USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=15 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 130 ASN : amide:sc= 0.527 K(o=2.3,f=-9.9!) USER MOD Set 1.2: A 132 LYS NZ :NH3+ 153:sc= 1.78 (180deg=-0.213!) USER MOD Set 2.1: A 44 HIS : no HD1:sc= 1.17 K(o=2.2,f=-4!) USER MOD Set 2.2: A 103 SER OG : rot 67:sc= 1.05 USER MOD Set 3.1: A 33 SER OG : rot -105:sc= 1.2 USER MOD Set 3.2: A 35 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 27 MET CE :methyl -162:sc= 0 (180deg=0) USER MOD Set 4.2: A 99 CYS SG : rot 150:sc= -3.12! USER MOD Single : A 19 HIS : no HD1:sc= -0.339! C(o=-0.34!,f=-7.2!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -1.9 K(o=-1.9,f=-4.3!) USER MOD Single : A 32 ASN : amide:sc= -1.1 K(o=-1.1,f=-5.1!) USER MOD Single : A 37 LYS NZ :NH3+ -135:sc= -0.3 (180deg=-1.94!) USER MOD Single : A 39 GLN : amide:sc= -1.49! K(o=-1.5!,f=-0.034) USER MOD Single : A 46 HIS : no HE2:sc= 1.13 K(o=1.1,f=-5.6!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= 0.53 K(o=0.53,f=0) USER MOD Single : A 53 SER OG : rot 80:sc= 0.933 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 121:sc= -0.146 USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 83 GLN : amide:sc= 0.787 K(o=0.79,f=-0.13) USER MOD Single : A 84 GLN : amide:sc= -0.856 K(o=-0.86,f=-2.7!) USER MOD Single : A 88 GLN : amide:sc= 0.479 X(o=0.48,f=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc= -1.92! C(o=-1.9!,f=-4.5!) USER MOD Single : A 108 MET CE :methyl 150:sc= -0.0309 (180deg=-0.783) USER MOD Single : A 113 ASN : amide:sc= 0.108 K(o=0.11,f=-4.4!) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 123 THR OG1 : rot -8:sc= 0.749 USER MOD Single : A 135 GLN : amide:sc= -0.323 K(o=-0.32,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 308 N VAL A 18 0.696 9.315 5.202 1.00 0.00 N ATOM 309 CA VAL A 18 -0.019 9.288 3.934 1.00 0.00 C ATOM 310 C VAL A 18 0.384 8.022 3.192 1.00 0.00 C ATOM 311 O VAL A 18 -0.438 7.342 2.585 1.00 0.00 O ATOM 312 CB VAL A 18 0.281 10.532 3.070 1.00 0.00 C ATOM 313 CG1 VAL A 18 -0.419 10.442 1.721 1.00 0.00 C ATOM 314 CG2 VAL A 18 -0.143 11.793 3.804 1.00 0.00 C ATOM 0 HA VAL A 18 -1.091 9.297 4.133 1.00 0.00 H new ATOM 0 HB VAL A 18 1.355 10.572 2.890 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.191 11.331 1.133 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.072 9.556 1.189 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -1.496 10.375 1.874 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.073 12.664 3.186 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.212 11.751 4.011 1.00 0.00 H new ATOM 0 HG23 VAL A 18 0.406 11.869 4.743 1.00 0.00 H new ATOM 324 N HIS A 19 1.665 7.695 3.310 1.00 0.00 N ATOM 325 CA HIS A 19 2.223 6.450 2.797 1.00 0.00 C ATOM 326 C HIS A 19 1.531 5.238 3.434 1.00 0.00 C ATOM 327 O HIS A 19 1.576 4.130 2.900 1.00 0.00 O ATOM 328 CB HIS A 19 3.742 6.453 3.063 1.00 0.00 C ATOM 329 CG HIS A 19 4.417 5.111 3.056 1.00 0.00 C ATOM 330 ND1 HIS A 19 4.781 4.446 1.907 1.00 0.00 N ATOM 331 CD2 HIS A 19 4.831 4.334 4.083 1.00 0.00 C ATOM 332 CE1 HIS A 19 5.391 3.318 2.230 1.00 0.00 C ATOM 333 NE2 HIS A 19 5.437 3.226 3.547 1.00 0.00 N ATOM 0 H HIS A 19 2.352 8.293 3.769 1.00 0.00 H new ATOM 0 HA HIS A 19 2.050 6.375 1.723 1.00 0.00 H new ATOM 0 HB2 HIS A 19 4.221 7.082 2.312 1.00 0.00 H new ATOM 0 HB3 HIS A 19 3.920 6.921 4.031 1.00 0.00 H new ATOM 0 HD2 HIS A 19 4.707 4.547 5.134 1.00 0.00 H new ATOM 0 HE1 HIS A 19 5.786 2.593 1.533 1.00 0.00 H new ATOM 0 HE2 HIS A 19 5.853 2.460 4.076 1.00 0.00 H new ATOM 342 N GLU A 20 0.879 5.456 4.570 1.00 0.00 N ATOM 343 CA GLU A 20 0.146 4.393 5.238 1.00 0.00 C ATOM 344 C GLU A 20 -1.325 4.386 4.832 1.00 0.00 C ATOM 345 O GLU A 20 -1.809 3.413 4.252 1.00 0.00 O ATOM 346 CB GLU A 20 0.249 4.513 6.759 1.00 0.00 C ATOM 347 CG GLU A 20 1.653 4.325 7.302 1.00 0.00 C ATOM 348 CD GLU A 20 1.651 3.884 8.752 1.00 0.00 C ATOM 349 OE1 GLU A 20 1.568 4.748 9.651 1.00 0.00 O ATOM 350 OE2 GLU A 20 1.720 2.661 8.995 1.00 0.00 O ATOM 0 H GLU A 20 0.844 6.358 5.045 1.00 0.00 H new ATOM 0 HA GLU A 20 0.603 3.455 4.924 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -0.117 5.494 7.061 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -0.408 3.773 7.216 1.00 0.00 H new ATOM 0 HG2 GLU A 20 2.178 3.584 6.699 1.00 0.00 H new ATOM 0 HG3 GLU A 20 2.205 5.260 7.209 1.00 0.00 H new ATOM 357 N LEU A 21 -2.023 5.482 5.115 1.00 0.00 N ATOM 358 CA LEU A 21 -3.475 5.527 4.961 1.00 0.00 C ATOM 359 C LEU A 21 -3.906 5.460 3.499 1.00 0.00 C ATOM 360 O LEU A 21 -4.974 4.931 3.194 1.00 0.00 O ATOM 361 CB LEU A 21 -4.050 6.782 5.623 1.00 0.00 C ATOM 362 CG LEU A 21 -3.695 6.957 7.100 1.00 0.00 C ATOM 363 CD1 LEU A 21 -4.300 8.241 7.643 1.00 0.00 C ATOM 364 CD2 LEU A 21 -4.169 5.759 7.909 1.00 0.00 C ATOM 0 H LEU A 21 -1.608 6.351 5.452 1.00 0.00 H new ATOM 0 HA LEU A 21 -3.873 4.643 5.460 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.699 7.656 5.075 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -5.135 6.760 5.526 1.00 0.00 H new ATOM 0 HG LEU A 21 -2.611 7.023 7.188 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -4.038 8.350 8.695 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.912 9.091 7.082 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -5.385 8.204 7.541 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.907 5.902 8.958 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -5.251 5.661 7.815 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -3.689 4.855 7.535 1.00 0.00 H new ATOM 376 N ALA A 22 -3.079 5.981 2.595 1.00 0.00 N ATOM 377 CA ALA A 22 -3.398 5.944 1.166 1.00 0.00 C ATOM 378 C ALA A 22 -3.556 4.507 0.676 1.00 0.00 C ATOM 379 O ALA A 22 -4.342 4.233 -0.231 1.00 0.00 O ATOM 380 CB ALA A 22 -2.333 6.662 0.350 1.00 0.00 C ATOM 0 H ALA A 22 -2.191 6.430 2.821 1.00 0.00 H new ATOM 0 HA ALA A 22 -4.347 6.462 1.028 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -2.595 6.619 -0.707 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.272 7.703 0.667 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -1.368 6.178 0.505 1.00 0.00 H new ATOM 386 N ARG A 23 -2.817 3.592 1.295 1.00 0.00 N ATOM 387 CA ARG A 23 -2.903 2.179 0.949 1.00 0.00 C ATOM 388 C ARG A 23 -4.281 1.632 1.287 1.00 0.00 C ATOM 389 O ARG A 23 -4.945 1.033 0.443 1.00 0.00 O ATOM 390 CB ARG A 23 -1.840 1.380 1.698 1.00 0.00 C ATOM 391 CG ARG A 23 -0.420 1.712 1.284 1.00 0.00 C ATOM 392 CD ARG A 23 0.583 0.962 2.138 1.00 0.00 C ATOM 393 NE ARG A 23 0.594 1.438 3.523 1.00 0.00 N ATOM 394 CZ ARG A 23 0.594 0.635 4.591 1.00 0.00 C ATOM 395 NH1 ARG A 23 0.472 -0.677 4.438 1.00 0.00 N ATOM 396 NH2 ARG A 23 0.701 1.144 5.815 1.00 0.00 N ATOM 0 H ARG A 23 -2.152 3.804 2.039 1.00 0.00 H new ATOM 0 HA ARG A 23 -2.733 2.082 -0.123 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -1.949 1.562 2.767 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -2.017 0.317 1.536 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.274 1.456 0.235 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.252 2.785 1.376 1.00 0.00 H new ATOM 0 HD2 ARG A 23 0.347 -0.102 2.123 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.579 1.074 1.709 1.00 0.00 H new ATOM 0 HE ARG A 23 0.602 2.445 3.682 1.00 0.00 H new ATOM 0 HH11 ARG A 23 0.378 -1.075 3.504 1.00 0.00 H new ATOM 0 HH12 ARG A 23 0.472 -1.288 5.255 1.00 0.00 H new ATOM 0 HH21 ARG A 23 0.784 2.153 5.942 1.00 0.00 H new ATOM 0 HH22 ARG A 23 0.700 0.526 6.626 1.00 0.00 H new ATOM 410 N VAL A 24 -4.705 1.854 2.527 1.00 0.00 N ATOM 411 CA VAL A 24 -6.008 1.394 2.989 1.00 0.00 C ATOM 412 C VAL A 24 -7.117 2.077 2.198 1.00 0.00 C ATOM 413 O VAL A 24 -8.117 1.455 1.844 1.00 0.00 O ATOM 414 CB VAL A 24 -6.201 1.674 4.496 1.00 0.00 C ATOM 415 CG1 VAL A 24 -7.536 1.129 4.986 1.00 0.00 C ATOM 416 CG2 VAL A 24 -5.053 1.080 5.301 1.00 0.00 C ATOM 0 H VAL A 24 -4.162 2.352 3.232 1.00 0.00 H new ATOM 0 HA VAL A 24 -6.055 0.317 2.830 1.00 0.00 H new ATOM 0 HB VAL A 24 -6.204 2.754 4.641 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -7.647 1.339 6.050 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -8.347 1.605 4.436 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -7.571 0.052 4.824 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -5.206 1.287 6.360 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -5.018 0.002 5.143 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -4.112 1.525 4.976 1.00 0.00 H new ATOM 426 N LYS A 25 -6.910 3.356 1.904 1.00 0.00 N ATOM 427 CA LYS A 25 -7.853 4.131 1.113 1.00 0.00 C ATOM 428 C LYS A 25 -8.061 3.470 -0.250 1.00 0.00 C ATOM 429 O LYS A 25 -9.194 3.268 -0.686 1.00 0.00 O ATOM 430 CB LYS A 25 -7.333 5.565 0.934 1.00 0.00 C ATOM 431 CG LYS A 25 -8.417 6.634 0.966 1.00 0.00 C ATOM 432 CD LYS A 25 -9.447 6.436 -0.133 1.00 0.00 C ATOM 433 CE LYS A 25 -10.566 7.456 -0.034 1.00 0.00 C ATOM 434 NZ LYS A 25 -11.655 7.172 -1.001 1.00 0.00 N ATOM 0 H LYS A 25 -6.089 3.880 2.206 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.809 4.166 1.635 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -6.607 5.776 1.719 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.803 5.631 -0.016 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.914 6.617 1.936 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.959 7.617 0.860 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -8.963 6.518 -1.106 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.862 5.430 -0.067 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.969 7.456 0.979 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.167 8.453 -0.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.401 7.890 -0.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.275 7.196 -1.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.053 6.231 -0.809 1.00 0.00 H new ATOM 448 N PHE A 26 -6.959 3.121 -0.908 1.00 0.00 N ATOM 449 CA PHE A 26 -7.017 2.465 -2.209 1.00 0.00 C ATOM 450 C PHE A 26 -7.666 1.089 -2.095 1.00 0.00 C ATOM 451 O PHE A 26 -8.532 0.736 -2.895 1.00 0.00 O ATOM 452 CB PHE A 26 -5.613 2.337 -2.810 1.00 0.00 C ATOM 453 CG PHE A 26 -5.583 1.603 -4.123 1.00 0.00 C ATOM 454 CD1 PHE A 26 -6.004 2.222 -5.289 1.00 0.00 C ATOM 455 CD2 PHE A 26 -5.136 0.292 -4.189 1.00 0.00 C ATOM 456 CE1 PHE A 26 -5.981 1.547 -6.496 1.00 0.00 C ATOM 457 CE2 PHE A 26 -5.110 -0.388 -5.391 1.00 0.00 C ATOM 458 CZ PHE A 26 -5.533 0.241 -6.546 1.00 0.00 C ATOM 0 H PHE A 26 -6.014 3.282 -0.560 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.627 3.081 -2.870 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -5.195 3.334 -2.951 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -4.969 1.819 -2.099 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.354 3.243 -5.255 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -4.804 -0.204 -3.289 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.313 2.040 -7.398 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.760 -1.409 -5.428 1.00 0.00 H new ATOM 0 HZ PHE A 26 -5.513 -0.288 -7.487 1.00 0.00 H new ATOM 468 N MET A 27 -7.241 0.321 -1.094 1.00 0.00 N ATOM 469 CA MET A 27 -7.796 -1.008 -0.849 1.00 0.00 C ATOM 470 C MET A 27 -9.308 -0.933 -0.675 1.00 0.00 C ATOM 471 O MET A 27 -10.045 -1.692 -1.294 1.00 0.00 O ATOM 472 CB MET A 27 -7.142 -1.638 0.383 1.00 0.00 C ATOM 473 CG MET A 27 -5.673 -1.985 0.177 1.00 0.00 C ATOM 474 SD MET A 27 -4.881 -2.619 1.669 1.00 0.00 S ATOM 475 CE MET A 27 -3.233 -2.972 1.058 1.00 0.00 C ATOM 0 H MET A 27 -6.511 0.598 -0.437 1.00 0.00 H new ATOM 0 HA MET A 27 -7.583 -1.637 -1.713 1.00 0.00 H new ATOM 0 HB2 MET A 27 -7.231 -0.950 1.224 1.00 0.00 H new ATOM 0 HB3 MET A 27 -7.687 -2.543 0.652 1.00 0.00 H new ATOM 0 HG2 MET A 27 -5.589 -2.728 -0.616 1.00 0.00 H new ATOM 0 HG3 MET A 27 -5.140 -1.097 -0.161 1.00 0.00 H new ATOM 0 HE1 MET A 27 -2.728 -3.650 1.745 1.00 0.00 H new ATOM 0 HE2 MET A 27 -3.301 -3.437 0.074 1.00 0.00 H new ATOM 0 HE3 MET A 27 -2.666 -2.044 0.982 1.00 0.00 H new ATOM 485 N GLN A 28 -9.765 0.003 0.143 1.00 0.00 N ATOM 486 CA GLN A 28 -11.192 0.184 0.374 1.00 0.00 C ATOM 487 C GLN A 28 -11.902 0.583 -0.915 1.00 0.00 C ATOM 488 O GLN A 28 -12.913 -0.005 -1.293 1.00 0.00 O ATOM 489 CB GLN A 28 -11.424 1.270 1.420 1.00 0.00 C ATOM 490 CG GLN A 28 -12.859 1.345 1.912 1.00 0.00 C ATOM 491 CD GLN A 28 -13.147 2.633 2.652 1.00 0.00 C ATOM 492 OE1 GLN A 28 -12.243 3.267 3.189 1.00 0.00 O ATOM 493 NE2 GLN A 28 -14.411 3.018 2.704 1.00 0.00 N ATOM 0 H GLN A 28 -9.169 0.650 0.659 1.00 0.00 H new ATOM 0 HA GLN A 28 -11.596 -0.764 0.729 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -10.766 1.090 2.270 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -11.143 2.235 0.998 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -13.537 1.257 1.063 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -13.060 0.499 2.569 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -15.133 2.463 2.244 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -14.664 3.870 3.204 1.00 0.00 H new ATOM 502 N ASP A 29 -11.348 1.582 -1.589 1.00 0.00 N ATOM 503 CA ASP A 29 -11.968 2.151 -2.778 1.00 0.00 C ATOM 504 C ASP A 29 -12.141 1.099 -3.870 1.00 0.00 C ATOM 505 O ASP A 29 -13.180 1.044 -4.528 1.00 0.00 O ATOM 506 CB ASP A 29 -11.126 3.318 -3.304 1.00 0.00 C ATOM 507 CG ASP A 29 -11.872 4.182 -4.302 1.00 0.00 C ATOM 508 OD1 ASP A 29 -11.854 3.870 -5.511 1.00 0.00 O ATOM 509 OD2 ASP A 29 -12.471 5.198 -3.882 1.00 0.00 O ATOM 0 H ASP A 29 -10.463 2.018 -1.330 1.00 0.00 H new ATOM 0 HA ASP A 29 -12.957 2.516 -2.500 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -10.806 3.935 -2.465 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -10.224 2.926 -3.774 1.00 0.00 H new ATOM 514 N VAL A 30 -11.137 0.245 -4.037 1.00 0.00 N ATOM 515 CA VAL A 30 -11.156 -0.750 -5.102 1.00 0.00 C ATOM 516 C VAL A 30 -12.104 -1.913 -4.773 1.00 0.00 C ATOM 517 O VAL A 30 -12.674 -2.530 -5.676 1.00 0.00 O ATOM 518 CB VAL A 30 -9.731 -1.283 -5.405 1.00 0.00 C ATOM 519 CG1 VAL A 30 -9.215 -2.182 -4.292 1.00 0.00 C ATOM 520 CG2 VAL A 30 -9.698 -2.005 -6.740 1.00 0.00 C ATOM 0 H VAL A 30 -10.303 0.222 -3.451 1.00 0.00 H new ATOM 0 HA VAL A 30 -11.531 -0.251 -5.996 1.00 0.00 H new ATOM 0 HB VAL A 30 -9.066 -0.421 -5.462 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.214 -2.534 -4.543 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -9.178 -1.621 -3.358 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -9.882 -3.036 -4.176 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -8.689 -2.370 -6.931 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -10.390 -2.847 -6.716 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -9.991 -1.317 -7.533 1.00 0.00 H new ATOM 530 N VAL A 31 -12.287 -2.194 -3.484 1.00 0.00 N ATOM 531 CA VAL A 31 -13.201 -3.252 -3.051 1.00 0.00 C ATOM 532 C VAL A 31 -14.649 -2.776 -3.129 1.00 0.00 C ATOM 533 O VAL A 31 -15.548 -3.532 -3.499 1.00 0.00 O ATOM 534 CB VAL A 31 -12.896 -3.716 -1.604 1.00 0.00 C ATOM 535 CG1 VAL A 31 -13.909 -4.752 -1.134 1.00 0.00 C ATOM 536 CG2 VAL A 31 -11.490 -4.283 -1.506 1.00 0.00 C ATOM 0 H VAL A 31 -11.816 -1.706 -2.722 1.00 0.00 H new ATOM 0 HA VAL A 31 -13.055 -4.096 -3.725 1.00 0.00 H new ATOM 0 HB VAL A 31 -12.970 -2.843 -0.955 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.670 -5.059 -0.116 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.909 -4.319 -1.157 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -13.874 -5.620 -1.792 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -11.297 -4.602 -0.482 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -11.394 -5.137 -2.177 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -10.768 -3.517 -1.789 1.00 0.00 H new ATOM 546 N ASN A 32 -14.865 -1.509 -2.802 1.00 0.00 N ATOM 547 CA ASN A 32 -16.208 -0.950 -2.767 1.00 0.00 C ATOM 548 C ASN A 32 -16.691 -0.623 -4.172 1.00 0.00 C ATOM 549 O ASN A 32 -17.892 -0.506 -4.414 1.00 0.00 O ATOM 550 CB ASN A 32 -16.261 0.305 -1.883 1.00 0.00 C ATOM 551 CG ASN A 32 -16.077 -0.002 -0.403 1.00 0.00 C ATOM 552 OD1 ASN A 32 -15.388 -0.947 -0.029 1.00 0.00 O ATOM 553 ND2 ASN A 32 -16.700 0.795 0.456 1.00 0.00 N ATOM 0 H ASN A 32 -14.127 -0.849 -2.557 1.00 0.00 H new ATOM 0 HA ASN A 32 -16.870 -1.701 -2.336 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -15.486 1.001 -2.203 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -17.219 0.805 -2.028 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -16.614 0.631 1.459 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -17.265 1.572 0.113 1.00 0.00 H new ATOM 560 N SER A 33 -15.756 -0.478 -5.101 1.00 0.00 N ATOM 561 CA SER A 33 -16.111 -0.212 -6.482 1.00 0.00 C ATOM 562 C SER A 33 -16.119 -1.508 -7.291 1.00 0.00 C ATOM 563 O SER A 33 -15.617 -2.537 -6.838 1.00 0.00 O ATOM 564 CB SER A 33 -15.158 0.813 -7.103 1.00 0.00 C ATOM 565 OG SER A 33 -13.808 0.393 -7.004 1.00 0.00 O ATOM 0 H SER A 33 -14.754 -0.540 -4.922 1.00 0.00 H new ATOM 0 HA SER A 33 -17.116 0.210 -6.502 1.00 0.00 H new ATOM 0 HB2 SER A 33 -15.417 0.964 -8.151 1.00 0.00 H new ATOM 0 HB3 SER A 33 -15.279 1.774 -6.603 1.00 0.00 H new ATOM 0 HG SER A 33 -13.357 0.905 -6.301 1.00 0.00 H new ATOM 571 N ASP A 34 -16.673 -1.451 -8.495 1.00 0.00 N ATOM 572 CA ASP A 34 -16.831 -2.639 -9.335 1.00 0.00 C ATOM 573 C ASP A 34 -15.492 -3.153 -9.842 1.00 0.00 C ATOM 574 O ASP A 34 -15.417 -4.240 -10.411 1.00 0.00 O ATOM 575 CB ASP A 34 -17.747 -2.338 -10.523 1.00 0.00 C ATOM 576 CG ASP A 34 -19.172 -2.061 -10.101 1.00 0.00 C ATOM 577 OD1 ASP A 34 -19.479 -0.906 -9.737 1.00 0.00 O ATOM 578 OD2 ASP A 34 -19.991 -3.002 -10.108 1.00 0.00 O ATOM 0 H ASP A 34 -17.023 -0.591 -8.917 1.00 0.00 H new ATOM 0 HA ASP A 34 -17.281 -3.414 -8.715 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -17.359 -1.477 -11.067 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -17.733 -3.183 -11.211 1.00 0.00 H new ATOM 583 N THR A 35 -14.443 -2.372 -9.622 1.00 0.00 N ATOM 584 CA THR A 35 -13.107 -2.730 -10.065 1.00 0.00 C ATOM 585 C THR A 35 -12.666 -4.072 -9.475 1.00 0.00 C ATOM 586 O THR A 35 -12.056 -4.892 -10.165 1.00 0.00 O ATOM 587 CB THR A 35 -12.102 -1.631 -9.677 1.00 0.00 C ATOM 588 OG1 THR A 35 -12.594 -0.357 -10.122 1.00 0.00 O ATOM 589 CG2 THR A 35 -10.734 -1.895 -10.289 1.00 0.00 C ATOM 0 H THR A 35 -14.496 -1.478 -9.134 1.00 0.00 H new ATOM 0 HA THR A 35 -13.131 -2.827 -11.150 1.00 0.00 H new ATOM 0 HB THR A 35 -11.993 -1.630 -8.592 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.956 0.345 -9.874 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.046 -1.102 -9.997 1.00 0.00 H new ATOM 0 HG22 THR A 35 -10.355 -2.853 -9.934 1.00 0.00 H new ATOM 0 HG23 THR A 35 -10.820 -1.919 -11.375 1.00 0.00 H new ATOM 597 N PHE A 36 -12.977 -4.300 -8.201 1.00 0.00 N ATOM 598 CA PHE A 36 -12.652 -5.571 -7.560 1.00 0.00 C ATOM 599 C PHE A 36 -13.725 -6.003 -6.566 1.00 0.00 C ATOM 600 O PHE A 36 -13.466 -6.835 -5.701 1.00 0.00 O ATOM 601 CB PHE A 36 -11.295 -5.495 -6.859 1.00 0.00 C ATOM 602 CG PHE A 36 -10.147 -5.953 -7.714 1.00 0.00 C ATOM 603 CD1 PHE A 36 -9.973 -7.300 -7.990 1.00 0.00 C ATOM 604 CD2 PHE A 36 -9.241 -5.045 -8.235 1.00 0.00 C ATOM 605 CE1 PHE A 36 -8.916 -7.732 -8.770 1.00 0.00 C ATOM 606 CE2 PHE A 36 -8.184 -5.470 -9.015 1.00 0.00 C ATOM 607 CZ PHE A 36 -8.021 -6.816 -9.284 1.00 0.00 C ATOM 0 H PHE A 36 -13.450 -3.628 -7.597 1.00 0.00 H new ATOM 0 HA PHE A 36 -12.606 -6.321 -8.350 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -11.115 -4.467 -6.545 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -11.328 -6.103 -5.955 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -10.671 -8.021 -7.591 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -9.362 -3.992 -8.029 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -8.791 -8.785 -8.977 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -7.485 -4.751 -9.415 1.00 0.00 H new ATOM 0 HZ PHE A 36 -7.195 -7.150 -9.895 1.00 0.00 H new ATOM 617 N LYS A 37 -14.944 -5.482 -6.716 1.00 0.00 N ATOM 618 CA LYS A 37 -16.041 -5.859 -5.821 1.00 0.00 C ATOM 619 C LYS A 37 -16.441 -7.319 -6.055 1.00 0.00 C ATOM 620 O LYS A 37 -17.218 -7.895 -5.294 1.00 0.00 O ATOM 621 CB LYS A 37 -17.259 -4.941 -6.009 1.00 0.00 C ATOM 622 CG LYS A 37 -18.259 -5.027 -4.860 1.00 0.00 C ATOM 623 CD LYS A 37 -19.430 -4.059 -5.010 1.00 0.00 C ATOM 624 CE LYS A 37 -20.420 -4.507 -6.078 1.00 0.00 C ATOM 625 NZ LYS A 37 -20.011 -4.087 -7.443 1.00 0.00 N ATOM 0 H LYS A 37 -15.195 -4.807 -7.438 1.00 0.00 H new ATOM 0 HA LYS A 37 -15.688 -5.745 -4.796 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -16.917 -3.911 -6.109 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -17.762 -5.202 -6.940 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -18.643 -6.045 -4.796 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -17.744 -4.821 -3.922 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.947 -3.967 -4.055 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -19.050 -3.069 -5.263 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -20.515 -5.592 -6.048 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -21.404 -4.094 -5.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -20.833 -3.698 -7.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -19.270 -3.360 -7.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -19.643 -4.909 -7.963 1.00 0.00 H new ATOM 639 N GLY A 38 -15.906 -7.906 -7.119 1.00 0.00 N ATOM 640 CA GLY A 38 -16.137 -9.308 -7.389 1.00 0.00 C ATOM 641 C GLY A 38 -15.296 -10.201 -6.497 1.00 0.00 C ATOM 642 O GLY A 38 -15.580 -11.389 -6.346 1.00 0.00 O ATOM 0 H GLY A 38 -15.314 -7.432 -7.801 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -17.192 -9.537 -7.241 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -15.908 -9.519 -8.434 1.00 0.00 H new ATOM 646 N GLN A 39 -14.255 -9.626 -5.905 1.00 0.00 N ATOM 647 CA GLN A 39 -13.403 -10.358 -4.981 1.00 0.00 C ATOM 648 C GLN A 39 -13.486 -9.734 -3.592 1.00 0.00 C ATOM 649 O GLN A 39 -12.806 -8.753 -3.308 1.00 0.00 O ATOM 650 CB GLN A 39 -11.947 -10.362 -5.457 1.00 0.00 C ATOM 651 CG GLN A 39 -11.750 -10.979 -6.831 1.00 0.00 C ATOM 652 CD GLN A 39 -10.286 -11.151 -7.194 1.00 0.00 C ATOM 653 OE1 GLN A 39 -9.911 -11.083 -8.365 1.00 0.00 O ATOM 654 NE2 GLN A 39 -9.449 -11.385 -6.194 1.00 0.00 N ATOM 0 H GLN A 39 -13.982 -8.654 -6.050 1.00 0.00 H new ATOM 0 HA GLN A 39 -13.755 -11.389 -4.941 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -11.578 -9.337 -5.474 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -11.340 -10.908 -4.734 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -12.244 -11.950 -6.862 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -12.234 -10.351 -7.579 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -9.799 -11.434 -5.237 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -8.455 -11.516 -6.381 1.00 0.00 H new ATOM 663 N PRO A 40 -14.337 -10.292 -2.716 1.00 0.00 N ATOM 664 CA PRO A 40 -14.519 -9.778 -1.353 1.00 0.00 C ATOM 665 C PRO A 40 -13.235 -9.851 -0.535 1.00 0.00 C ATOM 666 O PRO A 40 -13.026 -9.059 0.380 1.00 0.00 O ATOM 667 CB PRO A 40 -15.585 -10.701 -0.751 1.00 0.00 C ATOM 668 CG PRO A 40 -16.250 -11.345 -1.920 1.00 0.00 C ATOM 669 CD PRO A 40 -15.196 -11.456 -2.982 1.00 0.00 C ATOM 0 HA PRO A 40 -14.804 -8.726 -1.354 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -15.136 -11.446 -0.094 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -16.301 -10.138 -0.152 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -16.642 -12.327 -1.654 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -17.093 -10.748 -2.267 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -14.643 -12.392 -2.906 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -15.626 -11.420 -3.983 1.00 0.00 H new ATOM 677 N ILE A 41 -12.379 -10.807 -0.874 1.00 0.00 N ATOM 678 CA ILE A 41 -11.120 -11.001 -0.168 1.00 0.00 C ATOM 679 C ILE A 41 -9.971 -11.088 -1.170 1.00 0.00 C ATOM 680 O ILE A 41 -10.144 -11.601 -2.279 1.00 0.00 O ATOM 681 CB ILE A 41 -11.134 -12.294 0.686 1.00 0.00 C ATOM 682 CG1 ILE A 41 -12.358 -12.336 1.610 1.00 0.00 C ATOM 683 CG2 ILE A 41 -9.856 -12.400 1.506 1.00 0.00 C ATOM 684 CD1 ILE A 41 -12.379 -11.242 2.657 1.00 0.00 C ATOM 0 H ILE A 41 -12.536 -11.464 -1.639 1.00 0.00 H new ATOM 0 HA ILE A 41 -10.984 -10.147 0.496 1.00 0.00 H new ATOM 0 HB ILE A 41 -11.193 -13.144 0.006 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -13.261 -12.261 1.004 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -12.389 -13.304 2.110 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -9.880 -13.313 2.101 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -8.996 -12.425 0.837 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -9.776 -11.538 2.168 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -13.275 -11.341 3.269 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -11.496 -11.327 3.290 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -12.381 -10.269 2.166 1.00 0.00 H new ATOM 696 N PHE A 42 -8.809 -10.578 -0.786 1.00 0.00 N ATOM 697 CA PHE A 42 -7.620 -10.689 -1.617 1.00 0.00 C ATOM 698 C PHE A 42 -6.597 -11.591 -0.946 1.00 0.00 C ATOM 699 O PHE A 42 -6.795 -12.037 0.182 1.00 0.00 O ATOM 700 CB PHE A 42 -7.001 -9.317 -1.884 1.00 0.00 C ATOM 701 CG PHE A 42 -7.892 -8.383 -2.648 1.00 0.00 C ATOM 702 CD1 PHE A 42 -8.322 -8.705 -3.925 1.00 0.00 C ATOM 703 CD2 PHE A 42 -8.292 -7.180 -2.092 1.00 0.00 C ATOM 704 CE1 PHE A 42 -9.136 -7.843 -4.632 1.00 0.00 C ATOM 705 CE2 PHE A 42 -9.106 -6.315 -2.795 1.00 0.00 C ATOM 706 CZ PHE A 42 -9.528 -6.647 -4.066 1.00 0.00 C ATOM 0 H PHE A 42 -8.665 -10.084 0.095 1.00 0.00 H new ATOM 0 HA PHE A 42 -7.917 -11.122 -2.572 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -6.740 -8.856 -0.931 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.072 -9.451 -2.438 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.017 -9.640 -4.372 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -7.964 -6.916 -1.098 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.466 -8.104 -5.627 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -9.412 -5.379 -2.351 1.00 0.00 H new ATOM 0 HZ PHE A 42 -10.165 -5.971 -4.618 1.00 0.00 H new ATOM 716 N ASP A 43 -5.503 -11.856 -1.637 1.00 0.00 N ATOM 717 CA ASP A 43 -4.462 -12.721 -1.106 1.00 0.00 C ATOM 718 C ASP A 43 -3.155 -11.946 -0.952 1.00 0.00 C ATOM 719 O ASP A 43 -3.117 -10.730 -1.152 1.00 0.00 O ATOM 720 CB ASP A 43 -4.258 -13.924 -2.025 1.00 0.00 C ATOM 721 CG ASP A 43 -3.541 -13.558 -3.305 1.00 0.00 C ATOM 722 OD1 ASP A 43 -4.019 -12.663 -4.032 1.00 0.00 O ATOM 723 OD2 ASP A 43 -2.482 -14.153 -3.573 1.00 0.00 O ATOM 0 H ASP A 43 -5.311 -11.485 -2.568 1.00 0.00 H new ATOM 0 HA ASP A 43 -4.772 -13.078 -0.124 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -3.686 -14.688 -1.497 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -5.227 -14.361 -2.267 1.00 0.00 H new ATOM 728 N HIS A 44 -2.083 -12.655 -0.616 1.00 0.00 N ATOM 729 CA HIS A 44 -0.801 -12.016 -0.341 1.00 0.00 C ATOM 730 C HIS A 44 -0.055 -11.663 -1.626 1.00 0.00 C ATOM 731 O HIS A 44 0.781 -10.760 -1.630 1.00 0.00 O ATOM 732 CB HIS A 44 0.070 -12.907 0.548 1.00 0.00 C ATOM 733 CG HIS A 44 -0.470 -13.081 1.938 1.00 0.00 C ATOM 734 ND1 HIS A 44 -0.742 -14.312 2.490 1.00 0.00 N ATOM 735 CD2 HIS A 44 -0.782 -12.167 2.890 1.00 0.00 C ATOM 736 CE1 HIS A 44 -1.199 -14.149 3.720 1.00 0.00 C ATOM 737 NE2 HIS A 44 -1.234 -12.858 3.987 1.00 0.00 N ATOM 0 H HIS A 44 -2.076 -13.671 -0.528 1.00 0.00 H new ATOM 0 HA HIS A 44 -1.011 -11.087 0.188 1.00 0.00 H new ATOM 0 HB2 HIS A 44 0.169 -13.887 0.080 1.00 0.00 H new ATOM 0 HB3 HIS A 44 1.071 -12.479 0.607 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -0.692 -11.094 2.802 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -1.494 -14.940 4.393 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -1.546 -12.441 4.864 1.00 0.00 H new ATOM 746 N ALA A 45 -0.361 -12.358 -2.719 1.00 0.00 N ATOM 747 CA ALA A 45 0.258 -12.043 -4.002 1.00 0.00 C ATOM 748 C ALA A 45 -0.269 -10.711 -4.518 1.00 0.00 C ATOM 749 O ALA A 45 0.483 -9.898 -5.057 1.00 0.00 O ATOM 750 CB ALA A 45 0.011 -13.148 -5.017 1.00 0.00 C ATOM 0 H ALA A 45 -1.025 -13.132 -2.742 1.00 0.00 H new ATOM 0 HA ALA A 45 1.335 -11.965 -3.855 1.00 0.00 H new ATOM 0 HB1 ALA A 45 0.484 -12.885 -5.963 1.00 0.00 H new ATOM 0 HB2 ALA A 45 0.433 -14.083 -4.647 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -1.062 -13.269 -5.169 1.00 0.00 H new ATOM 756 N HIS A 46 -1.565 -10.482 -4.322 1.00 0.00 N ATOM 757 CA HIS A 46 -2.176 -9.212 -4.690 1.00 0.00 C ATOM 758 C HIS A 46 -1.685 -8.091 -3.785 1.00 0.00 C ATOM 759 O HIS A 46 -1.752 -6.917 -4.151 1.00 0.00 O ATOM 760 CB HIS A 46 -3.700 -9.304 -4.662 1.00 0.00 C ATOM 761 CG HIS A 46 -4.272 -9.859 -5.928 1.00 0.00 C ATOM 762 ND1 HIS A 46 -4.528 -11.196 -6.118 1.00 0.00 N ATOM 763 CD2 HIS A 46 -4.618 -9.243 -7.081 1.00 0.00 C ATOM 764 CE1 HIS A 46 -5.008 -11.381 -7.334 1.00 0.00 C ATOM 765 NE2 HIS A 46 -5.073 -10.209 -7.940 1.00 0.00 N ATOM 0 H HIS A 46 -2.209 -11.158 -3.912 1.00 0.00 H new ATOM 0 HA HIS A 46 -1.874 -8.981 -5.712 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -4.006 -9.932 -3.825 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -4.116 -8.312 -4.485 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -4.372 -11.930 -5.428 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -4.549 -8.185 -7.287 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.298 -12.330 -7.761 1.00 0.00 H new ATOM 774 N THR A 47 -1.195 -8.454 -2.603 1.00 0.00 N ATOM 775 CA THR A 47 -0.511 -7.498 -1.749 1.00 0.00 C ATOM 776 C THR A 47 0.704 -6.949 -2.484 1.00 0.00 C ATOM 777 O THR A 47 0.806 -5.746 -2.716 1.00 0.00 O ATOM 778 CB THR A 47 -0.059 -8.134 -0.421 1.00 0.00 C ATOM 779 OG1 THR A 47 -1.202 -8.528 0.350 1.00 0.00 O ATOM 780 CG2 THR A 47 0.812 -7.169 0.377 1.00 0.00 C ATOM 0 H THR A 47 -1.260 -9.397 -2.220 1.00 0.00 H new ATOM 0 HA THR A 47 -1.211 -6.697 -1.514 1.00 0.00 H new ATOM 0 HB THR A 47 0.537 -9.018 -0.649 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.905 -8.933 1.192 1.00 0.00 H new ATOM 0 HG21 THR A 47 1.118 -7.642 1.310 1.00 0.00 H new ATOM 0 HG22 THR A 47 1.696 -6.910 -0.206 1.00 0.00 H new ATOM 0 HG23 THR A 47 0.245 -6.265 0.597 1.00 0.00 H new ATOM 788 N ARG A 48 1.600 -7.851 -2.873 1.00 0.00 N ATOM 789 CA ARG A 48 2.782 -7.483 -3.644 1.00 0.00 C ATOM 790 C ARG A 48 2.390 -6.703 -4.898 1.00 0.00 C ATOM 791 O ARG A 48 3.017 -5.705 -5.233 1.00 0.00 O ATOM 792 CB ARG A 48 3.575 -8.739 -4.024 1.00 0.00 C ATOM 793 CG ARG A 48 4.653 -8.488 -5.070 1.00 0.00 C ATOM 794 CD ARG A 48 5.394 -9.762 -5.438 1.00 0.00 C ATOM 795 NE ARG A 48 6.231 -9.577 -6.625 1.00 0.00 N ATOM 796 CZ ARG A 48 7.475 -10.038 -6.748 1.00 0.00 C ATOM 797 NH1 ARG A 48 8.046 -10.710 -5.756 1.00 0.00 N ATOM 798 NH2 ARG A 48 8.146 -9.824 -7.872 1.00 0.00 N ATOM 0 H ARG A 48 1.529 -8.847 -2.665 1.00 0.00 H new ATOM 0 HA ARG A 48 3.411 -6.841 -3.027 1.00 0.00 H new ATOM 0 HB2 ARG A 48 4.039 -9.150 -3.128 1.00 0.00 H new ATOM 0 HB3 ARG A 48 2.885 -9.494 -4.400 1.00 0.00 H new ATOM 0 HG2 ARG A 48 4.199 -8.061 -5.964 1.00 0.00 H new ATOM 0 HG3 ARG A 48 5.362 -7.752 -4.691 1.00 0.00 H new ATOM 0 HD2 ARG A 48 6.016 -10.077 -4.600 1.00 0.00 H new ATOM 0 HD3 ARG A 48 4.676 -10.561 -5.620 1.00 0.00 H new ATOM 0 HE ARG A 48 5.835 -9.061 -7.410 1.00 0.00 H new ATOM 0 HH11 ARG A 48 7.532 -10.877 -4.891 1.00 0.00 H new ATOM 0 HH12 ARG A 48 8.999 -11.059 -5.859 1.00 0.00 H new ATOM 0 HH21 ARG A 48 7.709 -9.309 -8.636 1.00 0.00 H new ATOM 0 HH22 ARG A 48 9.099 -10.175 -7.972 1.00 0.00 H new ATOM 812 N GLU A 49 1.338 -7.159 -5.569 1.00 0.00 N ATOM 813 CA GLU A 49 0.858 -6.519 -6.792 1.00 0.00 C ATOM 814 C GLU A 49 0.536 -5.037 -6.561 1.00 0.00 C ATOM 815 O GLU A 49 1.094 -4.156 -7.227 1.00 0.00 O ATOM 816 CB GLU A 49 -0.379 -7.260 -7.304 1.00 0.00 C ATOM 817 CG GLU A 49 -0.862 -6.787 -8.665 1.00 0.00 C ATOM 818 CD GLU A 49 -1.999 -7.633 -9.199 1.00 0.00 C ATOM 819 OE1 GLU A 49 -1.861 -8.872 -9.221 1.00 0.00 O ATOM 820 OE2 GLU A 49 -3.035 -7.064 -9.605 1.00 0.00 O ATOM 0 H GLU A 49 0.797 -7.976 -5.285 1.00 0.00 H new ATOM 0 HA GLU A 49 1.649 -6.569 -7.540 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -0.155 -8.325 -7.359 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -1.186 -7.141 -6.582 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.188 -5.749 -8.592 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -0.032 -6.811 -9.371 1.00 0.00 H new ATOM 827 N PHE A 50 -0.346 -4.765 -5.608 1.00 0.00 N ATOM 828 CA PHE A 50 -0.770 -3.396 -5.333 1.00 0.00 C ATOM 829 C PHE A 50 0.345 -2.588 -4.671 1.00 0.00 C ATOM 830 O PHE A 50 0.583 -1.434 -5.030 1.00 0.00 O ATOM 831 CB PHE A 50 -2.024 -3.378 -4.452 1.00 0.00 C ATOM 832 CG PHE A 50 -3.264 -3.889 -5.139 1.00 0.00 C ATOM 833 CD1 PHE A 50 -3.569 -3.494 -6.433 1.00 0.00 C ATOM 834 CD2 PHE A 50 -4.131 -4.752 -4.485 1.00 0.00 C ATOM 835 CE1 PHE A 50 -4.713 -3.949 -7.061 1.00 0.00 C ATOM 836 CE2 PHE A 50 -5.277 -5.211 -5.110 1.00 0.00 C ATOM 837 CZ PHE A 50 -5.568 -4.808 -6.399 1.00 0.00 C ATOM 0 H PHE A 50 -0.781 -5.471 -5.014 1.00 0.00 H new ATOM 0 HA PHE A 50 -1.006 -2.932 -6.290 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -1.839 -3.981 -3.563 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -2.203 -2.357 -4.114 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.904 -2.823 -6.956 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -3.909 -5.069 -3.477 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.938 -3.633 -8.069 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -5.943 -5.884 -4.591 1.00 0.00 H new ATOM 0 HZ PHE A 50 -6.463 -5.164 -6.888 1.00 0.00 H new ATOM 847 N ILE A 51 1.035 -3.203 -3.715 1.00 0.00 N ATOM 848 CA ILE A 51 2.086 -2.517 -2.971 1.00 0.00 C ATOM 849 C ILE A 51 3.261 -2.144 -3.885 1.00 0.00 C ATOM 850 O ILE A 51 3.816 -1.049 -3.778 1.00 0.00 O ATOM 851 CB ILE A 51 2.573 -3.360 -1.765 1.00 0.00 C ATOM 852 CG1 ILE A 51 1.447 -3.508 -0.729 1.00 0.00 C ATOM 853 CG2 ILE A 51 3.799 -2.733 -1.119 1.00 0.00 C ATOM 854 CD1 ILE A 51 0.904 -2.187 -0.222 1.00 0.00 C ATOM 0 H ILE A 51 0.886 -4.173 -3.438 1.00 0.00 H new ATOM 0 HA ILE A 51 1.656 -1.595 -2.580 1.00 0.00 H new ATOM 0 HB ILE A 51 2.850 -4.348 -2.133 1.00 0.00 H new ATOM 0 HG12 ILE A 51 0.631 -4.079 -1.172 1.00 0.00 H new ATOM 0 HG13 ILE A 51 1.818 -4.086 0.117 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.119 -3.345 -0.276 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.605 -2.673 -1.850 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.553 -1.731 -0.767 1.00 0.00 H new ATOM 0 HD11 ILE A 51 0.113 -2.373 0.505 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.706 -1.622 0.252 1.00 0.00 H new ATOM 0 HD13 ILE A 51 0.501 -1.615 -1.057 1.00 0.00 H new ATOM 866 N GLN A 52 3.619 -3.041 -4.803 1.00 0.00 N ATOM 867 CA GLN A 52 4.694 -2.773 -5.761 1.00 0.00 C ATOM 868 C GLN A 52 4.322 -1.609 -6.671 1.00 0.00 C ATOM 869 O GLN A 52 5.157 -0.755 -6.970 1.00 0.00 O ATOM 870 CB GLN A 52 4.997 -4.017 -6.607 1.00 0.00 C ATOM 871 CG GLN A 52 6.045 -3.795 -7.692 1.00 0.00 C ATOM 872 CD GLN A 52 7.425 -3.485 -7.139 1.00 0.00 C ATOM 873 OE1 GLN A 52 8.229 -4.386 -6.911 1.00 0.00 O ATOM 874 NE2 GLN A 52 7.707 -2.209 -6.921 1.00 0.00 N ATOM 0 H GLN A 52 3.183 -3.957 -4.905 1.00 0.00 H new ATOM 0 HA GLN A 52 5.588 -2.510 -5.195 1.00 0.00 H new ATOM 0 HB2 GLN A 52 5.336 -4.817 -5.948 1.00 0.00 H new ATOM 0 HB3 GLN A 52 4.073 -4.359 -7.074 1.00 0.00 H new ATOM 0 HG2 GLN A 52 6.104 -4.685 -8.318 1.00 0.00 H new ATOM 0 HG3 GLN A 52 5.725 -2.974 -8.334 1.00 0.00 H new ATOM 0 HE21 GLN A 52 7.011 -1.491 -7.124 1.00 0.00 H new ATOM 0 HE22 GLN A 52 8.620 -1.945 -6.551 1.00 0.00 H new ATOM 883 N SER A 53 3.068 -1.576 -7.107 1.00 0.00 N ATOM 884 CA SER A 53 2.587 -0.505 -7.971 1.00 0.00 C ATOM 885 C SER A 53 2.607 0.840 -7.241 1.00 0.00 C ATOM 886 O SER A 53 2.845 1.887 -7.849 1.00 0.00 O ATOM 887 CB SER A 53 1.182 -0.830 -8.470 1.00 0.00 C ATOM 888 OG SER A 53 1.173 -2.073 -9.156 1.00 0.00 O ATOM 0 H SER A 53 2.366 -2.279 -6.876 1.00 0.00 H new ATOM 0 HA SER A 53 3.254 -0.425 -8.829 1.00 0.00 H new ATOM 0 HB2 SER A 53 0.490 -0.867 -7.628 1.00 0.00 H new ATOM 0 HB3 SER A 53 0.833 -0.039 -9.134 1.00 0.00 H new ATOM 0 HG SER A 53 1.148 -2.805 -8.505 1.00 0.00 H new ATOM 894 N PHE A 54 2.381 0.802 -5.932 1.00 0.00 N ATOM 895 CA PHE A 54 2.458 1.997 -5.101 1.00 0.00 C ATOM 896 C PHE A 54 3.880 2.560 -5.131 1.00 0.00 C ATOM 897 O PHE A 54 4.082 3.774 -5.192 1.00 0.00 O ATOM 898 CB PHE A 54 2.038 1.663 -3.664 1.00 0.00 C ATOM 899 CG PHE A 54 2.006 2.850 -2.739 1.00 0.00 C ATOM 900 CD1 PHE A 54 0.929 3.721 -2.748 1.00 0.00 C ATOM 901 CD2 PHE A 54 3.051 3.091 -1.859 1.00 0.00 C ATOM 902 CE1 PHE A 54 0.894 4.810 -1.898 1.00 0.00 C ATOM 903 CE2 PHE A 54 3.021 4.178 -1.009 1.00 0.00 C ATOM 904 CZ PHE A 54 1.941 5.039 -1.027 1.00 0.00 C ATOM 0 H PHE A 54 2.142 -0.048 -5.422 1.00 0.00 H new ATOM 0 HA PHE A 54 1.777 2.753 -5.493 1.00 0.00 H new ATOM 0 HB2 PHE A 54 1.049 1.205 -3.684 1.00 0.00 H new ATOM 0 HB3 PHE A 54 2.725 0.920 -3.260 1.00 0.00 H new ATOM 0 HD1 PHE A 54 0.107 3.547 -3.427 1.00 0.00 H new ATOM 0 HD2 PHE A 54 3.897 2.421 -1.839 1.00 0.00 H new ATOM 0 HE1 PHE A 54 0.048 5.482 -1.915 1.00 0.00 H new ATOM 0 HE2 PHE A 54 3.842 4.355 -0.330 1.00 0.00 H new ATOM 0 HZ PHE A 54 1.915 5.889 -0.362 1.00 0.00 H new ATOM 914 N ILE A 55 4.858 1.659 -5.103 1.00 0.00 N ATOM 915 CA ILE A 55 6.265 2.037 -5.199 1.00 0.00 C ATOM 916 C ILE A 55 6.594 2.472 -6.624 1.00 0.00 C ATOM 917 O ILE A 55 7.368 3.401 -6.846 1.00 0.00 O ATOM 918 CB ILE A 55 7.187 0.858 -4.818 1.00 0.00 C ATOM 919 CG1 ILE A 55 6.766 0.261 -3.475 1.00 0.00 C ATOM 920 CG2 ILE A 55 8.641 1.313 -4.764 1.00 0.00 C ATOM 921 CD1 ILE A 55 7.472 -1.036 -3.139 1.00 0.00 C ATOM 0 H ILE A 55 4.700 0.655 -5.014 1.00 0.00 H new ATOM 0 HA ILE A 55 6.434 2.860 -4.505 1.00 0.00 H new ATOM 0 HB ILE A 55 7.094 0.088 -5.584 1.00 0.00 H new ATOM 0 HG12 ILE A 55 6.964 0.987 -2.686 1.00 0.00 H new ATOM 0 HG13 ILE A 55 5.690 0.087 -3.486 1.00 0.00 H new ATOM 0 HG21 ILE A 55 9.276 0.469 -4.494 1.00 0.00 H new ATOM 0 HG22 ILE A 55 8.939 1.694 -5.741 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.748 2.101 -4.019 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.123 -1.400 -2.173 1.00 0.00 H new ATOM 0 HD12 ILE A 55 7.254 -1.778 -3.907 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.547 -0.864 -3.095 1.00 0.00 H new ATOM 933 N GLU A 56 5.977 1.788 -7.580 1.00 0.00 N ATOM 934 CA GLU A 56 6.186 2.043 -9.002 1.00 0.00 C ATOM 935 C GLU A 56 5.869 3.495 -9.358 1.00 0.00 C ATOM 936 O GLU A 56 6.509 4.087 -10.227 1.00 0.00 O ATOM 937 CB GLU A 56 5.299 1.099 -9.819 1.00 0.00 C ATOM 938 CG GLU A 56 5.498 1.190 -11.321 1.00 0.00 C ATOM 939 CD GLU A 56 4.494 0.350 -12.082 1.00 0.00 C ATOM 940 OE1 GLU A 56 4.611 -0.891 -12.061 1.00 0.00 O ATOM 941 OE2 GLU A 56 3.577 0.928 -12.703 1.00 0.00 O ATOM 0 H GLU A 56 5.314 1.037 -7.391 1.00 0.00 H new ATOM 0 HA GLU A 56 7.235 1.864 -9.236 1.00 0.00 H new ATOM 0 HB2 GLU A 56 5.492 0.074 -9.501 1.00 0.00 H new ATOM 0 HB3 GLU A 56 4.255 1.313 -9.590 1.00 0.00 H new ATOM 0 HG2 GLU A 56 5.411 2.230 -11.635 1.00 0.00 H new ATOM 0 HG3 GLU A 56 6.507 0.864 -11.573 1.00 0.00 H new ATOM 948 N ARG A 57 4.893 4.066 -8.661 1.00 0.00 N ATOM 949 CA ARG A 57 4.448 5.430 -8.929 1.00 0.00 C ATOM 950 C ARG A 57 5.440 6.480 -8.428 1.00 0.00 C ATOM 951 O ARG A 57 5.201 7.679 -8.573 1.00 0.00 O ATOM 952 CB ARG A 57 3.071 5.670 -8.316 1.00 0.00 C ATOM 953 CG ARG A 57 1.954 4.952 -9.054 1.00 0.00 C ATOM 954 CD ARG A 57 0.607 5.182 -8.393 1.00 0.00 C ATOM 955 NE ARG A 57 0.317 6.604 -8.205 1.00 0.00 N ATOM 956 CZ ARG A 57 -0.601 7.279 -8.902 1.00 0.00 C ATOM 957 NH1 ARG A 57 -1.232 6.696 -9.915 1.00 0.00 N ATOM 958 NH2 ARG A 57 -0.854 8.548 -8.607 1.00 0.00 N ATOM 0 H ARG A 57 4.392 3.603 -7.902 1.00 0.00 H new ATOM 0 HA ARG A 57 4.387 5.537 -10.012 1.00 0.00 H new ATOM 0 HB2 ARG A 57 3.081 5.342 -7.277 1.00 0.00 H new ATOM 0 HB3 ARG A 57 2.865 6.740 -8.310 1.00 0.00 H new ATOM 0 HG2 ARG A 57 1.917 5.300 -10.086 1.00 0.00 H new ATOM 0 HG3 ARG A 57 2.166 3.883 -9.085 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.176 4.731 -9.002 1.00 0.00 H new ATOM 0 HD3 ARG A 57 0.588 4.679 -7.426 1.00 0.00 H new ATOM 0 HE ARG A 57 0.849 7.111 -7.498 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -1.016 5.730 -10.162 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -1.933 7.214 -10.445 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -0.348 9.006 -7.849 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -1.555 9.065 -9.138 1.00 0.00 H new ATOM 972 N ASP A 58 6.552 6.038 -7.848 1.00 0.00 N ATOM 973 CA ASP A 58 7.628 6.956 -7.475 1.00 0.00 C ATOM 974 C ASP A 58 8.184 7.613 -8.733 1.00 0.00 C ATOM 975 O ASP A 58 8.589 8.775 -8.722 1.00 0.00 O ATOM 976 CB ASP A 58 8.741 6.218 -6.723 1.00 0.00 C ATOM 977 CG ASP A 58 9.896 7.121 -6.334 1.00 0.00 C ATOM 978 OD1 ASP A 58 9.786 7.827 -5.313 1.00 0.00 O ATOM 979 OD2 ASP A 58 10.918 7.117 -7.046 1.00 0.00 O ATOM 0 H ASP A 58 6.733 5.059 -7.627 1.00 0.00 H new ATOM 0 HA ASP A 58 7.227 7.721 -6.810 1.00 0.00 H new ATOM 0 HB2 ASP A 58 8.324 5.763 -5.824 1.00 0.00 H new ATOM 0 HB3 ASP A 58 9.116 5.406 -7.346 1.00 0.00 H new ATOM 984 N ASP A 59 8.156 6.858 -9.830 1.00 0.00 N ATOM 985 CA ASP A 59 8.576 7.360 -11.137 1.00 0.00 C ATOM 986 C ASP A 59 7.703 8.522 -11.585 1.00 0.00 C ATOM 987 O ASP A 59 8.166 9.422 -12.283 1.00 0.00 O ATOM 988 CB ASP A 59 8.517 6.248 -12.186 1.00 0.00 C ATOM 989 CG ASP A 59 9.811 5.474 -12.296 1.00 0.00 C ATOM 990 OD1 ASP A 59 10.137 4.709 -11.364 1.00 0.00 O ATOM 991 OD2 ASP A 59 10.509 5.625 -13.321 1.00 0.00 O ATOM 0 H ASP A 59 7.844 5.887 -9.838 1.00 0.00 H new ATOM 0 HA ASP A 59 9.604 7.710 -11.039 1.00 0.00 H new ATOM 0 HB2 ASP A 59 7.709 5.561 -11.935 1.00 0.00 H new ATOM 0 HB3 ASP A 59 8.276 6.683 -13.156 1.00 0.00 H new ATOM 996 N THR A 60 6.440 8.501 -11.178 1.00 0.00 N ATOM 997 CA THR A 60 5.508 9.557 -11.531 1.00 0.00 C ATOM 998 C THR A 60 5.933 10.874 -10.892 1.00 0.00 C ATOM 999 O THR A 60 6.000 11.908 -11.554 1.00 0.00 O ATOM 1000 CB THR A 60 4.078 9.196 -11.089 1.00 0.00 C ATOM 1001 OG1 THR A 60 3.765 7.864 -11.520 1.00 0.00 O ATOM 1002 CG2 THR A 60 3.063 10.171 -11.668 1.00 0.00 C ATOM 0 H THR A 60 6.040 7.761 -10.602 1.00 0.00 H new ATOM 0 HA THR A 60 5.517 9.669 -12.615 1.00 0.00 H new ATOM 0 HB THR A 60 4.029 9.256 -10.002 1.00 0.00 H new ATOM 0 HG1 THR A 60 2.855 7.634 -11.237 1.00 0.00 H new ATOM 0 HG21 THR A 60 2.062 9.892 -11.339 1.00 0.00 H new ATOM 0 HG22 THR A 60 3.290 11.180 -11.323 1.00 0.00 H new ATOM 0 HG23 THR A 60 3.109 10.141 -12.757 1.00 0.00 H new ATOM 1010 N GLU A 61 6.249 10.815 -9.608 1.00 0.00 N ATOM 1011 CA GLU A 61 6.725 11.985 -8.887 1.00 0.00 C ATOM 1012 C GLU A 61 8.111 12.382 -9.385 1.00 0.00 C ATOM 1013 O GLU A 61 8.429 13.560 -9.488 1.00 0.00 O ATOM 1014 CB GLU A 61 6.754 11.713 -7.385 1.00 0.00 C ATOM 1015 CG GLU A 61 5.376 11.468 -6.791 1.00 0.00 C ATOM 1016 CD GLU A 61 5.434 11.131 -5.318 1.00 0.00 C ATOM 1017 OE1 GLU A 61 5.632 12.053 -4.499 1.00 0.00 O ATOM 1018 OE2 GLU A 61 5.301 9.941 -4.973 1.00 0.00 O ATOM 0 H GLU A 61 6.184 9.968 -9.043 1.00 0.00 H new ATOM 0 HA GLU A 61 6.038 12.811 -9.072 1.00 0.00 H new ATOM 0 HB2 GLU A 61 7.385 10.845 -7.192 1.00 0.00 H new ATOM 0 HB3 GLU A 61 7.215 12.561 -6.878 1.00 0.00 H new ATOM 0 HG2 GLU A 61 4.759 12.355 -6.934 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.891 10.653 -7.328 1.00 0.00 H new ATOM 1025 N LEU A 62 8.920 11.380 -9.705 1.00 0.00 N ATOM 1026 CA LEU A 62 10.240 11.601 -10.288 1.00 0.00 C ATOM 1027 C LEU A 62 10.139 12.388 -11.591 1.00 0.00 C ATOM 1028 O LEU A 62 10.919 13.309 -11.830 1.00 0.00 O ATOM 1029 CB LEU A 62 10.919 10.248 -10.538 1.00 0.00 C ATOM 1030 CG LEU A 62 12.190 10.275 -11.393 1.00 0.00 C ATOM 1031 CD1 LEU A 62 13.260 11.144 -10.754 1.00 0.00 C ATOM 1032 CD2 LEU A 62 12.707 8.861 -11.601 1.00 0.00 C ATOM 0 H LEU A 62 8.683 10.397 -9.569 1.00 0.00 H new ATOM 0 HA LEU A 62 10.837 12.186 -9.589 1.00 0.00 H new ATOM 0 HB2 LEU A 62 11.165 9.805 -9.573 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.198 9.586 -11.018 1.00 0.00 H new ATOM 0 HG LEU A 62 11.943 10.708 -12.362 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.151 11.145 -11.382 1.00 0.00 H new ATOM 0 HD12 LEU A 62 12.887 12.163 -10.651 1.00 0.00 H new ATOM 0 HD13 LEU A 62 13.510 10.748 -9.770 1.00 0.00 H new ATOM 0 HD21 LEU A 62 13.611 8.890 -12.210 1.00 0.00 H new ATOM 0 HD22 LEU A 62 12.935 8.411 -10.635 1.00 0.00 H new ATOM 0 HD23 LEU A 62 11.947 8.267 -12.108 1.00 0.00 H new ATOM 1044 N ASP A 63 9.170 12.035 -12.425 1.00 0.00 N ATOM 1045 CA ASP A 63 8.993 12.708 -13.704 1.00 0.00 C ATOM 1046 C ASP A 63 8.437 14.116 -13.494 1.00 0.00 C ATOM 1047 O ASP A 63 8.554 14.975 -14.365 1.00 0.00 O ATOM 1048 CB ASP A 63 8.092 11.891 -14.633 1.00 0.00 C ATOM 1049 CG ASP A 63 8.175 12.351 -16.078 1.00 0.00 C ATOM 1050 OD1 ASP A 63 9.305 12.495 -16.605 1.00 0.00 O ATOM 1051 OD2 ASP A 63 7.114 12.565 -16.700 1.00 0.00 O ATOM 0 H ASP A 63 8.498 11.290 -12.240 1.00 0.00 H new ATOM 0 HA ASP A 63 9.968 12.796 -14.184 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.373 10.839 -14.573 1.00 0.00 H new ATOM 0 HB3 ASP A 63 7.060 11.965 -14.290 1.00 0.00 H new ATOM 1056 N GLU A 64 7.852 14.353 -12.322 1.00 0.00 N ATOM 1057 CA GLU A 64 7.443 15.698 -11.928 1.00 0.00 C ATOM 1058 C GLU A 64 8.667 16.586 -11.723 1.00 0.00 C ATOM 1059 O GLU A 64 8.665 17.753 -12.108 1.00 0.00 O ATOM 1060 CB GLU A 64 6.603 15.664 -10.651 1.00 0.00 C ATOM 1061 CG GLU A 64 5.147 15.297 -10.879 1.00 0.00 C ATOM 1062 CD GLU A 64 4.400 16.358 -11.661 1.00 0.00 C ATOM 1063 OE1 GLU A 64 4.623 17.563 -11.401 1.00 0.00 O ATOM 1064 OE2 GLU A 64 3.588 16.000 -12.536 1.00 0.00 O ATOM 0 H GLU A 64 7.651 13.632 -11.630 1.00 0.00 H new ATOM 0 HA GLU A 64 6.832 16.112 -12.730 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.043 14.947 -9.958 1.00 0.00 H new ATOM 0 HB3 GLU A 64 6.650 16.642 -10.171 1.00 0.00 H new ATOM 0 HG2 GLU A 64 5.094 14.349 -11.415 1.00 0.00 H new ATOM 0 HG3 GLU A 64 4.658 15.147 -9.917 1.00 0.00 H new ATOM 1071 N LEU A 65 9.708 16.031 -11.105 1.00 0.00 N ATOM 1072 CA LEU A 65 10.989 16.726 -10.987 1.00 0.00 C ATOM 1073 C LEU A 65 11.605 16.882 -12.369 1.00 0.00 C ATOM 1074 O LEU A 65 12.163 17.923 -12.717 1.00 0.00 O ATOM 1075 CB LEU A 65 11.976 15.947 -10.099 1.00 0.00 C ATOM 1076 CG LEU A 65 11.739 16.002 -8.586 1.00 0.00 C ATOM 1077 CD1 LEU A 65 10.533 15.178 -8.181 1.00 0.00 C ATOM 1078 CD2 LEU A 65 12.979 15.529 -7.845 1.00 0.00 C ATOM 0 H LEU A 65 9.690 15.104 -10.679 1.00 0.00 H new ATOM 0 HA LEU A 65 10.801 17.698 -10.531 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.958 14.902 -10.408 1.00 0.00 H new ATOM 0 HB3 LEU A 65 12.980 16.321 -10.299 1.00 0.00 H new ATOM 0 HG LEU A 65 11.536 17.038 -8.315 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.396 15.240 -7.102 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.645 15.562 -8.683 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.690 14.138 -8.467 1.00 0.00 H new ATOM 0 HD21 LEU A 65 12.800 15.572 -6.771 1.00 0.00 H new ATOM 0 HD22 LEU A 65 13.206 14.503 -8.134 1.00 0.00 H new ATOM 0 HD23 LEU A 65 13.822 16.172 -8.098 1.00 0.00 H new ATOM 1267 N PRO A 75 16.834 17.579 -12.988 1.00 0.00 N ATOM 1268 CA PRO A 75 16.925 17.777 -11.536 1.00 0.00 C ATOM 1269 C PRO A 75 18.247 17.274 -10.953 1.00 0.00 C ATOM 1270 O PRO A 75 18.656 17.716 -9.880 1.00 0.00 O ATOM 1271 CB PRO A 75 15.746 16.972 -10.973 1.00 0.00 C ATOM 1272 CG PRO A 75 15.307 16.077 -12.083 1.00 0.00 C ATOM 1273 CD PRO A 75 15.650 16.790 -13.358 1.00 0.00 C ATOM 0 HA PRO A 75 16.889 18.835 -11.278 1.00 0.00 H new ATOM 0 HB2 PRO A 75 16.047 16.394 -10.099 1.00 0.00 H new ATOM 0 HB3 PRO A 75 14.937 17.630 -10.657 1.00 0.00 H new ATOM 0 HG2 PRO A 75 15.812 15.113 -12.028 1.00 0.00 H new ATOM 0 HG3 PRO A 75 14.237 15.880 -12.023 1.00 0.00 H new ATOM 0 HD2 PRO A 75 15.867 16.091 -14.165 1.00 0.00 H new ATOM 0 HD3 PRO A 75 14.832 17.425 -13.698 1.00 0.00 H new ATOM 1281 N SER A 76 18.886 16.346 -11.674 1.00 0.00 N ATOM 1282 CA SER A 76 20.214 15.810 -11.338 1.00 0.00 C ATOM 1283 C SER A 76 20.364 15.447 -9.854 1.00 0.00 C ATOM 1284 O SER A 76 19.992 14.347 -9.442 1.00 0.00 O ATOM 1285 CB SER A 76 21.322 16.776 -11.793 1.00 0.00 C ATOM 1286 OG SER A 76 21.019 18.122 -11.455 1.00 0.00 O ATOM 0 H SER A 76 18.490 15.938 -12.521 1.00 0.00 H new ATOM 0 HA SER A 76 20.319 14.874 -11.886 1.00 0.00 H new ATOM 0 HB2 SER A 76 22.267 16.489 -11.331 1.00 0.00 H new ATOM 0 HB3 SER A 76 21.456 16.693 -12.872 1.00 0.00 H new ATOM 0 HG SER A 76 21.724 18.481 -10.877 1.00 0.00 H new ATOM 1292 N ASN A 77 20.880 16.375 -9.054 1.00 0.00 N ATOM 1293 CA ASN A 77 21.105 16.124 -7.632 1.00 0.00 C ATOM 1294 C ASN A 77 19.781 15.910 -6.908 1.00 0.00 C ATOM 1295 O ASN A 77 19.675 15.066 -6.015 1.00 0.00 O ATOM 1296 CB ASN A 77 21.875 17.288 -6.999 1.00 0.00 C ATOM 1297 CG ASN A 77 22.169 17.073 -5.526 1.00 0.00 C ATOM 1298 OD1 ASN A 77 23.145 16.413 -5.166 1.00 0.00 O ATOM 1299 ND2 ASN A 77 21.345 17.652 -4.667 1.00 0.00 N ATOM 0 H ASN A 77 21.151 17.308 -9.365 1.00 0.00 H new ATOM 0 HA ASN A 77 21.702 15.217 -7.535 1.00 0.00 H new ATOM 0 HB2 ASN A 77 22.814 17.429 -7.534 1.00 0.00 H new ATOM 0 HB3 ASN A 77 21.299 18.205 -7.119 1.00 0.00 H new ATOM 0 HD21 ASN A 77 21.507 17.560 -3.664 1.00 0.00 H new ATOM 0 HD22 ASN A 77 20.548 18.190 -5.008 1.00 0.00 H new ATOM 1306 N ARG A 78 18.764 16.658 -7.317 1.00 0.00 N ATOM 1307 CA ARG A 78 17.442 16.536 -6.719 1.00 0.00 C ATOM 1308 C ARG A 78 16.757 15.276 -7.239 1.00 0.00 C ATOM 1309 O ARG A 78 15.861 14.731 -6.599 1.00 0.00 O ATOM 1310 CB ARG A 78 16.593 17.770 -7.041 1.00 0.00 C ATOM 1311 CG ARG A 78 15.370 17.923 -6.149 1.00 0.00 C ATOM 1312 CD ARG A 78 14.480 19.064 -6.613 1.00 0.00 C ATOM 1313 NE ARG A 78 13.462 19.408 -5.620 1.00 0.00 N ATOM 1314 CZ ARG A 78 12.148 19.376 -5.845 1.00 0.00 C ATOM 1315 NH1 ARG A 78 11.676 18.971 -7.016 1.00 0.00 N ATOM 1316 NH2 ARG A 78 11.303 19.750 -4.891 1.00 0.00 N ATOM 0 H ARG A 78 18.830 17.354 -8.059 1.00 0.00 H new ATOM 0 HA ARG A 78 17.549 16.465 -5.637 1.00 0.00 H new ATOM 0 HB2 ARG A 78 17.214 18.661 -6.947 1.00 0.00 H new ATOM 0 HB3 ARG A 78 16.269 17.715 -8.080 1.00 0.00 H new ATOM 0 HG2 ARG A 78 14.801 16.994 -6.148 1.00 0.00 H new ATOM 0 HG3 ARG A 78 15.688 18.103 -5.122 1.00 0.00 H new ATOM 0 HD2 ARG A 78 15.094 19.940 -6.820 1.00 0.00 H new ATOM 0 HD3 ARG A 78 13.994 18.787 -7.548 1.00 0.00 H new ATOM 0 HE ARG A 78 13.779 19.691 -4.693 1.00 0.00 H new ATOM 0 HH11 ARG A 78 12.319 18.681 -7.752 1.00 0.00 H new ATOM 0 HH12 ARG A 78 10.670 18.949 -7.180 1.00 0.00 H new ATOM 0 HH21 ARG A 78 11.659 20.061 -3.987 1.00 0.00 H new ATOM 0 HH22 ARG A 78 10.298 19.726 -5.062 1.00 0.00 H new ATOM 1330 N GLN A 79 17.204 14.815 -8.400 1.00 0.00 N ATOM 1331 CA GLN A 79 16.657 13.615 -9.019 1.00 0.00 C ATOM 1332 C GLN A 79 17.092 12.383 -8.235 1.00 0.00 C ATOM 1333 O GLN A 79 16.297 11.481 -7.978 1.00 0.00 O ATOM 1334 CB GLN A 79 17.129 13.512 -10.469 1.00 0.00 C ATOM 1335 CG GLN A 79 16.434 12.427 -11.269 1.00 0.00 C ATOM 1336 CD GLN A 79 16.912 12.372 -12.705 1.00 0.00 C ATOM 1337 OE1 GLN A 79 17.336 13.382 -13.269 1.00 0.00 O ATOM 1338 NE2 GLN A 79 16.834 11.197 -13.309 1.00 0.00 N ATOM 0 H GLN A 79 17.950 15.258 -8.936 1.00 0.00 H new ATOM 0 HA GLN A 79 15.569 13.674 -9.009 1.00 0.00 H new ATOM 0 HB2 GLN A 79 16.969 14.471 -10.961 1.00 0.00 H new ATOM 0 HB3 GLN A 79 18.203 13.324 -10.478 1.00 0.00 H new ATOM 0 HG2 GLN A 79 16.608 11.461 -10.794 1.00 0.00 H new ATOM 0 HG3 GLN A 79 15.358 12.601 -11.254 1.00 0.00 H new ATOM 0 HE21 GLN A 79 16.476 10.386 -12.804 1.00 0.00 H new ATOM 0 HE22 GLN A 79 17.132 11.102 -14.280 1.00 0.00 H new ATOM 1347 N VAL A 80 18.360 12.366 -7.850 1.00 0.00 N ATOM 1348 CA VAL A 80 18.892 11.297 -7.014 1.00 0.00 C ATOM 1349 C VAL A 80 18.238 11.356 -5.639 1.00 0.00 C ATOM 1350 O VAL A 80 17.922 10.329 -5.039 1.00 0.00 O ATOM 1351 CB VAL A 80 20.428 11.400 -6.864 1.00 0.00 C ATOM 1352 CG1 VAL A 80 20.970 10.263 -6.010 1.00 0.00 C ATOM 1353 CG2 VAL A 80 21.101 11.409 -8.228 1.00 0.00 C ATOM 0 H VAL A 80 19.041 13.081 -8.103 1.00 0.00 H new ATOM 0 HA VAL A 80 18.667 10.346 -7.497 1.00 0.00 H new ATOM 0 HB VAL A 80 20.654 12.340 -6.361 1.00 0.00 H new ATOM 0 HG11 VAL A 80 22.052 10.359 -5.920 1.00 0.00 H new ATOM 0 HG12 VAL A 80 20.519 10.305 -5.019 1.00 0.00 H new ATOM 0 HG13 VAL A 80 20.728 9.309 -6.478 1.00 0.00 H new ATOM 0 HG21 VAL A 80 22.181 11.482 -8.100 1.00 0.00 H new ATOM 0 HG22 VAL A 80 20.860 10.488 -8.759 1.00 0.00 H new ATOM 0 HG23 VAL A 80 20.745 12.263 -8.804 1.00 0.00 H new ATOM 1363 N LEU A 81 18.013 12.579 -5.171 1.00 0.00 N ATOM 1364 CA LEU A 81 17.340 12.824 -3.900 1.00 0.00 C ATOM 1365 C LEU A 81 15.938 12.209 -3.906 1.00 0.00 C ATOM 1366 O LEU A 81 15.448 11.741 -2.878 1.00 0.00 O ATOM 1367 CB LEU A 81 17.258 14.335 -3.660 1.00 0.00 C ATOM 1368 CG LEU A 81 16.718 14.771 -2.299 1.00 0.00 C ATOM 1369 CD1 LEU A 81 17.650 14.324 -1.184 1.00 0.00 C ATOM 1370 CD2 LEU A 81 16.532 16.280 -2.270 1.00 0.00 C ATOM 0 H LEU A 81 18.292 13.429 -5.662 1.00 0.00 H new ATOM 0 HA LEU A 81 17.909 12.358 -3.096 1.00 0.00 H new ATOM 0 HB2 LEU A 81 18.255 14.757 -3.785 1.00 0.00 H new ATOM 0 HB3 LEU A 81 16.628 14.772 -4.435 1.00 0.00 H new ATOM 0 HG LEU A 81 15.749 14.297 -2.140 1.00 0.00 H new ATOM 0 HD11 LEU A 81 17.247 14.644 -0.223 1.00 0.00 H new ATOM 0 HD12 LEU A 81 17.738 13.238 -1.197 1.00 0.00 H new ATOM 0 HD13 LEU A 81 18.634 14.769 -1.332 1.00 0.00 H new ATOM 0 HD21 LEU A 81 16.147 16.580 -1.296 1.00 0.00 H new ATOM 0 HD22 LEU A 81 17.490 16.768 -2.448 1.00 0.00 H new ATOM 0 HD23 LEU A 81 15.825 16.574 -3.046 1.00 0.00 H new ATOM 1382 N LEU A 82 15.309 12.208 -5.075 1.00 0.00 N ATOM 1383 CA LEU A 82 13.991 11.610 -5.243 1.00 0.00 C ATOM 1384 C LEU A 82 14.091 10.090 -5.125 1.00 0.00 C ATOM 1385 O LEU A 82 13.308 9.463 -4.411 1.00 0.00 O ATOM 1386 CB LEU A 82 13.400 12.027 -6.605 1.00 0.00 C ATOM 1387 CG LEU A 82 11.934 11.643 -6.885 1.00 0.00 C ATOM 1388 CD1 LEU A 82 11.798 10.167 -7.218 1.00 0.00 C ATOM 1389 CD2 LEU A 82 11.043 12.000 -5.706 1.00 0.00 C ATOM 0 H LEU A 82 15.694 12.618 -5.926 1.00 0.00 H new ATOM 0 HA LEU A 82 13.324 11.967 -4.458 1.00 0.00 H new ATOM 0 HB2 LEU A 82 13.488 13.110 -6.694 1.00 0.00 H new ATOM 0 HB3 LEU A 82 14.019 11.591 -7.389 1.00 0.00 H new ATOM 0 HG LEU A 82 11.610 12.217 -7.753 1.00 0.00 H new ATOM 0 HD11 LEU A 82 10.751 9.932 -7.410 1.00 0.00 H new ATOM 0 HD12 LEU A 82 12.389 9.938 -8.105 1.00 0.00 H new ATOM 0 HD13 LEU A 82 12.156 9.570 -6.379 1.00 0.00 H new ATOM 0 HD21 LEU A 82 10.014 11.719 -5.929 1.00 0.00 H new ATOM 0 HD22 LEU A 82 11.381 11.464 -4.819 1.00 0.00 H new ATOM 0 HD23 LEU A 82 11.094 13.073 -5.523 1.00 0.00 H new ATOM 1401 N GLN A 83 15.070 9.507 -5.814 1.00 0.00 N ATOM 1402 CA GLN A 83 15.270 8.060 -5.796 1.00 0.00 C ATOM 1403 C GLN A 83 15.481 7.551 -4.373 1.00 0.00 C ATOM 1404 O GLN A 83 15.040 6.458 -4.021 1.00 0.00 O ATOM 1405 CB GLN A 83 16.476 7.664 -6.650 1.00 0.00 C ATOM 1406 CG GLN A 83 16.796 6.180 -6.564 1.00 0.00 C ATOM 1407 CD GLN A 83 18.191 5.837 -7.038 1.00 0.00 C ATOM 1408 OE1 GLN A 83 18.735 6.471 -7.946 1.00 0.00 O ATOM 1409 NE2 GLN A 83 18.792 4.848 -6.397 1.00 0.00 N ATOM 0 H GLN A 83 15.738 10.016 -6.393 1.00 0.00 H new ATOM 0 HA GLN A 83 14.369 7.606 -6.209 1.00 0.00 H new ATOM 0 HB2 GLN A 83 16.283 7.930 -7.689 1.00 0.00 H new ATOM 0 HB3 GLN A 83 17.346 8.238 -6.331 1.00 0.00 H new ATOM 0 HG2 GLN A 83 16.680 5.850 -5.532 1.00 0.00 H new ATOM 0 HG3 GLN A 83 16.071 5.625 -7.159 1.00 0.00 H new ATOM 0 HE21 GLN A 83 18.303 4.351 -5.652 1.00 0.00 H new ATOM 0 HE22 GLN A 83 19.744 4.582 -6.648 1.00 0.00 H new ATOM 1418 N GLN A 84 16.144 8.356 -3.557 1.00 0.00 N ATOM 1419 CA GLN A 84 16.466 7.971 -2.189 1.00 0.00 C ATOM 1420 C GLN A 84 15.210 7.654 -1.380 1.00 0.00 C ATOM 1421 O GLN A 84 15.282 6.951 -0.369 1.00 0.00 O ATOM 1422 CB GLN A 84 17.278 9.069 -1.509 1.00 0.00 C ATOM 1423 CG GLN A 84 18.627 9.301 -2.170 1.00 0.00 C ATOM 1424 CD GLN A 84 19.444 10.384 -1.497 1.00 0.00 C ATOM 1425 OE1 GLN A 84 18.904 11.324 -0.919 1.00 0.00 O ATOM 1426 NE2 GLN A 84 20.759 10.259 -1.578 1.00 0.00 N ATOM 0 H GLN A 84 16.472 9.286 -3.819 1.00 0.00 H new ATOM 0 HA GLN A 84 17.065 7.061 -2.232 1.00 0.00 H new ATOM 0 HB2 GLN A 84 16.707 9.998 -1.523 1.00 0.00 H new ATOM 0 HB3 GLN A 84 17.432 8.805 -0.463 1.00 0.00 H new ATOM 0 HG2 GLN A 84 19.193 8.370 -2.161 1.00 0.00 H new ATOM 0 HG3 GLN A 84 18.471 9.569 -3.215 1.00 0.00 H new ATOM 0 HE21 GLN A 84 21.166 9.462 -2.068 1.00 0.00 H new ATOM 0 HE22 GLN A 84 21.365 10.959 -1.151 1.00 0.00 H new ATOM 1435 N ARG A 85 14.059 8.157 -1.828 1.00 0.00 N ATOM 1436 CA ARG A 85 12.794 7.825 -1.185 1.00 0.00 C ATOM 1437 C ARG A 85 12.527 6.334 -1.311 1.00 0.00 C ATOM 1438 O ARG A 85 12.260 5.659 -0.319 1.00 0.00 O ATOM 1439 CB ARG A 85 11.614 8.574 -1.804 1.00 0.00 C ATOM 1440 CG ARG A 85 11.732 10.087 -1.793 1.00 0.00 C ATOM 1441 CD ARG A 85 10.401 10.729 -2.155 1.00 0.00 C ATOM 1442 NE ARG A 85 9.723 10.009 -3.238 1.00 0.00 N ATOM 1443 CZ ARG A 85 8.430 10.146 -3.541 1.00 0.00 C ATOM 1444 NH1 ARG A 85 7.672 11.024 -2.897 1.00 0.00 N ATOM 1445 NH2 ARG A 85 7.898 9.403 -4.497 1.00 0.00 N ATOM 0 H ARG A 85 13.980 8.789 -2.625 1.00 0.00 H new ATOM 0 HA ARG A 85 12.884 8.121 -0.140 1.00 0.00 H new ATOM 0 HB2 ARG A 85 11.494 8.242 -2.835 1.00 0.00 H new ATOM 0 HB3 ARG A 85 10.706 8.292 -1.271 1.00 0.00 H new ATOM 0 HG2 ARG A 85 12.049 10.426 -0.807 1.00 0.00 H new ATOM 0 HG3 ARG A 85 12.499 10.403 -2.500 1.00 0.00 H new ATOM 0 HD2 ARG A 85 9.758 10.751 -1.275 1.00 0.00 H new ATOM 0 HD3 ARG A 85 10.567 11.764 -2.455 1.00 0.00 H new ATOM 0 HE ARG A 85 10.277 9.360 -3.797 1.00 0.00 H new ATOM 0 HH11 ARG A 85 8.076 11.604 -2.161 1.00 0.00 H new ATOM 0 HH12 ARG A 85 6.685 11.119 -3.138 1.00 0.00 H new ATOM 0 HH21 ARG A 85 8.475 8.729 -5.000 1.00 0.00 H new ATOM 0 HH22 ARG A 85 6.911 9.504 -4.732 1.00 0.00 H new ATOM 1459 N ARG A 86 12.626 5.820 -2.536 1.00 0.00 N ATOM 1460 CA ARG A 86 12.295 4.426 -2.796 1.00 0.00 C ATOM 1461 C ARG A 86 13.330 3.509 -2.157 1.00 0.00 C ATOM 1462 O ARG A 86 12.992 2.436 -1.680 1.00 0.00 O ATOM 1463 CB ARG A 86 12.158 4.135 -4.303 1.00 0.00 C ATOM 1464 CG ARG A 86 13.461 4.191 -5.087 1.00 0.00 C ATOM 1465 CD ARG A 86 13.259 3.803 -6.547 1.00 0.00 C ATOM 1466 NE ARG A 86 12.416 4.756 -7.269 1.00 0.00 N ATOM 1467 CZ ARG A 86 11.946 4.560 -8.501 1.00 0.00 C ATOM 1468 NH1 ARG A 86 12.192 3.431 -9.153 1.00 0.00 N ATOM 1469 NH2 ARG A 86 11.214 5.498 -9.077 1.00 0.00 N ATOM 0 H ARG A 86 12.930 6.345 -3.356 1.00 0.00 H new ATOM 0 HA ARG A 86 11.323 4.228 -2.344 1.00 0.00 H new ATOM 0 HB2 ARG A 86 11.717 3.146 -4.429 1.00 0.00 H new ATOM 0 HB3 ARG A 86 11.460 4.852 -4.735 1.00 0.00 H new ATOM 0 HG2 ARG A 86 13.875 5.198 -5.032 1.00 0.00 H new ATOM 0 HG3 ARG A 86 14.189 3.521 -4.630 1.00 0.00 H new ATOM 0 HD2 ARG A 86 14.229 3.736 -7.039 1.00 0.00 H new ATOM 0 HD3 ARG A 86 12.807 2.812 -6.597 1.00 0.00 H new ATOM 0 HE ARG A 86 12.172 5.628 -6.799 1.00 0.00 H new ATOM 0 HH11 ARG A 86 12.748 2.698 -8.712 1.00 0.00 H new ATOM 0 HH12 ARG A 86 11.825 3.296 -10.095 1.00 0.00 H new ATOM 0 HH21 ARG A 86 11.012 6.365 -8.579 1.00 0.00 H new ATOM 0 HH22 ARG A 86 10.851 5.355 -10.019 1.00 0.00 H new ATOM 1483 N ASP A 87 14.585 3.952 -2.127 1.00 0.00 N ATOM 1484 CA ASP A 87 15.646 3.204 -1.452 1.00 0.00 C ATOM 1485 C ASP A 87 15.322 3.033 0.028 1.00 0.00 C ATOM 1486 O ASP A 87 15.266 1.914 0.542 1.00 0.00 O ATOM 1487 CB ASP A 87 16.995 3.915 -1.602 1.00 0.00 C ATOM 1488 CG ASP A 87 17.745 3.510 -2.854 1.00 0.00 C ATOM 1489 OD1 ASP A 87 17.542 4.141 -3.911 1.00 0.00 O ATOM 1490 OD2 ASP A 87 18.567 2.568 -2.779 1.00 0.00 O ATOM 0 H ASP A 87 14.893 4.822 -2.561 1.00 0.00 H new ATOM 0 HA ASP A 87 15.711 2.222 -1.920 1.00 0.00 H new ATOM 0 HB2 ASP A 87 16.831 4.993 -1.617 1.00 0.00 H new ATOM 0 HB3 ASP A 87 17.612 3.698 -0.730 1.00 0.00 H new ATOM 1495 N GLN A 88 15.086 4.155 0.697 1.00 0.00 N ATOM 1496 CA GLN A 88 14.754 4.161 2.118 1.00 0.00 C ATOM 1497 C GLN A 88 13.455 3.401 2.380 1.00 0.00 C ATOM 1498 O GLN A 88 13.348 2.630 3.343 1.00 0.00 O ATOM 1499 CB GLN A 88 14.627 5.609 2.609 1.00 0.00 C ATOM 1500 CG GLN A 88 14.093 5.753 4.028 1.00 0.00 C ATOM 1501 CD GLN A 88 15.051 5.246 5.088 1.00 0.00 C ATOM 1502 OE1 GLN A 88 15.887 5.994 5.594 1.00 0.00 O ATOM 1503 NE2 GLN A 88 14.930 3.976 5.437 1.00 0.00 N ATOM 0 H GLN A 88 15.119 5.082 0.273 1.00 0.00 H new ATOM 0 HA GLN A 88 15.553 3.660 2.664 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.606 6.085 2.553 1.00 0.00 H new ATOM 0 HB3 GLN A 88 13.969 6.152 1.931 1.00 0.00 H new ATOM 0 HG2 GLN A 88 13.873 6.803 4.220 1.00 0.00 H new ATOM 0 HG3 GLN A 88 13.152 5.210 4.110 1.00 0.00 H new ATOM 0 HE21 GLN A 88 14.223 3.390 4.992 1.00 0.00 H new ATOM 0 HE22 GLN A 88 15.543 3.583 6.151 1.00 0.00 H new ATOM 1512 N GLU A 89 12.470 3.610 1.524 1.00 0.00 N ATOM 1513 CA GLU A 89 11.171 2.998 1.717 1.00 0.00 C ATOM 1514 C GLU A 89 11.245 1.491 1.477 1.00 0.00 C ATOM 1515 O GLU A 89 10.605 0.721 2.184 1.00 0.00 O ATOM 1516 CB GLU A 89 10.122 3.646 0.814 1.00 0.00 C ATOM 1517 CG GLU A 89 8.727 3.637 1.418 1.00 0.00 C ATOM 1518 CD GLU A 89 8.639 4.442 2.705 1.00 0.00 C ATOM 1519 OE1 GLU A 89 9.314 4.080 3.690 1.00 0.00 O ATOM 1520 OE2 GLU A 89 7.877 5.433 2.745 1.00 0.00 O ATOM 0 H GLU A 89 12.546 4.196 0.693 1.00 0.00 H new ATOM 0 HA GLU A 89 10.868 3.162 2.751 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.415 4.675 0.607 1.00 0.00 H new ATOM 0 HB3 GLU A 89 10.101 3.123 -0.142 1.00 0.00 H new ATOM 0 HG2 GLU A 89 8.019 4.040 0.693 1.00 0.00 H new ATOM 0 HG3 GLU A 89 8.428 2.608 1.617 1.00 0.00 H new ATOM 1527 N LEU A 90 12.046 1.069 0.500 1.00 0.00 N ATOM 1528 CA LEU A 90 12.257 -0.356 0.264 1.00 0.00 C ATOM 1529 C LEU A 90 12.902 -1.000 1.482 1.00 0.00 C ATOM 1530 O LEU A 90 12.594 -2.140 1.825 1.00 0.00 O ATOM 1531 CB LEU A 90 13.121 -0.603 -0.976 1.00 0.00 C ATOM 1532 CG LEU A 90 12.419 -0.383 -2.319 1.00 0.00 C ATOM 1533 CD1 LEU A 90 13.392 -0.590 -3.469 1.00 0.00 C ATOM 1534 CD2 LEU A 90 11.226 -1.317 -2.456 1.00 0.00 C ATOM 0 H LEU A 90 12.554 1.686 -0.134 1.00 0.00 H new ATOM 0 HA LEU A 90 11.281 -0.809 0.088 1.00 0.00 H new ATOM 0 HB2 LEU A 90 13.991 0.052 -0.928 1.00 0.00 H new ATOM 0 HB3 LEU A 90 13.491 -1.628 -0.942 1.00 0.00 H new ATOM 0 HG LEU A 90 12.058 0.645 -2.354 1.00 0.00 H new ATOM 0 HD11 LEU A 90 12.876 -0.430 -4.416 1.00 0.00 H new ATOM 0 HD12 LEU A 90 14.216 0.118 -3.380 1.00 0.00 H new ATOM 0 HD13 LEU A 90 13.783 -1.607 -3.437 1.00 0.00 H new ATOM 0 HD21 LEU A 90 10.739 -1.147 -3.416 1.00 0.00 H new ATOM 0 HD22 LEU A 90 11.565 -2.351 -2.399 1.00 0.00 H new ATOM 0 HD23 LEU A 90 10.518 -1.123 -1.651 1.00 0.00 H new ATOM 1546 N LYS A 91 13.779 -0.254 2.145 1.00 0.00 N ATOM 1547 CA LYS A 91 14.405 -0.724 3.372 1.00 0.00 C ATOM 1548 C LYS A 91 13.339 -0.952 4.447 1.00 0.00 C ATOM 1549 O LYS A 91 13.487 -1.816 5.313 1.00 0.00 O ATOM 1550 CB LYS A 91 15.454 0.288 3.845 1.00 0.00 C ATOM 1551 CG LYS A 91 16.206 -0.138 5.093 1.00 0.00 C ATOM 1552 CD LYS A 91 17.338 0.824 5.413 1.00 0.00 C ATOM 1553 CE LYS A 91 18.054 0.428 6.693 1.00 0.00 C ATOM 1554 NZ LYS A 91 19.216 1.310 6.979 1.00 0.00 N ATOM 0 H LYS A 91 14.071 0.678 1.852 1.00 0.00 H new ATOM 0 HA LYS A 91 14.907 -1.672 3.181 1.00 0.00 H new ATOM 0 HB2 LYS A 91 16.171 0.455 3.041 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.963 1.242 4.037 1.00 0.00 H new ATOM 0 HG2 LYS A 91 15.517 -0.185 5.936 1.00 0.00 H new ATOM 0 HG3 LYS A 91 16.608 -1.142 4.953 1.00 0.00 H new ATOM 0 HD2 LYS A 91 18.049 0.841 4.587 1.00 0.00 H new ATOM 0 HD3 LYS A 91 16.942 1.835 5.513 1.00 0.00 H new ATOM 0 HE2 LYS A 91 17.354 0.469 7.527 1.00 0.00 H new ATOM 0 HE3 LYS A 91 18.394 -0.605 6.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 19.675 1.004 7.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 19.897 1.252 6.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 18.890 2.292 7.081 1.00 0.00 H new ATOM 1568 N GLU A 92 12.264 -0.173 4.374 1.00 0.00 N ATOM 1569 CA GLU A 92 11.110 -0.364 5.251 1.00 0.00 C ATOM 1570 C GLU A 92 10.351 -1.644 4.883 1.00 0.00 C ATOM 1571 O GLU A 92 10.059 -2.469 5.749 1.00 0.00 O ATOM 1572 CB GLU A 92 10.177 0.850 5.171 1.00 0.00 C ATOM 1573 CG GLU A 92 8.947 0.753 6.061 1.00 0.00 C ATOM 1574 CD GLU A 92 8.154 2.045 6.101 1.00 0.00 C ATOM 1575 OE1 GLU A 92 8.532 2.949 6.879 1.00 0.00 O ATOM 1576 OE2 GLU A 92 7.148 2.165 5.367 1.00 0.00 O ATOM 0 H GLU A 92 12.167 0.599 3.715 1.00 0.00 H new ATOM 0 HA GLU A 92 11.471 -0.464 6.275 1.00 0.00 H new ATOM 0 HB2 GLU A 92 10.738 1.744 5.443 1.00 0.00 H new ATOM 0 HB3 GLU A 92 9.854 0.978 4.138 1.00 0.00 H new ATOM 0 HG2 GLU A 92 8.306 -0.052 5.702 1.00 0.00 H new ATOM 0 HG3 GLU A 92 9.255 0.488 7.073 1.00 0.00 H new ATOM 1583 N PHE A 93 10.050 -1.808 3.594 1.00 0.00 N ATOM 1584 CA PHE A 93 9.316 -2.984 3.111 1.00 0.00 C ATOM 1585 C PHE A 93 10.048 -4.279 3.456 1.00 0.00 C ATOM 1586 O PHE A 93 9.433 -5.264 3.867 1.00 0.00 O ATOM 1587 CB PHE A 93 9.106 -2.914 1.592 1.00 0.00 C ATOM 1588 CG PHE A 93 8.194 -1.808 1.141 1.00 0.00 C ATOM 1589 CD1 PHE A 93 6.826 -1.903 1.322 1.00 0.00 C ATOM 1590 CD2 PHE A 93 8.704 -0.679 0.528 1.00 0.00 C ATOM 1591 CE1 PHE A 93 5.986 -0.891 0.902 1.00 0.00 C ATOM 1592 CE2 PHE A 93 7.870 0.338 0.106 1.00 0.00 C ATOM 1593 CZ PHE A 93 6.507 0.231 0.294 1.00 0.00 C ATOM 0 H PHE A 93 10.302 -1.142 2.864 1.00 0.00 H new ATOM 0 HA PHE A 93 8.347 -2.982 3.611 1.00 0.00 H new ATOM 0 HB2 PHE A 93 10.075 -2.789 1.109 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.700 -3.866 1.250 1.00 0.00 H new ATOM 0 HD1 PHE A 93 6.410 -2.779 1.797 1.00 0.00 H new ATOM 0 HD2 PHE A 93 9.770 -0.591 0.377 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.920 -0.979 1.050 1.00 0.00 H new ATOM 0 HE2 PHE A 93 8.284 1.215 -0.370 1.00 0.00 H new ATOM 0 HZ PHE A 93 5.851 1.024 -0.034 1.00 0.00 H new ATOM 1603 N LYS A 94 11.366 -4.263 3.298 1.00 0.00 N ATOM 1604 CA LYS A 94 12.189 -5.449 3.517 1.00 0.00 C ATOM 1605 C LYS A 94 12.352 -5.758 5.006 1.00 0.00 C ATOM 1606 O LYS A 94 12.883 -6.806 5.373 1.00 0.00 O ATOM 1607 CB LYS A 94 13.566 -5.254 2.875 1.00 0.00 C ATOM 1608 CG LYS A 94 13.512 -5.045 1.370 1.00 0.00 C ATOM 1609 CD LYS A 94 14.857 -4.595 0.821 1.00 0.00 C ATOM 1610 CE LYS A 94 14.775 -4.284 -0.664 1.00 0.00 C ATOM 1611 NZ LYS A 94 16.045 -3.716 -1.184 1.00 0.00 N ATOM 0 H LYS A 94 11.892 -3.436 3.017 1.00 0.00 H new ATOM 0 HA LYS A 94 11.682 -6.295 3.053 1.00 0.00 H new ATOM 0 HB2 LYS A 94 14.054 -4.395 3.335 1.00 0.00 H new ATOM 0 HB3 LYS A 94 14.185 -6.125 3.090 1.00 0.00 H new ATOM 0 HG2 LYS A 94 13.211 -5.973 0.883 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.753 -4.300 1.132 1.00 0.00 H new ATOM 0 HD2 LYS A 94 15.194 -3.710 1.361 1.00 0.00 H new ATOM 0 HD3 LYS A 94 15.600 -5.375 0.990 1.00 0.00 H new ATOM 0 HE2 LYS A 94 14.534 -5.195 -1.212 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.963 -3.580 -0.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 15.946 -3.518 -2.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 16.263 -2.833 -0.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 16.816 -4.398 -1.037 1.00 0.00 H new ATOM 1625 N ALA A 95 11.888 -4.850 5.855 1.00 0.00 N ATOM 1626 CA ALA A 95 12.028 -5.012 7.297 1.00 0.00 C ATOM 1627 C ALA A 95 10.721 -5.482 7.930 1.00 0.00 C ATOM 1628 O ALA A 95 10.633 -5.650 9.147 1.00 0.00 O ATOM 1629 CB ALA A 95 12.477 -3.703 7.928 1.00 0.00 C ATOM 0 H ALA A 95 11.412 -3.994 5.571 1.00 0.00 H new ATOM 0 HA ALA A 95 12.784 -5.776 7.481 1.00 0.00 H new ATOM 0 HB1 ALA A 95 12.579 -3.834 9.005 1.00 0.00 H new ATOM 0 HB2 ALA A 95 13.437 -3.406 7.506 1.00 0.00 H new ATOM 0 HB3 ALA A 95 11.737 -2.929 7.725 1.00 0.00 H new ATOM 1635 N GLY A 96 9.711 -5.705 7.101 1.00 0.00 N ATOM 1636 CA GLY A 96 8.412 -6.087 7.612 1.00 0.00 C ATOM 1637 C GLY A 96 7.441 -4.929 7.571 1.00 0.00 C ATOM 1638 O GLY A 96 7.220 -4.251 8.575 1.00 0.00 O ATOM 0 H GLY A 96 9.768 -5.628 6.086 1.00 0.00 H new ATOM 0 HA2 GLY A 96 8.017 -6.916 7.024 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.513 -6.443 8.637 1.00 0.00 H new ATOM 1642 N PHE A 97 6.860 -4.709 6.406 1.00 0.00 N ATOM 1643 CA PHE A 97 5.999 -3.565 6.175 1.00 0.00 C ATOM 1644 C PHE A 97 4.637 -3.764 6.835 1.00 0.00 C ATOM 1645 O PHE A 97 4.008 -4.807 6.670 1.00 0.00 O ATOM 1646 CB PHE A 97 5.842 -3.358 4.670 1.00 0.00 C ATOM 1647 CG PHE A 97 5.095 -2.117 4.298 1.00 0.00 C ATOM 1648 CD1 PHE A 97 5.525 -0.878 4.738 1.00 0.00 C ATOM 1649 CD2 PHE A 97 3.969 -2.190 3.497 1.00 0.00 C ATOM 1650 CE1 PHE A 97 4.845 0.266 4.387 1.00 0.00 C ATOM 1651 CE2 PHE A 97 3.288 -1.049 3.139 1.00 0.00 C ATOM 1652 CZ PHE A 97 3.725 0.183 3.585 1.00 0.00 C ATOM 0 H PHE A 97 6.972 -5.317 5.595 1.00 0.00 H new ATOM 0 HA PHE A 97 6.453 -2.679 6.620 1.00 0.00 H new ATOM 0 HB2 PHE A 97 6.831 -3.324 4.214 1.00 0.00 H new ATOM 0 HB3 PHE A 97 5.326 -4.220 4.248 1.00 0.00 H new ATOM 0 HD1 PHE A 97 6.403 -0.808 5.363 1.00 0.00 H new ATOM 0 HD2 PHE A 97 3.621 -3.152 3.149 1.00 0.00 H new ATOM 0 HE1 PHE A 97 5.188 1.228 4.739 1.00 0.00 H new ATOM 0 HE2 PHE A 97 2.413 -1.117 2.510 1.00 0.00 H new ATOM 0 HZ PHE A 97 3.191 1.080 3.307 1.00 0.00 H new ATOM 1662 N LEU A 98 4.190 -2.765 7.589 1.00 0.00 N ATOM 1663 CA LEU A 98 2.901 -2.834 8.266 1.00 0.00 C ATOM 1664 C LEU A 98 1.767 -2.767 7.250 1.00 0.00 C ATOM 1665 O LEU A 98 1.399 -1.690 6.777 1.00 0.00 O ATOM 1666 CB LEU A 98 2.762 -1.701 9.286 1.00 0.00 C ATOM 1667 CG LEU A 98 1.521 -1.781 10.183 1.00 0.00 C ATOM 1668 CD1 LEU A 98 1.585 -3.014 11.070 1.00 0.00 C ATOM 1669 CD2 LEU A 98 1.392 -0.522 11.027 1.00 0.00 C ATOM 0 H LEU A 98 4.702 -1.897 7.746 1.00 0.00 H new ATOM 0 HA LEU A 98 2.844 -3.784 8.797 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.649 -1.693 9.919 1.00 0.00 H new ATOM 0 HB3 LEU A 98 2.744 -0.752 8.751 1.00 0.00 H new ATOM 0 HG LEU A 98 0.639 -1.860 9.547 1.00 0.00 H new ATOM 0 HD11 LEU A 98 0.697 -3.055 11.700 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.631 -3.908 10.448 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.474 -2.964 11.699 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.506 -0.596 11.658 1.00 0.00 H new ATOM 0 HD22 LEU A 98 2.276 -0.413 11.655 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.301 0.346 10.374 1.00 0.00 H new ATOM 1681 N CYS A 99 1.230 -3.922 6.910 1.00 0.00 N ATOM 1682 CA CYS A 99 0.189 -4.016 5.906 1.00 0.00 C ATOM 1683 C CYS A 99 -0.991 -4.800 6.466 1.00 0.00 C ATOM 1684 O CYS A 99 -0.807 -5.720 7.265 1.00 0.00 O ATOM 1685 CB CYS A 99 0.747 -4.696 4.649 1.00 0.00 C ATOM 1686 SG CYS A 99 -0.361 -4.669 3.220 1.00 0.00 S ATOM 0 H CYS A 99 1.501 -4.816 7.319 1.00 0.00 H new ATOM 0 HA CYS A 99 -0.155 -3.017 5.636 1.00 0.00 H new ATOM 0 HB2 CYS A 99 1.683 -4.210 4.375 1.00 0.00 H new ATOM 0 HB3 CYS A 99 0.984 -5.733 4.888 1.00 0.00 H new ATOM 0 HG CYS A 99 0.342 -4.653 2.126 1.00 0.00 H new ATOM 1692 N PRO A 100 -2.221 -4.433 6.087 1.00 0.00 N ATOM 1693 CA PRO A 100 -3.409 -5.174 6.498 1.00 0.00 C ATOM 1694 C PRO A 100 -3.479 -6.520 5.791 1.00 0.00 C ATOM 1695 O PRO A 100 -3.248 -6.601 4.580 1.00 0.00 O ATOM 1696 CB PRO A 100 -4.569 -4.270 6.066 1.00 0.00 C ATOM 1697 CG PRO A 100 -4.022 -3.438 4.957 1.00 0.00 C ATOM 1698 CD PRO A 100 -2.549 -3.280 5.224 1.00 0.00 C ATOM 0 HA PRO A 100 -3.421 -5.395 7.565 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -5.424 -4.858 5.733 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -4.913 -3.648 6.893 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -4.192 -3.917 3.993 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -4.516 -2.467 4.921 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.971 -3.295 4.300 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -2.332 -2.334 5.720 1.00 0.00 H new ATOM 1706 N ASP A 101 -3.767 -7.578 6.538 1.00 0.00 N ATOM 1707 CA ASP A 101 -3.857 -8.901 5.939 1.00 0.00 C ATOM 1708 C ASP A 101 -5.116 -8.998 5.093 1.00 0.00 C ATOM 1709 O ASP A 101 -6.228 -9.095 5.616 1.00 0.00 O ATOM 1710 CB ASP A 101 -3.845 -10.006 6.996 1.00 0.00 C ATOM 1711 CG ASP A 101 -3.766 -11.384 6.365 1.00 0.00 C ATOM 1712 OD1 ASP A 101 -2.674 -11.765 5.896 1.00 0.00 O ATOM 1713 OD2 ASP A 101 -4.794 -12.093 6.328 1.00 0.00 O ATOM 0 H ASP A 101 -3.940 -7.547 7.543 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.980 -9.043 5.307 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -2.996 -9.862 7.664 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -4.745 -9.936 7.606 1.00 0.00 H new ATOM 1718 N LEU A 102 -4.937 -8.938 3.782 1.00 0.00 N ATOM 1719 CA LEU A 102 -6.057 -8.956 2.852 1.00 0.00 C ATOM 1720 C LEU A 102 -6.810 -10.274 2.909 1.00 0.00 C ATOM 1721 O LEU A 102 -7.992 -10.328 2.584 1.00 0.00 O ATOM 1722 CB LEU A 102 -5.576 -8.716 1.423 1.00 0.00 C ATOM 1723 CG LEU A 102 -4.929 -7.359 1.160 1.00 0.00 C ATOM 1724 CD1 LEU A 102 -4.599 -7.230 -0.315 1.00 0.00 C ATOM 1725 CD2 LEU A 102 -5.847 -6.229 1.604 1.00 0.00 C ATOM 0 H LEU A 102 -4.022 -8.876 3.336 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.733 -8.154 3.150 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -4.859 -9.495 1.165 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -6.426 -8.829 0.750 1.00 0.00 H new ATOM 0 HG LEU A 102 -4.008 -7.289 1.738 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -4.137 -6.260 -0.501 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -3.909 -8.022 -0.604 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -5.514 -7.314 -0.901 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -5.366 -5.271 1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -6.785 -6.284 1.052 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -6.048 -6.322 2.671 1.00 0.00 H new ATOM 1737 N SER A 103 -6.124 -11.327 3.335 1.00 0.00 N ATOM 1738 CA SER A 103 -6.707 -12.656 3.360 1.00 0.00 C ATOM 1739 C SER A 103 -7.585 -12.856 4.592 1.00 0.00 C ATOM 1740 O SER A 103 -8.205 -13.909 4.766 1.00 0.00 O ATOM 1741 CB SER A 103 -5.598 -13.708 3.297 1.00 0.00 C ATOM 1742 OG SER A 103 -4.423 -13.256 3.953 1.00 0.00 O ATOM 0 H SER A 103 -5.161 -11.283 3.668 1.00 0.00 H new ATOM 0 HA SER A 103 -7.350 -12.769 2.487 1.00 0.00 H new ATOM 0 HB2 SER A 103 -5.943 -14.632 3.760 1.00 0.00 H new ATOM 0 HB3 SER A 103 -5.371 -13.939 2.256 1.00 0.00 H new ATOM 0 HG SER A 103 -4.595 -13.176 4.914 1.00 0.00 H new ATOM 1748 N ASP A 104 -7.642 -11.839 5.442 1.00 0.00 N ATOM 1749 CA ASP A 104 -8.492 -11.882 6.617 1.00 0.00 C ATOM 1750 C ASP A 104 -9.819 -11.195 6.321 1.00 0.00 C ATOM 1751 O ASP A 104 -9.852 -10.025 5.933 1.00 0.00 O ATOM 1752 CB ASP A 104 -7.807 -11.213 7.808 1.00 0.00 C ATOM 1753 CG ASP A 104 -8.559 -11.449 9.098 1.00 0.00 C ATOM 1754 OD1 ASP A 104 -9.534 -10.721 9.369 1.00 0.00 O ATOM 1755 OD2 ASP A 104 -8.186 -12.377 9.845 1.00 0.00 O ATOM 0 H ASP A 104 -7.109 -10.976 5.337 1.00 0.00 H new ATOM 0 HA ASP A 104 -8.677 -12.925 6.872 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -6.791 -11.597 7.905 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -7.727 -10.141 7.626 1.00 0.00 H new ATOM 1760 N ALA A 105 -10.911 -11.921 6.511 1.00 0.00 N ATOM 1761 CA ALA A 105 -12.232 -11.431 6.139 1.00 0.00 C ATOM 1762 C ALA A 105 -12.727 -10.354 7.098 1.00 0.00 C ATOM 1763 O ALA A 105 -13.398 -9.405 6.685 1.00 0.00 O ATOM 1764 CB ALA A 105 -13.221 -12.584 6.075 1.00 0.00 C ATOM 0 H ALA A 105 -10.909 -12.855 6.922 1.00 0.00 H new ATOM 0 HA ALA A 105 -12.152 -10.976 5.152 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -14.204 -12.205 5.796 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -12.887 -13.309 5.332 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -13.281 -13.066 7.051 1.00 0.00 H new ATOM 1770 N LYS A 106 -12.405 -10.499 8.378 1.00 0.00 N ATOM 1771 CA LYS A 106 -12.797 -9.507 9.371 1.00 0.00 C ATOM 1772 C LYS A 106 -12.033 -8.214 9.138 1.00 0.00 C ATOM 1773 O LYS A 106 -12.606 -7.125 9.182 1.00 0.00 O ATOM 1774 CB LYS A 106 -12.556 -10.027 10.790 1.00 0.00 C ATOM 1775 CG LYS A 106 -13.465 -11.186 11.164 1.00 0.00 C ATOM 1776 CD LYS A 106 -13.187 -11.692 12.570 1.00 0.00 C ATOM 1777 CE LYS A 106 -14.111 -12.844 12.927 1.00 0.00 C ATOM 1778 NZ LYS A 106 -13.812 -13.412 14.269 1.00 0.00 N ATOM 0 H LYS A 106 -11.877 -11.288 8.751 1.00 0.00 H new ATOM 0 HA LYS A 106 -13.864 -9.312 9.265 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -11.517 -10.344 10.883 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -12.706 -9.213 11.499 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -14.506 -10.870 11.091 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -13.328 -11.999 10.452 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -12.149 -12.017 12.645 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -13.319 -10.880 13.285 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -15.145 -12.499 12.903 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -14.019 -13.627 12.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -14.467 -14.194 14.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -12.834 -13.766 14.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -13.925 -12.673 14.992 1.00 0.00 H new ATOM 1792 N ASN A 107 -10.742 -8.346 8.867 1.00 0.00 N ATOM 1793 CA ASN A 107 -9.911 -7.198 8.534 1.00 0.00 C ATOM 1794 C ASN A 107 -10.435 -6.498 7.285 1.00 0.00 C ATOM 1795 O ASN A 107 -10.551 -5.274 7.258 1.00 0.00 O ATOM 1796 CB ASN A 107 -8.453 -7.623 8.327 1.00 0.00 C ATOM 1797 CG ASN A 107 -7.583 -6.488 7.814 1.00 0.00 C ATOM 1798 OD1 ASN A 107 -7.100 -5.664 8.588 1.00 0.00 O ATOM 1799 ND2 ASN A 107 -7.354 -6.456 6.509 1.00 0.00 N ATOM 0 H ASN A 107 -10.247 -9.238 8.871 1.00 0.00 H new ATOM 0 HA ASN A 107 -9.953 -6.499 9.370 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -8.047 -7.990 9.270 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.417 -8.452 7.621 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.758 -5.729 6.113 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -7.774 -7.159 5.900 1.00 0.00 H new ATOM 1806 N MET A 108 -10.769 -7.279 6.261 1.00 0.00 N ATOM 1807 CA MET A 108 -11.272 -6.721 5.010 1.00 0.00 C ATOM 1808 C MET A 108 -12.600 -5.987 5.212 1.00 0.00 C ATOM 1809 O MET A 108 -12.853 -4.974 4.566 1.00 0.00 O ATOM 1810 CB MET A 108 -11.429 -7.816 3.953 1.00 0.00 C ATOM 1811 CG MET A 108 -12.018 -7.315 2.641 1.00 0.00 C ATOM 1812 SD MET A 108 -11.070 -5.963 1.909 1.00 0.00 S ATOM 1813 CE MET A 108 -9.529 -6.782 1.516 1.00 0.00 C ATOM 0 H MET A 108 -10.701 -8.297 6.273 1.00 0.00 H new ATOM 0 HA MET A 108 -10.538 -5.995 4.660 1.00 0.00 H new ATOM 0 HB2 MET A 108 -10.454 -8.263 3.757 1.00 0.00 H new ATOM 0 HB3 MET A 108 -12.067 -8.605 4.351 1.00 0.00 H new ATOM 0 HG2 MET A 108 -12.067 -8.142 1.932 1.00 0.00 H new ATOM 0 HG3 MET A 108 -13.041 -6.982 2.813 1.00 0.00 H new ATOM 0 HE1 MET A 108 -9.078 -6.309 0.644 1.00 0.00 H new ATOM 0 HE2 MET A 108 -8.849 -6.704 2.364 1.00 0.00 H new ATOM 0 HE3 MET A 108 -9.720 -7.833 1.300 1.00 0.00 H new ATOM 1823 N GLU A 109 -13.444 -6.480 6.110 1.00 0.00 N ATOM 1824 CA GLU A 109 -14.721 -5.820 6.364 1.00 0.00 C ATOM 1825 C GLU A 109 -14.502 -4.462 7.024 1.00 0.00 C ATOM 1826 O GLU A 109 -15.129 -3.473 6.642 1.00 0.00 O ATOM 1827 CB GLU A 109 -15.642 -6.684 7.223 1.00 0.00 C ATOM 1828 CG GLU A 109 -16.977 -6.013 7.508 1.00 0.00 C ATOM 1829 CD GLU A 109 -18.014 -6.964 8.051 1.00 0.00 C ATOM 1830 OE1 GLU A 109 -18.700 -7.621 7.242 1.00 0.00 O ATOM 1831 OE2 GLU A 109 -18.161 -7.051 9.288 1.00 0.00 O ATOM 0 H GLU A 109 -13.274 -7.318 6.666 1.00 0.00 H new ATOM 0 HA GLU A 109 -15.208 -5.670 5.401 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -15.818 -7.634 6.718 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -15.145 -6.911 8.166 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -16.825 -5.204 8.223 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -17.353 -5.561 6.590 1.00 0.00 H new ATOM 1838 N PHE A 110 -13.608 -4.418 8.002 1.00 0.00 N ATOM 1839 CA PHE A 110 -13.239 -3.159 8.638 1.00 0.00 C ATOM 1840 C PHE A 110 -12.572 -2.233 7.631 1.00 0.00 C ATOM 1841 O PHE A 110 -12.755 -1.019 7.672 1.00 0.00 O ATOM 1842 CB PHE A 110 -12.303 -3.403 9.824 1.00 0.00 C ATOM 1843 CG PHE A 110 -13.012 -3.757 11.100 1.00 0.00 C ATOM 1844 CD1 PHE A 110 -13.588 -5.004 11.272 1.00 0.00 C ATOM 1845 CD2 PHE A 110 -13.096 -2.834 12.129 1.00 0.00 C ATOM 1846 CE1 PHE A 110 -14.236 -5.326 12.450 1.00 0.00 C ATOM 1847 CE2 PHE A 110 -13.742 -3.149 13.308 1.00 0.00 C ATOM 1848 CZ PHE A 110 -14.314 -4.396 13.468 1.00 0.00 C ATOM 0 H PHE A 110 -13.125 -5.237 8.372 1.00 0.00 H new ATOM 0 HA PHE A 110 -14.149 -2.686 9.007 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -11.613 -4.207 9.569 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -11.703 -2.508 9.990 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -13.531 -5.733 10.477 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -12.651 -1.857 12.008 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -14.680 -6.303 12.574 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -13.800 -2.421 14.104 1.00 0.00 H new ATOM 0 HZ PHE A 110 -14.822 -4.644 14.388 1.00 0.00 H new ATOM 1858 N LEU A 111 -11.805 -2.826 6.726 1.00 0.00 N ATOM 1859 CA LEU A 111 -11.146 -2.085 5.660 1.00 0.00 C ATOM 1860 C LEU A 111 -12.183 -1.488 4.707 1.00 0.00 C ATOM 1861 O LEU A 111 -12.100 -0.319 4.346 1.00 0.00 O ATOM 1862 CB LEU A 111 -10.173 -3.018 4.922 1.00 0.00 C ATOM 1863 CG LEU A 111 -9.381 -2.400 3.766 1.00 0.00 C ATOM 1864 CD1 LEU A 111 -7.994 -3.018 3.694 1.00 0.00 C ATOM 1865 CD2 LEU A 111 -10.106 -2.609 2.447 1.00 0.00 C ATOM 0 H LEU A 111 -11.623 -3.829 6.710 1.00 0.00 H new ATOM 0 HA LEU A 111 -10.578 -1.257 6.084 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -9.464 -3.415 5.648 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -10.740 -3.864 4.534 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.289 -1.329 3.947 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -7.439 -2.572 2.869 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -7.465 -2.834 4.629 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -8.082 -4.092 3.533 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -9.527 -2.163 1.639 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -10.224 -3.677 2.262 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -11.088 -2.138 2.493 1.00 0.00 H new ATOM 1877 N ARG A 112 -13.167 -2.296 4.325 1.00 0.00 N ATOM 1878 CA ARG A 112 -14.260 -1.852 3.459 1.00 0.00 C ATOM 1879 C ARG A 112 -15.054 -0.719 4.112 1.00 0.00 C ATOM 1880 O ARG A 112 -15.625 0.138 3.433 1.00 0.00 O ATOM 1881 CB ARG A 112 -15.209 -3.021 3.166 1.00 0.00 C ATOM 1882 CG ARG A 112 -16.445 -2.620 2.375 1.00 0.00 C ATOM 1883 CD ARG A 112 -17.568 -3.640 2.502 1.00 0.00 C ATOM 1884 NE ARG A 112 -17.956 -3.869 3.899 1.00 0.00 N ATOM 1885 CZ ARG A 112 -18.566 -2.965 4.678 1.00 0.00 C ATOM 1886 NH1 ARG A 112 -18.919 -1.779 4.191 1.00 0.00 N ATOM 1887 NH2 ARG A 112 -18.845 -3.261 5.942 1.00 0.00 N ATOM 0 H ARG A 112 -13.232 -3.275 4.605 1.00 0.00 H new ATOM 0 HA ARG A 112 -13.821 -1.487 2.530 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -14.667 -3.788 2.613 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -15.521 -3.469 4.109 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -16.798 -1.649 2.724 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -16.179 -2.504 1.324 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -18.435 -3.295 1.938 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -17.252 -4.583 2.056 1.00 0.00 H new ATOM 0 HE ARG A 112 -17.747 -4.781 4.306 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -18.726 -1.550 3.216 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -19.383 -1.098 4.793 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -18.595 -4.175 6.319 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -19.309 -2.574 6.536 1.00 0.00 H new ATOM 1901 N ASN A 113 -15.085 -0.734 5.438 1.00 0.00 N ATOM 1902 CA ASN A 113 -15.912 0.194 6.194 1.00 0.00 C ATOM 1903 C ASN A 113 -15.047 1.266 6.859 1.00 0.00 C ATOM 1904 O ASN A 113 -15.455 1.901 7.832 1.00 0.00 O ATOM 1905 CB ASN A 113 -16.700 -0.590 7.250 1.00 0.00 C ATOM 1906 CG ASN A 113 -18.060 0.014 7.535 1.00 0.00 C ATOM 1907 OD1 ASN A 113 -19.039 -0.295 6.853 1.00 0.00 O ATOM 1908 ND2 ASN A 113 -18.137 0.857 8.549 1.00 0.00 N ATOM 0 H ASN A 113 -14.545 -1.381 6.013 1.00 0.00 H new ATOM 0 HA ASN A 113 -16.605 0.695 5.519 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -16.828 -1.618 6.912 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -16.123 -0.627 8.174 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -19.032 1.280 8.794 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -17.301 1.085 9.087 1.00 0.00 H new ATOM 1915 N TRP A 114 -13.850 1.457 6.318 1.00 0.00 N ATOM 1916 CA TRP A 114 -12.911 2.448 6.834 1.00 0.00 C ATOM 1917 C TRP A 114 -13.415 3.867 6.556 1.00 0.00 C ATOM 1918 O TRP A 114 -14.023 4.138 5.518 1.00 0.00 O ATOM 1919 CB TRP A 114 -11.529 2.225 6.199 1.00 0.00 C ATOM 1920 CG TRP A 114 -10.443 3.129 6.715 1.00 0.00 C ATOM 1921 CD1 TRP A 114 -9.810 3.050 7.923 1.00 0.00 C ATOM 1922 CD2 TRP A 114 -9.844 4.233 6.021 1.00 0.00 C ATOM 1923 NE1 TRP A 114 -8.861 4.043 8.023 1.00 0.00 N ATOM 1924 CE2 TRP A 114 -8.865 4.779 6.870 1.00 0.00 C ATOM 1925 CE3 TRP A 114 -10.043 4.813 4.765 1.00 0.00 C ATOM 1926 CZ2 TRP A 114 -8.087 5.874 6.506 1.00 0.00 C ATOM 1927 CZ3 TRP A 114 -9.272 5.902 4.405 1.00 0.00 C ATOM 1928 CH2 TRP A 114 -8.303 6.421 5.271 1.00 0.00 C ATOM 0 H TRP A 114 -13.503 0.933 5.514 1.00 0.00 H new ATOM 0 HA TRP A 114 -12.827 2.331 7.914 1.00 0.00 H new ATOM 0 HB2 TRP A 114 -11.231 1.190 6.367 1.00 0.00 H new ATOM 0 HB3 TRP A 114 -11.614 2.362 5.121 1.00 0.00 H new ATOM 0 HD1 TRP A 114 -10.022 2.317 8.687 1.00 0.00 H new ATOM 0 HE1 TRP A 114 -8.254 4.204 8.827 1.00 0.00 H new ATOM 0 HE3 TRP A 114 -10.786 4.417 4.088 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 -7.340 6.277 7.174 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 -9.420 6.360 3.438 1.00 0.00 H new ATOM 0 HH2 TRP A 114 -7.714 7.270 4.958 1.00 0.00 H new ATOM 1939 N ASN A 115 -13.173 4.763 7.504 1.00 0.00 N ATOM 1940 CA ASN A 115 -13.562 6.163 7.369 1.00 0.00 C ATOM 1941 C ASN A 115 -12.375 7.050 7.706 1.00 0.00 C ATOM 1942 O ASN A 115 -11.267 6.556 7.902 1.00 0.00 O ATOM 1943 CB ASN A 115 -14.729 6.513 8.303 1.00 0.00 C ATOM 1944 CG ASN A 115 -16.013 5.776 7.980 1.00 0.00 C ATOM 1945 OD1 ASN A 115 -16.796 6.209 7.136 1.00 0.00 O ATOM 1946 ND2 ASN A 115 -16.253 4.676 8.675 1.00 0.00 N ATOM 0 H ASN A 115 -12.705 4.543 8.383 1.00 0.00 H new ATOM 0 HA ASN A 115 -13.883 6.328 6.340 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -14.440 6.288 9.330 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -14.914 7.586 8.252 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -17.115 4.153 8.520 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -15.576 4.351 9.366 1.00 0.00 H new ATOM 1953 N GLY A 116 -12.607 8.355 7.796 1.00 0.00 N ATOM 1954 CA GLY A 116 -11.558 9.267 8.213 1.00 0.00 C ATOM 1955 C GLY A 116 -11.298 9.168 9.703 1.00 0.00 C ATOM 1956 O GLY A 116 -11.506 10.123 10.449 1.00 0.00 O ATOM 0 H GLY A 116 -13.502 8.797 7.588 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -10.642 9.044 7.667 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -11.840 10.289 7.959 1.00 0.00 H new ATOM 1960 N THR A 117 -10.859 7.999 10.134 1.00 0.00 N ATOM 1961 CA THR A 117 -10.654 7.715 11.540 1.00 0.00 C ATOM 1962 C THR A 117 -9.280 7.085 11.757 1.00 0.00 C ATOM 1963 O THR A 117 -8.991 6.015 11.221 1.00 0.00 O ATOM 1964 CB THR A 117 -11.756 6.762 12.048 1.00 0.00 C ATOM 1965 OG1 THR A 117 -13.042 7.276 11.678 1.00 0.00 O ATOM 1966 CG2 THR A 117 -11.696 6.592 13.558 1.00 0.00 C ATOM 0 H THR A 117 -10.635 7.219 9.516 1.00 0.00 H new ATOM 0 HA THR A 117 -10.703 8.649 12.099 1.00 0.00 H new ATOM 0 HB THR A 117 -11.594 5.786 11.590 1.00 0.00 H new ATOM 0 HG1 THR A 117 -13.742 6.670 11.999 1.00 0.00 H new ATOM 0 HG21 THR A 117 -12.487 5.914 13.880 1.00 0.00 H new ATOM 0 HG22 THR A 117 -10.727 6.179 13.839 1.00 0.00 H new ATOM 0 HG23 THR A 117 -11.831 7.561 14.039 1.00 0.00 H new ATOM 1974 N PHE A 118 -8.441 7.752 12.537 1.00 0.00 N ATOM 1975 CA PHE A 118 -7.087 7.279 12.783 1.00 0.00 C ATOM 1976 C PHE A 118 -7.102 6.132 13.783 1.00 0.00 C ATOM 1977 O PHE A 118 -6.303 5.202 13.694 1.00 0.00 O ATOM 1978 CB PHE A 118 -6.205 8.418 13.301 1.00 0.00 C ATOM 1979 CG PHE A 118 -6.151 9.605 12.380 1.00 0.00 C ATOM 1980 CD1 PHE A 118 -5.318 9.600 11.273 1.00 0.00 C ATOM 1981 CD2 PHE A 118 -6.931 10.725 12.622 1.00 0.00 C ATOM 1982 CE1 PHE A 118 -5.265 10.690 10.424 1.00 0.00 C ATOM 1983 CE2 PHE A 118 -6.881 11.818 11.777 1.00 0.00 C ATOM 1984 CZ PHE A 118 -6.047 11.800 10.676 1.00 0.00 C ATOM 0 H PHE A 118 -8.675 8.624 13.011 1.00 0.00 H new ATOM 0 HA PHE A 118 -6.672 6.920 11.841 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -6.577 8.740 14.274 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -5.194 8.042 13.455 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -4.703 8.735 11.071 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -7.586 10.744 13.481 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -4.612 10.673 9.564 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -7.493 12.685 11.977 1.00 0.00 H new ATOM 0 HZ PHE A 118 -6.007 12.652 10.014 1.00 0.00 H new ATOM 1994 N GLY A 119 -8.040 6.194 14.720 1.00 0.00 N ATOM 1995 CA GLY A 119 -8.166 5.149 15.720 1.00 0.00 C ATOM 1996 C GLY A 119 -8.695 3.849 15.140 1.00 0.00 C ATOM 1997 O GLY A 119 -8.648 2.804 15.792 1.00 0.00 O ATOM 0 H GLY A 119 -8.718 6.951 14.806 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -7.193 4.969 16.178 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -8.833 5.488 16.512 1.00 0.00 H new ATOM 2001 N LEU A 120 -9.185 3.912 13.905 1.00 0.00 N ATOM 2002 CA LEU A 120 -9.711 2.734 13.225 1.00 0.00 C ATOM 2003 C LEU A 120 -8.555 1.805 12.850 1.00 0.00 C ATOM 2004 O LEU A 120 -8.733 0.599 12.686 1.00 0.00 O ATOM 2005 CB LEU A 120 -10.504 3.160 11.979 1.00 0.00 C ATOM 2006 CG LEU A 120 -11.656 2.234 11.557 1.00 0.00 C ATOM 2007 CD1 LEU A 120 -12.571 2.950 10.576 1.00 0.00 C ATOM 2008 CD2 LEU A 120 -11.137 0.948 10.930 1.00 0.00 C ATOM 0 H LEU A 120 -9.228 4.769 13.354 1.00 0.00 H new ATOM 0 HA LEU A 120 -10.387 2.196 13.889 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -10.912 4.155 12.157 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -9.809 3.245 11.143 1.00 0.00 H new ATOM 0 HG LEU A 120 -12.216 1.972 12.454 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -13.383 2.284 10.284 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -12.984 3.841 11.048 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -12.002 3.238 9.692 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -11.979 0.317 10.644 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -10.546 1.187 10.046 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -10.515 0.417 11.650 1.00 0.00 H new ATOM 2020 N LEU A 121 -7.360 2.371 12.758 1.00 0.00 N ATOM 2021 CA LEU A 121 -6.170 1.595 12.432 1.00 0.00 C ATOM 2022 C LEU A 121 -5.865 0.604 13.548 1.00 0.00 C ATOM 2023 O LEU A 121 -5.273 -0.447 13.318 1.00 0.00 O ATOM 2024 CB LEU A 121 -4.962 2.513 12.191 1.00 0.00 C ATOM 2025 CG LEU A 121 -4.901 3.201 10.817 1.00 0.00 C ATOM 2026 CD1 LEU A 121 -4.866 2.169 9.702 1.00 0.00 C ATOM 2027 CD2 LEU A 121 -6.070 4.157 10.621 1.00 0.00 C ATOM 0 H LEU A 121 -7.188 3.366 12.904 1.00 0.00 H new ATOM 0 HA LEU A 121 -6.366 1.044 11.512 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.957 3.284 12.962 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -4.053 1.926 12.322 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.982 3.786 10.781 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -4.823 2.676 8.738 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -3.986 1.537 9.819 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -5.764 1.553 9.748 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -5.996 4.626 9.640 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -7.007 3.605 10.689 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -6.045 4.926 11.393 1.00 0.00 H new ATOM 2039 N ASN A 122 -6.300 0.933 14.757 1.00 0.00 N ATOM 2040 CA ASN A 122 -6.110 0.052 15.902 1.00 0.00 C ATOM 2041 C ASN A 122 -7.140 -1.069 15.900 1.00 0.00 C ATOM 2042 O ASN A 122 -6.989 -2.060 16.612 1.00 0.00 O ATOM 2043 CB ASN A 122 -6.205 0.834 17.214 1.00 0.00 C ATOM 2044 CG ASN A 122 -5.063 1.812 17.397 1.00 0.00 C ATOM 2045 OD1 ASN A 122 -5.150 2.968 16.991 1.00 0.00 O ATOM 2046 ND2 ASN A 122 -3.985 1.354 18.015 1.00 0.00 N ATOM 0 H ASN A 122 -6.787 1.804 14.970 1.00 0.00 H new ATOM 0 HA ASN A 122 -5.114 -0.383 15.821 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -7.150 1.376 17.241 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -6.215 0.134 18.049 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -3.186 1.969 18.169 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -3.954 0.387 18.337 1.00 0.00 H new ATOM 2053 N THR A 123 -8.187 -0.913 15.102 1.00 0.00 N ATOM 2054 CA THR A 123 -9.231 -1.924 15.025 1.00 0.00 C ATOM 2055 C THR A 123 -9.040 -2.808 13.794 1.00 0.00 C ATOM 2056 O THR A 123 -9.830 -3.717 13.536 1.00 0.00 O ATOM 2057 CB THR A 123 -10.641 -1.289 15.016 1.00 0.00 C ATOM 2058 OG1 THR A 123 -10.813 -0.441 13.874 1.00 0.00 O ATOM 2059 CG2 THR A 123 -10.867 -0.471 16.279 1.00 0.00 C ATOM 0 H THR A 123 -8.335 -0.101 14.502 1.00 0.00 H new ATOM 0 HA THR A 123 -9.149 -2.544 15.918 1.00 0.00 H new ATOM 0 HB THR A 123 -11.367 -2.101 14.972 1.00 0.00 H new ATOM 0 HG1 THR A 123 -9.958 -0.346 13.405 1.00 0.00 H new ATOM 0 HG21 THR A 123 -11.864 -0.032 16.255 1.00 0.00 H new ATOM 0 HG22 THR A 123 -10.776 -1.117 17.152 1.00 0.00 H new ATOM 0 HG23 THR A 123 -10.122 0.323 16.336 1.00 0.00 H new ATOM 2067 N LEU A 124 -7.971 -2.542 13.053 1.00 0.00 N ATOM 2068 CA LEU A 124 -7.643 -3.314 11.863 1.00 0.00 C ATOM 2069 C LEU A 124 -6.595 -4.372 12.180 1.00 0.00 C ATOM 2070 O LEU A 124 -5.757 -4.181 13.064 1.00 0.00 O ATOM 2071 CB LEU A 124 -7.136 -2.387 10.757 1.00 0.00 C ATOM 2072 CG LEU A 124 -8.214 -1.554 10.062 1.00 0.00 C ATOM 2073 CD1 LEU A 124 -7.583 -0.470 9.207 1.00 0.00 C ATOM 2074 CD2 LEU A 124 -9.098 -2.446 9.207 1.00 0.00 C ATOM 0 H LEU A 124 -7.312 -1.791 13.259 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.547 -3.816 11.519 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -6.395 -1.711 11.183 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -6.624 -2.989 10.006 1.00 0.00 H new ATOM 0 HG LEU A 124 -8.828 -1.078 10.827 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -8.366 0.112 8.721 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -6.981 0.186 9.836 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -6.948 -0.928 8.449 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -9.861 -1.841 8.718 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -8.490 -2.944 8.451 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -9.578 -3.195 9.838 1.00 0.00 H new ATOM 2086 N ARG A 125 -6.641 -5.487 11.465 1.00 0.00 N ATOM 2087 CA ARG A 125 -5.657 -6.542 11.646 1.00 0.00 C ATOM 2088 C ARG A 125 -4.426 -6.259 10.795 1.00 0.00 C ATOM 2089 O ARG A 125 -4.216 -6.863 9.740 1.00 0.00 O ATOM 2090 CB ARG A 125 -6.242 -7.920 11.318 1.00 0.00 C ATOM 2091 CG ARG A 125 -7.218 -8.436 12.367 1.00 0.00 C ATOM 2092 CD ARG A 125 -7.641 -9.867 12.072 1.00 0.00 C ATOM 2093 NE ARG A 125 -8.409 -10.461 13.168 1.00 0.00 N ATOM 2094 CZ ARG A 125 -8.359 -11.756 13.489 1.00 0.00 C ATOM 2095 NH1 ARG A 125 -7.586 -12.587 12.801 1.00 0.00 N ATOM 2096 NH2 ARG A 125 -9.089 -12.222 14.495 1.00 0.00 N ATOM 0 H ARG A 125 -7.348 -5.683 10.756 1.00 0.00 H new ATOM 0 HA ARG A 125 -5.364 -6.556 12.696 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -6.750 -7.869 10.355 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -5.426 -8.635 11.210 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -6.755 -8.387 13.353 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -8.098 -7.793 12.396 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -8.240 -9.885 11.161 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -6.755 -10.473 11.883 1.00 0.00 H new ATOM 0 HE ARG A 125 -9.016 -9.852 13.717 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -7.027 -12.237 12.023 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -7.551 -13.575 13.050 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -9.690 -11.590 15.025 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -9.049 -13.212 14.738 1.00 0.00 H new ATOM 2110 N LEU A 126 -3.642 -5.300 11.256 1.00 0.00 N ATOM 2111 CA LEU A 126 -2.428 -4.895 10.573 1.00 0.00 C ATOM 2112 C LEU A 126 -1.253 -5.730 11.054 1.00 0.00 C ATOM 2113 O LEU A 126 -0.987 -5.814 12.255 1.00 0.00 O ATOM 2114 CB LEU A 126 -2.164 -3.411 10.828 1.00 0.00 C ATOM 2115 CG LEU A 126 -3.226 -2.465 10.270 1.00 0.00 C ATOM 2116 CD1 LEU A 126 -3.161 -1.116 10.963 1.00 0.00 C ATOM 2117 CD2 LEU A 126 -3.053 -2.294 8.771 1.00 0.00 C ATOM 0 H LEU A 126 -3.830 -4.781 12.114 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.550 -5.055 9.502 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.084 -3.250 11.903 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.199 -3.148 10.394 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.205 -2.904 10.460 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.926 -0.458 10.550 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.333 -1.247 12.031 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -2.178 -0.673 10.806 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.818 -1.617 8.391 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.066 -1.880 8.564 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -3.150 -3.263 8.281 1.00 0.00 H new ATOM 2129 N ILE A 127 -0.564 -6.355 10.118 1.00 0.00 N ATOM 2130 CA ILE A 127 0.572 -7.201 10.440 1.00 0.00 C ATOM 2131 C ILE A 127 1.808 -6.731 9.686 1.00 0.00 C ATOM 2132 O ILE A 127 1.742 -5.787 8.899 1.00 0.00 O ATOM 2133 CB ILE A 127 0.291 -8.681 10.094 1.00 0.00 C ATOM 2134 CG1 ILE A 127 -0.059 -8.830 8.610 1.00 0.00 C ATOM 2135 CG2 ILE A 127 -0.834 -9.227 10.964 1.00 0.00 C ATOM 2136 CD1 ILE A 127 -0.297 -10.261 8.180 1.00 0.00 C ATOM 0 H ILE A 127 -0.772 -6.293 9.121 1.00 0.00 H new ATOM 0 HA ILE A 127 0.745 -7.125 11.513 1.00 0.00 H new ATOM 0 HB ILE A 127 1.194 -9.258 10.294 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.952 -8.243 8.396 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.750 -8.410 8.012 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -1.019 -10.270 10.707 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -0.549 -9.157 12.014 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -1.740 -8.645 10.794 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -0.540 -10.286 7.118 1.00 0.00 H new ATOM 0 HD12 ILE A 127 0.602 -10.850 8.361 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -1.126 -10.680 8.751 1.00 0.00 H new ATOM 2148 N ARG A 128 2.932 -7.381 9.931 1.00 0.00 N ATOM 2149 CA ARG A 128 4.157 -7.063 9.222 1.00 0.00 C ATOM 2150 C ARG A 128 4.344 -8.022 8.059 1.00 0.00 C ATOM 2151 O ARG A 128 4.466 -9.232 8.243 1.00 0.00 O ATOM 2152 CB ARG A 128 5.356 -7.099 10.174 1.00 0.00 C ATOM 2153 CG ARG A 128 5.455 -5.861 11.053 1.00 0.00 C ATOM 2154 CD ARG A 128 6.468 -6.034 12.174 1.00 0.00 C ATOM 2155 NE ARG A 128 6.022 -7.015 13.164 1.00 0.00 N ATOM 2156 CZ ARG A 128 5.351 -6.701 14.273 1.00 0.00 C ATOM 2157 NH1 ARG A 128 5.076 -5.433 14.555 1.00 0.00 N ATOM 2158 NH2 ARG A 128 4.968 -7.660 15.105 1.00 0.00 N ATOM 0 H ARG A 128 3.021 -8.132 10.616 1.00 0.00 H new ATOM 0 HA ARG A 128 4.086 -6.051 8.823 1.00 0.00 H new ATOM 0 HB2 ARG A 128 5.283 -7.983 10.808 1.00 0.00 H new ATOM 0 HB3 ARG A 128 6.272 -7.199 9.592 1.00 0.00 H new ATOM 0 HG2 ARG A 128 5.736 -5.004 10.441 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.477 -5.641 11.480 1.00 0.00 H new ATOM 0 HD2 ARG A 128 7.423 -6.349 11.755 1.00 0.00 H new ATOM 0 HD3 ARG A 128 6.636 -5.075 12.663 1.00 0.00 H new ATOM 0 HE ARG A 128 6.237 -7.998 12.996 1.00 0.00 H new ATOM 0 HH11 ARG A 128 5.378 -4.693 13.922 1.00 0.00 H new ATOM 0 HH12 ARG A 128 4.562 -5.199 15.405 1.00 0.00 H new ATOM 0 HH21 ARG A 128 5.187 -8.634 14.896 1.00 0.00 H new ATOM 0 HH22 ARG A 128 4.455 -7.424 15.954 1.00 0.00 H new ATOM 2172 N ILE A 129 4.331 -7.472 6.861 1.00 0.00 N ATOM 2173 CA ILE A 129 4.404 -8.261 5.647 1.00 0.00 C ATOM 2174 C ILE A 129 5.605 -7.839 4.810 1.00 0.00 C ATOM 2175 O ILE A 129 5.861 -6.648 4.635 1.00 0.00 O ATOM 2176 CB ILE A 129 3.111 -8.090 4.810 1.00 0.00 C ATOM 2177 CG1 ILE A 129 1.897 -8.592 5.593 1.00 0.00 C ATOM 2178 CG2 ILE A 129 3.217 -8.812 3.475 1.00 0.00 C ATOM 2179 CD1 ILE A 129 0.594 -8.480 4.831 1.00 0.00 C ATOM 0 H ILE A 129 4.270 -6.466 6.702 1.00 0.00 H new ATOM 0 HA ILE A 129 4.512 -9.308 5.930 1.00 0.00 H new ATOM 0 HB ILE A 129 2.983 -7.027 4.607 1.00 0.00 H new ATOM 0 HG12 ILE A 129 2.059 -9.634 5.868 1.00 0.00 H new ATOM 0 HG13 ILE A 129 1.815 -8.026 6.521 1.00 0.00 H new ATOM 0 HG21 ILE A 129 2.294 -8.673 2.912 1.00 0.00 H new ATOM 0 HG22 ILE A 129 4.054 -8.405 2.907 1.00 0.00 H new ATOM 0 HG23 ILE A 129 3.379 -9.876 3.649 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -0.222 -8.855 5.449 1.00 0.00 H new ATOM 0 HD12 ILE A 129 0.409 -7.436 4.579 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.656 -9.069 3.916 1.00 0.00 H new ATOM 2191 N ASN A 130 6.354 -8.814 4.321 1.00 0.00 N ATOM 2192 CA ASN A 130 7.429 -8.538 3.383 1.00 0.00 C ATOM 2193 C ASN A 130 6.820 -8.156 2.043 1.00 0.00 C ATOM 2194 O ASN A 130 5.713 -8.591 1.733 1.00 0.00 O ATOM 2195 CB ASN A 130 8.351 -9.754 3.229 1.00 0.00 C ATOM 2196 CG ASN A 130 9.452 -9.531 2.205 1.00 0.00 C ATOM 2197 OD1 ASN A 130 9.293 -9.838 1.021 1.00 0.00 O ATOM 2198 ND2 ASN A 130 10.576 -8.986 2.648 1.00 0.00 N ATOM 0 H ASN A 130 6.238 -9.800 4.557 1.00 0.00 H new ATOM 0 HA ASN A 130 8.036 -7.715 3.761 1.00 0.00 H new ATOM 0 HB2 ASN A 130 8.800 -9.988 4.194 1.00 0.00 H new ATOM 0 HB3 ASN A 130 7.757 -10.620 2.935 1.00 0.00 H new ATOM 0 HD21 ASN A 130 11.345 -8.808 2.002 1.00 0.00 H new ATOM 0 HD22 ASN A 130 10.672 -8.745 3.634 1.00 0.00 H new ATOM 2205 N ASP A 131 7.552 -7.365 1.265 1.00 0.00 N ATOM 2206 CA ASP A 131 7.063 -6.787 0.002 1.00 0.00 C ATOM 2207 C ASP A 131 6.374 -7.797 -0.931 1.00 0.00 C ATOM 2208 O ASP A 131 5.588 -7.404 -1.790 1.00 0.00 O ATOM 2209 CB ASP A 131 8.220 -6.110 -0.741 1.00 0.00 C ATOM 2210 CG ASP A 131 9.406 -7.032 -0.965 1.00 0.00 C ATOM 2211 OD1 ASP A 131 9.430 -7.756 -1.982 1.00 0.00 O ATOM 2212 OD2 ASP A 131 10.336 -7.029 -0.132 1.00 0.00 O ATOM 0 H ASP A 131 8.511 -7.100 1.489 1.00 0.00 H new ATOM 0 HA ASP A 131 6.299 -6.061 0.281 1.00 0.00 H new ATOM 0 HB2 ASP A 131 7.862 -5.748 -1.705 1.00 0.00 H new ATOM 0 HB3 ASP A 131 8.547 -5.238 -0.174 1.00 0.00 H new ATOM 2217 N LYS A 132 6.650 -9.085 -0.763 1.00 0.00 N ATOM 2218 CA LYS A 132 6.072 -10.110 -1.633 1.00 0.00 C ATOM 2219 C LYS A 132 4.813 -10.724 -1.029 1.00 0.00 C ATOM 2220 O LYS A 132 4.250 -11.668 -1.582 1.00 0.00 O ATOM 2221 CB LYS A 132 7.097 -11.212 -1.878 1.00 0.00 C ATOM 2222 CG LYS A 132 8.441 -10.685 -2.325 1.00 0.00 C ATOM 2223 CD LYS A 132 9.540 -11.701 -2.100 1.00 0.00 C ATOM 2224 CE LYS A 132 10.902 -11.051 -2.230 1.00 0.00 C ATOM 2225 NZ LYS A 132 11.034 -9.875 -1.328 1.00 0.00 N ATOM 0 H LYS A 132 7.268 -9.446 -0.036 1.00 0.00 H new ATOM 0 HA LYS A 132 5.798 -9.629 -2.572 1.00 0.00 H new ATOM 0 HB2 LYS A 132 7.226 -11.789 -0.963 1.00 0.00 H new ATOM 0 HB3 LYS A 132 6.712 -11.896 -2.634 1.00 0.00 H new ATOM 0 HG2 LYS A 132 8.397 -10.424 -3.382 1.00 0.00 H new ATOM 0 HG3 LYS A 132 8.673 -9.770 -1.780 1.00 0.00 H new ATOM 0 HD2 LYS A 132 9.436 -12.144 -1.110 1.00 0.00 H new ATOM 0 HD3 LYS A 132 9.447 -12.511 -2.823 1.00 0.00 H new ATOM 0 HE2 LYS A 132 11.678 -11.780 -1.995 1.00 0.00 H new ATOM 0 HE3 LYS A 132 11.060 -10.739 -3.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 12.035 -9.734 -1.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 10.672 -9.027 -1.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 10.487 -10.041 -0.459 1.00 0.00 H new ATOM 2239 N GLY A 133 4.376 -10.189 0.095 1.00 0.00 N ATOM 2240 CA GLY A 133 3.244 -10.762 0.785 1.00 0.00 C ATOM 2241 C GLY A 133 3.676 -11.867 1.722 1.00 0.00 C ATOM 2242 O GLY A 133 2.936 -12.821 1.961 1.00 0.00 O ATOM 0 H GLY A 133 4.784 -9.368 0.543 1.00 0.00 H new ATOM 0 HA2 GLY A 133 2.727 -9.985 1.349 1.00 0.00 H new ATOM 0 HA3 GLY A 133 2.533 -11.155 0.058 1.00 0.00 H new ATOM 2246 N GLU A 134 4.879 -11.732 2.263 1.00 0.00 N ATOM 2247 CA GLU A 134 5.442 -12.765 3.124 1.00 0.00 C ATOM 2248 C GLU A 134 5.210 -12.419 4.589 1.00 0.00 C ATOM 2249 O GLU A 134 5.261 -11.250 4.973 1.00 0.00 O ATOM 2250 CB GLU A 134 6.936 -12.950 2.843 1.00 0.00 C ATOM 2251 CG GLU A 134 7.245 -13.252 1.383 1.00 0.00 C ATOM 2252 CD GLU A 134 8.701 -13.600 1.147 1.00 0.00 C ATOM 2253 OE1 GLU A 134 9.582 -12.832 1.580 1.00 0.00 O ATOM 2254 OE2 GLU A 134 8.972 -14.641 0.513 1.00 0.00 O ATOM 0 H GLU A 134 5.482 -10.922 2.122 1.00 0.00 H new ATOM 0 HA GLU A 134 4.937 -13.706 2.907 1.00 0.00 H new ATOM 0 HB2 GLU A 134 7.468 -12.046 3.140 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.317 -13.762 3.463 1.00 0.00 H new ATOM 0 HG2 GLU A 134 6.620 -14.080 1.049 1.00 0.00 H new ATOM 0 HG3 GLU A 134 6.980 -12.387 0.775 1.00 0.00 H new ATOM 2261 N GLN A 135 4.959 -13.437 5.400 1.00 0.00 N ATOM 2262 CA GLN A 135 4.596 -13.237 6.797 1.00 0.00 C ATOM 2263 C GLN A 135 5.816 -12.895 7.647 1.00 0.00 C ATOM 2264 O GLN A 135 6.775 -13.669 7.720 1.00 0.00 O ATOM 2265 CB GLN A 135 3.914 -14.494 7.344 1.00 0.00 C ATOM 2266 CG GLN A 135 3.354 -14.324 8.748 1.00 0.00 C ATOM 2267 CD GLN A 135 2.289 -13.247 8.819 1.00 0.00 C ATOM 2268 OE1 GLN A 135 1.571 -13.008 7.853 1.00 0.00 O ATOM 2269 NE2 GLN A 135 2.186 -12.588 9.961 1.00 0.00 N ATOM 0 H GLN A 135 5.000 -14.415 5.113 1.00 0.00 H new ATOM 0 HA GLN A 135 3.905 -12.396 6.848 1.00 0.00 H new ATOM 0 HB2 GLN A 135 3.105 -14.779 6.672 1.00 0.00 H new ATOM 0 HB3 GLN A 135 4.632 -15.315 7.345 1.00 0.00 H new ATOM 0 HG2 GLN A 135 2.932 -15.271 9.085 1.00 0.00 H new ATOM 0 HG3 GLN A 135 4.165 -14.075 9.432 1.00 0.00 H new ATOM 0 HE21 GLN A 135 2.803 -12.818 10.740 1.00 0.00 H new ATOM 0 HE22 GLN A 135 1.490 -11.850 10.063 1.00 0.00 H new ATOM 2278 N VAL A 136 5.775 -11.728 8.278 1.00 0.00 N ATOM 2279 CA VAL A 136 6.817 -11.311 9.204 1.00 0.00 C ATOM 2280 C VAL A 136 6.225 -11.158 10.602 1.00 0.00 C ATOM 2281 O VAL A 136 5.341 -10.330 10.823 1.00 0.00 O ATOM 2282 CB VAL A 136 7.463 -9.972 8.777 1.00 0.00 C ATOM 2283 CG1 VAL A 136 8.660 -9.641 9.656 1.00 0.00 C ATOM 2284 CG2 VAL A 136 7.862 -10.003 7.308 1.00 0.00 C ATOM 0 H VAL A 136 5.023 -11.049 8.162 1.00 0.00 H new ATOM 0 HA VAL A 136 7.592 -12.078 9.200 1.00 0.00 H new ATOM 0 HB VAL A 136 6.720 -9.185 8.908 1.00 0.00 H new ATOM 0 HG11 VAL A 136 9.096 -8.695 9.335 1.00 0.00 H new ATOM 0 HG12 VAL A 136 8.337 -9.559 10.694 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.405 -10.432 9.569 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.314 -9.050 7.033 1.00 0.00 H new ATOM 0 HG22 VAL A 136 8.581 -10.806 7.143 1.00 0.00 H new ATOM 0 HG23 VAL A 136 6.978 -10.176 6.694 1.00 0.00 H new ATOM 2294 N VAL A 137 6.694 -11.965 11.541 1.00 0.00 N ATOM 2295 CA VAL A 137 6.154 -11.938 12.893 1.00 0.00 C ATOM 2296 C VAL A 137 6.821 -10.852 13.727 1.00 0.00 C ATOM 2297 O VAL A 137 6.225 -9.810 13.995 1.00 0.00 O ATOM 2298 CB VAL A 137 6.305 -13.301 13.601 1.00 0.00 C ATOM 2299 CG1 VAL A 137 5.663 -13.262 14.981 1.00 0.00 C ATOM 2300 CG2 VAL A 137 5.697 -14.414 12.758 1.00 0.00 C ATOM 0 H VAL A 137 7.442 -12.643 11.394 1.00 0.00 H new ATOM 0 HA VAL A 137 5.091 -11.717 12.802 1.00 0.00 H new ATOM 0 HB VAL A 137 7.368 -13.507 13.724 1.00 0.00 H new ATOM 0 HG11 VAL A 137 5.780 -14.232 15.464 1.00 0.00 H new ATOM 0 HG12 VAL A 137 6.147 -12.495 15.586 1.00 0.00 H new ATOM 0 HG13 VAL A 137 4.602 -13.031 14.882 1.00 0.00 H new ATOM 0 HG21 VAL A 137 5.814 -15.367 13.274 1.00 0.00 H new ATOM 0 HG22 VAL A 137 4.637 -14.214 12.601 1.00 0.00 H new ATOM 0 HG23 VAL A 137 6.204 -14.459 11.794 1.00 0.00 H new