5.728 4.768 1.00 0.00 H new ATOM 0 HG3 GLN A 88 15.392 5.854 4.893 1.00 0.00 H new ATOM 0 HE21 GLN A 88 13.273 6.936 6.635 1.00 0.00 H new ATOM 0 HE22 GLN A 88 13.540 8.681 6.691 1.00 0.00 H new ATOM 1512 N GLU A 89 12.169 4.641 2.211 1.00 0.00 N ATOM 1513 CA GLU A 89 10.912 4.001 2.572 1.00 0.00 C ATOM 1514 C GLU A 89 10.856 2.584 2.015 1.00 0.00 C ATOM 1515 O GLU A 89 10.257 1.702 2.619 1.00 0.00 O ATOM 1516 CB GLU A 89 9.705 4.816 2.107 1.00 0.00 C ATOM 1517 CG GLU A 89 8.385 4.234 2.595 1.00 0.00 C ATOM 1518 CD GLU A 89 7.273 5.256 2.659 1.00 0.00 C ATOM 1519 OE1 GLU A 89 7.402 6.218 3.453 1.00 0.00 O ATOM 1520 OE2 GLU A 89 6.261 5.086 1.944 1.00 0.00 O ATOM 0 H GLU A 89 12.093 5.379 1.511 1.00 0.00 H new ATOM 0 HA GLU A 89 10.868 3.951 3.660 1.00 0.00 H new ATOM 0 HB2 GLU A 89 9.802 5.840 2.467 1.00 0.00 H new ATOM 0 HB3 GLU A 89 9.698 4.860 1.018 1.00 0.00 H new ATOM 0 HG2 GLU A 89 8.086 3.422 1.932 1.00 0.00 H new ATOM 0 HG3 GLU A 89 8.530 3.801 3.585 1.00 0.00 H new ATOM 1527 N LEU A 90 11.496 2.365 0.875 1.00 0.00 N ATOM 1528 CA LEU A 90 11.597 1.026 0.308 1.00 0.00 C ATOM 1529 C LEU A 90 12.381 0.118 1.255 1.00 0.00 C ATOM 1530 O LEU A 90 11.987 -1.020 1.511 1.00 0.00 O ATOM 1531 CB LEU A 90 12.280 1.078 -1.061 1.00 0.00 C ATOM 1532 CG LEU A 90 12.366 -0.260 -1.800 1.00 0.00 C ATOM 1533 CD1 LEU A 90 10.975 -0.793 -2.113 1.00 0.00 C ATOM 1534 CD2 LEU A 90 13.180 -0.109 -3.075 1.00 0.00 C ATOM 0 H LEU A 90 11.952 3.094 0.326 1.00 0.00 H new ATOM 0 HA LEU A 90 10.593 0.622 0.179 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.743 1.788 -1.690 1.00 0.00 H new ATOM 0 HB3 LEU A 90 13.289 1.468 -0.931 1.00 0.00 H new ATOM 0 HG LEU A 90 12.867 -0.979 -1.152 1.00 0.00 H new ATOM 0 HD11 LEU A 90 11.060 -1.744 -2.638 1.00 0.00 H new ATOM 0 HD12 LEU A 90 10.424 -0.939 -1.184 1.00 0.00 H new ATOM 0 HD13 LEU A 90 10.444 -0.078 -2.741 1.00 0.00 H new ATOM 0 HD21 LEU A 90 13.232 -1.069 -3.589 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.705 0.626 -3.725 1.00 0.00 H new ATOM 0 HD23 LEU A 90 14.187 0.224 -2.826 1.00 0.00 H new ATOM 1546 N LYS A 91 13.481 0.643 1.778 1.00 0.00 N ATOM 1547 CA LYS A 91 14.304 -0.065 2.748 1.00 0.00 C ATOM 1548 C LYS A 91 13.489 -0.376 4.001 1.00 0.00 C ATOM 1549 O LYS A 91 13.534 -1.485 4.531 1.00 0.00 O ATOM 1550 CB LYS A 91 15.520 0.797 3.105 1.00 0.00 C ATOM 1551 CG LYS A 91 16.529 0.121 4.017 1.00 0.00 C ATOM 1552 CD LYS A 91 17.635 1.088 4.412 1.00 0.00 C ATOM 1553 CE LYS A 91 18.725 0.401 5.221 1.00 0.00 C ATOM 1554 NZ LYS A 91 19.467 -0.607 4.418 1.00 0.00 N ATOM 0 H LYS A 91 13.828 1.573 1.541 1.00 0.00 H new ATOM 0 HA LYS A 91 14.645 -1.006 2.317 1.00 0.00 H new ATOM 0 HB2 LYS A 91 16.023 1.092 2.184 1.00 0.00 H new ATOM 0 HB3 LYS A 91 15.172 1.712 3.585 1.00 0.00 H new ATOM 0 HG2 LYS A 91 16.027 -0.249 4.911 1.00 0.00 H new ATOM 0 HG3 LYS A 91 16.959 -0.744 3.512 1.00 0.00 H new ATOM 0 HD2 LYS A 91 18.071 1.528 3.515 1.00 0.00 H new ATOM 0 HD3 LYS A 91 17.211 1.906 4.994 1.00 0.00 H new ATOM 0 HE2 LYS A 91 19.423 1.149 5.597 1.00 0.00 H new ATOM 0 HE3 LYS A 91 18.280 -0.084 6.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 20.329 -0.890 4.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 18.865 -1.442 4.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 19.726 -0.196 3.499 1.00 0.00 H new ATOM 1568 N GLU A 92 12.732 0.616 4.448 1.00 0.00 N ATOM 1569 CA GLU A 92 11.875 0.481 5.621 1.00 0.00 C ATOM 1570 C GLU A 92 10.767 -0.542 5.365 1.00 0.00 C ATOM 1571 O GLU A 92 10.422 -1.340 6.235 1.00 0.00 O ATOM 1572 CB GLU A 92 11.283 1.849 5.963 1.00 0.00 C ATOM 1573 CG GLU A 92 10.416 1.871 7.205 1.00 0.00 C ATOM 1574 CD GLU A 92 9.954 3.271 7.537 1.00 0.00 C ATOM 1575 OE1 GLU A 92 9.028 3.769 6.871 1.00 0.00 O ATOM 1576 OE2 GLU A 92 10.534 3.890 8.455 1.00 0.00 O ATOM 0 H GLU A 92 12.693 1.536 4.010 1.00 0.00 H new ATOM 0 HA GLU A 92 12.466 0.122 6.464 1.00 0.00 H new ATOM 0 HB2 GLU A 92 12.099 2.560 6.093 1.00 0.00 H new ATOM 0 HB3 GLU A 92 10.690 2.195 5.116 1.00 0.00 H new ATOM 0 HG2 GLU A 92 9.549 1.227 7.056 1.00 0.00 H new ATOM 0 HG3 GLU A 92 10.975 1.463 8.047 1.00 0.00 H new ATOM 1583 N PHE A 93 10.232 -0.513 4.152 1.00 0.00 N ATOM 1584 CA PHE A 93 9.190 -1.439 3.728 1.00 0.00 C ATOM 1585 C PHE A 93 9.686 -2.886 3.770 1.00 0.00 C ATOM 1586 O PHE A 93 8.953 -3.795 4.168 1.00 0.00 O ATOM 1587 CB PHE A 93 8.728 -1.060 2.315 1.00 0.00 C ATOM 1588 CG PHE A 93 7.848 -2.076 1.651 1.00 0.00 C ATOM 1589 CD1 PHE A 93 6.629 -2.427 2.203 1.00 0.00 C ATOM 1590 CD2 PHE A 93 8.245 -2.680 0.471 1.00 0.00 C ATOM 1591 CE1 PHE A 93 5.821 -3.362 1.593 1.00 0.00 C ATOM 1592 CE2 PHE A 93 7.441 -3.614 -0.145 1.00 0.00 C ATOM 1593 CZ PHE A 93 6.227 -3.958 0.417 1.00 0.00 C ATOM 0 H PHE A 93 10.509 0.155 3.432 1.00 0.00 H new ATOM 0 HA PHE A 93 8.347 -1.367 4.416 1.00 0.00 H new ATOM 0 HB2 PHE A 93 8.192 -0.112 2.364 1.00 0.00 H new ATOM 0 HB3 PHE A 93 9.607 -0.897 1.691 1.00 0.00 H new ATOM 0 HD1 PHE A 93 6.307 -1.963 3.123 1.00 0.00 H new ATOM 0 HD2 PHE A 93 9.194 -2.417 0.029 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.872 -3.628 2.035 1.00 0.00 H new ATOM 0 HE2 PHE A 93 7.760 -4.077 -1.067 1.00 0.00 H new ATOM 0 HZ PHE A 93 5.597 -4.692 -0.063 1.00 0.00 H new ATOM 1603 N LYS A 94 10.939 -3.090 3.385 1.00 0.00 N ATOM 1604 CA LYS A 94 11.532 -4.426 3.362 1.00 0.00 C ATOM 1605 C LYS A 94 11.936 -4.882 4.766 1.00 0.00 C ATOM 1606 O LYS A 94 12.512 -5.957 4.944 1.00 0.00 O ATOM 1607 CB LYS A 94 12.748 -4.451 2.434 1.00 0.00 C ATOM 1608 CG LYS A 94 12.415 -4.161 0.980 1.00 0.00 C ATOM 1609 CD LYS A 94 13.669 -4.144 0.123 1.00 0.00 C ATOM 1610 CE LYS A 94 13.348 -3.897 -1.343 1.00 0.00 C ATOM 1611 NZ LYS A 94 12.494 -4.969 -1.917 1.00 0.00 N ATOM 0 H LYS A 94 11.568 -2.346 3.083 1.00 0.00 H new ATOM 0 HA LYS A 94 10.778 -5.118 2.985 1.00 0.00 H new ATOM 0 HB2 LYS A 94 13.475 -3.718 2.784 1.00 0.00 H new ATOM 0 HB3 LYS A 94 13.224 -5.429 2.500 1.00 0.00 H new ATOM 0 HG2 LYS A 94 11.725 -4.916 0.604 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.907 -3.200 0.905 1.00 0.00 H new ATOM 0 HD2 LYS A 94 14.345 -3.368 0.483 1.00 0.00 H new ATOM 0 HD3 LYS A 94 14.192 -5.095 0.225 1.00 0.00 H new ATOM 0 HE2 LYS A 94 12.842 -2.937 -1.446 1.00 0.00 H new ATOM 0 HE3 LYS A 94 14.276 -3.831 -1.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.688 -5.060 -2.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 12.703 -5.871 -1.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 11.492 -4.728 -1.776 1.00 0.00 H new ATOM 1625 N ALA A 95 11.640 -4.057 5.760 1.00 0.00 N ATOM 1626 CA ALA A 95 11.893 -4.415 7.147 1.00 0.00 C ATOM 1627 C ALA A 95 10.607 -4.892 7.813 1.00 0.00 C ATOM 1628 O ALA A 95 10.605 -5.293 8.976 1.00 0.00 O ATOM 1629 CB ALA A 95 12.482 -3.234 7.903 1.00 0.00 C ATOM 0 H ALA A 95 11.224 -3.135 5.631 1.00 0.00 H new ATOM 0 HA ALA A 95 12.616 -5.230 7.170 1.00 0.00 H new ATOM 0 HB1 ALA A 95 12.665 -3.520 8.939 1.00 0.00 H new ATOM 0 HB2 ALA A 95 13.421 -2.936 7.437 1.00 0.00 H new ATOM 0 HB3 ALA A 95 11.782 -2.399 7.875 1.00 0.00 H new ATOM 1635 N GLY A 96 9.514 -4.849 7.060 1.00 0.00 N ATOM 1636 CA GLY A 96 8.231 -5.258 7.591 1.00 0.00 C ATOM 1637 C GLY A 96 7.289 -4.085 7.749 1.00 0.00 C ATOM 1638 O GLY A 96 7.154 -3.525 8.838 1.00 0.00 O ATOM 0 H GLY A 96 9.495 -4.537 6.089 1.00 0.00 H new ATOM 0 HA2 GLY A 96 7.782 -5.998 6.928 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.375 -5.741 8.557 1.00 0.00 H new ATOM 1642 N PHE A 97 6.634 -3.714 6.658 1.00 0.00 N ATOM 1643 CA PHE A 97 5.734 -2.570 6.657 1.00 0.00 C ATOM 1644 C PHE A 97 4.382 -2.961 7.243 1.00 0.00 C ATOM 1645 O PHE A 97 4.010 -4.137 7.228 1.00 0.00 O ATOM 1646 CB PHE A 97 5.561 -2.041 5.229 1.00 0.00 C ATOM 1647 CG PHE A 97 4.967 -0.661 5.147 1.00 0.00 C ATOM 1648 CD1 PHE A 97 5.745 0.455 5.413 1.00 0.00 C ATOM 1649 CD2 PHE A 97 3.639 -0.479 4.798 1.00 0.00 C ATOM 1650 CE1 PHE A 97 5.207 1.726 5.334 1.00 0.00 C ATOM 1651 CE2 PHE A 97 3.096 0.789 4.715 1.00 0.00 C ATOM 1652 CZ PHE A 97 3.881 1.893 4.984 1.00 0.00 C ATOM 0 H PHE A 97 6.710 -4.191 5.759 1.00 0.00 H new ATOM 0 HA PHE A 97 6.165 -1.782 7.275 1.00 0.00 H new ATOM 0 HB2 PHE A 97 6.533 -2.035 4.736 1.00 0.00 H new ATOM 0 HB3 PHE A 97 4.926 -2.731 4.673 1.00 0.00 H new ATOM 0 HD1 PHE A 97 6.783 0.330 5.685 1.00 0.00 H new ATOM 0 HD2 PHE A 97 3.020 -1.339 4.588 1.00 0.00 H new ATOM 0 HE1 PHE A 97 5.823 2.588 5.546 1.00 0.00 H new ATOM 0 HE2 PHE A 97 2.059 0.916 4.440 1.00 0.00 H new ATOM 0 HZ PHE A 97 3.459 2.885 4.921 1.00 0.00 H new ATOM 1662 N LEU A 98 3.659 -1.979 7.766 1.00 0.00 N ATOM 1663 CA LEU A 98 2.354 -2.224 8.365 1.00 0.00 C ATOM 1664 C LEU A 98 1.291 -2.385 7.282 1.00 0.00 C ATOM 1665 O LEU A 98 0.770 -1.405 6.752 1.00 0.00 O ATOM 1666 CB LEU A 98 1.983 -1.074 9.307 1.00 0.00 C ATOM 1667 CG LEU A 98 0.710 -1.292 10.127 1.00 0.00 C ATOM 1668 CD1 LEU A 98 0.889 -2.462 11.082 1.00 0.00 C ATOM 1669 CD2 LEU A 98 0.344 -0.027 10.889 1.00 0.00 C ATOM 0 H LEU A 98 3.955 -1.003 7.787 1.00 0.00 H new ATOM 0 HA LEU A 98 2.403 -3.149 8.940 1.00 0.00 H new ATOM 0 HB2 LEU A 98 2.813 -0.904 9.992 1.00 0.00 H new ATOM 0 HB3 LEU A 98 1.865 -0.165 8.717 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.107 -1.528 9.445 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -0.025 -2.604 11.658 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.104 -3.367 10.513 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.717 -2.255 11.760 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.564 -0.200 11.467 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.158 0.240 11.563 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.175 0.787 10.184 1.00 0.00 H new ATOM 1681 N CYS A 99 1.002 -3.629 6.927 1.00 0.00 N ATOM 1682 CA CYS A 99 -0.008 -3.920 5.922 1.00 0.00 C ATOM 1683 C CYS A 99 -1.003 -4.946 6.459 1.00 0.00 C ATOM 1684 O CYS A 99 -0.631 -5.841 7.217 1.00 0.00 O ATOM 1685 CB CYS A 99 0.654 -4.440 4.643 1.00 0.00 C ATOM 1686 SG CYS A 99 1.835 -3.283 3.909 1.00 0.00 S ATOM 0 H CYS A 99 1.454 -4.454 7.322 1.00 0.00 H new ATOM 0 HA CYS A 99 -0.546 -3.001 5.687 1.00 0.00 H new ATOM 0 HB2 CYS A 99 1.167 -5.376 4.865 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -0.121 -4.667 3.911 1.00 0.00 H new ATOM 0 HG CYS A 99 2.346 -3.807 2.835 1.00 0.00 H new ATOM 1692 N PRO A 100 -2.289 -4.818 6.092 1.00 0.00 N ATOM 1693 CA PRO A 100 -3.317 -5.764 6.522 1.00 0.00 C ATOM 1694 C PRO A 100 -3.174 -7.116 5.831 1.00 0.00 C ATOM 1695 O PRO A 100 -2.479 -7.239 4.821 1.00 0.00 O ATOM 1696 CB PRO A 100 -4.625 -5.084 6.115 1.00 0.00 C ATOM 1697 CG PRO A 100 -4.256 -4.191 4.985 1.00 0.00 C ATOM 1698 CD PRO A 100 -2.838 -3.750 5.238 1.00 0.00 C ATOM 0 HA PRO A 100 -3.256 -5.980 7.589 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -5.373 -5.816 5.812 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -5.050 -4.518 6.944 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -4.336 -4.716 4.033 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -4.926 -3.333 4.933 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -2.277 -3.652 4.309 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -2.802 -2.781 5.736 1.00 0.00 H new ATOM 1706 N ASP A 101 -3.836 -8.126 6.383 1.00 0.00 N ATOM 1707 CA ASP A 101 -3.769 -9.480 5.841 1.00 0.00 C ATOM 1708 C ASP A 101 -4.319 -9.534 4.420 1.00 0.00 C ATOM 1709 O ASP A 101 -3.752 -10.199 3.554 1.00 0.00 O ATOM 1710 CB ASP A 101 -4.542 -10.448 6.729 1.00 0.00 C ATOM 1711 CG ASP A 101 -4.559 -11.848 6.159 1.00 0.00 C ATOM 1712 OD1 ASP A 101 -3.532 -12.551 6.266 1.00 0.00 O ATOM 1713 OD2 ASP A 101 -5.599 -12.252 5.604 1.00 0.00 O ATOM 0 H ASP A 101 -4.428 -8.033 7.209 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.720 -9.775 5.816 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -4.093 -10.466 7.722 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -5.565 -10.092 6.848 1.00 0.00 H new ATOM 1718 N LEU A 102 -5.448 -8.855 4.214 1.00 0.00 N ATOM 1719 CA LEU A 102 -6.052 -8.675 2.888 1.00 0.00 C ATOM 1720 C LEU A 102 -6.780 -9.937 2.401 1.00 0.00 C ATOM 1721 O LEU A 102 -7.623 -9.863 1.508 1.00 0.00 O ATOM 1722 CB LEU A 102 -4.993 -8.235 1.865 1.00 0.00 C ATOM 1723 CG LEU A 102 -5.540 -7.638 0.566 1.00 0.00 C ATOM 1724 CD1 LEU A 102 -6.261 -6.329 0.843 1.00 0.00 C ATOM 1725 CD2 LEU A 102 -4.419 -7.422 -0.437 1.00 0.00 C ATOM 0 H LEU A 102 -5.975 -8.410 4.966 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.801 -7.889 2.983 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -4.341 -7.499 2.336 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -4.374 -9.097 1.616 1.00 0.00 H new ATOM 0 HG LEU A 102 -6.254 -8.343 0.140 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -6.643 -5.919 -0.092 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -7.091 -6.508 1.527 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -5.567 -5.619 1.293 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.828 -6.997 -1.354 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -3.682 -6.738 -0.017 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -3.942 -8.376 -0.661 1.00 0.00 H new ATOM 1737 N SER A 103 -6.474 -11.086 2.988 1.00 0.00 N ATOM 1738 CA SER A 103 -7.114 -12.336 2.593 1.00 0.00 C ATOM 1739 C SER A 103 -8.119 -12.801 3.641 1.00 0.00 C ATOM 1740 O SER A 103 -8.590 -13.940 3.612 1.00 0.00 O ATOM 1741 CB SER A 103 -6.051 -13.411 2.334 1.00 0.00 C ATOM 1742 OG SER A 103 -5.020 -13.370 3.307 1.00 0.00 O ATOM 0 H SER A 103 -5.789 -11.180 3.738 1.00 0.00 H new ATOM 0 HA SER A 103 -7.667 -12.162 1.670 1.00 0.00 H new ATOM 0 HB2 SER A 103 -6.519 -14.395 2.340 1.00 0.00 H new ATOM 0 HB3 SER A 103 -5.622 -13.268 1.342 1.00 0.00 H new ATOM 0 HG SER A 103 -5.398 -13.110 4.173 1.00 0.00 H new ATOM 1748 N ASP A 104 -8.462 -11.908 4.553 1.00 0.00 N ATOM 1749 CA ASP A 104 -9.449 -12.205 5.580 1.00 0.00 C ATOM 1750 C ASP A 104 -10.734 -11.431 5.300 1.00 0.00 C ATOM 1751 O ASP A 104 -10.694 -10.231 5.018 1.00 0.00 O ATOM 1752 CB ASP A 104 -8.894 -11.851 6.964 1.00 0.00 C ATOM 1753 CG ASP A 104 -9.839 -12.222 8.090 1.00 0.00 C ATOM 1754 OD1 ASP A 104 -10.764 -11.442 8.381 1.00 0.00 O ATOM 1755 OD2 ASP A 104 -9.658 -13.299 8.699 1.00 0.00 O ATOM 0 H ASP A 104 -8.071 -10.967 4.604 1.00 0.00 H new ATOM 0 HA ASP A 104 -9.674 -13.272 5.564 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.943 -12.363 7.111 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.690 -10.781 7.005 1.00 0.00 H new ATOM 1760 N ALA A 105 -11.865 -12.122 5.355 1.00 0.00 N ATOM 1761 CA ALA A 105 -13.157 -11.522 5.037 1.00 0.00 C ATOM 1762 C ALA A 105 -13.556 -10.470 6.062 1.00 0.00 C ATOM 1763 O ALA A 105 -14.067 -9.406 5.708 1.00 0.00 O ATOM 1764 CB ALA A 105 -14.229 -12.599 4.939 1.00 0.00 C ATOM 0 H ALA A 105 -11.915 -13.106 5.619 1.00 0.00 H new ATOM 0 HA ALA A 105 -13.063 -11.024 4.072 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -15.188 -12.138 4.701 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -13.963 -13.307 4.154 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -14.305 -13.124 5.891 1.00 0.00 H new ATOM 1770 N LYS A 106 -13.306 -10.760 7.329 1.00 0.00 N ATOM 1771 CA LYS A 106 -13.620 -9.825 8.400 1.00 0.00 C ATOM 1772 C LYS A 106 -12.707 -8.608 8.304 1.00 0.00 C ATOM 1773 O LYS A 106 -13.107 -7.485 8.609 1.00 0.00 O ATOM 1774 CB LYS A 106 -13.473 -10.516 9.755 1.00 0.00 C ATOM 1775 CG LYS A 106 -14.487 -11.631 9.968 1.00 0.00 C ATOM 1776 CD LYS A 106 -14.124 -12.525 11.146 1.00 0.00 C ATOM 1777 CE LYS A 106 -13.089 -13.579 10.768 1.00 0.00 C ATOM 1778 NZ LYS A 106 -11.756 -12.992 10.462 1.00 0.00 N ATOM 0 H LYS A 106 -12.886 -11.635 7.642 1.00 0.00 H new ATOM 0 HA LYS A 106 -14.652 -9.489 8.300 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -12.467 -10.927 9.840 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -13.583 -9.776 10.548 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -15.472 -11.196 10.135 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -14.555 -12.235 9.063 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -13.736 -11.912 11.960 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -15.023 -13.017 11.518 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -12.988 -14.293 11.586 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -13.444 -14.136 9.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.028 -13.731 10.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -11.763 -12.598 9.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -11.545 -12.236 11.144 1.00 0.00 H new ATOM 1792 N ASN A 107 -11.482 -8.853 7.858 1.00 0.00 N ATOM 1793 CA ASN A 107 -10.528 -7.788 7.572 1.00 0.00 C ATOM 1794 C ASN A 107 -11.109 -6.822 6.542 1.00 0.00 C ATOM 1795 O ASN A 107 -10.978 -5.606 6.673 1.00 0.00 O ATOM 1796 CB ASN A 107 -9.217 -8.390 7.050 1.00 0.00 C ATOM 1797 CG ASN A 107 -8.164 -7.351 6.706 1.00 0.00 C ATOM 1798 OD1 ASN A 107 -7.344 -6.984 7.544 1.00 0.00 O ATOM 1799 ND2 ASN A 107 -8.163 -6.890 5.463 1.00 0.00 N ATOM 0 H ASN A 107 -11.122 -9.791 7.685 1.00 0.00 H new ATOM 0 HA ASN A 107 -10.326 -7.238 8.491 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -8.814 -9.068 7.802 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -9.429 -8.987 6.163 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -7.464 -6.206 5.173 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -8.861 -7.220 4.796 1.00 0.00 H new ATOM 1806 N MET A 108 -11.767 -7.373 5.525 1.00 0.00 N ATOM 1807 CA MET A 108 -12.371 -6.560 4.476 1.00 0.00 C ATOM 1808 C MET A 108 -13.538 -5.744 5.007 1.00 0.00 C ATOM 1809 O MET A 108 -13.821 -4.659 4.499 1.00 0.00 O ATOM 1810 CB MET A 108 -12.830 -7.426 3.305 1.00 0.00 C ATOM 1811 CG MET A 108 -11.684 -7.904 2.437 1.00 0.00 C ATOM 1812 SD MET A 108 -10.633 -6.543 1.905 1.00 0.00 S ATOM 1813 CE MET A 108 -9.461 -7.407 0.874 1.00 0.00 C ATOM 0 H MET A 108 -11.895 -8.378 5.406 1.00 0.00 H new ATOM 0 HA MET A 108 -11.604 -5.871 4.122 1.00 0.00 H new ATOM 0 HB2 MET A 108 -13.372 -8.290 3.690 1.00 0.00 H new ATOM 0 HB3 MET A 108 -13.530 -6.858 2.692 1.00 0.00 H new ATOM 0 HG2 MET A 108 -11.087 -8.629 2.990 1.00 0.00 H new ATOM 0 HG3 MET A 108 -12.081 -8.419 1.563 1.00 0.00 H new ATOM 0 HE1 MET A 108 -9.082 -6.730 0.108 1.00 0.00 H new ATOM 0 HE2 MET A 108 -8.632 -7.764 1.486 1.00 0.00 H new ATOM 0 HE3 MET A 108 -9.952 -8.255 0.397 1.00 0.00 H new ATOM 1823 N GLU A 109 -14.212 -6.257 6.028 1.00 0.00 N ATOM 1824 CA GLU A 109 -15.287 -5.507 6.661 1.00 0.00 C ATOM 1825 C GLU A 109 -14.721 -4.235 7.281 1.00 0.00 C ATOM 1826 O GLU A 109 -15.312 -3.164 7.167 1.00 0.00 O ATOM 1827 CB GLU A 109 -15.990 -6.335 7.737 1.00 0.00 C ATOM 1828 CG GLU A 109 -17.236 -5.655 8.284 1.00 0.00 C ATOM 1829 CD GLU A 109 -17.788 -6.332 9.516 1.00 0.00 C ATOM 1830 OE1 GLU A 109 -18.042 -7.551 9.469 1.00 0.00 O ATOM 1831 OE2 GLU A 109 -17.978 -5.645 10.541 1.00 0.00 O ATOM 0 H GLU A 109 -14.036 -7.177 6.431 1.00 0.00 H new ATOM 0 HA GLU A 109 -16.022 -5.256 5.897 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -16.264 -7.305 7.322 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -15.295 -6.523 8.556 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -17.002 -4.617 8.521 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -18.004 -5.640 7.510 1.00 0.00 H new ATOM 1838 N PHE A 110 -13.559 -4.365 7.918 1.00 0.00 N ATOM 1839 CA PHE A 110 -12.878 -3.218 8.507 1.00 0.00 C ATOM 1840 C PHE A 110 -12.528 -2.192 7.435 1.00 0.00 C ATOM 1841 O PHE A 110 -12.698 -0.993 7.640 1.00 0.00 O ATOM 1842 CB PHE A 110 -11.609 -3.649 9.247 1.00 0.00 C ATOM 1843 CG PHE A 110 -11.866 -4.522 10.443 1.00 0.00 C ATOM 1844 CD1 PHE A 110 -12.636 -4.064 11.502 1.00 0.00 C ATOM 1845 CD2 PHE A 110 -11.330 -5.797 10.513 1.00 0.00 C ATOM 1846 CE1 PHE A 110 -12.866 -4.862 12.605 1.00 0.00 C ATOM 1847 CE2 PHE A 110 -11.558 -6.600 11.614 1.00 0.00 C ATOM 1848 CZ PHE A 110 -12.327 -6.131 12.661 1.00 0.00 C ATOM 0 H PHE A 110 -13.071 -5.253 8.038 1.00 0.00 H new ATOM 0 HA PHE A 110 -13.559 -2.763 9.226 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -10.960 -4.183 8.553 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -11.068 -2.759 9.569 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -13.061 -3.072 11.463 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -10.727 -6.168 9.698 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -13.467 -4.493 13.423 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -11.135 -7.593 11.656 1.00 0.00 H new ATOM 0 HZ PHE A 110 -12.506 -6.757 13.523 1.00 0.00 H new ATOM 1858 N LEU A 111 -12.051 -2.670 6.289 1.00 0.00 N ATOM 1859 CA LEU A 111 -11.740 -1.785 5.167 1.00 0.00 C ATOM 1860 C LEU A 111 -12.996 -1.069 4.681 1.00 0.00 C ATOM 1861 O LEU A 111 -13.004 0.146 4.521 1.00 0.00 O ATOM 1862 CB LEU A 111 -11.099 -2.558 4.006 1.00 0.00 C ATOM 1863 CG LEU A 111 -9.569 -2.660 4.037 1.00 0.00 C ATOM 1864 CD1 LEU A 111 -9.098 -3.497 5.212 1.00 0.00 C ATOM 1865 CD2 LEU A 111 -9.047 -3.241 2.734 1.00 0.00 C ATOM 0 H LEU A 111 -11.872 -3.658 6.112 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.024 -1.045 5.523 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -11.512 -3.567 3.994 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -11.394 -2.082 3.071 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.170 -1.653 4.157 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -8.009 -3.551 5.207 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -9.434 -3.040 6.143 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -9.511 -4.502 5.132 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -7.960 -3.306 2.774 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -9.465 -4.237 2.587 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -9.342 -2.598 1.905 1.00 0.00 H new ATOM 1877 N ARG A 112 -14.069 -1.827 4.489 1.00 0.00 N ATOM 1878 CA ARG A 112 -15.324 -1.270 3.989 1.00 0.00 C ATOM 1879 C ARG A 112 -16.040 -0.451 5.064 1.00 0.00 C ATOM 1880 O ARG A 112 -17.121 0.091 4.831 1.00 0.00 O ATOM 1881 CB ARG A 112 -16.238 -2.386 3.479 1.00 0.00 C ATOM 1882 CG ARG A 112 -15.694 -3.105 2.253 1.00 0.00 C ATOM 1883 CD ARG A 112 -16.610 -4.238 1.813 1.00 0.00 C ATOM 1884 NE ARG A 112 -17.964 -3.769 1.516 1.00 0.00 N ATOM 1885 CZ ARG A 112 -19.019 -4.573 1.375 1.00 0.00 C ATOM 1886 NH1 ARG A 112 -18.872 -5.893 1.437 1.00 0.00 N ATOM 1887 NH2 ARG A 112 -20.219 -4.059 1.147 1.00 0.00 N ATOM 0 H ARG A 112 -14.097 -2.830 4.672 1.00 0.00 H new ATOM 0 HA ARG A 112 -15.084 -0.602 3.162 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -16.392 -3.112 4.277 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -17.214 -1.964 3.239 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -15.577 -2.393 1.436 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -14.703 -3.503 2.474 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -16.192 -4.719 0.929 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -16.653 -4.994 2.597 1.00 0.00 H new ATOM 0 HE ARG A 112 -18.110 -2.765 1.410 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -17.948 -6.297 1.593 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -19.683 -6.502 1.328 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -20.336 -3.048 1.079 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -21.025 -4.674 1.039 1.00 0.00 H new ATOM 1901 N ASN A 113 -15.441 -0.380 6.247 1.00 0.00 N ATOM 1902 CA ASN A 113 -15.976 0.431 7.337 1.00 0.00 C ATOM 1903 C ASN A 113 -14.989 1.525 7.726 1.00 0.00 C ATOM 1904 O ASN A 113 -15.246 2.311 8.643 1.00 0.00 O ATOM 1905 CB ASN A 113 -16.281 -0.433 8.570 1.00 0.00 C ATOM 1906 CG ASN A 113 -17.621 -1.153 8.510 1.00 0.00 C ATOM 1907 OD1 ASN A 113 -18.239 -1.412 9.544 1.00 0.00 O ATOM 1908 ND2 ASN A 113 -18.084 -1.482 7.315 1.00 0.00 N ATOM 0 H ASN A 113 -14.580 -0.876 6.478 1.00 0.00 H new ATOM 0 HA ASN A 113 -16.902 0.885 6.984 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -15.489 -1.172 8.687 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -16.260 0.200 9.457 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -18.978 -1.965 7.230 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -17.547 -1.252 6.479 1.00 0.00 H new ATOM 1915 N TRP A 114 -13.861 1.579 7.027 1.00 0.00 N ATOM 1916 CA TRP A 114 -12.803 2.521 7.361 1.00 0.00 C ATOM 1917 C TRP A 114 -13.190 3.935 6.945 1.00 0.00 C ATOM 1918 O TRP A 114 -13.253 4.260 5.761 1.00 0.00 O ATOM 1919 CB TRP A 114 -11.480 2.105 6.706 1.00 0.00 C ATOM 1920 CG TRP A 114 -10.302 2.921 7.157 1.00 0.00 C ATOM 1921 CD1 TRP A 114 -9.831 3.047 8.435 1.00 0.00 C ATOM 1922 CD2 TRP A 114 -9.437 3.711 6.332 1.00 0.00 C ATOM 1923 NE1 TRP A 114 -8.735 3.877 8.452 1.00 0.00 N ATOM 1924 CE2 TRP A 114 -8.472 4.294 7.176 1.00 0.00 C ATOM 1925 CE3 TRP A 114 -9.382 3.986 4.963 1.00 0.00 C ATOM 1926 CZ2 TRP A 114 -7.468 5.130 6.698 1.00 0.00 C ATOM 1927 CZ3 TRP A 114 -8.384 4.817 4.489 1.00 0.00 C ATOM 1928 CH2 TRP A 114 -7.439 5.380 5.355 1.00 0.00 C ATOM 0 H TRP A 114 -13.657 0.981 6.226 1.00 0.00 H new ATOM 0 HA TRP A 114 -12.665 2.510 8.442 1.00 0.00 H new ATOM 0 HB2 TRP A 114 -11.290 1.055 6.927 1.00 0.00 H new ATOM 0 HB3 TRP A 114 -11.578 2.191 5.624 1.00 0.00 H new ATOM 0 HD1 TRP A 114 -10.257 2.566 9.303 1.00 0.00 H new ATOM 0 HE1 TRP A 114 -8.204 4.139 9.282 1.00 0.00 H new ATOM 0 HE3 TRP A 114 -10.107 3.557 4.287 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 -6.738 5.566 7.364 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 -8.332 5.036 3.433 1.00 0.00 H new ATOM 0 HH2 TRP A 114 -6.671 6.025 4.953 1.00 0.00 H new ATOM 1939 N ASN A 115 -13.473 4.759 7.938 1.00 0.00 N ATOM 1940 CA ASN A 115 -13.858 6.142 7.711 1.00 0.00 C ATOM 1941 C ASN A 115 -12.638 7.055 7.774 1.00 0.00 C ATOM 1942 O ASN A 115 -12.677 8.194 7.316 1.00 0.00 O ATOM 1943 CB ASN A 115 -14.896 6.582 8.750 1.00 0.00 C ATOM 1944 CG ASN A 115 -14.376 6.474 10.176 1.00 0.00 C ATOM 1945 OD1 ASN A 115 -13.568 5.596 10.497 1.00 0.00 O ATOM 1946 ND2 ASN A 115 -14.839 7.354 11.045 1.00 0.00 N ATOM 0 H ASN A 115 -13.443 4.490 8.922 1.00 0.00 H new ATOM 0 HA ASN A 115 -14.299 6.217 6.717 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -15.190 7.613 8.551 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -15.792 5.969 8.646 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -14.530 7.322 12.017 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -15.505 8.065 10.745 1.00 0.00 H new ATOM 1953 N GLY A 116 -11.555 6.544 8.346 1.00 0.00 N ATOM 1954 CA GLY A 116 -10.346 7.332 8.472 1.00 0.00 C ATOM 1955 C GLY A 116 -9.854 7.406 9.902 1.00 0.00 C ATOM 1956 O GLY A 116 -8.733 7.847 10.155 1.00 0.00 O ATOM 0 H GLY A 116 -11.493 5.599 8.724 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.567 6.900 7.844 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -10.532 8.340 8.102 1.00 0.00 H new ATOM 1960 N THR A 117 -10.693 6.981 10.839 1.00 0.00 N ATOM 1961 CA THR A 117 -10.330 6.971 12.250 1.00 0.00 C ATOM 1962 C THR A 117 -9.153 6.026 12.505 1.00 0.00 C ATOM 1963 O THR A 117 -9.221 4.833 12.190 1.00 0.00 O ATOM 1964 CB THR A 117 -11.533 6.548 13.116 1.00 0.00 C ATOM 1965 OG1 THR A 117 -12.649 7.402 12.840 1.00 0.00 O ATOM 1966 CG2 THR A 117 -11.197 6.618 14.596 1.00 0.00 C ATOM 0 H THR A 117 -11.634 6.637 10.645 1.00 0.00 H new ATOM 0 HA THR A 117 -10.032 7.983 12.525 1.00 0.00 H new ATOM 0 HB THR A 117 -11.783 5.516 12.869 1.00 0.00 H new ATOM 0 HG1 THR A 117 -13.288 7.355 13.582 1.00 0.00 H new ATOM 0 HG21 THR A 117 -12.065 6.314 15.181 1.00 0.00 H new ATOM 0 HG22 THR A 117 -10.362 5.951 14.812 1.00 0.00 H new ATOM 0 HG23 THR A 117 -10.922 7.640 14.859 1.00 0.00 H new ATOM 1974 N PHE A 118 -8.076 6.562 13.076 1.00 0.00 N ATOM 1975 CA PHE A 118 -6.873 5.779 13.343 1.00 0.00 C ATOM 1976 C PHE A 118 -7.138 4.689 14.384 1.00 0.00 C ATOM 1977 O PHE A 118 -6.396 3.710 14.475 1.00 0.00 O ATOM 1978 CB PHE A 118 -5.739 6.694 13.809 1.00 0.00 C ATOM 1979 CG PHE A 118 -4.414 5.996 13.962 1.00 0.00 C ATOM 1980 CD1 PHE A 118 -3.766 5.460 12.859 1.00 0.00 C ATOM 1981 CD2 PHE A 118 -3.817 5.880 15.207 1.00 0.00 C ATOM 1982 CE1 PHE A 118 -2.549 4.822 12.997 1.00 0.00 C ATOM 1983 CE2 PHE A 118 -2.600 5.243 15.350 1.00 0.00 C ATOM 1984 CZ PHE A 118 -1.965 4.711 14.245 1.00 0.00 C ATOM 0 H PHE A 118 -8.013 7.539 13.363 1.00 0.00 H new ATOM 0 HA PHE A 118 -6.577 5.290 12.415 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -5.628 7.510 13.095 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -6.015 7.141 14.764 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -4.218 5.542 11.882 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -4.309 6.292 16.075 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -2.054 4.410 12.130 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -2.145 5.161 16.326 1.00 0.00 H new ATOM 0 HZ PHE A 118 -1.015 4.210 14.356 1.00 0.00 H new ATOM 1994 N GLY A 119 -8.201 4.861 15.163 1.00 0.00 N ATOM 1995 CA GLY A 119 -8.579 3.863 16.149 1.00 0.00 C ATOM 1996 C GLY A 119 -8.928 2.527 15.518 1.00 0.00 C ATOM 1997 O GLY A 119 -8.754 1.477 16.136 1.00 0.00 O ATOM 0 H GLY A 119 -8.811 5.678 15.129 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -7.760 3.725 16.855 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -9.434 4.226 16.720 1.00 0.00 H new ATOM 2001 N LEU A 120 -9.398 2.569 14.276 1.00 0.00 N ATOM 2002 CA LEU A 120 -9.767 1.360 13.550 1.00 0.00 C ATOM 2003 C LEU A 120 -8.509 0.578 13.173 1.00 0.00 C ATOM 2004 O LEU A 120 -8.551 -0.625 12.964 1.00 0.00 O ATOM 2005 CB LEU A 120 -10.578 1.732 12.296 1.00 0.00 C ATOM 2006 CG LEU A 120 -11.600 0.690 11.811 1.00 0.00 C ATOM 2007 CD1 LEU A 120 -12.551 1.319 10.808 1.00 0.00 C ATOM 2008 CD2 LEU A 120 -10.915 -0.511 11.181 1.00 0.00 C ATOM 0 H LEU A 120 -9.533 3.432 13.749 1.00 0.00 H new ATOM 0 HA LEU A 120 -10.387 0.728 14.186 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -11.108 2.664 12.495 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -9.879 1.930 11.483 1.00 0.00 H new ATOM 0 HG LEU A 120 -12.160 0.345 12.680 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -13.270 0.573 10.471 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -13.081 2.147 11.279 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -11.985 1.690 9.953 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -11.667 -1.227 10.850 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -10.323 -0.185 10.326 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -10.262 -0.984 11.915 1.00 0.00 H new ATOM 2020 N LEU A 121 -7.374 1.266 13.146 1.00 0.00 N ATOM 2021 CA LEU A 121 -6.106 0.642 12.769 1.00 0.00 C ATOM 2022 C LEU A 121 -5.600 -0.272 13.881 1.00 0.00 C ATOM 2023 O LEU A 121 -4.568 -0.927 13.746 1.00 0.00 O ATOM 2024 CB LEU A 121 -5.048 1.701 12.429 1.00 0.00 C ATOM 2025 CG LEU A 121 -5.112 2.284 11.009 1.00 0.00 C ATOM 2026 CD1 LEU A 121 -4.906 1.192 9.975 1.00 0.00 C ATOM 2027 CD2 LEU A 121 -6.429 3.000 10.764 1.00 0.00 C ATOM 0 H LEU A 121 -7.303 2.256 13.380 1.00 0.00 H new ATOM 0 HA LEU A 121 -6.285 0.040 11.878 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -5.141 2.521 13.142 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -4.062 1.261 12.576 1.00 0.00 H new ATOM 0 HG LEU A 121 -4.309 3.015 10.914 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -4.955 1.624 8.975 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -3.930 0.730 10.124 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -5.685 0.437 10.083 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -6.442 3.401 9.750 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -7.253 2.298 10.887 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -6.538 3.816 11.478 1.00 0.00 H new ATOM 2039 N ASN A 122 -6.327 -0.290 14.989 1.00 0.00 N ATOM 2040 CA ASN A 122 -6.050 -1.224 16.070 1.00 0.00 C ATOM 2041 C ASN A 122 -6.883 -2.487 15.885 1.00 0.00 C ATOM 2042 O ASN A 122 -6.428 -3.591 16.168 1.00 0.00 O ATOM 2043 CB ASN A 122 -6.377 -0.593 17.426 1.00 0.00 C ATOM 2044 CG ASN A 122 -6.110 -1.532 18.591 1.00 0.00 C ATOM 2045 OD1 ASN A 122 -5.154 -2.312 18.579 1.00 0.00 O ATOM 2046 ND2 ASN A 122 -6.965 -1.476 19.599 1.00 0.00 N ATOM 0 H ASN A 122 -7.115 0.334 15.163 1.00 0.00 H new ATOM 0 HA ASN A 122 -4.990 -1.475 16.046 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -5.785 0.313 17.552 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -7.425 -0.293 17.439 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -6.846 -2.092 20.404 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -7.743 -0.817 19.572 1.00 0.00 H new ATOM 2053 N THR A 123 -8.100 -2.308 15.383 1.00 0.00 N ATOM 2054 CA THR A 123 -9.040 -3.409 15.236 1.00 0.00 C ATOM 2055 C THR A 123 -8.833 -4.119 13.899 1.00 0.00 C ATOM 2056 O THR A 123 -9.053 -5.326 13.775 1.00 0.00 O ATOM 2057 CB THR A 123 -10.495 -2.902 15.348 1.00 0.00 C ATOM 2058 OG1 THR A 123 -10.829 -2.079 14.226 1.00 0.00 O ATOM 2059 CG2 THR A 123 -10.679 -2.083 16.616 1.00 0.00 C ATOM 0 H THR A 123 -8.458 -1.406 15.070 1.00 0.00 H new ATOM 0 HA THR A 123 -8.856 -4.121 16.041 1.00 0.00 H new ATOM 0 HB THR A 123 -11.148 -3.775 15.373 1.00 0.00 H new ATOM 0 HG1 THR A 123 -10.024 -1.621 13.905 1.00 0.00 H new ATOM 0 HG21 THR A 123 -11.710 -1.734 16.678 1.00 0.00 H new ATOM 0 HG22 THR A 123 -10.452 -2.701 17.485 1.00 0.00 H new ATOM 0 HG23 THR A 123 -10.007 -1.225 16.596 1.00 0.00 H new ATOM 2067 N LEU A 124 -8.410 -3.350 12.906 1.00 0.00 N ATOM 2068 CA LEU A 124 -8.070 -3.877 11.594 1.00 0.00 C ATOM 2069 C LEU A 124 -6.793 -4.711 11.703 1.00 0.00 C ATOM 2070 O LEU A 124 -5.820 -4.281 12.328 1.00 0.00 O ATOM 2071 CB LEU A 124 -7.873 -2.703 10.625 1.00 0.00 C ATOM 2072 CG LEU A 124 -8.235 -2.950 9.157 1.00 0.00 C ATOM 2073 CD1 LEU A 124 -8.148 -1.648 8.375 1.00 0.00 C ATOM 2074 CD2 LEU A 124 -7.328 -3.998 8.530 1.00 0.00 C ATOM 0 H LEU A 124 -8.293 -2.340 12.989 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.870 -4.515 11.219 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -8.467 -1.863 10.984 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -6.828 -2.397 10.670 1.00 0.00 H new ATOM 0 HG LEU A 124 -9.257 -3.327 9.120 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -8.407 -1.832 7.332 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -8.842 -0.922 8.799 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -7.133 -1.256 8.433 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -7.612 -4.149 7.489 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -6.293 -3.659 8.578 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -7.428 -4.938 9.073 1.00 0.00 H new ATOM 2086 N ARG A 125 -6.790 -5.900 11.112 1.00 0.00 N ATOM 2087 CA ARG A 125 -5.639 -6.788 11.215 1.00 0.00 C ATOM 2088 C ARG A 125 -4.516 -6.358 10.274 1.00 0.00 C ATOM 2089 O ARG A 125 -4.421 -6.834 9.139 1.00 0.00 O ATOM 2090 CB ARG A 125 -6.025 -8.244 10.926 1.00 0.00 C ATOM 2091 CG ARG A 125 -4.858 -9.216 11.064 1.00 0.00 C ATOM 2092 CD ARG A 125 -5.235 -10.625 10.634 1.00 0.00 C ATOM 2093 NE ARG A 125 -6.247 -11.218 11.504 1.00 0.00 N ATOM 2094 CZ ARG A 125 -7.164 -12.092 11.089 1.00 0.00 C ATOM 2095 NH1 ARG A 125 -7.160 -12.518 9.829 1.00 0.00 N ATOM 2096 NH2 ARG A 125 -8.058 -12.570 11.943 1.00 0.00 N ATOM 0 H ARG A 125 -7.565 -6.269 10.561 1.00 0.00 H new ATOM 0 HA ARG A 125 -5.280 -6.720 12.242 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -6.821 -8.544 11.608 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -6.428 -8.312 9.916 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -4.021 -8.865 10.461 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -4.520 -9.232 12.100 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -5.608 -10.602 9.610 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -4.344 -11.253 10.635 1.00 0.00 H new ATOM 0 HE ARG A 125 -6.252 -10.947 12.487 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -6.454 -12.176 9.177 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -7.863 -13.187 9.515 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -8.044 -12.269 12.917 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -8.760 -13.239 11.626 1.00 0.00 H new ATOM 2110 N LEU A 126 -3.687 -5.436 10.740 1.00 0.00 N ATOM 2111 CA LEU A 126 -2.479 -5.067 10.020 1.00 0.00 C ATOM 2112 C LEU A 126 -1.271 -5.692 10.694 1.00 0.00 C ATOM 2113 O LEU A 126 -1.079 -5.552 11.903 1.00 0.00 O ATOM 2114 CB LEU A 126 -2.294 -3.549 9.937 1.00 0.00 C ATOM 2115 CG LEU A 126 -3.326 -2.801 9.093 1.00 0.00 C ATOM 2116 CD1 LEU A 126 -4.499 -2.360 9.948 1.00 0.00 C ATOM 2117 CD2 LEU A 126 -2.686 -1.611 8.396 1.00 0.00 C ATOM 0 H LEU A 126 -3.829 -4.930 11.614 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.578 -5.442 9.001 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.316 -3.143 10.948 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.303 -3.344 9.532 1.00 0.00 H new ATOM 0 HG LEU A 126 -3.702 -3.481 8.328 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -5.222 -1.830 9.328 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.974 -3.234 10.392 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.145 -1.699 10.739 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.436 -1.091 7.800 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.279 -0.928 9.142 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.883 -1.959 7.746 1.00 0.00 H new ATOM 2129 N ILE A 127 -0.470 -6.379 9.906 1.00 0.00 N ATOM 2130 CA ILE A 127 0.701 -7.071 10.410 1.00 0.00 C ATOM 2131 C ILE A 127 1.960 -6.499 9.778 1.00 0.00 C ATOM 2132 O ILE A 127 1.909 -5.480 9.086 1.00 0.00 O ATOM 2133 CB ILE A 127 0.622 -8.587 10.114 1.00 0.00 C ATOM 2134 CG1 ILE A 127 0.352 -8.822 8.623 1.00 0.00 C ATOM 2135 CG2 ILE A 127 -0.454 -9.240 10.972 1.00 0.00 C ATOM 2136 CD1 ILE A 127 0.260 -10.282 8.236 1.00 0.00 C ATOM 0 H ILE A 127 -0.611 -6.474 8.900 1.00 0.00 H new ATOM 0 HA ILE A 127 0.735 -6.927 11.490 1.00 0.00 H new ATOM 0 HB ILE A 127 1.579 -9.045 10.365 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.579 -8.325 8.350 1.00 0.00 H new ATOM 0 HG13 ILE A 127 1.146 -8.352 8.042 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.497 -10.307 10.752 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -0.216 -9.096 12.026 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -1.420 -8.785 10.753 1.00 0.00 H new ATOM 0 HD11 ILE A 127 0.068 -10.363 7.166 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.199 -10.782 8.475 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -0.553 -10.754 8.788 1.00 0.00 H new ATOM 2148 N ARG A 128 3.086 -7.150 10.017 1.00 0.00 N ATOM 2149 CA ARG A 128 4.337 -6.745 9.408 1.00 0.00 C ATOM 2150 C ARG A 128 4.594 -7.581 8.163 1.00 0.00 C ATOM 2151 O ARG A 128 4.801 -8.796 8.243 1.00 0.00 O ATOM 2152 CB ARG A 128 5.478 -6.880 10.416 1.00 0.00 C ATOM 2153 CG ARG A 128 5.399 -5.864 11.544 1.00 0.00 C ATOM 2154 CD ARG A 128 6.190 -6.311 12.761 1.00 0.00 C ATOM 2155 NE ARG A 128 5.579 -7.473 13.408 1.00 0.00 N ATOM 2156 CZ ARG A 128 5.856 -7.871 14.650 1.00 0.00 C ATOM 2157 NH1 ARG A 128 6.722 -7.191 15.394 1.00 0.00 N ATOM 2158 NH2 ARG A 128 5.246 -8.934 15.156 1.00 0.00 N ATOM 0 H ARG A 128 3.157 -7.962 10.630 1.00 0.00 H new ATOM 0 HA ARG A 128 4.278 -5.698 9.110 1.00 0.00 H new ATOM 0 HB2 ARG A 128 5.465 -7.885 10.838 1.00 0.00 H new ATOM 0 HB3 ARG A 128 6.429 -6.765 9.897 1.00 0.00 H new ATOM 0 HG2 ARG A 128 5.779 -4.904 11.196 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.357 -5.712 11.824 1.00 0.00 H new ATOM 0 HD2 ARG A 128 7.210 -6.555 12.463 1.00 0.00 H new ATOM 0 HD3 ARG A 128 6.255 -5.490 13.475 1.00 0.00 H new ATOM 0 HE ARG A 128 4.898 -8.013 12.875 1.00 0.00 H new ATOM 0 HH11 ARG A 128 7.178 -6.361 15.015 1.00 0.00 H new ATOM 0 HH12 ARG A 128 6.931 -7.499 16.344 1.00 0.00 H new ATOM 0 HH21 ARG A 128 4.565 -9.447 14.595 1.00 0.00 H new ATOM 0 HH22 ARG A 128 5.457 -9.239 16.106 1.00 0.00 H new ATOM 2172 N ILE A 129 4.537 -6.930 7.015 1.00 0.00 N ATOM 2173 CA ILE A 129 4.658 -7.606 5.736 1.00 0.00 C ATOM 2174 C ILE A 129 5.929 -7.179 5.002 1.00 0.00 C ATOM 2175 O ILE A 129 6.247 -5.992 4.928 1.00 0.00 O ATOM 2176 CB ILE A 129 3.404 -7.336 4.869 1.00 0.00 C ATOM 2177 CG1 ILE A 129 2.223 -8.165 5.392 1.00 0.00 C ATOM 2178 CG2 ILE A 129 3.669 -7.631 3.402 1.00 0.00 C ATOM 2179 CD1 ILE A 129 0.955 -8.015 4.580 1.00 0.00 C ATOM 0 H ILE A 129 4.406 -5.921 6.943 1.00 0.00 H new ATOM 0 HA ILE A 129 4.730 -8.678 5.922 1.00 0.00 H new ATOM 0 HB ILE A 129 3.154 -6.278 4.944 1.00 0.00 H new ATOM 0 HG12 ILE A 129 2.510 -9.217 5.407 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.018 -7.876 6.423 1.00 0.00 H new ATOM 0 HG21 ILE A 129 2.768 -7.431 2.822 1.00 0.00 H new ATOM 0 HG22 ILE A 129 4.480 -6.996 3.044 1.00 0.00 H new ATOM 0 HG23 ILE A 129 3.950 -8.678 3.286 1.00 0.00 H new ATOM 0 HD11 ILE A 129 0.169 -8.633 5.015 1.00 0.00 H new ATOM 0 HD12 ILE A 129 0.641 -6.971 4.585 1.00 0.00 H new ATOM 0 HD13 ILE A 129 1.140 -8.333 3.554 1.00 0.00 H new ATOM 2191 N ASN A 130 6.657 -8.158 4.471 1.00 0.00 N ATOM 2192 CA ASN A 130 7.931 -7.896 3.811 1.00 0.00 C ATOM 2193 C ASN A 130 7.809 -8.019 2.294 1.00 0.00 C ATOM 2194 O ASN A 130 7.603 -9.114 1.768 1.00 0.00 O ATOM 2195 CB ASN A 130 9.003 -8.866 4.323 1.00 0.00 C ATOM 2196 CG ASN A 130 10.421 -8.460 3.940 1.00 0.00 C ATOM 2197 OD1 ASN A 130 10.657 -7.840 2.904 1.00 0.00 O ATOM 2198 ND2 ASN A 130 11.379 -8.812 4.783 1.00 0.00 N ATOM 0 H ASN A 130 6.385 -9.141 4.485 1.00 0.00 H new ATOM 0 HA ASN A 130 8.223 -6.873 4.048 1.00 0.00 H new ATOM 0 HB2 ASN A 130 8.933 -8.933 5.409 1.00 0.00 H new ATOM 0 HB3 ASN A 130 8.799 -9.862 3.929 1.00 0.00 H new ATOM 0 HD21 ASN A 130 12.349 -8.569 4.583 1.00 0.00 H new ATOM 0 HD22 ASN A 130 11.147 -9.326 5.633 1.00 0.00 H new ATOM 2205 N ASP A 131 7.886 -6.870 1.628 1.00 0.00 N ATOM 2206 CA ASP A 131 8.075 -6.767 0.173 1.00 0.00 C ATOM 2207 C ASP A 131 6.982 -7.466 -0.645 1.00 0.00 C ATOM 2208 O ASP A 131 6.035 -6.822 -1.096 1.00 0.00 O ATOM 2209 CB ASP A 131 9.460 -7.291 -0.216 1.00 0.00 C ATOM 2210 CG ASP A 131 9.973 -6.693 -1.511 1.00 0.00 C ATOM 2211 OD1 ASP A 131 9.703 -5.502 -1.780 1.00 0.00 O ATOM 2212 OD2 ASP A 131 10.680 -7.401 -2.256 1.00 0.00 O ATOM 0 H ASP A 131 7.818 -5.963 2.089 1.00 0.00 H new ATOM 0 HA ASP A 131 7.998 -5.708 -0.073 1.00 0.00 H new ATOM 0 HB2 ASP A 131 10.165 -7.070 0.585 1.00 0.00 H new ATOM 0 HB3 ASP A 131 9.419 -8.376 -0.314 1.00 0.00 H new ATOM 2217 N LYS A 132 7.103 -8.775 -0.835 1.00 0.00 N ATOM 2218 CA LYS A 132 6.163 -9.517 -1.676 1.00 0.00 C ATOM 2219 C LYS A 132 4.986 -10.068 -0.874 1.00 0.00 C ATOM 2220 O LYS A 132 4.401 -11.086 -1.237 1.00 0.00 O ATOM 2221 CB LYS A 132 6.864 -10.666 -2.416 1.00 0.00 C ATOM 2222 CG LYS A 132 7.498 -10.267 -3.744 1.00 0.00 C ATOM 2223 CD LYS A 132 8.753 -9.433 -3.556 1.00 0.00 C ATOM 2224 CE LYS A 132 9.314 -8.963 -4.890 1.00 0.00 C ATOM 2225 NZ LYS A 132 10.579 -8.198 -4.727 1.00 0.00 N ATOM 0 H LYS A 132 7.840 -9.346 -0.420 1.00 0.00 H new ATOM 0 HA LYS A 132 5.776 -8.806 -2.406 1.00 0.00 H new ATOM 0 HB2 LYS A 132 7.637 -11.081 -1.769 1.00 0.00 H new ATOM 0 HB3 LYS A 132 6.140 -11.460 -2.597 1.00 0.00 H new ATOM 0 HG2 LYS A 132 7.743 -11.165 -4.311 1.00 0.00 H new ATOM 0 HG3 LYS A 132 6.775 -9.704 -4.334 1.00 0.00 H new ATOM 0 HD2 LYS A 132 8.527 -8.569 -2.930 1.00 0.00 H new ATOM 0 HD3 LYS A 132 9.506 -10.020 -3.030 1.00 0.00 H new ATOM 0 HE2 LYS A 132 9.493 -9.826 -5.532 1.00 0.00 H new ATOM 0 HE3 LYS A 132 8.576 -8.339 -5.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 10.508 -7.296 -5.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 10.743 -8.010 -3.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 11.372 -8.752 -5.109 1.00 0.00 H new ATOM 2239 N GLY A 133 4.621 -9.376 0.191 1.00 0.00 N ATOM 2240 CA GLY A 133 3.464 -9.780 0.965 1.00 0.00 C ATOM 2241 C GLY A 133 3.782 -10.879 1.956 1.00 0.00 C ATOM 2242 O GLY A 133 2.878 -11.534 2.477 1.00 0.00 O ATOM 0 H GLY A 133 5.101 -8.544 0.535 1.00 0.00 H new ATOM 0 HA2 GLY A 133 3.070 -8.916 1.500 1.00 0.00 H new ATOM 0 HA3 GLY A 133 2.680 -10.121 0.289 1.00 0.00 H new ATOM 2246 N GLU A 134 5.064 -11.063 2.231 1.00 0.00 N ATOM 2247 CA GLU A 134 5.506 -12.158 3.080 1.00 0.00 C ATOM 2248 C GLU A 134 5.340 -11.814 4.557 1.00 0.00 C ATOM 2249 O GLU A 134 5.651 -10.703 4.992 1.00 0.00 O ATOM 2250 CB GLU A 134 6.965 -12.508 2.777 1.00 0.00 C ATOM 2251 CG GLU A 134 7.432 -13.794 3.439 1.00 0.00 C ATOM 2252 CD GLU A 134 8.853 -14.155 3.065 1.00 0.00 C ATOM 2253 OE1 GLU A 134 9.086 -14.512 1.890 1.00 0.00 O ATOM 2254 OE2 GLU A 134 9.738 -14.093 3.943 1.00 0.00 O ATOM 0 H GLU A 134 5.815 -10.469 1.879 1.00 0.00 H new ATOM 0 HA GLU A 134 4.881 -13.025 2.864 1.00 0.00 H new ATOM 0 HB2 GLU A 134 7.092 -12.598 1.698 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.603 -11.687 3.106 1.00 0.00 H new ATOM 0 HG2 GLU A 134 7.360 -13.688 4.522 1.00 0.00 H new ATOM 0 HG3 GLU A 134 6.766 -14.608 3.153 1.00 0.00 H new ATOM 2261 N GLN A 135 4.824 -12.777 5.305 1.00 0.00 N ATOM 2262 CA GLN A 135 4.648 -12.654 6.745 1.00 0.00 C ATOM 2263 C GLN A 135 5.988 -12.470 7.456 1.00 0.00 C ATOM 2264 O GLN A 135 6.867 -13.330 7.378 1.00 0.00 O ATOM 2265 CB GLN A 135 3.944 -13.908 7.275 1.00 0.00 C ATOM 2266 CG GLN A 135 3.751 -13.937 8.785 1.00 0.00 C ATOM 2267 CD GLN A 135 2.814 -12.854 9.275 1.00 0.00 C ATOM 2268 OE1 GLN A 135 1.601 -13.047 9.327 1.00 0.00 O ATOM 2269 NE2 GLN A 135 3.369 -11.717 9.663 1.00 0.00 N ATOM 0 H GLN A 135 4.513 -13.672 4.928 1.00 0.00 H new ATOM 0 HA GLN A 135 4.041 -11.772 6.946 1.00 0.00 H new ATOM 0 HB2 GLN A 135 2.969 -13.991 6.796 1.00 0.00 H new ATOM 0 HB3 GLN A 135 4.520 -14.785 6.979 1.00 0.00 H new ATOM 0 HG2 GLN A 135 3.359 -14.911 9.078 1.00 0.00 H new ATOM 0 HG3 GLN A 135 4.719 -13.823 9.273 1.00 0.00 H new ATOM 0 HE21 GLN A 135 4.380 -11.597 9.604 1.00 0.00 H new ATOM 0 HE22 GLN A 135 2.786 -10.961 10.021 1.00 0.00 H new ATOM 2278 N VAL A 136 6.144 -11.342 8.136 1.00 0.00 N ATOM 2279 CA VAL A 136 7.314 -11.109 8.971 1.00 0.00 C ATOM 2280 C VAL A 136 7.025 -11.536 10.402 1.00 0.00 C ATOM 2281 O VAL A 136 6.021 -11.125 10.987 1.00 0.00 O ATOM 2282 CB VAL A 136 7.742 -9.626 8.967 1.00 0.00 C ATOM 2283 CG1 VAL A 136 8.938 -9.399 9.882 1.00 0.00 C ATOM 2284 CG2 VAL A 136 8.061 -9.169 7.557 1.00 0.00 C ATOM 0 H VAL A 136 5.474 -10.573 8.125 1.00 0.00 H new ATOM 0 HA VAL A 136 8.129 -11.701 8.556 1.00 0.00 H new ATOM 0 HB VAL A 136 6.909 -9.034 9.346 1.00 0.00 H new ATOM 0 HG11 VAL A 136 9.218 -8.346 9.860 1.00 0.00 H new ATOM 0 HG12 VAL A 136 8.676 -9.683 10.901 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.777 -10.005 9.541 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.361 -8.121 7.573 1.00 0.00 H new ATOM 0 HG22 VAL A 136 8.874 -9.773 7.154 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.178 -9.284 6.929 1.00 0.00 H new ATOM 2294 N VAL A 137 7.886 -12.374 10.952 1.00 0.00 N ATOM 2295 CA VAL A 137 7.752 -12.799 12.335 1.00 0.00 C ATOM 2296 C VAL A 137 8.905 -12.247 13.161 1.00 0.00 C ATOM 2297 O VAL A 137 9.929 -11.838 12.611 1.00 0.00 O ATOM 2298 CB VAL A 137 7.697 -14.337 12.467 1.00 0.00 C ATOM 2299 CG1 VAL A 137 6.427 -14.885 11.838 1.00 0.00 C ATOM 2300 CG2 VAL A 137 8.922 -14.981 11.836 1.00 0.00 C ATOM 0 H VAL A 137 8.686 -12.774 10.462 1.00 0.00 H new ATOM 0 HA VAL A 137 6.808 -12.404 12.710 1.00 0.00 H new ATOM 0 HB VAL A 137 7.691 -14.583 13.529 1.00 0.00 H new ATOM 0 HG11 VAL A 137 6.408 -15.970 11.942 1.00 0.00 H new ATOM 0 HG12 VAL A 137 5.559 -14.457 12.339 1.00 0.00 H new ATOM 0 HG13 VAL A 137 6.402 -14.621 10.781 1.00 0.00 H new ATOM 0 HG21 VAL A 137 8.859 -16.064 11.942 1.00 0.00 H new ATOM 0 HG22 VAL A 137 8.965 -14.722 10.778 1.00 0.00 H new ATOM 0 HG23 VAL A 137 9.821 -14.619 12.335 1.00 0.00 H new