USER MOD reduce.3.24.130724 H: found=0, std=0, add=616, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 619 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 41 ASN : amide:sc= -0.498 K(o=-1.5,f=-0.91) USER MOD Set 1.2: A 103 LYS NZ :NH3+ -122:sc= -0.993 (180deg=-4.28!) USER MOD Single : A 25 GLN : amide:sc= -1.4 K(o=-1.4,f=-4.1!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 153:sc= -0.643 (180deg=-1.79) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 CYS SG : rot 140:sc= -0.403 USER MOD Single : A 39 ASN : amide:sc= -0.201 K(o=-0.2,f=-1.2) USER MOD Single : A 62 GLN : amide:sc= -2.46 K(o=-2.5,f=-1.5) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0.00637 X(o=0.0064,f=0) USER MOD Single : A 69 GLN : amide:sc= -0.0129 K(o=-0.013,f=-0.91) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0.0743 X(o=0.074,f=0.18) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.667) USER MOD Single : A 98 THR OG1 : rot 25:sc= 0.0559 USER MOD Single : A 101 MET CE :methyl 141:sc= -2 (180deg=-4.27!) USER MOD Single : A 104 ASN : amide:sc= -0.487 X(o=-0.49,f=-0.47) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 57:sc= 0.846 USER MOD Single : A 110 GLN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 159:sc= -0.0914 (180deg=-0.454) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -1.04 K(o=-1,f=-1.8) USER MOD Single : A 125 ASN : amide:sc= -0.529 K(o=-0.53,f=-2!) USER MOD Single : A 126 ASN : amide:sc= -0.208 X(o=-0.21,f=-0.15) USER MOD Single : A 128 ASN : amide:sc= -0.784 K(o=-0.78,f=0) USER MOD ----------------------------------------------------------------- ATOM 316 N ILE A 23 -0.640 -27.524 -14.314 1.00 52.50 N ATOM 317 CA ILE A 23 -1.710 -27.441 -15.300 1.00 71.21 C ATOM 318 C ILE A 23 -1.813 -28.728 -16.111 1.00 10.42 C ATOM 319 O ILE A 23 -0.806 -29.271 -16.562 1.00 53.52 O ATOM 320 CB ILE A 23 -1.499 -26.257 -16.264 1.00 41.35 C ATOM 321 CG1 ILE A 23 -1.432 -24.943 -15.483 1.00 13.10 C ATOM 322 CG2 ILE A 23 -2.613 -26.210 -17.298 1.00 73.31 C ATOM 323 CD1 ILE A 23 -0.913 -23.781 -16.302 1.00 74.23 C ATOM 0 HA ILE A 23 -2.636 -27.288 -14.746 1.00 71.21 H new ATOM 0 HB ILE A 23 -0.553 -26.396 -16.787 1.00 41.35 H new ATOM 0 HG12 ILE A 23 -2.427 -24.699 -15.111 1.00 13.10 H new ATOM 0 HG13 ILE A 23 -0.790 -25.079 -14.612 1.00 13.10 H new ATOM 0 HG21 ILE A 23 -2.449 -25.368 -17.971 1.00 73.31 H new ATOM 0 HG22 ILE A 23 -2.617 -27.137 -17.871 1.00 73.31 H new ATOM 0 HG23 ILE A 23 -3.572 -26.091 -16.794 1.00 73.31 H new ATOM 0 HD11 ILE A 23 -0.892 -22.882 -15.686 1.00 74.23 H new ATOM 0 HD12 ILE A 23 0.095 -24.004 -16.652 1.00 74.23 H new ATOM 0 HD13 ILE A 23 -1.567 -23.619 -17.159 1.00 74.23 H new ATOM 335 N GLU A 24 -3.039 -29.212 -16.291 1.00 71.32 N ATOM 336 CA GLU A 24 -3.272 -30.436 -17.048 1.00 63.12 C ATOM 337 C GLU A 24 -4.388 -30.238 -18.071 1.00 45.22 C ATOM 338 O GLU A 24 -5.248 -29.374 -17.907 1.00 40.33 O ATOM 339 CB GLU A 24 -3.630 -31.585 -16.104 1.00 43.20 C ATOM 340 CG GLU A 24 -5.083 -31.579 -15.660 1.00 24.25 C ATOM 341 CD GLU A 24 -5.269 -32.146 -14.267 1.00 12.10 C ATOM 342 OE1 GLU A 24 -4.463 -31.806 -13.375 1.00 52.34 O ATOM 343 OE2 GLU A 24 -6.220 -32.931 -14.066 1.00 51.31 O ATOM 0 H GLU A 24 -3.884 -28.775 -15.923 1.00 71.32 H new ATOM 0 HA GLU A 24 -2.354 -30.685 -17.580 1.00 63.12 H new ATOM 0 HB2 GLU A 24 -3.414 -32.532 -16.600 1.00 43.20 H new ATOM 0 HB3 GLU A 24 -2.990 -31.533 -15.223 1.00 43.20 H new ATOM 0 HG2 GLU A 24 -5.463 -30.558 -15.686 1.00 24.25 H new ATOM 0 HG3 GLU A 24 -5.677 -32.158 -16.366 1.00 24.25 H new ATOM 350 N GLN A 25 -4.363 -31.046 -19.127 1.00 72.41 N ATOM 351 CA GLN A 25 -5.371 -30.958 -20.178 1.00 70.32 C ATOM 352 C GLN A 25 -6.646 -31.691 -19.772 1.00 34.23 C ATOM 353 O GLN A 25 -6.601 -32.853 -19.365 1.00 3.23 O ATOM 354 CB GLN A 25 -4.828 -31.539 -21.484 1.00 62.23 C ATOM 355 CG GLN A 25 -4.564 -33.036 -21.421 1.00 24.51 C ATOM 356 CD GLN A 25 -5.743 -33.857 -21.906 1.00 33.21 C ATOM 357 OE1 GLN A 25 -6.834 -33.330 -22.124 1.00 64.03 O ATOM 358 NE2 GLN A 25 -5.528 -35.156 -22.078 1.00 41.21 N ATOM 0 H GLN A 25 -3.658 -31.767 -19.277 1.00 72.41 H new ATOM 0 HA GLN A 25 -5.611 -29.906 -20.329 1.00 70.32 H new ATOM 0 HB2 GLN A 25 -5.539 -31.337 -22.285 1.00 62.23 H new ATOM 0 HB3 GLN A 25 -3.902 -31.026 -21.743 1.00 62.23 H new ATOM 0 HG2 GLN A 25 -3.688 -33.272 -22.025 1.00 24.51 H new ATOM 0 HG3 GLN A 25 -4.328 -33.317 -20.395 1.00 24.51 H new ATOM 0 HE21 GLN A 25 -4.607 -35.550 -21.885 1.00 41.21 H new ATOM 0 HE22 GLN A 25 -6.283 -35.759 -22.403 1.00 41.21 H new ATOM 367 N ILE A 26 -7.778 -31.006 -19.884 1.00 31.52 N ATOM 368 CA ILE A 26 -9.064 -31.593 -19.529 1.00 43.51 C ATOM 369 C ILE A 26 -9.966 -31.720 -20.751 1.00 72.10 C ATOM 370 O ILE A 26 -9.565 -31.398 -21.869 1.00 74.50 O ATOM 371 CB ILE A 26 -9.787 -30.757 -18.456 1.00 53.31 C ATOM 372 CG1 ILE A 26 -10.020 -29.332 -18.960 1.00 70.00 C ATOM 373 CG2 ILE A 26 -8.983 -30.743 -17.164 1.00 53.23 C ATOM 374 CD1 ILE A 26 -11.465 -29.038 -19.298 1.00 44.33 C ATOM 0 H ILE A 26 -7.831 -30.044 -20.218 1.00 31.52 H new ATOM 0 HA ILE A 26 -8.858 -32.585 -19.128 1.00 43.51 H new ATOM 0 HB ILE A 26 -10.756 -31.213 -18.253 1.00 53.31 H new ATOM 0 HG12 ILE A 26 -9.683 -28.627 -18.200 1.00 70.00 H new ATOM 0 HG13 ILE A 26 -9.407 -29.164 -19.845 1.00 70.00 H new ATOM 0 HG21 ILE A 26 -9.507 -30.148 -16.416 1.00 53.23 H new ATOM 0 HG22 ILE A 26 -8.864 -31.763 -16.798 1.00 53.23 H new ATOM 0 HG23 ILE A 26 -8.001 -30.308 -17.351 1.00 53.23 H new ATOM 0 HD11 ILE A 26 -11.555 -28.010 -19.648 1.00 44.33 H new ATOM 0 HD12 ILE A 26 -11.801 -29.719 -20.080 1.00 44.33 H new ATOM 0 HD13 ILE A 26 -12.081 -29.173 -18.409 1.00 44.33 H new ATOM 386 N GLY A 27 -11.189 -32.191 -20.531 1.00 34.03 N ATOM 387 CA GLY A 27 -12.131 -32.351 -21.624 1.00 51.40 C ATOM 388 C GLY A 27 -13.426 -31.598 -21.389 1.00 43.34 C ATOM 389 O GLY A 27 -13.665 -31.087 -20.295 1.00 62.43 O ATOM 0 H GLY A 27 -11.545 -32.465 -19.615 1.00 34.03 H new ATOM 0 HA2 GLY A 27 -11.673 -32.000 -22.549 1.00 51.40 H new ATOM 0 HA3 GLY A 27 -12.350 -33.410 -21.759 1.00 51.40 H new ATOM 393 N ASP A 28 -14.262 -31.528 -22.418 1.00 72.03 N ATOM 394 CA ASP A 28 -15.539 -30.830 -22.319 1.00 72.25 C ATOM 395 C ASP A 28 -16.483 -31.559 -21.369 1.00 30.43 C ATOM 396 O ASP A 28 -17.270 -30.933 -20.659 1.00 45.30 O ATOM 397 CB ASP A 28 -16.184 -30.705 -23.701 1.00 20.12 C ATOM 398 CG ASP A 28 -17.314 -29.693 -23.723 1.00 62.32 C ATOM 399 OD1 ASP A 28 -17.618 -29.121 -22.655 1.00 61.43 O ATOM 400 OD2 ASP A 28 -17.892 -29.474 -24.807 1.00 15.13 O ATOM 0 H ASP A 28 -14.079 -31.946 -23.330 1.00 72.03 H new ATOM 0 HA ASP A 28 -15.351 -29.832 -21.922 1.00 72.25 H new ATOM 0 HB2 ASP A 28 -15.426 -30.414 -24.428 1.00 20.12 H new ATOM 0 HB3 ASP A 28 -16.565 -31.678 -24.010 1.00 20.12 H new ATOM 405 N SER A 29 -16.399 -32.885 -21.360 1.00 34.14 N ATOM 406 CA SER A 29 -17.250 -33.699 -20.499 1.00 40.21 C ATOM 407 C SER A 29 -16.710 -33.728 -19.073 1.00 24.42 C ATOM 408 O SER A 29 -17.457 -33.947 -18.120 1.00 3.01 O ATOM 409 CB SER A 29 -17.351 -35.124 -21.047 1.00 63.34 C ATOM 410 OG SER A 29 -18.221 -35.180 -22.165 1.00 42.24 O ATOM 0 H SER A 29 -15.751 -33.419 -21.939 1.00 34.14 H new ATOM 0 HA SER A 29 -18.244 -33.252 -20.484 1.00 40.21 H new ATOM 0 HB2 SER A 29 -16.361 -35.477 -21.335 1.00 63.34 H new ATOM 0 HB3 SER A 29 -17.714 -35.792 -20.266 1.00 63.34 H new ATOM 0 HG SER A 29 -18.267 -36.101 -22.498 1.00 42.24 H new ATOM 416 N GLU A 30 -15.407 -33.506 -18.935 1.00 3.41 N ATOM 417 CA GLU A 30 -14.766 -33.507 -17.625 1.00 21.44 C ATOM 418 C GLU A 30 -14.713 -32.098 -17.043 1.00 70.14 C ATOM 419 O GLU A 30 -14.433 -31.913 -15.859 1.00 61.05 O ATOM 420 CB GLU A 30 -13.352 -34.083 -17.725 1.00 71.22 C ATOM 421 CG GLU A 30 -13.224 -35.211 -18.735 1.00 52.14 C ATOM 422 CD GLU A 30 -14.338 -36.233 -18.613 1.00 63.22 C ATOM 423 OE1 GLU A 30 -14.818 -36.452 -17.482 1.00 62.15 O ATOM 424 OE2 GLU A 30 -14.727 -36.813 -19.648 1.00 33.44 O ATOM 0 H GLU A 30 -14.774 -33.323 -19.714 1.00 3.41 H new ATOM 0 HA GLU A 30 -15.360 -34.134 -16.959 1.00 21.44 H new ATOM 0 HB2 GLU A 30 -12.662 -33.284 -17.996 1.00 71.22 H new ATOM 0 HB3 GLU A 30 -13.047 -34.448 -16.744 1.00 71.22 H new ATOM 0 HG2 GLU A 30 -13.227 -34.794 -19.742 1.00 52.14 H new ATOM 0 HG3 GLU A 30 -12.264 -35.708 -18.599 1.00 52.14 H new ATOM 431 N PHE A 31 -14.982 -31.106 -17.886 1.00 51.15 N ATOM 432 CA PHE A 31 -14.964 -29.713 -17.458 1.00 15.33 C ATOM 433 C PHE A 31 -15.698 -29.542 -16.131 1.00 52.25 C ATOM 434 O PHE A 31 -15.077 -29.315 -15.091 1.00 53.02 O ATOM 435 CB PHE A 31 -15.602 -28.820 -18.525 1.00 75.15 C ATOM 436 CG PHE A 31 -15.854 -27.414 -18.059 1.00 65.24 C ATOM 437 CD1 PHE A 31 -14.807 -26.617 -17.626 1.00 33.35 C ATOM 438 CD2 PHE A 31 -17.137 -26.891 -18.052 1.00 72.53 C ATOM 439 CE1 PHE A 31 -15.035 -25.323 -17.197 1.00 31.30 C ATOM 440 CE2 PHE A 31 -17.371 -25.599 -17.624 1.00 51.23 C ATOM 441 CZ PHE A 31 -16.319 -24.813 -17.197 1.00 13.43 C ATOM 0 H PHE A 31 -15.215 -31.242 -18.870 1.00 51.15 H new ATOM 0 HA PHE A 31 -13.925 -29.416 -17.320 1.00 15.33 H new ATOM 0 HB2 PHE A 31 -14.953 -28.793 -19.400 1.00 75.15 H new ATOM 0 HB3 PHE A 31 -16.546 -29.264 -18.842 1.00 75.15 H new ATOM 0 HD1 PHE A 31 -13.801 -27.011 -17.624 1.00 33.35 H new ATOM 0 HD2 PHE A 31 -17.964 -27.501 -18.385 1.00 72.53 H new ATOM 0 HE1 PHE A 31 -14.210 -24.711 -16.862 1.00 31.30 H new ATOM 0 HE2 PHE A 31 -18.376 -25.204 -17.623 1.00 51.23 H new ATOM 0 HZ PHE A 31 -16.500 -23.802 -16.864 1.00 13.43 H new ATOM 451 N ASP A 32 -17.020 -29.652 -16.174 1.00 14.24 N ATOM 452 CA ASP A 32 -17.840 -29.511 -14.976 1.00 72.32 C ATOM 453 C ASP A 32 -17.585 -30.660 -14.006 1.00 72.42 C ATOM 454 O ASP A 32 -17.791 -30.524 -12.800 1.00 33.44 O ATOM 455 CB ASP A 32 -19.321 -29.461 -15.348 1.00 63.01 C ATOM 456 CG ASP A 32 -19.918 -30.841 -15.539 1.00 24.01 C ATOM 457 OD1 ASP A 32 -20.303 -31.465 -14.528 1.00 24.23 O ATOM 458 OD2 ASP A 32 -20.002 -31.297 -16.698 1.00 50.53 O ATOM 0 H ASP A 32 -17.548 -29.839 -17.026 1.00 14.24 H new ATOM 0 HA ASP A 32 -17.566 -28.577 -14.486 1.00 72.32 H new ATOM 0 HB2 ASP A 32 -19.871 -28.936 -14.567 1.00 63.01 H new ATOM 0 HB3 ASP A 32 -19.443 -28.886 -16.266 1.00 63.01 H new ATOM 463 N ASN A 33 -17.136 -31.791 -14.540 1.00 0.41 N ATOM 464 CA ASN A 33 -16.856 -32.965 -13.721 1.00 71.43 C ATOM 465 C ASN A 33 -15.850 -32.634 -12.623 1.00 5.31 C ATOM 466 O ASN A 33 -15.908 -33.187 -11.524 1.00 42.22 O ATOM 467 CB ASN A 33 -16.321 -34.104 -14.591 1.00 3.30 C ATOM 468 CG ASN A 33 -16.645 -35.470 -14.018 1.00 61.22 C ATOM 469 OD1 ASN A 33 -17.565 -36.146 -14.479 1.00 43.52 O ATOM 470 ND2 ASN A 33 -15.887 -35.883 -13.009 1.00 2.02 N ATOM 0 H ASN A 33 -16.958 -31.920 -15.536 1.00 0.41 H new ATOM 0 HA ASN A 33 -17.788 -33.281 -13.253 1.00 71.43 H new ATOM 0 HB2 ASN A 33 -16.745 -34.023 -15.592 1.00 3.30 H new ATOM 0 HB3 ASN A 33 -15.241 -34.003 -14.693 1.00 3.30 H new ATOM 0 HD21 ASN A 33 -16.057 -36.794 -12.584 1.00 2.02 H new ATOM 0 HD22 ASN A 33 -15.135 -35.289 -12.659 1.00 2.02 H new ATOM 477 N LYS A 34 -14.927 -31.727 -12.927 1.00 61.14 N ATOM 478 CA LYS A 34 -13.908 -31.320 -11.967 1.00 61.34 C ATOM 479 C LYS A 34 -14.074 -29.851 -11.589 1.00 34.21 C ATOM 480 O LYS A 34 -13.511 -29.387 -10.597 1.00 0.52 O ATOM 481 CB LYS A 34 -12.511 -31.555 -12.544 1.00 4.45 C ATOM 482 CG LYS A 34 -12.295 -30.904 -13.900 1.00 54.12 C ATOM 483 CD LYS A 34 -11.742 -31.892 -14.912 1.00 72.43 C ATOM 484 CE LYS A 34 -10.285 -32.225 -14.627 1.00 73.13 C ATOM 485 NZ LYS A 34 -10.150 -33.278 -13.583 1.00 34.51 N ATOM 0 H LYS A 34 -14.864 -31.260 -13.832 1.00 61.14 H new ATOM 0 HA LYS A 34 -14.028 -31.925 -11.068 1.00 61.34 H new ATOM 0 HB2 LYS A 34 -11.769 -31.172 -11.844 1.00 4.45 H new ATOM 0 HB3 LYS A 34 -12.340 -32.628 -12.634 1.00 4.45 H new ATOM 0 HG2 LYS A 34 -13.239 -30.499 -14.264 1.00 54.12 H new ATOM 0 HG3 LYS A 34 -11.607 -30.065 -13.796 1.00 54.12 H new ATOM 0 HD2 LYS A 34 -12.336 -32.806 -14.892 1.00 72.43 H new ATOM 0 HD3 LYS A 34 -11.832 -31.475 -15.915 1.00 72.43 H new ATOM 0 HE2 LYS A 34 -9.803 -32.560 -15.545 1.00 73.13 H new ATOM 0 HE3 LYS A 34 -9.763 -31.324 -14.304 1.00 73.13 H new ATOM 0 HZ1 LYS A 34 -9.259 -33.795 -13.725 1.00 34.51 H new ATOM 0 HZ2 LYS A 34 -10.148 -32.835 -12.642 1.00 34.51 H new ATOM 0 HZ3 LYS A 34 -10.949 -33.940 -13.652 1.00 34.51 H new ATOM 499 N VAL A 35 -14.849 -29.123 -12.386 1.00 34.33 N ATOM 500 CA VAL A 35 -15.091 -27.708 -12.134 1.00 51.44 C ATOM 501 C VAL A 35 -16.293 -27.510 -11.217 1.00 12.33 C ATOM 502 O VAL A 35 -16.191 -26.873 -10.168 1.00 34.24 O ATOM 503 CB VAL A 35 -15.327 -26.936 -13.445 1.00 22.45 C ATOM 504 CG1 VAL A 35 -15.940 -25.573 -13.161 1.00 52.31 C ATOM 505 CG2 VAL A 35 -14.026 -26.793 -14.220 1.00 15.43 C ATOM 0 H VAL A 35 -15.320 -29.490 -13.213 1.00 34.33 H new ATOM 0 HA VAL A 35 -14.198 -27.317 -11.647 1.00 51.44 H new ATOM 0 HB VAL A 35 -16.029 -27.502 -14.058 1.00 22.45 H new ATOM 0 HG11 VAL A 35 -16.099 -25.043 -14.100 1.00 52.31 H new ATOM 0 HG12 VAL A 35 -16.895 -25.702 -12.651 1.00 52.31 H new ATOM 0 HG13 VAL A 35 -15.266 -24.996 -12.528 1.00 52.31 H new ATOM 0 HG21 VAL A 35 -14.211 -26.245 -15.144 1.00 15.43 H new ATOM 0 HG22 VAL A 35 -13.300 -26.250 -13.615 1.00 15.43 H new ATOM 0 HG23 VAL A 35 -13.633 -27.782 -14.457 1.00 15.43 H new ATOM 515 N THR A 36 -17.434 -28.060 -11.620 1.00 23.22 N ATOM 516 CA THR A 36 -18.657 -27.945 -10.836 1.00 25.31 C ATOM 517 C THR A 36 -18.481 -28.553 -9.449 1.00 21.25 C ATOM 518 O THR A 36 -19.221 -28.229 -8.520 1.00 61.41 O ATOM 519 CB THR A 36 -19.843 -28.633 -11.539 1.00 24.40 C ATOM 520 OG1 THR A 36 -21.050 -27.905 -11.287 1.00 52.21 O ATOM 521 CG2 THR A 36 -19.999 -30.067 -11.057 1.00 14.11 C ATOM 0 H THR A 36 -17.536 -28.590 -12.486 1.00 23.22 H new ATOM 0 HA THR A 36 -18.870 -26.880 -10.739 1.00 25.31 H new ATOM 0 HB THR A 36 -19.645 -28.647 -12.611 1.00 24.40 H new ATOM 0 HG1 THR A 36 -21.799 -28.347 -11.738 1.00 52.21 H new ATOM 0 HG21 THR A 36 -20.842 -30.533 -11.567 1.00 14.11 H new ATOM 0 HG22 THR A 36 -19.089 -30.626 -11.276 1.00 14.11 H new ATOM 0 HG23 THR A 36 -20.178 -30.072 -9.982 1.00 14.11 H new ATOM 529 N SER A 37 -17.497 -29.436 -9.316 1.00 14.22 N ATOM 530 CA SER A 37 -17.225 -30.093 -8.042 1.00 52.32 C ATOM 531 C SER A 37 -16.443 -29.171 -7.112 1.00 53.20 C ATOM 532 O SER A 37 -16.492 -29.317 -5.890 1.00 32.53 O ATOM 533 CB SER A 37 -16.445 -31.389 -8.269 1.00 12.31 C ATOM 534 OG SER A 37 -16.674 -32.312 -7.218 1.00 23.30 O ATOM 0 H SER A 37 -16.874 -29.713 -10.075 1.00 14.22 H new ATOM 0 HA SER A 37 -18.179 -30.330 -7.572 1.00 52.32 H new ATOM 0 HB2 SER A 37 -16.741 -31.834 -9.219 1.00 12.31 H new ATOM 0 HB3 SER A 37 -15.380 -31.169 -8.338 1.00 12.31 H new ATOM 0 HG SER A 37 -16.166 -33.133 -7.387 1.00 23.30 H new ATOM 540 N CYS A 38 -15.723 -28.221 -7.698 1.00 31.15 N ATOM 541 CA CYS A 38 -14.929 -27.275 -6.922 1.00 55.44 C ATOM 542 C CYS A 38 -15.824 -26.405 -6.046 1.00 24.01 C ATOM 543 O CYS A 38 -16.380 -25.407 -6.506 1.00 1.31 O ATOM 544 CB CYS A 38 -14.096 -26.394 -7.855 1.00 50.43 C ATOM 545 SG CYS A 38 -12.658 -25.635 -7.061 1.00 51.34 S ATOM 0 H CYS A 38 -15.673 -28.085 -8.708 1.00 31.15 H new ATOM 0 HA CYS A 38 -14.260 -27.843 -6.275 1.00 55.44 H new ATOM 0 HB2 CYS A 38 -13.757 -26.995 -8.699 1.00 50.43 H new ATOM 0 HB3 CYS A 38 -14.733 -25.607 -8.259 1.00 50.43 H new ATOM 0 HG CYS A 38 -11.647 -25.662 -7.877 1.00 51.34 H new ATOM 551 N ASN A 39 -15.960 -26.790 -4.781 1.00 43.53 N ATOM 552 CA ASN A 39 -16.789 -26.046 -3.841 1.00 34.53 C ATOM 553 C ASN A 39 -15.927 -25.211 -2.898 1.00 40.14 C ATOM 554 O ASN A 39 -16.402 -24.731 -1.869 1.00 34.52 O ATOM 555 CB ASN A 39 -17.666 -27.005 -3.033 1.00 62.21 C ATOM 556 CG ASN A 39 -16.874 -28.155 -2.442 1.00 2.12 C ATOM 557 OD1 ASN A 39 -15.974 -27.949 -1.626 1.00 62.30 O ATOM 558 ND2 ASN A 39 -17.204 -29.374 -2.853 1.00 54.11 N ATOM 0 H ASN A 39 -15.507 -27.613 -4.384 1.00 43.53 H new ATOM 0 HA ASN A 39 -17.428 -25.373 -4.412 1.00 34.53 H new ATOM 0 HB2 ASN A 39 -18.157 -26.455 -2.230 1.00 62.21 H new ATOM 0 HB3 ASN A 39 -18.453 -27.401 -3.675 1.00 62.21 H new ATOM 0 HD21 ASN A 39 -16.705 -30.187 -2.491 1.00 54.11 H new ATOM 0 HD22 ASN A 39 -17.956 -29.498 -3.530 1.00 54.11 H new ATOM 565 N ASP A 40 -14.661 -25.041 -3.259 1.00 45.34 N ATOM 566 CA ASP A 40 -13.732 -24.262 -2.447 1.00 20.02 C ATOM 567 C ASP A 40 -13.692 -22.809 -2.910 1.00 50.34 C ATOM 568 O ASP A 40 -12.767 -22.068 -2.579 1.00 73.13 O ATOM 569 CB ASP A 40 -12.330 -24.871 -2.512 1.00 44.11 C ATOM 570 CG ASP A 40 -12.194 -26.106 -1.643 1.00 41.31 C ATOM 571 OD1 ASP A 40 -13.232 -26.722 -1.320 1.00 41.24 O ATOM 572 OD2 ASP A 40 -11.050 -26.457 -1.287 1.00 0.11 O ATOM 0 H ASP A 40 -14.253 -25.432 -4.108 1.00 45.34 H new ATOM 0 HA ASP A 40 -14.082 -24.286 -1.415 1.00 20.02 H new ATOM 0 HB2 ASP A 40 -12.097 -25.130 -3.545 1.00 44.11 H new ATOM 0 HB3 ASP A 40 -11.599 -24.127 -2.197 1.00 44.11 H new ATOM 577 N ASN A 41 -14.700 -22.411 -3.678 1.00 64.15 N ATOM 578 CA ASN A 41 -14.779 -21.047 -4.188 1.00 33.45 C ATOM 579 C ASN A 41 -13.476 -20.647 -4.876 1.00 33.24 C ATOM 580 O ASN A 41 -13.028 -19.506 -4.763 1.00 50.23 O ATOM 581 CB ASN A 41 -15.088 -20.072 -3.051 1.00 65.20 C ATOM 582 CG ASN A 41 -16.384 -20.406 -2.339 1.00 23.13 C ATOM 583 OD1 ASN A 41 -16.444 -20.419 -1.109 1.00 25.31 O ATOM 584 ND2 ASN A 41 -17.429 -20.680 -3.111 1.00 63.34 N ATOM 0 H ASN A 41 -15.473 -23.013 -3.961 1.00 64.15 H new ATOM 0 HA ASN A 41 -15.584 -21.006 -4.921 1.00 33.45 H new ATOM 0 HB2 ASN A 41 -14.268 -20.085 -2.333 1.00 65.20 H new ATOM 0 HB3 ASN A 41 -15.147 -19.059 -3.450 1.00 65.20 H new ATOM 0 HD21 ASN A 41 -18.328 -20.913 -2.689 1.00 63.34 H new ATOM 0 HD22 ASN A 41 -17.333 -20.657 -4.126 1.00 63.34 H new ATOM 591 N ILE A 42 -12.876 -21.594 -5.589 1.00 30.15 N ATOM 592 CA ILE A 42 -11.627 -21.340 -6.296 1.00 31.32 C ATOM 593 C ILE A 42 -11.870 -21.139 -7.787 1.00 41.34 C ATOM 594 O ILE A 42 -12.506 -21.968 -8.441 1.00 12.51 O ATOM 595 CB ILE A 42 -10.625 -22.494 -6.101 1.00 40.33 C ATOM 596 CG1 ILE A 42 -10.486 -22.832 -4.616 1.00 31.15 C ATOM 597 CG2 ILE A 42 -9.273 -22.128 -6.696 1.00 3.31 C ATOM 598 CD1 ILE A 42 -9.513 -23.958 -4.341 1.00 74.15 C ATOM 0 H ILE A 42 -13.234 -22.543 -5.692 1.00 30.15 H new ATOM 0 HA ILE A 42 -11.205 -20.428 -5.873 1.00 31.32 H new ATOM 0 HB ILE A 42 -11.002 -23.375 -6.621 1.00 40.33 H new ATOM 0 HG12 ILE A 42 -10.160 -21.942 -4.078 1.00 31.15 H new ATOM 0 HG13 ILE A 42 -11.465 -23.103 -4.220 1.00 31.15 H new ATOM 0 HG21 ILE A 42 -8.576 -22.953 -6.550 1.00 3.31 H new ATOM 0 HG22 ILE A 42 -9.386 -21.932 -7.762 1.00 3.31 H new ATOM 0 HG23 ILE A 42 -8.888 -21.236 -6.202 1.00 3.31 H new ATOM 0 HD11 ILE A 42 -9.465 -24.143 -3.268 1.00 74.15 H new ATOM 0 HD12 ILE A 42 -9.848 -24.861 -4.851 1.00 74.15 H new ATOM 0 HD13 ILE A 42 -8.524 -23.681 -4.706 1.00 74.15 H new ATOM 610 N LEU A 43 -11.359 -20.035 -8.321 1.00 40.54 N ATOM 611 CA LEU A 43 -11.520 -19.726 -9.738 1.00 63.50 C ATOM 612 C LEU A 43 -10.547 -20.538 -10.586 1.00 24.21 C ATOM 613 O LEU A 43 -9.331 -20.453 -10.407 1.00 62.32 O ATOM 614 CB LEU A 43 -11.301 -18.232 -9.982 1.00 50.44 C ATOM 615 CG LEU A 43 -10.002 -17.643 -9.429 1.00 62.42 C ATOM 616 CD1 LEU A 43 -9.001 -17.417 -10.550 1.00 51.24 C ATOM 617 CD2 LEU A 43 -10.279 -16.344 -8.686 1.00 42.21 C ATOM 0 H LEU A 43 -10.830 -19.339 -7.795 1.00 40.54 H new ATOM 0 HA LEU A 43 -12.536 -19.991 -10.029 1.00 63.50 H new ATOM 0 HB2 LEU A 43 -11.329 -18.052 -11.057 1.00 50.44 H new ATOM 0 HB3 LEU A 43 -12.138 -17.687 -9.546 1.00 50.44 H new ATOM 0 HG LEU A 43 -9.572 -18.355 -8.724 1.00 62.42 H new ATOM 0 HD11 LEU A 43 -8.083 -16.998 -10.139 1.00 51.24 H new ATOM 0 HD12 LEU A 43 -8.780 -18.367 -11.037 1.00 51.24 H new ATOM 0 HD13 LEU A 43 -9.421 -16.724 -11.279 1.00 51.24 H new ATOM 0 HD21 LEU A 43 -9.344 -15.939 -8.300 1.00 42.21 H new ATOM 0 HD22 LEU A 43 -10.732 -15.624 -9.368 1.00 42.21 H new ATOM 0 HD23 LEU A 43 -10.961 -16.537 -7.858 1.00 42.21 H new ATOM 629 N ILE A 44 -11.088 -21.323 -11.511 1.00 21.31 N ATOM 630 CA ILE A 44 -10.268 -22.148 -12.388 1.00 65.53 C ATOM 631 C ILE A 44 -10.086 -21.488 -13.751 1.00 4.02 C ATOM 632 O ILE A 44 -11.056 -21.245 -14.470 1.00 24.12 O ATOM 633 CB ILE A 44 -10.884 -23.545 -12.586 1.00 53.24 C ATOM 634 CG1 ILE A 44 -11.042 -24.253 -11.239 1.00 74.33 C ATOM 635 CG2 ILE A 44 -10.024 -24.375 -13.528 1.00 30.21 C ATOM 636 CD1 ILE A 44 -12.439 -24.158 -10.667 1.00 1.45 C ATOM 0 H ILE A 44 -12.092 -21.405 -11.672 1.00 21.31 H new ATOM 0 HA ILE A 44 -9.297 -22.253 -11.904 1.00 65.53 H new ATOM 0 HB ILE A 44 -11.871 -23.430 -13.033 1.00 53.24 H new ATOM 0 HG12 ILE A 44 -10.777 -25.304 -11.357 1.00 74.33 H new ATOM 0 HG13 ILE A 44 -10.337 -23.824 -10.527 1.00 74.33 H new ATOM 0 HG21 ILE A 44 -10.473 -25.360 -13.658 1.00 30.21 H new ATOM 0 HG22 ILE A 44 -9.958 -23.876 -14.495 1.00 30.21 H new ATOM 0 HG23 ILE A 44 -9.025 -24.484 -13.107 1.00 30.21 H new ATOM 0 HD11 ILE A 44 -12.478 -24.682 -9.712 1.00 1.45 H new ATOM 0 HD12 ILE A 44 -12.700 -23.110 -10.517 1.00 1.45 H new ATOM 0 HD13 ILE A 44 -13.147 -24.613 -11.359 1.00 1.45 H new ATOM 648 N LEU A 45 -8.837 -21.200 -14.101 1.00 43.35 N ATOM 649 CA LEU A 45 -8.526 -20.569 -15.379 1.00 3.23 C ATOM 650 C LEU A 45 -8.208 -21.618 -16.440 1.00 11.21 C ATOM 651 O LEU A 45 -7.117 -22.187 -16.459 1.00 74.13 O ATOM 652 CB LEU A 45 -7.344 -19.611 -15.223 1.00 44.40 C ATOM 653 CG LEU A 45 -7.696 -18.157 -14.906 1.00 62.25 C ATOM 654 CD1 LEU A 45 -7.662 -17.914 -13.404 1.00 40.02 C ATOM 655 CD2 LEU A 45 -6.746 -17.209 -15.623 1.00 41.32 C ATOM 0 H LEU A 45 -8.023 -21.393 -13.517 1.00 43.35 H new ATOM 0 HA LEU A 45 -9.402 -20.006 -15.701 1.00 3.23 H new ATOM 0 HB2 LEU A 45 -6.698 -19.989 -14.430 1.00 44.40 H new ATOM 0 HB3 LEU A 45 -6.762 -19.630 -16.145 1.00 44.40 H new ATOM 0 HG LEU A 45 -8.708 -17.963 -15.262 1.00 62.25 H new ATOM 0 HD11 LEU A 45 -7.915 -16.874 -13.198 1.00 40.02 H new ATOM 0 HD12 LEU A 45 -8.384 -18.567 -12.913 1.00 40.02 H new ATOM 0 HD13 LEU A 45 -6.663 -18.127 -13.024 1.00 40.02 H new ATOM 0 HD21 LEU A 45 -7.012 -16.179 -15.386 1.00 41.32 H new ATOM 0 HD22 LEU A 45 -5.724 -17.404 -15.299 1.00 41.32 H new ATOM 0 HD23 LEU A 45 -6.821 -17.364 -16.699 1.00 41.32 H new ATOM 667 N VAL A 46 -9.169 -21.866 -17.326 1.00 2.42 N ATOM 668 CA VAL A 46 -8.991 -22.843 -18.393 1.00 64.44 C ATOM 669 C VAL A 46 -8.613 -22.162 -19.703 1.00 14.45 C ATOM 670 O VAL A 46 -9.373 -21.354 -20.237 1.00 14.22 O ATOM 671 CB VAL A 46 -10.268 -23.677 -18.609 1.00 13.24 C ATOM 672 CG1 VAL A 46 -10.490 -24.626 -17.442 1.00 34.10 C ATOM 673 CG2 VAL A 46 -11.470 -22.766 -18.805 1.00 71.13 C ATOM 0 H VAL A 46 -10.078 -21.403 -17.325 1.00 2.42 H new ATOM 0 HA VAL A 46 -8.182 -23.505 -18.085 1.00 64.44 H new ATOM 0 HB VAL A 46 -10.144 -24.275 -19.512 1.00 13.24 H new ATOM 0 HG11 VAL A 46 -11.397 -25.207 -17.613 1.00 34.10 H new ATOM 0 HG12 VAL A 46 -9.638 -25.300 -17.354 1.00 34.10 H new ATOM 0 HG13 VAL A 46 -10.595 -24.052 -16.521 1.00 34.10 H new ATOM 0 HG21 VAL A 46 -12.364 -23.371 -18.956 1.00 71.13 H new ATOM 0 HG22 VAL A 46 -11.600 -22.140 -17.922 1.00 71.13 H new ATOM 0 HG23 VAL A 46 -11.308 -22.133 -19.677 1.00 71.13 H new ATOM 683 N ASP A 47 -7.434 -22.494 -20.218 1.00 71.33 N ATOM 684 CA ASP A 47 -6.955 -21.916 -21.468 1.00 75.44 C ATOM 685 C ASP A 47 -7.200 -22.867 -22.635 1.00 44.42 C ATOM 686 O ASP A 47 -7.438 -24.059 -22.439 1.00 2.15 O ATOM 687 CB ASP A 47 -5.464 -21.589 -21.365 1.00 2.13 C ATOM 688 CG ASP A 47 -4.586 -22.795 -21.636 1.00 51.30 C ATOM 689 OD1 ASP A 47 -4.422 -23.155 -22.819 1.00 35.11 O ATOM 690 OD2 ASP A 47 -4.064 -23.379 -20.662 1.00 25.30 O ATOM 0 H ASP A 47 -6.792 -23.161 -19.789 1.00 71.33 H new ATOM 0 HA ASP A 47 -7.509 -20.995 -21.650 1.00 75.44 H new ATOM 0 HB2 ASP A 47 -5.219 -20.798 -22.074 1.00 2.13 H new ATOM 0 HB3 ASP A 47 -5.248 -21.202 -20.369 1.00 2.13 H new ATOM 695 N PHE A 48 -7.141 -22.332 -23.850 1.00 52.31 N ATOM 696 CA PHE A 48 -7.358 -23.131 -25.050 1.00 61.22 C ATOM 697 C PHE A 48 -6.032 -23.614 -25.630 1.00 3.21 C ATOM 698 O PHE A 48 -4.990 -22.990 -25.428 1.00 44.32 O ATOM 699 CB PHE A 48 -8.122 -22.320 -26.099 1.00 14.53 C ATOM 700 CG PHE A 48 -9.533 -21.999 -25.699 1.00 12.12 C ATOM 701 CD1 PHE A 48 -10.471 -23.009 -25.550 1.00 52.21 C ATOM 702 CD2 PHE A 48 -9.923 -20.690 -25.471 1.00 11.40 C ATOM 703 CE1 PHE A 48 -11.771 -22.718 -25.182 1.00 54.22 C ATOM 704 CE2 PHE A 48 -11.222 -20.392 -25.103 1.00 0.41 C ATOM 705 CZ PHE A 48 -12.147 -21.409 -24.959 1.00 2.15 C ATOM 0 H PHE A 48 -6.944 -21.347 -24.029 1.00 52.31 H new ATOM 0 HA PHE A 48 -7.951 -24.002 -24.773 1.00 61.22 H new ATOM 0 HB2 PHE A 48 -7.586 -21.390 -26.288 1.00 14.53 H new ATOM 0 HB3 PHE A 48 -8.136 -22.876 -27.036 1.00 14.53 H new ATOM 0 HD1 PHE A 48 -10.182 -24.035 -25.724 1.00 52.21 H new ATOM 0 HD2 PHE A 48 -9.204 -19.892 -25.582 1.00 11.40 H new ATOM 0 HE1 PHE A 48 -12.492 -23.514 -25.069 1.00 54.22 H new ATOM 0 HE2 PHE A 48 -11.513 -19.367 -24.928 1.00 0.41 H new ATOM 0 HZ PHE A 48 -13.163 -21.180 -24.672 1.00 2.15 H new ATOM 884 N GLU A 60 2.757 -18.437 -21.256 1.00 12.25 N ATOM 885 CA GLU A 60 2.952 -17.385 -20.265 1.00 32.45 C ATOM 886 C GLU A 60 3.211 -17.979 -18.884 1.00 55.42 C ATOM 887 O GLU A 60 2.320 -18.536 -18.243 1.00 62.12 O ATOM 888 CB GLU A 60 1.728 -16.468 -20.216 1.00 30.34 C ATOM 889 CG GLU A 60 2.070 -15.008 -19.967 1.00 32.33 C ATOM 890 CD GLU A 60 2.934 -14.416 -21.064 1.00 23.13 C ATOM 891 OE1 GLU A 60 2.746 -14.798 -22.238 1.00 50.14 O ATOM 892 OE2 GLU A 60 3.795 -13.570 -20.748 1.00 35.42 O ATOM 0 HA GLU A 60 3.824 -16.801 -20.559 1.00 32.45 H new ATOM 0 HB2 GLU A 60 1.185 -16.550 -21.158 1.00 30.34 H new ATOM 0 HB3 GLU A 60 1.056 -16.814 -19.430 1.00 30.34 H new ATOM 0 HG2 GLU A 60 1.148 -14.432 -19.885 1.00 32.33 H new ATOM 0 HG3 GLU A 60 2.589 -14.918 -19.013 1.00 32.33 H new ATOM 899 N PRO A 61 4.461 -17.859 -18.414 1.00 14.41 N ATOM 900 CA PRO A 61 4.868 -18.377 -17.104 1.00 50.20 C ATOM 901 C PRO A 61 4.254 -17.589 -15.952 1.00 41.53 C ATOM 902 O PRO A 61 4.096 -18.109 -14.849 1.00 22.32 O ATOM 903 CB PRO A 61 6.390 -18.212 -17.115 1.00 62.02 C ATOM 904 CG PRO A 61 6.644 -17.100 -18.072 1.00 1.52 C ATOM 905 CD PRO A 61 5.575 -17.207 -19.125 1.00 3.21 C ATOM 0 HA PRO A 61 4.538 -19.405 -16.952 1.00 50.20 H new ATOM 0 HB2 PRO A 61 6.769 -17.973 -16.121 1.00 62.02 H new ATOM 0 HB3 PRO A 61 6.885 -19.129 -17.434 1.00 62.02 H new ATOM 0 HG2 PRO A 61 6.600 -16.134 -17.568 1.00 1.52 H new ATOM 0 HG3 PRO A 61 7.637 -17.185 -18.514 1.00 1.52 H new ATOM 0 HD2 PRO A 61 5.289 -16.228 -19.508 1.00 3.21 H new ATOM 0 HD3 PRO A 61 5.909 -17.798 -19.978 1.00 3.21 H new ATOM 913 N GLN A 62 3.911 -16.333 -16.218 1.00 11.15 N ATOM 914 CA GLN A 62 3.315 -15.474 -15.202 1.00 4.33 C ATOM 915 C GLN A 62 2.070 -16.119 -14.606 1.00 54.12 C ATOM 916 O GLN A 62 1.773 -15.945 -13.423 1.00 64.54 O ATOM 917 CB GLN A 62 2.960 -14.110 -15.801 1.00 70.43 C ATOM 918 CG GLN A 62 4.136 -13.415 -16.469 1.00 42.43 C ATOM 919 CD GLN A 62 3.721 -12.177 -17.239 1.00 2.22 C ATOM 920 OE1 GLN A 62 4.297 -11.102 -17.067 1.00 72.41 O ATOM 921 NE2 GLN A 62 2.716 -12.321 -18.094 1.00 53.33 N ATOM 0 H GLN A 62 4.035 -15.888 -17.127 1.00 11.15 H new ATOM 0 HA GLN A 62 4.046 -15.335 -14.406 1.00 4.33 H new ATOM 0 HB2 GLN A 62 2.162 -14.240 -16.532 1.00 70.43 H new ATOM 0 HB3 GLN A 62 2.568 -13.467 -15.013 1.00 70.43 H new ATOM 0 HG2 GLN A 62 4.868 -13.138 -15.710 1.00 42.43 H new ATOM 0 HG3 GLN A 62 4.628 -14.112 -17.147 1.00 42.43 H new ATOM 0 HE21 GLN A 62 2.267 -13.230 -18.205 1.00 53.33 H new ATOM 0 HE22 GLN A 62 2.393 -11.522 -18.640 1.00 53.33 H new ATOM 930 N LEU A 63 1.343 -16.865 -15.430 1.00 3.30 N ATOM 931 CA LEU A 63 0.127 -17.538 -14.984 1.00 51.52 C ATOM 932 C LEU A 63 0.443 -18.585 -13.921 1.00 11.10 C ATOM 933 O LEU A 63 -0.201 -18.635 -12.875 1.00 50.22 O ATOM 934 CB LEU A 63 -0.580 -18.196 -16.170 1.00 63.14 C ATOM 935 CG LEU A 63 -1.276 -17.246 -17.147 1.00 4.31 C ATOM 936 CD1 LEU A 63 -1.488 -17.926 -18.491 1.00 33.34 C ATOM 937 CD2 LEU A 63 -2.603 -16.770 -16.573 1.00 44.21 C ATOM 0 H LEU A 63 1.574 -17.020 -16.411 1.00 3.30 H new ATOM 0 HA LEU A 63 -0.533 -16.789 -14.546 1.00 51.52 H new ATOM 0 HB2 LEU A 63 0.153 -18.783 -16.724 1.00 63.14 H new ATOM 0 HB3 LEU A 63 -1.322 -18.895 -15.783 1.00 63.14 H new ATOM 0 HG LEU A 63 -0.636 -16.377 -17.299 1.00 4.31 H new ATOM 0 HD11 LEU A 63 -1.984 -17.236 -19.174 1.00 33.34 H new ATOM 0 HD12 LEU A 63 -0.524 -18.218 -18.907 1.00 33.34 H new ATOM 0 HD13 LEU A 63 -2.108 -18.812 -18.357 1.00 33.34 H new ATOM 0 HD21 LEU A 63 -3.084 -16.095 -17.281 1.00 44.21 H new ATOM 0 HD22 LEU A 63 -3.250 -17.628 -16.392 1.00 44.21 H new ATOM 0 HD23 LEU A 63 -2.426 -16.245 -15.634 1.00 44.21 H new ATOM 949 N GLU A 64 1.441 -19.418 -14.198 1.00 45.21 N ATOM 950 CA GLU A 64 1.844 -20.464 -13.264 1.00 2.31 C ATOM 951 C GLU A 64 2.541 -19.866 -12.046 1.00 45.41 C ATOM 952 O GLU A 64 2.375 -20.345 -10.924 1.00 21.22 O ATOM 953 CB GLU A 64 2.771 -21.467 -13.955 1.00 23.31 C ATOM 954 CG GLU A 64 2.249 -21.954 -15.297 1.00 22.31 C ATOM 955 CD GLU A 64 2.969 -23.194 -15.787 1.00 12.53 C ATOM 956 OE1 GLU A 64 2.632 -24.301 -15.318 1.00 32.21 O ATOM 957 OE2 GLU A 64 3.871 -23.058 -16.641 1.00 51.52 O ATOM 0 H GLU A 64 1.985 -19.389 -15.060 1.00 45.21 H new ATOM 0 HA GLU A 64 0.946 -20.982 -12.929 1.00 2.31 H new ATOM 0 HB2 GLU A 64 3.748 -21.006 -14.100 1.00 23.31 H new ATOM 0 HB3 GLU A 64 2.918 -22.325 -13.299 1.00 23.31 H new ATOM 0 HG2 GLU A 64 1.183 -22.167 -15.213 1.00 22.31 H new ATOM 0 HG3 GLU A 64 2.358 -21.159 -16.035 1.00 22.31 H new ATOM 964 N LYS A 65 3.323 -18.817 -12.275 1.00 53.21 N ATOM 965 CA LYS A 65 4.046 -18.151 -11.198 1.00 34.44 C ATOM 966 C LYS A 65 3.081 -17.616 -10.144 1.00 3.12 C ATOM 967 O LYS A 65 3.255 -17.857 -8.949 1.00 2.53 O ATOM 968 CB LYS A 65 4.894 -17.007 -11.756 1.00 20.12 C ATOM 969 CG LYS A 65 6.140 -17.475 -12.490 1.00 22.54 C ATOM 970 CD LYS A 65 7.281 -17.757 -11.527 1.00 64.11 C ATOM 971 CE LYS A 65 7.873 -16.471 -10.971 1.00 75.14 C ATOM 972 NZ LYS A 65 9.263 -16.669 -10.478 1.00 55.11 N ATOM 0 H LYS A 65 3.473 -18.409 -13.198 1.00 53.21 H new ATOM 0 HA LYS A 65 4.701 -18.884 -10.727 1.00 34.44 H new ATOM 0 HB2 LYS A 65 4.284 -16.412 -12.436 1.00 20.12 H new ATOM 0 HB3 LYS A 65 5.190 -16.352 -10.937 1.00 20.12 H new ATOM 0 HG2 LYS A 65 5.911 -18.376 -13.059 1.00 22.54 H new ATOM 0 HG3 LYS A 65 6.448 -16.715 -13.208 1.00 22.54 H new ATOM 0 HD2 LYS A 65 6.921 -18.377 -10.706 1.00 64.11 H new ATOM 0 HD3 LYS A 65 8.058 -18.325 -12.039 1.00 64.11 H new ATOM 0 HE2 LYS A 65 7.868 -15.704 -11.746 1.00 75.14 H new ATOM 0 HE3 LYS A 65 7.247 -16.105 -10.157 1.00 75.14 H new ATOM 0 HZ1 LYS A 65 9.631 -15.770 -10.107 1.00 55.11 H new ATOM 0 HZ2 LYS A 65 9.265 -17.382 -9.721 1.00 55.11 H new ATOM 0 HZ3 LYS A 65 9.866 -16.993 -11.261 1.00 55.11 H new ATOM 986 N LEU A 66 2.064 -16.890 -10.594 1.00 62.23 N ATOM 987 CA LEU A 66 1.070 -16.321 -9.691 1.00 42.40 C ATOM 988 C LEU A 66 0.103 -17.394 -9.201 1.00 34.31 C ATOM 989 O LEU A 66 -0.385 -17.337 -8.073 1.00 43.55 O ATOM 990 CB LEU A 66 0.297 -15.202 -10.391 1.00 35.22 C ATOM 991 CG LEU A 66 0.884 -13.796 -10.258 1.00 12.31 C ATOM 992 CD1 LEU A 66 0.900 -13.359 -8.802 1.00 3.13 C ATOM 993 CD2 LEU A 66 2.286 -13.747 -10.847 1.00 20.50 C ATOM 0 H LEU A 66 1.906 -16.681 -11.580 1.00 62.23 H new ATOM 0 HA LEU A 66 1.593 -15.908 -8.828 1.00 42.40 H new ATOM 0 HB2 LEU A 66 0.225 -15.445 -11.451 1.00 35.22 H new ATOM 0 HB3 LEU A 66 -0.719 -15.188 -9.997 1.00 35.22 H new ATOM 0 HG LEU A 66 0.252 -13.105 -10.816 1.00 12.31 H new ATOM 0 HD11 LEU A 66 1.321 -12.356 -8.728 1.00 3.13 H new ATOM 0 HD12 LEU A 66 -0.118 -13.355 -8.412 1.00 3.13 H new ATOM 0 HD13 LEU A 66 1.508 -14.052 -8.221 1.00 3.13 H new ATOM 0 HD21 LEU A 66 2.689 -12.739 -10.744 1.00 20.50 H new ATOM 0 HD22 LEU A 66 2.928 -14.450 -10.317 1.00 20.50 H new ATOM 0 HD23 LEU A 66 2.247 -14.016 -11.903 1.00 20.50 H new ATOM 1005 N ALA A 67 -0.170 -18.373 -10.058 1.00 62.40 N ATOM 1006 CA ALA A 67 -1.076 -19.461 -9.710 1.00 31.15 C ATOM 1007 C ALA A 67 -0.642 -20.145 -8.419 1.00 1.14 C ATOM 1008 O ALA A 67 -1.476 -20.617 -7.645 1.00 75.05 O ATOM 1009 CB ALA A 67 -1.147 -20.471 -10.846 1.00 20.14 C ATOM 0 H ALA A 67 0.223 -18.435 -10.997 1.00 62.40 H new ATOM 0 HA ALA A 67 -2.068 -19.038 -9.551 1.00 31.15 H new ATOM 0 HB1 ALA A 67 -1.827 -21.278 -10.573 1.00 20.14 H new ATOM 0 HB2 ALA A 67 -1.511 -19.979 -11.748 1.00 20.14 H new ATOM 0 HB3 ALA A 67 -0.154 -20.880 -11.032 1.00 20.14 H new ATOM 1015 N GLN A 68 0.667 -20.197 -8.192 1.00 12.15 N ATOM 1016 CA GLN A 68 1.210 -20.826 -6.994 1.00 64.31 C ATOM 1017 C GLN A 68 1.125 -19.883 -5.798 1.00 50.20 C ATOM 1018 O GLN A 68 0.975 -20.323 -4.659 1.00 5.42 O ATOM 1019 CB GLN A 68 2.663 -21.244 -7.225 1.00 4.24 C ATOM 1020 CG GLN A 68 2.806 -22.559 -7.975 1.00 32.35 C ATOM 1021 CD GLN A 68 4.241 -22.858 -8.361 1.00 43.12 C ATOM 1022 OE1 GLN A 68 4.903 -23.686 -7.735 1.00 72.41 O ATOM 1023 NE2 GLN A 68 4.729 -22.184 -9.395 1.00 1.41 N ATOM 0 H GLN A 68 1.371 -19.811 -8.822 1.00 12.15 H new ATOM 0 HA GLN A 68 0.614 -21.713 -6.778 1.00 64.31 H new ATOM 0 HB2 GLN A 68 3.174 -20.459 -7.783 1.00 4.24 H new ATOM 0 HB3 GLN A 68 3.166 -21.328 -6.262 1.00 4.24 H new ATOM 0 HG2 GLN A 68 2.424 -23.370 -7.355 1.00 32.35 H new ATOM 0 HG3 GLN A 68 2.191 -22.529 -8.874 1.00 32.35 H new ATOM 0 HE21 GLN A 68 4.144 -21.507 -9.884 1.00 1.41 H new ATOM 0 HE22 GLN A 68 5.689 -22.343 -9.700 1.00 1.41 H new ATOM 1032 N GLN A 69 1.221 -18.584 -6.066 1.00 75.41 N ATOM 1033 CA GLN A 69 1.155 -17.580 -5.011 1.00 73.40 C ATOM 1034 C GLN A 69 -0.271 -17.427 -4.493 1.00 43.13 C ATOM 1035 O GLN A 69 -0.486 -17.068 -3.336 1.00 45.10 O ATOM 1036 CB GLN A 69 1.670 -16.235 -5.526 1.00 50.41 C ATOM 1037 CG GLN A 69 3.131 -16.263 -5.945 1.00 72.14 C ATOM 1038 CD GLN A 69 3.785 -14.897 -5.874 1.00 5.22 C ATOM 1039 OE1 GLN A 69 3.104 -13.873 -5.797 1.00 1.33 O ATOM 1040 NE2 GLN A 69 5.112 -14.873 -5.900 1.00 61.43 N ATOM 0 H GLN A 69 1.345 -18.203 -7.004 1.00 75.41 H new ATOM 0 HA GLN A 69 1.787 -17.913 -4.188 1.00 73.40 H new ATOM 0 HB2 GLN A 69 1.063 -15.924 -6.376 1.00 50.41 H new ATOM 0 HB3 GLN A 69 1.538 -15.483 -4.748 1.00 50.41 H new ATOM 0 HG2 GLN A 69 3.676 -16.956 -5.304 1.00 72.14 H new ATOM 0 HG3 GLN A 69 3.206 -16.645 -6.963 1.00 72.14 H new ATOM 0 HE21 GLN A 69 5.637 -15.745 -5.964 1.00 61.43 H new ATOM 0 HE22 GLN A 69 5.607 -13.982 -5.856 1.00 61.43 H new ATOM 1049 N TYR A 70 -1.241 -17.702 -5.357 1.00 25.32 N ATOM 1050 CA TYR A 70 -2.648 -17.592 -4.987 1.00 13.24 C ATOM 1051 C TYR A 70 -3.373 -18.917 -5.202 1.00 13.40 C ATOM 1052 O TYR A 70 -4.595 -18.954 -5.347 1.00 60.12 O ATOM 1053 CB TYR A 70 -3.327 -16.489 -5.801 1.00 73.14 C ATOM 1054 CG TYR A 70 -2.739 -15.116 -5.567 1.00 2.41 C ATOM 1055 CD1 TYR A 70 -2.643 -14.588 -4.285 1.00 41.41 C ATOM 1056 CD2 TYR A 70 -2.279 -14.346 -6.629 1.00 54.44 C ATOM 1057 CE1 TYR A 70 -2.108 -13.334 -4.068 1.00 63.31 C ATOM 1058 CE2 TYR A 70 -1.740 -13.091 -6.420 1.00 43.53 C ATOM 1059 CZ TYR A 70 -1.658 -12.588 -5.137 1.00 60.24 C ATOM 1060 OH TYR A 70 -1.123 -11.339 -4.924 1.00 32.23 O ATOM 0 H TYR A 70 -1.080 -18.003 -6.318 1.00 25.32 H new ATOM 0 HA TYR A 70 -2.700 -17.337 -3.928 1.00 13.24 H new ATOM 0 HB2 TYR A 70 -3.251 -16.732 -6.861 1.00 73.14 H new ATOM 0 HB3 TYR A 70 -4.388 -16.468 -5.554 1.00 73.14 H new ATOM 0 HD1 TYR A 70 -2.993 -15.169 -3.444 1.00 41.41 H new ATOM 0 HD2 TYR A 70 -2.344 -14.735 -7.634 1.00 54.44 H new ATOM 0 HE1 TYR A 70 -2.042 -12.939 -3.065 1.00 63.31 H new ATOM 0 HE2 TYR A 70 -1.385 -12.507 -7.256 1.00 43.53 H new ATOM 0 HH TYR A 70 -0.853 -10.948 -5.781 1.00 32.23 H new ATOM 1070 N THR A 71 -2.609 -20.005 -5.222 1.00 53.31 N ATOM 1071 CA THR A 71 -3.176 -21.333 -5.419 1.00 63.45 C ATOM 1072 C THR A 71 -4.270 -21.622 -4.397 1.00 25.02 C ATOM 1073 O THR A 71 -5.140 -22.462 -4.626 1.00 11.42 O ATOM 1074 CB THR A 71 -2.096 -22.427 -5.320 1.00 51.51 C ATOM 1075 OG1 THR A 71 -2.630 -23.684 -5.749 1.00 70.04 O ATOM 1076 CG2 THR A 71 -1.580 -22.549 -3.894 1.00 62.15 C ATOM 0 H THR A 71 -1.596 -19.992 -5.104 1.00 53.31 H new ATOM 0 HA THR A 71 -3.605 -21.346 -6.421 1.00 63.45 H new ATOM 0 HB THR A 71 -1.265 -22.147 -5.968 1.00 51.51 H new ATOM 0 HG1 THR A 71 -1.936 -24.373 -5.684 1.00 70.04 H new ATOM 0 HG21 THR A 71 -0.818 -23.327 -3.848 1.00 62.15 H new ATOM 0 HG22 THR A 71 -1.147 -21.599 -3.581 1.00 62.15 H new ATOM 0 HG23 THR A 71 -2.404 -22.808 -3.230 1.00 62.15 H new ATOM 1084 N GLU A 72 -4.220 -20.919 -3.270 1.00 42.03 N ATOM 1085 CA GLU A 72 -5.209 -21.101 -2.213 1.00 25.13 C ATOM 1086 C GLU A 72 -6.624 -20.923 -2.754 1.00 64.22 C ATOM 1087 O GLU A 72 -7.547 -21.630 -2.353 1.00 31.12 O ATOM 1088 CB GLU A 72 -4.959 -20.110 -1.074 1.00 62.10 C ATOM 1089 CG GLU A 72 -3.760 -20.466 -0.210 1.00 10.13 C ATOM 1090 CD GLU A 72 -3.369 -19.346 0.735 1.00 41.34 C ATOM 1091 OE1 GLU A 72 -2.904 -18.295 0.247 1.00 3.33 O ATOM 1092 OE2 GLU A 72 -3.528 -19.521 1.961 1.00 54.20 O ATOM 0 H GLU A 72 -3.507 -20.219 -3.065 1.00 42.03 H new ATOM 0 HA GLU A 72 -5.110 -22.117 -1.830 1.00 25.13 H new ATOM 0 HB2 GLU A 72 -4.811 -19.116 -1.495 1.00 62.10 H new ATOM 0 HB3 GLU A 72 -5.848 -20.061 -0.445 1.00 62.10 H new ATOM 0 HG2 GLU A 72 -3.987 -21.362 0.368 1.00 10.13 H new ATOM 0 HG3 GLU A 72 -2.913 -20.707 -0.852 1.00 10.13 H new ATOM 1099 N ASN A 73 -6.786 -19.972 -3.669 1.00 43.45 N ATOM 1100 CA ASN A 73 -8.089 -19.700 -4.265 1.00 72.45 C ATOM 1101 C ASN A 73 -7.964 -19.483 -5.770 1.00 43.54 C ATOM 1102 O ASN A 73 -8.811 -18.840 -6.389 1.00 5.44 O ATOM 1103 CB ASN A 73 -8.724 -18.470 -3.613 1.00 62.14 C ATOM 1104 CG ASN A 73 -10.239 -18.504 -3.669 1.00 62.35 C ATOM 1105 OD1 ASN A 73 -10.863 -17.732 -4.399 1.00 54.33 O ATOM 1106 ND2 ASN A 73 -10.840 -19.402 -2.897 1.00 12.25 N ATOM 0 H ASN A 73 -6.032 -19.378 -4.013 1.00 43.45 H new ATOM 0 HA ASN A 73 -8.728 -20.566 -4.092 1.00 72.45 H new ATOM 0 HB2 ASN A 73 -8.403 -18.407 -2.573 1.00 62.14 H new ATOM 0 HB3 ASN A 73 -8.365 -17.571 -4.113 1.00 62.14 H new ATOM 0 HD21 ASN A 73 -11.858 -19.472 -2.893 1.00 12.25 H new ATOM 0 HD22 ASN A 73 -10.284 -20.022 -2.308 1.00 12.25 H new ATOM 1113 N VAL A 74 -6.899 -20.026 -6.354 1.00 43.23 N ATOM 1114 CA VAL A 74 -6.663 -19.895 -7.787 1.00 42.34 C ATOM 1115 C VAL A 74 -6.269 -21.232 -8.404 1.00 24.52 C ATOM 1116 O VAL A 74 -5.517 -22.005 -7.811 1.00 11.33 O ATOM 1117 CB VAL A 74 -5.560 -18.861 -8.081 1.00 72.22 C ATOM 1118 CG1 VAL A 74 -5.316 -18.751 -9.578 1.00 21.22 C ATOM 1119 CG2 VAL A 74 -5.928 -17.508 -7.492 1.00 13.41 C ATOM 0 H VAL A 74 -6.187 -20.560 -5.856 1.00 43.23 H new ATOM 0 HA VAL A 74 -7.598 -19.555 -8.232 1.00 42.34 H new ATOM 0 HB VAL A 74 -4.636 -19.198 -7.611 1.00 72.22 H new ATOM 0 HG11 VAL A 74 -4.534 -18.016 -9.766 1.00 21.22 H new ATOM 0 HG12 VAL A 74 -5.005 -19.720 -9.968 1.00 21.22 H new ATOM 0 HG13 VAL A 74 -6.235 -18.438 -10.074 1.00 21.22 H new ATOM 0 HG21 VAL A 74 -5.138 -16.790 -7.709 1.00 13.41 H new ATOM 0 HG22 VAL A 74 -6.864 -17.162 -7.932 1.00 13.41 H new ATOM 0 HG23 VAL A 74 -6.047 -17.601 -6.413 1.00 13.41 H new ATOM 1129 N LYS A 75 -6.782 -21.499 -9.600 1.00 41.33 N ATOM 1130 CA LYS A 75 -6.483 -22.742 -10.301 1.00 54.30 C ATOM 1131 C LYS A 75 -6.326 -22.499 -11.799 1.00 41.22 C ATOM 1132 O LYS A 75 -6.775 -21.478 -12.321 1.00 54.54 O ATOM 1133 CB LYS A 75 -7.590 -23.769 -10.054 1.00 44.23 C ATOM 1134 CG LYS A 75 -7.121 -25.209 -10.168 1.00 44.22 C ATOM 1135 CD LYS A 75 -6.144 -25.566 -9.060 1.00 22.44 C ATOM 1136 CE LYS A 75 -6.787 -25.442 -7.687 1.00 73.13 C ATOM 1137 NZ LYS A 75 -5.982 -26.119 -6.634 1.00 54.32 N ATOM 0 H LYS A 75 -7.407 -20.871 -10.105 1.00 41.33 H new ATOM 0 HA LYS A 75 -5.541 -23.131 -9.914 1.00 54.30 H new ATOM 0 HB2 LYS A 75 -8.007 -23.609 -9.060 1.00 44.23 H new ATOM 0 HB3 LYS A 75 -8.396 -23.601 -10.768 1.00 44.23 H new ATOM 0 HG2 LYS A 75 -7.981 -25.877 -10.125 1.00 44.22 H new ATOM 0 HG3 LYS A 75 -6.646 -25.362 -11.137 1.00 44.22 H new ATOM 0 HD2 LYS A 75 -5.786 -26.585 -9.204 1.00 22.44 H new ATOM 0 HD3 LYS A 75 -5.274 -24.911 -9.116 1.00 22.44 H new ATOM 0 HE2 LYS A 75 -6.903 -24.388 -7.434 1.00 73.13 H new ATOM 0 HE3 LYS A 75 -7.787 -25.875 -7.714 1.00 73.13 H new ATOM 0 HZ1 LYS A 75 -6.454 -26.012 -5.713 1.00 54.32 H new ATOM 0 HZ2 LYS A 75 -5.893 -27.130 -6.861 1.00 54.32 H new ATOM 0 HZ3 LYS A 75 -5.036 -25.689 -6.590 1.00 54.32 H new ATOM 1151 N ILE A 76 -5.687 -23.441 -12.483 1.00 32.00 N ATOM 1152 CA ILE A 76 -5.475 -23.330 -13.920 1.00 74.21 C ATOM 1153 C ILE A 76 -5.517 -24.699 -14.591 1.00 73.53 C ATOM 1154 O ILE A 76 -5.059 -25.693 -14.026 1.00 22.14 O ATOM 1155 CB ILE A 76 -4.127 -22.656 -14.238 1.00 4.33 C ATOM 1156 CG1 ILE A 76 -4.074 -21.255 -13.627 1.00 15.14 C ATOM 1157 CG2 ILE A 76 -3.908 -22.592 -15.743 1.00 3.40 C ATOM 1158 CD1 ILE A 76 -2.790 -20.513 -13.924 1.00 71.25 C ATOM 0 H ILE A 76 -5.307 -24.290 -12.065 1.00 32.00 H new ATOM 0 HA ILE A 76 -6.283 -22.713 -14.312 1.00 74.21 H new ATOM 0 HB ILE A 76 -3.328 -23.253 -13.799 1.00 4.33 H new ATOM 0 HG12 ILE A 76 -4.916 -20.672 -14.002 1.00 15.14 H new ATOM 0 HG13 ILE A 76 -4.197 -21.334 -12.547 1.00 15.14 H new ATOM 0 HG21 ILE A 76 -2.951 -22.113 -15.951 1.00 3.40 H new ATOM 0 HG22 ILE A 76 -3.905 -23.602 -16.154 1.00 3.40 H new ATOM 0 HG23 ILE A 76 -4.710 -22.015 -16.203 1.00 3.40 H new ATOM 0 HD11 ILE A 76 -2.823 -19.528 -13.459 1.00 71.25 H new ATOM 0 HD12 ILE A 76 -1.945 -21.074 -13.525 1.00 71.25 H new ATOM 0 HD13 ILE A 76 -2.675 -20.402 -15.002 1.00 71.25 H new ATOM 1170 N TYR A 77 -6.067 -24.743 -15.799 1.00 44.05 N ATOM 1171 CA TYR A 77 -6.171 -25.990 -16.546 1.00 41.33 C ATOM 1172 C TYR A 77 -5.997 -25.744 -18.042 1.00 64.33 C ATOM 1173 O TYR A 77 -6.241 -24.643 -18.536 1.00 10.43 O ATOM 1174 CB TYR A 77 -7.521 -26.657 -16.282 1.00 72.10 C ATOM 1175 CG TYR A 77 -7.543 -27.508 -15.031 1.00 12.23 C ATOM 1176 CD1 TYR A 77 -6.505 -28.386 -14.748 1.00 21.01 C ATOM 1177 CD2 TYR A 77 -8.600 -27.430 -14.133 1.00 20.02 C ATOM 1178 CE1 TYR A 77 -6.521 -29.165 -13.607 1.00 1.23 C ATOM 1179 CE2 TYR A 77 -8.623 -28.204 -12.990 1.00 23.03 C ATOM 1180 CZ TYR A 77 -7.582 -29.070 -12.730 1.00 14.33 C ATOM 1181 OH TYR A 77 -7.600 -29.842 -11.593 1.00 41.31 O ATOM 0 H TYR A 77 -6.448 -23.929 -16.282 1.00 44.05 H new ATOM 0 HA TYR A 77 -5.374 -26.653 -16.209 1.00 41.33 H new ATOM 0 HB2 TYR A 77 -8.288 -25.886 -16.200 1.00 72.10 H new ATOM 0 HB3 TYR A 77 -7.783 -27.278 -17.138 1.00 72.10 H new ATOM 0 HD1 TYR A 77 -5.672 -28.461 -15.431 1.00 21.01 H new ATOM 0 HD2 TYR A 77 -9.417 -26.753 -14.332 1.00 20.02 H new ATOM 0 HE1 TYR A 77 -5.707 -29.845 -13.403 1.00 1.23 H new ATOM 0 HE2 TYR A 77 -9.453 -28.131 -12.303 1.00 23.03 H new ATOM 0 HH TYR A 77 -8.415 -29.654 -11.083 1.00 41.31 H new ATOM 1191 N LYS A 78 -5.573 -26.779 -18.760 1.00 23.53 N ATOM 1192 CA LYS A 78 -5.366 -26.680 -20.200 1.00 3.52 C ATOM 1193 C LYS A 78 -6.409 -27.496 -20.956 1.00 53.52 C ATOM 1194 O LYS A 78 -7.271 -28.133 -20.351 1.00 32.22 O ATOM 1195 CB LYS A 78 -3.961 -27.159 -20.569 1.00 32.21 C ATOM 1196 CG LYS A 78 -2.928 -26.046 -20.606 1.00 32.34 C ATOM 1197 CD LYS A 78 -1.524 -26.579 -20.373 1.00 31.11 C ATOM 1198 CE LYS A 78 -0.843 -26.944 -21.683 1.00 21.42 C ATOM 1199 NZ LYS A 78 -1.393 -28.199 -22.264 1.00 41.41 N ATOM 0 H LYS A 78 -5.366 -27.697 -18.367 1.00 23.53 H new ATOM 0 HA LYS A 78 -5.472 -25.634 -20.486 1.00 3.52 H new ATOM 0 HB2 LYS A 78 -3.643 -27.914 -19.850 1.00 32.21 H new ATOM 0 HB3 LYS A 78 -3.996 -27.643 -21.545 1.00 32.21 H new ATOM 0 HG2 LYS A 78 -2.971 -25.541 -21.571 1.00 32.34 H new ATOM 0 HG3 LYS A 78 -3.166 -25.302 -19.846 1.00 32.34 H new ATOM 0 HD2 LYS A 78 -0.931 -25.829 -19.850 1.00 31.11 H new ATOM 0 HD3 LYS A 78 -1.569 -27.457 -19.728 1.00 31.11 H new ATOM 0 HE2 LYS A 78 -0.967 -26.129 -22.396 1.00 21.42 H new ATOM 0 HE3 LYS A 78 0.228 -27.060 -21.515 1.00 21.42 H new ATOM 0 HZ1 LYS A 78 -0.690 -28.623 -22.903 1.00 41.41 H new ATOM 0 HZ2 LYS A 78 -1.613 -28.868 -21.499 1.00 41.41 H new ATOM 0 HZ3 LYS A 78 -2.260 -27.984 -22.796 1.00 41.41 H new ATOM 1490 N THR A 98 -7.307 -18.346 -25.401 1.00 45.20 N ATOM 1491 CA THR A 98 -8.107 -17.566 -24.464 1.00 23.33 C ATOM 1492 C THR A 98 -8.345 -18.336 -23.170 1.00 42.13 C ATOM 1493 O THR A 98 -8.494 -19.558 -23.183 1.00 12.55 O ATOM 1494 CB THR A 98 -9.467 -17.177 -25.074 1.00 62.14 C ATOM 1495 OG1 THR A 98 -9.267 -16.400 -26.260 1.00 63.21 O ATOM 1496 CG2 THR A 98 -10.301 -16.386 -24.077 1.00 55.04 C ATOM 0 HA THR A 98 -7.543 -16.659 -24.246 1.00 23.33 H new ATOM 0 HB THR A 98 -10.003 -18.092 -25.326 1.00 62.14 H new ATOM 0 HG1 THR A 98 -8.391 -16.610 -26.645 1.00 63.21 H new ATOM 0 HG21 THR A 98 -11.257 -16.123 -24.530 1.00 55.04 H new ATOM 0 HG22 THR A 98 -10.476 -16.991 -23.188 1.00 55.04 H new ATOM 0 HG23 THR A 98 -9.769 -15.477 -23.798 1.00 55.04 H new ATOM 1504 N ILE A 99 -8.382 -17.614 -22.055 1.00 62.15 N ATOM 1505 CA ILE A 99 -8.603 -18.230 -20.753 1.00 43.54 C ATOM 1506 C ILE A 99 -9.971 -17.854 -20.193 1.00 65.44 C ATOM 1507 O ILE A 99 -10.433 -16.724 -20.360 1.00 5.15 O ATOM 1508 CB ILE A 99 -7.516 -17.819 -19.743 1.00 53.20 C ATOM 1509 CG1 ILE A 99 -6.135 -18.250 -20.243 1.00 62.33 C ATOM 1510 CG2 ILE A 99 -7.804 -18.427 -18.378 1.00 14.24 C ATOM 1511 CD1 ILE A 99 -5.490 -17.245 -21.171 1.00 74.33 C ATOM 0 H ILE A 99 -8.262 -16.601 -22.028 1.00 62.15 H new ATOM 0 HA ILE A 99 -8.558 -19.309 -20.902 1.00 43.54 H new ATOM 0 HB ILE A 99 -7.524 -16.733 -19.645 1.00 53.20 H new ATOM 0 HG12 ILE A 99 -5.482 -18.413 -19.386 1.00 62.33 H new ATOM 0 HG13 ILE A 99 -6.226 -19.205 -20.761 1.00 62.33 H new ATOM 0 HG21 ILE A 99 -7.027 -18.127 -17.675 1.00 14.24 H new ATOM 0 HG22 ILE A 99 -8.772 -18.076 -18.020 1.00 14.24 H new ATOM 0 HG23 ILE A 99 -7.820 -19.514 -18.460 1.00 14.24 H new ATOM 0 HD11 ILE A 99 -4.514 -17.615 -21.486 1.00 74.33 H new ATOM 0 HD12 ILE A 99 -6.123 -17.099 -22.046 1.00 74.33 H new ATOM 0 HD13 ILE A 99 -5.367 -16.295 -20.650 1.00 74.33 H new ATOM 1523 N LEU A 100 -10.613 -18.805 -19.525 1.00 14.13 N ATOM 1524 CA LEU A 100 -11.927 -18.573 -18.937 1.00 74.13 C ATOM 1525 C LEU A 100 -11.954 -19.006 -17.475 1.00 51.03 C ATOM 1526 O LEU A 100 -11.600 -20.138 -17.145 1.00 42.25 O ATOM 1527 CB LEU A 100 -13.000 -19.328 -19.723 1.00 11.41 C ATOM 1528 CG LEU A 100 -13.243 -18.852 -21.156 1.00 23.02 C ATOM 1529 CD1 LEU A 100 -13.621 -20.022 -22.051 1.00 75.25 C ATOM 1530 CD2 LEU A 100 -14.325 -17.783 -21.186 1.00 10.22 C ATOM 0 H LEU A 100 -10.245 -19.745 -19.377 1.00 14.13 H new ATOM 0 HA LEU A 100 -12.135 -17.504 -18.984 1.00 74.13 H new ATOM 0 HB2 LEU A 100 -12.725 -20.382 -19.753 1.00 11.41 H new ATOM 0 HB3 LEU A 100 -13.939 -19.259 -19.175 1.00 11.41 H new ATOM 0 HG LEU A 100 -12.319 -18.416 -21.535 1.00 23.02 H new ATOM 0 HD11 LEU A 100 -13.790 -19.664 -23.066 1.00 75.25 H new ATOM 0 HD12 LEU A 100 -12.813 -20.754 -22.054 1.00 75.25 H new ATOM 0 HD13 LEU A 100 -14.531 -20.489 -21.675 1.00 75.25 H new ATOM 0 HD21 LEU A 100 -14.485 -17.456 -22.213 1.00 10.22 H new ATOM 0 HD22 LEU A 100 -15.253 -18.193 -20.787 1.00 10.22 H new ATOM 0 HD23 LEU A 100 -14.014 -16.933 -20.579 1.00 10.22 H new ATOM 1542 N MET A 101 -12.379 -18.098 -16.602 1.00 44.04 N ATOM 1543 CA MET A 101 -12.455 -18.388 -15.175 1.00 51.33 C ATOM 1544 C MET A 101 -13.811 -18.986 -14.813 1.00 12.11 C ATOM 1545 O MET A 101 -14.854 -18.383 -15.065 1.00 52.43 O ATOM 1546 CB MET A 101 -12.213 -17.116 -14.361 1.00 34.22 C ATOM 1547 CG MET A 101 -10.750 -16.709 -14.290 1.00 12.34 C ATOM 1548 SD MET A 101 -10.486 -15.233 -13.288 1.00 53.14 S ATOM 1549 CE MET A 101 -8.971 -14.602 -14.005 1.00 41.24 C ATOM 0 H MET A 101 -12.676 -17.156 -16.858 1.00 44.04 H new ATOM 0 HA MET A 101 -11.681 -19.117 -14.936 1.00 51.33 H new ATOM 0 HB2 MET A 101 -12.788 -16.300 -14.798 1.00 34.22 H new ATOM 0 HB3 MET A 101 -12.590 -17.265 -13.349 1.00 34.22 H new ATOM 0 HG2 MET A 101 -10.168 -17.533 -13.877 1.00 12.34 H new ATOM 0 HG3 MET A 101 -10.378 -16.530 -15.299 1.00 12.34 H new ATOM 0 HE1 MET A 101 -9.019 -13.514 -14.059 1.00 41.24 H new ATOM 0 HE2 MET A 101 -8.125 -14.897 -13.385 1.00 41.24 H new ATOM 0 HE3 MET A 101 -8.846 -15.010 -15.008 1.00 41.24 H new ATOM 1559 N PHE A 102 -13.789 -20.176 -14.221 1.00 41.14 N ATOM 1560 CA PHE A 102 -15.016 -20.855 -13.825 1.00 22.24 C ATOM 1561 C PHE A 102 -14.868 -21.488 -12.444 1.00 24.11 C ATOM 1562 O PHE A 102 -13.779 -21.916 -12.058 1.00 24.33 O ATOM 1563 CB PHE A 102 -15.384 -21.928 -14.853 1.00 14.11 C ATOM 1564 CG PHE A 102 -15.979 -21.372 -16.115 1.00 43.34 C ATOM 1565 CD1 PHE A 102 -17.250 -20.822 -16.112 1.00 33.42 C ATOM 1566 CD2 PHE A 102 -15.266 -21.397 -17.302 1.00 24.13 C ATOM 1567 CE1 PHE A 102 -17.800 -20.309 -17.272 1.00 43.32 C ATOM 1568 CE2 PHE A 102 -15.811 -20.886 -18.465 1.00 54.11 C ATOM 1569 CZ PHE A 102 -17.080 -20.340 -18.449 1.00 21.31 C ATOM 0 H PHE A 102 -12.934 -20.689 -14.005 1.00 41.14 H new ATOM 0 HA PHE A 102 -15.814 -20.113 -13.781 1.00 22.24 H new ATOM 0 HB2 PHE A 102 -14.491 -22.501 -15.104 1.00 14.11 H new ATOM 0 HB3 PHE A 102 -16.093 -22.623 -14.403 1.00 14.11 H new ATOM 0 HD1 PHE A 102 -17.818 -20.794 -15.194 1.00 33.42 H new ATOM 0 HD2 PHE A 102 -14.273 -21.821 -17.319 1.00 24.13 H new ATOM 0 HE1 PHE A 102 -18.793 -19.884 -17.257 1.00 43.32 H new ATOM 0 HE2 PHE A 102 -15.246 -20.914 -19.385 1.00 54.11 H new ATOM 0 HZ PHE A 102 -17.508 -19.938 -19.356 1.00 21.31 H new ATOM 1579 N LYS A 103 -15.969 -21.543 -11.704 1.00 0.52 N ATOM 1580 CA LYS A 103 -15.964 -22.123 -10.366 1.00 14.34 C ATOM 1581 C LYS A 103 -17.387 -22.370 -9.874 1.00 42.13 C ATOM 1582 O LYS A 103 -18.260 -21.516 -10.021 1.00 4.33 O ATOM 1583 CB LYS A 103 -15.229 -21.201 -9.391 1.00 55.11 C ATOM 1584 CG LYS A 103 -16.048 -19.998 -8.956 1.00 53.23 C ATOM 1585 CD LYS A 103 -15.277 -19.121 -7.985 1.00 73.44 C ATOM 1586 CE LYS A 103 -16.211 -18.404 -7.020 1.00 31.03 C ATOM 1587 NZ LYS A 103 -16.974 -19.362 -6.173 1.00 61.33 N ATOM 0 H LYS A 103 -16.877 -21.193 -12.008 1.00 0.52 H new ATOM 0 HA LYS A 103 -15.444 -23.080 -10.414 1.00 14.34 H new ATOM 0 HB2 LYS A 103 -14.943 -21.773 -8.509 1.00 55.11 H new ATOM 0 HB3 LYS A 103 -14.308 -20.853 -9.858 1.00 55.11 H new ATOM 0 HG2 LYS A 103 -16.330 -19.413 -9.831 1.00 53.23 H new ATOM 0 HG3 LYS A 103 -16.972 -20.336 -8.487 1.00 53.23 H new ATOM 0 HD2 LYS A 103 -14.570 -19.732 -7.423 1.00 73.44 H new ATOM 0 HD3 LYS A 103 -14.693 -18.387 -8.540 1.00 73.44 H new ATOM 0 HE2 LYS A 103 -15.632 -17.737 -6.382 1.00 31.03 H new ATOM 0 HE3 LYS A 103 -16.907 -17.782 -7.583 1.00 31.03 H new ATOM 0 HZ1 LYS A 103 -17.994 -19.210 -6.309 1.00 61.33 H new ATOM 0 HZ2 LYS A 103 -16.730 -20.336 -6.445 1.00 61.33 H new ATOM 0 HZ3 LYS A 103 -16.732 -19.211 -5.173 1.00 61.33 H new ATOM 1601 N ASN A 104 -17.612 -23.542 -9.290 1.00 42.33 N ATOM 1602 CA ASN A 104 -18.929 -23.900 -8.776 1.00 62.34 C ATOM 1603 C ASN A 104 -19.992 -23.766 -9.863 1.00 50.33 C ATOM 1604 O ASN A 104 -21.168 -23.555 -9.572 1.00 40.20 O ATOM 1605 CB ASN A 104 -19.292 -23.013 -7.582 1.00 11.23 C ATOM 1606 CG ASN A 104 -20.517 -23.514 -6.842 1.00 4.44 C ATOM 1607 OD1 ASN A 104 -21.532 -22.822 -6.760 1.00 62.54 O ATOM 1608 ND2 ASN A 104 -20.427 -24.722 -6.298 1.00 61.13 N ATOM 0 H ASN A 104 -16.899 -24.260 -9.161 1.00 42.33 H new ATOM 0 HA ASN A 104 -18.894 -24.940 -8.451 1.00 62.34 H new ATOM 0 HB2 ASN A 104 -18.447 -22.970 -6.894 1.00 11.23 H new ATOM 0 HB3 ASN A 104 -19.472 -21.996 -7.930 1.00 11.23 H new ATOM 0 HD21 ASN A 104 -21.219 -25.112 -5.787 1.00 61.13 H new ATOM 0 HD22 ASN A 104 -19.566 -25.260 -6.391 1.00 61.13 H new ATOM 1615 N GLY A 105 -19.567 -23.894 -11.116 1.00 52.35 N ATOM 1616 CA GLY A 105 -20.495 -23.786 -12.227 1.00 3.40 C ATOM 1617 C GLY A 105 -20.853 -22.348 -12.547 1.00 72.24 C ATOM 1618 O GLY A 105 -21.936 -22.068 -13.060 1.00 44.34 O ATOM 0 H GLY A 105 -18.598 -24.070 -11.382 1.00 52.35 H new ATOM 0 HA2 GLY A 105 -20.057 -24.253 -13.109 1.00 3.40 H new ATOM 0 HA3 GLY A 105 -21.404 -24.340 -11.992 1.00 3.40 H new ATOM 1622 N LYS A 106 -19.941 -21.431 -12.239 1.00 63.04 N ATOM 1623 CA LYS A 106 -20.165 -20.013 -12.495 1.00 23.53 C ATOM 1624 C LYS A 106 -18.893 -19.346 -13.011 1.00 52.51 C ATOM 1625 O LYS A 106 -17.787 -19.682 -12.586 1.00 15.21 O ATOM 1626 CB LYS A 106 -20.641 -19.313 -11.221 1.00 4.42 C ATOM 1627 CG LYS A 106 -21.431 -18.042 -11.484 1.00 13.01 C ATOM 1628 CD LYS A 106 -21.347 -17.081 -10.311 1.00 34.42 C ATOM 1629 CE LYS A 106 -22.171 -15.827 -10.558 1.00 12.25 C ATOM 1630 NZ LYS A 106 -23.619 -16.052 -10.289 1.00 53.44 N ATOM 0 H LYS A 106 -19.040 -21.645 -11.812 1.00 63.04 H new ATOM 0 HA LYS A 106 -20.936 -19.924 -13.260 1.00 23.53 H new ATOM 0 HB2 LYS A 106 -21.259 -20.003 -10.647 1.00 4.42 H new ATOM 0 HB3 LYS A 106 -19.775 -19.072 -10.604 1.00 4.42 H new ATOM 0 HG2 LYS A 106 -21.051 -17.555 -12.382 1.00 13.01 H new ATOM 0 HG3 LYS A 106 -22.474 -18.294 -11.675 1.00 13.01 H new ATOM 0 HD2 LYS A 106 -21.700 -17.577 -9.407 1.00 34.42 H new ATOM 0 HD3 LYS A 106 -20.307 -16.806 -10.138 1.00 34.42 H new ATOM 0 HE2 LYS A 106 -21.805 -15.021 -9.922 1.00 12.25 H new ATOM 0 HE3 LYS A 106 -22.039 -15.504 -11.591 1.00 12.25 H new ATOM 0 HZ1 LYS A 106 -24.146 -15.174 -10.469 1.00 53.44 H new ATOM 0 HZ2 LYS A 106 -23.975 -16.804 -10.913 1.00 53.44 H new ATOM 0 HZ3 LYS A 106 -23.748 -16.336 -9.297 1.00 53.44 H new ATOM 1644 N LYS A 107 -19.058 -18.398 -13.926 1.00 5.15 N ATOM 1645 CA LYS A 107 -17.924 -17.681 -14.499 1.00 22.41 C ATOM 1646 C LYS A 107 -17.503 -16.523 -13.598 1.00 2.12 C ATOM 1647 O LYS A 107 -18.345 -15.847 -13.005 1.00 70.34 O ATOM 1648 CB LYS A 107 -18.277 -17.156 -15.892 1.00 42.32 C ATOM 1649 CG LYS A 107 -19.220 -15.965 -15.873 1.00 53.43 C ATOM 1650 CD LYS A 107 -19.491 -15.445 -17.275 1.00 74.10 C ATOM 1651 CE LYS A 107 -20.852 -14.773 -17.367 1.00 71.11 C ATOM 1652 NZ LYS A 107 -21.296 -14.611 -18.779 1.00 25.43 N ATOM 0 H LYS A 107 -19.966 -18.107 -14.288 1.00 5.15 H new ATOM 0 HA LYS A 107 -17.089 -18.377 -14.582 1.00 22.41 H new ATOM 0 HB2 LYS A 107 -17.359 -16.874 -16.408 1.00 42.32 H new ATOM 0 HB3 LYS A 107 -18.733 -17.960 -16.469 1.00 42.32 H new ATOM 0 HG2 LYS A 107 -20.160 -16.252 -15.402 1.00 53.43 H new ATOM 0 HG3 LYS A 107 -18.790 -15.169 -15.266 1.00 53.43 H new ATOM 0 HD2 LYS A 107 -18.714 -14.735 -17.557 1.00 74.10 H new ATOM 0 HD3 LYS A 107 -19.443 -16.270 -17.986 1.00 74.10 H new ATOM 0 HE2 LYS A 107 -21.587 -15.365 -16.821 1.00 71.11 H new ATOM 0 HE3 LYS A 107 -20.808 -13.796 -16.886 1.00 71.11 H new ATOM 0 HZ1 LYS A 107 -22.228 -14.149 -18.799 1.00 25.43 H new ATOM 0 HZ2 LYS A 107 -20.608 -14.025 -19.294 1.00 25.43 H new ATOM 0 HZ3 LYS A 107 -21.363 -15.545 -19.231 1.00 25.43 H new ATOM 1666 N LEU A 108 -16.198 -16.298 -13.503 1.00 62.00 N ATOM 1667 CA LEU A 108 -15.666 -15.220 -12.677 1.00 31.31 C ATOM 1668 C LEU A 108 -15.046 -14.126 -13.541 1.00 60.45 C ATOM 1669 O LEU A 108 -15.067 -12.949 -13.181 1.00 22.20 O ATOM 1670 CB LEU A 108 -14.622 -15.767 -11.701 1.00 53.53 C ATOM 1671 CG LEU A 108 -15.051 -16.974 -10.866 1.00 64.34 C ATOM 1672 CD1 LEU A 108 -16.496 -16.823 -10.414 1.00 21.01 C ATOM 1673 CD2 LEU A 108 -14.868 -18.262 -11.656 1.00 44.43 C ATOM 0 H LEU A 108 -15.488 -16.847 -13.988 1.00 62.00 H new ATOM 0 HA LEU A 108 -16.492 -14.787 -12.112 1.00 31.31 H new ATOM 0 HB2 LEU A 108 -13.732 -16.040 -12.268 1.00 53.53 H new ATOM 0 HB3 LEU A 108 -14.333 -14.965 -11.022 1.00 53.53 H new ATOM 0 HG LEU A 108 -14.418 -17.023 -9.980 1.00 64.34 H new ATOM 0 HD11 LEU A 108 -16.784 -17.691 -9.821 1.00 21.01 H new ATOM 0 HD12 LEU A 108 -16.596 -15.921 -9.810 1.00 21.01 H new ATOM 0 HD13 LEU A 108 -17.144 -16.748 -11.287 1.00 21.01 H new ATOM 0 HD21 LEU A 108 -15.178 -19.110 -11.046 1.00 44.43 H new ATOM 0 HD22 LEU A 108 -15.476 -18.224 -12.560 1.00 44.43 H new ATOM 0 HD23 LEU A 108 -13.819 -18.376 -11.929 1.00 44.43 H new ATOM 1685 N SER A 109 -14.497 -14.523 -14.685 1.00 64.12 N ATOM 1686 CA SER A 109 -13.870 -13.577 -15.600 1.00 55.15 C ATOM 1687 C SER A 109 -13.320 -14.293 -16.830 1.00 41.05 C ATOM 1688 O SER A 109 -13.304 -15.522 -16.888 1.00 33.13 O ATOM 1689 CB SER A 109 -12.745 -12.819 -14.893 1.00 52.45 C ATOM 1690 OG SER A 109 -13.172 -11.528 -14.494 1.00 54.05 O ATOM 0 H SER A 109 -14.474 -15.493 -15.000 1.00 64.12 H new ATOM 0 HA SER A 109 -14.630 -12.866 -15.924 1.00 55.15 H new ATOM 0 HB2 SER A 109 -12.415 -13.382 -14.020 1.00 52.45 H new ATOM 0 HB3 SER A 109 -11.886 -12.732 -15.559 1.00 52.45 H new ATOM 0 HG SER A 109 -13.960 -11.608 -13.917 1.00 54.05 H new ATOM 1696 N GLN A 110 -12.873 -13.515 -17.810 1.00 73.42 N ATOM 1697 CA GLN A 110 -12.324 -14.075 -19.039 1.00 42.33 C ATOM 1698 C GLN A 110 -11.080 -13.310 -19.478 1.00 70.12 C ATOM 1699 O GLN A 110 -11.164 -12.155 -19.896 1.00 44.53 O ATOM 1700 CB GLN A 110 -13.374 -14.046 -20.151 1.00 72.44 C ATOM 1701 CG GLN A 110 -14.093 -12.712 -20.274 1.00 35.44 C ATOM 1702 CD GLN A 110 -15.235 -12.755 -21.271 1.00 64.20 C ATOM 1703 OE1 GLN A 110 -15.500 -13.788 -21.886 1.00 14.10 O ATOM 1704 NE2 GLN A 110 -15.917 -11.628 -21.439 1.00 21.42 N ATOM 0 H GLN A 110 -12.880 -12.496 -17.777 1.00 73.42 H new ATOM 0 HA GLN A 110 -12.041 -15.109 -18.843 1.00 42.33 H new ATOM 0 HB2 GLN A 110 -12.892 -14.278 -21.101 1.00 72.44 H new ATOM 0 HB3 GLN A 110 -14.109 -14.830 -19.966 1.00 72.44 H new ATOM 0 HG2 GLN A 110 -14.479 -12.420 -19.297 1.00 35.44 H new ATOM 0 HG3 GLN A 110 -13.380 -11.946 -20.577 1.00 35.44 H new ATOM 0 HE21 GLN A 110 -15.663 -10.795 -20.908 1.00 21.42 H new ATOM 0 HE22 GLN A 110 -16.694 -11.596 -22.099 1.00 21.42 H new ATOM 1713 N VAL A 111 -9.925 -13.961 -19.380 1.00 61.10 N ATOM 1714 CA VAL A 111 -8.663 -13.342 -19.767 1.00 4.43 C ATOM 1715 C VAL A 111 -8.309 -13.674 -21.212 1.00 3.33 C ATOM 1716 O VAL A 111 -8.530 -14.793 -21.674 1.00 41.10 O ATOM 1717 CB VAL A 111 -7.511 -13.794 -18.850 1.00 34.54 C ATOM 1718 CG1 VAL A 111 -6.197 -13.169 -19.294 1.00 53.12 C ATOM 1719 CG2 VAL A 111 -7.816 -13.445 -17.401 1.00 22.25 C ATOM 0 H VAL A 111 -9.837 -14.917 -19.036 1.00 61.10 H new ATOM 0 HA VAL A 111 -8.795 -12.265 -19.667 1.00 4.43 H new ATOM 0 HB VAL A 111 -7.413 -14.877 -18.926 1.00 34.54 H new ATOM 0 HG11 VAL A 111 -5.395 -13.500 -18.634 1.00 53.12 H new ATOM 0 HG12 VAL A 111 -5.975 -13.475 -20.316 1.00 53.12 H new ATOM 0 HG13 VAL A 111 -6.278 -12.083 -19.250 1.00 53.12 H new ATOM 0 HG21 VAL A 111 -6.992 -13.771 -16.767 1.00 22.25 H new ATOM 0 HG22 VAL A 111 -7.942 -12.367 -17.305 1.00 22.25 H new ATOM 0 HG23 VAL A 111 -8.733 -13.947 -17.091 1.00 22.25 H new ATOM 1729 N ILE A 112 -7.757 -12.695 -21.920 1.00 40.51 N ATOM 1730 CA ILE A 112 -7.370 -12.884 -23.313 1.00 13.53 C ATOM 1731 C ILE A 112 -6.015 -12.248 -23.598 1.00 35.44 C ATOM 1732 O ILE A 112 -5.890 -11.025 -23.658 1.00 64.54 O ATOM 1733 CB ILE A 112 -8.417 -12.288 -24.274 1.00 10.42 C ATOM 1734 CG1 ILE A 112 -9.821 -12.753 -23.884 1.00 64.13 C ATOM 1735 CG2 ILE A 112 -8.101 -12.682 -25.709 1.00 61.22 C ATOM 1736 CD1 ILE A 112 -10.911 -12.189 -24.769 1.00 11.41 C ATOM 0 H ILE A 112 -7.568 -11.763 -21.552 1.00 40.51 H new ATOM 0 HA ILE A 112 -7.306 -13.959 -23.480 1.00 13.53 H new ATOM 0 HB ILE A 112 -8.382 -11.201 -24.200 1.00 10.42 H new ATOM 0 HG12 ILE A 112 -9.859 -13.842 -23.924 1.00 64.13 H new ATOM 0 HG13 ILE A 112 -10.017 -12.465 -22.851 1.00 64.13 H new ATOM 0 HG21 ILE A 112 -8.849 -12.254 -26.377 1.00 61.22 H new ATOM 0 HG22 ILE A 112 -7.114 -12.306 -25.981 1.00 61.22 H new ATOM 0 HG23 ILE A 112 -8.113 -13.768 -25.799 1.00 61.22 H new ATOM 0 HD11 ILE A 112 -11.880 -12.561 -24.435 1.00 11.41 H new ATOM 0 HD12 ILE A 112 -10.900 -11.101 -24.711 1.00 11.41 H new ATOM 0 HD13 ILE A 112 -10.740 -12.499 -25.800 1.00 11.41 H new ATOM 1748 N GLY A 113 -4.998 -13.087 -23.776 1.00 53.21 N ATOM 1749 CA GLY A 113 -3.664 -12.587 -24.054 1.00 14.23 C ATOM 1750 C GLY A 113 -2.694 -12.860 -22.920 1.00 44.34 C ATOM 1751 O GLY A 113 -2.901 -13.776 -22.126 1.00 21.13 O ATOM 0 H GLY A 113 -5.074 -14.103 -23.733 1.00 53.21 H new ATOM 0 HA2 GLY A 113 -3.289 -13.049 -24.968 1.00 14.23 H new ATOM 0 HA3 GLY A 113 -3.712 -11.513 -24.236 1.00 14.23 H new ATOM 1755 N ALA A 114 -1.633 -12.063 -22.847 1.00 2.12 N ATOM 1756 CA ALA A 114 -0.629 -12.223 -21.804 1.00 50.23 C ATOM 1757 C ALA A 114 -0.441 -10.927 -21.020 1.00 73.31 C ATOM 1758 O ALA A 114 0.486 -10.161 -21.283 1.00 1.34 O ATOM 1759 CB ALA A 114 0.693 -12.673 -22.408 1.00 34.24 C ATOM 0 H ALA A 114 -1.447 -11.300 -23.498 1.00 2.12 H new ATOM 0 HA ALA A 114 -0.979 -12.989 -21.112 1.00 50.23 H new ATOM 0 HB1 ALA A 114 1.434 -12.788 -21.617 1.00 34.24 H new ATOM 0 HB2 ALA A 114 0.554 -13.627 -22.917 1.00 34.24 H new ATOM 0 HB3 ALA A 114 1.039 -11.927 -23.123 1.00 34.24 H new ATOM 1765 N ASP A 115 -1.325 -10.690 -20.058 1.00 11.22 N ATOM 1766 CA ASP A 115 -1.256 -9.487 -19.235 1.00 33.14 C ATOM 1767 C ASP A 115 -1.265 -9.843 -17.752 1.00 50.50 C ATOM 1768 O ASP A 115 -2.323 -10.070 -17.165 1.00 41.34 O ATOM 1769 CB ASP A 115 -2.427 -8.557 -19.557 1.00 73.33 C ATOM 1770 CG ASP A 115 -2.178 -7.722 -20.799 1.00 45.55 C ATOM 1771 OD1 ASP A 115 -1.105 -7.092 -20.885 1.00 51.32 O ATOM 1772 OD2 ASP A 115 -3.059 -7.699 -21.684 1.00 15.43 O ATOM 0 H ASP A 115 -2.098 -11.314 -19.828 1.00 11.22 H new ATOM 0 HA ASP A 115 -0.321 -8.973 -19.461 1.00 33.14 H new ATOM 0 HB2 ASP A 115 -3.331 -9.150 -19.697 1.00 73.33 H new ATOM 0 HB3 ASP A 115 -2.607 -7.897 -18.709 1.00 73.33 H new ATOM 1777 N ILE A 116 -0.080 -9.888 -17.153 1.00 43.41 N ATOM 1778 CA ILE A 116 0.048 -10.216 -15.739 1.00 44.52 C ATOM 1779 C ILE A 116 -0.747 -9.244 -14.875 1.00 11.00 C ATOM 1780 O ILE A 116 -1.417 -9.647 -13.925 1.00 0.15 O ATOM 1781 CB ILE A 116 1.521 -10.198 -15.288 1.00 1.13 C ATOM 1782 CG1 ILE A 116 1.624 -10.503 -13.792 1.00 20.02 C ATOM 1783 CG2 ILE A 116 2.156 -8.853 -15.604 1.00 15.41 C ATOM 1784 CD1 ILE A 116 1.151 -11.893 -13.425 1.00 45.32 C ATOM 0 H ILE A 116 0.805 -9.701 -17.625 1.00 43.41 H new ATOM 0 HA ILE A 116 -0.351 -11.222 -15.612 1.00 44.52 H new ATOM 0 HB ILE A 116 2.061 -10.970 -15.835 1.00 1.13 H new ATOM 0 HG12 ILE A 116 2.660 -10.385 -13.476 1.00 20.02 H new ATOM 0 HG13 ILE A 116 1.037 -9.770 -13.239 1.00 20.02 H new ATOM 0 HG21 ILE A 116 3.196 -8.857 -15.279 1.00 15.41 H new ATOM 0 HG22 ILE A 116 2.112 -8.673 -16.678 1.00 15.41 H new ATOM 0 HG23 ILE A 116 1.616 -8.064 -15.081 1.00 15.41 H new ATOM 0 HD11 ILE A 116 1.253 -12.040 -12.350 1.00 45.32 H new ATOM 0 HD12 ILE A 116 0.105 -12.009 -13.710 1.00 45.32 H new ATOM 0 HD13 ILE A 116 1.754 -12.633 -13.951 1.00 45.32 H new ATOM 1796 N SER A 117 -0.669 -7.961 -15.213 1.00 21.43 N ATOM 1797 CA SER A 117 -1.380 -6.929 -14.467 1.00 43.32 C ATOM 1798 C SER A 117 -2.890 -7.119 -14.583 1.00 21.20 C ATOM 1799 O SER A 117 -3.657 -6.604 -13.768 1.00 13.41 O ATOM 1800 CB SER A 117 -0.989 -5.540 -14.977 1.00 12.44 C ATOM 1801 OG SER A 117 -1.831 -5.131 -16.041 1.00 62.05 O ATOM 0 H SER A 117 -0.121 -7.611 -15.999 1.00 21.43 H new ATOM 0 HA SER A 117 -1.099 -7.015 -13.417 1.00 43.32 H new ATOM 0 HB2 SER A 117 -1.052 -4.819 -14.162 1.00 12.44 H new ATOM 0 HB3 SER A 117 0.048 -5.551 -15.313 1.00 12.44 H new ATOM 0 HG SER A 117 -1.561 -4.240 -16.348 1.00 62.05 H new ATOM 1807 N LYS A 118 -3.310 -7.861 -15.602 1.00 15.20 N ATOM 1808 CA LYS A 118 -4.727 -8.122 -15.825 1.00 45.15 C ATOM 1809 C LYS A 118 -5.198 -9.317 -15.004 1.00 64.05 C ATOM 1810 O LYS A 118 -6.116 -9.202 -14.192 1.00 21.20 O ATOM 1811 CB LYS A 118 -4.991 -8.375 -17.312 1.00 45.12 C ATOM 1812 CG LYS A 118 -6.459 -8.285 -17.693 1.00 72.13 C ATOM 1813 CD LYS A 118 -7.159 -9.625 -17.536 1.00 21.24 C ATOM 1814 CE LYS A 118 -8.542 -9.608 -18.169 1.00 12.53 C ATOM 1815 NZ LYS A 118 -8.476 -9.397 -19.642 1.00 64.22 N ATOM 0 H LYS A 118 -2.689 -8.292 -16.287 1.00 15.20 H new ATOM 0 HA LYS A 118 -5.287 -7.243 -15.506 1.00 45.15 H new ATOM 0 HB2 LYS A 118 -4.426 -7.652 -17.901 1.00 45.12 H new ATOM 0 HB3 LYS A 118 -4.616 -9.364 -17.576 1.00 45.12 H new ATOM 0 HG2 LYS A 118 -6.953 -7.540 -17.069 1.00 72.13 H new ATOM 0 HG3 LYS A 118 -6.548 -7.946 -18.725 1.00 72.13 H new ATOM 0 HD2 LYS A 118 -6.556 -10.408 -17.997 1.00 21.24 H new ATOM 0 HD3 LYS A 118 -7.245 -9.870 -16.477 1.00 21.24 H new ATOM 0 HE2 LYS A 118 -9.049 -10.550 -17.960 1.00 12.53 H new ATOM 0 HE3 LYS A 118 -9.139 -8.817 -17.715 1.00 12.53 H new ATOM 0 HZ1 LYS A 118 -9.356 -9.736 -20.081 1.00 64.22 H new ATOM 0 HZ2 LYS A 118 -8.358 -8.383 -19.843 1.00 64.22 H new ATOM 0 HZ3 LYS A 118 -7.669 -9.924 -20.032 1.00 64.22 H new ATOM 1829 N ILE A 119 -4.562 -10.464 -15.219 1.00 65.15 N ATOM 1830 CA ILE A 119 -4.914 -11.680 -14.496 1.00 50.12 C ATOM 1831 C ILE A 119 -4.875 -11.454 -12.988 1.00 70.05 C ATOM 1832 O ILE A 119 -5.661 -12.036 -12.242 1.00 1.10 O ATOM 1833 CB ILE A 119 -3.968 -12.841 -14.853 1.00 20.21 C ATOM 1834 CG1 ILE A 119 -2.586 -12.610 -14.241 1.00 2.20 C ATOM 1835 CG2 ILE A 119 -3.866 -12.994 -16.364 1.00 22.50 C ATOM 1836 CD1 ILE A 119 -2.389 -13.308 -12.913 1.00 60.34 C ATOM 0 H ILE A 119 -3.800 -10.577 -15.888 1.00 65.15 H new ATOM 0 HA ILE A 119 -5.928 -11.943 -14.796 1.00 50.12 H new ATOM 0 HB ILE A 119 -4.376 -13.763 -14.440 1.00 20.21 H new ATOM 0 HG12 ILE A 119 -1.825 -12.956 -14.941 1.00 2.20 H new ATOM 0 HG13 ILE A 119 -2.432 -11.539 -14.106 1.00 2.20 H new ATOM 0 HG21 ILE A 119 -3.194 -13.819 -16.602 1.00 22.50 H new ATOM 0 HG22 ILE A 119 -4.854 -13.201 -16.776 1.00 22.50 H new ATOM 0 HG23 ILE A 119 -3.477 -12.073 -16.798 1.00 22.50 H new ATOM 0 HD11 ILE A 119 -1.387 -13.100 -12.538 1.00 60.34 H new ATOM 0 HD12 ILE A 119 -3.127 -12.944 -12.198 1.00 60.34 H new ATOM 0 HD13 ILE A 119 -2.511 -14.383 -13.045 1.00 60.34 H new ATOM 1848 N ILE A 120 -3.955 -10.601 -12.547 1.00 42.50 N ATOM 1849 CA ILE A 120 -3.815 -10.295 -11.129 1.00 1.51 C ATOM 1850 C ILE A 120 -4.936 -9.377 -10.651 1.00 62.35 C ATOM 1851 O ILE A 120 -5.387 -9.472 -9.510 1.00 43.52 O ATOM 1852 CB ILE A 120 -2.459 -9.630 -10.827 1.00 53.45 C ATOM 1853 CG1 ILE A 120 -2.340 -8.302 -11.577 1.00 1.40 C ATOM 1854 CG2 ILE A 120 -1.317 -10.562 -11.204 1.00 71.24 C ATOM 1855 CD1 ILE A 120 -2.786 -7.107 -10.764 1.00 14.01 C ATOM 0 H ILE A 120 -3.296 -10.110 -13.152 1.00 42.50 H new ATOM 0 HA ILE A 120 -3.872 -11.244 -10.595 1.00 1.51 H new ATOM 0 HB ILE A 120 -2.399 -9.428 -9.757 1.00 53.45 H new ATOM 0 HG12 ILE A 120 -1.303 -8.158 -11.882 1.00 1.40 H new ATOM 0 HG13 ILE A 120 -2.936 -8.354 -12.488 1.00 1.40 H new ATOM 0 HG21 ILE A 120 -0.365 -10.078 -10.985 1.00 71.24 H new ATOM 0 HG22 ILE A 120 -1.396 -11.485 -10.629 1.00 71.24 H new ATOM 0 HG23 ILE A 120 -1.371 -10.791 -12.268 1.00 71.24 H new ATOM 0 HD11 ILE A 120 -2.674 -6.200 -11.358 1.00 14.01 H new ATOM 0 HD12 ILE A 120 -3.832 -7.229 -10.481 1.00 14.01 H new ATOM 0 HD13 ILE A 120 -2.174 -7.029 -9.865 1.00 14.01 H new ATOM 1867 N SER A 121 -5.383 -8.490 -11.534 1.00 0.12 N ATOM 1868 CA SER A 121 -6.451 -7.553 -11.202 1.00 73.21 C ATOM 1869 C SER A 121 -7.789 -8.276 -11.078 1.00 61.43 C ATOM 1870 O SER A 121 -8.611 -7.936 -10.228 1.00 43.23 O ATOM 1871 CB SER A 121 -6.547 -6.459 -12.268 1.00 52.11 C ATOM 1872 OG SER A 121 -7.605 -5.562 -11.982 1.00 1.41 O ATOM 0 H SER A 121 -5.023 -8.400 -12.484 1.00 0.12 H new ATOM 0 HA SER A 121 -6.214 -7.096 -10.241 1.00 73.21 H new ATOM 0 HB2 SER A 121 -5.606 -5.912 -12.318 1.00 52.11 H new ATOM 0 HB3 SER A 121 -6.705 -6.913 -13.246 1.00 52.11 H new ATOM 0 HG SER A 121 -7.645 -4.871 -12.676 1.00 1.41 H new ATOM 1878 N GLU A 122 -7.997 -9.274 -11.930 1.00 41.41 N ATOM 1879 CA GLU A 122 -9.234 -10.044 -11.916 1.00 61.12 C ATOM 1880 C GLU A 122 -9.238 -11.048 -10.766 1.00 33.11 C ATOM 1881 O GLU A 122 -10.161 -11.072 -9.951 1.00 50.32 O ATOM 1882 CB GLU A 122 -9.421 -10.776 -13.247 1.00 22.41 C ATOM 1883 CG GLU A 122 -9.448 -9.851 -14.451 1.00 53.03 C ATOM 1884 CD GLU A 122 -10.588 -8.853 -14.396 1.00 22.05 C ATOM 1885 OE1 GLU A 122 -11.685 -9.231 -13.931 1.00 60.42 O ATOM 1886 OE2 GLU A 122 -10.385 -7.695 -14.817 1.00 35.23 O ATOM 0 H GLU A 122 -7.325 -9.568 -12.639 1.00 41.41 H new ATOM 0 HA GLU A 122 -10.062 -9.350 -11.772 1.00 61.12 H new ATOM 0 HB2 GLU A 122 -8.614 -11.498 -13.372 1.00 22.41 H new ATOM 0 HB3 GLU A 122 -10.352 -11.342 -13.213 1.00 22.41 H new ATOM 0 HG2 GLU A 122 -8.502 -9.313 -14.512 1.00 53.03 H new ATOM 0 HG3 GLU A 122 -9.535 -10.446 -15.360 1.00 53.03 H new ATOM 1893 N ILE A 123 -8.199 -11.874 -10.708 1.00 72.25 N ATOM 1894 CA ILE A 123 -8.081 -12.880 -9.659 1.00 54.04 C ATOM 1895 C ILE A 123 -8.185 -12.246 -8.275 1.00 62.52 C ATOM 1896 O ILE A 123 -9.018 -12.642 -7.461 1.00 23.52 O ATOM 1897 CB ILE A 123 -6.749 -13.646 -9.761 1.00 31.40 C ATOM 1898 CG1 ILE A 123 -6.696 -14.450 -11.061 1.00 34.31 C ATOM 1899 CG2 ILE A 123 -6.571 -14.562 -8.558 1.00 30.35 C ATOM 1900 CD1 ILE A 123 -5.309 -14.940 -11.413 1.00 24.43 C ATOM 0 H ILE A 123 -7.427 -11.867 -11.375 1.00 72.25 H new ATOM 0 HA ILE A 123 -8.905 -13.580 -9.799 1.00 54.04 H new ATOM 0 HB ILE A 123 -5.932 -12.925 -9.768 1.00 31.40 H new ATOM 0 HG12 ILE A 123 -7.364 -15.307 -10.976 1.00 34.31 H new ATOM 0 HG13 ILE A 123 -7.072 -13.832 -11.876 1.00 34.31 H new ATOM 0 HG21 ILE A 123 -5.625 -15.097 -8.645 1.00 30.35 H new ATOM 0 HG22 ILE A 123 -6.569 -13.967 -7.645 1.00 30.35 H new ATOM 0 HG23 ILE A 123 -7.391 -15.279 -8.522 1.00 30.35 H new ATOM 0 HD11 ILE A 123 -5.348 -15.502 -12.346 1.00 24.43 H new ATOM 0 HD12 ILE A 123 -4.641 -14.087 -11.530 1.00 24.43 H new ATOM 0 HD13 ILE A 123 -4.938 -15.585 -10.616 1.00 24.43 H new ATOM 1912 N ASN A 124 -7.335 -11.257 -8.019 1.00 75.21 N ATOM 1913 CA ASN A 124 -7.333 -10.566 -6.734 1.00 73.45 C ATOM 1914 C ASN A 124 -8.703 -9.966 -6.437 1.00 64.11 C ATOM 1915 O ASN A 124 -9.051 -9.732 -5.279 1.00 42.22 O ATOM 1916 CB ASN A 124 -6.269 -9.466 -6.726 1.00 11.21 C ATOM 1917 CG ASN A 124 -4.861 -10.022 -6.813 1.00 25.22 C ATOM 1918 OD1 ASN A 124 -4.638 -11.213 -6.599 1.00 22.41 O ATOM 1919 ND2 ASN A 124 -3.902 -9.158 -7.129 1.00 11.02 N ATOM 0 H ASN A 124 -6.640 -10.916 -8.683 1.00 75.21 H new ATOM 0 HA ASN A 124 -7.100 -11.294 -5.958 1.00 73.45 H new ATOM 0 HB2 ASN A 124 -6.442 -8.791 -7.564 1.00 11.21 H new ATOM 0 HB3 ASN A 124 -6.368 -8.876 -5.815 1.00 11.21 H new ATOM 0 HD21 ASN A 124 -2.935 -9.474 -7.202 1.00 11.02 H new ATOM 0 HD22 ASN A 124 -4.133 -8.179 -7.298 1.00 11.02 H new ATOM 1926 N ASN A 125 -9.477 -9.721 -7.488 1.00 51.03 N ATOM 1927 CA ASN A 125 -10.811 -9.148 -7.339 1.00 1.33 C ATOM 1928 C ASN A 125 -11.847 -10.241 -7.099 1.00 30.23 C ATOM 1929 O ASN A 125 -12.922 -9.982 -6.559 1.00 34.25 O ATOM 1930 CB ASN A 125 -11.183 -8.340 -8.585 1.00 2.44 C ATOM 1931 CG ASN A 125 -10.892 -6.861 -8.423 1.00 64.22 C ATOM 1932 OD1 ASN A 125 -10.889 -6.336 -7.309 1.00 75.13 O ATOM 1933 ND2 ASN A 125 -10.644 -6.182 -9.536 1.00 2.34 N ATOM 0 H ASN A 125 -9.205 -9.910 -8.453 1.00 51.03 H new ATOM 0 HA ASN A 125 -10.802 -8.485 -6.474 1.00 1.33 H new ATOM 0 HB2 ASN A 125 -10.630 -8.724 -9.442 1.00 2.44 H new ATOM 0 HB3 ASN A 125 -12.243 -8.478 -8.801 1.00 2.44 H new ATOM 0 HD21 ASN A 125 -10.440 -5.184 -9.490 1.00 2.34 H new ATOM 0 HD22 ASN A 125 -10.657 -6.659 -10.438 1.00 2.34 H new ATOM 1940 N ASN A 126 -11.517 -11.463 -7.504 1.00 22.12 N ATOM 1941 CA ASN A 126 -12.420 -12.595 -7.333 1.00 5.34 C ATOM 1942 C ASN A 126 -11.936 -13.512 -6.214 1.00 72.44 C ATOM 1943 O ASN A 126 -12.440 -14.622 -6.046 1.00 24.00 O ATOM 1944 CB ASN A 126 -12.537 -13.383 -8.639 1.00 64.41 C ATOM 1945 CG ASN A 126 -12.839 -12.492 -9.827 1.00 31.12 C ATOM 1946 OD1 ASN A 126 -13.648 -11.568 -9.734 1.00 60.44 O ATOM 1947 ND2 ASN A 126 -12.188 -12.764 -10.952 1.00 44.34 N ATOM 0 H ASN A 126 -10.631 -11.695 -7.953 1.00 22.12 H new ATOM 0 HA ASN A 126 -13.402 -12.207 -7.062 1.00 5.34 H new ATOM 0 HB2 ASN A 126 -11.607 -13.922 -8.820 1.00 64.41 H new ATOM 0 HB3 ASN A 126 -13.324 -14.131 -8.540 1.00 64.41 H new ATOM 0 HD21 ASN A 126 -12.350 -12.197 -11.785 1.00 44.34 H new ATOM 0 HD22 ASN A 126 -11.526 -13.540 -10.984 1.00 44.34 H new ATOM 1954 N ILE A 127 -10.955 -13.040 -5.452 1.00 64.21 N ATOM 1955 CA ILE A 127 -10.404 -13.817 -4.348 1.00 53.31 C ATOM 1956 C ILE A 127 -11.007 -13.384 -3.016 1.00 13.41 C ATOM 1957 O ILE A 127 -11.221 -12.197 -2.778 1.00 22.03 O ATOM 1958 CB ILE A 127 -8.871 -13.680 -4.274 1.00 71.21 C ATOM 1959 CG1 ILE A 127 -8.201 -14.692 -5.205 1.00 12.14 C ATOM 1960 CG2 ILE A 127 -8.392 -13.871 -2.843 1.00 2.33 C ATOM 1961 CD1 ILE A 127 -6.690 -14.620 -5.190 1.00 51.21 C ATOM 0 H ILE A 127 -10.525 -12.124 -5.579 1.00 64.21 H new ATOM 0 HA ILE A 127 -10.659 -14.860 -4.537 1.00 53.31 H new ATOM 0 HB ILE A 127 -8.594 -12.677 -4.599 1.00 71.21 H new ATOM 0 HG12 ILE A 127 -8.511 -15.697 -4.919 1.00 12.14 H new ATOM 0 HG13 ILE A 127 -8.554 -14.526 -6.223 1.00 12.14 H new ATOM 0 HG21 ILE A 127 -7.307 -13.772 -2.806 1.00 2.33 H new ATOM 0 HG22 ILE A 127 -8.848 -13.116 -2.203 1.00 2.33 H new ATOM 0 HG23 ILE A 127 -8.677 -14.863 -2.493 1.00 2.33 H new ATOM 0 HD11 ILE A 127 -6.283 -15.366 -5.873 1.00 51.21 H new ATOM 0 HD12 ILE A 127 -6.370 -13.627 -5.505 1.00 51.21 H new ATOM 0 HD13 ILE A 127 -6.326 -14.816 -4.181 1.00 51.21 H new ATOM 1973 N ASN A 128 -11.277 -14.357 -2.151 1.00 2.43 N ATOM 1974 CA ASN A 128 -11.854 -14.075 -0.842 1.00 53.34 C ATOM 1975 C ASN A 128 -11.063 -12.989 -0.120 1.00 63.41 C ATOM 1976 O ASN A 128 -11.349 -12.662 1.032 1.00 72.01 O ATOM 1977 CB ASN A 128 -11.887 -15.348 0.007 1.00 3.42 C ATOM 1978 CG ASN A 128 -10.535 -15.676 0.610 1.00 11.34 C ATOM 1979 OD1 ASN A 128 -10.373 -15.684 1.830 1.00 54.30 O ATOM 1980 ND2 ASN A 128 -9.556 -15.947 -0.246 1.00 25.45 N ATOM 0 H ASN A 128 -11.106 -15.346 -2.333 1.00 2.43 H new ATOM 0 HA ASN A 128 -12.873 -13.718 -0.991 1.00 53.34 H new ATOM 0 HB2 ASN A 128 -12.619 -15.230 0.806 1.00 3.42 H new ATOM 0 HB3 ASN A 128 -12.219 -16.184 -0.609 1.00 3.42 H new ATOM 0 HD21 ASN A 128 -8.624 -16.174 0.100 1.00 25.45 H new ATOM 0 HD22 ASN A 128 -9.736 -15.928 -1.250 1.00 25.45 H new