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 25 GLN : amide:sc= -0.783 K(o=-0.93,f=-5.9!) USER MOD Set 1.2: A 78 LYS NZ :NH3+ -122:sc= -0.145 (180deg=-2.58!) USER MOD Set 2.1: A 75 LYS NZ :NH3+ 161:sc= 0.151 (180deg=-0.562) USER MOD Set 2.2: A 77 TYR OH : rot 180:sc= 0.287 USER MOD Set 3.1: A 73 ASN : amide:sc= -1.05 K(o=-1.4,f=-0.026) USER MOD Set 3.2: A 128 ASN : amide:sc= -0.399 K(o=-1.4,f=-0.026) USER MOD Set 4.1: A 41 ASN : amide:sc= -0.842 K(o=-0.84,f=-0.041) USER MOD Set 4.2: A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot -15:sc= 0.286 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 154:sc= -0.639 (180deg=-1.72) 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 -59:sc= -0.64 USER MOD Single : A 39 ASN : amide:sc= -0.495 X(o=-0.49,f=-0.94) USER MOD Single : A 62 GLN : amide:sc= -0.576 X(o=-0.58,f=-0.32) USER MOD Single : A 65 LYS NZ :NH3+ -106:sc= -0.66 (180deg=-2.76!) USER MOD Single : A 68 GLN : amide:sc= -0.308 X(o=-0.31,f=-0.072) USER MOD Single : A 69 GLN : amide:sc= -0.0713 K(o=-0.071,f=-1.9!) 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 98 THR OG1 : rot 16:sc= 0.318 USER MOD Single : A 101 MET CE :methyl 134:sc= -4.14! (180deg=-9.03!) USER MOD Single : A 104 ASN : amide:sc= -0.506 K(o=-0.51,f=-1.8) 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 42:sc= 1.27 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.441) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.3 K(o=-0.3,f=-1.2) USER MOD Single : A 125 ASN : amide:sc= -1.27 K(o=-1.3,f=-2.9!) USER MOD Single : A 126 ASN : amide:sc= -0.359 X(o=-0.36,f=-0.027) USER MOD ----------------------------------------------------------------- ATOM 316 N ILE A 23 -0.097 -27.256 -14.729 1.00 52.50 N ATOM 317 CA ILE A 23 -1.304 -27.172 -15.541 1.00 71.21 C ATOM 318 C ILE A 23 -1.597 -28.502 -16.228 1.00 10.42 C ATOM 319 O ILE A 23 -0.732 -29.074 -16.887 1.00 53.52 O ATOM 320 CB ILE A 23 -1.188 -26.069 -16.609 1.00 41.35 C ATOM 321 CG1 ILE A 23 -0.903 -24.718 -15.951 1.00 13.10 C ATOM 322 CG2 ILE A 23 -2.460 -26.002 -17.441 1.00 73.31 C ATOM 323 CD1 ILE A 23 -0.693 -23.594 -16.943 1.00 74.23 C ATOM 0 HA ILE A 23 -2.123 -26.927 -14.865 1.00 71.21 H new ATOM 0 HB ILE A 23 -0.356 -26.311 -17.271 1.00 41.35 H new ATOM 0 HG12 ILE A 23 -1.734 -24.461 -15.294 1.00 13.10 H new ATOM 0 HG13 ILE A 23 -0.016 -24.808 -15.324 1.00 13.10 H new ATOM 0 HG21 ILE A 23 -2.363 -25.218 -18.192 1.00 73.31 H new ATOM 0 HG22 ILE A 23 -2.622 -26.960 -17.936 1.00 73.31 H new ATOM 0 HG23 ILE A 23 -3.308 -25.781 -16.793 1.00 73.31 H new ATOM 0 HD11 ILE A 23 -0.496 -22.666 -16.406 1.00 74.23 H new ATOM 0 HD12 ILE A 23 0.156 -23.829 -17.585 1.00 74.23 H new ATOM 0 HD13 ILE A 23 -1.588 -23.476 -17.554 1.00 74.23 H new ATOM 335 N GLU A 24 -2.826 -28.984 -16.069 1.00 71.32 N ATOM 336 CA GLU A 24 -3.234 -30.247 -16.675 1.00 63.12 C ATOM 337 C GLU A 24 -4.331 -30.023 -17.712 1.00 45.22 C ATOM 338 O GLU A 24 -5.068 -29.038 -17.647 1.00 40.33 O ATOM 339 CB GLU A 24 -3.724 -31.219 -15.601 1.00 43.20 C ATOM 340 CG GLU A 24 -5.181 -31.020 -15.217 1.00 24.25 C ATOM 341 CD GLU A 24 -5.467 -31.426 -13.784 1.00 12.10 C ATOM 342 OE1 GLU A 24 -4.533 -31.383 -12.958 1.00 52.34 O ATOM 343 OE2 GLU A 24 -6.626 -31.788 -13.491 1.00 51.31 O ATOM 0 H GLU A 24 -3.555 -28.520 -15.527 1.00 71.32 H new ATOM 0 HA GLU A 24 -2.366 -30.677 -17.175 1.00 63.12 H new ATOM 0 HB2 GLU A 24 -3.587 -32.240 -15.958 1.00 43.20 H new ATOM 0 HB3 GLU A 24 -3.104 -31.107 -14.711 1.00 43.20 H new ATOM 0 HG2 GLU A 24 -5.449 -29.973 -15.354 1.00 24.25 H new ATOM 0 HG3 GLU A 24 -5.813 -31.602 -15.889 1.00 24.25 H new ATOM 350 N GLN A 25 -4.432 -30.941 -18.666 1.00 72.41 N ATOM 351 CA GLN A 25 -5.438 -30.843 -19.717 1.00 70.32 C ATOM 352 C GLN A 25 -6.692 -31.625 -19.344 1.00 34.23 C ATOM 353 O GLN A 25 -6.624 -32.809 -19.016 1.00 3.23 O ATOM 354 CB GLN A 25 -4.875 -31.363 -21.041 1.00 62.23 C ATOM 355 CG GLN A 25 -4.213 -32.727 -20.927 1.00 24.51 C ATOM 356 CD GLN A 25 -2.722 -32.634 -20.671 1.00 33.21 C ATOM 357 OE1 GLN A 25 -2.054 -31.715 -21.147 1.00 64.03 O ATOM 358 NE2 GLN A 25 -2.191 -33.586 -19.913 1.00 41.21 N ATOM 0 H GLN A 25 -3.830 -31.761 -18.734 1.00 72.41 H new ATOM 0 HA GLN A 25 -5.706 -29.793 -19.831 1.00 70.32 H new ATOM 0 HB2 GLN A 25 -5.682 -31.420 -21.772 1.00 62.23 H new ATOM 0 HB3 GLN A 25 -4.148 -30.646 -21.424 1.00 62.23 H new ATOM 0 HG2 GLN A 25 -4.682 -33.287 -20.118 1.00 24.51 H new ATOM 0 HG3 GLN A 25 -4.386 -33.288 -21.846 1.00 24.51 H new ATOM 0 HE21 GLN A 25 -2.781 -34.329 -19.539 1.00 41.21 H new ATOM 0 HE22 GLN A 25 -1.193 -33.574 -19.705 1.00 41.21 H new ATOM 367 N ILE A 26 -7.838 -30.953 -19.395 1.00 31.52 N ATOM 368 CA ILE A 26 -9.109 -31.586 -19.062 1.00 43.51 C ATOM 369 C ILE A 26 -9.942 -31.836 -20.315 1.00 72.10 C ATOM 370 O ILE A 26 -9.504 -31.560 -21.430 1.00 74.50 O ATOM 371 CB ILE A 26 -9.926 -30.726 -18.080 1.00 53.31 C ATOM 372 CG1 ILE A 26 -10.235 -29.361 -18.697 1.00 70.00 C ATOM 373 CG2 ILE A 26 -9.173 -30.562 -16.768 1.00 53.23 C ATOM 374 CD1 ILE A 26 -11.671 -29.213 -19.147 1.00 44.33 C ATOM 0 H ILE A 26 -7.912 -29.972 -19.663 1.00 31.52 H new ATOM 0 HA ILE A 26 -8.873 -32.539 -18.588 1.00 43.51 H new ATOM 0 HB ILE A 26 -10.869 -31.232 -17.875 1.00 53.31 H new ATOM 0 HG12 ILE A 26 -10.009 -28.582 -17.968 1.00 70.00 H new ATOM 0 HG13 ILE A 26 -9.577 -29.200 -19.551 1.00 70.00 H new ATOM 0 HG21 ILE A 26 -9.763 -29.952 -16.084 1.00 53.23 H new ATOM 0 HG22 ILE A 26 -9.000 -31.542 -16.323 1.00 53.23 H new ATOM 0 HG23 ILE A 26 -8.216 -30.075 -16.956 1.00 53.23 H new ATOM 0 HD11 ILE A 26 -11.818 -28.221 -19.574 1.00 44.33 H new ATOM 0 HD12 ILE A 26 -11.896 -29.969 -19.899 1.00 44.33 H new ATOM 0 HD13 ILE A 26 -12.335 -29.342 -18.292 1.00 44.33 H new ATOM 386 N GLY A 27 -11.149 -32.360 -20.122 1.00 34.03 N ATOM 387 CA GLY A 27 -12.026 -32.638 -21.243 1.00 51.40 C ATOM 388 C GLY A 27 -13.416 -32.065 -21.049 1.00 43.34 C ATOM 389 O GLY A 27 -13.840 -31.819 -19.919 1.00 62.43 O ATOM 0 H GLY A 27 -11.535 -32.597 -19.208 1.00 34.03 H new ATOM 0 HA2 GLY A 27 -11.590 -32.225 -22.152 1.00 51.40 H new ATOM 0 HA3 GLY A 27 -12.098 -33.716 -21.385 1.00 51.40 H new ATOM 393 N ASP A 28 -14.127 -31.852 -22.151 1.00 72.03 N ATOM 394 CA ASP A 28 -15.477 -31.303 -22.096 1.00 72.25 C ATOM 395 C ASP A 28 -16.387 -32.185 -21.245 1.00 30.43 C ATOM 396 O ASP A 28 -17.330 -31.699 -20.621 1.00 45.30 O ATOM 397 CB ASP A 28 -16.053 -31.166 -23.507 1.00 20.12 C ATOM 398 CG ASP A 28 -16.517 -32.493 -24.073 1.00 62.32 C ATOM 399 OD1 ASP A 28 -15.661 -33.373 -24.304 1.00 61.43 O ATOM 400 OD2 ASP A 28 -17.737 -32.653 -24.285 1.00 15.13 O ATOM 0 H ASP A 28 -13.791 -32.051 -23.093 1.00 72.03 H new ATOM 0 HA ASP A 28 -15.423 -30.316 -21.637 1.00 72.25 H new ATOM 0 HB2 ASP A 28 -16.891 -30.469 -23.488 1.00 20.12 H new ATOM 0 HB3 ASP A 28 -15.297 -30.738 -24.165 1.00 20.12 H new ATOM 405 N SER A 29 -16.098 -33.482 -21.228 1.00 34.14 N ATOM 406 CA SER A 29 -16.893 -34.431 -20.457 1.00 40.21 C ATOM 407 C SER A 29 -16.500 -34.399 -18.984 1.00 24.42 C ATOM 408 O SER A 29 -17.196 -34.953 -18.133 1.00 3.01 O ATOM 409 CB SER A 29 -16.715 -35.846 -21.013 1.00 63.34 C ATOM 410 OG SER A 29 -17.375 -36.800 -20.200 1.00 42.24 O ATOM 0 H SER A 29 -15.320 -33.900 -21.739 1.00 34.14 H new ATOM 0 HA SER A 29 -17.941 -34.143 -20.541 1.00 40.21 H new ATOM 0 HB2 SER A 29 -17.109 -35.894 -22.028 1.00 63.34 H new ATOM 0 HB3 SER A 29 -15.653 -36.086 -21.072 1.00 63.34 H new ATOM 0 HG SER A 29 -17.603 -36.394 -19.338 1.00 42.24 H new ATOM 416 N GLU A 30 -15.379 -33.747 -18.690 1.00 3.41 N ATOM 417 CA GLU A 30 -14.894 -33.643 -17.319 1.00 21.44 C ATOM 418 C GLU A 30 -14.923 -32.195 -16.840 1.00 70.14 C ATOM 419 O GLU A 30 -14.555 -31.898 -15.703 1.00 61.05 O ATOM 420 CB GLU A 30 -13.471 -34.196 -17.216 1.00 71.22 C ATOM 421 CG GLU A 30 -13.212 -35.384 -18.128 1.00 52.14 C ATOM 422 CD GLU A 30 -14.315 -36.423 -18.059 1.00 63.22 C ATOM 423 OE1 GLU A 30 -14.902 -36.592 -16.971 1.00 62.15 O ATOM 424 OE2 GLU A 30 -14.589 -37.066 -19.094 1.00 33.44 O ATOM 0 H GLU A 30 -14.791 -33.284 -19.382 1.00 3.41 H new ATOM 0 HA GLU A 30 -15.553 -34.232 -16.682 1.00 21.44 H new ATOM 0 HB2 GLU A 30 -12.764 -33.403 -17.457 1.00 71.22 H new ATOM 0 HB3 GLU A 30 -13.279 -34.492 -16.185 1.00 71.22 H new ATOM 0 HG2 GLU A 30 -13.111 -35.034 -19.155 1.00 52.14 H new ATOM 0 HG3 GLU A 30 -12.264 -35.847 -17.855 1.00 52.14 H new ATOM 431 N PHE A 31 -15.366 -31.297 -17.714 1.00 51.15 N ATOM 432 CA PHE A 31 -15.443 -29.880 -17.381 1.00 15.33 C ATOM 433 C PHE A 31 -16.121 -29.674 -16.030 1.00 52.25 C ATOM 434 O PHE A 31 -15.470 -29.342 -15.040 1.00 53.02 O ATOM 435 CB PHE A 31 -16.205 -29.120 -18.469 1.00 75.15 C ATOM 436 CG PHE A 31 -16.499 -27.691 -18.108 1.00 65.24 C ATOM 437 CD1 PHE A 31 -15.469 -26.806 -17.832 1.00 33.35 C ATOM 438 CD2 PHE A 31 -17.805 -27.234 -18.046 1.00 72.53 C ATOM 439 CE1 PHE A 31 -15.738 -25.492 -17.500 1.00 31.30 C ATOM 440 CE2 PHE A 31 -18.079 -25.921 -17.713 1.00 51.23 C ATOM 441 CZ PHE A 31 -17.044 -25.048 -17.441 1.00 13.43 C ATOM 0 H PHE A 31 -15.677 -31.526 -18.658 1.00 51.15 H new ATOM 0 HA PHE A 31 -14.427 -29.491 -17.320 1.00 15.33 H new ATOM 0 HB2 PHE A 31 -15.624 -29.141 -19.391 1.00 75.15 H new ATOM 0 HB3 PHE A 31 -17.144 -29.636 -18.672 1.00 75.15 H new ATOM 0 HD1 PHE A 31 -14.445 -27.147 -17.877 1.00 33.35 H new ATOM 0 HD2 PHE A 31 -18.618 -27.911 -18.260 1.00 72.53 H new ATOM 0 HE1 PHE A 31 -14.926 -24.812 -17.287 1.00 31.30 H new ATOM 0 HE2 PHE A 31 -19.102 -25.578 -17.666 1.00 51.23 H new ATOM 0 HZ PHE A 31 -17.256 -24.021 -17.183 1.00 13.43 H new ATOM 451 N ASP A 32 -17.434 -29.872 -15.999 1.00 14.24 N ATOM 452 CA ASP A 32 -18.203 -29.710 -14.770 1.00 72.32 C ATOM 453 C ASP A 32 -17.842 -30.792 -13.756 1.00 72.42 C ATOM 454 O ASP A 32 -18.009 -30.607 -12.551 1.00 33.44 O ATOM 455 CB ASP A 32 -19.702 -29.755 -15.071 1.00 63.01 C ATOM 456 CG ASP A 32 -20.125 -31.061 -15.714 1.00 24.01 C ATOM 457 OD1 ASP A 32 -20.184 -32.083 -14.999 1.00 24.23 O ATOM 458 OD2 ASP A 32 -20.396 -31.062 -16.933 1.00 50.53 O ATOM 0 H ASP A 32 -17.988 -30.145 -16.811 1.00 14.24 H new ATOM 0 HA ASP A 32 -17.956 -28.739 -14.341 1.00 72.32 H new ATOM 0 HB2 ASP A 32 -20.260 -29.612 -14.146 1.00 63.01 H new ATOM 0 HB3 ASP A 32 -19.962 -28.928 -15.731 1.00 63.01 H new ATOM 463 N ASN A 33 -17.349 -31.921 -14.254 1.00 0.41 N ATOM 464 CA ASN A 33 -16.966 -33.033 -13.391 1.00 71.43 C ATOM 465 C ASN A 33 -16.025 -32.566 -12.286 1.00 5.31 C ATOM 466 O ASN A 33 -16.079 -33.058 -11.159 1.00 42.22 O ATOM 467 CB ASN A 33 -16.298 -34.137 -14.214 1.00 3.30 C ATOM 468 CG ASN A 33 -16.355 -35.487 -13.524 1.00 61.22 C ATOM 469 OD1 ASN A 33 -15.401 -35.900 -12.866 1.00 43.52 O ATOM 470 ND2 ASN A 33 -17.477 -36.181 -13.675 1.00 2.02 N ATOM 0 H ASN A 33 -17.205 -32.090 -15.250 1.00 0.41 H new ATOM 0 HA ASN A 33 -17.870 -33.430 -12.929 1.00 71.43 H new ATOM 0 HB2 ASN A 33 -16.786 -34.208 -15.186 1.00 3.30 H new ATOM 0 HB3 ASN A 33 -15.257 -33.870 -14.399 1.00 3.30 H new ATOM 0 HD21 ASN A 33 -17.573 -37.097 -13.236 1.00 2.02 H new ATOM 0 HD22 ASN A 33 -18.243 -35.798 -14.230 1.00 2.02 H new ATOM 477 N LYS A 34 -15.161 -31.612 -12.617 1.00 61.14 N ATOM 478 CA LYS A 34 -14.207 -31.076 -11.653 1.00 61.34 C ATOM 479 C LYS A 34 -14.489 -29.603 -11.371 1.00 34.21 C ATOM 480 O LYS A 34 -14.181 -29.097 -10.292 1.00 0.52 O ATOM 481 CB LYS A 34 -12.777 -31.241 -12.173 1.00 4.45 C ATOM 482 CG LYS A 34 -12.567 -30.676 -13.567 1.00 54.12 C ATOM 483 CD LYS A 34 -11.970 -31.712 -14.505 1.00 72.43 C ATOM 484 CE LYS A 34 -10.495 -31.941 -14.214 1.00 73.13 C ATOM 485 NZ LYS A 34 -10.294 -32.884 -13.078 1.00 34.51 N ATOM 0 H LYS A 34 -15.102 -31.194 -13.546 1.00 61.14 H new ATOM 0 HA LYS A 34 -14.316 -31.634 -10.723 1.00 61.34 H new ATOM 0 HB2 LYS A 34 -12.090 -30.750 -11.484 1.00 4.45 H new ATOM 0 HB3 LYS A 34 -12.521 -32.301 -12.177 1.00 4.45 H new ATOM 0 HG2 LYS A 34 -13.519 -30.328 -13.967 1.00 54.12 H new ATOM 0 HG3 LYS A 34 -11.908 -29.809 -13.514 1.00 54.12 H new ATOM 0 HD2 LYS A 34 -12.512 -32.652 -14.404 1.00 72.43 H new ATOM 0 HD3 LYS A 34 -12.092 -31.383 -15.537 1.00 72.43 H new ATOM 0 HE2 LYS A 34 -10.006 -32.336 -15.105 1.00 73.13 H new ATOM 0 HE3 LYS A 34 -10.018 -30.988 -13.984 1.00 73.13 H new ATOM 0 HZ1 LYS A 34 -9.371 -33.354 -13.176 1.00 34.51 H new ATOM 0 HZ2 LYS A 34 -10.322 -32.358 -12.181 1.00 34.51 H new ATOM 0 HZ3 LYS A 34 -11.049 -33.600 -13.083 1.00 34.51 H new ATOM 499 N VAL A 35 -15.079 -28.921 -12.347 1.00 34.33 N ATOM 500 CA VAL A 35 -15.405 -27.506 -12.203 1.00 51.44 C ATOM 501 C VAL A 35 -16.566 -27.306 -11.236 1.00 12.33 C ATOM 502 O VAL A 35 -16.475 -26.521 -10.292 1.00 34.24 O ATOM 503 CB VAL A 35 -15.765 -26.873 -13.559 1.00 22.45 C ATOM 504 CG1 VAL A 35 -16.437 -25.522 -13.356 1.00 52.31 C ATOM 505 CG2 VAL A 35 -14.525 -26.735 -14.429 1.00 15.43 C ATOM 0 H VAL A 35 -15.341 -29.325 -13.246 1.00 34.33 H new ATOM 0 HA VAL A 35 -14.517 -27.015 -11.806 1.00 51.44 H new ATOM 0 HB VAL A 35 -16.469 -27.529 -14.071 1.00 22.45 H new ATOM 0 HG11 VAL A 35 -16.684 -25.089 -14.325 1.00 52.31 H new ATOM 0 HG12 VAL A 35 -17.349 -25.653 -12.774 1.00 52.31 H new ATOM 0 HG13 VAL A 35 -15.759 -24.855 -12.823 1.00 52.31 H new ATOM 0 HG21 VAL A 35 -14.799 -26.286 -15.384 1.00 15.43 H new ATOM 0 HG22 VAL A 35 -13.796 -26.101 -13.925 1.00 15.43 H new ATOM 0 HG23 VAL A 35 -14.091 -27.720 -14.603 1.00 15.43 H new ATOM 515 N THR A 36 -17.659 -28.024 -11.476 1.00 23.22 N ATOM 516 CA THR A 36 -18.840 -27.925 -10.627 1.00 25.31 C ATOM 517 C THR A 36 -18.585 -28.539 -9.256 1.00 21.25 C ATOM 518 O THR A 36 -19.284 -28.237 -8.289 1.00 61.41 O ATOM 519 CB THR A 36 -20.055 -28.621 -11.271 1.00 24.40 C ATOM 520 OG1 THR A 36 -21.251 -27.893 -10.972 1.00 52.21 O ATOM 521 CG2 THR A 36 -20.187 -30.051 -10.769 1.00 14.11 C ATOM 0 H THR A 36 -17.751 -28.680 -12.251 1.00 23.22 H new ATOM 0 HA THR A 36 -19.058 -26.863 -10.511 1.00 25.31 H new ATOM 0 HB THR A 36 -19.904 -28.644 -12.350 1.00 24.40 H new ATOM 0 HG1 THR A 36 -22.018 -28.340 -11.386 1.00 52.21 H new ATOM 0 HG21 THR A 36 -21.051 -30.523 -11.237 1.00 14.11 H new ATOM 0 HG22 THR A 36 -19.287 -30.610 -11.023 1.00 14.11 H new ATOM 0 HG23 THR A 36 -20.318 -30.046 -9.687 1.00 14.11 H new ATOM 529 N SER A 37 -17.578 -29.403 -9.179 1.00 14.22 N ATOM 530 CA SER A 37 -17.231 -30.063 -7.925 1.00 52.32 C ATOM 531 C SER A 37 -16.394 -29.145 -7.040 1.00 53.20 C ATOM 532 O SER A 37 -16.365 -29.299 -5.818 1.00 32.53 O ATOM 533 CB SER A 37 -16.467 -31.360 -8.200 1.00 12.31 C ATOM 534 OG SER A 37 -15.894 -31.877 -7.012 1.00 23.30 O ATOM 0 H SER A 37 -16.988 -29.663 -9.970 1.00 14.22 H new ATOM 0 HA SER A 37 -18.157 -30.299 -7.400 1.00 52.32 H new ATOM 0 HB2 SER A 37 -17.142 -32.098 -8.633 1.00 12.31 H new ATOM 0 HB3 SER A 37 -15.683 -31.175 -8.935 1.00 12.31 H new ATOM 0 HG SER A 37 -15.413 -32.706 -7.215 1.00 23.30 H new ATOM 540 N CYS A 38 -15.716 -28.188 -7.666 1.00 31.15 N ATOM 541 CA CYS A 38 -14.877 -27.244 -6.937 1.00 55.44 C ATOM 542 C CYS A 38 -15.691 -26.490 -5.890 1.00 24.01 C ATOM 543 O CYS A 38 -16.386 -25.525 -6.206 1.00 1.31 O ATOM 544 CB CYS A 38 -14.227 -26.254 -7.905 1.00 50.43 C ATOM 545 SG CYS A 38 -12.891 -25.278 -7.176 1.00 51.34 S ATOM 0 H CYS A 38 -15.731 -28.046 -8.676 1.00 31.15 H new ATOM 0 HA CYS A 38 -14.096 -27.808 -6.427 1.00 55.44 H new ATOM 0 HB2 CYS A 38 -13.836 -26.803 -8.761 1.00 50.43 H new ATOM 0 HB3 CYS A 38 -14.993 -25.577 -8.284 1.00 50.43 H new ATOM 0 HG CYS A 38 -13.350 -24.600 -6.166 1.00 51.34 H new ATOM 551 N ASN A 39 -15.600 -26.938 -4.642 1.00 43.53 N ATOM 552 CA ASN A 39 -16.330 -26.308 -3.547 1.00 34.53 C ATOM 553 C ASN A 39 -15.396 -25.460 -2.688 1.00 40.14 C ATOM 554 O ASN A 39 -15.745 -25.071 -1.573 1.00 34.52 O ATOM 555 CB ASN A 39 -17.014 -27.368 -2.684 1.00 62.21 C ATOM 556 CG ASN A 39 -18.021 -26.770 -1.722 1.00 2.12 C ATOM 557 OD1 ASN A 39 -17.720 -26.548 -0.549 1.00 62.30 O ATOM 558 ND2 ASN A 39 -19.225 -26.506 -2.215 1.00 54.11 N ATOM 0 H ASN A 39 -15.028 -27.735 -4.363 1.00 43.53 H new ATOM 0 HA ASN A 39 -17.090 -25.657 -3.978 1.00 34.53 H new ATOM 0 HB2 ASN A 39 -17.516 -28.089 -3.329 1.00 62.21 H new ATOM 0 HB3 ASN A 39 -16.259 -27.916 -2.121 1.00 62.21 H new ATOM 0 HD21 ASN A 39 -19.945 -26.103 -1.615 1.00 54.11 H new ATOM 0 HD22 ASN A 39 -19.430 -26.706 -3.194 1.00 54.11 H new ATOM 565 N ASP A 40 -14.209 -25.179 -3.215 1.00 45.34 N ATOM 566 CA ASP A 40 -13.225 -24.377 -2.497 1.00 20.02 C ATOM 567 C ASP A 40 -13.237 -22.933 -2.991 1.00 50.34 C ATOM 568 O ASP A 40 -12.327 -22.159 -2.697 1.00 73.13 O ATOM 569 CB ASP A 40 -11.828 -24.975 -2.664 1.00 44.11 C ATOM 570 CG ASP A 40 -11.514 -26.015 -1.607 1.00 41.31 C ATOM 571 OD1 ASP A 40 -12.239 -27.029 -1.537 1.00 41.24 O ATOM 572 OD2 ASP A 40 -10.542 -25.815 -0.849 1.00 0.11 O ATOM 0 H ASP A 40 -13.905 -25.494 -4.136 1.00 45.34 H new ATOM 0 HA ASP A 40 -13.489 -24.383 -1.440 1.00 20.02 H new ATOM 0 HB2 ASP A 40 -11.746 -25.429 -3.652 1.00 44.11 H new ATOM 0 HB3 ASP A 40 -11.086 -24.178 -2.617 1.00 44.11 H new ATOM 577 N ASN A 41 -14.272 -22.579 -3.745 1.00 64.15 N ATOM 578 CA ASN A 41 -14.402 -21.229 -4.281 1.00 33.45 C ATOM 579 C ASN A 41 -13.127 -20.809 -5.008 1.00 33.24 C ATOM 580 O ASN A 41 -12.686 -19.664 -4.898 1.00 50.23 O ATOM 581 CB ASN A 41 -14.712 -20.238 -3.158 1.00 65.20 C ATOM 582 CG ASN A 41 -16.180 -20.233 -2.780 1.00 23.13 C ATOM 583 OD1 ASN A 41 -16.532 -20.357 -1.607 1.00 25.31 O ATOM 584 ND2 ASN A 41 -17.046 -20.088 -3.776 1.00 63.34 N ATOM 0 H ASN A 41 -15.033 -23.208 -3.999 1.00 64.15 H new ATOM 0 HA ASN A 41 -15.226 -21.226 -4.995 1.00 33.45 H new ATOM 0 HB2 ASN A 41 -14.115 -20.488 -2.281 1.00 65.20 H new ATOM 0 HB3 ASN A 41 -14.416 -19.236 -3.469 1.00 65.20 H new ATOM 0 HD21 ASN A 41 -18.048 -20.076 -3.583 1.00 63.34 H new ATOM 0 HD22 ASN A 41 -16.710 -19.988 -4.734 1.00 63.34 H new ATOM 591 N ILE A 42 -12.540 -21.742 -5.750 1.00 30.15 N ATOM 592 CA ILE A 42 -11.318 -21.468 -6.495 1.00 31.32 C ATOM 593 C ILE A 42 -11.628 -21.114 -7.947 1.00 41.34 C ATOM 594 O ILE A 42 -12.486 -21.733 -8.579 1.00 12.51 O ATOM 595 CB ILE A 42 -10.359 -22.672 -6.466 1.00 40.33 C ATOM 596 CG1 ILE A 42 -10.196 -23.187 -5.034 1.00 31.15 C ATOM 597 CG2 ILE A 42 -9.009 -22.287 -7.053 1.00 3.31 C ATOM 598 CD1 ILE A 42 -9.305 -24.404 -4.927 1.00 74.15 C ATOM 0 H ILE A 42 -12.891 -22.694 -5.851 1.00 30.15 H new ATOM 0 HA ILE A 42 -10.836 -20.619 -6.010 1.00 31.32 H new ATOM 0 HB ILE A 42 -10.783 -23.471 -7.074 1.00 40.33 H new ATOM 0 HG12 ILE A 42 -9.785 -22.390 -4.415 1.00 31.15 H new ATOM 0 HG13 ILE A 42 -11.179 -23.430 -4.630 1.00 31.15 H new ATOM 0 HG21 ILE A 42 -8.341 -23.148 -7.026 1.00 3.31 H new ATOM 0 HG22 ILE A 42 -9.140 -21.962 -8.085 1.00 3.31 H new ATOM 0 HG23 ILE A 42 -8.577 -21.474 -6.469 1.00 3.31 H new ATOM 0 HD11 ILE A 42 -9.235 -24.713 -3.884 1.00 74.15 H new ATOM 0 HD12 ILE A 42 -9.726 -25.216 -5.519 1.00 74.15 H new ATOM 0 HD13 ILE A 42 -8.310 -24.161 -5.301 1.00 74.15 H new ATOM 610 N LEU A 43 -10.923 -20.117 -8.470 1.00 40.54 N ATOM 611 CA LEU A 43 -11.119 -19.682 -9.848 1.00 63.50 C ATOM 612 C LEU A 43 -10.316 -20.547 -10.813 1.00 24.21 C ATOM 613 O LEU A 43 -9.086 -20.487 -10.839 1.00 62.32 O ATOM 614 CB LEU A 43 -10.715 -18.214 -10.003 1.00 50.44 C ATOM 615 CG LEU A 43 -11.278 -17.249 -8.959 1.00 62.42 C ATOM 616 CD1 LEU A 43 -10.366 -16.043 -8.800 1.00 51.24 C ATOM 617 CD2 LEU A 43 -12.683 -16.809 -9.345 1.00 42.21 C ATOM 0 H LEU A 43 -10.210 -19.595 -7.960 1.00 40.54 H new ATOM 0 HA LEU A 43 -12.177 -19.789 -10.089 1.00 63.50 H new ATOM 0 HB2 LEU A 43 -9.627 -18.153 -9.976 1.00 50.44 H new ATOM 0 HB3 LEU A 43 -11.029 -17.874 -10.990 1.00 50.44 H new ATOM 0 HG LEU A 43 -11.330 -17.768 -8.002 1.00 62.42 H new ATOM 0 HD11 LEU A 43 -10.783 -15.367 -8.053 1.00 51.24 H new ATOM 0 HD12 LEU A 43 -9.378 -16.374 -8.479 1.00 51.24 H new ATOM 0 HD13 LEU A 43 -10.282 -15.522 -9.754 1.00 51.24 H new ATOM 0 HD21 LEU A 43 -13.069 -16.123 -8.592 1.00 42.21 H new ATOM 0 HD22 LEU A 43 -12.654 -16.307 -10.312 1.00 42.21 H new ATOM 0 HD23 LEU A 43 -13.333 -17.682 -9.408 1.00 42.21 H new ATOM 629 N ILE A 44 -11.018 -21.350 -11.605 1.00 21.31 N ATOM 630 CA ILE A 44 -10.370 -22.226 -12.574 1.00 65.53 C ATOM 631 C ILE A 44 -10.107 -21.495 -13.885 1.00 4.02 C ATOM 632 O ILE A 44 -11.005 -21.339 -14.713 1.00 24.12 O ATOM 633 CB ILE A 44 -11.220 -23.478 -12.858 1.00 53.24 C ATOM 634 CG1 ILE A 44 -11.365 -24.322 -11.590 1.00 74.33 C ATOM 635 CG2 ILE A 44 -10.597 -24.298 -13.978 1.00 30.21 C ATOM 636 CD1 ILE A 44 -12.594 -23.984 -10.775 1.00 1.45 C ATOM 0 H ILE A 44 -12.036 -21.412 -11.595 1.00 21.31 H new ATOM 0 HA ILE A 44 -9.421 -22.534 -12.136 1.00 65.53 H new ATOM 0 HB ILE A 44 -12.213 -23.160 -13.175 1.00 53.24 H new ATOM 0 HG12 ILE A 44 -11.401 -25.376 -11.867 1.00 74.33 H new ATOM 0 HG13 ILE A 44 -10.479 -24.186 -10.970 1.00 74.33 H new ATOM 0 HG21 ILE A 44 -11.209 -25.180 -14.167 1.00 30.21 H new ATOM 0 HG22 ILE A 44 -10.541 -23.694 -14.884 1.00 30.21 H new ATOM 0 HG23 ILE A 44 -9.594 -24.609 -13.687 1.00 30.21 H new ATOM 0 HD11 ILE A 44 -12.631 -24.621 -9.892 1.00 1.45 H new ATOM 0 HD12 ILE A 44 -12.550 -22.939 -10.467 1.00 1.45 H new ATOM 0 HD13 ILE A 44 -13.487 -24.147 -11.378 1.00 1.45 H new ATOM 648 N LEU A 45 -8.869 -21.048 -14.070 1.00 43.35 N ATOM 649 CA LEU A 45 -8.486 -20.335 -15.283 1.00 3.23 C ATOM 650 C LEU A 45 -8.238 -21.307 -16.432 1.00 11.21 C ATOM 651 O LEU A 45 -7.187 -21.943 -16.505 1.00 74.13 O ATOM 652 CB LEU A 45 -7.232 -19.496 -15.030 1.00 44.40 C ATOM 653 CG LEU A 45 -7.465 -18.092 -14.473 1.00 62.25 C ATOM 654 CD1 LEU A 45 -8.064 -17.187 -15.539 1.00 40.02 C ATOM 655 CD2 LEU A 45 -8.368 -18.146 -13.250 1.00 41.32 C ATOM 0 H LEU A 45 -8.114 -21.167 -13.395 1.00 43.35 H new ATOM 0 HA LEU A 45 -9.308 -19.675 -15.562 1.00 3.23 H new ATOM 0 HB2 LEU A 45 -6.590 -20.039 -14.336 1.00 44.40 H new ATOM 0 HB3 LEU A 45 -6.684 -19.407 -15.968 1.00 44.40 H new ATOM 0 HG LEU A 45 -6.503 -17.678 -14.172 1.00 62.25 H new ATOM 0 HD11 LEU A 45 -8.223 -16.192 -15.124 1.00 40.02 H new ATOM 0 HD12 LEU A 45 -7.382 -17.122 -16.387 1.00 40.02 H new ATOM 0 HD13 LEU A 45 -9.017 -17.598 -15.871 1.00 40.02 H new ATOM 0 HD21 LEU A 45 -8.523 -17.137 -12.867 1.00 41.32 H new ATOM 0 HD22 LEU A 45 -9.329 -18.581 -13.526 1.00 41.32 H new ATOM 0 HD23 LEU A 45 -7.900 -18.759 -12.479 1.00 41.32 H new ATOM 667 N VAL A 46 -9.213 -21.416 -17.330 1.00 2.42 N ATOM 668 CA VAL A 46 -9.099 -22.308 -18.477 1.00 64.44 C ATOM 669 C VAL A 46 -8.596 -21.561 -19.706 1.00 14.45 C ATOM 670 O VAL A 46 -9.244 -20.632 -20.190 1.00 14.22 O ATOM 671 CB VAL A 46 -10.450 -22.969 -18.809 1.00 13.24 C ATOM 672 CG1 VAL A 46 -10.310 -23.898 -20.006 1.00 34.10 C ATOM 673 CG2 VAL A 46 -10.987 -23.721 -17.601 1.00 71.13 C ATOM 0 H VAL A 46 -10.090 -20.897 -17.285 1.00 2.42 H new ATOM 0 HA VAL A 46 -8.380 -23.082 -18.207 1.00 64.44 H new ATOM 0 HB VAL A 46 -11.163 -22.186 -19.067 1.00 13.24 H new ATOM 0 HG11 VAL A 46 -11.274 -24.356 -20.226 1.00 34.10 H new ATOM 0 HG12 VAL A 46 -9.973 -23.328 -20.872 1.00 34.10 H new ATOM 0 HG13 VAL A 46 -9.582 -24.677 -19.779 1.00 34.10 H new ATOM 0 HG21 VAL A 46 -11.942 -24.181 -17.854 1.00 71.13 H new ATOM 0 HG22 VAL A 46 -10.277 -24.495 -17.309 1.00 71.13 H new ATOM 0 HG23 VAL A 46 -11.127 -23.026 -16.773 1.00 71.13 H new ATOM 683 N ASP A 47 -7.436 -21.971 -20.207 1.00 71.33 N ATOM 684 CA ASP A 47 -6.845 -21.341 -21.382 1.00 75.44 C ATOM 685 C ASP A 47 -6.875 -22.287 -22.579 1.00 44.42 C ATOM 686 O ASP A 47 -6.877 -23.507 -22.418 1.00 2.15 O ATOM 687 CB ASP A 47 -5.404 -20.916 -21.089 1.00 2.13 C ATOM 688 CG ASP A 47 -4.772 -20.176 -22.250 1.00 51.30 C ATOM 689 OD1 ASP A 47 -5.353 -19.165 -22.698 1.00 25.30 O ATOM 690 OD2 ASP A 47 -3.694 -20.605 -22.712 1.00 35.11 O ATOM 0 H ASP A 47 -6.886 -22.737 -19.818 1.00 71.33 H new ATOM 0 HA ASP A 47 -7.435 -20.457 -21.625 1.00 75.44 H new ATOM 0 HB2 ASP A 47 -5.389 -20.279 -20.204 1.00 2.13 H new ATOM 0 HB3 ASP A 47 -4.808 -21.799 -20.857 1.00 2.13 H new ATOM 695 N PHE A 48 -6.900 -21.715 -23.778 1.00 52.31 N ATOM 696 CA PHE A 48 -6.933 -22.507 -25.002 1.00 61.22 C ATOM 697 C PHE A 48 -5.710 -23.414 -25.096 1.00 3.21 C ATOM 698 O PHE A 48 -4.932 -23.525 -24.149 1.00 44.32 O ATOM 699 CB PHE A 48 -6.997 -21.589 -26.225 1.00 14.53 C ATOM 700 CG PHE A 48 -5.659 -21.046 -26.638 1.00 12.12 C ATOM 701 CD1 PHE A 48 -4.860 -20.373 -25.727 1.00 11.40 C ATOM 702 CD2 PHE A 48 -5.201 -21.206 -27.935 1.00 52.21 C ATOM 703 CE1 PHE A 48 -3.628 -19.871 -26.104 1.00 0.41 C ATOM 704 CE2 PHE A 48 -3.970 -20.707 -28.318 1.00 54.22 C ATOM 705 CZ PHE A 48 -3.183 -20.039 -27.401 1.00 2.15 C ATOM 0 H PHE A 48 -6.898 -20.706 -23.928 1.00 52.31 H new ATOM 0 HA PHE A 48 -7.825 -23.132 -24.978 1.00 61.22 H new ATOM 0 HB2 PHE A 48 -7.430 -22.139 -27.060 1.00 14.53 H new ATOM 0 HB3 PHE A 48 -7.667 -20.757 -26.010 1.00 14.53 H new ATOM 0 HD1 PHE A 48 -5.203 -20.239 -24.712 1.00 11.40 H new ATOM 0 HD2 PHE A 48 -5.813 -21.727 -28.656 1.00 52.21 H new ATOM 0 HE1 PHE A 48 -3.014 -19.348 -25.385 1.00 0.41 H new ATOM 0 HE2 PHE A 48 -3.624 -20.839 -29.333 1.00 54.22 H new ATOM 0 HZ PHE A 48 -2.221 -19.648 -27.697 1.00 2.15 H new ATOM 884 N GLU A 60 3.427 -16.695 -21.811 1.00 12.25 N ATOM 885 CA GLU A 60 2.953 -16.007 -20.617 1.00 32.45 C ATOM 886 C GLU A 60 3.009 -16.928 -19.401 1.00 55.42 C ATOM 887 O GLU A 60 1.984 -17.322 -18.842 1.00 62.12 O ATOM 888 CB GLU A 60 1.522 -15.505 -20.824 1.00 30.34 C ATOM 889 CG GLU A 60 0.680 -16.411 -21.705 1.00 32.33 C ATOM 890 CD GLU A 60 0.745 -17.865 -21.276 1.00 23.13 C ATOM 891 OE1 GLU A 60 0.047 -18.230 -20.307 1.00 50.14 O ATOM 892 OE2 GLU A 60 1.494 -18.637 -21.911 1.00 35.42 O ATOM 0 HA GLU A 60 3.607 -15.154 -20.437 1.00 32.45 H new ATOM 0 HB2 GLU A 60 1.037 -15.404 -19.853 1.00 30.34 H new ATOM 0 HB3 GLU A 60 1.556 -14.510 -21.268 1.00 30.34 H new ATOM 0 HG2 GLU A 60 -0.357 -16.075 -21.680 1.00 32.33 H new ATOM 0 HG3 GLU A 60 1.019 -16.325 -22.737 1.00 32.33 H new ATOM 899 N PRO A 61 4.232 -17.280 -18.981 1.00 14.41 N ATOM 900 CA PRO A 61 4.452 -18.159 -17.828 1.00 50.20 C ATOM 901 C PRO A 61 4.088 -17.486 -16.509 1.00 41.53 C ATOM 902 O PRO A 61 4.047 -18.132 -15.464 1.00 22.32 O ATOM 903 CB PRO A 61 5.954 -18.447 -17.884 1.00 62.02 C ATOM 904 CG PRO A 61 6.538 -17.282 -18.606 1.00 1.52 C ATOM 905 CD PRO A 61 5.497 -16.849 -19.601 1.00 3.21 C ATOM 0 HA PRO A 61 3.830 -19.053 -17.872 1.00 50.20 H new ATOM 0 HB2 PRO A 61 6.376 -18.544 -16.884 1.00 62.02 H new ATOM 0 HB3 PRO A 61 6.159 -19.380 -18.408 1.00 62.02 H new ATOM 0 HG2 PRO A 61 6.777 -16.474 -17.915 1.00 1.52 H new ATOM 0 HG3 PRO A 61 7.466 -17.558 -19.107 1.00 1.52 H new ATOM 0 HD2 PRO A 61 5.519 -15.771 -19.762 1.00 3.21 H new ATOM 0 HD3 PRO A 61 5.649 -17.320 -20.572 1.00 3.21 H new ATOM 913 N GLN A 62 3.822 -16.184 -16.568 1.00 11.15 N ATOM 914 CA GLN A 62 3.461 -15.425 -15.377 1.00 4.33 C ATOM 915 C GLN A 62 2.238 -16.030 -14.696 1.00 54.12 C ATOM 916 O GLN A 62 2.121 -16.005 -13.469 1.00 64.54 O ATOM 917 CB GLN A 62 3.187 -13.965 -15.741 1.00 70.43 C ATOM 918 CG GLN A 62 4.336 -13.295 -16.477 1.00 42.43 C ATOM 919 CD GLN A 62 3.876 -12.157 -17.366 1.00 2.22 C ATOM 920 OE1 GLN A 62 4.393 -11.042 -17.285 1.00 72.41 O ATOM 921 NE2 GLN A 62 2.899 -12.432 -18.221 1.00 53.33 N ATOM 0 H GLN A 62 3.850 -15.634 -17.427 1.00 11.15 H new ATOM 0 HA GLN A 62 4.299 -15.467 -14.682 1.00 4.33 H new ATOM 0 HB2 GLN A 62 2.292 -13.916 -16.361 1.00 70.43 H new ATOM 0 HB3 GLN A 62 2.975 -13.406 -14.830 1.00 70.43 H new ATOM 0 HG2 GLN A 62 5.055 -12.916 -15.751 1.00 42.43 H new ATOM 0 HG3 GLN A 62 4.856 -14.037 -17.083 1.00 42.43 H new ATOM 0 HE21 GLN A 62 2.499 -13.370 -18.254 1.00 53.33 H new ATOM 0 HE22 GLN A 62 2.548 -11.705 -18.845 1.00 53.33 H new ATOM 930 N LEU A 63 1.328 -16.572 -15.497 1.00 3.30 N ATOM 931 CA LEU A 63 0.112 -17.183 -14.972 1.00 51.52 C ATOM 932 C LEU A 63 0.445 -18.361 -14.062 1.00 11.10 C ATOM 933 O LEU A 63 -0.109 -18.489 -12.970 1.00 50.22 O ATOM 934 CB LEU A 63 -0.784 -17.650 -16.120 1.00 63.14 C ATOM 935 CG LEU A 63 -1.606 -16.563 -16.815 1.00 4.31 C ATOM 936 CD1 LEU A 63 -2.177 -17.081 -18.126 1.00 33.34 C ATOM 937 CD2 LEU A 63 -2.720 -16.073 -15.903 1.00 44.21 C ATOM 0 H LEU A 63 1.409 -16.601 -16.513 1.00 3.30 H new ATOM 0 HA LEU A 63 -0.419 -16.433 -14.386 1.00 51.52 H new ATOM 0 HB2 LEU A 63 -0.158 -18.138 -16.867 1.00 63.14 H new ATOM 0 HB3 LEU A 63 -1.469 -18.406 -15.735 1.00 63.14 H new ATOM 0 HG LEU A 63 -0.948 -15.723 -17.036 1.00 4.31 H new ATOM 0 HD11 LEU A 63 -2.759 -16.294 -18.606 1.00 33.34 H new ATOM 0 HD12 LEU A 63 -1.362 -17.382 -18.784 1.00 33.34 H new ATOM 0 HD13 LEU A 63 -2.820 -17.939 -17.929 1.00 33.34 H new ATOM 0 HD21 LEU A 63 -3.295 -15.300 -16.413 1.00 44.21 H new ATOM 0 HD22 LEU A 63 -3.376 -16.906 -15.650 1.00 44.21 H new ATOM 0 HD23 LEU A 63 -2.289 -15.661 -14.991 1.00 44.21 H new ATOM 949 N GLU A 64 1.355 -19.217 -14.517 1.00 45.21 N ATOM 950 CA GLU A 64 1.761 -20.382 -13.741 1.00 2.31 C ATOM 951 C GLU A 64 2.481 -19.961 -12.463 1.00 45.41 C ATOM 952 O GLU A 64 2.146 -20.416 -11.369 1.00 21.22 O ATOM 953 CB GLU A 64 2.669 -21.287 -14.576 1.00 23.31 C ATOM 954 CG GLU A 64 2.050 -21.723 -15.893 1.00 22.31 C ATOM 955 CD GLU A 64 3.090 -22.074 -16.940 1.00 12.53 C ATOM 956 OE1 GLU A 64 4.259 -22.296 -16.563 1.00 32.21 O ATOM 957 OE2 GLU A 64 2.733 -22.125 -18.136 1.00 51.52 O ATOM 0 H GLU A 64 1.824 -19.125 -15.418 1.00 45.21 H new ATOM 0 HA GLU A 64 0.862 -20.934 -13.466 1.00 2.31 H new ATOM 0 HB2 GLU A 64 3.603 -20.762 -14.779 1.00 23.31 H new ATOM 0 HB3 GLU A 64 2.921 -22.172 -13.992 1.00 23.31 H new ATOM 0 HG2 GLU A 64 1.408 -22.587 -15.720 1.00 22.31 H new ATOM 0 HG3 GLU A 64 1.413 -20.924 -16.273 1.00 22.31 H new ATOM 964 N LYS A 65 3.472 -19.089 -12.609 1.00 53.21 N ATOM 965 CA LYS A 65 4.241 -18.604 -11.468 1.00 34.44 C ATOM 966 C LYS A 65 3.316 -18.088 -10.370 1.00 3.12 C ATOM 967 O LYS A 65 3.433 -18.484 -9.209 1.00 2.53 O ATOM 968 CB LYS A 65 5.199 -17.495 -11.907 1.00 20.12 C ATOM 969 CG LYS A 65 6.608 -17.986 -12.190 1.00 22.54 C ATOM 970 CD LYS A 65 6.819 -18.251 -13.670 1.00 64.11 C ATOM 971 CE LYS A 65 7.367 -17.025 -14.385 1.00 75.14 C ATOM 972 NZ LYS A 65 8.215 -17.395 -15.552 1.00 55.11 N ATOM 0 H LYS A 65 3.762 -18.703 -13.507 1.00 53.21 H new ATOM 0 HA LYS A 65 4.820 -19.437 -11.070 1.00 34.44 H new ATOM 0 HB2 LYS A 65 4.803 -17.018 -12.803 1.00 20.12 H new ATOM 0 HB3 LYS A 65 5.238 -16.732 -11.130 1.00 20.12 H new ATOM 0 HG2 LYS A 65 7.329 -17.244 -11.846 1.00 22.54 H new ATOM 0 HG3 LYS A 65 6.796 -18.899 -11.625 1.00 22.54 H new ATOM 0 HD2 LYS A 65 7.509 -19.085 -13.796 1.00 64.11 H new ATOM 0 HD3 LYS A 65 5.874 -18.547 -14.126 1.00 64.11 H new ATOM 0 HE2 LYS A 65 6.539 -16.401 -14.721 1.00 75.14 H new ATOM 0 HE3 LYS A 65 7.953 -16.428 -13.686 1.00 75.14 H new ATOM 0 HZ1 LYS A 65 9.216 -17.234 -15.319 1.00 55.11 H new ATOM 0 HZ2 LYS A 65 8.070 -18.399 -15.782 1.00 55.11 H new ATOM 0 HZ3 LYS A 65 7.952 -16.810 -16.371 1.00 55.11 H new ATOM 986 N LEU A 66 2.397 -17.204 -10.743 1.00 62.23 N ATOM 987 CA LEU A 66 1.452 -16.635 -9.790 1.00 42.40 C ATOM 988 C LEU A 66 0.453 -17.687 -9.319 1.00 34.31 C ATOM 989 O LEU A 66 0.055 -17.703 -8.155 1.00 43.55 O ATOM 990 CB LEU A 66 0.708 -15.456 -10.421 1.00 35.22 C ATOM 991 CG LEU A 66 1.392 -14.094 -10.309 1.00 12.31 C ATOM 992 CD1 LEU A 66 1.608 -13.723 -8.850 1.00 3.13 C ATOM 993 CD2 LEU A 66 2.715 -14.097 -11.061 1.00 20.50 C ATOM 0 H LEU A 66 2.287 -16.866 -11.699 1.00 62.23 H new ATOM 0 HA LEU A 66 2.014 -16.282 -8.926 1.00 42.40 H new ATOM 0 HB2 LEU A 66 0.550 -15.675 -11.477 1.00 35.22 H new ATOM 0 HB3 LEU A 66 -0.277 -15.385 -9.959 1.00 35.22 H new ATOM 0 HG LEU A 66 0.742 -13.345 -10.761 1.00 12.31 H new ATOM 0 HD11 LEU A 66 2.096 -12.750 -8.790 1.00 3.13 H new ATOM 0 HD12 LEU A 66 0.646 -13.678 -8.340 1.00 3.13 H new ATOM 0 HD13 LEU A 66 2.237 -14.474 -8.373 1.00 3.13 H new ATOM 0 HD21 LEU A 66 3.187 -13.119 -10.970 1.00 20.50 H new ATOM 0 HD22 LEU A 66 3.372 -14.858 -10.639 1.00 20.50 H new ATOM 0 HD23 LEU A 66 2.535 -14.316 -12.113 1.00 20.50 H new ATOM 1005 N ALA A 67 0.053 -18.567 -10.232 1.00 62.40 N ATOM 1006 CA ALA A 67 -0.895 -19.625 -9.909 1.00 31.15 C ATOM 1007 C ALA A 67 -0.436 -20.422 -8.692 1.00 1.14 C ATOM 1008 O ALA A 67 -1.255 -20.937 -7.932 1.00 75.05 O ATOM 1009 CB ALA A 67 -1.085 -20.547 -11.105 1.00 20.14 C ATOM 0 H ALA A 67 0.371 -18.567 -11.201 1.00 62.40 H new ATOM 0 HA ALA A 67 -1.851 -19.160 -9.667 1.00 31.15 H new ATOM 0 HB1 ALA A 67 -1.796 -21.333 -10.849 1.00 20.14 H new ATOM 0 HB2 ALA A 67 -1.466 -19.973 -11.950 1.00 20.14 H new ATOM 0 HB3 ALA A 67 -0.129 -20.996 -11.374 1.00 20.14 H new ATOM 1015 N GLN A 68 0.878 -20.519 -8.515 1.00 12.15 N ATOM 1016 CA GLN A 68 1.445 -21.254 -7.391 1.00 64.31 C ATOM 1017 C GLN A 68 1.399 -20.419 -6.116 1.00 50.20 C ATOM 1018 O GLN A 68 1.273 -20.956 -5.016 1.00 5.42 O ATOM 1019 CB GLN A 68 2.887 -21.662 -7.698 1.00 4.24 C ATOM 1020 CG GLN A 68 3.031 -22.481 -8.970 1.00 32.35 C ATOM 1021 CD GLN A 68 4.345 -22.229 -9.681 1.00 43.12 C ATOM 1022 OE1 GLN A 68 5.401 -22.151 -9.051 1.00 72.41 O ATOM 1023 NE2 GLN A 68 4.289 -22.099 -11.001 1.00 1.41 N ATOM 0 H GLN A 68 1.569 -20.098 -9.136 1.00 12.15 H new ATOM 0 HA GLN A 68 0.846 -22.152 -7.236 1.00 64.31 H new ATOM 0 HB2 GLN A 68 3.499 -20.764 -7.783 1.00 4.24 H new ATOM 0 HB3 GLN A 68 3.279 -22.237 -6.859 1.00 4.24 H new ATOM 0 HG2 GLN A 68 2.952 -23.540 -8.726 1.00 32.35 H new ATOM 0 HG3 GLN A 68 2.207 -22.246 -9.644 1.00 32.35 H new ATOM 0 HE21 GLN A 68 3.393 -22.171 -11.483 1.00 1.41 H new ATOM 0 HE22 GLN A 68 5.142 -21.927 -11.533 1.00 1.41 H new ATOM 1032 N GLN A 69 1.504 -19.103 -6.273 1.00 75.41 N ATOM 1033 CA GLN A 69 1.477 -18.194 -5.133 1.00 73.40 C ATOM 1034 C GLN A 69 0.057 -18.033 -4.600 1.00 43.13 C ATOM 1035 O GLN A 69 -0.146 -17.772 -3.414 1.00 45.10 O ATOM 1036 CB GLN A 69 2.044 -16.830 -5.527 1.00 50.41 C ATOM 1037 CG GLN A 69 3.510 -16.872 -5.925 1.00 72.14 C ATOM 1038 CD GLN A 69 4.176 -15.513 -5.845 1.00 5.22 C ATOM 1039 OE1 GLN A 69 3.726 -14.630 -5.115 1.00 1.33 O ATOM 1040 NE2 GLN A 69 5.256 -15.338 -6.600 1.00 61.43 N ATOM 0 H GLN A 69 1.608 -18.643 -7.177 1.00 75.41 H new ATOM 0 HA GLN A 69 2.096 -18.622 -4.344 1.00 73.40 H new ATOM 0 HB2 GLN A 69 1.462 -16.430 -6.357 1.00 50.41 H new ATOM 0 HB3 GLN A 69 1.923 -16.140 -4.692 1.00 50.41 H new ATOM 0 HG2 GLN A 69 4.039 -17.570 -5.276 1.00 72.14 H new ATOM 0 HG3 GLN A 69 3.596 -17.255 -6.942 1.00 72.14 H new ATOM 0 HE21 GLN A 69 5.594 -16.098 -7.190 1.00 61.43 H new ATOM 0 HE22 GLN A 69 5.747 -14.444 -6.589 1.00 61.43 H new ATOM 1049 N TYR A 70 -0.923 -18.190 -5.482 1.00 25.32 N ATOM 1050 CA TYR A 70 -2.324 -18.059 -5.102 1.00 13.24 C ATOM 1051 C TYR A 70 -3.090 -19.345 -5.392 1.00 13.40 C ATOM 1052 O TYR A 70 -4.312 -19.336 -5.541 1.00 60.12 O ATOM 1053 CB TYR A 70 -2.969 -16.888 -5.846 1.00 73.14 C ATOM 1054 CG TYR A 70 -2.301 -15.559 -5.580 1.00 2.41 C ATOM 1055 CD1 TYR A 70 -2.104 -15.106 -4.282 1.00 41.41 C ATOM 1056 CD2 TYR A 70 -1.866 -14.757 -6.628 1.00 54.44 C ATOM 1057 CE1 TYR A 70 -1.495 -13.891 -4.035 1.00 63.31 C ATOM 1058 CE2 TYR A 70 -1.254 -13.541 -6.390 1.00 43.53 C ATOM 1059 CZ TYR A 70 -1.071 -13.113 -5.091 1.00 60.24 C ATOM 1060 OH TYR A 70 -0.462 -11.902 -4.849 1.00 32.23 O ATOM 0 H TYR A 70 -0.773 -18.409 -6.467 1.00 25.32 H new ATOM 0 HA TYR A 70 -2.367 -17.867 -4.030 1.00 13.24 H new ATOM 0 HB2 TYR A 70 -2.943 -17.090 -6.917 1.00 73.14 H new ATOM 0 HB3 TYR A 70 -4.019 -16.821 -5.560 1.00 73.14 H new ATOM 0 HD1 TYR A 70 -2.432 -15.714 -3.452 1.00 41.41 H new ATOM 0 HD2 TYR A 70 -2.009 -15.090 -7.646 1.00 54.44 H new ATOM 0 HE1 TYR A 70 -1.352 -13.552 -3.020 1.00 63.31 H new ATOM 0 HE2 TYR A 70 -0.921 -12.929 -7.216 1.00 43.53 H new ATOM 0 HH TYR A 70 -0.223 -11.480 -5.701 1.00 32.23 H new ATOM 1070 N THR A 71 -2.362 -20.455 -5.471 1.00 53.31 N ATOM 1071 CA THR A 71 -2.970 -21.751 -5.744 1.00 63.45 C ATOM 1072 C THR A 71 -4.056 -22.075 -4.723 1.00 25.02 C ATOM 1073 O THR A 71 -4.952 -22.874 -4.991 1.00 11.42 O ATOM 1074 CB THR A 71 -1.921 -22.879 -5.735 1.00 51.51 C ATOM 1075 OG1 THR A 71 -2.493 -24.086 -6.247 1.00 70.04 O ATOM 1076 CG2 THR A 71 -1.396 -23.117 -4.327 1.00 62.15 C ATOM 0 H THR A 71 -1.350 -20.482 -5.350 1.00 53.31 H new ATOM 0 HA THR A 71 -3.415 -21.687 -6.737 1.00 63.45 H new ATOM 0 HB THR A 71 -1.089 -22.576 -6.370 1.00 51.51 H new ATOM 0 HG1 THR A 71 -1.818 -24.797 -6.239 1.00 70.04 H new ATOM 0 HG21 THR A 71 -0.657 -23.918 -4.345 1.00 62.15 H new ATOM 0 HG22 THR A 71 -0.933 -22.204 -3.952 1.00 62.15 H new ATOM 0 HG23 THR A 71 -2.222 -23.400 -3.674 1.00 62.15 H new ATOM 1084 N GLU A 72 -3.968 -21.448 -3.554 1.00 42.03 N ATOM 1085 CA GLU A 72 -4.943 -21.671 -2.494 1.00 25.13 C ATOM 1086 C GLU A 72 -6.361 -21.412 -2.996 1.00 64.22 C ATOM 1087 O GLU A 72 -7.300 -22.114 -2.626 1.00 31.12 O ATOM 1088 CB GLU A 72 -4.642 -20.768 -1.295 1.00 62.10 C ATOM 1089 CG GLU A 72 -3.449 -21.226 -0.473 1.00 10.13 C ATOM 1090 CD GLU A 72 -3.025 -20.201 0.560 1.00 41.34 C ATOM 1091 OE1 GLU A 72 -3.873 -19.374 0.956 1.00 3.33 O ATOM 1092 OE2 GLU A 72 -1.847 -20.226 0.972 1.00 54.20 O ATOM 0 H GLU A 72 -3.232 -20.782 -3.318 1.00 42.03 H new ATOM 0 HA GLU A 72 -4.871 -22.713 -2.182 1.00 25.13 H new ATOM 0 HB2 GLU A 72 -4.460 -19.754 -1.651 1.00 62.10 H new ATOM 0 HB3 GLU A 72 -5.521 -20.727 -0.652 1.00 62.10 H new ATOM 0 HG2 GLU A 72 -3.696 -22.162 0.029 1.00 10.13 H new ATOM 0 HG3 GLU A 72 -2.611 -21.433 -1.139 1.00 10.13 H new ATOM 1099 N ASN A 73 -6.507 -20.397 -3.841 1.00 43.45 N ATOM 1100 CA ASN A 73 -7.809 -20.043 -4.394 1.00 72.45 C ATOM 1101 C ASN A 73 -7.704 -19.738 -5.885 1.00 43.54 C ATOM 1102 O ASN A 73 -8.534 -19.023 -6.445 1.00 5.44 O ATOM 1103 CB ASN A 73 -8.389 -18.834 -3.655 1.00 62.14 C ATOM 1104 CG ASN A 73 -9.515 -19.218 -2.714 1.00 62.35 C ATOM 1105 OD1 ASN A 73 -9.507 -18.853 -1.538 1.00 54.33 O ATOM 1106 ND2 ASN A 73 -10.489 -19.959 -3.228 1.00 12.25 N ATOM 0 H ASN A 73 -5.739 -19.805 -4.158 1.00 43.45 H new ATOM 0 HA ASN A 73 -8.475 -20.896 -4.262 1.00 72.45 H new ATOM 0 HB2 ASN A 73 -7.597 -18.343 -3.089 1.00 62.14 H new ATOM 0 HB3 ASN A 73 -8.757 -18.110 -4.382 1.00 62.14 H new ATOM 0 HD21 ASN A 73 -11.272 -20.249 -2.643 1.00 12.25 H new ATOM 0 HD22 ASN A 73 -10.454 -20.238 -4.208 1.00 12.25 H new ATOM 1113 N VAL A 74 -6.675 -20.288 -6.525 1.00 43.23 N ATOM 1114 CA VAL A 74 -6.461 -20.077 -7.951 1.00 42.34 C ATOM 1115 C VAL A 74 -6.021 -21.365 -8.637 1.00 24.52 C ATOM 1116 O VAL A 74 -5.209 -22.120 -8.103 1.00 11.33 O ATOM 1117 CB VAL A 74 -5.402 -18.986 -8.204 1.00 72.22 C ATOM 1118 CG1 VAL A 74 -5.262 -18.714 -9.694 1.00 21.22 C ATOM 1119 CG2 VAL A 74 -5.758 -17.713 -7.451 1.00 13.41 C ATOM 0 H VAL A 74 -5.978 -20.883 -6.077 1.00 43.23 H new ATOM 0 HA VAL A 74 -7.414 -19.753 -8.370 1.00 42.34 H new ATOM 0 HB VAL A 74 -4.441 -19.343 -7.833 1.00 72.22 H new ATOM 0 HG11 VAL A 74 -4.510 -17.941 -9.854 1.00 21.22 H new ATOM 0 HG12 VAL A 74 -4.957 -19.628 -10.204 1.00 21.22 H new ATOM 0 HG13 VAL A 74 -6.219 -18.378 -10.094 1.00 21.22 H new ATOM 0 HG21 VAL A 74 -5.000 -16.954 -7.641 1.00 13.41 H new ATOM 0 HG22 VAL A 74 -6.728 -17.349 -7.789 1.00 13.41 H new ATOM 0 HG23 VAL A 74 -5.802 -17.923 -6.382 1.00 13.41 H new ATOM 1129 N LYS A 75 -6.563 -21.611 -9.824 1.00 41.33 N ATOM 1130 CA LYS A 75 -6.228 -22.807 -10.587 1.00 54.30 C ATOM 1131 C LYS A 75 -6.112 -22.491 -12.074 1.00 41.22 C ATOM 1132 O LYS A 75 -6.618 -21.469 -12.542 1.00 54.54 O ATOM 1133 CB LYS A 75 -7.286 -23.891 -10.366 1.00 44.23 C ATOM 1134 CG LYS A 75 -7.014 -24.768 -9.156 1.00 44.22 C ATOM 1135 CD LYS A 75 -5.759 -25.603 -9.341 1.00 22.44 C ATOM 1136 CE LYS A 75 -5.620 -26.651 -8.247 1.00 73.13 C ATOM 1137 NZ LYS A 75 -6.782 -27.584 -8.222 1.00 54.32 N ATOM 0 H LYS A 75 -7.238 -20.997 -10.280 1.00 41.33 H new ATOM 0 HA LYS A 75 -5.263 -23.172 -10.236 1.00 54.30 H new ATOM 0 HB2 LYS A 75 -8.261 -23.417 -10.249 1.00 44.23 H new ATOM 0 HB3 LYS A 75 -7.341 -24.520 -11.255 1.00 44.23 H new ATOM 0 HG2 LYS A 75 -6.908 -24.143 -8.269 1.00 44.22 H new ATOM 0 HG3 LYS A 75 -7.866 -25.425 -8.983 1.00 44.22 H new ATOM 0 HD2 LYS A 75 -5.787 -26.093 -10.314 1.00 22.44 H new ATOM 0 HD3 LYS A 75 -4.884 -24.953 -9.337 1.00 22.44 H new ATOM 0 HE2 LYS A 75 -4.702 -27.218 -8.402 1.00 73.13 H new ATOM 0 HE3 LYS A 75 -5.530 -26.157 -7.280 1.00 73.13 H new ATOM 0 HZ1 LYS A 75 -6.521 -28.450 -7.709 1.00 54.32 H new ATOM 0 HZ2 LYS A 75 -7.584 -27.127 -7.744 1.00 54.32 H new ATOM 0 HZ3 LYS A 75 -7.053 -27.827 -9.196 1.00 54.32 H new ATOM 1151 N ILE A 76 -5.445 -23.371 -12.812 1.00 32.00 N ATOM 1152 CA ILE A 76 -5.266 -23.186 -14.247 1.00 74.21 C ATOM 1153 C ILE A 76 -5.308 -24.520 -14.984 1.00 73.53 C ATOM 1154 O ILE A 76 -4.581 -25.453 -14.640 1.00 22.14 O ATOM 1155 CB ILE A 76 -3.934 -22.480 -14.562 1.00 4.33 C ATOM 1156 CG1 ILE A 76 -3.868 -21.127 -13.849 1.00 15.14 C ATOM 1157 CG2 ILE A 76 -3.771 -22.302 -16.064 1.00 3.40 C ATOM 1158 CD1 ILE A 76 -2.594 -20.360 -14.127 1.00 71.25 C ATOM 0 H ILE A 76 -5.019 -24.220 -12.440 1.00 32.00 H new ATOM 0 HA ILE A 76 -6.090 -22.559 -14.589 1.00 74.21 H new ATOM 0 HB ILE A 76 -3.115 -23.101 -14.199 1.00 4.33 H new ATOM 0 HG12 ILE A 76 -4.721 -20.522 -14.155 1.00 15.14 H new ATOM 0 HG13 ILE A 76 -3.960 -21.287 -12.775 1.00 15.14 H new ATOM 0 HG21 ILE A 76 -2.825 -21.802 -16.271 1.00 3.40 H new ATOM 0 HG22 ILE A 76 -3.779 -23.278 -16.549 1.00 3.40 H new ATOM 0 HG23 ILE A 76 -4.592 -21.699 -16.450 1.00 3.40 H new ATOM 0 HD11 ILE A 76 -2.616 -19.412 -13.590 1.00 71.25 H new ATOM 0 HD12 ILE A 76 -1.737 -20.946 -13.795 1.00 71.25 H new ATOM 0 HD13 ILE A 76 -2.510 -20.169 -15.197 1.00 71.25 H new ATOM 1170 N TYR A 77 -6.161 -24.603 -15.999 1.00 44.05 N ATOM 1171 CA TYR A 77 -6.298 -25.824 -16.784 1.00 41.33 C ATOM 1172 C TYR A 77 -6.340 -25.509 -18.276 1.00 64.33 C ATOM 1173 O TYR A 77 -6.471 -24.352 -18.676 1.00 10.43 O ATOM 1174 CB TYR A 77 -7.562 -26.580 -16.374 1.00 72.10 C ATOM 1175 CG TYR A 77 -7.509 -27.133 -14.968 1.00 12.23 C ATOM 1176 CD1 TYR A 77 -6.353 -27.727 -14.478 1.00 21.01 C ATOM 1177 CD2 TYR A 77 -8.614 -27.059 -14.129 1.00 20.02 C ATOM 1178 CE1 TYR A 77 -6.300 -28.233 -13.193 1.00 1.23 C ATOM 1179 CE2 TYR A 77 -8.570 -27.561 -12.843 1.00 23.03 C ATOM 1180 CZ TYR A 77 -7.411 -28.148 -12.380 1.00 14.33 C ATOM 1181 OH TYR A 77 -7.361 -28.651 -11.099 1.00 41.31 O ATOM 0 H TYR A 77 -6.768 -23.839 -16.297 1.00 44.05 H new ATOM 0 HA TYR A 77 -5.429 -26.452 -16.588 1.00 41.33 H new ATOM 0 HB2 TYR A 77 -8.419 -25.912 -16.460 1.00 72.10 H new ATOM 0 HB3 TYR A 77 -7.727 -27.401 -17.072 1.00 72.10 H new ATOM 0 HD1 TYR A 77 -5.481 -27.795 -15.112 1.00 21.01 H new ATOM 0 HD2 TYR A 77 -9.523 -26.601 -14.489 1.00 20.02 H new ATOM 0 HE1 TYR A 77 -5.394 -28.692 -12.827 1.00 1.23 H new ATOM 0 HE2 TYR A 77 -9.438 -27.494 -12.204 1.00 23.03 H new ATOM 0 HH TYR A 77 -8.225 -28.511 -10.659 1.00 41.31 H new ATOM 1191 N LYS A 78 -6.230 -26.548 -19.096 1.00 23.53 N ATOM 1192 CA LYS A 78 -6.257 -26.387 -20.546 1.00 3.52 C ATOM 1193 C LYS A 78 -6.924 -27.585 -21.214 1.00 53.52 C ATOM 1194 O LYS A 78 -7.438 -28.478 -20.539 1.00 32.22 O ATOM 1195 CB LYS A 78 -4.837 -26.212 -21.087 1.00 32.21 C ATOM 1196 CG LYS A 78 -3.905 -27.357 -20.729 1.00 32.34 C ATOM 1197 CD LYS A 78 -2.646 -27.337 -21.580 1.00 31.11 C ATOM 1198 CE LYS A 78 -2.919 -27.837 -22.990 1.00 21.42 C ATOM 1199 NZ LYS A 78 -2.713 -29.308 -23.107 1.00 41.41 N ATOM 0 H LYS A 78 -6.121 -27.512 -18.781 1.00 23.53 H new ATOM 0 HA LYS A 78 -6.839 -25.495 -20.777 1.00 3.52 H new ATOM 0 HB2 LYS A 78 -4.880 -26.115 -22.172 1.00 32.21 H new ATOM 0 HB3 LYS A 78 -4.422 -25.282 -20.700 1.00 32.21 H new ATOM 0 HG2 LYS A 78 -3.634 -27.291 -19.675 1.00 32.34 H new ATOM 0 HG3 LYS A 78 -4.423 -28.306 -20.866 1.00 32.34 H new ATOM 0 HD2 LYS A 78 -2.250 -26.322 -21.623 1.00 31.11 H new ATOM 0 HD3 LYS A 78 -1.881 -27.958 -21.114 1.00 31.11 H new ATOM 0 HE2 LYS A 78 -3.943 -27.590 -23.271 1.00 21.42 H new ATOM 0 HE3 LYS A 78 -2.263 -27.322 -23.691 1.00 21.42 H new ATOM 0 HZ1 LYS A 78 -1.997 -29.501 -23.836 1.00 41.41 H new ATOM 0 HZ2 LYS A 78 -2.388 -29.687 -22.194 1.00 41.41 H new ATOM 0 HZ3 LYS A 78 -3.609 -29.764 -23.372 1.00 41.41 H new ATOM 1490 N THR A 98 -7.138 -17.059 -25.303 1.00 45.20 N ATOM 1491 CA THR A 98 -7.950 -16.411 -24.280 1.00 23.33 C ATOM 1492 C THR A 98 -8.143 -17.320 -23.072 1.00 42.13 C ATOM 1493 O THR A 98 -7.971 -18.536 -23.166 1.00 12.55 O ATOM 1494 CB THR A 98 -9.331 -16.007 -24.831 1.00 62.14 C ATOM 1495 OG1 THR A 98 -9.195 -15.475 -26.153 1.00 63.21 O ATOM 1496 CG2 THR A 98 -9.993 -14.977 -23.928 1.00 55.04 C ATOM 0 HA THR A 98 -7.413 -15.514 -23.973 1.00 23.33 H new ATOM 0 HB THR A 98 -9.960 -16.897 -24.862 1.00 62.14 H new ATOM 0 HG1 THR A 98 -8.316 -15.715 -26.514 1.00 63.21 H new ATOM 0 HG21 THR A 98 -10.967 -14.707 -24.337 1.00 55.04 H new ATOM 0 HG22 THR A 98 -10.122 -15.397 -22.931 1.00 55.04 H new ATOM 0 HG23 THR A 98 -9.365 -14.088 -23.869 1.00 55.04 H new ATOM 1504 N ILE A 99 -8.501 -16.724 -21.940 1.00 62.15 N ATOM 1505 CA ILE A 99 -8.719 -17.483 -20.715 1.00 43.54 C ATOM 1506 C ILE A 99 -10.073 -17.152 -20.096 1.00 65.44 C ATOM 1507 O ILE A 99 -10.556 -16.023 -20.200 1.00 5.15 O ATOM 1508 CB ILE A 99 -7.613 -17.208 -19.679 1.00 53.20 C ATOM 1509 CG1 ILE A 99 -6.236 -17.266 -20.343 1.00 62.33 C ATOM 1510 CG2 ILE A 99 -7.698 -18.208 -18.535 1.00 14.24 C ATOM 1511 CD1 ILE A 99 -5.100 -16.916 -19.408 1.00 74.33 C ATOM 0 H ILE A 99 -8.646 -15.719 -21.846 1.00 62.15 H new ATOM 0 HA ILE A 99 -8.696 -18.538 -20.989 1.00 43.54 H new ATOM 0 HB ILE A 99 -7.758 -16.207 -19.272 1.00 53.20 H new ATOM 0 HG12 ILE A 99 -6.074 -18.269 -20.739 1.00 62.33 H new ATOM 0 HG13 ILE A 99 -6.222 -16.582 -21.192 1.00 62.33 H new ATOM 0 HG21 ILE A 99 -6.910 -18.001 -17.811 1.00 14.24 H new ATOM 0 HG22 ILE A 99 -8.670 -18.122 -18.048 1.00 14.24 H new ATOM 0 HG23 ILE A 99 -7.576 -19.218 -18.925 1.00 14.24 H new ATOM 0 HD11 ILE A 99 -4.154 -16.978 -19.946 1.00 74.33 H new ATOM 0 HD12 ILE A 99 -5.238 -15.902 -19.031 1.00 74.33 H new ATOM 0 HD13 ILE A 99 -5.088 -17.615 -18.572 1.00 74.33 H new ATOM 1523 N LEU A 100 -10.681 -18.141 -19.451 1.00 14.13 N ATOM 1524 CA LEU A 100 -11.979 -17.955 -18.814 1.00 74.13 C ATOM 1525 C LEU A 100 -11.958 -18.464 -17.376 1.00 51.03 C ATOM 1526 O LEU A 100 -11.431 -19.540 -17.096 1.00 42.25 O ATOM 1527 CB LEU A 100 -13.068 -18.679 -19.607 1.00 11.41 C ATOM 1528 CG LEU A 100 -13.009 -18.522 -21.127 1.00 23.02 C ATOM 1529 CD1 LEU A 100 -12.523 -19.807 -21.779 1.00 75.25 C ATOM 1530 CD2 LEU A 100 -14.372 -18.125 -21.675 1.00 10.22 C ATOM 0 H LEU A 100 -10.295 -19.080 -19.355 1.00 14.13 H new ATOM 0 HA LEU A 100 -12.198 -16.887 -18.799 1.00 74.13 H new ATOM 0 HB2 LEU A 100 -13.017 -19.742 -19.369 1.00 11.41 H new ATOM 0 HB3 LEU A 100 -14.038 -18.322 -19.262 1.00 11.41 H new ATOM 0 HG LEU A 100 -12.299 -17.729 -21.364 1.00 23.02 H new ATOM 0 HD11 LEU A 100 -12.488 -19.676 -22.860 1.00 75.25 H new ATOM 0 HD12 LEU A 100 -11.526 -20.048 -21.410 1.00 75.25 H new ATOM 0 HD13 LEU A 100 -13.206 -20.620 -21.534 1.00 75.25 H new ATOM 0 HD21 LEU A 100 -14.312 -18.018 -22.758 1.00 10.22 H new ATOM 0 HD22 LEU A 100 -15.102 -18.895 -21.427 1.00 10.22 H new ATOM 0 HD23 LEU A 100 -14.680 -17.177 -21.233 1.00 10.22 H new ATOM 1542 N MET A 101 -12.537 -17.684 -16.468 1.00 44.04 N ATOM 1543 CA MET A 101 -12.586 -18.058 -15.059 1.00 51.33 C ATOM 1544 C MET A 101 -13.862 -18.836 -14.749 1.00 12.11 C ATOM 1545 O MET A 101 -14.965 -18.297 -14.831 1.00 52.43 O ATOM 1546 CB MET A 101 -12.507 -16.812 -14.177 1.00 34.22 C ATOM 1547 CG MET A 101 -11.161 -16.109 -14.236 1.00 12.34 C ATOM 1548 SD MET A 101 -10.546 -15.645 -12.606 1.00 53.14 S ATOM 1549 CE MET A 101 -9.022 -14.813 -13.043 1.00 41.24 C ATOM 0 H MET A 101 -12.978 -16.790 -16.683 1.00 44.04 H new ATOM 0 HA MET A 101 -11.730 -18.699 -14.847 1.00 51.33 H new ATOM 0 HB2 MET A 101 -13.286 -16.113 -14.480 1.00 34.22 H new ATOM 0 HB3 MET A 101 -12.715 -17.094 -13.145 1.00 34.22 H new ATOM 0 HG2 MET A 101 -10.436 -16.762 -14.721 1.00 12.34 H new ATOM 0 HG3 MET A 101 -11.249 -15.216 -14.854 1.00 12.34 H new ATOM 0 HE1 MET A 101 -8.945 -13.879 -12.487 1.00 41.24 H new ATOM 0 HE2 MET A 101 -8.175 -15.453 -12.797 1.00 41.24 H new ATOM 0 HE3 MET A 101 -9.017 -14.600 -14.112 1.00 41.24 H new ATOM 1559 N PHE A 102 -13.703 -20.105 -14.392 1.00 41.14 N ATOM 1560 CA PHE A 102 -14.841 -20.958 -14.070 1.00 22.24 C ATOM 1561 C PHE A 102 -14.785 -21.414 -12.615 1.00 24.11 C ATOM 1562 O PHE A 102 -13.707 -21.647 -12.066 1.00 24.33 O ATOM 1563 CB PHE A 102 -14.872 -22.175 -14.997 1.00 14.11 C ATOM 1564 CG PHE A 102 -15.244 -21.840 -16.413 1.00 43.34 C ATOM 1565 CD1 PHE A 102 -16.498 -21.332 -16.713 1.00 33.42 C ATOM 1566 CD2 PHE A 102 -14.340 -22.032 -17.445 1.00 24.13 C ATOM 1567 CE1 PHE A 102 -16.843 -21.024 -18.016 1.00 43.32 C ATOM 1568 CE2 PHE A 102 -14.678 -21.726 -18.749 1.00 54.11 C ATOM 1569 CZ PHE A 102 -15.931 -21.220 -19.035 1.00 21.31 C ATOM 0 H PHE A 102 -12.796 -20.566 -14.318 1.00 41.14 H new ATOM 0 HA PHE A 102 -15.751 -20.376 -14.215 1.00 22.24 H new ATOM 0 HB2 PHE A 102 -13.892 -22.652 -14.990 1.00 14.11 H new ATOM 0 HB3 PHE A 102 -15.583 -22.902 -14.605 1.00 14.11 H new ATOM 0 HD1 PHE A 102 -17.214 -21.175 -15.920 1.00 33.42 H new ATOM 0 HD2 PHE A 102 -13.358 -22.426 -17.227 1.00 24.13 H new ATOM 0 HE1 PHE A 102 -17.824 -20.631 -18.237 1.00 43.32 H new ATOM 0 HE2 PHE A 102 -13.964 -21.882 -19.544 1.00 54.11 H new ATOM 0 HZ PHE A 102 -16.197 -20.978 -20.053 1.00 21.31 H new ATOM 1579 N LYS A 103 -15.953 -21.540 -11.995 1.00 0.52 N ATOM 1580 CA LYS A 103 -16.039 -21.969 -10.604 1.00 14.34 C ATOM 1581 C LYS A 103 -17.484 -22.267 -10.216 1.00 42.13 C ATOM 1582 O LYS A 103 -18.391 -21.495 -10.521 1.00 4.33 O ATOM 1583 CB LYS A 103 -15.464 -20.892 -9.680 1.00 55.11 C ATOM 1584 CG LYS A 103 -15.610 -21.218 -8.204 1.00 53.23 C ATOM 1585 CD LYS A 103 -16.806 -20.506 -7.592 1.00 73.44 C ATOM 1586 CE LYS A 103 -16.430 -19.126 -7.076 1.00 31.03 C ATOM 1587 NZ LYS A 103 -17.617 -18.379 -6.577 1.00 61.33 N ATOM 0 H LYS A 103 -16.854 -21.351 -12.434 1.00 0.52 H new ATOM 0 HA LYS A 103 -15.455 -22.883 -10.495 1.00 14.34 H new ATOM 0 HB2 LYS A 103 -14.408 -20.753 -9.910 1.00 55.11 H new ATOM 0 HB3 LYS A 103 -15.962 -19.945 -9.886 1.00 55.11 H new ATOM 0 HG2 LYS A 103 -15.722 -22.295 -8.077 1.00 53.23 H new ATOM 0 HG3 LYS A 103 -14.702 -20.928 -7.675 1.00 53.23 H new ATOM 0 HD2 LYS A 103 -17.596 -20.414 -8.337 1.00 73.44 H new ATOM 0 HD3 LYS A 103 -17.207 -21.104 -6.774 1.00 73.44 H new ATOM 0 HE2 LYS A 103 -15.699 -19.225 -6.273 1.00 31.03 H new ATOM 0 HE3 LYS A 103 -15.952 -18.558 -7.874 1.00 31.03 H new ATOM 0 HZ1 LYS A 103 -17.319 -17.443 -6.234 1.00 61.33 H new ATOM 0 HZ2 LYS A 103 -18.304 -18.262 -7.349 1.00 61.33 H new ATOM 0 HZ3 LYS A 103 -18.059 -18.909 -5.799 1.00 61.33 H new ATOM 1601 N ASN A 104 -17.690 -23.394 -9.540 1.00 42.33 N ATOM 1602 CA ASN A 104 -19.024 -23.794 -9.109 1.00 62.34 C ATOM 1603 C ASN A 104 -19.994 -23.808 -10.286 1.00 50.33 C ATOM 1604 O ASN A 104 -21.196 -23.609 -10.115 1.00 40.20 O ATOM 1605 CB ASN A 104 -19.537 -22.846 -8.021 1.00 11.23 C ATOM 1606 CG ASN A 104 -20.800 -23.359 -7.357 1.00 4.44 C ATOM 1607 OD1 ASN A 104 -21.113 -24.548 -7.428 1.00 62.54 O ATOM 1608 ND2 ASN A 104 -21.533 -22.461 -6.709 1.00 61.13 N ATOM 0 H ASN A 104 -16.950 -24.045 -9.279 1.00 42.33 H new ATOM 0 HA ASN A 104 -18.960 -24.803 -8.702 1.00 62.34 H new ATOM 0 HB2 ASN A 104 -18.762 -22.710 -7.266 1.00 11.23 H new ATOM 0 HB3 ASN A 104 -19.731 -21.867 -8.458 1.00 11.23 H new ATOM 0 HD21 ASN A 104 -22.395 -22.746 -6.244 1.00 61.13 H new ATOM 0 HD22 ASN A 104 -21.234 -21.486 -6.677 1.00 61.13 H new ATOM 1615 N GLY A 105 -19.462 -24.045 -11.482 1.00 52.35 N ATOM 1616 CA GLY A 105 -20.296 -24.080 -12.670 1.00 3.40 C ATOM 1617 C GLY A 105 -20.771 -22.703 -13.087 1.00 72.24 C ATOM 1618 O GLY A 105 -21.828 -22.562 -13.700 1.00 44.34 O ATOM 0 H GLY A 105 -18.470 -24.213 -11.649 1.00 52.35 H new ATOM 0 HA2 GLY A 105 -19.737 -24.531 -13.489 1.00 3.40 H new ATOM 0 HA3 GLY A 105 -21.160 -24.718 -12.485 1.00 3.40 H new ATOM 1622 N LYS A 106 -19.987 -21.683 -12.752 1.00 63.04 N ATOM 1623 CA LYS A 106 -20.333 -20.309 -13.096 1.00 23.53 C ATOM 1624 C LYS A 106 -19.095 -19.526 -13.521 1.00 52.51 C ATOM 1625 O LYS A 106 -17.968 -19.901 -13.194 1.00 15.21 O ATOM 1626 CB LYS A 106 -21.003 -19.617 -11.906 1.00 4.42 C ATOM 1627 CG LYS A 106 -21.718 -18.329 -12.275 1.00 13.01 C ATOM 1628 CD LYS A 106 -22.596 -17.832 -11.138 1.00 34.42 C ATOM 1629 CE LYS A 106 -23.264 -16.511 -11.485 1.00 12.25 C ATOM 1630 NZ LYS A 106 -24.180 -16.052 -10.405 1.00 53.44 N ATOM 0 H LYS A 106 -19.109 -21.782 -12.243 1.00 63.04 H new ATOM 0 HA LYS A 106 -21.030 -20.335 -13.934 1.00 23.53 H new ATOM 0 HB2 LYS A 106 -21.719 -20.303 -11.453 1.00 4.42 H new ATOM 0 HB3 LYS A 106 -20.248 -19.400 -11.150 1.00 4.42 H new ATOM 0 HG2 LYS A 106 -20.984 -17.565 -12.530 1.00 13.01 H new ATOM 0 HG3 LYS A 106 -22.329 -18.493 -13.163 1.00 13.01 H new ATOM 0 HD2 LYS A 106 -23.358 -18.578 -10.913 1.00 34.42 H new ATOM 0 HD3 LYS A 106 -21.993 -17.711 -10.238 1.00 34.42 H new ATOM 0 HE2 LYS A 106 -22.501 -15.753 -11.660 1.00 12.25 H new ATOM 0 HE3 LYS A 106 -23.824 -16.620 -12.414 1.00 12.25 H new ATOM 0 HZ1 LYS A 106 -24.616 -15.148 -10.680 1.00 53.44 H new ATOM 0 HZ2 LYS A 106 -24.924 -16.763 -10.255 1.00 53.44 H new ATOM 0 HZ3 LYS A 106 -23.642 -15.923 -9.525 1.00 53.44 H new ATOM 1644 N LYS A 107 -19.310 -18.436 -14.250 1.00 5.15 N ATOM 1645 CA LYS A 107 -18.212 -17.598 -14.718 1.00 22.41 C ATOM 1646 C LYS A 107 -17.916 -16.482 -13.721 1.00 2.12 C ATOM 1647 O LYS A 107 -18.832 -15.860 -13.181 1.00 70.34 O ATOM 1648 CB LYS A 107 -18.547 -17.000 -16.086 1.00 42.32 C ATOM 1649 CG LYS A 107 -19.838 -16.200 -16.100 1.00 53.43 C ATOM 1650 CD LYS A 107 -20.968 -16.977 -16.756 1.00 74.10 C ATOM 1651 CE LYS A 107 -20.942 -16.828 -18.269 1.00 71.11 C ATOM 1652 NZ LYS A 107 -21.753 -17.879 -18.944 1.00 25.43 N ATOM 0 H LYS A 107 -20.236 -18.112 -14.530 1.00 5.15 H new ATOM 0 HA LYS A 107 -17.324 -18.223 -14.810 1.00 22.41 H new ATOM 0 HB2 LYS A 107 -17.727 -16.356 -16.402 1.00 42.32 H new ATOM 0 HB3 LYS A 107 -18.620 -17.805 -16.817 1.00 42.32 H new ATOM 0 HG2 LYS A 107 -20.118 -15.941 -15.079 1.00 53.43 H new ATOM 0 HG3 LYS A 107 -19.681 -15.263 -16.635 1.00 53.43 H new ATOM 0 HD2 LYS A 107 -20.887 -18.031 -16.492 1.00 74.10 H new ATOM 0 HD3 LYS A 107 -21.925 -16.624 -16.371 1.00 74.10 H new ATOM 0 HE2 LYS A 107 -21.322 -15.844 -18.544 1.00 71.11 H new ATOM 0 HE3 LYS A 107 -19.912 -16.882 -18.622 1.00 71.11 H new ATOM 0 HZ1 LYS A 107 -21.710 -17.743 -19.974 1.00 25.43 H new ATOM 0 HZ2 LYS A 107 -21.375 -18.817 -18.703 1.00 25.43 H new ATOM 0 HZ3 LYS A 107 -22.741 -17.812 -18.627 1.00 25.43 H new ATOM 1666 N LEU A 108 -16.634 -16.233 -13.482 1.00 62.00 N ATOM 1667 CA LEU A 108 -16.218 -15.190 -12.551 1.00 31.31 C ATOM 1668 C LEU A 108 -15.550 -14.035 -13.290 1.00 60.45 C ATOM 1669 O LEU A 108 -15.579 -12.893 -12.833 1.00 22.20 O ATOM 1670 CB LEU A 108 -15.259 -15.764 -11.506 1.00 53.53 C ATOM 1671 CG LEU A 108 -15.682 -17.083 -10.860 1.00 64.34 C ATOM 1672 CD1 LEU A 108 -17.182 -17.098 -10.608 1.00 21.01 C ATOM 1673 CD2 LEU A 108 -15.275 -18.260 -11.735 1.00 44.43 C ATOM 0 H LEU A 108 -15.864 -16.739 -13.920 1.00 62.00 H new ATOM 0 HA LEU A 108 -17.108 -14.810 -12.049 1.00 31.31 H new ATOM 0 HB2 LEU A 108 -14.286 -15.908 -11.975 1.00 53.53 H new ATOM 0 HB3 LEU A 108 -15.126 -15.023 -10.718 1.00 53.53 H new ATOM 0 HG LEU A 108 -15.172 -17.175 -9.901 1.00 64.34 H new ATOM 0 HD11 LEU A 108 -17.464 -18.045 -10.148 1.00 21.01 H new ATOM 0 HD12 LEU A 108 -17.447 -16.277 -9.941 1.00 21.01 H new ATOM 0 HD13 LEU A 108 -17.711 -16.983 -11.554 1.00 21.01 H new ATOM 0 HD21 LEU A 108 -15.584 -19.191 -11.260 1.00 44.43 H new ATOM 0 HD22 LEU A 108 -15.756 -18.173 -12.709 1.00 44.43 H new ATOM 0 HD23 LEU A 108 -14.193 -18.260 -11.864 1.00 44.43 H new ATOM 1685 N SER A 109 -14.951 -14.341 -14.437 1.00 64.12 N ATOM 1686 CA SER A 109 -14.274 -13.328 -15.239 1.00 55.15 C ATOM 1687 C SER A 109 -13.668 -13.947 -16.495 1.00 41.05 C ATOM 1688 O SER A 109 -13.649 -15.168 -16.651 1.00 33.13 O ATOM 1689 CB SER A 109 -13.183 -12.641 -14.417 1.00 52.45 C ATOM 1690 OG SER A 109 -13.665 -11.444 -13.830 1.00 54.05 O ATOM 0 H SER A 109 -14.921 -15.281 -14.831 1.00 64.12 H new ATOM 0 HA SER A 109 -15.012 -12.585 -15.541 1.00 55.15 H new ATOM 0 HB2 SER A 109 -12.831 -13.316 -13.637 1.00 52.45 H new ATOM 0 HB3 SER A 109 -12.328 -12.418 -15.055 1.00 52.45 H new ATOM 0 HG SER A 109 -14.569 -11.591 -13.482 1.00 54.05 H new ATOM 1696 N GLN A 110 -13.172 -13.095 -17.386 1.00 73.42 N ATOM 1697 CA GLN A 110 -12.565 -13.557 -18.629 1.00 42.33 C ATOM 1698 C GLN A 110 -11.342 -12.717 -18.982 1.00 70.12 C ATOM 1699 O GLN A 110 -11.462 -11.547 -19.344 1.00 44.53 O ATOM 1700 CB GLN A 110 -13.582 -13.502 -19.770 1.00 72.44 C ATOM 1701 CG GLN A 110 -14.328 -12.181 -19.857 1.00 35.44 C ATOM 1702 CD GLN A 110 -15.449 -12.210 -20.877 1.00 64.20 C ATOM 1703 OE1 GLN A 110 -15.257 -12.639 -22.015 1.00 14.10 O ATOM 1704 NE2 GLN A 110 -16.629 -11.752 -20.475 1.00 21.42 N ATOM 0 H GLN A 110 -13.178 -12.082 -17.271 1.00 73.42 H new ATOM 0 HA GLN A 110 -12.246 -14.589 -18.486 1.00 42.33 H new ATOM 0 HB2 GLN A 110 -13.067 -13.682 -20.714 1.00 72.44 H new ATOM 0 HB3 GLN A 110 -14.303 -14.309 -19.642 1.00 72.44 H new ATOM 0 HG2 GLN A 110 -14.739 -11.935 -18.878 1.00 35.44 H new ATOM 0 HG3 GLN A 110 -13.626 -11.388 -20.116 1.00 35.44 H new ATOM 0 HE21 GLN A 110 -16.744 -11.406 -19.523 1.00 21.42 H new ATOM 0 HE22 GLN A 110 -17.420 -11.747 -21.119 1.00 21.42 H new ATOM 1713 N VAL A 111 -10.162 -13.322 -18.874 1.00 61.10 N ATOM 1714 CA VAL A 111 -8.917 -12.630 -19.182 1.00 4.43 C ATOM 1715 C VAL A 111 -8.553 -12.784 -20.655 1.00 3.33 C ATOM 1716 O VAL A 111 -8.683 -13.867 -21.226 1.00 41.10 O ATOM 1717 CB VAL A 111 -7.754 -13.157 -18.320 1.00 34.54 C ATOM 1718 CG1 VAL A 111 -6.452 -12.470 -18.702 1.00 53.12 C ATOM 1719 CG2 VAL A 111 -8.056 -12.960 -16.842 1.00 22.25 C ATOM 0 H VAL A 111 -10.043 -14.290 -18.575 1.00 61.10 H new ATOM 0 HA VAL A 111 -9.077 -11.575 -18.958 1.00 4.43 H new ATOM 0 HB VAL A 111 -7.641 -14.225 -18.506 1.00 34.54 H new ATOM 0 HG11 VAL A 111 -5.642 -12.855 -18.083 1.00 53.12 H new ATOM 0 HG12 VAL A 111 -6.231 -12.666 -19.751 1.00 53.12 H new ATOM 0 HG13 VAL A 111 -6.548 -11.395 -18.546 1.00 53.12 H new ATOM 0 HG21 VAL A 111 -7.224 -13.338 -16.247 1.00 22.25 H new ATOM 0 HG22 VAL A 111 -8.196 -11.899 -16.638 1.00 22.25 H new ATOM 0 HG23 VAL A 111 -8.965 -13.503 -16.581 1.00 22.25 H new ATOM 1729 N ILE A 112 -8.097 -11.694 -21.262 1.00 40.51 N ATOM 1730 CA ILE A 112 -7.713 -11.709 -22.669 1.00 13.53 C ATOM 1731 C ILE A 112 -6.338 -11.080 -22.870 1.00 35.44 C ATOM 1732 O ILE A 112 -6.173 -9.868 -22.736 1.00 64.54 O ATOM 1733 CB ILE A 112 -8.739 -10.963 -23.541 1.00 10.42 C ATOM 1734 CG1 ILE A 112 -10.160 -11.401 -23.183 1.00 64.13 C ATOM 1735 CG2 ILE A 112 -8.459 -11.207 -25.016 1.00 61.22 C ATOM 1736 CD1 ILE A 112 -11.232 -10.685 -23.974 1.00 11.41 C ATOM 0 H ILE A 112 -7.984 -10.790 -20.803 1.00 40.51 H new ATOM 0 HA ILE A 112 -7.680 -12.754 -22.976 1.00 13.53 H new ATOM 0 HB ILE A 112 -8.649 -9.894 -23.347 1.00 10.42 H new ATOM 0 HG12 ILE A 112 -10.253 -12.474 -23.349 1.00 64.13 H new ATOM 0 HG13 ILE A 112 -10.328 -11.228 -22.120 1.00 64.13 H new ATOM 0 HG21 ILE A 112 -9.193 -10.673 -25.619 1.00 61.22 H new ATOM 0 HG22 ILE A 112 -7.459 -10.849 -25.261 1.00 61.22 H new ATOM 0 HG23 ILE A 112 -8.524 -12.274 -25.227 1.00 61.22 H new ATOM 0 HD11 ILE A 112 -12.213 -11.047 -23.667 1.00 11.41 H new ATOM 0 HD12 ILE A 112 -11.166 -9.613 -23.789 1.00 11.41 H new ATOM 0 HD13 ILE A 112 -11.090 -10.879 -25.037 1.00 11.41 H new ATOM 1748 N GLY A 113 -5.354 -11.912 -23.193 1.00 53.21 N ATOM 1749 CA GLY A 113 -4.006 -11.420 -23.409 1.00 14.23 C ATOM 1750 C GLY A 113 -3.049 -11.849 -22.314 1.00 44.34 C ATOM 1751 O GLY A 113 -3.433 -12.565 -21.391 1.00 21.13 O ATOM 0 H GLY A 113 -5.466 -12.919 -23.309 1.00 53.21 H new ATOM 0 HA2 GLY A 113 -3.640 -11.782 -24.370 1.00 14.23 H new ATOM 0 HA3 GLY A 113 -4.025 -10.332 -23.465 1.00 14.23 H new ATOM 1755 N ALA A 114 -1.798 -11.410 -22.418 1.00 2.12 N ATOM 1756 CA ALA A 114 -0.784 -11.753 -21.429 1.00 50.23 C ATOM 1757 C ALA A 114 -0.442 -10.550 -20.555 1.00 73.31 C ATOM 1758 O ALA A 114 0.651 -9.994 -20.649 1.00 1.34 O ATOM 1759 CB ALA A 114 0.466 -12.280 -22.116 1.00 34.24 C ATOM 0 H ALA A 114 -1.463 -10.816 -23.177 1.00 2.12 H new ATOM 0 HA ALA A 114 -1.188 -12.534 -20.786 1.00 50.23 H new ATOM 0 HB1 ALA A 114 1.215 -12.532 -21.365 1.00 34.24 H new ATOM 0 HB2 ALA A 114 0.216 -13.171 -22.693 1.00 34.24 H new ATOM 0 HB3 ALA A 114 0.864 -11.516 -22.783 1.00 34.24 H new ATOM 1765 N ASP A 115 -1.384 -10.156 -19.705 1.00 11.22 N ATOM 1766 CA ASP A 115 -1.181 -9.020 -18.813 1.00 33.14 C ATOM 1767 C ASP A 115 -1.156 -9.472 -17.355 1.00 50.50 C ATOM 1768 O ASP A 115 -2.203 -9.620 -16.724 1.00 41.34 O ATOM 1769 CB ASP A 115 -2.284 -7.980 -19.019 1.00 73.33 C ATOM 1770 CG ASP A 115 -2.048 -6.718 -18.213 1.00 45.55 C ATOM 1771 OD1 ASP A 115 -1.060 -6.678 -17.451 1.00 51.32 O ATOM 1772 OD2 ASP A 115 -2.851 -5.771 -18.343 1.00 15.43 O ATOM 0 H ASP A 115 -2.295 -10.606 -19.615 1.00 11.22 H new ATOM 0 HA ASP A 115 -0.218 -8.569 -19.051 1.00 33.14 H new ATOM 0 HB2 ASP A 115 -2.346 -7.725 -20.077 1.00 73.33 H new ATOM 0 HB3 ASP A 115 -3.244 -8.413 -18.738 1.00 73.33 H new ATOM 1777 N ILE A 116 0.045 -9.688 -16.830 1.00 43.41 N ATOM 1778 CA ILE A 116 0.206 -10.122 -15.448 1.00 44.52 C ATOM 1779 C ILE A 116 -0.524 -9.186 -14.489 1.00 11.00 C ATOM 1780 O ILE A 116 -1.207 -9.634 -13.568 1.00 0.15 O ATOM 1781 CB ILE A 116 1.691 -10.191 -15.048 1.00 1.13 C ATOM 1782 CG1 ILE A 116 1.828 -10.519 -13.560 1.00 20.02 C ATOM 1783 CG2 ILE A 116 2.388 -8.877 -15.373 1.00 15.41 C ATOM 1784 CD1 ILE A 116 1.149 -11.812 -13.162 1.00 45.32 C ATOM 0 H ILE A 116 0.920 -9.570 -17.340 1.00 43.41 H new ATOM 0 HA ILE A 116 -0.227 -11.120 -15.379 1.00 44.52 H new ATOM 0 HB ILE A 116 2.169 -10.986 -15.620 1.00 1.13 H new ATOM 0 HG12 ILE A 116 2.886 -10.580 -13.305 1.00 20.02 H new ATOM 0 HG13 ILE A 116 1.406 -9.701 -12.975 1.00 20.02 H new ATOM 0 HG21 ILE A 116 3.437 -8.941 -15.085 1.00 15.41 H new ATOM 0 HG22 ILE A 116 2.317 -8.682 -16.443 1.00 15.41 H new ATOM 0 HG23 ILE A 116 1.910 -8.066 -14.824 1.00 15.41 H new ATOM 0 HD11 ILE A 116 1.287 -11.981 -12.094 1.00 45.32 H new ATOM 0 HD12 ILE A 116 0.084 -11.747 -13.385 1.00 45.32 H new ATOM 0 HD13 ILE A 116 1.587 -12.640 -13.720 1.00 45.32 H new ATOM 1796 N SER A 117 -0.376 -7.885 -14.714 1.00 21.43 N ATOM 1797 CA SER A 117 -1.019 -6.885 -13.870 1.00 43.32 C ATOM 1798 C SER A 117 -2.538 -7.004 -13.947 1.00 21.20 C ATOM 1799 O SER A 117 -3.256 -6.524 -13.070 1.00 13.41 O ATOM 1800 CB SER A 117 -0.585 -5.479 -14.286 1.00 12.44 C ATOM 1801 OG SER A 117 0.827 -5.365 -14.302 1.00 62.05 O ATOM 0 H SER A 117 0.184 -7.498 -15.474 1.00 21.43 H new ATOM 0 HA SER A 117 -0.710 -7.063 -12.840 1.00 43.32 H new ATOM 0 HB2 SER A 117 -0.983 -5.250 -15.275 1.00 12.44 H new ATOM 0 HB3 SER A 117 -1.004 -4.747 -13.596 1.00 12.44 H new ATOM 0 HG SER A 117 1.079 -4.457 -14.573 1.00 62.05 H new ATOM 1807 N LYS A 118 -3.021 -7.649 -15.004 1.00 15.20 N ATOM 1808 CA LYS A 118 -4.454 -7.835 -15.198 1.00 45.15 C ATOM 1809 C LYS A 118 -4.949 -9.071 -14.452 1.00 64.05 C ATOM 1810 O LYS A 118 -5.829 -8.979 -13.596 1.00 21.20 O ATOM 1811 CB LYS A 118 -4.776 -7.963 -16.688 1.00 45.12 C ATOM 1812 CG LYS A 118 -6.264 -7.954 -16.992 1.00 72.13 C ATOM 1813 CD LYS A 118 -6.864 -9.345 -16.884 1.00 21.24 C ATOM 1814 CE LYS A 118 -8.215 -9.425 -17.576 1.00 12.53 C ATOM 1815 NZ LYS A 118 -9.141 -8.354 -17.113 1.00 64.22 N ATOM 0 H LYS A 118 -2.440 -8.052 -15.740 1.00 15.20 H new ATOM 0 HA LYS A 118 -4.966 -6.960 -14.796 1.00 45.15 H new ATOM 0 HB2 LYS A 118 -4.299 -7.144 -17.226 1.00 45.12 H new ATOM 0 HB3 LYS A 118 -4.342 -8.888 -17.067 1.00 45.12 H new ATOM 0 HG2 LYS A 118 -6.773 -7.283 -16.301 1.00 72.13 H new ATOM 0 HG3 LYS A 118 -6.429 -7.563 -17.996 1.00 72.13 H new ATOM 0 HD2 LYS A 118 -6.183 -10.071 -17.328 1.00 21.24 H new ATOM 0 HD3 LYS A 118 -6.976 -9.613 -15.834 1.00 21.24 H new ATOM 0 HE2 LYS A 118 -8.076 -9.344 -18.654 1.00 12.53 H new ATOM 0 HE3 LYS A 118 -8.663 -10.400 -17.385 1.00 12.53 H new ATOM 0 HZ1 LYS A 118 -10.125 -8.668 -17.236 1.00 64.22 H new ATOM 0 HZ2 LYS A 118 -8.965 -8.154 -16.108 1.00 64.22 H new ATOM 0 HZ3 LYS A 118 -8.981 -7.491 -17.671 1.00 64.22 H new ATOM 1829 N ILE A 119 -4.377 -10.224 -14.782 1.00 65.15 N ATOM 1830 CA ILE A 119 -4.760 -11.476 -14.142 1.00 50.12 C ATOM 1831 C ILE A 119 -4.652 -11.373 -12.625 1.00 70.05 C ATOM 1832 O ILE A 119 -5.435 -11.979 -11.894 1.00 1.10 O ATOM 1833 CB ILE A 119 -3.884 -12.646 -14.629 1.00 20.21 C ATOM 1834 CG1 ILE A 119 -2.474 -12.534 -14.045 1.00 2.20 C ATOM 1835 CG2 ILE A 119 -3.833 -12.673 -16.148 1.00 22.50 C ATOM 1836 CD1 ILE A 119 -2.277 -13.345 -12.783 1.00 60.34 C ATOM 0 H ILE A 119 -3.647 -10.317 -15.488 1.00 65.15 H new ATOM 0 HA ILE A 119 -5.797 -11.668 -14.418 1.00 50.12 H new ATOM 0 HB ILE A 119 -4.327 -13.580 -14.283 1.00 20.21 H new ATOM 0 HG12 ILE A 119 -1.752 -12.861 -14.794 1.00 2.20 H new ATOM 0 HG13 ILE A 119 -2.260 -11.487 -13.832 1.00 2.20 H new ATOM 0 HG21 ILE A 119 -3.210 -13.505 -16.476 1.00 22.50 H new ATOM 0 HG22 ILE A 119 -4.841 -12.796 -16.544 1.00 22.50 H new ATOM 0 HG23 ILE A 119 -3.411 -11.737 -16.515 1.00 22.50 H new ATOM 0 HD11 ILE A 119 -1.255 -13.218 -12.425 1.00 60.34 H new ATOM 0 HD12 ILE A 119 -2.975 -13.003 -12.018 1.00 60.34 H new ATOM 0 HD13 ILE A 119 -2.459 -14.399 -12.995 1.00 60.34 H new ATOM 1848 N ILE A 120 -3.679 -10.598 -12.157 1.00 42.50 N ATOM 1849 CA ILE A 120 -3.472 -10.412 -10.726 1.00 1.51 C ATOM 1850 C ILE A 120 -4.528 -9.487 -10.133 1.00 62.35 C ATOM 1851 O ILE A 120 -4.932 -9.645 -8.981 1.00 43.52 O ATOM 1852 CB ILE A 120 -2.075 -9.834 -10.430 1.00 53.45 C ATOM 1853 CG1 ILE A 120 -1.929 -8.447 -11.058 1.00 1.40 C ATOM 1854 CG2 ILE A 120 -0.994 -10.772 -10.946 1.00 71.24 C ATOM 1855 CD1 ILE A 120 -2.297 -7.317 -10.122 1.00 14.01 C ATOM 0 H ILE A 120 -3.022 -10.089 -12.748 1.00 42.50 H new ATOM 0 HA ILE A 120 -3.555 -11.396 -10.265 1.00 1.51 H new ATOM 0 HB ILE A 120 -1.959 -9.737 -9.351 1.00 53.45 H new ATOM 0 HG12 ILE A 120 -0.899 -8.313 -11.388 1.00 1.40 H new ATOM 0 HG13 ILE A 120 -2.558 -8.391 -11.946 1.00 1.40 H new ATOM 0 HG21 ILE A 120 -0.013 -10.350 -10.730 1.00 71.24 H new ATOM 0 HG22 ILE A 120 -1.089 -11.741 -10.456 1.00 71.24 H new ATOM 0 HG23 ILE A 120 -1.105 -10.898 -12.023 1.00 71.24 H new ATOM 0 HD11 ILE A 120 -2.169 -6.364 -10.635 1.00 14.01 H new ATOM 0 HD12 ILE A 120 -3.336 -7.426 -9.811 1.00 14.01 H new ATOM 0 HD13 ILE A 120 -1.651 -7.346 -9.245 1.00 14.01 H new ATOM 1867 N SER A 121 -4.974 -8.519 -10.929 1.00 0.12 N ATOM 1868 CA SER A 121 -5.984 -7.567 -10.482 1.00 73.21 C ATOM 1869 C SER A 121 -7.345 -8.240 -10.350 1.00 61.43 C ATOM 1870 O SER A 121 -8.110 -7.941 -9.433 1.00 43.23 O ATOM 1871 CB SER A 121 -6.076 -6.393 -11.461 1.00 52.11 C ATOM 1872 OG SER A 121 -7.168 -5.549 -11.142 1.00 1.41 O ATOM 0 H SER A 121 -4.652 -8.374 -11.886 1.00 0.12 H new ATOM 0 HA SER A 121 -5.687 -7.193 -9.502 1.00 73.21 H new ATOM 0 HB2 SER A 121 -5.149 -5.820 -11.435 1.00 52.11 H new ATOM 0 HB3 SER A 121 -6.189 -6.771 -12.477 1.00 52.11 H new ATOM 0 HG SER A 121 -7.205 -4.806 -11.780 1.00 1.41 H new ATOM 1878 N GLU A 122 -7.641 -9.151 -11.271 1.00 41.41 N ATOM 1879 CA GLU A 122 -8.911 -9.867 -11.257 1.00 61.12 C ATOM 1880 C GLU A 122 -8.906 -10.965 -10.198 1.00 33.11 C ATOM 1881 O GLU A 122 -9.785 -11.018 -9.338 1.00 50.32 O ATOM 1882 CB GLU A 122 -9.197 -10.472 -12.634 1.00 22.41 C ATOM 1883 CG GLU A 122 -9.212 -9.448 -13.757 1.00 53.03 C ATOM 1884 CD GLU A 122 -10.246 -8.361 -13.541 1.00 22.05 C ATOM 1885 OE1 GLU A 122 -11.451 -8.650 -13.698 1.00 60.42 O ATOM 1886 OE2 GLU A 122 -9.851 -7.222 -13.216 1.00 35.23 O ATOM 0 H GLU A 122 -7.019 -9.411 -12.036 1.00 41.41 H new ATOM 0 HA GLU A 122 -9.697 -9.153 -11.011 1.00 61.12 H new ATOM 0 HB2 GLU A 122 -8.443 -11.228 -12.853 1.00 22.41 H new ATOM 0 HB3 GLU A 122 -10.160 -10.981 -12.605 1.00 22.41 H new ATOM 0 HG2 GLU A 122 -8.225 -8.994 -13.842 1.00 53.03 H new ATOM 0 HG3 GLU A 122 -9.413 -9.953 -14.702 1.00 53.03 H new ATOM 1893 N ILE A 123 -7.909 -11.840 -10.268 1.00 72.25 N ATOM 1894 CA ILE A 123 -7.787 -12.938 -9.315 1.00 54.04 C ATOM 1895 C ILE A 123 -7.849 -12.428 -7.879 1.00 62.52 C ATOM 1896 O ILE A 123 -8.689 -12.861 -7.092 1.00 23.52 O ATOM 1897 CB ILE A 123 -6.473 -13.715 -9.516 1.00 31.40 C ATOM 1898 CG1 ILE A 123 -6.487 -14.446 -10.860 1.00 34.31 C ATOM 1899 CG2 ILE A 123 -6.258 -14.697 -8.374 1.00 30.35 C ATOM 1900 CD1 ILE A 123 -5.130 -14.963 -11.281 1.00 24.43 C ATOM 0 H ILE A 123 -7.174 -11.811 -10.974 1.00 72.25 H new ATOM 0 HA ILE A 123 -8.627 -13.609 -9.497 1.00 54.04 H new ATOM 0 HB ILE A 123 -5.646 -13.005 -9.519 1.00 31.40 H new ATOM 0 HG12 ILE A 123 -7.183 -15.282 -10.802 1.00 34.31 H new ATOM 0 HG13 ILE A 123 -6.864 -13.770 -11.628 1.00 34.31 H new ATOM 0 HG21 ILE A 123 -5.325 -15.239 -8.531 1.00 30.35 H new ATOM 0 HG22 ILE A 123 -6.208 -14.153 -7.431 1.00 30.35 H new ATOM 0 HG23 ILE A 123 -7.087 -15.404 -8.341 1.00 30.35 H new ATOM 0 HD11 ILE A 123 -5.216 -15.470 -12.242 1.00 24.43 H new ATOM 0 HD12 ILE A 123 -4.435 -14.128 -11.372 1.00 24.43 H new ATOM 0 HD13 ILE A 123 -4.760 -15.664 -10.533 1.00 24.43 H new ATOM 1912 N ASN A 124 -6.955 -11.503 -7.546 1.00 75.21 N ATOM 1913 CA ASN A 124 -6.908 -10.932 -6.205 1.00 73.45 C ATOM 1914 C ASN A 124 -8.231 -10.258 -5.854 1.00 64.11 C ATOM 1915 O ASN A 124 -8.542 -10.050 -4.683 1.00 42.22 O ATOM 1916 CB ASN A 124 -5.765 -9.921 -6.097 1.00 11.21 C ATOM 1917 CG ASN A 124 -4.402 -10.577 -6.211 1.00 25.22 C ATOM 1918 OD1 ASN A 124 -4.253 -11.774 -5.961 1.00 22.41 O ATOM 1919 ND2 ASN A 124 -3.398 -9.794 -6.588 1.00 11.02 N ATOM 0 H ASN A 124 -6.253 -11.133 -8.187 1.00 75.21 H new ATOM 0 HA ASN A 124 -6.734 -11.744 -5.499 1.00 73.45 H new ATOM 0 HB2 ASN A 124 -5.871 -9.171 -6.881 1.00 11.21 H new ATOM 0 HB3 ASN A 124 -5.835 -9.398 -5.143 1.00 11.21 H new ATOM 0 HD21 ASN A 124 -2.458 -10.179 -6.681 1.00 11.02 H new ATOM 0 HD22 ASN A 124 -3.567 -8.808 -6.785 1.00 11.02 H new ATOM 1926 N ASN A 125 -9.007 -9.921 -6.880 1.00 51.03 N ATOM 1927 CA ASN A 125 -10.298 -9.271 -6.680 1.00 1.33 C ATOM 1928 C ASN A 125 -11.423 -10.300 -6.624 1.00 30.23 C ATOM 1929 O ASN A 125 -12.568 -9.967 -6.321 1.00 34.25 O ATOM 1930 CB ASN A 125 -10.565 -8.266 -7.803 1.00 2.44 C ATOM 1931 CG ASN A 125 -9.914 -6.922 -7.542 1.00 64.22 C ATOM 1932 OD1 ASN A 125 -9.421 -6.660 -6.444 1.00 75.13 O ATOM 1933 ND2 ASN A 125 -9.911 -6.060 -8.553 1.00 2.34 N ATOM 0 H ASN A 125 -8.765 -10.087 -7.857 1.00 51.03 H new ATOM 0 HA ASN A 125 -10.267 -8.742 -5.727 1.00 1.33 H new ATOM 0 HB2 ASN A 125 -10.193 -8.670 -8.745 1.00 2.44 H new ATOM 0 HB3 ASN A 125 -11.640 -8.130 -7.917 1.00 2.44 H new ATOM 0 HD21 ASN A 125 -9.489 -5.139 -8.437 1.00 2.34 H new ATOM 0 HD22 ASN A 125 -10.331 -6.319 -9.446 1.00 2.34 H new ATOM 1940 N ASN A 126 -11.088 -11.552 -6.920 1.00 22.12 N ATOM 1941 CA ASN A 126 -12.069 -12.630 -6.904 1.00 5.34 C ATOM 1942 C ASN A 126 -11.618 -13.763 -5.988 1.00 72.44 C ATOM 1943 O ASN A 126 -12.201 -14.847 -5.991 1.00 24.00 O ATOM 1944 CB ASN A 126 -12.294 -13.164 -8.320 1.00 64.41 C ATOM 1945 CG ASN A 126 -12.924 -12.130 -9.235 1.00 31.12 C ATOM 1946 OD1 ASN A 126 -14.017 -11.632 -8.966 1.00 60.44 O ATOM 1947 ND2 ASN A 126 -12.234 -11.803 -10.321 1.00 44.34 N ATOM 0 H ASN A 126 -10.144 -11.844 -7.174 1.00 22.12 H new ATOM 0 HA ASN A 126 -13.007 -12.228 -6.521 1.00 5.34 H new ATOM 0 HB2 ASN A 126 -11.341 -13.484 -8.740 1.00 64.41 H new ATOM 0 HB3 ASN A 126 -12.935 -14.045 -8.276 1.00 64.41 H new ATOM 0 HD21 ASN A 126 -12.606 -11.113 -10.973 1.00 44.34 H new ATOM 0 HD22 ASN A 126 -11.332 -12.242 -10.503 1.00 44.34 H new ATOM 1954 N ILE A 127 -10.576 -13.504 -5.205 1.00 64.21 N ATOM 1955 CA ILE A 127 -10.048 -14.501 -4.282 1.00 53.31 C ATOM 1956 C ILE A 127 -10.704 -14.383 -2.910 1.00 13.41 C ATOM 1957 O ILE A 127 -10.901 -13.282 -2.398 1.00 22.03 O ATOM 1958 CB ILE A 127 -8.522 -14.367 -4.122 1.00 71.21 C ATOM 1959 CG1 ILE A 127 -7.801 -15.202 -5.183 1.00 12.14 C ATOM 1960 CG2 ILE A 127 -8.096 -14.795 -2.725 1.00 2.33 C ATOM 1961 CD1 ILE A 127 -6.293 -15.104 -5.106 1.00 51.21 C ATOM 0 H ILE A 127 -10.081 -12.612 -5.191 1.00 64.21 H new ATOM 0 HA ILE A 127 -10.277 -15.478 -4.708 1.00 53.31 H new ATOM 0 HB ILE A 127 -8.248 -13.321 -4.260 1.00 71.21 H new ATOM 0 HG12 ILE A 127 -8.095 -16.246 -5.074 1.00 12.14 H new ATOM 0 HG13 ILE A 127 -8.128 -14.880 -6.172 1.00 12.14 H new ATOM 0 HG21 ILE A 127 -7.015 -14.695 -2.628 1.00 2.33 H new ATOM 0 HG22 ILE A 127 -8.587 -14.163 -1.985 1.00 2.33 H new ATOM 0 HG23 ILE A 127 -8.380 -15.834 -2.560 1.00 2.33 H new ATOM 0 HD11 ILE A 127 -5.848 -15.721 -5.887 1.00 51.21 H new ATOM 0 HD12 ILE A 127 -5.988 -14.067 -5.245 1.00 51.21 H new ATOM 0 HD13 ILE A 127 -5.955 -15.454 -4.131 1.00 51.21 H new ATOM 1973 N ASN A 128 -11.038 -15.525 -2.320 1.00 2.43 N ATOM 1974 CA ASN A 128 -11.670 -15.551 -1.006 1.00 53.34 C ATOM 1975 C ASN A 128 -12.835 -14.566 -0.944 1.00 63.41 C ATOM 1976 O ASN A 128 -12.722 -13.492 -0.354 1.00 72.01 O ATOM 1977 CB ASN A 128 -10.648 -15.217 0.083 1.00 3.42 C ATOM 1978 CG ASN A 128 -9.846 -16.430 0.513 1.00 11.34 C ATOM 1979 OD1 ASN A 128 -10.368 -17.330 1.171 1.00 54.30 O ATOM 1980 ND2 ASN A 128 -8.571 -16.457 0.145 1.00 25.45 N ATOM 0 H ASN A 128 -10.882 -16.445 -2.731 1.00 2.43 H new ATOM 0 HA ASN A 128 -12.056 -16.556 -0.836 1.00 53.34 H new ATOM 0 HB2 ASN A 128 -9.969 -14.447 -0.283 1.00 3.42 H new ATOM 0 HB3 ASN A 128 -11.165 -14.801 0.948 1.00 3.42 H new ATOM 0 HD21 ASN A 128 -7.981 -17.247 0.407 1.00 25.45 H new ATOM 0 HD22 ASN A 128 -8.181 -15.688 -0.400 1.00 25.45 H new