USER MOD reduce.3.24.130724 H: found=0, std=0, add=616, rem=0, adj=17 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= -0.485 K(o=-0.63,f=0.11) USER MOD Set 1.2: A 103 LYS NZ :NH3+ 159:sc= -0.149 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -0.0603 K(o=-0.06,f=-2.5!) USER MOD Single : A 29 SER OG : rot 51:sc= 0.0361 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 152:sc= -0.686 (180deg=-1.84) 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 137:sc= -0.581 USER MOD Single : A 39 ASN : amide:sc= -0.539 X(o=-0.54,f=-1) USER MOD Single : A 62 GLN : amide:sc= -0.896 X(o=-0.9,f=-0.64) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 GLN : amide:sc= -0.174 K(o=-0.17,f=-1.8!) 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= 0.108 K(o=0.11,f=-0.94) 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+ -149:sc= -0.176 (180deg=-0.94) USER MOD Single : A 98 THR OG1 : rot -140:sc= -0.489 USER MOD Single : A 101 MET CE :methyl -107:sc= -6.74! (180deg=-14.5!) USER MOD Single : A 104 ASN : amide:sc= -0.646 K(o=-0.65,f=-1.2) USER MOD Single : A 106 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0481) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot -107:sc= 0.549 USER MOD Single : A 110 GLN : amide:sc=-0.000823 X(o=-0.00082,f=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 162:sc= -0.0113 (180deg=-0.125) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.426 K(o=-0.43,f=-0.98) USER MOD Single : A 125 ASN : amide:sc= -0.0355 X(o=-0.035,f=-0.035) USER MOD Single : A 126 ASN : amide:sc= -5.1! C(o=-5.1!,f=-13!) USER MOD Single : A 128 ASN : amide:sc= -0.857 K(o=-0.86,f=0) USER MOD ----------------------------------------------------------------- ATOM 316 N ILE A 23 0.595 -27.150 -15.100 1.00 52.50 N ATOM 317 CA ILE A 23 -0.738 -27.150 -15.689 1.00 71.21 C ATOM 318 C ILE A 23 -1.003 -28.445 -16.448 1.00 10.42 C ATOM 319 O ILE A 23 -0.095 -29.024 -17.044 1.00 53.52 O ATOM 320 CB ILE A 23 -0.932 -25.958 -16.644 1.00 41.35 C ATOM 321 CG1 ILE A 23 -0.318 -24.691 -16.045 1.00 13.10 C ATOM 322 CG2 ILE A 23 -2.411 -25.749 -16.938 1.00 73.31 C ATOM 323 CD1 ILE A 23 -0.856 -24.349 -14.673 1.00 74.23 C ATOM 0 HA ILE A 23 -1.447 -27.063 -14.866 1.00 71.21 H new ATOM 0 HB ILE A 23 -0.423 -26.177 -17.582 1.00 41.35 H new ATOM 0 HG12 ILE A 23 0.763 -24.816 -15.982 1.00 13.10 H new ATOM 0 HG13 ILE A 23 -0.503 -23.854 -16.718 1.00 13.10 H new ATOM 0 HG21 ILE A 23 -2.531 -24.903 -17.614 1.00 73.31 H new ATOM 0 HG22 ILE A 23 -2.820 -26.646 -17.403 1.00 73.31 H new ATOM 0 HG23 ILE A 23 -2.942 -25.548 -16.008 1.00 73.31 H new ATOM 0 HD11 ILE A 23 -0.376 -23.440 -14.310 1.00 74.23 H new ATOM 0 HD12 ILE A 23 -1.933 -24.192 -14.733 1.00 74.23 H new ATOM 0 HD13 ILE A 23 -0.647 -25.169 -13.985 1.00 74.23 H new ATOM 335 N GLU A 24 -2.255 -28.894 -16.424 1.00 71.32 N ATOM 336 CA GLU A 24 -2.639 -30.120 -17.112 1.00 63.12 C ATOM 337 C GLU A 24 -3.808 -29.869 -18.062 1.00 45.22 C ATOM 338 O GLU A 24 -4.590 -28.938 -17.865 1.00 40.33 O ATOM 339 CB GLU A 24 -3.017 -31.203 -16.099 1.00 43.20 C ATOM 340 CG GLU A 24 -4.465 -31.131 -15.642 1.00 24.25 C ATOM 341 CD GLU A 24 -4.664 -31.693 -14.247 1.00 12.10 C ATOM 342 OE1 GLU A 24 -3.668 -32.132 -13.635 1.00 51.31 O ATOM 343 OE2 GLU A 24 -5.818 -31.696 -13.769 1.00 52.34 O ATOM 0 H GLU A 24 -3.019 -28.427 -15.936 1.00 71.32 H new ATOM 0 HA GLU A 24 -1.784 -30.460 -17.696 1.00 63.12 H new ATOM 0 HB2 GLU A 24 -2.833 -32.182 -16.541 1.00 43.20 H new ATOM 0 HB3 GLU A 24 -2.366 -31.118 -15.229 1.00 43.20 H new ATOM 0 HG2 GLU A 24 -4.798 -30.093 -15.663 1.00 24.25 H new ATOM 0 HG3 GLU A 24 -5.092 -31.681 -16.344 1.00 24.25 H new ATOM 350 N GLN A 25 -3.917 -30.702 -19.090 1.00 72.41 N ATOM 351 CA GLN A 25 -4.988 -30.569 -20.071 1.00 70.32 C ATOM 352 C GLN A 25 -6.240 -31.311 -19.614 1.00 34.23 C ATOM 353 O GLN A 25 -6.153 -32.360 -18.976 1.00 3.23 O ATOM 354 CB GLN A 25 -4.532 -31.102 -21.430 1.00 62.23 C ATOM 355 CG GLN A 25 -3.982 -32.519 -21.375 1.00 24.51 C ATOM 356 CD GLN A 25 -2.474 -32.554 -21.220 1.00 33.21 C ATOM 357 OE1 GLN A 25 -1.956 -32.699 -20.112 1.00 64.03 O ATOM 358 NE2 GLN A 25 -1.761 -32.422 -22.332 1.00 41.21 N ATOM 0 H GLN A 25 -3.277 -31.477 -19.266 1.00 72.41 H new ATOM 0 HA GLN A 25 -5.230 -29.511 -20.167 1.00 70.32 H new ATOM 0 HB2 GLN A 25 -5.373 -31.074 -22.123 1.00 62.23 H new ATOM 0 HB3 GLN A 25 -3.766 -30.439 -21.832 1.00 62.23 H new ATOM 0 HG2 GLN A 25 -4.442 -33.051 -20.542 1.00 24.51 H new ATOM 0 HG3 GLN A 25 -4.262 -33.049 -22.285 1.00 24.51 H new ATOM 0 HE21 GLN A 25 -2.232 -32.304 -23.229 1.00 41.21 H new ATOM 0 HE22 GLN A 25 -0.742 -32.439 -22.289 1.00 41.21 H new ATOM 367 N ILE A 26 -7.402 -30.760 -19.945 1.00 31.52 N ATOM 368 CA ILE A 26 -8.671 -31.371 -19.569 1.00 43.51 C ATOM 369 C ILE A 26 -9.535 -31.644 -20.797 1.00 72.10 C ATOM 370 O ILE A 26 -9.173 -31.282 -21.916 1.00 74.50 O ATOM 371 CB ILE A 26 -9.458 -30.478 -18.591 1.00 53.31 C ATOM 372 CG1 ILE A 26 -9.666 -29.086 -19.192 1.00 70.00 C ATOM 373 CG2 ILE A 26 -8.728 -30.381 -17.260 1.00 53.23 C ATOM 374 CD1 ILE A 26 -11.122 -28.730 -19.398 1.00 44.33 C ATOM 0 H ILE A 26 -7.492 -29.892 -20.473 1.00 31.52 H new ATOM 0 HA ILE A 26 -8.433 -32.314 -19.077 1.00 43.51 H new ATOM 0 HB ILE A 26 -10.435 -30.928 -18.417 1.00 53.31 H new ATOM 0 HG12 ILE A 26 -9.208 -28.344 -18.538 1.00 70.00 H new ATOM 0 HG13 ILE A 26 -9.148 -29.031 -20.149 1.00 70.00 H new ATOM 0 HG21 ILE A 26 -9.296 -29.747 -16.579 1.00 53.23 H new ATOM 0 HG22 ILE A 26 -8.625 -31.376 -16.828 1.00 53.23 H new ATOM 0 HG23 ILE A 26 -7.739 -29.950 -17.418 1.00 53.23 H new ATOM 0 HD11 ILE A 26 -11.195 -27.730 -19.827 1.00 44.33 H new ATOM 0 HD12 ILE A 26 -11.580 -29.450 -20.076 1.00 44.33 H new ATOM 0 HD13 ILE A 26 -11.641 -28.753 -18.440 1.00 44.33 H new ATOM 386 N GLY A 27 -10.679 -32.284 -20.577 1.00 34.03 N ATOM 387 CA GLY A 27 -11.578 -32.593 -21.674 1.00 51.40 C ATOM 388 C GLY A 27 -12.872 -31.806 -21.603 1.00 43.34 C ATOM 389 O GLY A 27 -13.278 -31.364 -20.530 1.00 62.43 O ATOM 0 H GLY A 27 -10.999 -32.594 -19.660 1.00 34.03 H new ATOM 0 HA2 GLY A 27 -11.079 -32.381 -22.619 1.00 51.40 H new ATOM 0 HA3 GLY A 27 -11.804 -33.659 -21.665 1.00 51.40 H new ATOM 393 N ASP A 28 -13.519 -31.631 -22.750 1.00 72.03 N ATOM 394 CA ASP A 28 -14.775 -30.893 -22.814 1.00 72.25 C ATOM 395 C ASP A 28 -15.811 -31.498 -21.871 1.00 30.43 C ATOM 396 O ASP A 28 -16.576 -30.779 -21.230 1.00 45.30 O ATOM 397 CB ASP A 28 -15.314 -30.883 -24.245 1.00 20.12 C ATOM 398 CG ASP A 28 -15.636 -32.275 -24.751 1.00 62.32 C ATOM 399 OD1 ASP A 28 -16.750 -32.764 -24.471 1.00 15.13 O ATOM 400 OD2 ASP A 28 -14.774 -32.876 -25.427 1.00 61.43 O ATOM 0 H ASP A 28 -13.195 -31.990 -23.648 1.00 72.03 H new ATOM 0 HA ASP A 28 -14.580 -29.867 -22.500 1.00 72.25 H new ATOM 0 HB2 ASP A 28 -16.212 -30.267 -24.288 1.00 20.12 H new ATOM 0 HB3 ASP A 28 -14.579 -30.421 -24.904 1.00 20.12 H new ATOM 405 N SER A 29 -15.829 -32.825 -21.794 1.00 34.14 N ATOM 406 CA SER A 29 -16.774 -33.527 -20.934 1.00 40.21 C ATOM 407 C SER A 29 -16.295 -33.525 -19.485 1.00 24.42 C ATOM 408 O SER A 29 -17.090 -33.675 -18.558 1.00 3.01 O ATOM 409 CB SER A 29 -16.963 -34.967 -21.417 1.00 63.34 C ATOM 410 OG SER A 29 -17.927 -35.033 -22.454 1.00 42.24 O ATOM 0 H SER A 29 -15.200 -33.435 -22.316 1.00 34.14 H new ATOM 0 HA SER A 29 -17.730 -33.005 -20.984 1.00 40.21 H new ATOM 0 HB2 SER A 29 -16.012 -35.362 -21.774 1.00 63.34 H new ATOM 0 HB3 SER A 29 -17.277 -35.596 -20.584 1.00 63.34 H new ATOM 0 HG SER A 29 -17.709 -34.374 -23.146 1.00 42.24 H new ATOM 416 N GLU A 30 -14.990 -33.351 -19.299 1.00 3.41 N ATOM 417 CA GLU A 30 -14.405 -33.329 -17.964 1.00 21.44 C ATOM 418 C GLU A 30 -14.421 -31.917 -17.385 1.00 70.14 C ATOM 419 O GLU A 30 -14.165 -31.717 -16.199 1.00 61.05 O ATOM 420 CB GLU A 30 -12.971 -33.860 -18.002 1.00 71.22 C ATOM 421 CG GLU A 30 -12.766 -34.987 -19.000 1.00 52.14 C ATOM 422 CD GLU A 30 -13.857 -36.037 -18.927 1.00 63.22 C ATOM 423 OE1 GLU A 30 -13.876 -36.806 -17.943 1.00 33.44 O ATOM 424 OE2 GLU A 30 -14.692 -36.089 -19.854 1.00 62.15 O ATOM 0 H GLU A 30 -14.318 -33.223 -20.056 1.00 3.41 H new ATOM 0 HA GLU A 30 -15.006 -33.973 -17.322 1.00 21.44 H new ATOM 0 HB2 GLU A 30 -12.295 -33.041 -18.248 1.00 71.22 H new ATOM 0 HB3 GLU A 30 -12.696 -34.212 -17.008 1.00 71.22 H new ATOM 0 HG2 GLU A 30 -12.732 -34.573 -20.008 1.00 52.14 H new ATOM 0 HG3 GLU A 30 -11.800 -35.458 -18.817 1.00 52.14 H new ATOM 431 N PHE A 31 -14.723 -30.940 -18.235 1.00 51.15 N ATOM 432 CA PHE A 31 -14.772 -29.545 -17.809 1.00 15.33 C ATOM 433 C PHE A 31 -15.538 -29.403 -16.499 1.00 52.25 C ATOM 434 O PHE A 31 -14.949 -29.156 -15.446 1.00 53.02 O ATOM 435 CB PHE A 31 -15.425 -28.683 -18.892 1.00 75.15 C ATOM 436 CG PHE A 31 -15.804 -27.310 -18.416 1.00 65.24 C ATOM 437 CD1 PHE A 31 -14.828 -26.385 -18.079 1.00 33.35 C ATOM 438 CD2 PHE A 31 -17.136 -26.944 -18.307 1.00 72.53 C ATOM 439 CE1 PHE A 31 -15.175 -25.122 -17.639 1.00 31.30 C ATOM 440 CE2 PHE A 31 -17.488 -25.681 -17.869 1.00 51.23 C ATOM 441 CZ PHE A 31 -16.506 -24.768 -17.536 1.00 13.43 C ATOM 0 H PHE A 31 -14.937 -31.088 -19.221 1.00 51.15 H new ATOM 0 HA PHE A 31 -13.749 -29.203 -17.649 1.00 15.33 H new ATOM 0 HB2 PHE A 31 -14.739 -28.591 -19.734 1.00 75.15 H new ATOM 0 HB3 PHE A 31 -16.317 -29.190 -19.261 1.00 75.15 H new ATOM 0 HD1 PHE A 31 -13.785 -26.654 -18.161 1.00 33.35 H new ATOM 0 HD2 PHE A 31 -17.908 -27.653 -18.567 1.00 72.53 H new ATOM 0 HE1 PHE A 31 -14.405 -24.412 -17.376 1.00 31.30 H new ATOM 0 HE2 PHE A 31 -18.530 -25.408 -17.787 1.00 51.23 H new ATOM 0 HZ PHE A 31 -16.779 -23.780 -17.196 1.00 13.43 H new ATOM 451 N ASP A 32 -16.856 -29.560 -16.570 1.00 14.24 N ATOM 452 CA ASP A 32 -17.705 -29.451 -15.389 1.00 72.32 C ATOM 453 C ASP A 32 -17.435 -30.594 -14.417 1.00 72.42 C ATOM 454 O ASP A 32 -17.674 -30.472 -13.216 1.00 33.44 O ATOM 455 CB ASP A 32 -19.179 -29.446 -15.794 1.00 63.01 C ATOM 456 CG ASP A 32 -19.529 -30.590 -16.724 1.00 24.01 C ATOM 457 OD1 ASP A 32 -19.310 -30.451 -17.945 1.00 50.53 O ATOM 458 OD2 ASP A 32 -20.020 -31.628 -16.230 1.00 24.23 O ATOM 0 H ASP A 32 -17.359 -29.763 -17.433 1.00 14.24 H new ATOM 0 HA ASP A 32 -17.470 -28.511 -14.889 1.00 72.32 H new ATOM 0 HB2 ASP A 32 -19.799 -29.507 -14.899 1.00 63.01 H new ATOM 0 HB3 ASP A 32 -19.415 -28.500 -16.282 1.00 63.01 H new ATOM 463 N ASN A 33 -16.935 -31.707 -14.945 1.00 0.41 N ATOM 464 CA ASN A 33 -16.634 -32.874 -14.123 1.00 71.43 C ATOM 465 C ASN A 33 -15.680 -32.511 -12.990 1.00 5.31 C ATOM 466 O ASN A 33 -15.755 -33.070 -11.896 1.00 42.22 O ATOM 467 CB ASN A 33 -16.025 -33.985 -14.983 1.00 3.30 C ATOM 468 CG ASN A 33 -16.296 -35.367 -14.418 1.00 61.22 C ATOM 469 OD1 ASN A 33 -15.719 -35.759 -13.405 1.00 43.52 O ATOM 470 ND2 ASN A 33 -17.178 -36.111 -15.076 1.00 2.02 N ATOM 0 H ASN A 33 -16.730 -31.825 -15.937 1.00 0.41 H new ATOM 0 HA ASN A 33 -17.567 -33.231 -13.687 1.00 71.43 H new ATOM 0 HB2 ASN A 33 -16.430 -33.922 -15.993 1.00 3.30 H new ATOM 0 HB3 ASN A 33 -14.949 -33.832 -15.061 1.00 3.30 H new ATOM 0 HD21 ASN A 33 -17.401 -37.050 -14.745 1.00 2.02 H new ATOM 0 HD22 ASN A 33 -17.632 -35.744 -15.912 1.00 2.02 H new ATOM 477 N LYS A 34 -14.781 -31.570 -13.260 1.00 61.14 N ATOM 478 CA LYS A 34 -13.812 -31.129 -12.264 1.00 61.34 C ATOM 479 C LYS A 34 -14.038 -29.666 -11.896 1.00 34.21 C ATOM 480 O LYS A 34 -13.530 -29.185 -10.882 1.00 0.52 O ATOM 481 CB LYS A 34 -12.387 -31.319 -12.791 1.00 4.45 C ATOM 482 CG LYS A 34 -12.144 -30.663 -14.138 1.00 54.12 C ATOM 483 CD LYS A 34 -11.527 -31.636 -15.129 1.00 72.43 C ATOM 484 CE LYS A 34 -10.069 -31.919 -14.799 1.00 73.13 C ATOM 485 NZ LYS A 34 -9.932 -32.956 -13.738 1.00 34.51 N ATOM 0 H LYS A 34 -14.704 -31.098 -14.161 1.00 61.14 H new ATOM 0 HA LYS A 34 -13.946 -31.736 -11.368 1.00 61.34 H new ATOM 0 HB2 LYS A 34 -11.683 -30.911 -12.066 1.00 4.45 H new ATOM 0 HB3 LYS A 34 -12.178 -32.386 -12.873 1.00 4.45 H new ATOM 0 HG2 LYS A 34 -13.086 -30.286 -14.535 1.00 54.12 H new ATOM 0 HG3 LYS A 34 -11.485 -29.804 -14.012 1.00 54.12 H new ATOM 0 HD2 LYS A 34 -12.090 -32.569 -15.123 1.00 72.43 H new ATOM 0 HD3 LYS A 34 -11.600 -31.226 -16.136 1.00 72.43 H new ATOM 0 HE2 LYS A 34 -9.550 -32.249 -15.699 1.00 73.13 H new ATOM 0 HE3 LYS A 34 -9.585 -30.999 -14.472 1.00 73.13 H new ATOM 0 HZ1 LYS A 34 -9.029 -33.458 -13.858 1.00 34.51 H new ATOM 0 HZ2 LYS A 34 -9.954 -32.501 -12.803 1.00 34.51 H new ATOM 0 HZ3 LYS A 34 -10.717 -33.634 -13.812 1.00 34.51 H new ATOM 499 N VAL A 35 -14.804 -28.963 -12.724 1.00 34.33 N ATOM 500 CA VAL A 35 -15.099 -27.555 -12.483 1.00 51.44 C ATOM 501 C VAL A 35 -16.338 -27.396 -11.610 1.00 12.33 C ATOM 502 O VAL A 35 -16.295 -26.746 -10.565 1.00 34.24 O ATOM 503 CB VAL A 35 -15.314 -26.794 -13.805 1.00 22.45 C ATOM 504 CG1 VAL A 35 -15.965 -25.444 -13.543 1.00 52.31 C ATOM 505 CG2 VAL A 35 -13.995 -26.626 -14.544 1.00 15.43 C ATOM 0 H VAL A 35 -15.232 -29.345 -13.568 1.00 34.33 H new ATOM 0 HA VAL A 35 -14.237 -27.134 -11.966 1.00 51.44 H new ATOM 0 HB VAL A 35 -15.984 -27.378 -14.436 1.00 22.45 H new ATOM 0 HG11 VAL A 35 -16.109 -24.920 -14.488 1.00 52.31 H new ATOM 0 HG12 VAL A 35 -16.931 -25.593 -13.060 1.00 52.31 H new ATOM 0 HG13 VAL A 35 -15.322 -24.850 -12.893 1.00 52.31 H new ATOM 0 HG21 VAL A 35 -14.166 -26.086 -15.475 1.00 15.43 H new ATOM 0 HG22 VAL A 35 -13.298 -26.064 -13.922 1.00 15.43 H new ATOM 0 HG23 VAL A 35 -13.574 -27.607 -14.765 1.00 15.43 H new ATOM 515 N THR A 36 -17.443 -27.994 -12.044 1.00 23.22 N ATOM 516 CA THR A 36 -18.696 -27.917 -11.302 1.00 25.31 C ATOM 517 C THR A 36 -18.553 -28.540 -9.918 1.00 21.25 C ATOM 518 O THR A 36 -19.341 -28.258 -9.015 1.00 61.41 O ATOM 519 CB THR A 36 -19.839 -28.623 -12.056 1.00 24.40 C ATOM 520 OG1 THR A 36 -21.069 -27.922 -11.847 1.00 52.21 O ATOM 521 CG2 THR A 36 -19.985 -30.064 -11.589 1.00 14.11 C ATOM 0 H THR A 36 -17.496 -28.537 -12.906 1.00 23.22 H new ATOM 0 HA THR A 36 -18.939 -26.859 -11.198 1.00 25.31 H new ATOM 0 HB THR A 36 -19.598 -28.624 -13.119 1.00 24.40 H new ATOM 0 HG1 THR A 36 -21.790 -28.376 -12.331 1.00 52.21 H new ATOM 0 HG21 THR A 36 -20.798 -30.543 -12.135 1.00 14.11 H new ATOM 0 HG22 THR A 36 -19.056 -30.603 -11.775 1.00 14.11 H new ATOM 0 HG23 THR A 36 -20.206 -30.080 -10.522 1.00 14.11 H new ATOM 529 N SER A 37 -17.543 -29.390 -9.758 1.00 14.22 N ATOM 530 CA SER A 37 -17.301 -30.057 -8.484 1.00 52.32 C ATOM 531 C SER A 37 -16.545 -29.139 -7.527 1.00 53.20 C ATOM 532 O SER A 37 -16.628 -29.293 -6.308 1.00 32.53 O ATOM 533 CB SER A 37 -16.510 -31.348 -8.702 1.00 12.31 C ATOM 534 OG SER A 37 -16.390 -32.083 -7.497 1.00 23.30 O ATOM 0 H SER A 37 -16.880 -29.633 -10.494 1.00 14.22 H new ATOM 0 HA SER A 37 -18.266 -30.302 -8.040 1.00 52.32 H new ATOM 0 HB2 SER A 37 -17.006 -31.959 -9.456 1.00 12.31 H new ATOM 0 HB3 SER A 37 -15.518 -31.110 -9.086 1.00 12.31 H new ATOM 0 HG SER A 37 -15.882 -32.904 -7.664 1.00 23.30 H new ATOM 540 N CYS A 38 -15.808 -28.187 -8.089 1.00 31.15 N ATOM 541 CA CYS A 38 -15.037 -27.245 -7.286 1.00 55.44 C ATOM 542 C CYS A 38 -15.949 -26.437 -6.368 1.00 24.01 C ATOM 543 O CYS A 38 -16.531 -25.435 -6.780 1.00 1.31 O ATOM 544 CB CYS A 38 -14.242 -26.303 -8.192 1.00 50.43 C ATOM 545 SG CYS A 38 -12.690 -25.719 -7.471 1.00 51.34 S ATOM 0 H CYS A 38 -15.728 -28.047 -9.096 1.00 31.15 H new ATOM 0 HA CYS A 38 -14.344 -27.816 -6.668 1.00 55.44 H new ATOM 0 HB2 CYS A 38 -14.024 -26.815 -9.129 1.00 50.43 H new ATOM 0 HB3 CYS A 38 -14.863 -25.441 -8.437 1.00 50.43 H new ATOM 0 HG CYS A 38 -11.751 -25.761 -8.369 1.00 51.34 H new ATOM 551 N ASN A 39 -16.070 -26.883 -5.121 1.00 43.53 N ATOM 552 CA ASN A 39 -16.914 -26.203 -4.145 1.00 34.53 C ATOM 553 C ASN A 39 -16.068 -25.399 -3.162 1.00 40.14 C ATOM 554 O ASN A 39 -16.552 -24.978 -2.111 1.00 34.52 O ATOM 555 CB ASN A 39 -17.771 -27.218 -3.387 1.00 62.21 C ATOM 556 CG ASN A 39 -18.870 -26.556 -2.578 1.00 2.12 C ATOM 557 OD1 ASN A 39 -18.728 -26.346 -1.373 1.00 62.30 O ATOM 558 ND2 ASN A 39 -19.973 -26.225 -3.239 1.00 54.11 N ATOM 0 H ASN A 39 -15.595 -27.712 -4.763 1.00 43.53 H new ATOM 0 HA ASN A 39 -17.567 -25.515 -4.682 1.00 34.53 H new ATOM 0 HB2 ASN A 39 -18.216 -27.916 -4.096 1.00 62.21 H new ATOM 0 HB3 ASN A 39 -17.135 -27.802 -2.722 1.00 62.21 H new ATOM 0 HD21 ASN A 39 -20.747 -25.777 -2.748 1.00 54.11 H new ATOM 0 HD22 ASN A 39 -20.046 -26.418 -4.238 1.00 54.11 H new ATOM 565 N ASP A 40 -14.804 -25.189 -3.513 1.00 45.34 N ATOM 566 CA ASP A 40 -13.892 -24.432 -2.662 1.00 20.02 C ATOM 567 C ASP A 40 -13.884 -22.957 -3.050 1.00 50.34 C ATOM 568 O ASP A 40 -12.989 -22.208 -2.662 1.00 73.13 O ATOM 569 CB ASP A 40 -12.477 -25.006 -2.760 1.00 44.11 C ATOM 570 CG ASP A 40 -12.239 -26.132 -1.774 1.00 41.31 C ATOM 571 OD1 ASP A 40 -12.533 -27.295 -2.119 1.00 0.11 O ATOM 572 OD2 ASP A 40 -11.759 -25.851 -0.656 1.00 41.24 O ATOM 0 H ASP A 40 -14.388 -25.531 -4.379 1.00 45.34 H new ATOM 0 HA ASP A 40 -14.240 -24.516 -1.632 1.00 20.02 H new ATOM 0 HB2 ASP A 40 -12.306 -25.372 -3.773 1.00 44.11 H new ATOM 0 HB3 ASP A 40 -11.753 -24.211 -2.581 1.00 44.11 H new ATOM 577 N ASN A 41 -14.887 -22.547 -3.819 1.00 64.15 N ATOM 578 CA ASN A 41 -14.995 -21.161 -4.261 1.00 33.45 C ATOM 579 C ASN A 41 -13.696 -20.695 -4.911 1.00 33.24 C ATOM 580 O ASN A 41 -13.320 -19.527 -4.805 1.00 50.23 O ATOM 581 CB ASN A 41 -15.340 -20.253 -3.079 1.00 65.20 C ATOM 582 CG ASN A 41 -16.815 -20.299 -2.727 1.00 23.13 C ATOM 583 OD1 ASN A 41 -17.183 -20.507 -1.571 1.00 25.31 O ATOM 584 ND2 ASN A 41 -17.668 -20.103 -3.726 1.00 63.34 N ATOM 0 H ASN A 41 -15.637 -23.155 -4.149 1.00 64.15 H new ATOM 0 HA ASN A 41 -15.793 -21.103 -5.001 1.00 33.45 H new ATOM 0 HB2 ASN A 41 -14.752 -20.552 -2.211 1.00 65.20 H new ATOM 0 HB3 ASN A 41 -15.058 -19.228 -3.317 1.00 65.20 H new ATOM 0 HD21 ASN A 41 -18.673 -20.121 -3.550 1.00 63.34 H new ATOM 0 HD22 ASN A 41 -17.319 -19.934 -4.669 1.00 63.34 H new ATOM 591 N ILE A 42 -13.016 -21.617 -5.586 1.00 30.15 N ATOM 592 CA ILE A 42 -11.760 -21.299 -6.256 1.00 31.32 C ATOM 593 C ILE A 42 -11.979 -21.044 -7.743 1.00 41.34 C ATOM 594 O ILE A 42 -12.741 -21.756 -8.400 1.00 12.51 O ATOM 595 CB ILE A 42 -10.730 -22.432 -6.087 1.00 40.33 C ATOM 596 CG1 ILE A 42 -10.575 -22.793 -4.608 1.00 31.15 C ATOM 597 CG2 ILE A 42 -9.391 -22.024 -6.682 1.00 3.31 C ATOM 598 CD1 ILE A 42 -9.610 -23.932 -4.363 1.00 74.15 C ATOM 0 H ILE A 42 -13.313 -22.588 -5.683 1.00 30.15 H new ATOM 0 HA ILE A 42 -11.373 -20.394 -5.788 1.00 31.32 H new ATOM 0 HB ILE A 42 -11.089 -23.312 -6.621 1.00 40.33 H new ATOM 0 HG12 ILE A 42 -10.233 -21.914 -4.061 1.00 31.15 H new ATOM 0 HG13 ILE A 42 -11.551 -23.061 -4.203 1.00 31.15 H new ATOM 0 HG21 ILE A 42 -8.674 -22.835 -6.555 1.00 3.31 H new ATOM 0 HG22 ILE A 42 -9.514 -21.812 -7.744 1.00 3.31 H new ATOM 0 HG23 ILE A 42 -9.024 -21.132 -6.174 1.00 3.31 H new ATOM 0 HD11 ILE A 42 -9.549 -24.134 -3.294 1.00 74.15 H new ATOM 0 HD12 ILE A 42 -9.961 -24.824 -4.881 1.00 74.15 H new ATOM 0 HD13 ILE A 42 -8.623 -23.660 -4.737 1.00 74.15 H new ATOM 610 N LEU A 43 -11.307 -20.026 -8.268 1.00 40.54 N ATOM 611 CA LEU A 43 -11.426 -19.678 -9.679 1.00 63.50 C ATOM 612 C LEU A 43 -10.426 -20.465 -10.522 1.00 24.21 C ATOM 613 O LEU A 43 -9.217 -20.381 -10.308 1.00 62.32 O ATOM 614 CB LEU A 43 -11.203 -18.177 -9.876 1.00 50.44 C ATOM 615 CG LEU A 43 -9.985 -17.582 -9.170 1.00 62.42 C ATOM 616 CD1 LEU A 43 -9.271 -16.593 -10.079 1.00 51.24 C ATOM 617 CD2 LEU A 43 -10.397 -16.911 -7.868 1.00 42.21 C ATOM 0 H LEU A 43 -10.674 -19.427 -7.738 1.00 40.54 H new ATOM 0 HA LEU A 43 -12.433 -19.937 -10.006 1.00 63.50 H new ATOM 0 HB2 LEU A 43 -11.111 -17.981 -10.944 1.00 50.44 H new ATOM 0 HB3 LEU A 43 -12.092 -17.649 -9.531 1.00 50.44 H new ATOM 0 HG LEU A 43 -9.294 -18.392 -8.935 1.00 62.42 H new ATOM 0 HD11 LEU A 43 -8.407 -16.180 -9.559 1.00 51.24 H new ATOM 0 HD12 LEU A 43 -8.941 -17.103 -10.984 1.00 51.24 H new ATOM 0 HD13 LEU A 43 -9.954 -15.786 -10.346 1.00 51.24 H new ATOM 0 HD21 LEU A 43 -9.517 -16.493 -7.379 1.00 42.21 H new ATOM 0 HD22 LEU A 43 -11.108 -16.112 -8.079 1.00 42.21 H new ATOM 0 HD23 LEU A 43 -10.862 -17.646 -7.211 1.00 42.21 H new ATOM 629 N ILE A 44 -10.940 -21.230 -11.480 1.00 21.31 N ATOM 630 CA ILE A 44 -10.093 -22.030 -12.355 1.00 65.53 C ATOM 631 C ILE A 44 -9.776 -21.282 -13.646 1.00 4.02 C ATOM 632 O ILE A 44 -10.678 -20.892 -14.388 1.00 24.12 O ATOM 633 CB ILE A 44 -10.756 -23.376 -12.704 1.00 53.24 C ATOM 634 CG1 ILE A 44 -11.015 -24.186 -11.433 1.00 74.33 C ATOM 635 CG2 ILE A 44 -9.881 -24.162 -13.669 1.00 30.21 C ATOM 636 CD1 ILE A 44 -12.362 -23.905 -10.802 1.00 1.45 C ATOM 0 H ILE A 44 -11.939 -21.312 -11.669 1.00 21.31 H new ATOM 0 HA ILE A 44 -9.168 -22.221 -11.811 1.00 65.53 H new ATOM 0 HB ILE A 44 -11.712 -23.179 -13.188 1.00 53.24 H new ATOM 0 HG12 ILE A 44 -10.947 -25.248 -11.668 1.00 74.33 H new ATOM 0 HG13 ILE A 44 -10.231 -23.970 -10.708 1.00 74.33 H new ATOM 0 HG21 ILE A 44 -10.362 -25.111 -13.906 1.00 30.21 H new ATOM 0 HG22 ILE A 44 -9.741 -23.587 -14.584 1.00 30.21 H new ATOM 0 HG23 ILE A 44 -8.912 -24.352 -13.209 1.00 30.21 H new ATOM 0 HD11 ILE A 44 -12.478 -24.514 -9.905 1.00 1.45 H new ATOM 0 HD12 ILE A 44 -12.426 -22.850 -10.535 1.00 1.45 H new ATOM 0 HD13 ILE A 44 -13.154 -24.148 -11.511 1.00 1.45 H new ATOM 648 N LEU A 45 -8.489 -21.087 -13.909 1.00 43.35 N ATOM 649 CA LEU A 45 -8.051 -20.388 -15.112 1.00 3.23 C ATOM 650 C LEU A 45 -7.786 -21.371 -16.247 1.00 11.21 C ATOM 651 O LEU A 45 -6.744 -22.026 -16.286 1.00 74.13 O ATOM 652 CB LEU A 45 -6.788 -19.574 -14.821 1.00 44.40 C ATOM 653 CG LEU A 45 -7.010 -18.146 -14.322 1.00 62.25 C ATOM 654 CD1 LEU A 45 -7.210 -17.195 -15.491 1.00 40.02 C ATOM 655 CD2 LEU A 45 -8.203 -18.092 -13.378 1.00 41.32 C ATOM 0 H LEU A 45 -7.730 -21.403 -13.305 1.00 43.35 H new ATOM 0 HA LEU A 45 -8.849 -19.712 -15.421 1.00 3.23 H new ATOM 0 HB2 LEU A 45 -6.198 -20.110 -14.077 1.00 44.40 H new ATOM 0 HB3 LEU A 45 -6.190 -19.531 -15.731 1.00 44.40 H new ATOM 0 HG LEU A 45 -6.122 -17.831 -13.774 1.00 62.25 H new ATOM 0 HD11 LEU A 45 -7.366 -16.184 -15.115 1.00 40.02 H new ATOM 0 HD12 LEU A 45 -6.327 -17.212 -16.129 1.00 40.02 H new ATOM 0 HD13 LEU A 45 -8.081 -17.506 -16.068 1.00 40.02 H new ATOM 0 HD21 LEU A 45 -8.347 -17.068 -13.032 1.00 41.32 H new ATOM 0 HD22 LEU A 45 -9.098 -18.427 -13.903 1.00 41.32 H new ATOM 0 HD23 LEU A 45 -8.020 -18.742 -12.522 1.00 41.32 H new ATOM 667 N VAL A 46 -8.735 -21.469 -17.173 1.00 2.42 N ATOM 668 CA VAL A 46 -8.603 -22.370 -18.312 1.00 64.44 C ATOM 669 C VAL A 46 -8.125 -21.622 -19.551 1.00 14.45 C ATOM 670 O VAL A 46 -8.808 -20.728 -20.051 1.00 14.22 O ATOM 671 CB VAL A 46 -9.938 -23.070 -18.631 1.00 13.24 C ATOM 672 CG1 VAL A 46 -9.798 -23.947 -19.865 1.00 34.10 C ATOM 673 CG2 VAL A 46 -10.410 -23.885 -17.437 1.00 71.13 C ATOM 0 H VAL A 46 -9.604 -20.935 -17.157 1.00 2.42 H new ATOM 0 HA VAL A 46 -7.863 -23.122 -18.037 1.00 64.44 H new ATOM 0 HB VAL A 46 -10.688 -22.308 -18.840 1.00 13.24 H new ATOM 0 HG11 VAL A 46 -10.750 -24.434 -20.075 1.00 34.10 H new ATOM 0 HG12 VAL A 46 -9.508 -23.332 -20.717 1.00 34.10 H new ATOM 0 HG13 VAL A 46 -9.035 -24.705 -19.688 1.00 34.10 H new ATOM 0 HG21 VAL A 46 -11.354 -24.373 -17.680 1.00 71.13 H new ATOM 0 HG22 VAL A 46 -9.663 -24.641 -17.194 1.00 71.13 H new ATOM 0 HG23 VAL A 46 -10.552 -23.226 -16.580 1.00 71.13 H new ATOM 683 N ASP A 47 -6.948 -21.995 -20.042 1.00 71.33 N ATOM 684 CA ASP A 47 -6.378 -21.360 -21.225 1.00 75.44 C ATOM 685 C ASP A 47 -6.324 -22.339 -22.393 1.00 44.42 C ATOM 686 O ASP A 47 -5.458 -23.214 -22.444 1.00 2.15 O ATOM 687 CB ASP A 47 -4.975 -20.832 -20.920 1.00 2.13 C ATOM 688 CG ASP A 47 -4.485 -19.851 -21.967 1.00 51.30 C ATOM 689 OD1 ASP A 47 -5.126 -19.756 -23.035 1.00 25.30 O ATOM 690 OD2 ASP A 47 -3.463 -19.179 -21.719 1.00 35.11 O ATOM 0 H ASP A 47 -6.370 -22.733 -19.640 1.00 71.33 H new ATOM 0 HA ASP A 47 -7.019 -20.524 -21.504 1.00 75.44 H new ATOM 0 HB2 ASP A 47 -4.977 -20.346 -19.944 1.00 2.13 H new ATOM 0 HB3 ASP A 47 -4.280 -21.670 -20.858 1.00 2.13 H new ATOM 695 N PHE A 48 -7.253 -22.187 -23.330 1.00 52.31 N ATOM 696 CA PHE A 48 -7.312 -23.059 -24.498 1.00 61.22 C ATOM 697 C PHE A 48 -6.000 -23.017 -25.274 1.00 3.21 C ATOM 698 O PHE A 48 -5.493 -21.943 -25.601 1.00 44.32 O ATOM 699 CB PHE A 48 -8.471 -22.649 -25.408 1.00 14.53 C ATOM 700 CG PHE A 48 -8.528 -23.426 -26.692 1.00 12.12 C ATOM 701 CD1 PHE A 48 -8.324 -24.797 -26.697 1.00 11.40 C ATOM 702 CD2 PHE A 48 -8.785 -22.787 -27.895 1.00 52.21 C ATOM 703 CE1 PHE A 48 -8.376 -25.514 -27.878 1.00 0.41 C ATOM 704 CE2 PHE A 48 -8.838 -23.498 -29.078 1.00 54.22 C ATOM 705 CZ PHE A 48 -8.633 -24.864 -29.069 1.00 2.15 C ATOM 0 H PHE A 48 -7.976 -21.468 -23.304 1.00 52.31 H new ATOM 0 HA PHE A 48 -7.475 -24.080 -24.152 1.00 61.22 H new ATOM 0 HB2 PHE A 48 -9.410 -22.782 -24.870 1.00 14.53 H new ATOM 0 HB3 PHE A 48 -8.384 -21.587 -25.639 1.00 14.53 H new ATOM 0 HD1 PHE A 48 -8.122 -25.311 -25.769 1.00 11.40 H new ATOM 0 HD2 PHE A 48 -8.946 -21.719 -27.907 1.00 52.21 H new ATOM 0 HE1 PHE A 48 -8.216 -26.582 -27.869 1.00 0.41 H new ATOM 0 HE2 PHE A 48 -9.039 -22.987 -30.008 1.00 54.22 H new ATOM 0 HZ PHE A 48 -8.674 -25.423 -29.992 1.00 2.15 H new ATOM 884 N GLU A 60 3.413 -18.042 -21.443 1.00 12.25 N ATOM 885 CA GLU A 60 2.978 -17.189 -20.342 1.00 32.45 C ATOM 886 C GLU A 60 3.060 -17.935 -19.013 1.00 55.42 C ATOM 887 O GLU A 60 2.050 -18.327 -18.429 1.00 62.12 O ATOM 888 CB GLU A 60 1.548 -16.702 -20.580 1.00 30.34 C ATOM 889 CG GLU A 60 1.294 -16.227 -22.000 1.00 32.33 C ATOM 890 CD GLU A 60 2.438 -15.399 -22.552 1.00 23.13 C ATOM 891 OE1 GLU A 60 3.062 -14.652 -21.769 1.00 50.14 O ATOM 892 OE2 GLU A 60 2.709 -15.497 -23.767 1.00 35.42 O ATOM 0 HA GLU A 60 3.644 -16.327 -20.297 1.00 32.45 H new ATOM 0 HB2 GLU A 60 0.855 -17.510 -20.347 1.00 30.34 H new ATOM 0 HB3 GLU A 60 1.331 -15.887 -19.889 1.00 30.34 H new ATOM 0 HG2 GLU A 60 1.132 -17.091 -22.644 1.00 32.33 H new ATOM 0 HG3 GLU A 60 0.379 -15.636 -22.023 1.00 32.33 H new ATOM 899 N PRO A 61 4.292 -18.136 -18.523 1.00 14.41 N ATOM 900 CA PRO A 61 4.536 -18.834 -17.257 1.00 50.20 C ATOM 901 C PRO A 61 4.081 -18.022 -16.049 1.00 41.53 C ATOM 902 O PRO A 61 3.964 -18.550 -14.944 1.00 22.32 O ATOM 903 CB PRO A 61 6.056 -19.014 -17.238 1.00 62.02 C ATOM 904 CG PRO A 61 6.578 -17.914 -18.097 1.00 1.52 C ATOM 905 CD PRO A 61 5.542 -17.695 -19.164 1.00 3.21 C ATOM 0 HA PRO A 61 3.981 -19.770 -17.195 1.00 50.20 H new ATOM 0 HB2 PRO A 61 6.450 -18.946 -16.224 1.00 62.02 H new ATOM 0 HB3 PRO A 61 6.344 -19.991 -17.627 1.00 62.02 H new ATOM 0 HG2 PRO A 61 6.737 -17.006 -17.515 1.00 1.52 H new ATOM 0 HG3 PRO A 61 7.539 -18.184 -18.535 1.00 1.52 H new ATOM 0 HD2 PRO A 61 5.491 -16.649 -19.466 1.00 3.21 H new ATOM 0 HD3 PRO A 61 5.760 -18.275 -20.061 1.00 3.21 H new ATOM 913 N GLN A 62 3.825 -16.737 -16.269 1.00 11.15 N ATOM 914 CA GLN A 62 3.382 -15.852 -15.197 1.00 4.33 C ATOM 915 C GLN A 62 2.136 -16.404 -14.516 1.00 54.12 C ATOM 916 O GLN A 62 1.968 -16.273 -13.303 1.00 64.54 O ATOM 917 CB GLN A 62 3.101 -14.452 -15.746 1.00 70.43 C ATOM 918 CG GLN A 62 4.279 -13.843 -16.491 1.00 42.43 C ATOM 919 CD GLN A 62 3.858 -12.742 -17.445 1.00 2.22 C ATOM 920 OE1 GLN A 62 4.397 -11.636 -17.409 1.00 72.41 O ATOM 921 NE2 GLN A 62 2.892 -13.041 -18.305 1.00 53.33 N ATOM 0 H GLN A 62 3.916 -16.285 -17.179 1.00 11.15 H new ATOM 0 HA GLN A 62 4.180 -15.790 -14.457 1.00 4.33 H new ATOM 0 HB2 GLN A 62 2.243 -14.499 -16.416 1.00 70.43 H new ATOM 0 HB3 GLN A 62 2.825 -13.796 -14.921 1.00 70.43 H new ATOM 0 HG2 GLN A 62 4.992 -13.442 -15.771 1.00 42.43 H new ATOM 0 HG3 GLN A 62 4.795 -14.625 -17.049 1.00 42.43 H new ATOM 0 HE21 GLN A 62 2.474 -13.971 -18.299 1.00 53.33 H new ATOM 0 HE22 GLN A 62 2.568 -12.340 -18.972 1.00 53.33 H new ATOM 930 N LEU A 63 1.261 -17.022 -15.303 1.00 3.30 N ATOM 931 CA LEU A 63 0.027 -17.595 -14.776 1.00 51.52 C ATOM 932 C LEU A 63 0.326 -18.643 -13.710 1.00 11.10 C ATOM 933 O LEU A 63 -0.250 -18.617 -12.622 1.00 50.22 O ATOM 934 CB LEU A 63 -0.792 -18.219 -15.907 1.00 63.14 C ATOM 935 CG LEU A 63 -1.287 -17.257 -16.988 1.00 4.31 C ATOM 936 CD1 LEU A 63 -2.033 -18.015 -18.074 1.00 33.34 C ATOM 937 CD2 LEU A 63 -2.175 -16.182 -16.377 1.00 44.21 C ATOM 0 H LEU A 63 1.384 -17.139 -16.309 1.00 3.30 H new ATOM 0 HA LEU A 63 -0.551 -16.793 -14.318 1.00 51.52 H new ATOM 0 HB2 LEU A 63 -0.187 -18.990 -16.384 1.00 63.14 H new ATOM 0 HB3 LEU A 63 -1.657 -18.718 -15.470 1.00 63.14 H new ATOM 0 HG LEU A 63 -0.423 -16.772 -17.441 1.00 4.31 H new ATOM 0 HD11 LEU A 63 -2.378 -17.315 -18.835 1.00 33.34 H new ATOM 0 HD12 LEU A 63 -1.367 -18.747 -18.530 1.00 33.34 H new ATOM 0 HD13 LEU A 63 -2.890 -18.527 -17.637 1.00 33.34 H new ATOM 0 HD21 LEU A 63 -2.519 -15.506 -17.160 1.00 44.21 H new ATOM 0 HD22 LEU A 63 -3.035 -16.650 -15.898 1.00 44.21 H new ATOM 0 HD23 LEU A 63 -1.608 -15.620 -15.635 1.00 44.21 H new ATOM 949 N GLU A 64 1.232 -19.564 -14.029 1.00 45.21 N ATOM 950 CA GLU A 64 1.606 -20.620 -13.096 1.00 2.31 C ATOM 951 C GLU A 64 2.342 -20.044 -11.890 1.00 45.41 C ATOM 952 O GLU A 64 2.086 -20.430 -10.749 1.00 21.22 O ATOM 953 CB GLU A 64 2.486 -21.659 -13.796 1.00 23.31 C ATOM 954 CG GLU A 64 1.971 -22.069 -15.165 1.00 22.31 C ATOM 955 CD GLU A 64 2.751 -23.225 -15.759 1.00 12.53 C ATOM 956 OE1 GLU A 64 3.640 -23.761 -15.066 1.00 32.21 O ATOM 957 OE2 GLU A 64 2.474 -23.593 -16.921 1.00 51.52 O ATOM 0 H GLU A 64 1.719 -19.599 -14.925 1.00 45.21 H new ATOM 0 HA GLU A 64 0.693 -21.102 -12.746 1.00 2.31 H new ATOM 0 HB2 GLU A 64 3.494 -21.257 -13.902 1.00 23.31 H new ATOM 0 HB3 GLU A 64 2.560 -22.545 -13.165 1.00 23.31 H new ATOM 0 HG2 GLU A 64 0.920 -22.347 -15.085 1.00 22.31 H new ATOM 0 HG3 GLU A 64 2.024 -21.215 -15.840 1.00 22.31 H new ATOM 964 N LYS A 65 3.260 -19.120 -12.150 1.00 53.21 N ATOM 965 CA LYS A 65 4.034 -18.488 -11.087 1.00 34.44 C ATOM 966 C LYS A 65 3.117 -17.927 -10.006 1.00 3.12 C ATOM 967 O LYS A 65 3.305 -18.192 -8.818 1.00 2.53 O ATOM 968 CB LYS A 65 4.910 -17.371 -11.660 1.00 20.12 C ATOM 969 CG LYS A 65 5.971 -16.874 -10.692 1.00 22.54 C ATOM 970 CD LYS A 65 7.004 -17.948 -10.397 1.00 64.11 C ATOM 971 CE LYS A 65 8.194 -17.384 -9.637 1.00 75.14 C ATOM 972 NZ LYS A 65 7.983 -17.428 -8.164 1.00 55.11 N ATOM 0 H LYS A 65 3.487 -18.791 -13.089 1.00 53.21 H new ATOM 0 HA LYS A 65 4.674 -19.247 -10.637 1.00 34.44 H new ATOM 0 HB2 LYS A 65 5.397 -17.731 -12.566 1.00 20.12 H new ATOM 0 HB3 LYS A 65 4.274 -16.535 -11.950 1.00 20.12 H new ATOM 0 HG2 LYS A 65 6.465 -15.998 -11.111 1.00 22.54 H new ATOM 0 HG3 LYS A 65 5.497 -16.558 -9.762 1.00 22.54 H new ATOM 0 HD2 LYS A 65 6.544 -18.746 -9.814 1.00 64.11 H new ATOM 0 HD3 LYS A 65 7.346 -18.392 -11.332 1.00 64.11 H new ATOM 0 HE2 LYS A 65 9.090 -17.950 -9.893 1.00 75.14 H new ATOM 0 HE3 LYS A 65 8.369 -16.354 -9.948 1.00 75.14 H new ATOM 0 HZ1 LYS A 65 8.816 -17.035 -7.682 1.00 55.11 H new ATOM 0 HZ2 LYS A 65 7.143 -16.867 -7.917 1.00 55.11 H new ATOM 0 HZ3 LYS A 65 7.842 -18.413 -7.863 1.00 55.11 H new ATOM 986 N LEU A 66 2.124 -17.150 -10.424 1.00 62.23 N ATOM 987 CA LEU A 66 1.175 -16.551 -9.491 1.00 42.40 C ATOM 988 C LEU A 66 0.208 -17.600 -8.950 1.00 34.31 C ATOM 989 O LEU A 66 -0.194 -17.546 -7.788 1.00 43.55 O ATOM 990 CB LEU A 66 0.395 -15.428 -10.177 1.00 35.22 C ATOM 991 CG LEU A 66 1.024 -14.036 -10.108 1.00 12.31 C ATOM 992 CD1 LEU A 66 1.203 -13.602 -8.661 1.00 3.13 C ATOM 993 CD2 LEU A 66 2.356 -14.015 -10.842 1.00 20.50 C ATOM 0 H LEU A 66 1.955 -16.920 -11.403 1.00 62.23 H new ATOM 0 HA LEU A 66 1.738 -16.136 -8.655 1.00 42.40 H new ATOM 0 HB2 LEU A 66 0.262 -15.693 -11.226 1.00 35.22 H new ATOM 0 HB3 LEU A 66 -0.599 -15.378 -9.732 1.00 35.22 H new ATOM 0 HG LEU A 66 0.352 -13.330 -10.597 1.00 12.31 H new ATOM 0 HD11 LEU A 66 1.652 -12.609 -8.632 1.00 3.13 H new ATOM 0 HD12 LEU A 66 0.232 -13.576 -8.166 1.00 3.13 H new ATOM 0 HD13 LEU A 66 1.853 -14.310 -8.147 1.00 3.13 H new ATOM 0 HD21 LEU A 66 2.789 -13.016 -10.782 1.00 20.50 H new ATOM 0 HD22 LEU A 66 3.036 -14.733 -10.383 1.00 20.50 H new ATOM 0 HD23 LEU A 66 2.200 -14.281 -11.888 1.00 20.50 H new ATOM 1005 N ALA A 67 -0.158 -18.555 -9.799 1.00 62.40 N ATOM 1006 CA ALA A 67 -1.073 -19.617 -9.404 1.00 31.15 C ATOM 1007 C ALA A 67 -0.583 -20.324 -8.144 1.00 1.14 C ATOM 1008 O ALA A 67 -1.380 -20.857 -7.372 1.00 75.05 O ATOM 1009 CB ALA A 67 -1.243 -20.616 -10.540 1.00 20.14 C ATOM 0 H ALA A 67 0.166 -18.614 -10.764 1.00 62.40 H new ATOM 0 HA ALA A 67 -2.040 -19.166 -9.183 1.00 31.15 H new ATOM 0 HB1 ALA A 67 -1.929 -21.405 -10.231 1.00 20.14 H new ATOM 0 HB2 ALA A 67 -1.646 -20.106 -11.415 1.00 20.14 H new ATOM 0 HB3 ALA A 67 -0.276 -21.053 -10.788 1.00 20.14 H new ATOM 1015 N GLN A 68 0.731 -20.325 -7.945 1.00 12.15 N ATOM 1016 CA GLN A 68 1.326 -20.969 -6.779 1.00 64.31 C ATOM 1017 C GLN A 68 1.249 -20.058 -5.557 1.00 50.20 C ATOM 1018 O GLN A 68 1.148 -20.532 -4.426 1.00 5.42 O ATOM 1019 CB GLN A 68 2.783 -21.339 -7.063 1.00 4.24 C ATOM 1020 CG GLN A 68 2.941 -22.654 -7.809 1.00 32.35 C ATOM 1021 CD GLN A 68 4.388 -22.973 -8.128 1.00 43.12 C ATOM 1022 OE1 GLN A 68 5.072 -23.650 -7.359 1.00 72.41 O ATOM 1023 NE2 GLN A 68 4.865 -22.486 -9.268 1.00 1.41 N ATOM 0 H GLN A 68 1.404 -19.888 -8.575 1.00 12.15 H new ATOM 0 HA GLN A 68 0.762 -21.878 -6.569 1.00 64.31 H new ATOM 0 HB2 GLN A 68 3.245 -20.542 -7.646 1.00 4.24 H new ATOM 0 HB3 GLN A 68 3.325 -21.399 -6.119 1.00 4.24 H new ATOM 0 HG2 GLN A 68 2.519 -23.460 -7.210 1.00 32.35 H new ATOM 0 HG3 GLN A 68 2.369 -22.613 -8.736 1.00 32.35 H new ATOM 0 HE21 GLN A 68 4.264 -21.930 -9.876 1.00 1.41 H new ATOM 0 HE22 GLN A 68 5.832 -22.668 -9.535 1.00 1.41 H new ATOM 1032 N GLN A 69 1.296 -18.751 -5.795 1.00 75.41 N ATOM 1033 CA GLN A 69 1.234 -17.777 -4.713 1.00 73.40 C ATOM 1034 C GLN A 69 -0.198 -17.609 -4.214 1.00 43.13 C ATOM 1035 O GLN A 69 -0.425 -17.232 -3.064 1.00 45.10 O ATOM 1036 CB GLN A 69 1.784 -16.428 -5.180 1.00 50.41 C ATOM 1037 CG GLN A 69 3.262 -16.465 -5.534 1.00 72.14 C ATOM 1038 CD GLN A 69 3.956 -15.141 -5.281 1.00 5.22 C ATOM 1039 OE1 GLN A 69 3.551 -14.371 -4.410 1.00 1.33 O ATOM 1040 NE2 GLN A 69 5.008 -14.868 -6.043 1.00 61.43 N ATOM 0 H GLN A 69 1.377 -18.343 -6.726 1.00 75.41 H new ATOM 0 HA GLN A 69 1.846 -18.146 -3.890 1.00 73.40 H new ATOM 0 HB2 GLN A 69 1.218 -16.096 -6.050 1.00 50.41 H new ATOM 0 HB3 GLN A 69 1.625 -15.688 -4.395 1.00 50.41 H new ATOM 0 HG2 GLN A 69 3.752 -17.245 -4.951 1.00 72.14 H new ATOM 0 HG3 GLN A 69 3.374 -16.734 -6.584 1.00 72.14 H new ATOM 0 HE21 GLN A 69 5.310 -15.535 -6.753 1.00 61.43 H new ATOM 0 HE22 GLN A 69 5.515 -13.992 -5.918 1.00 61.43 H new ATOM 1049 N TYR A 70 -1.160 -17.892 -5.085 1.00 25.32 N ATOM 1050 CA TYR A 70 -2.570 -17.769 -4.734 1.00 13.24 C ATOM 1051 C TYR A 70 -3.307 -19.083 -4.978 1.00 13.40 C ATOM 1052 O TYR A 70 -4.527 -19.101 -5.151 1.00 60.12 O ATOM 1053 CB TYR A 70 -3.222 -16.647 -5.541 1.00 73.14 C ATOM 1054 CG TYR A 70 -2.559 -15.301 -5.354 1.00 2.41 C ATOM 1055 CD1 TYR A 70 -2.325 -14.790 -4.082 1.00 41.41 C ATOM 1056 CD2 TYR A 70 -2.164 -14.540 -6.448 1.00 54.44 C ATOM 1057 CE1 TYR A 70 -1.720 -13.561 -3.907 1.00 63.31 C ATOM 1058 CE2 TYR A 70 -1.556 -13.311 -6.281 1.00 43.53 C ATOM 1059 CZ TYR A 70 -1.337 -12.826 -5.009 1.00 60.24 C ATOM 1060 OH TYR A 70 -0.732 -11.602 -4.837 1.00 32.23 O ATOM 0 H TYR A 70 -0.989 -18.208 -6.040 1.00 25.32 H new ATOM 0 HA TYR A 70 -2.636 -17.528 -3.673 1.00 13.24 H new ATOM 0 HB2 TYR A 70 -3.198 -16.910 -6.598 1.00 73.14 H new ATOM 0 HB3 TYR A 70 -4.271 -16.568 -5.256 1.00 73.14 H new ATOM 0 HD1 TYR A 70 -2.621 -15.364 -3.216 1.00 41.41 H new ATOM 0 HD2 TYR A 70 -2.335 -14.916 -7.446 1.00 54.44 H new ATOM 0 HE1 TYR A 70 -1.548 -13.178 -2.912 1.00 63.31 H new ATOM 0 HE2 TYR A 70 -1.254 -12.733 -7.142 1.00 43.53 H new ATOM 0 HH TYR A 70 -0.524 -11.214 -5.713 1.00 32.23 H new ATOM 1070 N THR A 71 -2.559 -20.181 -4.991 1.00 53.31 N ATOM 1071 CA THR A 71 -3.140 -21.499 -5.214 1.00 63.45 C ATOM 1072 C THR A 71 -4.286 -21.766 -4.246 1.00 25.02 C ATOM 1073 O THR A 71 -5.165 -22.582 -4.520 1.00 11.42 O ATOM 1074 CB THR A 71 -2.085 -22.611 -5.063 1.00 51.51 C ATOM 1075 OG1 THR A 71 -2.627 -23.864 -5.497 1.00 70.04 O ATOM 1076 CG2 THR A 71 -1.624 -22.726 -3.618 1.00 62.15 C ATOM 0 H THR A 71 -1.549 -20.184 -4.850 1.00 53.31 H new ATOM 0 HA THR A 71 -3.522 -21.507 -6.235 1.00 63.45 H new ATOM 0 HB THR A 71 -1.226 -22.353 -5.683 1.00 51.51 H new ATOM 0 HG1 THR A 71 -1.949 -24.565 -5.399 1.00 70.04 H new ATOM 0 HG21 THR A 71 -0.879 -23.518 -3.536 1.00 62.15 H new ATOM 0 HG22 THR A 71 -1.185 -21.780 -3.300 1.00 62.15 H new ATOM 0 HG23 THR A 71 -2.477 -22.963 -2.982 1.00 62.15 H new ATOM 1084 N GLU A 72 -4.270 -21.073 -3.111 1.00 42.03 N ATOM 1085 CA GLU A 72 -5.310 -21.237 -2.102 1.00 25.13 C ATOM 1086 C GLU A 72 -6.695 -21.032 -2.708 1.00 64.22 C ATOM 1087 O GLU A 72 -7.642 -21.741 -2.372 1.00 31.12 O ATOM 1088 CB GLU A 72 -5.094 -20.251 -0.951 1.00 62.10 C ATOM 1089 CG GLU A 72 -3.938 -20.623 -0.039 1.00 10.13 C ATOM 1090 CD GLU A 72 -3.570 -19.508 0.921 1.00 41.34 C ATOM 1091 OE1 GLU A 72 -4.451 -18.683 1.239 1.00 54.20 O ATOM 1092 OE2 GLU A 72 -2.399 -19.462 1.354 1.00 3.33 O ATOM 0 H GLU A 72 -3.549 -20.394 -2.868 1.00 42.03 H new ATOM 0 HA GLU A 72 -5.249 -22.255 -1.717 1.00 25.13 H new ATOM 0 HB2 GLU A 72 -4.915 -19.258 -1.363 1.00 62.10 H new ATOM 0 HB3 GLU A 72 -6.007 -20.191 -0.359 1.00 62.10 H new ATOM 0 HG2 GLU A 72 -4.201 -21.515 0.530 1.00 10.13 H new ATOM 0 HG3 GLU A 72 -3.069 -20.877 -0.646 1.00 10.13 H new ATOM 1099 N ASN A 73 -6.803 -20.058 -3.605 1.00 43.45 N ATOM 1100 CA ASN A 73 -8.072 -19.758 -4.259 1.00 72.45 C ATOM 1101 C ASN A 73 -7.868 -19.497 -5.749 1.00 43.54 C ATOM 1102 O ASN A 73 -8.671 -18.815 -6.386 1.00 5.44 O ATOM 1103 CB ASN A 73 -8.734 -18.545 -3.603 1.00 62.14 C ATOM 1104 CG ASN A 73 -10.229 -18.498 -3.853 1.00 62.35 C ATOM 1105 OD1 ASN A 73 -10.699 -17.777 -4.735 1.00 54.33 O ATOM 1106 ND2 ASN A 73 -10.983 -19.264 -3.076 1.00 12.25 N ATOM 0 H ASN A 73 -6.027 -19.463 -3.896 1.00 43.45 H new ATOM 0 HA ASN A 73 -8.724 -20.624 -4.146 1.00 72.45 H new ATOM 0 HB2 ASN A 73 -8.548 -18.569 -2.529 1.00 62.14 H new ATOM 0 HB3 ASN A 73 -8.275 -17.633 -3.985 1.00 62.14 H new ATOM 0 HD21 ASN A 73 -11.996 -19.272 -3.196 1.00 12.25 H new ATOM 0 HD22 ASN A 73 -10.550 -19.845 -2.358 1.00 12.25 H new ATOM 1113 N VAL A 74 -6.788 -20.045 -6.298 1.00 43.23 N ATOM 1114 CA VAL A 74 -6.479 -19.872 -7.712 1.00 42.34 C ATOM 1115 C VAL A 74 -6.048 -21.190 -8.345 1.00 24.52 C ATOM 1116 O VAL A 74 -5.229 -21.921 -7.788 1.00 11.33 O ATOM 1117 CB VAL A 74 -5.366 -18.827 -7.920 1.00 72.22 C ATOM 1118 CG1 VAL A 74 -5.061 -18.660 -9.401 1.00 21.22 C ATOM 1119 CG2 VAL A 74 -5.760 -17.498 -7.296 1.00 13.41 C ATOM 0 H VAL A 74 -6.113 -20.612 -5.785 1.00 43.23 H new ATOM 0 HA VAL A 74 -7.391 -19.521 -8.195 1.00 42.34 H new ATOM 0 HB VAL A 74 -4.462 -19.181 -7.425 1.00 72.22 H new ATOM 0 HG11 VAL A 74 -4.273 -17.918 -9.529 1.00 21.22 H new ATOM 0 HG12 VAL A 74 -4.733 -19.613 -9.815 1.00 21.22 H new ATOM 0 HG13 VAL A 74 -5.959 -18.329 -9.922 1.00 21.22 H new ATOM 0 HG21 VAL A 74 -4.962 -16.772 -7.452 1.00 13.41 H new ATOM 0 HG22 VAL A 74 -6.677 -17.135 -7.761 1.00 13.41 H new ATOM 0 HG23 VAL A 74 -5.924 -17.632 -6.227 1.00 13.41 H new ATOM 1129 N LYS A 75 -6.605 -21.489 -9.515 1.00 41.33 N ATOM 1130 CA LYS A 75 -6.278 -22.719 -10.226 1.00 54.30 C ATOM 1131 C LYS A 75 -6.016 -22.439 -11.702 1.00 41.22 C ATOM 1132 O LYS A 75 -6.379 -21.382 -12.217 1.00 54.54 O ATOM 1133 CB LYS A 75 -7.415 -23.734 -10.081 1.00 44.23 C ATOM 1134 CG LYS A 75 -7.268 -24.642 -8.873 1.00 44.22 C ATOM 1135 CD LYS A 75 -6.092 -25.591 -9.029 1.00 22.44 C ATOM 1136 CE LYS A 75 -6.053 -26.619 -7.908 1.00 73.13 C ATOM 1137 NZ LYS A 75 -5.334 -26.105 -6.710 1.00 54.32 N ATOM 0 H LYS A 75 -7.285 -20.896 -9.990 1.00 41.33 H new ATOM 0 HA LYS A 75 -5.371 -23.135 -9.786 1.00 54.30 H new ATOM 0 HB2 LYS A 75 -8.362 -23.199 -10.010 1.00 44.23 H new ATOM 0 HB3 LYS A 75 -7.462 -24.346 -10.982 1.00 44.23 H new ATOM 0 HG2 LYS A 75 -7.132 -24.037 -7.976 1.00 44.22 H new ATOM 0 HG3 LYS A 75 -8.184 -25.216 -8.735 1.00 44.22 H new ATOM 0 HD2 LYS A 75 -6.160 -26.101 -9.990 1.00 22.44 H new ATOM 0 HD3 LYS A 75 -5.162 -25.022 -9.035 1.00 22.44 H new ATOM 0 HE2 LYS A 75 -7.071 -26.893 -7.631 1.00 73.13 H new ATOM 0 HE3 LYS A 75 -5.564 -27.526 -8.264 1.00 73.13 H new ATOM 0 HZ1 LYS A 75 -5.329 -26.834 -5.969 1.00 54.32 H new ATOM 0 HZ2 LYS A 75 -4.355 -25.867 -6.968 1.00 54.32 H new ATOM 0 HZ3 LYS A 75 -5.815 -25.254 -6.355 1.00 54.32 H new ATOM 1151 N ILE A 76 -5.387 -23.395 -12.378 1.00 32.00 N ATOM 1152 CA ILE A 76 -5.080 -23.252 -13.796 1.00 74.21 C ATOM 1153 C ILE A 76 -5.159 -24.595 -14.514 1.00 73.53 C ATOM 1154 O ILE A 76 -4.728 -25.620 -13.985 1.00 22.14 O ATOM 1155 CB ILE A 76 -3.679 -22.650 -14.010 1.00 4.33 C ATOM 1156 CG1 ILE A 76 -3.583 -21.275 -13.347 1.00 15.14 C ATOM 1157 CG2 ILE A 76 -3.367 -22.549 -15.497 1.00 3.40 C ATOM 1158 CD1 ILE A 76 -2.250 -20.592 -13.560 1.00 71.25 C ATOM 0 H ILE A 76 -5.080 -24.277 -11.967 1.00 32.00 H new ATOM 0 HA ILE A 76 -5.825 -22.575 -14.214 1.00 74.21 H new ATOM 0 HB ILE A 76 -2.943 -23.308 -13.547 1.00 4.33 H new ATOM 0 HG12 ILE A 76 -4.375 -20.636 -13.737 1.00 15.14 H new ATOM 0 HG13 ILE A 76 -3.759 -21.384 -12.277 1.00 15.14 H new ATOM 0 HG21 ILE A 76 -2.373 -22.122 -15.632 1.00 3.40 H new ATOM 0 HG22 ILE A 76 -3.398 -23.543 -15.944 1.00 3.40 H new ATOM 0 HG23 ILE A 76 -4.106 -21.910 -15.981 1.00 3.40 H new ATOM 0 HD11 ILE A 76 -2.254 -19.622 -13.062 1.00 71.25 H new ATOM 0 HD12 ILE A 76 -1.454 -21.210 -13.144 1.00 71.25 H new ATOM 0 HD13 ILE A 76 -2.080 -20.451 -14.627 1.00 71.25 H new ATOM 1170 N TYR A 77 -5.713 -24.582 -15.721 1.00 44.05 N ATOM 1171 CA TYR A 77 -5.850 -25.799 -16.512 1.00 41.33 C ATOM 1172 C TYR A 77 -5.786 -25.489 -18.004 1.00 64.33 C ATOM 1173 O TYR A 77 -5.982 -24.348 -18.423 1.00 10.43 O ATOM 1174 CB TYR A 77 -7.168 -26.501 -16.182 1.00 72.10 C ATOM 1175 CG TYR A 77 -7.131 -27.283 -14.888 1.00 12.23 C ATOM 1176 CD1 TYR A 77 -6.059 -28.112 -14.585 1.00 21.01 C ATOM 1177 CD2 TYR A 77 -8.168 -27.189 -13.967 1.00 20.02 C ATOM 1178 CE1 TYR A 77 -6.021 -28.828 -13.405 1.00 1.23 C ATOM 1179 CE2 TYR A 77 -8.138 -27.901 -12.784 1.00 23.03 C ATOM 1180 CZ TYR A 77 -7.062 -28.719 -12.506 1.00 14.33 C ATOM 1181 OH TYR A 77 -7.027 -29.430 -11.328 1.00 41.31 O ATOM 0 H TYR A 77 -6.075 -23.742 -16.173 1.00 44.05 H new ATOM 0 HA TYR A 77 -5.021 -26.460 -16.261 1.00 41.33 H new ATOM 0 HB2 TYR A 77 -7.962 -25.756 -16.124 1.00 72.10 H new ATOM 0 HB3 TYR A 77 -7.424 -27.177 -16.998 1.00 72.10 H new ATOM 0 HD1 TYR A 77 -5.241 -28.198 -15.285 1.00 21.01 H new ATOM 0 HD2 TYR A 77 -9.011 -26.549 -14.180 1.00 20.02 H new ATOM 0 HE1 TYR A 77 -5.181 -29.470 -13.187 1.00 1.23 H new ATOM 0 HE2 TYR A 77 -8.953 -27.818 -12.080 1.00 23.03 H new ATOM 0 HH TYR A 77 -7.835 -29.240 -10.807 1.00 41.31 H new ATOM 1191 N LYS A 78 -5.508 -26.514 -18.804 1.00 23.53 N ATOM 1192 CA LYS A 78 -5.419 -26.355 -20.250 1.00 3.52 C ATOM 1193 C LYS A 78 -6.342 -27.338 -20.963 1.00 53.52 C ATOM 1194 O LYS A 78 -7.106 -28.062 -20.325 1.00 32.22 O ATOM 1195 CB LYS A 78 -3.977 -26.560 -20.719 1.00 32.21 C ATOM 1196 CG LYS A 78 -3.016 -25.497 -20.213 1.00 32.34 C ATOM 1197 CD LYS A 78 -1.617 -26.056 -20.022 1.00 31.11 C ATOM 1198 CE LYS A 78 -0.976 -26.420 -21.353 1.00 21.42 C ATOM 1199 NZ LYS A 78 -1.322 -27.805 -21.776 1.00 41.41 N ATOM 0 H LYS A 78 -5.340 -27.464 -18.474 1.00 23.53 H new ATOM 0 HA LYS A 78 -5.734 -25.342 -20.499 1.00 3.52 H new ATOM 0 HB2 LYS A 78 -3.631 -27.539 -20.386 1.00 32.21 H new ATOM 0 HB3 LYS A 78 -3.956 -26.568 -21.809 1.00 32.21 H new ATOM 0 HG2 LYS A 78 -2.984 -24.668 -20.920 1.00 32.34 H new ATOM 0 HG3 LYS A 78 -3.381 -25.096 -19.267 1.00 32.34 H new ATOM 0 HD2 LYS A 78 -0.998 -25.321 -19.507 1.00 31.11 H new ATOM 0 HD3 LYS A 78 -1.661 -26.939 -19.384 1.00 31.11 H new ATOM 0 HE2 LYS A 78 -1.302 -25.715 -22.118 1.00 21.42 H new ATOM 0 HE3 LYS A 78 0.107 -26.325 -21.272 1.00 21.42 H new ATOM 0 HZ1 LYS A 78 -0.537 -28.206 -22.327 1.00 41.41 H new ATOM 0 HZ2 LYS A 78 -1.490 -28.393 -20.935 1.00 41.41 H new ATOM 0 HZ3 LYS A 78 -2.181 -27.785 -22.362 1.00 41.41 H new ATOM 1490 N THR A 98 -7.919 -18.736 -25.679 1.00 45.20 N ATOM 1491 CA THR A 98 -8.206 -17.654 -24.745 1.00 23.33 C ATOM 1492 C THR A 98 -8.293 -18.172 -23.314 1.00 42.13 C ATOM 1493 O THR A 98 -8.310 -19.381 -23.082 1.00 12.55 O ATOM 1494 CB THR A 98 -9.522 -16.939 -25.101 1.00 62.14 C ATOM 1495 OG1 THR A 98 -9.530 -15.620 -24.543 1.00 63.21 O ATOM 1496 CG2 THR A 98 -10.720 -17.720 -24.583 1.00 55.04 C ATOM 0 HA THR A 98 -7.383 -16.943 -24.822 1.00 23.33 H new ATOM 0 HB THR A 98 -9.592 -16.875 -26.187 1.00 62.14 H new ATOM 0 HG1 THR A 98 -10.424 -15.417 -24.196 1.00 63.21 H new ATOM 0 HG21 THR A 98 -11.638 -17.195 -24.847 1.00 55.04 H new ATOM 0 HG22 THR A 98 -10.728 -18.713 -25.032 1.00 55.04 H new ATOM 0 HG23 THR A 98 -10.653 -17.812 -23.499 1.00 55.04 H new ATOM 1504 N ILE A 99 -8.347 -17.250 -22.358 1.00 62.15 N ATOM 1505 CA ILE A 99 -8.434 -17.615 -20.950 1.00 43.54 C ATOM 1506 C ILE A 99 -9.832 -17.353 -20.400 1.00 65.44 C ATOM 1507 O ILE A 99 -10.453 -16.335 -20.710 1.00 5.15 O ATOM 1508 CB ILE A 99 -7.409 -16.839 -20.103 1.00 53.20 C ATOM 1509 CG1 ILE A 99 -5.992 -17.331 -20.401 1.00 62.33 C ATOM 1510 CG2 ILE A 99 -7.725 -16.985 -18.622 1.00 14.24 C ATOM 1511 CD1 ILE A 99 -5.419 -16.781 -21.690 1.00 74.33 C ATOM 0 H ILE A 99 -8.332 -16.245 -22.533 1.00 62.15 H new ATOM 0 HA ILE A 99 -8.214 -18.681 -20.886 1.00 43.54 H new ATOM 0 HB ILE A 99 -7.470 -15.783 -20.365 1.00 53.20 H new ATOM 0 HG12 ILE A 99 -5.338 -17.053 -19.574 1.00 62.33 H new ATOM 0 HG13 ILE A 99 -5.997 -18.420 -20.451 1.00 62.33 H new ATOM 0 HG21 ILE A 99 -6.991 -16.431 -18.037 1.00 14.24 H new ATOM 0 HG22 ILE A 99 -8.721 -16.591 -18.422 1.00 14.24 H new ATOM 0 HG23 ILE A 99 -7.689 -18.038 -18.344 1.00 14.24 H new ATOM 0 HD11 ILE A 99 -4.412 -17.172 -21.837 1.00 74.33 H new ATOM 0 HD12 ILE A 99 -6.050 -17.081 -22.526 1.00 74.33 H new ATOM 0 HD13 ILE A 99 -5.381 -15.693 -21.636 1.00 74.33 H new ATOM 1523 N LEU A 100 -10.322 -18.277 -19.580 1.00 14.13 N ATOM 1524 CA LEU A 100 -11.647 -18.146 -18.984 1.00 74.13 C ATOM 1525 C LEU A 100 -11.642 -18.623 -17.535 1.00 51.03 C ATOM 1526 O LEU A 100 -11.175 -19.721 -17.235 1.00 42.25 O ATOM 1527 CB LEU A 100 -12.672 -18.944 -19.792 1.00 11.41 C ATOM 1528 CG LEU A 100 -13.218 -18.260 -21.046 1.00 23.02 C ATOM 1529 CD1 LEU A 100 -13.838 -19.283 -21.985 1.00 75.25 C ATOM 1530 CD2 LEU A 100 -14.236 -17.193 -20.670 1.00 10.22 C ATOM 0 H LEU A 100 -9.822 -19.125 -19.313 1.00 14.13 H new ATOM 0 HA LEU A 100 -11.923 -17.092 -18.999 1.00 74.13 H new ATOM 0 HB2 LEU A 100 -12.216 -19.889 -20.087 1.00 11.41 H new ATOM 0 HB3 LEU A 100 -13.511 -19.185 -19.139 1.00 11.41 H new ATOM 0 HG LEU A 100 -12.389 -17.777 -21.564 1.00 23.02 H new ATOM 0 HD11 LEU A 100 -14.221 -18.778 -22.872 1.00 75.25 H new ATOM 0 HD12 LEU A 100 -13.082 -20.011 -22.280 1.00 75.25 H new ATOM 0 HD13 LEU A 100 -14.656 -19.795 -21.477 1.00 75.25 H new ATOM 0 HD21 LEU A 100 -14.614 -16.716 -21.574 1.00 10.22 H new ATOM 0 HD22 LEU A 100 -15.063 -17.653 -20.129 1.00 10.22 H new ATOM 0 HD23 LEU A 100 -13.761 -16.444 -20.037 1.00 10.22 H new ATOM 1542 N MET A 101 -12.165 -17.790 -16.642 1.00 44.04 N ATOM 1543 CA MET A 101 -12.224 -18.128 -15.224 1.00 51.33 C ATOM 1544 C MET A 101 -13.540 -18.820 -14.885 1.00 12.11 C ATOM 1545 O MET A 101 -14.601 -18.195 -14.890 1.00 52.43 O ATOM 1546 CB MET A 101 -12.060 -16.869 -14.370 1.00 34.22 C ATOM 1547 CG MET A 101 -10.799 -16.081 -14.686 1.00 12.34 C ATOM 1548 SD MET A 101 -10.096 -15.285 -13.229 1.00 53.14 S ATOM 1549 CE MET A 101 -8.509 -14.752 -13.867 1.00 41.24 C ATOM 0 H MET A 101 -12.554 -16.876 -16.874 1.00 44.04 H new ATOM 0 HA MET A 101 -11.406 -18.815 -15.005 1.00 51.33 H new ATOM 0 HB2 MET A 101 -12.927 -16.225 -14.516 1.00 34.22 H new ATOM 0 HB3 MET A 101 -12.047 -17.153 -13.318 1.00 34.22 H new ATOM 0 HG2 MET A 101 -10.057 -16.749 -15.124 1.00 12.34 H new ATOM 0 HG3 MET A 101 -11.027 -15.323 -15.435 1.00 12.34 H new ATOM 0 HE1 MET A 101 -7.721 -15.381 -13.454 1.00 41.24 H new ATOM 0 HE2 MET A 101 -8.507 -14.835 -14.954 1.00 41.24 H new ATOM 0 HE3 MET A 101 -8.332 -13.715 -13.582 1.00 41.24 H new ATOM 1559 N PHE A 102 -13.465 -20.113 -14.588 1.00 41.14 N ATOM 1560 CA PHE A 102 -14.651 -20.890 -14.248 1.00 22.24 C ATOM 1561 C PHE A 102 -14.583 -21.381 -12.804 1.00 24.11 C ATOM 1562 O PHE A 102 -13.510 -21.701 -12.294 1.00 24.33 O ATOM 1563 CB PHE A 102 -14.797 -22.081 -15.197 1.00 14.11 C ATOM 1564 CG PHE A 102 -15.351 -21.711 -16.543 1.00 43.34 C ATOM 1565 CD1 PHE A 102 -16.647 -21.238 -16.668 1.00 33.42 C ATOM 1566 CD2 PHE A 102 -14.574 -21.834 -17.684 1.00 24.13 C ATOM 1567 CE1 PHE A 102 -17.158 -20.898 -17.905 1.00 43.32 C ATOM 1568 CE2 PHE A 102 -15.081 -21.495 -18.924 1.00 54.11 C ATOM 1569 CZ PHE A 102 -16.374 -21.024 -19.035 1.00 21.31 C ATOM 0 H PHE A 102 -12.595 -20.645 -14.576 1.00 41.14 H new ATOM 0 HA PHE A 102 -15.521 -20.242 -14.353 1.00 22.24 H new ATOM 0 HB2 PHE A 102 -13.822 -22.550 -15.331 1.00 14.11 H new ATOM 0 HB3 PHE A 102 -15.448 -22.824 -14.737 1.00 14.11 H new ATOM 0 HD1 PHE A 102 -17.265 -21.134 -15.788 1.00 33.42 H new ATOM 0 HD2 PHE A 102 -13.561 -22.199 -17.603 1.00 24.13 H new ATOM 0 HE1 PHE A 102 -18.171 -20.533 -17.989 1.00 43.32 H new ATOM 0 HE2 PHE A 102 -14.466 -21.598 -19.806 1.00 54.11 H new ATOM 0 HZ PHE A 102 -16.771 -20.755 -20.003 1.00 21.31 H new ATOM 1579 N LYS A 103 -15.739 -21.435 -12.149 1.00 0.52 N ATOM 1580 CA LYS A 103 -15.814 -21.887 -10.765 1.00 14.34 C ATOM 1581 C LYS A 103 -17.235 -22.306 -10.406 1.00 42.13 C ATOM 1582 O LYS A 103 -18.180 -21.535 -10.570 1.00 4.33 O ATOM 1583 CB LYS A 103 -15.342 -20.779 -9.820 1.00 55.11 C ATOM 1584 CG LYS A 103 -15.561 -21.099 -8.351 1.00 53.23 C ATOM 1585 CD LYS A 103 -16.870 -20.518 -7.843 1.00 73.44 C ATOM 1586 CE LYS A 103 -16.658 -19.165 -7.182 1.00 31.03 C ATOM 1587 NZ LYS A 103 -17.922 -18.623 -6.610 1.00 61.33 N ATOM 0 H LYS A 103 -16.637 -21.171 -12.555 1.00 0.52 H new ATOM 0 HA LYS A 103 -15.161 -22.753 -10.655 1.00 14.34 H new ATOM 0 HB2 LYS A 103 -14.281 -20.596 -9.989 1.00 55.11 H new ATOM 0 HB3 LYS A 103 -15.868 -19.856 -10.065 1.00 55.11 H new ATOM 0 HG2 LYS A 103 -15.562 -22.180 -8.209 1.00 53.23 H new ATOM 0 HG3 LYS A 103 -14.733 -20.702 -7.764 1.00 53.23 H new ATOM 0 HD2 LYS A 103 -17.569 -20.414 -8.672 1.00 73.44 H new ATOM 0 HD3 LYS A 103 -17.322 -21.206 -7.129 1.00 73.44 H new ATOM 0 HE2 LYS A 103 -15.913 -19.260 -6.392 1.00 31.03 H new ATOM 0 HE3 LYS A 103 -16.260 -18.462 -7.913 1.00 31.03 H new ATOM 0 HZ1 LYS A 103 -17.698 -17.913 -5.884 1.00 61.33 H new ATOM 0 HZ2 LYS A 103 -18.483 -18.181 -7.366 1.00 61.33 H new ATOM 0 HZ3 LYS A 103 -18.468 -19.397 -6.180 1.00 61.33 H new ATOM 1601 N ASN A 104 -17.379 -23.531 -9.912 1.00 42.33 N ATOM 1602 CA ASN A 104 -18.686 -24.052 -9.529 1.00 62.34 C ATOM 1603 C ASN A 104 -19.695 -23.881 -10.661 1.00 50.33 C ATOM 1604 O ASN A 104 -20.857 -23.552 -10.427 1.00 40.20 O ATOM 1605 CB ASN A 104 -19.191 -23.344 -8.270 1.00 11.23 C ATOM 1606 CG ASN A 104 -20.429 -24.004 -7.692 1.00 4.44 C ATOM 1607 OD1 ASN A 104 -21.549 -23.535 -7.898 1.00 62.54 O ATOM 1608 ND2 ASN A 104 -20.232 -25.097 -6.964 1.00 61.13 N ATOM 0 H ASN A 104 -16.607 -24.182 -9.767 1.00 42.33 H new ATOM 0 HA ASN A 104 -18.578 -25.117 -9.322 1.00 62.34 H new ATOM 0 HB2 ASN A 104 -18.401 -23.338 -7.519 1.00 11.23 H new ATOM 0 HB3 ASN A 104 -19.414 -22.304 -8.506 1.00 11.23 H new ATOM 0 HD21 ASN A 104 -21.027 -25.584 -6.549 1.00 61.13 H new ATOM 0 HD22 ASN A 104 -19.286 -25.450 -6.820 1.00 61.13 H new ATOM 1615 N GLY A 105 -19.240 -24.105 -11.891 1.00 52.35 N ATOM 1616 CA GLY A 105 -20.114 -23.971 -13.041 1.00 3.40 C ATOM 1617 C GLY A 105 -20.528 -22.534 -13.291 1.00 72.24 C ATOM 1618 O GLY A 105 -21.590 -22.274 -13.856 1.00 44.34 O ATOM 0 H GLY A 105 -18.282 -24.377 -12.111 1.00 52.35 H new ATOM 0 HA2 GLY A 105 -19.608 -24.359 -13.925 1.00 3.40 H new ATOM 0 HA3 GLY A 105 -21.004 -24.581 -12.890 1.00 3.40 H new ATOM 1622 N LYS A 106 -19.686 -21.596 -12.867 1.00 63.04 N ATOM 1623 CA LYS A 106 -19.968 -20.177 -13.047 1.00 23.53 C ATOM 1624 C LYS A 106 -18.737 -19.438 -13.560 1.00 52.51 C ATOM 1625 O LYS A 106 -17.620 -19.953 -13.497 1.00 15.21 O ATOM 1626 CB LYS A 106 -20.435 -19.557 -11.727 1.00 4.42 C ATOM 1627 CG LYS A 106 -21.487 -18.475 -11.901 1.00 13.01 C ATOM 1628 CD LYS A 106 -21.899 -17.879 -10.566 1.00 34.42 C ATOM 1629 CE LYS A 106 -22.881 -16.732 -10.748 1.00 12.25 C ATOM 1630 NZ LYS A 106 -24.188 -17.200 -11.289 1.00 53.44 N ATOM 0 H LYS A 106 -18.803 -21.794 -12.396 1.00 63.04 H new ATOM 0 HA LYS A 106 -20.762 -20.081 -13.788 1.00 23.53 H new ATOM 0 HB2 LYS A 106 -20.837 -20.343 -11.088 1.00 4.42 H new ATOM 0 HB3 LYS A 106 -19.574 -19.135 -11.209 1.00 4.42 H new ATOM 0 HG2 LYS A 106 -21.098 -17.688 -12.547 1.00 13.01 H new ATOM 0 HG3 LYS A 106 -22.362 -18.893 -12.399 1.00 13.01 H new ATOM 0 HD2 LYS A 106 -22.352 -18.652 -9.945 1.00 34.42 H new ATOM 0 HD3 LYS A 106 -21.015 -17.522 -10.037 1.00 34.42 H new ATOM 0 HE2 LYS A 106 -23.041 -16.236 -9.791 1.00 12.25 H new ATOM 0 HE3 LYS A 106 -22.453 -15.991 -11.423 1.00 12.25 H new ATOM 0 HZ1 LYS A 106 -24.867 -16.412 -11.287 1.00 53.44 H new ATOM 0 HZ2 LYS A 106 -24.058 -17.543 -12.262 1.00 53.44 H new ATOM 0 HZ3 LYS A 106 -24.553 -17.972 -10.696 1.00 53.44 H new ATOM 1644 N LYS A 107 -18.947 -18.227 -14.065 1.00 5.15 N ATOM 1645 CA LYS A 107 -17.854 -17.415 -14.587 1.00 22.41 C ATOM 1646 C LYS A 107 -17.458 -16.331 -13.590 1.00 2.12 C ATOM 1647 O LYS A 107 -18.315 -15.682 -12.990 1.00 70.34 O ATOM 1648 CB LYS A 107 -18.256 -16.777 -15.918 1.00 42.32 C ATOM 1649 CG LYS A 107 -19.560 -16.000 -15.851 1.00 53.43 C ATOM 1650 CD LYS A 107 -19.590 -14.871 -16.866 1.00 74.10 C ATOM 1651 CE LYS A 107 -20.665 -13.848 -16.532 1.00 71.11 C ATOM 1652 NZ LYS A 107 -20.817 -12.830 -17.608 1.00 25.43 N ATOM 0 H LYS A 107 -19.865 -17.786 -14.124 1.00 5.15 H new ATOM 0 HA LYS A 107 -16.995 -18.067 -14.749 1.00 22.41 H new ATOM 0 HB2 LYS A 107 -17.460 -16.108 -16.245 1.00 42.32 H new ATOM 0 HB3 LYS A 107 -18.346 -17.558 -16.673 1.00 42.32 H new ATOM 0 HG2 LYS A 107 -20.396 -16.675 -16.032 1.00 53.43 H new ATOM 0 HG3 LYS A 107 -19.690 -15.592 -14.848 1.00 53.43 H new ATOM 0 HD2 LYS A 107 -18.617 -14.381 -16.895 1.00 74.10 H new ATOM 0 HD3 LYS A 107 -19.771 -15.279 -17.860 1.00 74.10 H new ATOM 0 HE2 LYS A 107 -21.616 -14.358 -16.378 1.00 71.11 H new ATOM 0 HE3 LYS A 107 -20.414 -13.351 -15.595 1.00 71.11 H new ATOM 0 HZ1 LYS A 107 -21.559 -12.152 -17.342 1.00 25.43 H new ATOM 0 HZ2 LYS A 107 -19.917 -12.325 -17.738 1.00 25.43 H new ATOM 0 HZ3 LYS A 107 -21.081 -13.301 -18.497 1.00 25.43 H new ATOM 1666 N LEU A 108 -16.155 -16.139 -13.419 1.00 62.00 N ATOM 1667 CA LEU A 108 -15.645 -15.131 -12.495 1.00 31.31 C ATOM 1668 C LEU A 108 -14.968 -13.992 -13.251 1.00 60.45 C ATOM 1669 O LEU A 108 -14.942 -12.853 -12.784 1.00 22.20 O ATOM 1670 CB LEU A 108 -14.657 -15.764 -11.513 1.00 53.53 C ATOM 1671 CG LEU A 108 -15.107 -17.069 -10.856 1.00 64.34 C ATOM 1672 CD1 LEU A 108 -14.606 -18.266 -11.649 1.00 21.01 C ATOM 1673 CD2 LEU A 108 -14.618 -17.139 -9.417 1.00 44.43 C ATOM 0 H LEU A 108 -15.432 -16.667 -13.908 1.00 62.00 H new ATOM 0 HA LEU A 108 -16.489 -14.723 -11.939 1.00 31.31 H new ATOM 0 HB2 LEU A 108 -13.721 -15.950 -12.040 1.00 53.53 H new ATOM 0 HB3 LEU A 108 -14.443 -15.040 -10.727 1.00 53.53 H new ATOM 0 HG LEU A 108 -16.197 -17.093 -10.850 1.00 64.34 H new ATOM 0 HD11 LEU A 108 -14.936 -19.186 -11.166 1.00 21.01 H new ATOM 0 HD12 LEU A 108 -15.006 -18.224 -12.662 1.00 21.01 H new ATOM 0 HD13 LEU A 108 -13.517 -18.247 -11.687 1.00 21.01 H new ATOM 0 HD21 LEU A 108 -14.948 -18.075 -8.966 1.00 44.43 H new ATOM 0 HD22 LEU A 108 -13.529 -17.092 -9.400 1.00 44.43 H new ATOM 0 HD23 LEU A 108 -15.026 -16.300 -8.853 1.00 44.43 H new ATOM 1685 N SER A 109 -14.424 -14.307 -14.422 1.00 64.12 N ATOM 1686 CA SER A 109 -13.745 -13.310 -15.242 1.00 55.15 C ATOM 1687 C SER A 109 -13.182 -13.943 -16.511 1.00 41.05 C ATOM 1688 O SER A 109 -13.193 -15.164 -16.665 1.00 33.13 O ATOM 1689 CB SER A 109 -12.619 -12.645 -14.447 1.00 52.45 C ATOM 1690 OG SER A 109 -12.930 -11.293 -14.158 1.00 54.05 O ATOM 0 H SER A 109 -14.440 -15.244 -14.824 1.00 64.12 H new ATOM 0 HA SER A 109 -14.475 -12.552 -15.527 1.00 55.15 H new ATOM 0 HB2 SER A 109 -12.454 -13.190 -13.518 1.00 52.45 H new ATOM 0 HB3 SER A 109 -11.690 -12.695 -15.015 1.00 52.45 H new ATOM 0 HG SER A 109 -12.383 -10.704 -14.719 1.00 54.05 H new ATOM 1696 N GLN A 110 -12.692 -13.103 -17.416 1.00 73.42 N ATOM 1697 CA GLN A 110 -12.126 -13.580 -18.673 1.00 42.33 C ATOM 1698 C GLN A 110 -10.865 -12.798 -19.033 1.00 70.12 C ATOM 1699 O GLN A 110 -10.727 -11.627 -18.680 1.00 44.53 O ATOM 1700 CB GLN A 110 -13.154 -13.459 -19.799 1.00 72.44 C ATOM 1701 CG GLN A 110 -13.801 -12.087 -19.887 1.00 35.44 C ATOM 1702 CD GLN A 110 -14.499 -11.854 -21.212 1.00 64.20 C ATOM 1703 OE1 GLN A 110 -15.728 -11.805 -21.281 1.00 14.10 O ATOM 1704 NE2 GLN A 110 -13.717 -11.711 -22.276 1.00 21.42 N ATOM 0 H GLN A 110 -12.675 -12.089 -17.303 1.00 73.42 H new ATOM 0 HA GLN A 110 -11.858 -14.629 -18.547 1.00 42.33 H new ATOM 0 HB2 GLN A 110 -12.669 -13.684 -20.749 1.00 72.44 H new ATOM 0 HB3 GLN A 110 -13.931 -14.209 -19.652 1.00 72.44 H new ATOM 0 HG2 GLN A 110 -14.522 -11.977 -19.077 1.00 35.44 H new ATOM 0 HG3 GLN A 110 -13.040 -11.321 -19.742 1.00 35.44 H new ATOM 0 HE21 GLN A 110 -12.703 -11.758 -22.174 1.00 21.42 H new ATOM 0 HE22 GLN A 110 -14.130 -11.554 -23.195 1.00 21.42 H new ATOM 1713 N VAL A 111 -9.949 -13.455 -19.737 1.00 61.10 N ATOM 1714 CA VAL A 111 -8.702 -12.822 -20.146 1.00 4.43 C ATOM 1715 C VAL A 111 -8.295 -13.263 -21.548 1.00 3.33 C ATOM 1716 O VAL A 111 -8.487 -14.418 -21.926 1.00 41.10 O ATOM 1717 CB VAL A 111 -7.559 -13.148 -19.166 1.00 34.54 C ATOM 1718 CG1 VAL A 111 -6.256 -12.519 -19.635 1.00 53.12 C ATOM 1719 CG2 VAL A 111 -7.913 -12.680 -17.762 1.00 22.25 C ATOM 0 H VAL A 111 -10.047 -14.425 -20.036 1.00 61.10 H new ATOM 0 HA VAL A 111 -8.878 -11.746 -20.143 1.00 4.43 H new ATOM 0 HB VAL A 111 -7.422 -14.229 -19.141 1.00 34.54 H new ATOM 0 HG11 VAL A 111 -5.461 -12.761 -18.930 1.00 53.12 H new ATOM 0 HG12 VAL A 111 -5.998 -12.908 -20.620 1.00 53.12 H new ATOM 0 HG13 VAL A 111 -6.374 -11.437 -19.692 1.00 53.12 H new ATOM 0 HG21 VAL A 111 -7.095 -12.918 -17.082 1.00 22.25 H new ATOM 0 HG22 VAL A 111 -8.078 -11.603 -17.768 1.00 22.25 H new ATOM 0 HG23 VAL A 111 -8.820 -13.184 -17.428 1.00 22.25 H new ATOM 1729 N ILE A 112 -7.732 -12.334 -22.314 1.00 40.51 N ATOM 1730 CA ILE A 112 -7.297 -12.628 -23.673 1.00 13.53 C ATOM 1731 C ILE A 112 -5.908 -12.057 -23.942 1.00 35.44 C ATOM 1732 O ILE A 112 -5.740 -10.847 -24.087 1.00 64.54 O ATOM 1733 CB ILE A 112 -8.282 -12.062 -24.714 1.00 10.42 C ATOM 1734 CG1 ILE A 112 -9.724 -12.290 -24.260 1.00 64.13 C ATOM 1735 CG2 ILE A 112 -8.041 -12.703 -26.073 1.00 61.22 C ATOM 1736 CD1 ILE A 112 -10.755 -11.793 -25.249 1.00 11.41 C ATOM 0 H ILE A 112 -7.567 -11.372 -22.016 1.00 40.51 H new ATOM 0 HA ILE A 112 -7.265 -13.714 -23.766 1.00 13.53 H new ATOM 0 HB ILE A 112 -8.115 -10.989 -24.805 1.00 10.42 H new ATOM 0 HG12 ILE A 112 -9.879 -13.356 -24.091 1.00 64.13 H new ATOM 0 HG13 ILE A 112 -9.879 -11.790 -23.304 1.00 64.13 H new ATOM 0 HG21 ILE A 112 -8.744 -12.293 -26.798 1.00 61.22 H new ATOM 0 HG22 ILE A 112 -7.022 -12.494 -26.398 1.00 61.22 H new ATOM 0 HG23 ILE A 112 -8.184 -13.781 -25.997 1.00 61.22 H new ATOM 0 HD11 ILE A 112 -11.755 -11.988 -24.861 1.00 11.41 H new ATOM 0 HD12 ILE A 112 -10.627 -10.721 -25.400 1.00 11.41 H new ATOM 0 HD13 ILE A 112 -10.627 -12.311 -26.199 1.00 11.41 H new ATOM 1748 N GLY A 113 -4.914 -12.939 -24.008 1.00 53.21 N ATOM 1749 CA GLY A 113 -3.553 -12.504 -24.260 1.00 14.23 C ATOM 1750 C GLY A 113 -2.640 -12.743 -23.075 1.00 44.34 C ATOM 1751 O GLY A 113 -2.996 -13.463 -22.143 1.00 21.13 O ATOM 0 H GLY A 113 -5.028 -13.946 -23.891 1.00 53.21 H new ATOM 0 HA2 GLY A 113 -3.161 -13.032 -25.129 1.00 14.23 H new ATOM 0 HA3 GLY A 113 -3.554 -11.442 -24.506 1.00 14.23 H new ATOM 1755 N ALA A 114 -1.456 -12.139 -23.111 1.00 2.12 N ATOM 1756 CA ALA A 114 -0.489 -12.289 -22.031 1.00 50.23 C ATOM 1757 C ALA A 114 -0.336 -10.991 -21.245 1.00 73.31 C ATOM 1758 O ALA A 114 0.454 -10.122 -21.612 1.00 1.34 O ATOM 1759 CB ALA A 114 0.856 -12.735 -22.585 1.00 34.24 C ATOM 0 H ALA A 114 -1.144 -11.541 -23.877 1.00 2.12 H new ATOM 0 HA ALA A 114 -0.860 -13.054 -21.349 1.00 50.23 H new ATOM 0 HB1 ALA A 114 1.569 -12.843 -21.767 1.00 34.24 H new ATOM 0 HB2 ALA A 114 0.741 -13.692 -23.094 1.00 34.24 H new ATOM 0 HB3 ALA A 114 1.224 -11.990 -23.291 1.00 34.24 H new ATOM 1765 N ASP A 115 -1.097 -10.866 -20.164 1.00 11.22 N ATOM 1766 CA ASP A 115 -1.046 -9.674 -19.326 1.00 33.14 C ATOM 1767 C ASP A 115 -1.050 -10.048 -17.847 1.00 50.50 C ATOM 1768 O ASP A 115 -2.105 -10.290 -17.261 1.00 41.34 O ATOM 1769 CB ASP A 115 -2.231 -8.756 -19.636 1.00 73.33 C ATOM 1770 CG ASP A 115 -1.935 -7.791 -20.766 1.00 45.55 C ATOM 1771 OD1 ASP A 115 -2.165 -8.158 -21.937 1.00 15.43 O ATOM 1772 OD2 ASP A 115 -1.473 -6.666 -20.480 1.00 51.32 O ATOM 0 H ASP A 115 -1.757 -11.576 -19.847 1.00 11.22 H new ATOM 0 HA ASP A 115 -0.119 -9.145 -19.546 1.00 33.14 H new ATOM 0 HB2 ASP A 115 -3.098 -9.363 -19.898 1.00 73.33 H new ATOM 0 HB3 ASP A 115 -2.495 -8.193 -18.741 1.00 73.33 H new ATOM 1777 N ILE A 116 0.138 -10.095 -17.252 1.00 43.41 N ATOM 1778 CA ILE A 116 0.271 -10.439 -15.842 1.00 44.52 C ATOM 1779 C ILE A 116 -0.481 -9.449 -14.960 1.00 11.00 C ATOM 1780 O ILE A 116 -1.152 -9.836 -14.004 1.00 0.15 O ATOM 1781 CB ILE A 116 1.748 -10.477 -15.409 1.00 1.13 C ATOM 1782 CG1 ILE A 116 1.858 -10.810 -13.920 1.00 20.02 C ATOM 1783 CG2 ILE A 116 2.422 -9.147 -15.710 1.00 15.41 C ATOM 1784 CD1 ILE A 116 1.329 -12.183 -13.567 1.00 45.32 C ATOM 0 H ILE A 116 1.021 -9.899 -17.724 1.00 43.41 H new ATOM 0 HA ILE A 116 -0.161 -11.432 -15.718 1.00 44.52 H new ATOM 0 HB ILE A 116 2.257 -11.257 -15.975 1.00 1.13 H new ATOM 0 HG12 ILE A 116 2.903 -10.743 -13.617 1.00 20.02 H new ATOM 0 HG13 ILE A 116 1.312 -10.061 -13.347 1.00 20.02 H new ATOM 0 HG21 ILE A 116 3.466 -9.189 -15.398 1.00 15.41 H new ATOM 0 HG22 ILE A 116 2.371 -8.947 -16.780 1.00 15.41 H new ATOM 0 HG23 ILE A 116 1.913 -8.350 -15.167 1.00 15.41 H new ATOM 0 HD11 ILE A 116 1.439 -12.351 -12.496 1.00 45.32 H new ATOM 0 HD12 ILE A 116 0.275 -12.248 -13.838 1.00 45.32 H new ATOM 0 HD13 ILE A 116 1.891 -12.941 -14.113 1.00 45.32 H new ATOM 1796 N SER A 117 -0.364 -8.166 -15.288 1.00 21.43 N ATOM 1797 CA SER A 117 -1.030 -7.118 -14.525 1.00 43.32 C ATOM 1798 C SER A 117 -2.547 -7.250 -14.629 1.00 21.20 C ATOM 1799 O SER A 117 -3.287 -6.720 -13.800 1.00 13.41 O ATOM 1800 CB SER A 117 -0.594 -5.738 -15.023 1.00 12.44 C ATOM 1801 OG SER A 117 -1.547 -4.747 -14.683 1.00 62.05 O ATOM 0 H SER A 117 0.186 -7.828 -16.077 1.00 21.43 H new ATOM 0 HA SER A 117 -0.743 -7.228 -13.479 1.00 43.32 H new ATOM 0 HB2 SER A 117 0.373 -5.481 -14.590 1.00 12.44 H new ATOM 0 HB3 SER A 117 -0.462 -5.764 -16.105 1.00 12.44 H new ATOM 0 HG SER A 117 -1.243 -3.875 -15.011 1.00 62.05 H new ATOM 1807 N LYS A 118 -3.003 -7.964 -15.653 1.00 15.20 N ATOM 1808 CA LYS A 118 -4.430 -8.171 -15.866 1.00 45.15 C ATOM 1809 C LYS A 118 -4.937 -9.356 -15.050 1.00 64.05 C ATOM 1810 O LYS A 118 -5.844 -9.214 -14.230 1.00 21.20 O ATOM 1811 CB LYS A 118 -4.717 -8.400 -17.352 1.00 45.12 C ATOM 1812 CG LYS A 118 -6.141 -8.846 -17.635 1.00 72.13 C ATOM 1813 CD LYS A 118 -7.155 -7.855 -17.088 1.00 21.24 C ATOM 1814 CE LYS A 118 -8.144 -7.422 -18.160 1.00 12.53 C ATOM 1815 NZ LYS A 118 -8.925 -8.573 -18.692 1.00 64.22 N ATOM 0 H LYS A 118 -2.404 -8.409 -16.348 1.00 15.20 H new ATOM 0 HA LYS A 118 -4.955 -7.275 -15.535 1.00 45.15 H new ATOM 0 HB2 LYS A 118 -4.519 -7.478 -17.898 1.00 45.12 H new ATOM 0 HB3 LYS A 118 -4.027 -9.152 -17.735 1.00 45.12 H new ATOM 0 HG2 LYS A 118 -6.282 -8.956 -18.710 1.00 72.13 H new ATOM 0 HG3 LYS A 118 -6.312 -9.826 -17.189 1.00 72.13 H new ATOM 0 HD2 LYS A 118 -7.694 -8.306 -16.255 1.00 21.24 H new ATOM 0 HD3 LYS A 118 -6.636 -6.981 -16.696 1.00 21.24 H new ATOM 0 HE2 LYS A 118 -8.827 -6.680 -17.746 1.00 12.53 H new ATOM 0 HE3 LYS A 118 -7.607 -6.940 -18.976 1.00 12.53 H new ATOM 0 HZ1 LYS A 118 -9.775 -8.221 -19.177 1.00 64.22 H new ATOM 0 HZ2 LYS A 118 -8.339 -9.109 -19.364 1.00 64.22 H new ATOM 0 HZ3 LYS A 118 -9.207 -9.194 -17.907 1.00 64.22 H new ATOM 1829 N ILE A 119 -4.344 -10.522 -15.281 1.00 65.15 N ATOM 1830 CA ILE A 119 -4.734 -11.731 -14.565 1.00 50.12 C ATOM 1831 C ILE A 119 -4.674 -11.520 -13.056 1.00 70.05 C ATOM 1832 O ILE A 119 -5.476 -12.081 -12.309 1.00 1.10 O ATOM 1833 CB ILE A 119 -3.836 -12.924 -14.942 1.00 20.21 C ATOM 1834 CG1 ILE A 119 -2.442 -12.752 -14.332 1.00 2.20 C ATOM 1835 CG2 ILE A 119 -3.745 -13.061 -16.454 1.00 22.50 C ATOM 1836 CD1 ILE A 119 -2.269 -13.469 -13.012 1.00 60.34 C ATOM 0 H ILE A 119 -3.592 -10.656 -15.958 1.00 65.15 H new ATOM 0 HA ILE A 119 -5.760 -11.953 -14.858 1.00 50.12 H new ATOM 0 HB ILE A 119 -4.279 -13.836 -14.541 1.00 20.21 H new ATOM 0 HG12 ILE A 119 -1.697 -13.121 -15.037 1.00 2.20 H new ATOM 0 HG13 ILE A 119 -2.246 -11.690 -14.188 1.00 2.20 H new ATOM 0 HG21 ILE A 119 -3.107 -13.908 -16.705 1.00 22.50 H new ATOM 0 HG22 ILE A 119 -4.741 -13.223 -16.865 1.00 22.50 H new ATOM 0 HG23 ILE A 119 -3.321 -12.150 -16.877 1.00 22.50 H new ATOM 0 HD11 ILE A 119 -1.259 -13.304 -12.638 1.00 60.34 H new ATOM 0 HD12 ILE A 119 -2.990 -13.084 -12.291 1.00 60.34 H new ATOM 0 HD13 ILE A 119 -2.433 -14.537 -13.154 1.00 60.34 H new ATOM 1848 N ILE A 120 -3.720 -10.708 -12.615 1.00 42.50 N ATOM 1849 CA ILE A 120 -3.557 -10.420 -11.196 1.00 1.51 C ATOM 1850 C ILE A 120 -4.635 -9.463 -10.701 1.00 62.35 C ATOM 1851 O ILE A 120 -5.082 -9.550 -9.558 1.00 43.52 O ATOM 1852 CB ILE A 120 -2.172 -9.815 -10.899 1.00 53.45 C ATOM 1853 CG1 ILE A 120 -2.006 -8.485 -11.637 1.00 1.40 C ATOM 1854 CG2 ILE A 120 -1.072 -10.788 -11.294 1.00 71.24 C ATOM 1855 CD1 ILE A 120 -2.396 -7.280 -10.809 1.00 14.01 C ATOM 0 H ILE A 120 -3.048 -10.237 -13.221 1.00 42.50 H new ATOM 0 HA ILE A 120 -3.649 -11.370 -10.669 1.00 1.51 H new ATOM 0 HB ILE A 120 -2.095 -9.628 -9.828 1.00 53.45 H new ATOM 0 HG12 ILE A 120 -0.967 -8.380 -11.950 1.00 1.40 H new ATOM 0 HG13 ILE A 120 -2.611 -8.504 -12.543 1.00 1.40 H new ATOM 0 HG21 ILE A 120 -0.100 -10.345 -11.078 1.00 71.24 H new ATOM 0 HG22 ILE A 120 -1.184 -11.713 -10.728 1.00 71.24 H new ATOM 0 HG23 ILE A 120 -1.143 -11.004 -12.360 1.00 71.24 H new ATOM 0 HD11 ILE A 120 -2.252 -6.373 -11.396 1.00 14.01 H new ATOM 0 HD12 ILE A 120 -3.443 -7.362 -10.518 1.00 14.01 H new ATOM 0 HD13 ILE A 120 -1.774 -7.236 -9.915 1.00 14.01 H new ATOM 1867 N SER A 121 -5.052 -8.549 -11.573 1.00 0.12 N ATOM 1868 CA SER A 121 -6.078 -7.573 -11.225 1.00 73.21 C ATOM 1869 C SER A 121 -7.443 -8.242 -11.095 1.00 61.43 C ATOM 1870 O SER A 121 -8.248 -7.873 -10.241 1.00 43.23 O ATOM 1871 CB SER A 121 -6.138 -6.466 -12.279 1.00 52.11 C ATOM 1872 OG SER A 121 -7.169 -5.540 -11.988 1.00 1.41 O ATOM 0 H SER A 121 -4.695 -8.465 -12.525 1.00 0.12 H new ATOM 0 HA SER A 121 -5.815 -7.134 -10.263 1.00 73.21 H new ATOM 0 HB2 SER A 121 -5.180 -5.947 -12.321 1.00 52.11 H new ATOM 0 HB3 SER A 121 -6.306 -6.905 -13.263 1.00 52.11 H new ATOM 0 HG SER A 121 -7.185 -4.842 -12.676 1.00 1.41 H new ATOM 1878 N GLU A 122 -7.696 -9.228 -11.951 1.00 41.41 N ATOM 1879 CA GLU A 122 -8.963 -9.948 -11.933 1.00 61.12 C ATOM 1880 C GLU A 122 -9.001 -10.956 -10.789 1.00 33.11 C ATOM 1881 O GLU A 122 -9.914 -10.940 -9.963 1.00 50.32 O ATOM 1882 CB GLU A 122 -9.188 -10.665 -13.266 1.00 22.41 C ATOM 1883 CG GLU A 122 -9.284 -9.723 -14.455 1.00 53.03 C ATOM 1884 CD GLU A 122 -10.542 -8.877 -14.429 1.00 22.05 C ATOM 1885 OE1 GLU A 122 -10.662 -8.021 -13.527 1.00 60.42 O ATOM 1886 OE2 GLU A 122 -11.407 -9.071 -15.308 1.00 35.23 O ATOM 0 H GLU A 122 -7.040 -9.546 -12.665 1.00 41.41 H new ATOM 0 HA GLU A 122 -9.761 -9.221 -11.780 1.00 61.12 H new ATOM 0 HB2 GLU A 122 -8.371 -11.367 -13.434 1.00 22.41 H new ATOM 0 HB3 GLU A 122 -10.104 -11.252 -13.203 1.00 22.41 H new ATOM 0 HG2 GLU A 122 -8.412 -9.070 -14.468 1.00 53.03 H new ATOM 0 HG3 GLU A 122 -9.260 -10.304 -15.377 1.00 53.03 H new ATOM 1893 N ILE A 123 -8.003 -11.833 -10.747 1.00 72.25 N ATOM 1894 CA ILE A 123 -7.920 -12.848 -9.704 1.00 54.04 C ATOM 1895 C ILE A 123 -8.031 -12.222 -8.319 1.00 62.52 C ATOM 1896 O ILE A 123 -8.910 -12.579 -7.534 1.00 23.52 O ATOM 1897 CB ILE A 123 -6.603 -13.640 -9.794 1.00 31.40 C ATOM 1898 CG1 ILE A 123 -6.555 -14.447 -11.093 1.00 34.31 C ATOM 1899 CG2 ILE A 123 -6.455 -14.558 -8.589 1.00 30.35 C ATOM 1900 CD1 ILE A 123 -5.162 -14.897 -11.474 1.00 24.43 C ATOM 0 H ILE A 123 -7.240 -11.861 -11.424 1.00 72.25 H new ATOM 0 HA ILE A 123 -8.756 -13.530 -9.859 1.00 54.04 H new ATOM 0 HB ILE A 123 -5.771 -12.935 -9.795 1.00 31.40 H new ATOM 0 HG12 ILE A 123 -7.196 -15.323 -10.991 1.00 34.31 H new ATOM 0 HG13 ILE A 123 -6.967 -13.843 -11.902 1.00 34.31 H new ATOM 0 HG21 ILE A 123 -5.519 -15.112 -8.666 1.00 30.35 H new ATOM 0 HG22 ILE A 123 -6.450 -13.962 -7.676 1.00 30.35 H new ATOM 0 HG23 ILE A 123 -7.290 -15.258 -8.560 1.00 30.35 H new ATOM 0 HD11 ILE A 123 -5.204 -15.463 -12.404 1.00 24.43 H new ATOM 0 HD12 ILE A 123 -4.522 -14.025 -11.609 1.00 24.43 H new ATOM 0 HD13 ILE A 123 -4.754 -15.528 -10.684 1.00 24.43 H new ATOM 1912 N ASN A 124 -7.135 -11.286 -8.024 1.00 75.21 N ATOM 1913 CA ASN A 124 -7.133 -10.609 -6.732 1.00 73.45 C ATOM 1914 C ASN A 124 -8.452 -9.880 -6.498 1.00 64.11 C ATOM 1915 O ASN A 124 -8.807 -9.565 -5.363 1.00 42.22 O ATOM 1916 CB ASN A 124 -5.968 -9.619 -6.654 1.00 11.21 C ATOM 1917 CG ASN A 124 -4.619 -10.310 -6.693 1.00 25.22 C ATOM 1918 OD1 ASN A 124 -4.483 -11.454 -6.260 1.00 22.41 O ATOM 1919 ND2 ASN A 124 -3.614 -9.615 -7.212 1.00 11.02 N ATOM 0 H ASN A 124 -6.401 -10.979 -8.662 1.00 75.21 H new ATOM 0 HA ASN A 124 -7.013 -11.363 -5.954 1.00 73.45 H new ATOM 0 HB2 ASN A 124 -6.037 -8.915 -7.483 1.00 11.21 H new ATOM 0 HB3 ASN A 124 -6.049 -9.038 -5.735 1.00 11.21 H new ATOM 0 HD21 ASN A 124 -2.682 -10.027 -7.264 1.00 11.02 H new ATOM 0 HD22 ASN A 124 -3.774 -8.669 -7.559 1.00 11.02 H new ATOM 1926 N ASN A 125 -9.175 -9.614 -7.582 1.00 51.03 N ATOM 1927 CA ASN A 125 -10.455 -8.921 -7.495 1.00 1.33 C ATOM 1928 C ASN A 125 -11.591 -9.906 -7.234 1.00 30.23 C ATOM 1929 O ASN A 125 -12.619 -9.548 -6.662 1.00 34.25 O ATOM 1930 CB ASN A 125 -10.727 -8.142 -8.784 1.00 2.44 C ATOM 1931 CG ASN A 125 -12.171 -7.694 -8.896 1.00 64.22 C ATOM 1932 OD1 ASN A 125 -12.582 -6.723 -8.261 1.00 75.13 O ATOM 1933 ND2 ASN A 125 -12.949 -8.402 -9.706 1.00 2.34 N ATOM 0 H ASN A 125 -8.896 -9.868 -8.530 1.00 51.03 H new ATOM 0 HA ASN A 125 -10.404 -8.222 -6.660 1.00 1.33 H new ATOM 0 HB2 ASN A 125 -10.075 -7.269 -8.822 1.00 2.44 H new ATOM 0 HB3 ASN A 125 -10.476 -8.766 -9.642 1.00 2.44 H new ATOM 0 HD21 ASN A 125 -13.930 -8.148 -9.821 1.00 2.34 H new ATOM 0 HD22 ASN A 125 -12.566 -9.200 -10.213 1.00 2.34 H new ATOM 1940 N ASN A 126 -11.396 -11.151 -7.659 1.00 22.12 N ATOM 1941 CA ASN A 126 -12.403 -12.189 -7.472 1.00 5.34 C ATOM 1942 C ASN A 126 -11.968 -13.182 -6.399 1.00 72.44 C ATOM 1943 O ASN A 126 -12.577 -14.240 -6.234 1.00 24.00 O ATOM 1944 CB ASN A 126 -12.659 -12.924 -8.789 1.00 64.41 C ATOM 1945 CG ASN A 126 -11.387 -13.493 -9.390 1.00 31.12 C ATOM 1946 OD1 ASN A 126 -10.607 -14.156 -8.705 1.00 60.44 O ATOM 1947 ND2 ASN A 126 -11.174 -13.237 -10.675 1.00 44.34 N ATOM 0 H ASN A 126 -10.550 -11.465 -8.135 1.00 22.12 H new ATOM 0 HA ASN A 126 -13.326 -11.710 -7.146 1.00 5.34 H new ATOM 0 HB2 ASN A 126 -13.370 -13.732 -8.619 1.00 64.41 H new ATOM 0 HB3 ASN A 126 -13.119 -12.239 -9.501 1.00 64.41 H new ATOM 0 HD21 ASN A 126 -10.336 -13.594 -11.134 1.00 44.34 H new ATOM 0 HD22 ASN A 126 -11.848 -12.683 -11.203 1.00 44.34 H new ATOM 1954 N ILE A 127 -10.912 -12.834 -5.671 1.00 64.21 N ATOM 1955 CA ILE A 127 -10.396 -13.693 -4.613 1.00 53.31 C ATOM 1956 C ILE A 127 -11.020 -13.342 -3.267 1.00 13.41 C ATOM 1957 O ILE A 127 -11.215 -12.170 -2.948 1.00 22.03 O ATOM 1958 CB ILE A 127 -8.864 -13.589 -4.498 1.00 71.21 C ATOM 1959 CG1 ILE A 127 -8.191 -14.645 -5.377 1.00 12.14 C ATOM 1960 CG2 ILE A 127 -8.429 -13.743 -3.049 1.00 2.33 C ATOM 1961 CD1 ILE A 127 -6.681 -14.570 -5.364 1.00 51.21 C ATOM 0 H ILE A 127 -10.397 -11.962 -5.795 1.00 64.21 H new ATOM 0 HA ILE A 127 -10.663 -14.716 -4.880 1.00 53.31 H new ATOM 0 HB ILE A 127 -8.555 -12.603 -4.846 1.00 71.21 H new ATOM 0 HG12 ILE A 127 -8.500 -15.635 -5.042 1.00 12.14 H new ATOM 0 HG13 ILE A 127 -8.543 -14.531 -6.402 1.00 12.14 H new ATOM 0 HG21 ILE A 127 -7.344 -13.667 -2.985 1.00 2.33 H new ATOM 0 HG22 ILE A 127 -8.884 -12.956 -2.447 1.00 2.33 H new ATOM 0 HG23 ILE A 127 -8.747 -14.716 -2.675 1.00 2.33 H new ATOM 0 HD11 ILE A 127 -6.272 -15.348 -6.009 1.00 51.21 H new ATOM 0 HD12 ILE A 127 -6.362 -13.593 -5.727 1.00 51.21 H new ATOM 0 HD13 ILE A 127 -6.318 -14.715 -4.346 1.00 51.21 H new ATOM 1973 N ASN A 128 -11.331 -14.367 -2.480 1.00 2.43 N ATOM 1974 CA ASN A 128 -11.932 -14.166 -1.166 1.00 53.34 C ATOM 1975 C ASN A 128 -11.129 -13.160 -0.347 1.00 63.41 C ATOM 1976 O ASN A 128 -11.688 -12.410 0.453 1.00 72.01 O ATOM 1977 CB ASN A 128 -12.022 -15.496 -0.415 1.00 3.42 C ATOM 1978 CG ASN A 128 -10.698 -15.899 0.205 1.00 11.34 C ATOM 1979 OD1 ASN A 128 -10.588 -16.041 1.424 1.00 54.30 O ATOM 1980 ND2 ASN A 128 -9.685 -16.087 -0.633 1.00 25.45 N ATOM 0 H ASN A 128 -11.177 -15.344 -2.729 1.00 2.43 H new ATOM 0 HA ASN A 128 -12.937 -13.769 -1.311 1.00 53.34 H new ATOM 0 HB2 ASN A 128 -12.778 -15.419 0.367 1.00 3.42 H new ATOM 0 HB3 ASN A 128 -12.352 -16.276 -1.101 1.00 3.42 H new ATOM 0 HD21 ASN A 128 -8.770 -16.360 -0.274 1.00 25.45 H new ATOM 0 HD22 ASN A 128 -9.822 -15.958 -1.636 1.00 25.45 H new