USER MOD reduce.3.24.130724 H: found=0, std=0, add=616, rem=0, adj=14 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 125 ASN : amide:sc= -0.305 K(o=-1.1,f=-0.47) USER MOD Set 1.2: A 126 ASN : amide:sc= -0.757 X(o=-1.1,f=-0.89) USER MOD Set 2.1: A 73 ASN : amide:sc= 0.666 K(o=-1,f=-0.051) USER MOD Set 2.2: A 128 ASN : amide:sc= -1.69! K(o=-1!,f=0.82) USER MOD Single : A 25 GLN : amide:sc= -0.331 K(o=-0.33,f=-1.8!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.0918 X(o=-0.092,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 151:sc= -0.675 (180deg=-1.73) 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 -60:sc= -0.315 USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 ASN : amide:sc= -0.38 X(o=-0.38,f=-0.084) USER MOD Single : A 62 GLN : amide:sc= -1.05 X(o=-1.1,f=-1.2) USER MOD Single : A 65 LYS NZ :NH3+ -157:sc= -0.0489 (180deg=-0.355) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 GLN : amide:sc= -0.0408 K(o=-0.041,f=-1.6!) 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 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 20:sc= 0.243 USER MOD Single : A 101 MET CE :methyl -133:sc= -3.54 (180deg=-4.64!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= -0.444 X(o=-0.44,f=-0.61) 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 65:sc= -0.164 USER MOD Single : A 110 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -1.09 X(o=-1.1,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 316 N ILE A 23 0.102 -27.897 -14.567 1.00 52.50 N ATOM 317 CA ILE A 23 -1.279 -27.794 -15.022 1.00 71.21 C ATOM 318 C ILE A 23 -1.728 -29.078 -15.711 1.00 10.42 C ATOM 319 O ILE A 23 -0.944 -29.730 -16.400 1.00 53.52 O ATOM 320 CB ILE A 23 -1.465 -26.612 -15.991 1.00 41.35 C ATOM 321 CG1 ILE A 23 -1.057 -25.301 -15.317 1.00 13.10 C ATOM 322 CG2 ILE A 23 -2.908 -26.541 -16.469 1.00 73.31 C ATOM 323 CD1 ILE A 23 -0.925 -24.141 -16.279 1.00 74.23 C ATOM 0 HA ILE A 23 -1.892 -27.627 -14.136 1.00 71.21 H new ATOM 0 HB ILE A 23 -0.822 -26.768 -16.857 1.00 41.35 H new ATOM 0 HG12 ILE A 23 -1.795 -25.049 -14.556 1.00 13.10 H new ATOM 0 HG13 ILE A 23 -0.106 -25.446 -14.804 1.00 13.10 H new ATOM 0 HG21 ILE A 23 -3.024 -25.700 -17.153 1.00 73.31 H new ATOM 0 HG22 ILE A 23 -3.167 -27.466 -16.984 1.00 73.31 H new ATOM 0 HG23 ILE A 23 -3.569 -26.405 -15.613 1.00 73.31 H new ATOM 0 HD11 ILE A 23 -0.633 -23.245 -15.731 1.00 74.23 H new ATOM 0 HD12 ILE A 23 -0.166 -24.373 -17.026 1.00 74.23 H new ATOM 0 HD13 ILE A 23 -1.881 -23.968 -16.774 1.00 74.23 H new ATOM 335 N GLU A 24 -2.994 -29.434 -15.520 1.00 71.32 N ATOM 336 CA GLU A 24 -3.548 -30.640 -16.124 1.00 63.12 C ATOM 337 C GLU A 24 -4.506 -30.290 -17.259 1.00 45.22 C ATOM 338 O GLU A 24 -5.130 -29.229 -17.252 1.00 40.33 O ATOM 339 CB GLU A 24 -4.273 -31.479 -15.070 1.00 43.20 C ATOM 340 CG GLU A 24 -5.685 -31.874 -15.473 1.00 24.25 C ATOM 341 CD GLU A 24 -6.373 -32.724 -14.423 1.00 12.10 C ATOM 342 OE1 GLU A 24 -5.944 -32.682 -13.250 1.00 52.34 O ATOM 343 OE2 GLU A 24 -7.341 -33.432 -14.773 1.00 51.31 O ATOM 0 H GLU A 24 -3.655 -28.905 -14.952 1.00 71.32 H new ATOM 0 HA GLU A 24 -2.722 -31.221 -16.535 1.00 63.12 H new ATOM 0 HB2 GLU A 24 -3.694 -32.382 -14.875 1.00 43.20 H new ATOM 0 HB3 GLU A 24 -4.314 -30.918 -14.136 1.00 43.20 H new ATOM 0 HG2 GLU A 24 -6.274 -30.974 -15.650 1.00 24.25 H new ATOM 0 HG3 GLU A 24 -5.651 -32.423 -16.414 1.00 24.25 H new ATOM 350 N GLN A 25 -4.616 -31.188 -18.232 1.00 72.41 N ATOM 351 CA GLN A 25 -5.497 -30.974 -19.374 1.00 70.32 C ATOM 352 C GLN A 25 -6.841 -31.661 -19.161 1.00 34.23 C ATOM 353 O GLN A 25 -6.906 -32.878 -18.980 1.00 3.23 O ATOM 354 CB GLN A 25 -4.842 -31.493 -20.655 1.00 62.23 C ATOM 355 CG GLN A 25 -4.307 -32.911 -20.532 1.00 24.51 C ATOM 356 CD GLN A 25 -2.807 -32.952 -20.314 1.00 33.21 C ATOM 357 OE1 GLN A 25 -2.079 -32.066 -20.762 1.00 64.03 O ATOM 358 NE2 GLN A 25 -2.337 -33.983 -19.621 1.00 41.21 N ATOM 0 H GLN A 25 -4.106 -32.071 -18.253 1.00 72.41 H new ATOM 0 HA GLN A 25 -5.670 -29.902 -19.472 1.00 70.32 H new ATOM 0 HB2 GLN A 25 -5.570 -31.457 -21.466 1.00 62.23 H new ATOM 0 HB3 GLN A 25 -4.024 -30.827 -20.931 1.00 62.23 H new ATOM 0 HG2 GLN A 25 -4.805 -33.412 -19.702 1.00 24.51 H new ATOM 0 HG3 GLN A 25 -4.554 -33.468 -21.436 1.00 24.51 H new ATOM 0 HE21 GLN A 25 -2.977 -34.695 -19.268 1.00 41.21 H new ATOM 0 HE22 GLN A 25 -1.336 -34.063 -19.441 1.00 41.21 H new ATOM 367 N ILE A 26 -7.912 -30.875 -19.184 1.00 31.52 N ATOM 368 CA ILE A 26 -9.256 -31.409 -18.994 1.00 43.51 C ATOM 369 C ILE A 26 -10.010 -31.483 -20.317 1.00 72.10 C ATOM 370 O ILE A 26 -9.464 -31.167 -21.373 1.00 74.50 O ATOM 371 CB ILE A 26 -10.065 -30.555 -18.001 1.00 53.31 C ATOM 372 CG1 ILE A 26 -10.219 -29.127 -18.530 1.00 70.00 C ATOM 373 CG2 ILE A 26 -9.394 -30.550 -16.635 1.00 53.23 C ATOM 374 CD1 ILE A 26 -11.592 -28.837 -19.095 1.00 44.33 C ATOM 0 H ILE A 26 -7.876 -29.866 -19.332 1.00 31.52 H new ATOM 0 HA ILE A 26 -9.142 -32.414 -18.587 1.00 43.51 H new ATOM 0 HB ILE A 26 -11.058 -30.992 -17.894 1.00 53.31 H new ATOM 0 HG12 ILE A 26 -10.011 -28.425 -17.723 1.00 70.00 H new ATOM 0 HG13 ILE A 26 -9.472 -28.952 -19.304 1.00 70.00 H new ATOM 0 HG21 ILE A 26 -9.979 -29.942 -15.945 1.00 53.23 H new ATOM 0 HG22 ILE A 26 -9.332 -31.570 -16.256 1.00 53.23 H new ATOM 0 HG23 ILE A 26 -8.390 -30.134 -16.724 1.00 53.23 H new ATOM 0 HD11 ILE A 26 -11.629 -27.807 -19.451 1.00 44.33 H new ATOM 0 HD12 ILE A 26 -11.795 -29.515 -19.924 1.00 44.33 H new ATOM 0 HD13 ILE A 26 -12.343 -28.979 -18.318 1.00 44.33 H new ATOM 386 N GLY A 27 -11.270 -31.902 -20.252 1.00 34.03 N ATOM 387 CA GLY A 27 -12.080 -32.008 -21.450 1.00 51.40 C ATOM 388 C GLY A 27 -13.403 -31.280 -21.323 1.00 43.34 C ATOM 389 O GLY A 27 -13.906 -31.080 -20.217 1.00 62.43 O ATOM 0 H GLY A 27 -11.744 -32.170 -19.390 1.00 34.03 H new ATOM 0 HA2 GLY A 27 -11.526 -31.602 -22.296 1.00 51.40 H new ATOM 0 HA3 GLY A 27 -12.267 -33.060 -21.666 1.00 51.40 H new ATOM 393 N ASP A 28 -13.968 -30.879 -22.457 1.00 72.03 N ATOM 394 CA ASP A 28 -15.241 -30.168 -22.467 1.00 72.25 C ATOM 395 C ASP A 28 -16.321 -30.976 -21.756 1.00 30.43 C ATOM 396 O ASP A 28 -17.248 -30.414 -21.171 1.00 45.30 O ATOM 397 CB ASP A 28 -15.672 -29.872 -23.905 1.00 20.12 C ATOM 398 CG ASP A 28 -16.375 -31.049 -24.552 1.00 62.32 C ATOM 399 OD1 ASP A 28 -15.702 -32.065 -24.825 1.00 15.13 O ATOM 400 OD2 ASP A 28 -17.599 -30.954 -24.786 1.00 61.43 O ATOM 0 H ASP A 28 -13.564 -31.034 -23.381 1.00 72.03 H new ATOM 0 HA ASP A 28 -15.107 -29.227 -21.934 1.00 72.25 H new ATOM 0 HB2 ASP A 28 -16.336 -29.007 -23.912 1.00 20.12 H new ATOM 0 HB3 ASP A 28 -14.796 -29.606 -24.496 1.00 20.12 H new ATOM 405 N SER A 29 -16.196 -32.298 -21.809 1.00 34.14 N ATOM 406 CA SER A 29 -17.164 -33.184 -21.173 1.00 40.21 C ATOM 407 C SER A 29 -16.898 -33.294 -19.675 1.00 24.42 C ATOM 408 O SER A 29 -17.776 -33.680 -18.904 1.00 3.01 O ATOM 409 CB SER A 29 -17.116 -34.571 -21.814 1.00 63.34 C ATOM 410 OG SER A 29 -17.945 -34.632 -22.963 1.00 42.24 O ATOM 0 H SER A 29 -15.434 -32.779 -22.286 1.00 34.14 H new ATOM 0 HA SER A 29 -18.157 -32.759 -21.318 1.00 40.21 H new ATOM 0 HB2 SER A 29 -16.089 -34.812 -22.089 1.00 63.34 H new ATOM 0 HB3 SER A 29 -17.436 -35.321 -21.090 1.00 63.34 H new ATOM 0 HG SER A 29 -17.895 -35.529 -23.355 1.00 42.24 H new ATOM 416 N GLU A 30 -15.678 -32.954 -19.271 1.00 3.41 N ATOM 417 CA GLU A 30 -15.294 -33.015 -17.866 1.00 21.44 C ATOM 418 C GLU A 30 -15.244 -31.618 -17.253 1.00 70.14 C ATOM 419 O GLU A 30 -14.949 -31.458 -16.068 1.00 61.05 O ATOM 420 CB GLU A 30 -13.934 -33.699 -17.714 1.00 71.22 C ATOM 421 CG GLU A 30 -13.717 -34.844 -18.689 1.00 52.14 C ATOM 422 CD GLU A 30 -14.922 -35.759 -18.792 1.00 63.22 C ATOM 423 OE1 GLU A 30 -15.613 -35.946 -17.768 1.00 62.15 O ATOM 424 OE2 GLU A 30 -15.174 -36.288 -19.895 1.00 33.44 O ATOM 0 H GLU A 30 -14.939 -32.634 -19.897 1.00 3.41 H new ATOM 0 HA GLU A 30 -16.047 -33.598 -17.336 1.00 21.44 H new ATOM 0 HB2 GLU A 30 -13.147 -32.959 -17.855 1.00 71.22 H new ATOM 0 HB3 GLU A 30 -13.838 -34.077 -16.696 1.00 71.22 H new ATOM 0 HG2 GLU A 30 -13.488 -34.439 -19.675 1.00 52.14 H new ATOM 0 HG3 GLU A 30 -12.850 -35.425 -18.374 1.00 52.14 H new ATOM 431 N PHE A 31 -15.532 -30.610 -18.069 1.00 51.15 N ATOM 432 CA PHE A 31 -15.518 -29.227 -17.610 1.00 15.33 C ATOM 433 C PHE A 31 -16.283 -29.082 -16.296 1.00 52.25 C ATOM 434 O PHE A 31 -15.686 -28.896 -15.236 1.00 53.02 O ATOM 435 CB PHE A 31 -16.128 -28.308 -18.671 1.00 75.15 C ATOM 436 CG PHE A 31 -16.508 -26.953 -18.145 1.00 65.24 C ATOM 437 CD1 PHE A 31 -15.569 -26.153 -17.513 1.00 33.35 C ATOM 438 CD2 PHE A 31 -17.802 -26.478 -18.285 1.00 72.53 C ATOM 439 CE1 PHE A 31 -15.916 -24.907 -17.028 1.00 31.30 C ATOM 440 CE2 PHE A 31 -18.154 -25.233 -17.802 1.00 51.23 C ATOM 441 CZ PHE A 31 -17.210 -24.446 -17.174 1.00 13.43 C ATOM 0 H PHE A 31 -15.778 -30.725 -19.052 1.00 51.15 H new ATOM 0 HA PHE A 31 -14.481 -28.938 -17.441 1.00 15.33 H new ATOM 0 HB2 PHE A 31 -15.416 -28.185 -19.487 1.00 75.15 H new ATOM 0 HB3 PHE A 31 -17.013 -28.787 -19.090 1.00 75.15 H new ATOM 0 HD1 PHE A 31 -14.555 -26.508 -17.399 1.00 33.35 H new ATOM 0 HD2 PHE A 31 -18.544 -27.089 -18.778 1.00 72.53 H new ATOM 0 HE1 PHE A 31 -15.176 -24.294 -16.535 1.00 31.30 H new ATOM 0 HE2 PHE A 31 -19.167 -24.876 -17.916 1.00 51.23 H new ATOM 0 HZ PHE A 31 -17.483 -23.471 -16.797 1.00 13.43 H new ATOM 451 N ASP A 32 -17.606 -29.168 -16.377 1.00 14.24 N ATOM 452 CA ASP A 32 -18.453 -29.047 -15.196 1.00 72.32 C ATOM 453 C ASP A 32 -18.267 -30.245 -14.270 1.00 72.42 C ATOM 454 O ASP A 32 -18.511 -30.155 -13.068 1.00 33.44 O ATOM 455 CB ASP A 32 -19.922 -28.926 -15.605 1.00 63.01 C ATOM 456 CG ASP A 32 -20.311 -29.933 -16.669 1.00 24.01 C ATOM 457 OD1 ASP A 32 -20.541 -31.109 -16.317 1.00 50.53 O ATOM 458 OD2 ASP A 32 -20.386 -29.546 -17.855 1.00 24.23 O ATOM 0 H ASP A 32 -18.115 -29.321 -17.248 1.00 14.24 H new ATOM 0 HA ASP A 32 -18.159 -28.145 -14.659 1.00 72.32 H new ATOM 0 HB2 ASP A 32 -20.553 -29.067 -14.728 1.00 63.01 H new ATOM 0 HB3 ASP A 32 -20.111 -27.919 -15.976 1.00 63.01 H new ATOM 463 N ASN A 33 -17.836 -31.366 -14.839 1.00 0.41 N ATOM 464 CA ASN A 33 -17.620 -32.582 -14.064 1.00 71.43 C ATOM 465 C ASN A 33 -16.732 -32.307 -12.855 1.00 5.31 C ATOM 466 O ASN A 33 -16.914 -32.896 -11.789 1.00 42.22 O ATOM 467 CB ASN A 33 -16.986 -33.664 -14.941 1.00 3.30 C ATOM 468 CG ASN A 33 -17.215 -35.060 -14.395 1.00 61.22 C ATOM 469 OD1 ASN A 33 -18.060 -35.804 -14.895 1.00 43.52 O ATOM 470 ND2 ASN A 33 -16.463 -35.423 -13.363 1.00 2.02 N ATOM 0 H ASN A 33 -17.630 -31.457 -15.834 1.00 0.41 H new ATOM 0 HA ASN A 33 -18.589 -32.933 -13.708 1.00 71.43 H new ATOM 0 HB2 ASN A 33 -17.398 -33.599 -15.948 1.00 3.30 H new ATOM 0 HB3 ASN A 33 -15.915 -33.480 -15.022 1.00 3.30 H new ATOM 0 HD21 ASN A 33 -16.573 -36.350 -12.953 1.00 2.02 H new ATOM 0 HD22 ASN A 33 -15.775 -34.775 -12.980 1.00 2.02 H new ATOM 477 N LYS A 34 -15.770 -31.407 -13.027 1.00 61.14 N ATOM 478 CA LYS A 34 -14.853 -31.050 -11.951 1.00 61.34 C ATOM 479 C LYS A 34 -15.030 -29.590 -11.548 1.00 34.21 C ATOM 480 O LYS A 34 -14.691 -29.199 -10.431 1.00 0.52 O ATOM 481 CB LYS A 34 -13.406 -31.300 -12.382 1.00 4.45 C ATOM 482 CG LYS A 34 -13.037 -30.628 -13.694 1.00 54.12 C ATOM 483 CD LYS A 34 -12.453 -31.621 -14.683 1.00 72.43 C ATOM 484 CE LYS A 34 -11.027 -32.003 -14.314 1.00 73.13 C ATOM 485 NZ LYS A 34 -10.990 -33.041 -13.248 1.00 34.51 N ATOM 0 H LYS A 34 -15.605 -30.911 -13.903 1.00 61.14 H new ATOM 0 HA LYS A 34 -15.082 -31.677 -11.089 1.00 61.34 H new ATOM 0 HB2 LYS A 34 -12.736 -30.943 -11.600 1.00 4.45 H new ATOM 0 HB3 LYS A 34 -13.244 -32.374 -12.475 1.00 4.45 H new ATOM 0 HG2 LYS A 34 -13.922 -30.160 -14.126 1.00 54.12 H new ATOM 0 HG3 LYS A 34 -12.316 -29.833 -13.506 1.00 54.12 H new ATOM 0 HD2 LYS A 34 -13.075 -32.516 -14.712 1.00 72.43 H new ATOM 0 HD3 LYS A 34 -12.468 -31.190 -15.684 1.00 72.43 H new ATOM 0 HE2 LYS A 34 -10.509 -32.373 -15.199 1.00 73.13 H new ATOM 0 HE3 LYS A 34 -10.489 -31.117 -13.977 1.00 73.13 H new ATOM 0 HZ1 LYS A 34 -10.130 -33.616 -13.353 1.00 34.51 H new ATOM 0 HZ2 LYS A 34 -10.987 -32.581 -12.315 1.00 34.51 H new ATOM 0 HZ3 LYS A 34 -11.827 -33.653 -13.330 1.00 34.51 H new ATOM 499 N VAL A 35 -15.564 -28.788 -12.464 1.00 34.33 N ATOM 500 CA VAL A 35 -15.789 -27.372 -12.201 1.00 51.44 C ATOM 501 C VAL A 35 -17.043 -27.160 -11.361 1.00 12.33 C ATOM 502 O VAL A 35 -17.000 -26.516 -10.312 1.00 34.24 O ATOM 503 CB VAL A 35 -15.923 -26.572 -13.512 1.00 22.45 C ATOM 504 CG1 VAL A 35 -16.506 -25.195 -13.240 1.00 52.31 C ATOM 505 CG2 VAL A 35 -14.574 -26.463 -14.208 1.00 15.43 C ATOM 0 H VAL A 35 -15.849 -29.095 -13.394 1.00 34.33 H new ATOM 0 HA VAL A 35 -14.921 -27.012 -11.649 1.00 51.44 H new ATOM 0 HB VAL A 35 -16.606 -27.103 -14.175 1.00 22.45 H new ATOM 0 HG11 VAL A 35 -16.593 -24.645 -14.177 1.00 52.31 H new ATOM 0 HG12 VAL A 35 -17.492 -25.300 -12.788 1.00 52.31 H new ATOM 0 HG13 VAL A 35 -15.851 -24.651 -12.559 1.00 52.31 H new ATOM 0 HG21 VAL A 35 -14.686 -25.895 -15.132 1.00 15.43 H new ATOM 0 HG22 VAL A 35 -13.867 -25.954 -13.553 1.00 15.43 H new ATOM 0 HG23 VAL A 35 -14.202 -27.461 -14.438 1.00 15.43 H new ATOM 515 N THR A 36 -18.162 -27.707 -11.827 1.00 23.22 N ATOM 516 CA THR A 36 -19.429 -27.578 -11.119 1.00 25.31 C ATOM 517 C THR A 36 -19.361 -28.238 -9.747 1.00 21.25 C ATOM 518 O THR A 36 -20.138 -27.909 -8.850 1.00 61.41 O ATOM 519 CB THR A 36 -20.586 -28.203 -11.920 1.00 24.40 C ATOM 520 OG1 THR A 36 -21.779 -27.433 -11.739 1.00 52.21 O ATOM 521 CG2 THR A 36 -20.832 -29.640 -11.483 1.00 14.11 C ATOM 0 H THR A 36 -18.216 -28.244 -12.693 1.00 23.22 H new ATOM 0 HA THR A 36 -19.616 -26.511 -10.997 1.00 25.31 H new ATOM 0 HB THR A 36 -20.311 -28.203 -12.975 1.00 24.40 H new ATOM 0 HG1 THR A 36 -22.510 -27.836 -12.253 1.00 52.21 H new ATOM 0 HG21 THR A 36 -21.654 -30.061 -12.062 1.00 14.11 H new ATOM 0 HG22 THR A 36 -19.931 -30.230 -11.649 1.00 14.11 H new ATOM 0 HG23 THR A 36 -21.088 -29.659 -10.424 1.00 14.11 H new ATOM 529 N SER A 37 -18.426 -29.170 -9.589 1.00 14.22 N ATOM 530 CA SER A 37 -18.259 -29.879 -8.325 1.00 52.32 C ATOM 531 C SER A 37 -17.294 -29.134 -7.408 1.00 53.20 C ATOM 532 O SER A 37 -17.285 -29.346 -6.195 1.00 32.53 O ATOM 533 CB SER A 37 -17.749 -31.299 -8.576 1.00 12.31 C ATOM 534 OG SER A 37 -18.177 -32.182 -7.554 1.00 23.30 O ATOM 0 H SER A 37 -17.773 -29.452 -10.320 1.00 14.22 H new ATOM 0 HA SER A 37 -19.231 -29.931 -7.835 1.00 52.32 H new ATOM 0 HB2 SER A 37 -18.110 -31.653 -9.542 1.00 12.31 H new ATOM 0 HB3 SER A 37 -16.660 -31.295 -8.625 1.00 12.31 H new ATOM 0 HG SER A 37 -17.840 -33.083 -7.738 1.00 23.30 H new ATOM 540 N CYS A 38 -16.485 -28.260 -7.996 1.00 31.15 N ATOM 541 CA CYS A 38 -15.514 -27.484 -7.233 1.00 55.44 C ATOM 542 C CYS A 38 -16.211 -26.625 -6.182 1.00 24.01 C ATOM 543 O CYS A 38 -16.710 -25.542 -6.483 1.00 1.31 O ATOM 544 CB CYS A 38 -14.690 -26.598 -8.168 1.00 50.43 C ATOM 545 SG CYS A 38 -13.180 -25.941 -7.422 1.00 51.34 S ATOM 0 H CYS A 38 -16.482 -28.071 -8.998 1.00 31.15 H new ATOM 0 HA CYS A 38 -14.848 -28.181 -6.724 1.00 55.44 H new ATOM 0 HB2 CYS A 38 -14.424 -27.173 -9.055 1.00 50.43 H new ATOM 0 HB3 CYS A 38 -15.309 -25.766 -8.502 1.00 50.43 H new ATOM 0 HG CYS A 38 -13.487 -25.216 -6.387 1.00 51.34 H new ATOM 551 N ASN A 39 -16.242 -27.118 -4.948 1.00 43.53 N ATOM 552 CA ASN A 39 -16.879 -26.396 -3.853 1.00 34.53 C ATOM 553 C ASN A 39 -15.836 -25.736 -2.956 1.00 40.14 C ATOM 554 O ASN A 39 -16.139 -25.317 -1.839 1.00 34.52 O ATOM 555 CB ASN A 39 -17.750 -27.346 -3.027 1.00 62.21 C ATOM 556 CG ASN A 39 -18.962 -26.653 -2.436 1.00 2.12 C ATOM 557 OD1 ASN A 39 -19.975 -26.467 -3.110 1.00 62.30 O ATOM 558 ND2 ASN A 39 -18.863 -26.267 -1.169 1.00 54.11 N ATOM 0 H ASN A 39 -15.834 -28.014 -4.682 1.00 43.53 H new ATOM 0 HA ASN A 39 -17.508 -25.616 -4.283 1.00 34.53 H new ATOM 0 HB2 ASN A 39 -18.079 -28.173 -3.657 1.00 62.21 H new ATOM 0 HB3 ASN A 39 -17.153 -27.776 -2.223 1.00 62.21 H new ATOM 0 HD21 ASN A 39 -19.646 -25.796 -0.717 1.00 54.11 H new ATOM 0 HD22 ASN A 39 -18.004 -26.442 -0.648 1.00 54.11 H new ATOM 565 N ASP A 40 -14.609 -25.645 -3.455 1.00 45.34 N ATOM 566 CA ASP A 40 -13.521 -25.033 -2.701 1.00 20.02 C ATOM 567 C ASP A 40 -13.481 -23.526 -2.929 1.00 50.34 C ATOM 568 O ASP A 40 -12.561 -22.844 -2.479 1.00 73.13 O ATOM 569 CB ASP A 40 -12.182 -25.657 -3.099 1.00 44.11 C ATOM 570 CG ASP A 40 -12.010 -27.060 -2.550 1.00 41.31 C ATOM 571 OD1 ASP A 40 -12.669 -27.386 -1.541 1.00 0.11 O ATOM 572 OD2 ASP A 40 -11.216 -27.831 -3.128 1.00 41.24 O ATOM 0 H ASP A 40 -14.342 -25.987 -4.378 1.00 45.34 H new ATOM 0 HA ASP A 40 -13.699 -25.217 -1.641 1.00 20.02 H new ATOM 0 HB2 ASP A 40 -12.106 -25.684 -4.186 1.00 44.11 H new ATOM 0 HB3 ASP A 40 -11.369 -25.027 -2.738 1.00 44.11 H new ATOM 577 N ASN A 41 -14.486 -23.012 -3.632 1.00 64.15 N ATOM 578 CA ASN A 41 -14.565 -21.585 -3.922 1.00 33.45 C ATOM 579 C ASN A 41 -13.322 -21.112 -4.671 1.00 33.24 C ATOM 580 O ASN A 41 -12.971 -19.933 -4.626 1.00 50.23 O ATOM 581 CB ASN A 41 -14.728 -20.789 -2.625 1.00 65.20 C ATOM 582 CG ASN A 41 -16.179 -20.650 -2.210 1.00 23.13 C ATOM 583 OD1 ASN A 41 -16.541 -20.941 -1.070 1.00 25.31 O ATOM 584 ND2 ASN A 41 -17.019 -20.203 -3.136 1.00 63.34 N ATOM 0 H ASN A 41 -15.256 -23.563 -4.011 1.00 64.15 H new ATOM 0 HA ASN A 41 -15.435 -21.415 -4.556 1.00 33.45 H new ATOM 0 HB2 ASN A 41 -14.171 -21.281 -1.828 1.00 65.20 H new ATOM 0 HB3 ASN A 41 -14.293 -19.798 -2.753 1.00 65.20 H new ATOM 0 HD21 ASN A 41 -18.008 -20.089 -2.915 1.00 63.34 H new ATOM 0 HD22 ASN A 41 -16.675 -19.974 -4.069 1.00 63.34 H new ATOM 591 N ILE A 42 -12.664 -22.039 -5.357 1.00 30.15 N ATOM 592 CA ILE A 42 -11.462 -21.717 -6.117 1.00 31.32 C ATOM 593 C ILE A 42 -11.791 -21.455 -7.581 1.00 41.34 C ATOM 594 O ILE A 42 -12.502 -22.234 -8.219 1.00 12.51 O ATOM 595 CB ILE A 42 -10.421 -22.849 -6.030 1.00 40.33 C ATOM 596 CG1 ILE A 42 -10.161 -23.222 -4.570 1.00 31.15 C ATOM 597 CG2 ILE A 42 -9.128 -22.432 -6.715 1.00 3.31 C ATOM 598 CD1 ILE A 42 -9.160 -24.344 -4.401 1.00 74.15 C ATOM 0 H ILE A 42 -12.942 -23.019 -5.403 1.00 30.15 H new ATOM 0 HA ILE A 42 -11.042 -20.814 -5.675 1.00 31.32 H new ATOM 0 HB ILE A 42 -10.815 -23.726 -6.544 1.00 40.33 H new ATOM 0 HG12 ILE A 42 -9.801 -22.342 -4.037 1.00 31.15 H new ATOM 0 HG13 ILE A 42 -11.103 -23.513 -4.105 1.00 31.15 H new ATOM 0 HG21 ILE A 42 -8.402 -23.242 -6.645 1.00 3.31 H new ATOM 0 HG22 ILE A 42 -9.327 -22.212 -7.764 1.00 3.31 H new ATOM 0 HG23 ILE A 42 -8.728 -21.543 -6.227 1.00 3.31 H new ATOM 0 HD11 ILE A 42 -9.025 -24.555 -3.340 1.00 74.15 H new ATOM 0 HD12 ILE A 42 -9.527 -25.238 -4.905 1.00 74.15 H new ATOM 0 HD13 ILE A 42 -8.205 -24.049 -4.836 1.00 74.15 H new ATOM 610 N LEU A 43 -11.270 -20.354 -8.111 1.00 40.54 N ATOM 611 CA LEU A 43 -11.507 -19.988 -9.504 1.00 63.50 C ATOM 612 C LEU A 43 -10.571 -20.754 -10.435 1.00 24.21 C ATOM 613 O LEU A 43 -9.350 -20.694 -10.288 1.00 62.32 O ATOM 614 CB LEU A 43 -11.317 -18.484 -9.696 1.00 50.44 C ATOM 615 CG LEU A 43 -9.985 -17.907 -9.216 1.00 62.42 C ATOM 616 CD1 LEU A 43 -9.060 -17.645 -10.394 1.00 51.24 C ATOM 617 CD2 LEU A 43 -10.212 -16.631 -8.419 1.00 42.21 C ATOM 0 H LEU A 43 -10.681 -19.699 -7.598 1.00 40.54 H new ATOM 0 HA LEU A 43 -12.535 -20.252 -9.754 1.00 63.50 H new ATOM 0 HB2 LEU A 43 -11.427 -18.257 -10.756 1.00 50.44 H new ATOM 0 HB3 LEU A 43 -12.123 -17.967 -9.174 1.00 50.44 H new ATOM 0 HG LEU A 43 -9.509 -18.639 -8.563 1.00 62.42 H new ATOM 0 HD11 LEU A 43 -8.117 -17.235 -10.032 1.00 51.24 H new ATOM 0 HD12 LEU A 43 -8.870 -18.579 -10.922 1.00 51.24 H new ATOM 0 HD13 LEU A 43 -9.529 -16.933 -11.073 1.00 51.24 H new ATOM 0 HD21 LEU A 43 -9.253 -16.235 -8.086 1.00 42.21 H new ATOM 0 HD22 LEU A 43 -10.711 -15.893 -9.048 1.00 42.21 H new ATOM 0 HD23 LEU A 43 -10.835 -16.850 -7.552 1.00 42.21 H new ATOM 629 N ILE A 44 -11.151 -21.469 -11.392 1.00 21.31 N ATOM 630 CA ILE A 44 -10.369 -22.242 -12.348 1.00 65.53 C ATOM 631 C ILE A 44 -10.213 -21.492 -13.666 1.00 4.02 C ATOM 632 O ILE A 44 -11.201 -21.111 -14.297 1.00 24.12 O ATOM 633 CB ILE A 44 -11.012 -23.614 -12.624 1.00 53.24 C ATOM 634 CG1 ILE A 44 -11.280 -24.350 -11.310 1.00 74.33 C ATOM 635 CG2 ILE A 44 -10.118 -24.446 -13.531 1.00 30.21 C ATOM 636 CD1 ILE A 44 -12.751 -24.479 -10.979 1.00 1.45 C ATOM 0 H ILE A 44 -12.160 -21.529 -11.526 1.00 21.31 H new ATOM 0 HA ILE A 44 -9.387 -22.394 -11.901 1.00 65.53 H new ATOM 0 HB ILE A 44 -11.964 -23.457 -13.131 1.00 53.24 H new ATOM 0 HG12 ILE A 44 -10.839 -25.345 -11.364 1.00 74.33 H new ATOM 0 HG13 ILE A 44 -10.778 -23.823 -10.499 1.00 74.33 H new ATOM 0 HG21 ILE A 44 -10.587 -25.413 -13.716 1.00 30.21 H new ATOM 0 HG22 ILE A 44 -9.974 -23.925 -14.477 1.00 30.21 H new ATOM 0 HG23 ILE A 44 -9.152 -24.598 -13.050 1.00 30.21 H new ATOM 0 HD11 ILE A 44 -12.866 -25.011 -10.035 1.00 1.45 H new ATOM 0 HD12 ILE A 44 -13.193 -23.486 -10.892 1.00 1.45 H new ATOM 0 HD13 ILE A 44 -13.255 -25.033 -11.771 1.00 1.45 H new ATOM 648 N LEU A 45 -8.968 -21.283 -14.077 1.00 43.35 N ATOM 649 CA LEU A 45 -8.682 -20.579 -15.323 1.00 3.23 C ATOM 650 C LEU A 45 -8.427 -21.565 -16.460 1.00 11.21 C ATOM 651 O LEU A 45 -7.360 -22.174 -16.540 1.00 74.13 O ATOM 652 CB LEU A 45 -7.470 -19.663 -15.147 1.00 44.40 C ATOM 653 CG LEU A 45 -7.776 -18.201 -14.816 1.00 62.25 C ATOM 654 CD1 LEU A 45 -7.808 -17.990 -13.311 1.00 40.02 C ATOM 655 CD2 LEU A 45 -6.750 -17.282 -15.464 1.00 41.32 C ATOM 0 H LEU A 45 -8.140 -21.590 -13.567 1.00 43.35 H new ATOM 0 HA LEU A 45 -9.553 -19.975 -15.578 1.00 3.23 H new ATOM 0 HB2 LEU A 45 -6.844 -20.071 -14.354 1.00 44.40 H new ATOM 0 HB3 LEU A 45 -6.882 -19.692 -16.064 1.00 44.40 H new ATOM 0 HG LEU A 45 -8.759 -17.955 -15.217 1.00 62.25 H new ATOM 0 HD11 LEU A 45 -8.027 -16.944 -13.095 1.00 40.02 H new ATOM 0 HD12 LEU A 45 -8.581 -18.621 -12.871 1.00 40.02 H new ATOM 0 HD13 LEU A 45 -6.839 -18.253 -12.886 1.00 40.02 H new ATOM 0 HD21 LEU A 45 -6.983 -16.246 -15.218 1.00 41.32 H new ATOM 0 HD22 LEU A 45 -5.755 -17.528 -15.093 1.00 41.32 H new ATOM 0 HD23 LEU A 45 -6.776 -17.413 -16.546 1.00 41.32 H new ATOM 667 N VAL A 46 -9.413 -21.714 -17.338 1.00 2.42 N ATOM 668 CA VAL A 46 -9.296 -22.622 -18.472 1.00 64.44 C ATOM 669 C VAL A 46 -8.750 -21.901 -19.701 1.00 14.45 C ATOM 670 O VAL A 46 -9.417 -21.039 -20.274 1.00 14.22 O ATOM 671 CB VAL A 46 -10.653 -23.259 -18.826 1.00 13.24 C ATOM 672 CG1 VAL A 46 -10.517 -24.168 -20.037 1.00 34.10 C ATOM 673 CG2 VAL A 46 -11.208 -24.023 -17.633 1.00 71.13 C ATOM 0 H VAL A 46 -10.302 -21.217 -17.286 1.00 2.42 H new ATOM 0 HA VAL A 46 -8.601 -23.408 -18.176 1.00 64.44 H new ATOM 0 HB VAL A 46 -11.355 -22.464 -19.078 1.00 13.24 H new ATOM 0 HG11 VAL A 46 -11.486 -24.609 -20.272 1.00 34.10 H new ATOM 0 HG12 VAL A 46 -10.166 -23.587 -20.890 1.00 34.10 H new ATOM 0 HG13 VAL A 46 -9.801 -24.961 -19.819 1.00 34.10 H new ATOM 0 HG21 VAL A 46 -12.167 -24.467 -17.900 1.00 71.13 H new ATOM 0 HG22 VAL A 46 -10.510 -24.810 -17.349 1.00 71.13 H new ATOM 0 HG23 VAL A 46 -11.345 -23.340 -16.795 1.00 71.13 H new ATOM 683 N ASP A 47 -7.535 -22.258 -20.098 1.00 71.33 N ATOM 684 CA ASP A 47 -6.899 -21.646 -21.259 1.00 75.44 C ATOM 685 C ASP A 47 -6.884 -22.611 -22.441 1.00 44.42 C ATOM 686 O ASP A 47 -6.717 -23.818 -22.269 1.00 2.15 O ATOM 687 CB ASP A 47 -5.473 -21.214 -20.919 1.00 2.13 C ATOM 688 CG ASP A 47 -4.562 -22.394 -20.637 1.00 51.30 C ATOM 689 OD1 ASP A 47 -4.230 -23.127 -21.591 1.00 25.30 O ATOM 690 OD2 ASP A 47 -4.182 -22.581 -19.462 1.00 35.11 O ATOM 0 H ASP A 47 -6.970 -22.968 -19.633 1.00 71.33 H new ATOM 0 HA ASP A 47 -7.479 -20.766 -21.538 1.00 75.44 H new ATOM 0 HB2 ASP A 47 -5.065 -20.634 -21.747 1.00 2.13 H new ATOM 0 HB3 ASP A 47 -5.493 -20.558 -20.049 1.00 2.13 H new ATOM 695 N PHE A 48 -7.059 -22.070 -23.643 1.00 52.31 N ATOM 696 CA PHE A 48 -7.067 -22.882 -24.853 1.00 61.22 C ATOM 697 C PHE A 48 -5.647 -23.117 -25.360 1.00 3.21 C ATOM 698 O PHE A 48 -4.690 -22.536 -24.848 1.00 44.32 O ATOM 699 CB PHE A 48 -7.903 -22.206 -25.942 1.00 14.53 C ATOM 700 CG PHE A 48 -9.310 -21.899 -25.512 1.00 12.12 C ATOM 701 CD1 PHE A 48 -10.057 -22.839 -24.821 1.00 11.40 C ATOM 702 CD2 PHE A 48 -9.883 -20.671 -25.800 1.00 52.21 C ATOM 703 CE1 PHE A 48 -11.352 -22.559 -24.425 1.00 0.41 C ATOM 704 CE2 PHE A 48 -11.177 -20.385 -25.406 1.00 54.22 C ATOM 705 CZ PHE A 48 -11.912 -21.330 -24.718 1.00 2.15 C ATOM 0 H PHE A 48 -7.197 -21.072 -23.804 1.00 52.31 H new ATOM 0 HA PHE A 48 -7.512 -23.847 -24.609 1.00 61.22 H new ATOM 0 HB2 PHE A 48 -7.413 -21.280 -26.243 1.00 14.53 H new ATOM 0 HB3 PHE A 48 -7.932 -22.851 -26.820 1.00 14.53 H new ATOM 0 HD1 PHE A 48 -9.623 -23.801 -24.589 1.00 11.40 H new ATOM 0 HD2 PHE A 48 -9.312 -19.929 -26.338 1.00 52.21 H new ATOM 0 HE1 PHE A 48 -11.925 -23.300 -23.887 1.00 0.41 H new ATOM 0 HE2 PHE A 48 -11.612 -19.424 -25.636 1.00 54.22 H new ATOM 0 HZ PHE A 48 -12.923 -21.109 -24.409 1.00 2.15 H new ATOM 884 N GLU A 60 2.775 -18.192 -22.071 1.00 12.25 N ATOM 885 CA GLU A 60 2.362 -17.337 -20.964 1.00 32.45 C ATOM 886 C GLU A 60 2.592 -18.034 -19.624 1.00 55.42 C ATOM 887 O GLU A 60 1.655 -18.480 -18.960 1.00 62.12 O ATOM 888 CB GLU A 60 0.888 -16.955 -21.107 1.00 30.34 C ATOM 889 CG GLU A 60 0.499 -16.549 -22.518 1.00 32.33 C ATOM 890 CD GLU A 60 1.543 -15.673 -23.182 1.00 23.13 C ATOM 891 OE1 GLU A 60 2.162 -14.849 -22.476 1.00 35.42 O ATOM 892 OE2 GLU A 60 1.743 -15.812 -24.406 1.00 50.14 O ATOM 0 HA GLU A 60 2.968 -16.431 -20.992 1.00 32.45 H new ATOM 0 HB2 GLU A 60 0.271 -17.799 -20.798 1.00 30.34 H new ATOM 0 HB3 GLU A 60 0.667 -16.132 -20.427 1.00 30.34 H new ATOM 0 HG2 GLU A 60 0.345 -17.444 -23.120 1.00 32.33 H new ATOM 0 HG3 GLU A 60 -0.452 -16.017 -22.490 1.00 32.33 H new ATOM 899 N PRO A 61 3.866 -18.130 -19.218 1.00 14.41 N ATOM 900 CA PRO A 61 4.249 -18.770 -17.956 1.00 50.20 C ATOM 901 C PRO A 61 3.819 -17.957 -16.740 1.00 41.53 C ATOM 902 O PRO A 61 3.784 -18.468 -15.622 1.00 22.32 O ATOM 903 CB PRO A 61 5.775 -18.839 -18.042 1.00 62.02 C ATOM 904 CG PRO A 61 6.153 -17.732 -18.964 1.00 1.52 C ATOM 905 CD PRO A 61 5.032 -17.620 -19.959 1.00 3.21 C ATOM 0 HA PRO A 61 3.772 -19.742 -17.830 1.00 50.20 H new ATOM 0 HB2 PRO A 61 6.233 -18.711 -17.061 1.00 62.02 H new ATOM 0 HB3 PRO A 61 6.107 -19.804 -18.425 1.00 62.02 H new ATOM 0 HG2 PRO A 61 6.285 -16.798 -18.418 1.00 1.52 H new ATOM 0 HG3 PRO A 61 7.098 -17.946 -19.463 1.00 1.52 H new ATOM 0 HD2 PRO A 61 4.883 -16.590 -20.283 1.00 3.21 H new ATOM 0 HD3 PRO A 61 5.229 -18.210 -20.854 1.00 3.21 H new ATOM 913 N GLN A 62 3.495 -16.688 -16.968 1.00 11.15 N ATOM 914 CA GLN A 62 3.068 -15.804 -15.889 1.00 4.33 C ATOM 915 C GLN A 62 1.869 -16.387 -15.149 1.00 54.12 C ATOM 916 O GLN A 62 1.755 -16.260 -13.929 1.00 64.54 O ATOM 917 CB GLN A 62 2.719 -14.421 -16.441 1.00 70.43 C ATOM 918 CG GLN A 62 3.842 -13.786 -17.245 1.00 42.43 C ATOM 919 CD GLN A 62 3.347 -12.707 -18.188 1.00 2.22 C ATOM 920 OE1 GLN A 62 3.856 -11.585 -18.188 1.00 72.41 O ATOM 921 NE2 GLN A 62 2.350 -13.040 -18.998 1.00 53.33 N ATOM 0 H GLN A 62 3.520 -16.249 -17.889 1.00 11.15 H new ATOM 0 HA GLN A 62 3.894 -15.708 -15.185 1.00 4.33 H new ATOM 0 HB2 GLN A 62 1.834 -14.503 -17.071 1.00 70.43 H new ATOM 0 HB3 GLN A 62 2.460 -13.763 -15.612 1.00 70.43 H new ATOM 0 HG2 GLN A 62 4.575 -13.358 -16.562 1.00 42.43 H new ATOM 0 HG3 GLN A 62 4.354 -14.558 -17.819 1.00 42.43 H new ATOM 0 HE21 GLN A 62 1.958 -13.981 -18.964 1.00 53.33 H new ATOM 0 HE22 GLN A 62 1.976 -12.355 -19.654 1.00 53.33 H new ATOM 930 N LEU A 63 0.973 -17.025 -15.895 1.00 3.30 N ATOM 931 CA LEU A 63 -0.220 -17.628 -15.311 1.00 51.52 C ATOM 932 C LEU A 63 0.154 -18.748 -14.345 1.00 11.10 C ATOM 933 O LEU A 63 -0.392 -18.839 -13.246 1.00 50.22 O ATOM 934 CB LEU A 63 -1.132 -18.171 -16.412 1.00 63.14 C ATOM 935 CG LEU A 63 -2.138 -17.181 -17.000 1.00 4.31 C ATOM 936 CD1 LEU A 63 -3.228 -16.863 -15.989 1.00 33.34 C ATOM 937 CD2 LEU A 63 -1.434 -15.907 -17.445 1.00 44.21 C ATOM 0 H LEU A 63 1.050 -17.138 -16.906 1.00 3.30 H new ATOM 0 HA LEU A 63 -0.753 -16.857 -14.755 1.00 51.52 H new ATOM 0 HB2 LEU A 63 -0.506 -18.546 -17.222 1.00 63.14 H new ATOM 0 HB3 LEU A 63 -1.682 -19.023 -16.013 1.00 63.14 H new ATOM 0 HG LEU A 63 -2.603 -17.640 -17.872 1.00 4.31 H new ATOM 0 HD11 LEU A 63 -3.934 -16.157 -16.426 1.00 33.34 H new ATOM 0 HD12 LEU A 63 -3.752 -17.780 -15.718 1.00 33.34 H new ATOM 0 HD13 LEU A 63 -2.780 -16.424 -15.097 1.00 33.34 H new ATOM 0 HD21 LEU A 63 -2.165 -15.214 -17.861 1.00 44.21 H new ATOM 0 HD22 LEU A 63 -0.942 -15.445 -16.589 1.00 44.21 H new ATOM 0 HD23 LEU A 63 -0.690 -16.149 -18.204 1.00 44.21 H new ATOM 949 N GLU A 64 1.087 -19.596 -14.763 1.00 45.21 N ATOM 950 CA GLU A 64 1.534 -20.709 -13.934 1.00 2.31 C ATOM 951 C GLU A 64 2.349 -20.209 -12.745 1.00 45.41 C ATOM 952 O GLU A 64 2.260 -20.752 -11.644 1.00 21.22 O ATOM 953 CB GLU A 64 2.368 -21.688 -14.762 1.00 23.31 C ATOM 954 CG GLU A 64 1.768 -22.001 -16.122 1.00 22.31 C ATOM 955 CD GLU A 64 2.318 -23.281 -16.723 1.00 12.53 C ATOM 956 OE1 GLU A 64 2.968 -24.051 -15.984 1.00 51.52 O ATOM 957 OE2 GLU A 64 2.099 -23.511 -17.930 1.00 32.21 O ATOM 0 H GLU A 64 1.548 -19.534 -15.671 1.00 45.21 H new ATOM 0 HA GLU A 64 0.651 -21.224 -13.556 1.00 2.31 H new ATOM 0 HB2 GLU A 64 3.366 -21.274 -14.902 1.00 23.31 H new ATOM 0 HB3 GLU A 64 2.484 -22.617 -14.203 1.00 23.31 H new ATOM 0 HG2 GLU A 64 0.685 -22.085 -16.027 1.00 22.31 H new ATOM 0 HG3 GLU A 64 1.965 -21.171 -16.801 1.00 22.31 H new ATOM 964 N LYS A 65 3.145 -19.169 -12.975 1.00 53.21 N ATOM 965 CA LYS A 65 3.976 -18.593 -11.926 1.00 34.44 C ATOM 966 C LYS A 65 3.117 -18.062 -10.782 1.00 3.12 C ATOM 967 O LYS A 65 3.375 -18.350 -9.613 1.00 2.53 O ATOM 968 CB LYS A 65 4.842 -17.467 -12.493 1.00 20.12 C ATOM 969 CG LYS A 65 6.233 -17.917 -12.904 1.00 22.54 C ATOM 970 CD LYS A 65 6.696 -17.213 -14.168 1.00 64.11 C ATOM 971 CE LYS A 65 8.214 -17.124 -14.231 1.00 75.14 C ATOM 972 NZ LYS A 65 8.761 -16.216 -13.186 1.00 55.11 N ATOM 0 H LYS A 65 3.231 -18.708 -13.881 1.00 53.21 H new ATOM 0 HA LYS A 65 4.623 -19.379 -11.537 1.00 34.44 H new ATOM 0 HB2 LYS A 65 4.339 -17.034 -13.358 1.00 20.12 H new ATOM 0 HB3 LYS A 65 4.930 -16.677 -11.747 1.00 20.12 H new ATOM 0 HG2 LYS A 65 6.936 -17.715 -12.096 1.00 22.54 H new ATOM 0 HG3 LYS A 65 6.235 -18.995 -13.065 1.00 22.54 H new ATOM 0 HD2 LYS A 65 6.325 -17.749 -15.041 1.00 64.11 H new ATOM 0 HD3 LYS A 65 6.270 -16.211 -14.205 1.00 64.11 H new ATOM 0 HE2 LYS A 65 8.641 -18.119 -14.107 1.00 75.14 H new ATOM 0 HE3 LYS A 65 8.516 -16.768 -15.216 1.00 75.14 H new ATOM 0 HZ1 LYS A 65 9.698 -15.873 -13.480 1.00 55.11 H new ATOM 0 HZ2 LYS A 65 8.120 -15.407 -13.059 1.00 55.11 H new ATOM 0 HZ3 LYS A 65 8.847 -16.733 -12.288 1.00 55.11 H new ATOM 986 N LEU A 66 2.095 -17.286 -11.126 1.00 62.23 N ATOM 987 CA LEU A 66 1.197 -16.716 -10.129 1.00 42.40 C ATOM 988 C LEU A 66 0.225 -17.768 -9.606 1.00 34.31 C ATOM 989 O LEU A 66 -0.211 -17.709 -8.456 1.00 43.55 O ATOM 990 CB LEU A 66 0.422 -15.539 -10.725 1.00 35.22 C ATOM 991 CG LEU A 66 1.044 -14.157 -10.529 1.00 12.31 C ATOM 992 CD1 LEU A 66 1.054 -13.780 -9.056 1.00 3.13 C ATOM 993 CD2 LEU A 66 2.453 -14.120 -11.101 1.00 20.50 C ATOM 0 H LEU A 66 1.868 -17.037 -12.089 1.00 62.23 H new ATOM 0 HA LEU A 66 1.800 -16.360 -9.294 1.00 42.40 H new ATOM 0 HB2 LEU A 66 0.303 -15.713 -11.794 1.00 35.22 H new ATOM 0 HB3 LEU A 66 -0.577 -15.530 -10.290 1.00 35.22 H new ATOM 0 HG LEU A 66 0.437 -13.427 -11.065 1.00 12.31 H new ATOM 0 HD11 LEU A 66 1.501 -12.793 -8.936 1.00 3.13 H new ATOM 0 HD12 LEU A 66 0.032 -13.764 -8.677 1.00 3.13 H new ATOM 0 HD13 LEU A 66 1.637 -14.512 -8.497 1.00 3.13 H new ATOM 0 HD21 LEU A 66 2.880 -13.128 -10.952 1.00 20.50 H new ATOM 0 HD22 LEU A 66 3.071 -14.861 -10.594 1.00 20.50 H new ATOM 0 HD23 LEU A 66 2.419 -14.344 -12.167 1.00 20.50 H new ATOM 1005 N ALA A 67 -0.111 -18.731 -10.458 1.00 62.40 N ATOM 1006 CA ALA A 67 -1.028 -19.800 -10.081 1.00 31.15 C ATOM 1007 C ALA A 67 -0.526 -20.545 -8.849 1.00 1.14 C ATOM 1008 O ALA A 67 -1.316 -21.038 -8.045 1.00 75.05 O ATOM 1009 CB ALA A 67 -1.220 -20.765 -11.242 1.00 20.14 C ATOM 0 H ALA A 67 0.238 -18.793 -11.414 1.00 62.40 H new ATOM 0 HA ALA A 67 -1.990 -19.350 -9.834 1.00 31.15 H new ATOM 0 HB1 ALA A 67 -1.907 -21.558 -10.946 1.00 20.14 H new ATOM 0 HB2 ALA A 67 -1.632 -20.228 -12.097 1.00 20.14 H new ATOM 0 HB3 ALA A 67 -0.259 -21.201 -11.516 1.00 20.14 H new ATOM 1015 N GLN A 68 0.794 -20.624 -8.708 1.00 12.15 N ATOM 1016 CA GLN A 68 1.400 -21.310 -7.573 1.00 64.31 C ATOM 1017 C GLN A 68 1.391 -20.425 -6.331 1.00 50.20 C ATOM 1018 O GLN A 68 1.304 -20.919 -5.207 1.00 5.42 O ATOM 1019 CB GLN A 68 2.834 -21.725 -7.908 1.00 4.24 C ATOM 1020 CG GLN A 68 2.923 -22.985 -8.752 1.00 32.35 C ATOM 1021 CD GLN A 68 4.319 -23.233 -9.287 1.00 43.12 C ATOM 1022 OE1 GLN A 68 5.282 -23.322 -8.525 1.00 72.41 O ATOM 1023 NE2 GLN A 68 4.436 -23.346 -10.605 1.00 1.41 N ATOM 0 H GLN A 68 1.463 -20.222 -9.365 1.00 12.15 H new ATOM 0 HA GLN A 68 0.810 -22.202 -7.364 1.00 64.31 H new ATOM 0 HB2 GLN A 68 3.325 -20.908 -8.437 1.00 4.24 H new ATOM 0 HB3 GLN A 68 3.384 -21.880 -6.980 1.00 4.24 H new ATOM 0 HG2 GLN A 68 2.610 -23.841 -8.154 1.00 32.35 H new ATOM 0 HG3 GLN A 68 2.227 -22.908 -9.587 1.00 32.35 H new ATOM 0 HE21 GLN A 68 3.611 -23.265 -11.199 1.00 1.41 H new ATOM 0 HE22 GLN A 68 5.351 -23.513 -11.023 1.00 1.41 H new ATOM 1032 N GLN A 69 1.481 -19.115 -6.544 1.00 75.41 N ATOM 1033 CA GLN A 69 1.483 -18.162 -5.441 1.00 73.40 C ATOM 1034 C GLN A 69 0.084 -18.008 -4.851 1.00 43.13 C ATOM 1035 O GLN A 69 -0.072 -17.739 -3.660 1.00 45.10 O ATOM 1036 CB GLN A 69 2.002 -16.804 -5.915 1.00 50.41 C ATOM 1037 CG GLN A 69 3.388 -16.865 -6.536 1.00 72.14 C ATOM 1038 CD GLN A 69 4.021 -15.496 -6.685 1.00 5.22 C ATOM 1039 OE1 GLN A 69 3.561 -14.519 -6.095 1.00 1.33 O ATOM 1040 NE2 GLN A 69 5.084 -15.418 -7.478 1.00 61.43 N ATOM 0 H GLN A 69 1.553 -18.691 -7.469 1.00 75.41 H new ATOM 0 HA GLN A 69 2.144 -18.545 -4.664 1.00 73.40 H new ATOM 0 HB2 GLN A 69 1.304 -16.392 -6.644 1.00 50.41 H new ATOM 0 HB3 GLN A 69 2.022 -16.117 -5.069 1.00 50.41 H new ATOM 0 HG2 GLN A 69 4.031 -17.493 -5.919 1.00 72.14 H new ATOM 0 HG3 GLN A 69 3.323 -17.340 -7.515 1.00 72.14 H new ATOM 0 HE21 GLN A 69 5.432 -16.254 -7.948 1.00 61.43 H new ATOM 0 HE22 GLN A 69 5.552 -14.522 -7.617 1.00 61.43 H new ATOM 1049 N TYR A 70 -0.929 -18.180 -5.692 1.00 25.32 N ATOM 1050 CA TYR A 70 -2.314 -18.058 -5.255 1.00 13.24 C ATOM 1051 C TYR A 70 -3.074 -19.361 -5.482 1.00 13.40 C ATOM 1052 O TYR A 70 -4.302 -19.369 -5.582 1.00 60.12 O ATOM 1053 CB TYR A 70 -3.006 -16.914 -5.998 1.00 73.14 C ATOM 1054 CG TYR A 70 -2.410 -15.556 -5.709 1.00 2.41 C ATOM 1055 CD1 TYR A 70 -2.394 -15.042 -4.418 1.00 41.41 C ATOM 1056 CD2 TYR A 70 -1.860 -14.785 -6.726 1.00 54.44 C ATOM 1057 CE1 TYR A 70 -1.851 -13.800 -4.149 1.00 63.31 C ATOM 1058 CE2 TYR A 70 -1.314 -13.544 -6.467 1.00 43.53 C ATOM 1059 CZ TYR A 70 -1.311 -13.055 -5.177 1.00 60.24 C ATOM 1060 OH TYR A 70 -0.768 -11.819 -4.914 1.00 32.23 O ATOM 0 H TYR A 70 -0.817 -18.404 -6.681 1.00 25.32 H new ATOM 0 HA TYR A 70 -2.314 -17.841 -4.187 1.00 13.24 H new ATOM 0 HB2 TYR A 70 -2.953 -17.104 -7.070 1.00 73.14 H new ATOM 0 HB3 TYR A 70 -4.062 -16.903 -5.728 1.00 73.14 H new ATOM 0 HD1 TYR A 70 -2.813 -15.624 -3.610 1.00 41.41 H new ATOM 0 HD2 TYR A 70 -1.860 -15.164 -7.737 1.00 54.44 H new ATOM 0 HE1 TYR A 70 -1.849 -13.415 -3.140 1.00 63.31 H new ATOM 0 HE2 TYR A 70 -0.891 -12.959 -7.270 1.00 43.53 H new ATOM 0 HH TYR A 70 -0.430 -11.426 -5.746 1.00 32.23 H new ATOM 1070 N THR A 71 -2.336 -20.464 -5.561 1.00 53.31 N ATOM 1071 CA THR A 71 -2.939 -21.772 -5.776 1.00 63.45 C ATOM 1072 C THR A 71 -4.002 -22.069 -4.725 1.00 25.02 C ATOM 1073 O THR A 71 -4.897 -22.884 -4.948 1.00 11.42 O ATOM 1074 CB THR A 71 -1.878 -22.891 -5.748 1.00 51.51 C ATOM 1075 OG1 THR A 71 -2.451 -24.120 -6.205 1.00 70.04 O ATOM 1076 CG2 THR A 71 -1.325 -23.075 -4.343 1.00 62.15 C ATOM 0 H THR A 71 -1.319 -20.477 -5.479 1.00 53.31 H new ATOM 0 HA THR A 71 -3.405 -21.746 -6.761 1.00 63.45 H new ATOM 0 HB THR A 71 -1.060 -22.604 -6.409 1.00 51.51 H new ATOM 0 HG1 THR A 71 -1.771 -24.825 -6.186 1.00 70.04 H new ATOM 0 HG21 THR A 71 -0.578 -23.869 -4.347 1.00 62.15 H new ATOM 0 HG22 THR A 71 -0.864 -22.145 -4.009 1.00 62.15 H new ATOM 0 HG23 THR A 71 -2.136 -23.342 -3.665 1.00 62.15 H new ATOM 1084 N GLU A 72 -3.897 -21.402 -3.580 1.00 42.03 N ATOM 1085 CA GLU A 72 -4.851 -21.595 -2.495 1.00 25.13 C ATOM 1086 C GLU A 72 -6.280 -21.371 -2.979 1.00 64.22 C ATOM 1087 O GLU A 72 -7.203 -22.072 -2.568 1.00 31.12 O ATOM 1088 CB GLU A 72 -4.539 -20.644 -1.337 1.00 62.10 C ATOM 1089 CG GLU A 72 -3.323 -21.055 -0.523 1.00 10.13 C ATOM 1090 CD GLU A 72 -2.871 -19.973 0.439 1.00 41.34 C ATOM 1091 OE1 GLU A 72 -3.661 -19.610 1.335 1.00 3.33 O ATOM 1092 OE2 GLU A 72 -1.729 -19.488 0.293 1.00 54.20 O ATOM 0 H GLU A 72 -3.162 -20.724 -3.380 1.00 42.03 H new ATOM 0 HA GLU A 72 -4.761 -22.624 -2.146 1.00 25.13 H new ATOM 0 HB2 GLU A 72 -4.378 -19.642 -1.734 1.00 62.10 H new ATOM 0 HB3 GLU A 72 -5.406 -20.590 -0.678 1.00 62.10 H new ATOM 0 HG2 GLU A 72 -3.555 -21.960 0.038 1.00 10.13 H new ATOM 0 HG3 GLU A 72 -2.504 -21.300 -1.199 1.00 10.13 H new ATOM 1099 N ASN A 73 -6.454 -20.388 -3.857 1.00 43.45 N ATOM 1100 CA ASN A 73 -7.770 -20.069 -4.398 1.00 72.45 C ATOM 1101 C ASN A 73 -7.693 -19.812 -5.899 1.00 43.54 C ATOM 1102 O ASN A 73 -8.547 -19.130 -6.468 1.00 5.44 O ATOM 1103 CB ASN A 73 -8.354 -18.847 -3.688 1.00 62.14 C ATOM 1104 CG ASN A 73 -9.865 -18.912 -3.572 1.00 62.35 C ATOM 1105 OD1 ASN A 73 -10.404 -19.230 -2.512 1.00 54.33 O ATOM 1106 ND2 ASN A 73 -10.555 -18.612 -4.667 1.00 12.25 N ATOM 0 H ASN A 73 -5.700 -19.799 -4.209 1.00 43.45 H new ATOM 0 HA ASN A 73 -8.423 -20.925 -4.228 1.00 72.45 H new ATOM 0 HB2 ASN A 73 -7.919 -18.767 -2.692 1.00 62.14 H new ATOM 0 HB3 ASN A 73 -8.073 -17.945 -4.232 1.00 62.14 H new ATOM 0 HD21 ASN A 73 -11.574 -18.640 -4.651 1.00 12.25 H new ATOM 0 HD22 ASN A 73 -10.065 -18.354 -5.524 1.00 12.25 H new ATOM 1113 N VAL A 74 -6.665 -20.362 -6.537 1.00 43.23 N ATOM 1114 CA VAL A 74 -6.477 -20.193 -7.973 1.00 42.34 C ATOM 1115 C VAL A 74 -6.132 -21.518 -8.643 1.00 24.52 C ATOM 1116 O VAL A 74 -5.339 -22.303 -8.120 1.00 11.33 O ATOM 1117 CB VAL A 74 -5.364 -19.171 -8.277 1.00 72.22 C ATOM 1118 CG1 VAL A 74 -5.177 -19.018 -9.779 1.00 21.22 C ATOM 1119 CG2 VAL A 74 -5.681 -17.832 -7.632 1.00 13.41 C ATOM 0 H VAL A 74 -5.949 -20.929 -6.082 1.00 43.23 H new ATOM 0 HA VAL A 74 -7.420 -19.822 -8.374 1.00 42.34 H new ATOM 0 HB VAL A 74 -4.429 -19.540 -7.854 1.00 72.22 H new ATOM 0 HG11 VAL A 74 -4.387 -18.293 -9.975 1.00 21.22 H new ATOM 0 HG12 VAL A 74 -4.902 -19.980 -10.211 1.00 21.22 H new ATOM 0 HG13 VAL A 74 -6.108 -18.672 -10.228 1.00 21.22 H new ATOM 0 HG21 VAL A 74 -4.885 -17.122 -7.857 1.00 13.41 H new ATOM 0 HG22 VAL A 74 -6.625 -17.454 -8.024 1.00 13.41 H new ATOM 0 HG23 VAL A 74 -5.761 -17.958 -6.552 1.00 13.41 H new ATOM 1129 N LYS A 75 -6.731 -21.764 -9.802 1.00 41.33 N ATOM 1130 CA LYS A 75 -6.486 -22.994 -10.546 1.00 54.30 C ATOM 1131 C LYS A 75 -6.357 -22.711 -12.039 1.00 41.22 C ATOM 1132 O LYS A 75 -6.755 -21.648 -12.515 1.00 54.54 O ATOM 1133 CB LYS A 75 -7.618 -23.995 -10.302 1.00 44.23 C ATOM 1134 CG LYS A 75 -7.371 -24.917 -9.120 1.00 44.22 C ATOM 1135 CD LYS A 75 -6.321 -25.966 -9.443 1.00 22.44 C ATOM 1136 CE LYS A 75 -5.846 -26.684 -8.188 1.00 73.13 C ATOM 1137 NZ LYS A 75 -6.774 -27.777 -7.789 1.00 54.32 N ATOM 0 H LYS A 75 -7.391 -21.127 -10.248 1.00 41.33 H new ATOM 0 HA LYS A 75 -5.548 -23.422 -10.193 1.00 54.30 H new ATOM 0 HB2 LYS A 75 -8.546 -23.448 -10.137 1.00 44.23 H new ATOM 0 HB3 LYS A 75 -7.758 -24.598 -11.199 1.00 44.23 H new ATOM 0 HG2 LYS A 75 -7.048 -24.330 -8.260 1.00 44.22 H new ATOM 0 HG3 LYS A 75 -8.303 -25.408 -8.839 1.00 44.22 H new ATOM 0 HD2 LYS A 75 -6.733 -26.691 -10.144 1.00 22.44 H new ATOM 0 HD3 LYS A 75 -5.472 -25.493 -9.936 1.00 22.44 H new ATOM 0 HE2 LYS A 75 -4.852 -27.097 -8.360 1.00 73.13 H new ATOM 0 HE3 LYS A 75 -5.757 -25.967 -7.372 1.00 73.13 H new ATOM 0 HZ1 LYS A 75 -6.415 -28.241 -6.930 1.00 54.32 H new ATOM 0 HZ2 LYS A 75 -7.717 -27.380 -7.600 1.00 54.32 H new ATOM 0 HZ3 LYS A 75 -6.840 -28.474 -8.558 1.00 54.32 H new ATOM 1151 N ILE A 76 -5.799 -23.668 -12.772 1.00 32.00 N ATOM 1152 CA ILE A 76 -5.620 -23.521 -14.211 1.00 74.21 C ATOM 1153 C ILE A 76 -5.679 -24.874 -14.913 1.00 73.53 C ATOM 1154 O ILE A 76 -5.116 -25.859 -14.434 1.00 22.14 O ATOM 1155 CB ILE A 76 -4.280 -22.841 -14.545 1.00 4.33 C ATOM 1156 CG1 ILE A 76 -4.218 -21.449 -13.912 1.00 15.14 C ATOM 1157 CG2 ILE A 76 -4.093 -22.751 -16.052 1.00 3.40 C ATOM 1158 CD1 ILE A 76 -2.939 -20.702 -14.217 1.00 71.25 C ATOM 0 H ILE A 76 -5.463 -24.553 -12.393 1.00 32.00 H new ATOM 0 HA ILE A 76 -6.436 -22.893 -14.568 1.00 74.21 H new ATOM 0 HB ILE A 76 -3.471 -23.444 -14.133 1.00 4.33 H new ATOM 0 HG12 ILE A 76 -5.065 -20.861 -14.264 1.00 15.14 H new ATOM 0 HG13 ILE A 76 -4.324 -21.545 -12.831 1.00 15.14 H new ATOM 0 HG21 ILE A 76 -3.141 -22.268 -16.272 1.00 3.40 H new ATOM 0 HG22 ILE A 76 -4.099 -23.753 -16.480 1.00 3.40 H new ATOM 0 HG23 ILE A 76 -4.905 -22.167 -16.485 1.00 3.40 H new ATOM 0 HD11 ILE A 76 -2.965 -19.724 -13.736 1.00 71.25 H new ATOM 0 HD12 ILE A 76 -2.088 -21.269 -13.840 1.00 71.25 H new ATOM 0 HD13 ILE A 76 -2.841 -20.574 -15.295 1.00 71.25 H new ATOM 1170 N TYR A 77 -6.363 -24.914 -16.051 1.00 44.05 N ATOM 1171 CA TYR A 77 -6.496 -26.146 -16.819 1.00 41.33 C ATOM 1172 C TYR A 77 -6.401 -25.867 -18.316 1.00 64.33 C ATOM 1173 O TYR A 77 -6.556 -24.730 -18.760 1.00 10.43 O ATOM 1174 CB TYR A 77 -7.826 -26.830 -16.500 1.00 72.10 C ATOM 1175 CG TYR A 77 -7.863 -27.473 -15.132 1.00 12.23 C ATOM 1176 CD1 TYR A 77 -6.787 -28.215 -14.662 1.00 21.01 C ATOM 1177 CD2 TYR A 77 -8.975 -27.337 -14.309 1.00 20.02 C ATOM 1178 CE1 TYR A 77 -6.818 -28.805 -13.413 1.00 1.23 C ATOM 1179 CE2 TYR A 77 -9.013 -27.921 -13.058 1.00 23.03 C ATOM 1180 CZ TYR A 77 -7.932 -28.655 -12.615 1.00 14.33 C ATOM 1181 OH TYR A 77 -7.966 -29.239 -11.369 1.00 41.31 O ATOM 0 H TYR A 77 -6.834 -24.108 -16.462 1.00 44.05 H new ATOM 0 HA TYR A 77 -5.678 -26.809 -16.538 1.00 41.33 H new ATOM 0 HB2 TYR A 77 -8.628 -26.096 -16.569 1.00 72.10 H new ATOM 0 HB3 TYR A 77 -8.024 -27.591 -17.255 1.00 72.10 H new ATOM 0 HD1 TYR A 77 -5.911 -28.333 -15.283 1.00 21.01 H new ATOM 0 HD2 TYR A 77 -9.824 -26.765 -14.654 1.00 20.02 H new ATOM 0 HE1 TYR A 77 -5.974 -29.381 -13.064 1.00 1.23 H new ATOM 0 HE2 TYR A 77 -9.884 -27.804 -12.430 1.00 23.03 H new ATOM 0 HH TYR A 77 -8.821 -29.036 -10.936 1.00 41.31 H new ATOM 1191 N LYS A 78 -6.146 -26.916 -19.092 1.00 23.53 N ATOM 1192 CA LYS A 78 -6.032 -26.788 -20.540 1.00 3.52 C ATOM 1193 C LYS A 78 -6.842 -27.869 -21.247 1.00 53.52 C ATOM 1194 O LYS A 78 -7.650 -28.559 -20.625 1.00 32.22 O ATOM 1195 CB LYS A 78 -4.564 -26.875 -20.966 1.00 32.21 C ATOM 1196 CG LYS A 78 -3.644 -25.966 -20.170 1.00 32.34 C ATOM 1197 CD LYS A 78 -2.380 -25.635 -20.944 1.00 31.11 C ATOM 1198 CE LYS A 78 -1.237 -26.565 -20.570 1.00 21.42 C ATOM 1199 NZ LYS A 78 0.088 -25.989 -20.929 1.00 41.41 N ATOM 0 H LYS A 78 -6.014 -27.865 -18.741 1.00 23.53 H new ATOM 0 HA LYS A 78 -6.430 -25.815 -20.826 1.00 3.52 H new ATOM 0 HB2 LYS A 78 -4.224 -27.905 -20.859 1.00 32.21 H new ATOM 0 HB3 LYS A 78 -4.486 -26.621 -22.023 1.00 32.21 H new ATOM 0 HG2 LYS A 78 -4.170 -25.045 -19.919 1.00 32.34 H new ATOM 0 HG3 LYS A 78 -3.380 -26.449 -19.229 1.00 32.34 H new ATOM 0 HD2 LYS A 78 -2.577 -25.711 -22.013 1.00 31.11 H new ATOM 0 HD3 LYS A 78 -2.090 -24.603 -20.745 1.00 31.11 H new ATOM 0 HE2 LYS A 78 -1.268 -26.765 -19.499 1.00 21.42 H new ATOM 0 HE3 LYS A 78 -1.366 -27.521 -21.077 1.00 21.42 H new ATOM 0 HZ1 LYS A 78 0.840 -26.654 -20.658 1.00 41.41 H new ATOM 0 HZ2 LYS A 78 0.127 -25.821 -21.955 1.00 41.41 H new ATOM 0 HZ3 LYS A 78 0.223 -25.089 -20.426 1.00 41.41 H new ATOM 1490 N THR A 98 -7.838 -17.945 -25.442 1.00 45.20 N ATOM 1491 CA THR A 98 -8.494 -17.143 -24.418 1.00 23.33 C ATOM 1492 C THR A 98 -8.641 -17.926 -23.117 1.00 42.13 C ATOM 1493 O THR A 98 -8.670 -19.158 -23.124 1.00 12.55 O ATOM 1494 CB THR A 98 -9.885 -16.670 -24.879 1.00 62.14 C ATOM 1495 OG1 THR A 98 -9.813 -16.170 -26.219 1.00 63.21 O ATOM 1496 CG2 THR A 98 -10.422 -15.587 -23.956 1.00 55.04 C ATOM 0 HA THR A 98 -7.862 -16.272 -24.246 1.00 23.33 H new ATOM 0 HB THR A 98 -10.564 -17.522 -24.846 1.00 62.14 H new ATOM 0 HG1 THR A 98 -9.007 -16.518 -26.655 1.00 63.21 H new ATOM 0 HG21 THR A 98 -11.405 -15.269 -24.302 1.00 55.04 H new ATOM 0 HG22 THR A 98 -10.503 -15.980 -22.943 1.00 55.04 H new ATOM 0 HG23 THR A 98 -9.742 -14.735 -23.961 1.00 55.04 H new ATOM 1504 N ILE A 99 -8.735 -17.205 -22.005 1.00 62.15 N ATOM 1505 CA ILE A 99 -8.881 -17.834 -20.698 1.00 43.54 C ATOM 1506 C ILE A 99 -10.243 -17.520 -20.087 1.00 65.44 C ATOM 1507 O ILE A 99 -10.691 -16.373 -20.096 1.00 5.15 O ATOM 1508 CB ILE A 99 -7.777 -17.376 -19.727 1.00 53.20 C ATOM 1509 CG1 ILE A 99 -6.411 -17.871 -20.202 1.00 62.33 C ATOM 1510 CG2 ILE A 99 -8.068 -17.877 -18.321 1.00 14.24 C ATOM 1511 CD1 ILE A 99 -5.797 -17.007 -21.283 1.00 74.33 C ATOM 0 H ILE A 99 -8.713 -16.185 -21.983 1.00 62.15 H new ATOM 0 HA ILE A 99 -8.794 -18.909 -20.853 1.00 43.54 H new ATOM 0 HB ILE A 99 -7.760 -16.286 -19.708 1.00 53.20 H new ATOM 0 HG12 ILE A 99 -5.732 -17.911 -19.350 1.00 62.33 H new ATOM 0 HG13 ILE A 99 -6.513 -18.890 -20.576 1.00 62.33 H new ATOM 0 HG21 ILE A 99 -7.279 -17.545 -17.646 1.00 14.24 H new ATOM 0 HG22 ILE A 99 -9.025 -17.479 -17.984 1.00 14.24 H new ATOM 0 HG23 ILE A 99 -8.109 -18.966 -18.324 1.00 14.24 H new ATOM 0 HD11 ILE A 99 -4.829 -17.418 -21.571 1.00 74.33 H new ATOM 0 HD12 ILE A 99 -6.456 -16.987 -22.151 1.00 74.33 H new ATOM 0 HD13 ILE A 99 -5.663 -15.993 -20.906 1.00 74.33 H new ATOM 1523 N LEU A 100 -10.897 -18.547 -19.557 1.00 14.13 N ATOM 1524 CA LEU A 100 -12.208 -18.382 -18.939 1.00 74.13 C ATOM 1525 C LEU A 100 -12.187 -18.845 -17.485 1.00 51.03 C ATOM 1526 O LEU A 100 -11.818 -19.981 -17.191 1.00 42.25 O ATOM 1527 CB LEU A 100 -13.265 -19.166 -19.721 1.00 11.41 C ATOM 1528 CG LEU A 100 -13.157 -19.102 -21.245 1.00 23.02 C ATOM 1529 CD1 LEU A 100 -12.211 -20.177 -21.758 1.00 75.25 C ATOM 1530 CD2 LEU A 100 -14.530 -19.247 -21.883 1.00 10.22 C ATOM 0 H LEU A 100 -10.541 -19.503 -19.543 1.00 14.13 H new ATOM 0 HA LEU A 100 -12.461 -17.322 -18.960 1.00 74.13 H new ATOM 0 HB2 LEU A 100 -13.212 -20.211 -19.417 1.00 11.41 H new ATOM 0 HB3 LEU A 100 -14.249 -18.799 -19.431 1.00 11.41 H new ATOM 0 HG LEU A 100 -12.752 -18.129 -21.522 1.00 23.02 H new ATOM 0 HD11 LEU A 100 -12.146 -20.117 -22.844 1.00 75.25 H new ATOM 0 HD12 LEU A 100 -11.221 -20.027 -21.327 1.00 75.25 H new ATOM 0 HD13 LEU A 100 -12.587 -21.159 -21.471 1.00 75.25 H new ATOM 0 HD21 LEU A 100 -14.434 -19.199 -22.968 1.00 10.22 H new ATOM 0 HD22 LEU A 100 -14.964 -20.206 -21.599 1.00 10.22 H new ATOM 0 HD23 LEU A 100 -15.178 -18.440 -21.540 1.00 10.22 H new ATOM 1542 N MET A 101 -12.589 -17.957 -16.581 1.00 44.04 N ATOM 1543 CA MET A 101 -12.619 -18.277 -15.159 1.00 51.33 C ATOM 1544 C MET A 101 -13.978 -18.840 -14.758 1.00 12.11 C ATOM 1545 O MET A 101 -15.001 -18.164 -14.873 1.00 52.43 O ATOM 1546 CB MET A 101 -12.305 -17.030 -14.329 1.00 34.22 C ATOM 1547 CG MET A 101 -10.820 -16.717 -14.242 1.00 12.34 C ATOM 1548 SD MET A 101 -10.448 -15.451 -13.012 1.00 53.14 S ATOM 1549 CE MET A 101 -8.972 -14.720 -13.715 1.00 41.24 C ATOM 0 H MET A 101 -12.898 -17.012 -16.808 1.00 44.04 H new ATOM 0 HA MET A 101 -11.860 -19.035 -14.965 1.00 51.33 H new ATOM 0 HB2 MET A 101 -12.824 -16.175 -14.762 1.00 34.22 H new ATOM 0 HB3 MET A 101 -12.699 -17.165 -13.322 1.00 34.22 H new ATOM 0 HG2 MET A 101 -10.274 -17.628 -13.997 1.00 12.34 H new ATOM 0 HG3 MET A 101 -10.465 -16.386 -15.218 1.00 12.34 H new ATOM 0 HE1 MET A 101 -8.212 -14.618 -12.940 1.00 41.24 H new ATOM 0 HE2 MET A 101 -8.593 -15.360 -14.512 1.00 41.24 H new ATOM 0 HE3 MET A 101 -9.211 -13.737 -14.121 1.00 41.24 H new ATOM 1559 N PHE A 102 -13.983 -20.082 -14.285 1.00 41.14 N ATOM 1560 CA PHE A 102 -15.217 -20.737 -13.868 1.00 22.24 C ATOM 1561 C PHE A 102 -15.125 -21.197 -12.416 1.00 24.11 C ATOM 1562 O PHE A 102 -14.046 -21.535 -11.927 1.00 24.33 O ATOM 1563 CB PHE A 102 -15.517 -21.932 -14.775 1.00 14.11 C ATOM 1564 CG PHE A 102 -15.860 -21.543 -16.184 1.00 43.34 C ATOM 1565 CD1 PHE A 102 -17.066 -20.924 -16.473 1.00 33.42 C ATOM 1566 CD2 PHE A 102 -14.977 -21.796 -17.222 1.00 24.13 C ATOM 1567 CE1 PHE A 102 -17.384 -20.566 -17.769 1.00 43.32 C ATOM 1568 CE2 PHE A 102 -15.289 -21.440 -18.520 1.00 54.11 C ATOM 1569 CZ PHE A 102 -16.494 -20.823 -18.794 1.00 21.31 C ATOM 0 H PHE A 102 -13.146 -20.655 -14.181 1.00 41.14 H new ATOM 0 HA PHE A 102 -16.028 -20.014 -13.951 1.00 22.24 H new ATOM 0 HB2 PHE A 102 -14.651 -22.593 -14.790 1.00 14.11 H new ATOM 0 HB3 PHE A 102 -16.345 -22.501 -14.352 1.00 14.11 H new ATOM 0 HD1 PHE A 102 -17.765 -20.719 -15.676 1.00 33.42 H new ATOM 0 HD2 PHE A 102 -14.033 -22.278 -17.014 1.00 24.13 H new ATOM 0 HE1 PHE A 102 -18.328 -20.086 -17.981 1.00 43.32 H new ATOM 0 HE2 PHE A 102 -14.592 -21.644 -19.319 1.00 54.11 H new ATOM 0 HZ PHE A 102 -16.740 -20.542 -19.807 1.00 21.31 H new ATOM 1579 N LYS A 103 -16.263 -21.208 -11.731 1.00 0.52 N ATOM 1580 CA LYS A 103 -16.312 -21.627 -10.336 1.00 14.34 C ATOM 1581 C LYS A 103 -17.756 -21.785 -9.866 1.00 42.13 C ATOM 1582 O LYS A 103 -18.582 -20.894 -10.057 1.00 4.33 O ATOM 1583 CB LYS A 103 -15.585 -20.611 -9.450 1.00 55.11 C ATOM 1584 CG LYS A 103 -15.552 -20.999 -7.982 1.00 53.23 C ATOM 1585 CD LYS A 103 -15.505 -19.773 -7.083 1.00 73.44 C ATOM 1586 CE LYS A 103 -14.216 -18.990 -7.278 1.00 31.03 C ATOM 1587 NZ LYS A 103 -14.232 -17.703 -6.527 1.00 61.33 N ATOM 0 H LYS A 103 -17.164 -20.931 -12.120 1.00 0.52 H new ATOM 0 HA LYS A 103 -15.813 -22.593 -10.255 1.00 14.34 H new ATOM 0 HB2 LYS A 103 -14.563 -20.494 -9.809 1.00 55.11 H new ATOM 0 HB3 LYS A 103 -16.071 -19.641 -9.550 1.00 55.11 H new ATOM 0 HG2 LYS A 103 -16.433 -21.594 -7.742 1.00 53.23 H new ATOM 0 HG3 LYS A 103 -14.682 -21.626 -7.790 1.00 53.23 H new ATOM 0 HD2 LYS A 103 -16.359 -19.130 -7.297 1.00 73.44 H new ATOM 0 HD3 LYS A 103 -15.591 -20.081 -6.041 1.00 73.44 H new ATOM 0 HE2 LYS A 103 -13.371 -19.593 -6.947 1.00 31.03 H new ATOM 0 HE3 LYS A 103 -14.069 -18.790 -8.339 1.00 31.03 H new ATOM 0 HZ1 LYS A 103 -13.337 -17.198 -6.685 1.00 61.33 H new ATOM 0 HZ2 LYS A 103 -15.024 -17.117 -6.860 1.00 61.33 H new ATOM 0 HZ3 LYS A 103 -14.347 -17.895 -5.511 1.00 61.33 H new ATOM 1601 N ASN A 104 -18.051 -22.925 -9.249 1.00 42.33 N ATOM 1602 CA ASN A 104 -19.394 -23.198 -8.752 1.00 62.34 C ATOM 1603 C ASN A 104 -20.431 -23.014 -9.855 1.00 50.33 C ATOM 1604 O ASN A 104 -21.560 -22.597 -9.598 1.00 40.20 O ATOM 1605 CB ASN A 104 -19.720 -22.282 -7.572 1.00 11.23 C ATOM 1606 CG ASN A 104 -20.996 -22.688 -6.859 1.00 4.44 C ATOM 1607 OD1 ASN A 104 -22.007 -21.988 -6.925 1.00 62.54 O ATOM 1608 ND2 ASN A 104 -20.954 -23.824 -6.172 1.00 61.13 N ATOM 0 H ASN A 104 -17.379 -23.673 -9.082 1.00 42.33 H new ATOM 0 HA ASN A 104 -19.426 -24.235 -8.418 1.00 62.34 H new ATOM 0 HB2 ASN A 104 -18.891 -22.297 -6.864 1.00 11.23 H new ATOM 0 HB3 ASN A 104 -19.817 -21.256 -7.928 1.00 11.23 H new ATOM 0 HD21 ASN A 104 -21.782 -24.148 -5.671 1.00 61.13 H new ATOM 0 HD22 ASN A 104 -20.094 -24.372 -6.145 1.00 61.13 H new ATOM 1615 N GLY A 105 -20.040 -23.328 -11.087 1.00 52.35 N ATOM 1616 CA GLY A 105 -20.947 -23.191 -12.212 1.00 3.40 C ATOM 1617 C GLY A 105 -21.224 -21.741 -12.559 1.00 72.24 C ATOM 1618 O GLY A 105 -22.286 -21.414 -13.089 1.00 44.34 O ATOM 0 H GLY A 105 -19.111 -23.675 -11.326 1.00 52.35 H new ATOM 0 HA2 GLY A 105 -20.523 -23.695 -13.081 1.00 3.40 H new ATOM 0 HA3 GLY A 105 -21.887 -23.692 -11.980 1.00 3.40 H new ATOM 1622 N LYS A 106 -20.268 -20.869 -12.257 1.00 63.04 N ATOM 1623 CA LYS A 106 -20.413 -19.445 -12.541 1.00 23.53 C ATOM 1624 C LYS A 106 -19.103 -18.857 -13.054 1.00 52.51 C ATOM 1625 O LYS A 106 -18.022 -19.364 -12.754 1.00 15.21 O ATOM 1626 CB LYS A 106 -20.863 -18.699 -11.283 1.00 4.42 C ATOM 1627 CG LYS A 106 -22.370 -18.654 -11.108 1.00 13.01 C ATOM 1628 CD LYS A 106 -22.756 -18.364 -9.667 1.00 34.42 C ATOM 1629 CE LYS A 106 -22.781 -16.870 -9.386 1.00 12.25 C ATOM 1630 NZ LYS A 106 -22.681 -16.578 -7.928 1.00 53.44 N ATOM 0 H LYS A 106 -19.384 -21.123 -11.816 1.00 63.04 H new ATOM 0 HA LYS A 106 -21.170 -19.328 -13.316 1.00 23.53 H new ATOM 0 HB2 LYS A 106 -20.419 -19.176 -10.410 1.00 4.42 H new ATOM 0 HB3 LYS A 106 -20.479 -17.679 -11.319 1.00 4.42 H new ATOM 0 HG2 LYS A 106 -22.790 -17.888 -11.759 1.00 13.01 H new ATOM 0 HG3 LYS A 106 -22.802 -19.606 -11.417 1.00 13.01 H new ATOM 0 HD2 LYS A 106 -23.737 -18.791 -9.459 1.00 34.42 H new ATOM 0 HD3 LYS A 106 -22.048 -18.850 -8.995 1.00 34.42 H new ATOM 0 HE2 LYS A 106 -21.956 -16.388 -9.910 1.00 12.25 H new ATOM 0 HE3 LYS A 106 -23.703 -16.442 -9.780 1.00 12.25 H new ATOM 0 HZ1 LYS A 106 -22.701 -15.549 -7.778 1.00 53.44 H new ATOM 0 HZ2 LYS A 106 -23.482 -17.017 -7.430 1.00 53.44 H new ATOM 0 HZ3 LYS A 106 -21.790 -16.964 -7.557 1.00 53.44 H new ATOM 1644 N LYS A 107 -19.207 -17.783 -13.830 1.00 5.15 N ATOM 1645 CA LYS A 107 -18.031 -17.122 -14.383 1.00 22.41 C ATOM 1646 C LYS A 107 -17.504 -16.057 -13.426 1.00 2.12 C ATOM 1647 O LYS A 107 -18.278 -15.319 -12.814 1.00 70.34 O ATOM 1648 CB LYS A 107 -18.365 -16.488 -15.734 1.00 42.32 C ATOM 1649 CG LYS A 107 -19.383 -15.365 -15.644 1.00 53.43 C ATOM 1650 CD LYS A 107 -19.545 -14.650 -16.975 1.00 74.10 C ATOM 1651 CE LYS A 107 -20.618 -13.574 -16.903 1.00 71.11 C ATOM 1652 NZ LYS A 107 -20.159 -12.382 -16.139 1.00 25.43 N ATOM 0 H LYS A 107 -20.094 -17.352 -14.090 1.00 5.15 H new ATOM 0 HA LYS A 107 -17.255 -17.875 -14.524 1.00 22.41 H new ATOM 0 HB2 LYS A 107 -17.449 -16.102 -16.181 1.00 42.32 H new ATOM 0 HB3 LYS A 107 -18.746 -17.259 -16.404 1.00 42.32 H new ATOM 0 HG2 LYS A 107 -20.345 -15.769 -15.328 1.00 53.43 H new ATOM 0 HG3 LYS A 107 -19.071 -14.651 -14.882 1.00 53.43 H new ATOM 0 HD2 LYS A 107 -18.596 -14.200 -17.265 1.00 74.10 H new ATOM 0 HD3 LYS A 107 -19.805 -15.373 -17.748 1.00 74.10 H new ATOM 0 HE2 LYS A 107 -20.898 -13.272 -17.912 1.00 71.11 H new ATOM 0 HE3 LYS A 107 -21.512 -13.984 -16.433 1.00 71.11 H new ATOM 0 HZ1 LYS A 107 -20.919 -11.672 -16.113 1.00 25.43 H new ATOM 0 HZ2 LYS A 107 -19.916 -12.664 -15.168 1.00 25.43 H new ATOM 0 HZ3 LYS A 107 -19.321 -11.975 -16.601 1.00 25.43 H new ATOM 1666 N LEU A 108 -16.183 -15.980 -13.302 1.00 62.00 N ATOM 1667 CA LEU A 108 -15.553 -15.003 -12.421 1.00 31.31 C ATOM 1668 C LEU A 108 -14.806 -13.945 -13.226 1.00 60.45 C ATOM 1669 O LEU A 108 -14.642 -12.811 -12.778 1.00 22.20 O ATOM 1670 CB LEU A 108 -14.590 -15.702 -11.458 1.00 53.53 C ATOM 1671 CG LEU A 108 -15.159 -16.896 -10.690 1.00 64.34 C ATOM 1672 CD1 LEU A 108 -16.589 -16.618 -10.253 1.00 21.01 C ATOM 1673 CD2 LEU A 108 -15.095 -18.157 -11.539 1.00 44.43 C ATOM 0 H LEU A 108 -15.528 -16.582 -13.800 1.00 62.00 H new ATOM 0 HA LEU A 108 -16.337 -14.509 -11.847 1.00 31.31 H new ATOM 0 HB2 LEU A 108 -13.722 -16.040 -12.025 1.00 53.53 H new ATOM 0 HB3 LEU A 108 -14.233 -14.968 -10.736 1.00 53.53 H new ATOM 0 HG LEU A 108 -14.552 -17.051 -9.798 1.00 64.34 H new ATOM 0 HD11 LEU A 108 -16.977 -17.479 -9.708 1.00 21.01 H new ATOM 0 HD12 LEU A 108 -16.608 -15.741 -9.606 1.00 21.01 H new ATOM 0 HD13 LEU A 108 -17.209 -16.435 -11.131 1.00 21.01 H new ATOM 0 HD21 LEU A 108 -15.504 -18.996 -10.976 1.00 44.43 H new ATOM 0 HD22 LEU A 108 -15.677 -18.013 -12.449 1.00 44.43 H new ATOM 0 HD23 LEU A 108 -14.058 -18.367 -11.801 1.00 44.43 H new ATOM 1685 N SER A 109 -14.357 -14.325 -14.419 1.00 64.12 N ATOM 1686 CA SER A 109 -13.625 -13.409 -15.286 1.00 55.15 C ATOM 1687 C SER A 109 -13.268 -14.082 -16.608 1.00 41.05 C ATOM 1688 O SER A 109 -13.461 -15.286 -16.776 1.00 33.13 O ATOM 1689 CB SER A 109 -12.354 -12.919 -14.591 1.00 52.45 C ATOM 1690 OG SER A 109 -12.397 -11.519 -14.377 1.00 54.05 O ATOM 0 H SER A 109 -14.487 -15.260 -14.806 1.00 64.12 H new ATOM 0 HA SER A 109 -14.268 -12.554 -15.494 1.00 55.15 H new ATOM 0 HB2 SER A 109 -12.237 -13.432 -13.637 1.00 52.45 H new ATOM 0 HB3 SER A 109 -11.484 -13.171 -15.198 1.00 52.45 H new ATOM 0 HG SER A 109 -13.115 -11.307 -13.745 1.00 54.05 H new ATOM 1696 N GLN A 110 -12.747 -13.295 -17.544 1.00 73.42 N ATOM 1697 CA GLN A 110 -12.364 -13.815 -18.851 1.00 42.33 C ATOM 1698 C GLN A 110 -11.239 -12.982 -19.459 1.00 70.12 C ATOM 1699 O GLN A 110 -11.476 -11.901 -19.998 1.00 44.53 O ATOM 1700 CB GLN A 110 -13.570 -13.828 -19.792 1.00 72.44 C ATOM 1701 CG GLN A 110 -14.382 -12.544 -19.760 1.00 35.44 C ATOM 1702 CD GLN A 110 -15.641 -12.628 -20.599 1.00 64.20 C ATOM 1703 OE1 GLN A 110 -16.137 -13.717 -20.888 1.00 14.10 O ATOM 1704 NE2 GLN A 110 -16.165 -11.474 -20.998 1.00 21.42 N ATOM 0 H GLN A 110 -12.581 -12.296 -17.422 1.00 73.42 H new ATOM 0 HA GLN A 110 -12.006 -14.836 -18.717 1.00 42.33 H new ATOM 0 HB2 GLN A 110 -13.223 -14.003 -20.810 1.00 72.44 H new ATOM 0 HB3 GLN A 110 -14.218 -14.664 -19.527 1.00 72.44 H new ATOM 0 HG2 GLN A 110 -14.652 -12.315 -18.729 1.00 35.44 H new ATOM 0 HG3 GLN A 110 -13.765 -11.720 -20.119 1.00 35.44 H new ATOM 0 HE21 GLN A 110 -15.721 -10.594 -20.735 1.00 21.42 H new ATOM 0 HE22 GLN A 110 -17.012 -11.468 -21.567 1.00 21.42 H new ATOM 1713 N VAL A 111 -10.016 -13.493 -19.369 1.00 61.10 N ATOM 1714 CA VAL A 111 -8.855 -12.798 -19.910 1.00 4.43 C ATOM 1715 C VAL A 111 -8.618 -13.176 -21.368 1.00 3.33 C ATOM 1716 O VAL A 111 -8.793 -14.331 -21.756 1.00 41.10 O ATOM 1717 CB VAL A 111 -7.584 -13.108 -19.098 1.00 34.54 C ATOM 1718 CG1 VAL A 111 -6.374 -12.422 -19.712 1.00 53.12 C ATOM 1719 CG2 VAL A 111 -7.765 -12.689 -17.646 1.00 22.25 C ATOM 0 H VAL A 111 -9.803 -14.387 -18.926 1.00 61.10 H new ATOM 0 HA VAL A 111 -9.067 -11.731 -19.844 1.00 4.43 H new ATOM 0 HB VAL A 111 -7.412 -14.184 -19.124 1.00 34.54 H new ATOM 0 HG11 VAL A 111 -5.487 -12.654 -19.123 1.00 53.12 H new ATOM 0 HG12 VAL A 111 -6.234 -12.776 -20.733 1.00 53.12 H new ATOM 0 HG13 VAL A 111 -6.532 -11.344 -19.720 1.00 53.12 H new ATOM 0 HG21 VAL A 111 -6.857 -12.915 -17.086 1.00 22.25 H new ATOM 0 HG22 VAL A 111 -7.963 -11.618 -17.598 1.00 22.25 H new ATOM 0 HG23 VAL A 111 -8.604 -13.233 -17.212 1.00 22.25 H new ATOM 1729 N ILE A 112 -8.217 -12.196 -22.170 1.00 40.51 N ATOM 1730 CA ILE A 112 -7.954 -12.427 -23.586 1.00 13.53 C ATOM 1731 C ILE A 112 -6.542 -11.992 -23.961 1.00 35.44 C ATOM 1732 O ILE A 112 -6.237 -10.800 -23.996 1.00 64.54 O ATOM 1733 CB ILE A 112 -8.963 -11.677 -24.475 1.00 10.42 C ATOM 1734 CG1 ILE A 112 -10.392 -11.931 -23.990 1.00 64.13 C ATOM 1735 CG2 ILE A 112 -8.808 -12.102 -25.927 1.00 61.22 C ATOM 1736 CD1 ILE A 112 -11.440 -11.173 -24.775 1.00 11.41 C ATOM 0 H ILE A 112 -8.067 -11.235 -21.864 1.00 40.51 H new ATOM 0 HA ILE A 112 -8.058 -13.499 -23.756 1.00 13.53 H new ATOM 0 HB ILE A 112 -8.761 -10.608 -24.406 1.00 10.42 H new ATOM 0 HG12 ILE A 112 -10.604 -12.998 -24.053 1.00 64.13 H new ATOM 0 HG13 ILE A 112 -10.465 -11.653 -22.939 1.00 64.13 H new ATOM 0 HG21 ILE A 112 -9.528 -11.563 -26.543 1.00 61.22 H new ATOM 0 HG22 ILE A 112 -7.798 -11.874 -26.267 1.00 61.22 H new ATOM 0 HG23 ILE A 112 -8.987 -13.174 -26.014 1.00 61.22 H new ATOM 0 HD11 ILE A 112 -12.429 -11.401 -24.376 1.00 11.41 H new ATOM 0 HD12 ILE A 112 -11.253 -10.102 -24.692 1.00 11.41 H new ATOM 0 HD13 ILE A 112 -11.394 -11.469 -25.823 1.00 11.41 H new ATOM 1748 N GLY A 113 -5.683 -12.968 -24.241 1.00 53.21 N ATOM 1749 CA GLY A 113 -4.313 -12.666 -24.612 1.00 14.23 C ATOM 1750 C GLY A 113 -3.324 -13.031 -23.521 1.00 44.34 C ATOM 1751 O GLY A 113 -3.442 -14.082 -22.894 1.00 21.13 O ATOM 0 H GLY A 113 -5.912 -13.962 -24.217 1.00 53.21 H new ATOM 0 HA2 GLY A 113 -4.059 -13.206 -25.524 1.00 14.23 H new ATOM 0 HA3 GLY A 113 -4.226 -11.603 -24.836 1.00 14.23 H new ATOM 1755 N ALA A 114 -2.345 -12.160 -23.299 1.00 2.12 N ATOM 1756 CA ALA A 114 -1.332 -12.396 -22.277 1.00 50.23 C ATOM 1757 C ALA A 114 -0.930 -11.094 -21.592 1.00 73.31 C ATOM 1758 O ALA A 114 -0.535 -10.132 -22.250 1.00 1.34 O ATOM 1759 CB ALA A 114 -0.112 -13.070 -22.890 1.00 34.24 C ATOM 0 H ALA A 114 -2.232 -11.286 -23.812 1.00 2.12 H new ATOM 0 HA ALA A 114 -1.759 -13.057 -21.522 1.00 50.23 H new ATOM 0 HB1 ALA A 114 0.637 -13.240 -22.116 1.00 34.24 H new ATOM 0 HB2 ALA A 114 -0.405 -14.024 -23.328 1.00 34.24 H new ATOM 0 HB3 ALA A 114 0.307 -12.428 -23.665 1.00 34.24 H new ATOM 1765 N ASP A 115 -1.034 -11.072 -20.268 1.00 11.22 N ATOM 1766 CA ASP A 115 -0.681 -9.888 -19.493 1.00 33.14 C ATOM 1767 C ASP A 115 -0.670 -10.200 -17.999 1.00 50.50 C ATOM 1768 O ASP A 115 -1.723 -10.351 -17.379 1.00 41.34 O ATOM 1769 CB ASP A 115 -1.663 -8.751 -19.782 1.00 73.33 C ATOM 1770 CG ASP A 115 -1.372 -7.512 -18.960 1.00 45.55 C ATOM 1771 OD1 ASP A 115 -0.273 -7.435 -18.371 1.00 51.32 O ATOM 1772 OD2 ASP A 115 -2.241 -6.617 -18.907 1.00 15.43 O ATOM 0 H ASP A 115 -1.360 -11.860 -19.709 1.00 11.22 H new ATOM 0 HA ASP A 115 0.321 -9.576 -19.788 1.00 33.14 H new ATOM 0 HB2 ASP A 115 -1.621 -8.499 -20.842 1.00 73.33 H new ATOM 0 HB3 ASP A 115 -2.678 -9.090 -19.576 1.00 73.33 H new ATOM 1777 N ILE A 116 0.526 -10.295 -17.429 1.00 43.41 N ATOM 1778 CA ILE A 116 0.674 -10.588 -16.009 1.00 44.52 C ATOM 1779 C ILE A 116 -0.131 -9.611 -15.159 1.00 11.00 C ATOM 1780 O ILE A 116 -0.811 -10.009 -14.214 1.00 0.15 O ATOM 1781 CB ILE A 116 2.151 -10.534 -15.574 1.00 1.13 C ATOM 1782 CG1 ILE A 116 2.265 -10.717 -14.059 1.00 20.02 C ATOM 1783 CG2 ILE A 116 2.782 -9.217 -16.003 1.00 15.41 C ATOM 1784 CD1 ILE A 116 1.718 -12.039 -13.567 1.00 45.32 C ATOM 0 H ILE A 116 1.407 -10.173 -17.929 1.00 43.41 H new ATOM 0 HA ILE A 116 0.295 -11.598 -15.854 1.00 44.52 H new ATOM 0 HB ILE A 116 2.689 -11.347 -16.061 1.00 1.13 H new ATOM 0 HG12 ILE A 116 3.313 -10.636 -13.769 1.00 20.02 H new ATOM 0 HG13 ILE A 116 1.733 -9.906 -13.562 1.00 20.02 H new ATOM 0 HG21 ILE A 116 3.825 -9.194 -15.688 1.00 15.41 H new ATOM 0 HG22 ILE A 116 2.728 -9.124 -17.088 1.00 15.41 H new ATOM 0 HG23 ILE A 116 2.245 -8.389 -15.540 1.00 15.41 H new ATOM 0 HD11 ILE A 116 1.832 -12.100 -12.485 1.00 45.32 H new ATOM 0 HD12 ILE A 116 0.662 -12.115 -13.826 1.00 45.32 H new ATOM 0 HD13 ILE A 116 2.266 -12.856 -14.036 1.00 45.32 H new ATOM 1796 N SER A 117 -0.051 -8.329 -15.504 1.00 21.43 N ATOM 1797 CA SER A 117 -0.770 -7.294 -14.771 1.00 43.32 C ATOM 1798 C SER A 117 -2.278 -7.497 -14.884 1.00 21.20 C ATOM 1799 O SER A 117 -3.049 -6.978 -14.078 1.00 13.41 O ATOM 1800 CB SER A 117 -0.390 -5.909 -15.299 1.00 12.44 C ATOM 1801 OG SER A 117 1.015 -5.725 -15.282 1.00 62.05 O ATOM 0 H SER A 117 0.505 -7.983 -16.286 1.00 21.43 H new ATOM 0 HA SER A 117 -0.489 -7.365 -13.720 1.00 43.32 H new ATOM 0 HB2 SER A 117 -0.763 -5.789 -16.316 1.00 12.44 H new ATOM 0 HB3 SER A 117 -0.868 -5.141 -14.691 1.00 12.44 H new ATOM 0 HG SER A 117 1.232 -4.833 -15.626 1.00 62.05 H new ATOM 1807 N LYS A 118 -2.692 -8.258 -15.892 1.00 15.20 N ATOM 1808 CA LYS A 118 -4.107 -8.533 -16.112 1.00 45.15 C ATOM 1809 C LYS A 118 -4.570 -9.716 -15.267 1.00 64.05 C ATOM 1810 O LYS A 118 -5.484 -9.589 -14.453 1.00 21.20 O ATOM 1811 CB LYS A 118 -4.368 -8.817 -17.593 1.00 45.12 C ATOM 1812 CG LYS A 118 -5.841 -8.960 -17.935 1.00 72.13 C ATOM 1813 CD LYS A 118 -6.587 -7.649 -17.751 1.00 21.24 C ATOM 1814 CE LYS A 118 -8.087 -7.834 -17.914 1.00 12.53 C ATOM 1815 NZ LYS A 118 -8.825 -6.549 -17.755 1.00 64.22 N ATOM 0 H LYS A 118 -2.067 -8.695 -16.569 1.00 15.20 H new ATOM 0 HA LYS A 118 -4.674 -7.652 -15.812 1.00 45.15 H new ATOM 0 HB2 LYS A 118 -3.942 -8.010 -18.189 1.00 45.12 H new ATOM 0 HB3 LYS A 118 -3.848 -9.732 -17.876 1.00 45.12 H new ATOM 0 HG2 LYS A 118 -5.945 -9.297 -18.966 1.00 72.13 H new ATOM 0 HG3 LYS A 118 -6.289 -9.726 -17.303 1.00 72.13 H new ATOM 0 HD2 LYS A 118 -6.375 -7.244 -16.762 1.00 21.24 H new ATOM 0 HD3 LYS A 118 -6.228 -6.920 -18.477 1.00 21.24 H new ATOM 0 HE2 LYS A 118 -8.296 -8.254 -18.898 1.00 12.53 H new ATOM 0 HE3 LYS A 118 -8.446 -8.553 -17.178 1.00 12.53 H new ATOM 0 HZ1 LYS A 118 -9.844 -6.717 -17.873 1.00 64.22 H new ATOM 0 HZ2 LYS A 118 -8.646 -6.161 -16.807 1.00 64.22 H new ATOM 0 HZ3 LYS A 118 -8.500 -5.871 -18.474 1.00 64.22 H new ATOM 1829 N ILE A 119 -3.932 -10.865 -15.467 1.00 65.15 N ATOM 1830 CA ILE A 119 -4.276 -12.069 -14.722 1.00 50.12 C ATOM 1831 C ILE A 119 -4.228 -11.818 -13.218 1.00 70.05 C ATOM 1832 O ILE A 119 -5.008 -12.391 -12.458 1.00 1.10 O ATOM 1833 CB ILE A 119 -3.331 -13.235 -15.067 1.00 20.21 C ATOM 1834 CG1 ILE A 119 -1.947 -12.995 -14.459 1.00 2.20 C ATOM 1835 CG2 ILE A 119 -3.231 -13.406 -16.575 1.00 22.50 C ATOM 1836 CD1 ILE A 119 -1.749 -13.671 -13.121 1.00 60.34 C ATOM 0 H ILE A 119 -3.174 -10.987 -16.139 1.00 65.15 H new ATOM 0 HA ILE A 119 -5.292 -12.338 -15.011 1.00 50.12 H new ATOM 0 HB ILE A 119 -3.739 -14.153 -14.643 1.00 20.21 H new ATOM 0 HG12 ILE A 119 -1.187 -13.353 -15.154 1.00 2.20 H new ATOM 0 HG13 ILE A 119 -1.792 -11.923 -14.342 1.00 2.20 H new ATOM 0 HG21 ILE A 119 -2.560 -14.234 -16.804 1.00 22.50 H new ATOM 0 HG22 ILE A 119 -4.219 -13.617 -16.984 1.00 22.50 H new ATOM 0 HG23 ILE A 119 -2.842 -12.490 -17.020 1.00 22.50 H new ATOM 0 HD11 ILE A 119 -0.746 -13.458 -12.750 1.00 60.34 H new ATOM 0 HD12 ILE A 119 -2.486 -13.296 -12.411 1.00 60.34 H new ATOM 0 HD13 ILE A 119 -1.872 -14.748 -13.236 1.00 60.34 H new ATOM 1848 N ILE A 120 -3.308 -10.957 -12.798 1.00 42.50 N ATOM 1849 CA ILE A 120 -3.159 -10.627 -11.386 1.00 1.51 C ATOM 1850 C ILE A 120 -4.274 -9.696 -10.918 1.00 62.35 C ATOM 1851 O ILE A 120 -4.713 -9.765 -9.770 1.00 43.52 O ATOM 1852 CB ILE A 120 -1.798 -9.964 -11.102 1.00 53.45 C ATOM 1853 CG1 ILE A 120 -1.687 -8.637 -11.856 1.00 1.40 C ATOM 1854 CG2 ILE A 120 -0.663 -10.897 -11.490 1.00 71.24 C ATOM 1855 CD1 ILE A 120 -2.131 -7.440 -11.045 1.00 14.01 C ATOM 0 H ILE A 120 -2.654 -10.475 -13.415 1.00 42.50 H new ATOM 0 HA ILE A 120 -3.218 -11.566 -10.835 1.00 1.51 H new ATOM 0 HB ILE A 120 -1.724 -9.761 -10.034 1.00 53.45 H new ATOM 0 HG12 ILE A 120 -0.653 -8.491 -12.167 1.00 1.40 H new ATOM 0 HG13 ILE A 120 -2.288 -8.693 -12.764 1.00 1.40 H new ATOM 0 HG21 ILE A 120 0.292 -10.414 -11.283 1.00 71.24 H new ATOM 0 HG22 ILE A 120 -0.736 -11.819 -10.913 1.00 71.24 H new ATOM 0 HG23 ILE A 120 -0.730 -11.129 -12.553 1.00 71.24 H new ATOM 0 HD11 ILE A 120 -2.024 -6.535 -11.643 1.00 14.01 H new ATOM 0 HD12 ILE A 120 -3.175 -7.563 -10.756 1.00 14.01 H new ATOM 0 HD13 ILE A 120 -1.514 -7.358 -10.150 1.00 14.01 H new ATOM 1867 N SER A 121 -4.728 -8.829 -11.817 1.00 0.12 N ATOM 1868 CA SER A 121 -5.790 -7.882 -11.497 1.00 73.21 C ATOM 1869 C SER A 121 -7.127 -8.599 -11.336 1.00 61.43 C ATOM 1870 O SER A 121 -7.934 -8.245 -10.477 1.00 43.23 O ATOM 1871 CB SER A 121 -5.898 -6.816 -12.588 1.00 52.11 C ATOM 1872 OG SER A 121 -7.065 -6.030 -12.419 1.00 1.41 O ATOM 0 H SER A 121 -4.377 -8.763 -12.773 1.00 0.12 H new ATOM 0 HA SER A 121 -5.540 -7.400 -10.552 1.00 73.21 H new ATOM 0 HB2 SER A 121 -5.017 -6.175 -12.563 1.00 52.11 H new ATOM 0 HB3 SER A 121 -5.916 -7.294 -13.567 1.00 52.11 H new ATOM 0 HG SER A 121 -7.110 -5.355 -13.128 1.00 1.41 H new ATOM 1878 N GLU A 122 -7.352 -9.611 -12.169 1.00 41.41 N ATOM 1879 CA GLU A 122 -8.591 -10.378 -12.120 1.00 61.12 C ATOM 1880 C GLU A 122 -8.575 -11.364 -10.955 1.00 33.11 C ATOM 1881 O GLU A 122 -9.485 -11.376 -10.126 1.00 50.32 O ATOM 1882 CB GLU A 122 -8.804 -11.130 -13.436 1.00 22.41 C ATOM 1883 CG GLU A 122 -8.856 -10.223 -14.653 1.00 53.03 C ATOM 1884 CD GLU A 122 -10.207 -9.555 -14.826 1.00 22.05 C ATOM 1885 OE1 GLU A 122 -10.678 -8.912 -13.866 1.00 35.23 O ATOM 1886 OE2 GLU A 122 -10.791 -9.676 -15.923 1.00 60.42 O ATOM 0 H GLU A 122 -6.693 -9.918 -12.885 1.00 41.41 H new ATOM 0 HA GLU A 122 -9.415 -9.680 -11.971 1.00 61.12 H new ATOM 0 HB2 GLU A 122 -7.999 -11.853 -13.566 1.00 22.41 H new ATOM 0 HB3 GLU A 122 -9.734 -11.696 -13.375 1.00 22.41 H new ATOM 0 HG2 GLU A 122 -8.085 -9.457 -14.564 1.00 53.03 H new ATOM 0 HG3 GLU A 122 -8.626 -10.805 -15.545 1.00 53.03 H new ATOM 1893 N ILE A 123 -7.535 -12.189 -10.900 1.00 72.25 N ATOM 1894 CA ILE A 123 -7.400 -13.178 -9.838 1.00 54.04 C ATOM 1895 C ILE A 123 -7.477 -12.521 -8.464 1.00 62.52 C ATOM 1896 O ILE A 123 -8.338 -12.858 -7.652 1.00 23.52 O ATOM 1897 CB ILE A 123 -6.072 -13.949 -9.953 1.00 31.40 C ATOM 1898 CG1 ILE A 123 -6.049 -14.780 -11.237 1.00 34.31 C ATOM 1899 CG2 ILE A 123 -5.871 -14.840 -8.736 1.00 30.35 C ATOM 1900 CD1 ILE A 123 -4.669 -15.269 -11.617 1.00 24.43 C ATOM 0 H ILE A 123 -6.773 -12.192 -11.579 1.00 72.25 H new ATOM 0 HA ILE A 123 -8.228 -13.878 -9.950 1.00 54.04 H new ATOM 0 HB ILE A 123 -5.254 -13.230 -9.993 1.00 31.40 H new ATOM 0 HG12 ILE A 123 -6.709 -15.639 -11.116 1.00 34.31 H new ATOM 0 HG13 ILE A 123 -6.451 -14.182 -12.054 1.00 34.31 H new ATOM 0 HG21 ILE A 123 -4.928 -15.379 -8.831 1.00 30.35 H new ATOM 0 HG22 ILE A 123 -5.849 -14.226 -7.835 1.00 30.35 H new ATOM 0 HG23 ILE A 123 -6.692 -15.554 -8.668 1.00 30.35 H new ATOM 0 HD11 ILE A 123 -4.730 -15.851 -12.537 1.00 24.43 H new ATOM 0 HD12 ILE A 123 -4.010 -14.415 -11.771 1.00 24.43 H new ATOM 0 HD13 ILE A 123 -4.272 -15.895 -10.818 1.00 24.43 H new ATOM 1912 N ASN A 124 -6.571 -11.582 -8.211 1.00 75.21 N ATOM 1913 CA ASN A 124 -6.537 -10.877 -6.935 1.00 73.45 C ATOM 1914 C ASN A 124 -7.891 -10.242 -6.628 1.00 64.11 C ATOM 1915 O ASN A 124 -8.240 -10.034 -5.467 1.00 42.22 O ATOM 1916 CB ASN A 124 -5.449 -9.802 -6.952 1.00 11.21 C ATOM 1917 CG ASN A 124 -4.061 -10.387 -7.126 1.00 25.22 C ATOM 1918 OD1 ASN A 124 -3.851 -11.584 -6.931 1.00 22.41 O ATOM 1919 ND2 ASN A 124 -3.104 -9.542 -7.493 1.00 11.02 N ATOM 0 H ASN A 124 -5.851 -11.292 -8.873 1.00 75.21 H new ATOM 0 HA ASN A 124 -6.310 -11.602 -6.153 1.00 73.45 H new ATOM 0 HB2 ASN A 124 -5.648 -9.100 -7.762 1.00 11.21 H new ATOM 0 HB3 ASN A 124 -5.487 -9.235 -6.022 1.00 11.21 H new ATOM 0 HD21 ASN A 124 -2.150 -9.878 -7.624 1.00 11.02 H new ATOM 0 HD22 ASN A 124 -3.323 -8.557 -7.644 1.00 11.02 H new ATOM 1926 N ASN A 125 -8.647 -9.939 -7.677 1.00 51.03 N ATOM 1927 CA ASN A 125 -9.963 -9.328 -7.520 1.00 1.33 C ATOM 1928 C ASN A 125 -11.010 -10.377 -7.160 1.00 30.23 C ATOM 1929 O ASN A 125 -11.995 -10.079 -6.487 1.00 34.25 O ATOM 1930 CB ASN A 125 -10.369 -8.606 -8.806 1.00 2.44 C ATOM 1931 CG ASN A 125 -11.856 -8.312 -8.858 1.00 64.22 C ATOM 1932 OD1 ASN A 125 -12.356 -7.454 -8.130 1.00 75.13 O ATOM 1933 ND2 ASN A 125 -12.570 -9.025 -9.722 1.00 2.34 N ATOM 0 H ASN A 125 -8.372 -10.106 -8.645 1.00 51.03 H new ATOM 0 HA ASN A 125 -9.906 -8.604 -6.707 1.00 1.33 H new ATOM 0 HB2 ASN A 125 -9.813 -7.672 -8.886 1.00 2.44 H new ATOM 0 HB3 ASN A 125 -10.092 -9.216 -9.665 1.00 2.44 H new ATOM 0 HD21 ASN A 125 -13.575 -8.872 -9.802 1.00 2.34 H new ATOM 0 HD22 ASN A 125 -12.113 -9.726 -10.305 1.00 2.34 H new ATOM 1940 N ASN A 126 -10.789 -11.607 -7.613 1.00 22.12 N ATOM 1941 CA ASN A 126 -11.713 -12.701 -7.339 1.00 5.34 C ATOM 1942 C ASN A 126 -11.190 -13.584 -6.209 1.00 72.44 C ATOM 1943 O ASN A 126 -11.719 -14.669 -5.962 1.00 24.00 O ATOM 1944 CB ASN A 126 -11.931 -13.540 -8.599 1.00 64.41 C ATOM 1945 CG ASN A 126 -12.206 -12.686 -9.822 1.00 31.12 C ATOM 1946 OD1 ASN A 126 -13.005 -11.750 -9.772 1.00 60.44 O ATOM 1947 ND2 ASN A 126 -11.545 -13.007 -10.927 1.00 44.34 N ATOM 0 H ASN A 126 -9.977 -11.871 -8.172 1.00 22.12 H new ATOM 0 HA ASN A 126 -12.665 -12.271 -7.029 1.00 5.34 H new ATOM 0 HB2 ASN A 126 -11.050 -14.155 -8.780 1.00 64.41 H new ATOM 0 HB3 ASN A 126 -12.767 -14.221 -8.439 1.00 64.41 H new ATOM 0 HD21 ASN A 126 -11.689 -12.470 -11.782 1.00 44.34 H new ATOM 0 HD22 ASN A 126 -10.893 -13.791 -10.921 1.00 44.34 H new ATOM 1954 N ILE A 127 -10.152 -13.112 -5.529 1.00 64.21 N ATOM 1955 CA ILE A 127 -9.559 -13.859 -4.426 1.00 53.31 C ATOM 1956 C ILE A 127 -10.022 -13.311 -3.080 1.00 13.41 C ATOM 1957 O ILE A 127 -10.254 -12.111 -2.934 1.00 22.03 O ATOM 1958 CB ILE A 127 -8.020 -13.819 -4.481 1.00 71.21 C ATOM 1959 CG1 ILE A 127 -7.493 -14.932 -5.390 1.00 12.14 C ATOM 1960 CG2 ILE A 127 -7.437 -13.948 -3.083 1.00 2.33 C ATOM 1961 CD1 ILE A 127 -5.983 -15.023 -5.418 1.00 51.21 C ATOM 0 H ILE A 127 -9.704 -12.216 -5.722 1.00 64.21 H new ATOM 0 HA ILE A 127 -9.891 -14.892 -4.530 1.00 53.31 H new ATOM 0 HB ILE A 127 -7.709 -12.860 -4.895 1.00 71.21 H new ATOM 0 HG12 ILE A 127 -7.901 -15.886 -5.057 1.00 12.14 H new ATOM 0 HG13 ILE A 127 -7.858 -14.766 -6.404 1.00 12.14 H new ATOM 0 HG21 ILE A 127 -6.349 -13.918 -3.138 1.00 2.33 H new ATOM 0 HG22 ILE A 127 -7.792 -13.124 -2.463 1.00 2.33 H new ATOM 0 HG23 ILE A 127 -7.752 -14.894 -2.643 1.00 2.33 H new ATOM 0 HD11 ILE A 127 -5.680 -15.833 -6.082 1.00 51.21 H new ATOM 0 HD12 ILE A 127 -5.568 -14.082 -5.780 1.00 51.21 H new ATOM 0 HD13 ILE A 127 -5.612 -15.220 -4.412 1.00 51.21 H new ATOM 1973 N ASN A 128 -10.154 -14.198 -2.100 1.00 2.43 N ATOM 1974 CA ASN A 128 -10.587 -13.803 -0.764 1.00 53.34 C ATOM 1975 C ASN A 128 -9.874 -12.531 -0.314 1.00 63.41 C ATOM 1976 O ASN A 128 -10.511 -11.560 0.091 1.00 72.01 O ATOM 1977 CB ASN A 128 -10.324 -14.931 0.235 1.00 3.42 C ATOM 1978 CG ASN A 128 -10.508 -16.304 -0.382 1.00 11.34 C ATOM 1979 OD1 ASN A 128 -11.560 -16.927 -0.235 1.00 54.30 O ATOM 1980 ND2 ASN A 128 -9.483 -16.783 -1.076 1.00 25.45 N ATOM 0 H ASN A 128 -9.968 -15.195 -2.205 1.00 2.43 H new ATOM 0 HA ASN A 128 -11.658 -13.603 -0.801 1.00 53.34 H new ATOM 0 HB2 ASN A 128 -9.308 -14.842 0.620 1.00 3.42 H new ATOM 0 HB3 ASN A 128 -10.998 -14.824 1.085 1.00 3.42 H new ATOM 0 HD21 ASN A 128 -9.548 -17.702 -1.513 1.00 25.45 H new ATOM 0 HD22 ASN A 128 -8.630 -16.232 -1.172 1.00 25.45 H new