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 125 ASN : amide:sc= -0.144 X(o=0.75,f=0.9) USER MOD Set 1.2: A 126 ASN : amide:sc= 0.895 K(o=0.75,f=-0.11) USER MOD Set 2.1: A 70 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 124 ASN : amide:sc= -1.16 X(o=-1.2,f=-0.98) USER MOD Single : A 25 GLN : amide:sc= -0.132 K(o=-0.13,f=-1.9!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.0204 K(o=-0.02,f=-0.57) USER MOD Single : A 34 LYS NZ :NH3+ 148:sc= -0.161 (180deg=-0.822) 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 61:sc= 0.58 USER MOD Single : A 39 ASN : amide:sc= -0.101 K(o=-0.1,f=-0.97) USER MOD Single : A 41 ASN : amide:sc= -0.763 K(o=-0.76,f=0) USER MOD Single : A 62 GLN : amide:sc= -0.454 X(o=-0.45,f=-0.41) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc=-0.00187 X(o=-0.0019,f=0) USER MOD Single : A 69 GLN : amide:sc= -0.0105 K(o=-0.011,f=-1.1) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0.205 X(o=0.2,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ -120:sc= -0.798 (180deg=-4.5!) USER MOD Single : A 98 THR OG1 : rot 27:sc= 0.0508 USER MOD Single : A 101 MET CE :methyl -169:sc= -2.74 (180deg=-3.32) USER MOD Single : A 103 LYS NZ :NH3+ 143:sc= -0.0292 (180deg=-0.939) USER MOD Single : A 104 ASN : amide:sc= -0.577 X(o=-0.58,f=-0.73) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 163:sc= -0.0518 (180deg=-0.342) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 138:sc= -0.734 (180deg=-3.06!) USER MOD Single : A 121 SER OG : rot 95:sc= 0.521 USER MOD Single : A 128 ASN : amide:sc= -0.854 K(o=-0.85,f=0) USER MOD ----------------------------------------------------------------- ATOM 316 N ILE A 23 -0.276 -27.559 -14.359 1.00 52.50 N ATOM 317 CA ILE A 23 -1.410 -27.463 -15.269 1.00 71.21 C ATOM 318 C ILE A 23 -1.545 -28.724 -16.115 1.00 10.42 C ATOM 319 O ILE A 23 -0.556 -29.253 -16.619 1.00 53.52 O ATOM 320 CB ILE A 23 -1.281 -26.243 -16.202 1.00 41.35 C ATOM 321 CG1 ILE A 23 -1.202 -24.954 -15.383 1.00 13.10 C ATOM 322 CG2 ILE A 23 -2.453 -26.192 -17.170 1.00 73.31 C ATOM 323 CD1 ILE A 23 -0.885 -23.729 -16.213 1.00 74.23 C ATOM 0 HA ILE A 23 -2.301 -27.346 -14.652 1.00 71.21 H new ATOM 0 HB ILE A 23 -0.362 -26.340 -16.780 1.00 41.35 H new ATOM 0 HG12 ILE A 23 -2.152 -24.800 -14.871 1.00 13.10 H new ATOM 0 HG13 ILE A 23 -0.439 -25.069 -14.613 1.00 13.10 H new ATOM 0 HG21 ILE A 23 -2.348 -25.325 -17.823 1.00 73.31 H new ATOM 0 HG22 ILE A 23 -2.467 -27.100 -17.772 1.00 73.31 H new ATOM 0 HG23 ILE A 23 -3.385 -26.114 -16.610 1.00 73.31 H new ATOM 0 HD11 ILE A 23 -0.845 -22.852 -15.567 1.00 74.23 H new ATOM 0 HD12 ILE A 23 0.079 -23.862 -16.705 1.00 74.23 H new ATOM 0 HD13 ILE A 23 -1.660 -23.589 -16.966 1.00 74.23 H new ATOM 335 N GLU A 24 -2.778 -29.199 -16.266 1.00 71.32 N ATOM 336 CA GLU A 24 -3.042 -30.398 -17.052 1.00 63.12 C ATOM 337 C GLU A 24 -4.191 -30.166 -18.029 1.00 45.22 C ATOM 338 O GLU A 24 -5.076 -29.348 -17.779 1.00 40.33 O ATOM 339 CB GLU A 24 -3.370 -31.576 -16.132 1.00 43.20 C ATOM 340 CG GLU A 24 -4.663 -32.288 -16.492 1.00 24.25 C ATOM 341 CD GLU A 24 -4.961 -33.457 -15.573 1.00 12.10 C ATOM 342 OE1 GLU A 24 -5.609 -33.239 -14.528 1.00 51.31 O ATOM 343 OE2 GLU A 24 -4.546 -34.589 -15.900 1.00 52.34 O ATOM 0 H GLU A 24 -3.608 -28.772 -15.855 1.00 71.32 H new ATOM 0 HA GLU A 24 -2.144 -30.632 -17.623 1.00 63.12 H new ATOM 0 HB2 GLU A 24 -2.549 -32.292 -16.166 1.00 43.20 H new ATOM 0 HB3 GLU A 24 -3.437 -31.216 -15.105 1.00 43.20 H new ATOM 0 HG2 GLU A 24 -5.489 -31.578 -16.449 1.00 24.25 H new ATOM 0 HG3 GLU A 24 -4.603 -32.645 -17.520 1.00 24.25 H new ATOM 350 N GLN A 25 -4.170 -30.893 -19.141 1.00 72.41 N ATOM 351 CA GLN A 25 -5.210 -30.766 -20.156 1.00 70.32 C ATOM 352 C GLN A 25 -6.450 -31.565 -19.769 1.00 34.23 C ATOM 353 O GLN A 25 -6.346 -32.647 -19.191 1.00 3.23 O ATOM 354 CB GLN A 25 -4.687 -31.237 -21.514 1.00 62.23 C ATOM 355 CG GLN A 25 -4.296 -32.706 -21.538 1.00 24.51 C ATOM 356 CD GLN A 25 -3.173 -32.995 -22.516 1.00 33.21 C ATOM 357 OE1 GLN A 25 -2.717 -32.106 -23.235 1.00 64.03 O ATOM 358 NE2 GLN A 25 -2.723 -34.244 -22.548 1.00 41.21 N ATOM 0 H GLN A 25 -3.445 -31.576 -19.362 1.00 72.41 H new ATOM 0 HA GLN A 25 -5.487 -29.714 -20.227 1.00 70.32 H new ATOM 0 HB2 GLN A 25 -5.452 -31.061 -22.270 1.00 62.23 H new ATOM 0 HB3 GLN A 25 -3.822 -30.634 -21.790 1.00 62.23 H new ATOM 0 HG2 GLN A 25 -3.990 -33.013 -20.538 1.00 24.51 H new ATOM 0 HG3 GLN A 25 -5.167 -33.306 -21.803 1.00 24.51 H new ATOM 0 HE21 GLN A 25 -3.131 -34.949 -21.934 1.00 41.21 H new ATOM 0 HE22 GLN A 25 -1.970 -34.498 -23.187 1.00 41.21 H new ATOM 367 N ILE A 26 -7.620 -31.025 -20.092 1.00 31.52 N ATOM 368 CA ILE A 26 -8.879 -31.690 -19.778 1.00 43.51 C ATOM 369 C ILE A 26 -9.822 -31.672 -20.976 1.00 72.10 C ATOM 370 O ILE A 26 -9.469 -31.192 -22.052 1.00 74.50 O ATOM 371 CB ILE A 26 -9.581 -31.028 -18.577 1.00 53.31 C ATOM 372 CG1 ILE A 26 -9.903 -29.565 -18.889 1.00 70.00 C ATOM 373 CG2 ILE A 26 -8.711 -31.131 -17.333 1.00 53.23 C ATOM 374 CD1 ILE A 26 -11.277 -29.363 -19.487 1.00 44.33 C ATOM 0 H ILE A 26 -7.723 -30.130 -20.570 1.00 31.52 H new ATOM 0 HA ILE A 26 -8.637 -32.722 -19.523 1.00 43.51 H new ATOM 0 HB ILE A 26 -10.517 -31.553 -18.387 1.00 53.31 H new ATOM 0 HG12 ILE A 26 -9.825 -28.981 -17.972 1.00 70.00 H new ATOM 0 HG13 ILE A 26 -9.154 -29.176 -19.579 1.00 70.00 H new ATOM 0 HG21 ILE A 26 -9.220 -30.659 -16.493 1.00 53.23 H new ATOM 0 HG22 ILE A 26 -8.528 -32.181 -17.103 1.00 53.23 H new ATOM 0 HG23 ILE A 26 -7.761 -30.627 -17.511 1.00 53.23 H new ATOM 0 HD11 ILE A 26 -11.437 -28.303 -19.682 1.00 44.33 H new ATOM 0 HD12 ILE A 26 -11.353 -29.919 -20.421 1.00 44.33 H new ATOM 0 HD13 ILE A 26 -12.034 -29.721 -18.789 1.00 44.33 H new ATOM 386 N GLY A 27 -11.028 -32.200 -20.781 1.00 34.03 N ATOM 387 CA GLY A 27 -12.004 -32.235 -21.853 1.00 51.40 C ATOM 388 C GLY A 27 -13.303 -31.547 -21.478 1.00 43.34 C ATOM 389 O GLY A 27 -13.524 -31.221 -20.311 1.00 62.43 O ATOM 0 H GLY A 27 -11.345 -32.604 -19.900 1.00 34.03 H new ATOM 0 HA2 GLY A 27 -11.585 -31.756 -22.738 1.00 51.40 H new ATOM 0 HA3 GLY A 27 -12.209 -33.272 -22.119 1.00 51.40 H new ATOM 393 N ASP A 28 -14.161 -31.327 -22.467 1.00 72.03 N ATOM 394 CA ASP A 28 -15.443 -30.673 -22.234 1.00 72.25 C ATOM 395 C ASP A 28 -16.364 -31.562 -21.403 1.00 30.43 C ATOM 396 O ASP A 28 -17.205 -31.070 -20.651 1.00 45.30 O ATOM 397 CB ASP A 28 -16.113 -30.328 -23.565 1.00 20.12 C ATOM 398 CG ASP A 28 -17.010 -29.110 -23.463 1.00 62.32 C ATOM 399 OD1 ASP A 28 -17.116 -28.543 -22.356 1.00 15.13 O ATOM 400 OD2 ASP A 28 -17.606 -28.724 -24.491 1.00 61.43 O ATOM 0 H ASP A 28 -13.992 -31.592 -23.438 1.00 72.03 H new ATOM 0 HA ASP A 28 -15.258 -29.753 -21.680 1.00 72.25 H new ATOM 0 HB2 ASP A 28 -15.346 -30.149 -24.319 1.00 20.12 H new ATOM 0 HB3 ASP A 28 -16.701 -31.181 -23.905 1.00 20.12 H new ATOM 405 N SER A 29 -16.199 -32.873 -21.547 1.00 34.14 N ATOM 406 CA SER A 29 -17.017 -33.831 -20.813 1.00 40.21 C ATOM 407 C SER A 29 -16.574 -33.921 -19.356 1.00 24.42 C ATOM 408 O SER A 29 -17.341 -34.338 -18.488 1.00 3.01 O ATOM 409 CB SER A 29 -16.936 -35.211 -21.469 1.00 63.34 C ATOM 410 OG SER A 29 -17.750 -35.274 -22.627 1.00 42.24 O ATOM 0 H SER A 29 -15.506 -33.296 -22.165 1.00 34.14 H new ATOM 0 HA SER A 29 -18.050 -33.484 -20.839 1.00 40.21 H new ATOM 0 HB2 SER A 29 -15.902 -35.430 -21.735 1.00 63.34 H new ATOM 0 HB3 SER A 29 -17.251 -35.974 -20.757 1.00 63.34 H new ATOM 0 HG SER A 29 -17.679 -36.165 -23.028 1.00 42.24 H new ATOM 416 N GLU A 30 -15.332 -33.527 -19.096 1.00 3.41 N ATOM 417 CA GLU A 30 -14.786 -33.563 -17.745 1.00 21.44 C ATOM 418 C GLU A 30 -14.663 -32.156 -17.169 1.00 70.14 C ATOM 419 O GLU A 30 -14.296 -31.977 -16.007 1.00 61.05 O ATOM 420 CB GLU A 30 -13.419 -34.249 -17.741 1.00 71.22 C ATOM 421 CG GLU A 30 -13.319 -35.412 -18.714 1.00 52.14 C ATOM 422 CD GLU A 30 -14.513 -36.343 -18.637 1.00 63.22 C ATOM 423 OE1 GLU A 30 -15.100 -36.463 -17.542 1.00 62.15 O ATOM 424 OE2 GLU A 30 -14.860 -36.951 -19.672 1.00 33.44 O ATOM 0 H GLU A 30 -14.685 -33.179 -19.803 1.00 3.41 H new ATOM 0 HA GLU A 30 -15.472 -34.134 -17.119 1.00 21.44 H new ATOM 0 HB2 GLU A 30 -12.652 -33.514 -17.986 1.00 71.22 H new ATOM 0 HB3 GLU A 30 -13.205 -34.609 -16.735 1.00 71.22 H new ATOM 0 HG2 GLU A 30 -13.230 -35.025 -19.729 1.00 52.14 H new ATOM 0 HG3 GLU A 30 -12.410 -35.976 -18.507 1.00 52.14 H new ATOM 431 N PHE A 31 -14.971 -31.158 -17.991 1.00 51.15 N ATOM 432 CA PHE A 31 -14.893 -29.765 -17.566 1.00 15.33 C ATOM 433 C PHE A 31 -15.520 -29.581 -16.188 1.00 52.25 C ATOM 434 O PHE A 31 -14.820 -29.374 -15.197 1.00 53.02 O ATOM 435 CB PHE A 31 -15.591 -28.859 -18.582 1.00 75.15 C ATOM 436 CG PHE A 31 -15.898 -27.488 -18.052 1.00 65.24 C ATOM 437 CD1 PHE A 31 -14.877 -26.630 -17.678 1.00 33.35 C ATOM 438 CD2 PHE A 31 -17.210 -27.058 -17.927 1.00 72.53 C ATOM 439 CE1 PHE A 31 -15.157 -25.368 -17.189 1.00 31.30 C ATOM 440 CE2 PHE A 31 -17.496 -25.796 -17.438 1.00 51.23 C ATOM 441 CZ PHE A 31 -16.468 -24.950 -17.070 1.00 13.43 C ATOM 0 H PHE A 31 -15.277 -31.288 -18.955 1.00 51.15 H new ATOM 0 HA PHE A 31 -13.840 -29.488 -17.507 1.00 15.33 H new ATOM 0 HB2 PHE A 31 -14.961 -28.765 -19.466 1.00 75.15 H new ATOM 0 HB3 PHE A 31 -16.519 -29.333 -18.901 1.00 75.15 H new ATOM 0 HD1 PHE A 31 -13.850 -26.951 -17.770 1.00 33.35 H new ATOM 0 HD2 PHE A 31 -18.017 -27.715 -18.214 1.00 72.53 H new ATOM 0 HE1 PHE A 31 -14.351 -24.709 -16.900 1.00 31.30 H new ATOM 0 HE2 PHE A 31 -18.522 -25.472 -17.344 1.00 51.23 H new ATOM 0 HZ PHE A 31 -16.689 -23.964 -16.690 1.00 13.43 H new ATOM 451 N ASP A 32 -16.846 -29.658 -16.133 1.00 14.24 N ATOM 452 CA ASP A 32 -17.570 -29.500 -14.877 1.00 72.32 C ATOM 453 C ASP A 32 -17.266 -30.654 -13.927 1.00 72.42 C ATOM 454 O ASP A 32 -17.394 -30.520 -12.710 1.00 33.44 O ATOM 455 CB ASP A 32 -19.075 -29.420 -15.138 1.00 63.01 C ATOM 456 CG ASP A 32 -19.551 -30.479 -16.113 1.00 24.01 C ATOM 457 OD1 ASP A 32 -19.625 -31.660 -15.715 1.00 50.53 O ATOM 458 OD2 ASP A 32 -19.847 -30.127 -17.274 1.00 24.23 O ATOM 0 H ASP A 32 -17.441 -29.829 -16.944 1.00 14.24 H new ATOM 0 HA ASP A 32 -17.241 -28.572 -14.410 1.00 72.32 H new ATOM 0 HB2 ASP A 32 -19.611 -29.531 -14.195 1.00 63.01 H new ATOM 0 HB3 ASP A 32 -19.321 -28.433 -15.530 1.00 63.01 H new ATOM 463 N ASN A 33 -16.865 -31.790 -14.491 1.00 0.41 N ATOM 464 CA ASN A 33 -16.545 -32.968 -13.694 1.00 71.43 C ATOM 465 C ASN A 33 -15.510 -32.636 -12.623 1.00 5.31 C ATOM 466 O ASN A 33 -15.557 -33.166 -11.513 1.00 42.22 O ATOM 467 CB ASN A 33 -16.024 -34.091 -14.592 1.00 3.30 C ATOM 468 CG ASN A 33 -16.120 -35.452 -13.931 1.00 61.22 C ATOM 469 OD1 ASN A 33 -15.548 -35.678 -12.865 1.00 43.52 O ATOM 470 ND2 ASN A 33 -16.846 -36.367 -14.564 1.00 2.02 N ATOM 0 H ASN A 33 -16.754 -31.919 -15.497 1.00 0.41 H new ATOM 0 HA ASN A 33 -17.458 -33.301 -13.201 1.00 71.43 H new ATOM 0 HB2 ASN A 33 -16.592 -34.101 -15.522 1.00 3.30 H new ATOM 0 HB3 ASN A 33 -14.985 -33.890 -14.855 1.00 3.30 H new ATOM 0 HD21 ASN A 33 -16.947 -37.302 -14.168 1.00 2.02 H new ATOM 0 HD22 ASN A 33 -17.303 -36.135 -15.446 1.00 2.02 H new ATOM 477 N LYS A 34 -14.577 -31.754 -12.964 1.00 61.14 N ATOM 478 CA LYS A 34 -13.530 -31.349 -12.033 1.00 61.34 C ATOM 479 C LYS A 34 -13.658 -29.870 -11.681 1.00 34.21 C ATOM 480 O LYS A 34 -13.078 -29.402 -10.702 1.00 0.52 O ATOM 481 CB LYS A 34 -12.150 -31.623 -12.633 1.00 4.45 C ATOM 482 CG LYS A 34 -11.964 -31.038 -14.023 1.00 54.12 C ATOM 483 CD LYS A 34 -11.629 -32.115 -15.041 1.00 72.43 C ATOM 484 CE LYS A 34 -10.293 -32.776 -14.735 1.00 73.13 C ATOM 485 NZ LYS A 34 -10.465 -34.157 -14.208 1.00 34.51 N ATOM 0 H LYS A 34 -14.524 -31.306 -13.879 1.00 61.14 H new ATOM 0 HA LYS A 34 -13.645 -31.934 -11.120 1.00 61.34 H new ATOM 0 HB2 LYS A 34 -11.387 -31.214 -11.971 1.00 4.45 H new ATOM 0 HB3 LYS A 34 -11.989 -32.700 -12.677 1.00 4.45 H new ATOM 0 HG2 LYS A 34 -12.874 -30.520 -14.326 1.00 54.12 H new ATOM 0 HG3 LYS A 34 -11.167 -30.295 -14.002 1.00 54.12 H new ATOM 0 HD2 LYS A 34 -12.416 -32.869 -15.047 1.00 72.43 H new ATOM 0 HD3 LYS A 34 -11.599 -31.677 -16.039 1.00 72.43 H new ATOM 0 HE2 LYS A 34 -9.687 -32.806 -15.640 1.00 73.13 H new ATOM 0 HE3 LYS A 34 -9.749 -32.175 -14.007 1.00 73.13 H new ATOM 0 HZ1 LYS A 34 -9.661 -34.745 -14.507 1.00 34.51 H new ATOM 0 HZ2 LYS A 34 -10.506 -34.130 -13.169 1.00 34.51 H new ATOM 0 HZ3 LYS A 34 -11.348 -34.563 -14.579 1.00 34.51 H new ATOM 499 N VAL A 35 -14.423 -29.139 -12.487 1.00 34.33 N ATOM 500 CA VAL A 35 -14.629 -27.713 -12.259 1.00 51.44 C ATOM 501 C VAL A 35 -15.791 -27.472 -11.303 1.00 12.33 C ATOM 502 O VAL A 35 -15.637 -26.822 -10.269 1.00 34.24 O ATOM 503 CB VAL A 35 -14.900 -26.968 -13.579 1.00 22.45 C ATOM 504 CG1 VAL A 35 -15.440 -25.573 -13.302 1.00 52.31 C ATOM 505 CG2 VAL A 35 -13.637 -26.902 -14.422 1.00 15.43 C ATOM 0 H VAL A 35 -14.910 -29.511 -13.303 1.00 34.33 H new ATOM 0 HA VAL A 35 -13.712 -27.327 -11.815 1.00 51.44 H new ATOM 0 HB VAL A 35 -15.655 -27.519 -14.140 1.00 22.45 H new ATOM 0 HG11 VAL A 35 -15.626 -25.061 -14.246 1.00 52.31 H new ATOM 0 HG12 VAL A 35 -16.371 -25.648 -12.740 1.00 52.31 H new ATOM 0 HG13 VAL A 35 -14.710 -25.009 -12.721 1.00 52.31 H new ATOM 0 HG21 VAL A 35 -13.847 -26.372 -15.351 1.00 15.43 H new ATOM 0 HG22 VAL A 35 -12.859 -26.374 -13.871 1.00 15.43 H new ATOM 0 HG23 VAL A 35 -13.298 -27.913 -14.649 1.00 15.43 H new ATOM 515 N THR A 36 -16.960 -28.002 -11.654 1.00 23.22 N ATOM 516 CA THR A 36 -18.150 -27.844 -10.829 1.00 25.31 C ATOM 517 C THR A 36 -17.966 -28.503 -9.467 1.00 21.25 C ATOM 518 O THR A 36 -18.670 -28.181 -8.510 1.00 61.41 O ATOM 519 CB THR A 36 -19.392 -28.446 -11.514 1.00 24.40 C ATOM 520 OG1 THR A 36 -20.542 -27.636 -11.241 1.00 52.21 O ATOM 521 CG2 THR A 36 -19.640 -29.867 -11.032 1.00 14.11 C ATOM 0 H THR A 36 -17.107 -28.545 -12.505 1.00 23.22 H new ATOM 0 HA THR A 36 -18.301 -26.773 -10.694 1.00 25.31 H new ATOM 0 HB THR A 36 -19.212 -28.470 -12.589 1.00 24.40 H new ATOM 0 HG1 THR A 36 -21.327 -28.024 -11.681 1.00 52.21 H new ATOM 0 HG21 THR A 36 -20.522 -30.271 -11.529 1.00 14.11 H new ATOM 0 HG22 THR A 36 -18.775 -30.487 -11.267 1.00 14.11 H new ATOM 0 HG23 THR A 36 -19.801 -29.863 -9.954 1.00 14.11 H new ATOM 529 N SER A 37 -17.013 -29.426 -9.385 1.00 14.22 N ATOM 530 CA SER A 37 -16.739 -30.134 -8.140 1.00 52.32 C ATOM 531 C SER A 37 -16.154 -29.187 -7.096 1.00 53.20 C ATOM 532 O SER A 37 -16.279 -29.419 -5.892 1.00 32.53 O ATOM 533 CB SER A 37 -15.773 -31.294 -8.390 1.00 12.31 C ATOM 534 OG SER A 37 -15.785 -32.210 -7.308 1.00 23.30 O ATOM 0 H SER A 37 -16.418 -29.701 -10.166 1.00 14.22 H new ATOM 0 HA SER A 37 -17.681 -30.530 -7.761 1.00 52.32 H new ATOM 0 HB2 SER A 37 -16.049 -31.809 -9.310 1.00 12.31 H new ATOM 0 HB3 SER A 37 -14.764 -30.907 -8.532 1.00 12.31 H new ATOM 0 HG SER A 37 -15.161 -32.943 -7.493 1.00 23.30 H new ATOM 540 N CYS A 38 -15.518 -28.120 -7.564 1.00 31.15 N ATOM 541 CA CYS A 38 -14.912 -27.137 -6.672 1.00 55.44 C ATOM 542 C CYS A 38 -15.953 -26.137 -6.178 1.00 24.01 C ATOM 543 O CYS A 38 -16.404 -25.273 -6.929 1.00 1.31 O ATOM 544 CB CYS A 38 -13.779 -26.400 -7.386 1.00 50.43 C ATOM 545 SG CYS A 38 -12.667 -27.480 -8.317 1.00 51.34 S ATOM 0 H CYS A 38 -15.408 -27.913 -8.557 1.00 31.15 H new ATOM 0 HA CYS A 38 -14.505 -27.667 -5.811 1.00 55.44 H new ATOM 0 HB2 CYS A 38 -14.210 -25.666 -8.067 1.00 50.43 H new ATOM 0 HB3 CYS A 38 -13.198 -25.847 -6.648 1.00 50.43 H new ATOM 0 HG CYS A 38 -13.337 -28.098 -9.244 1.00 51.34 H new ATOM 551 N ASN A 39 -16.332 -26.263 -4.910 1.00 43.53 N ATOM 552 CA ASN A 39 -17.322 -25.372 -4.318 1.00 34.53 C ATOM 553 C ASN A 39 -16.675 -24.447 -3.290 1.00 40.14 C ATOM 554 O ASN A 39 -17.361 -23.844 -2.464 1.00 34.52 O ATOM 555 CB ASN A 39 -18.439 -26.183 -3.658 1.00 62.21 C ATOM 556 CG ASN A 39 -18.082 -26.622 -2.250 1.00 2.12 C ATOM 557 OD1 ASN A 39 -17.061 -27.274 -2.032 1.00 62.30 O ATOM 558 ND2 ASN A 39 -18.924 -26.264 -1.288 1.00 54.11 N ATOM 0 H ASN A 39 -15.969 -26.973 -4.274 1.00 43.53 H new ATOM 0 HA ASN A 39 -17.747 -24.761 -5.114 1.00 34.53 H new ATOM 0 HB2 ASN A 39 -19.350 -25.585 -3.629 1.00 62.21 H new ATOM 0 HB3 ASN A 39 -18.654 -27.062 -4.266 1.00 62.21 H new ATOM 0 HD21 ASN A 39 -18.736 -26.530 -0.321 1.00 54.11 H new ATOM 0 HD22 ASN A 39 -19.758 -25.723 -1.516 1.00 54.11 H new ATOM 565 N ASP A 40 -15.353 -24.342 -3.347 1.00 45.34 N ATOM 566 CA ASP A 40 -14.613 -23.490 -2.424 1.00 20.02 C ATOM 567 C ASP A 40 -14.376 -22.109 -3.028 1.00 50.34 C ATOM 568 O ASP A 40 -13.329 -21.499 -2.814 1.00 73.13 O ATOM 569 CB ASP A 40 -13.276 -24.137 -2.059 1.00 44.11 C ATOM 570 CG ASP A 40 -12.925 -23.957 -0.595 1.00 41.31 C ATOM 571 OD1 ASP A 40 -12.982 -22.807 -0.109 1.00 0.11 O ATOM 572 OD2 ASP A 40 -12.593 -24.964 0.065 1.00 41.24 O ATOM 0 H ASP A 40 -14.771 -24.837 -4.023 1.00 45.34 H new ATOM 0 HA ASP A 40 -15.210 -23.373 -1.520 1.00 20.02 H new ATOM 0 HB2 ASP A 40 -13.315 -25.201 -2.292 1.00 44.11 H new ATOM 0 HB3 ASP A 40 -12.487 -23.705 -2.674 1.00 44.11 H new ATOM 577 N ASN A 41 -15.355 -21.624 -3.785 1.00 64.15 N ATOM 578 CA ASN A 41 -15.253 -20.317 -4.422 1.00 33.45 C ATOM 579 C ASN A 41 -13.921 -20.172 -5.154 1.00 33.24 C ATOM 580 O ASN A 41 -13.381 -19.071 -5.267 1.00 50.23 O ATOM 581 CB ASN A 41 -15.399 -19.205 -3.381 1.00 65.20 C ATOM 582 CG ASN A 41 -16.749 -19.234 -2.691 1.00 23.13 C ATOM 583 OD1 ASN A 41 -16.834 -19.157 -1.465 1.00 25.31 O ATOM 584 ND2 ASN A 41 -17.813 -19.345 -3.478 1.00 63.34 N ATOM 0 H ASN A 41 -16.228 -22.117 -3.972 1.00 64.15 H new ATOM 0 HA ASN A 41 -16.060 -20.231 -5.150 1.00 33.45 H new ATOM 0 HB2 ASN A 41 -14.610 -19.303 -2.635 1.00 65.20 H new ATOM 0 HB3 ASN A 41 -15.262 -18.238 -3.865 1.00 65.20 H new ATOM 0 HD21 ASN A 41 -18.748 -19.369 -3.071 1.00 63.34 H new ATOM 0 HD22 ASN A 41 -17.695 -19.406 -4.489 1.00 63.34 H new ATOM 591 N ILE A 42 -13.400 -21.288 -5.649 1.00 30.15 N ATOM 592 CA ILE A 42 -12.133 -21.284 -6.372 1.00 31.32 C ATOM 593 C ILE A 42 -12.335 -20.895 -7.832 1.00 41.34 C ATOM 594 O ILE A 42 -13.289 -21.332 -8.476 1.00 12.51 O ATOM 595 CB ILE A 42 -11.446 -22.661 -6.308 1.00 40.33 C ATOM 596 CG1 ILE A 42 -9.954 -22.525 -6.621 1.00 31.15 C ATOM 597 CG2 ILE A 42 -12.109 -23.630 -7.275 1.00 3.31 C ATOM 598 CD1 ILE A 42 -9.631 -22.662 -8.093 1.00 74.15 C ATOM 0 H ILE A 42 -13.834 -22.207 -5.563 1.00 30.15 H new ATOM 0 HA ILE A 42 -11.494 -20.545 -5.888 1.00 31.32 H new ATOM 0 HB ILE A 42 -11.552 -23.057 -5.298 1.00 40.33 H new ATOM 0 HG12 ILE A 42 -9.604 -21.554 -6.269 1.00 31.15 H new ATOM 0 HG13 ILE A 42 -9.403 -23.283 -6.064 1.00 31.15 H new ATOM 0 HG21 ILE A 42 -11.612 -24.598 -7.218 1.00 3.31 H new ATOM 0 HG22 ILE A 42 -13.160 -23.745 -7.011 1.00 3.31 H new ATOM 0 HG23 ILE A 42 -12.031 -23.241 -8.290 1.00 3.31 H new ATOM 0 HD11 ILE A 42 -8.556 -22.555 -8.241 1.00 74.15 H new ATOM 0 HD12 ILE A 42 -9.950 -23.643 -8.446 1.00 74.15 H new ATOM 0 HD13 ILE A 42 -10.154 -21.887 -8.654 1.00 74.15 H new ATOM 610 N LEU A 43 -11.428 -20.074 -8.349 1.00 40.54 N ATOM 611 CA LEU A 43 -11.505 -19.626 -9.736 1.00 63.50 C ATOM 612 C LEU A 43 -10.662 -20.517 -10.643 1.00 24.21 C ATOM 613 O LEU A 43 -9.437 -20.556 -10.525 1.00 62.32 O ATOM 614 CB LEU A 43 -11.037 -18.174 -9.851 1.00 50.44 C ATOM 615 CG LEU A 43 -11.379 -17.264 -8.671 1.00 62.42 C ATOM 616 CD1 LEU A 43 -10.247 -17.258 -7.655 1.00 51.24 C ATOM 617 CD2 LEU A 43 -11.670 -15.851 -9.155 1.00 42.21 C ATOM 0 H LEU A 43 -10.631 -19.705 -7.830 1.00 40.54 H new ATOM 0 HA LEU A 43 -12.545 -19.692 -10.056 1.00 63.50 H new ATOM 0 HB2 LEU A 43 -9.955 -18.171 -9.985 1.00 50.44 H new ATOM 0 HB3 LEU A 43 -11.471 -17.744 -10.754 1.00 50.44 H new ATOM 0 HG LEU A 43 -12.274 -17.653 -8.185 1.00 62.42 H new ATOM 0 HD11 LEU A 43 -10.509 -16.605 -6.823 1.00 51.24 H new ATOM 0 HD12 LEU A 43 -10.085 -18.270 -7.285 1.00 51.24 H new ATOM 0 HD13 LEU A 43 -9.335 -16.894 -8.129 1.00 51.24 H new ATOM 0 HD21 LEU A 43 -11.912 -15.217 -8.302 1.00 42.21 H new ATOM 0 HD22 LEU A 43 -10.793 -15.454 -9.666 1.00 42.21 H new ATOM 0 HD23 LEU A 43 -12.514 -15.869 -9.844 1.00 42.21 H new ATOM 629 N ILE A 44 -11.326 -21.230 -11.546 1.00 21.31 N ATOM 630 CA ILE A 44 -10.637 -22.118 -12.475 1.00 65.53 C ATOM 631 C ILE A 44 -10.396 -21.432 -13.816 1.00 4.02 C ATOM 632 O ILE A 44 -11.320 -21.261 -14.613 1.00 24.12 O ATOM 633 CB ILE A 44 -11.435 -23.414 -12.710 1.00 53.24 C ATOM 634 CG1 ILE A 44 -11.600 -24.182 -11.398 1.00 74.33 C ATOM 635 CG2 ILE A 44 -10.743 -24.278 -13.753 1.00 30.21 C ATOM 636 CD1 ILE A 44 -12.876 -23.847 -10.658 1.00 1.45 C ATOM 0 H ILE A 44 -12.340 -21.210 -11.654 1.00 21.31 H new ATOM 0 HA ILE A 44 -9.678 -22.368 -12.021 1.00 65.53 H new ATOM 0 HB ILE A 44 -12.426 -23.152 -13.082 1.00 53.24 H new ATOM 0 HG12 ILE A 44 -11.581 -25.251 -11.608 1.00 74.33 H new ATOM 0 HG13 ILE A 44 -10.748 -23.969 -10.752 1.00 74.33 H new ATOM 0 HG21 ILE A 44 -11.318 -25.191 -13.909 1.00 30.21 H new ATOM 0 HG22 ILE A 44 -10.672 -23.729 -14.692 1.00 30.21 H new ATOM 0 HG23 ILE A 44 -9.742 -24.535 -13.407 1.00 30.21 H new ATOM 0 HD11 ILE A 44 -12.926 -24.429 -9.737 1.00 1.45 H new ATOM 0 HD12 ILE A 44 -12.888 -22.784 -10.417 1.00 1.45 H new ATOM 0 HD13 ILE A 44 -13.734 -24.087 -11.286 1.00 1.45 H new ATOM 648 N LEU A 45 -9.150 -21.041 -14.058 1.00 43.35 N ATOM 649 CA LEU A 45 -8.786 -20.374 -15.304 1.00 3.23 C ATOM 650 C LEU A 45 -8.602 -21.387 -16.430 1.00 11.21 C ATOM 651 O LEU A 45 -7.572 -22.057 -16.513 1.00 74.13 O ATOM 652 CB LEU A 45 -7.503 -19.564 -15.116 1.00 44.40 C ATOM 653 CG LEU A 45 -7.647 -18.245 -14.356 1.00 62.25 C ATOM 654 CD1 LEU A 45 -7.940 -18.506 -12.886 1.00 40.02 C ATOM 655 CD2 LEU A 45 -6.390 -17.400 -14.509 1.00 41.32 C ATOM 0 H LEU A 45 -8.375 -21.174 -13.409 1.00 43.35 H new ATOM 0 HA LEU A 45 -9.597 -19.699 -15.577 1.00 3.23 H new ATOM 0 HB2 LEU A 45 -6.778 -20.186 -14.590 1.00 44.40 H new ATOM 0 HB3 LEU A 45 -7.085 -19.350 -16.100 1.00 44.40 H new ATOM 0 HG LEU A 45 -8.485 -17.693 -14.781 1.00 62.25 H new ATOM 0 HD11 LEU A 45 -8.039 -17.556 -12.361 1.00 40.02 H new ATOM 0 HD12 LEU A 45 -8.868 -19.070 -12.795 1.00 40.02 H new ATOM 0 HD13 LEU A 45 -7.123 -19.079 -12.448 1.00 40.02 H new ATOM 0 HD21 LEU A 45 -6.511 -16.465 -13.961 1.00 41.32 H new ATOM 0 HD22 LEU A 45 -5.534 -17.945 -14.111 1.00 41.32 H new ATOM 0 HD23 LEU A 45 -6.223 -17.183 -15.564 1.00 41.32 H new ATOM 667 N VAL A 46 -9.605 -21.492 -17.295 1.00 2.42 N ATOM 668 CA VAL A 46 -9.552 -22.420 -18.418 1.00 64.44 C ATOM 669 C VAL A 46 -9.078 -21.721 -19.687 1.00 14.45 C ATOM 670 O VAL A 46 -9.799 -20.911 -20.268 1.00 14.22 O ATOM 671 CB VAL A 46 -10.928 -23.060 -18.682 1.00 13.24 C ATOM 672 CG1 VAL A 46 -10.865 -23.980 -19.892 1.00 34.10 C ATOM 673 CG2 VAL A 46 -11.408 -23.816 -17.452 1.00 71.13 C ATOM 0 H VAL A 46 -10.465 -20.946 -17.240 1.00 2.42 H new ATOM 0 HA VAL A 46 -8.841 -23.201 -18.150 1.00 64.44 H new ATOM 0 HB VAL A 46 -11.644 -22.266 -18.895 1.00 13.24 H new ATOM 0 HG11 VAL A 46 -11.846 -24.423 -20.063 1.00 34.10 H new ATOM 0 HG12 VAL A 46 -10.567 -23.407 -20.770 1.00 34.10 H new ATOM 0 HG13 VAL A 46 -10.136 -24.770 -19.711 1.00 34.10 H new ATOM 0 HG21 VAL A 46 -12.382 -24.262 -17.656 1.00 71.13 H new ATOM 0 HG22 VAL A 46 -10.693 -24.601 -17.206 1.00 71.13 H new ATOM 0 HG23 VAL A 46 -11.493 -23.127 -16.612 1.00 71.13 H new ATOM 683 N ASP A 47 -7.859 -22.041 -20.112 1.00 71.33 N ATOM 684 CA ASP A 47 -7.288 -21.444 -21.313 1.00 75.44 C ATOM 685 C ASP A 47 -7.451 -22.375 -22.512 1.00 44.42 C ATOM 686 O ASP A 47 -7.639 -23.581 -22.353 1.00 2.15 O ATOM 687 CB ASP A 47 -5.808 -21.128 -21.096 1.00 2.13 C ATOM 688 CG ASP A 47 -5.247 -20.215 -22.169 1.00 51.30 C ATOM 689 OD1 ASP A 47 -6.017 -19.395 -22.713 1.00 25.30 O ATOM 690 OD2 ASP A 47 -4.039 -20.321 -22.467 1.00 35.11 O ATOM 0 H ASP A 47 -7.249 -22.710 -19.642 1.00 71.33 H new ATOM 0 HA ASP A 47 -7.824 -20.517 -21.519 1.00 75.44 H new ATOM 0 HB2 ASP A 47 -5.679 -20.659 -20.120 1.00 2.13 H new ATOM 0 HB3 ASP A 47 -5.239 -22.058 -21.081 1.00 2.13 H new ATOM 695 N PHE A 48 -7.381 -21.805 -23.710 1.00 52.31 N ATOM 696 CA PHE A 48 -7.522 -22.582 -24.936 1.00 61.22 C ATOM 697 C PHE A 48 -6.184 -22.709 -25.658 1.00 3.21 C ATOM 698 O PHE A 48 -5.138 -22.353 -25.115 1.00 44.32 O ATOM 699 CB PHE A 48 -8.554 -21.931 -25.860 1.00 14.53 C ATOM 700 CG PHE A 48 -9.866 -21.646 -25.188 1.00 12.12 C ATOM 701 CD1 PHE A 48 -10.529 -22.638 -24.484 1.00 11.40 C ATOM 702 CD2 PHE A 48 -10.437 -20.386 -25.260 1.00 52.21 C ATOM 703 CE1 PHE A 48 -11.737 -22.379 -23.864 1.00 0.41 C ATOM 704 CE2 PHE A 48 -11.645 -20.119 -24.642 1.00 54.22 C ATOM 705 CZ PHE A 48 -12.295 -21.117 -23.943 1.00 2.15 C ATOM 0 H PHE A 48 -7.227 -20.808 -23.858 1.00 52.31 H new ATOM 0 HA PHE A 48 -7.864 -23.581 -24.666 1.00 61.22 H new ATOM 0 HB2 PHE A 48 -8.144 -20.999 -26.249 1.00 14.53 H new ATOM 0 HB3 PHE A 48 -8.727 -22.584 -26.715 1.00 14.53 H new ATOM 0 HD1 PHE A 48 -10.097 -23.626 -24.419 1.00 11.40 H new ATOM 0 HD2 PHE A 48 -9.932 -19.602 -25.806 1.00 52.21 H new ATOM 0 HE1 PHE A 48 -12.244 -23.161 -23.319 1.00 0.41 H new ATOM 0 HE2 PHE A 48 -12.079 -19.132 -24.706 1.00 54.22 H new ATOM 0 HZ PHE A 48 -13.238 -20.912 -23.459 1.00 2.15 H new ATOM 884 N GLU A 60 3.463 -17.767 -22.001 1.00 12.25 N ATOM 885 CA GLU A 60 3.069 -16.981 -20.837 1.00 32.45 C ATOM 886 C GLU A 60 3.161 -17.815 -19.563 1.00 55.42 C ATOM 887 O GLU A 60 2.154 -18.219 -18.981 1.00 62.12 O ATOM 888 CB GLU A 60 1.644 -16.450 -21.011 1.00 30.34 C ATOM 889 CG GLU A 60 1.381 -15.851 -22.382 1.00 32.33 C ATOM 890 CD GLU A 60 -0.069 -15.454 -22.577 1.00 23.13 C ATOM 891 OE1 GLU A 60 -0.839 -15.516 -21.595 1.00 50.14 O ATOM 892 OE2 GLU A 60 -0.435 -15.081 -23.711 1.00 35.42 O ATOM 0 HA GLU A 60 3.754 -16.138 -20.750 1.00 32.45 H new ATOM 0 HB2 GLU A 60 0.939 -17.263 -20.838 1.00 30.34 H new ATOM 0 HB3 GLU A 60 1.452 -15.693 -20.250 1.00 30.34 H new ATOM 0 HG2 GLU A 60 2.015 -14.975 -22.519 1.00 32.33 H new ATOM 0 HG3 GLU A 60 1.663 -16.572 -23.149 1.00 32.33 H new ATOM 899 N PRO A 61 4.399 -18.079 -19.117 1.00 14.41 N ATOM 900 CA PRO A 61 4.653 -18.867 -17.907 1.00 50.20 C ATOM 901 C PRO A 61 4.249 -18.125 -16.638 1.00 41.53 C ATOM 902 O PRO A 61 4.168 -18.717 -15.562 1.00 22.32 O ATOM 903 CB PRO A 61 6.167 -19.086 -17.939 1.00 62.02 C ATOM 904 CG PRO A 61 6.699 -17.947 -18.736 1.00 1.52 C ATOM 905 CD PRO A 61 5.645 -17.629 -19.761 1.00 3.21 C ATOM 0 HA PRO A 61 4.075 -19.791 -17.893 1.00 50.20 H new ATOM 0 HB2 PRO A 61 6.587 -19.095 -16.933 1.00 62.02 H new ATOM 0 HB3 PRO A 61 6.419 -20.042 -18.398 1.00 62.02 H new ATOM 0 HG2 PRO A 61 6.897 -17.084 -18.100 1.00 1.52 H new ATOM 0 HG3 PRO A 61 7.641 -18.213 -19.215 1.00 1.52 H new ATOM 0 HD2 PRO A 61 5.617 -16.564 -19.992 1.00 3.21 H new ATOM 0 HD3 PRO A 61 5.825 -18.154 -20.699 1.00 3.21 H new ATOM 913 N GLN A 62 3.997 -16.827 -16.771 1.00 11.15 N ATOM 914 CA GLN A 62 3.601 -16.005 -15.632 1.00 4.33 C ATOM 915 C GLN A 62 2.348 -16.565 -14.968 1.00 54.12 C ATOM 916 O GLN A 62 2.201 -16.504 -13.746 1.00 64.54 O ATOM 917 CB GLN A 62 3.356 -14.563 -16.079 1.00 70.43 C ATOM 918 CG GLN A 62 4.540 -13.941 -16.804 1.00 42.43 C ATOM 919 CD GLN A 62 4.142 -12.753 -17.657 1.00 2.22 C ATOM 920 OE1 GLN A 62 4.642 -11.644 -17.470 1.00 72.41 O ATOM 921 NE2 GLN A 62 3.238 -12.980 -18.603 1.00 53.33 N ATOM 0 H GLN A 62 4.060 -16.322 -17.655 1.00 11.15 H new ATOM 0 HA GLN A 62 4.412 -16.019 -14.904 1.00 4.33 H new ATOM 0 HB2 GLN A 62 2.485 -14.537 -16.734 1.00 70.43 H new ATOM 0 HB3 GLN A 62 3.116 -13.956 -15.206 1.00 70.43 H new ATOM 0 HG2 GLN A 62 5.284 -13.626 -16.073 1.00 42.43 H new ATOM 0 HG3 GLN A 62 5.012 -14.695 -17.434 1.00 42.43 H new ATOM 0 HE21 GLN A 62 2.849 -13.915 -18.723 1.00 53.33 H new ATOM 0 HE22 GLN A 62 2.932 -12.219 -19.209 1.00 53.33 H new ATOM 930 N LEU A 63 1.446 -17.107 -15.778 1.00 3.30 N ATOM 931 CA LEU A 63 0.204 -17.677 -15.268 1.00 51.52 C ATOM 932 C LEU A 63 0.487 -18.818 -14.296 1.00 11.10 C ATOM 933 O LEU A 63 -0.102 -18.885 -13.217 1.00 50.22 O ATOM 934 CB LEU A 63 -0.661 -18.181 -16.424 1.00 63.14 C ATOM 935 CG LEU A 63 -1.479 -17.122 -17.163 1.00 4.31 C ATOM 936 CD1 LEU A 63 -2.423 -16.412 -16.204 1.00 33.34 C ATOM 937 CD2 LEU A 63 -0.561 -16.121 -17.848 1.00 44.21 C ATOM 0 H LEU A 63 1.551 -17.164 -16.791 1.00 3.30 H new ATOM 0 HA LEU A 63 -0.334 -16.894 -14.734 1.00 51.52 H new ATOM 0 HB2 LEU A 63 -0.013 -18.679 -17.145 1.00 63.14 H new ATOM 0 HB3 LEU A 63 -1.346 -18.935 -16.037 1.00 63.14 H new ATOM 0 HG LEU A 63 -2.076 -17.620 -17.927 1.00 4.31 H new ATOM 0 HD11 LEU A 63 -2.997 -15.662 -16.747 1.00 33.34 H new ATOM 0 HD12 LEU A 63 -3.104 -17.138 -15.759 1.00 33.34 H new ATOM 0 HD13 LEU A 63 -1.845 -15.927 -15.417 1.00 33.34 H new ATOM 0 HD21 LEU A 63 -1.161 -15.375 -18.369 1.00 44.21 H new ATOM 0 HD22 LEU A 63 0.062 -15.629 -17.101 1.00 44.21 H new ATOM 0 HD23 LEU A 63 0.074 -16.641 -18.565 1.00 44.21 H new ATOM 949 N GLU A 64 1.393 -19.710 -14.684 1.00 45.21 N ATOM 950 CA GLU A 64 1.754 -20.845 -13.844 1.00 2.31 C ATOM 951 C GLU A 64 2.503 -20.384 -12.597 1.00 45.41 C ATOM 952 O GLU A 64 2.215 -20.828 -11.486 1.00 21.22 O ATOM 953 CB GLU A 64 2.614 -21.836 -14.631 1.00 23.31 C ATOM 954 CG GLU A 64 2.101 -22.106 -16.035 1.00 22.31 C ATOM 955 CD GLU A 64 2.428 -23.505 -16.518 1.00 12.53 C ATOM 956 OE1 GLU A 64 2.447 -24.431 -15.681 1.00 51.52 O ATOM 957 OE2 GLU A 64 2.666 -23.674 -17.732 1.00 32.21 O ATOM 0 H GLU A 64 1.890 -19.668 -15.574 1.00 45.21 H new ATOM 0 HA GLU A 64 0.834 -21.340 -13.532 1.00 2.31 H new ATOM 0 HB2 GLU A 64 3.632 -21.451 -14.693 1.00 23.31 H new ATOM 0 HB3 GLU A 64 2.662 -22.777 -14.083 1.00 23.31 H new ATOM 0 HG2 GLU A 64 1.021 -21.962 -16.057 1.00 22.31 H new ATOM 0 HG3 GLU A 64 2.534 -21.378 -16.722 1.00 22.31 H new ATOM 964 N LYS A 65 3.466 -19.489 -12.790 1.00 53.21 N ATOM 965 CA LYS A 65 4.258 -18.966 -11.683 1.00 34.44 C ATOM 966 C LYS A 65 3.357 -18.432 -10.574 1.00 3.12 C ATOM 967 O LYS A 65 3.481 -18.828 -9.414 1.00 2.53 O ATOM 968 CB LYS A 65 5.189 -17.855 -12.176 1.00 20.12 C ATOM 969 CG LYS A 65 6.392 -17.628 -11.277 1.00 22.54 C ATOM 970 CD LYS A 65 7.412 -16.711 -11.932 1.00 64.11 C ATOM 971 CE LYS A 65 8.430 -16.199 -10.923 1.00 75.14 C ATOM 972 NZ LYS A 65 7.982 -14.935 -10.277 1.00 55.11 N ATOM 0 H LYS A 65 3.717 -19.111 -13.703 1.00 53.21 H new ATOM 0 HA LYS A 65 4.857 -19.783 -11.280 1.00 34.44 H new ATOM 0 HB2 LYS A 65 5.537 -18.102 -13.179 1.00 20.12 H new ATOM 0 HB3 LYS A 65 4.624 -16.926 -12.254 1.00 20.12 H new ATOM 0 HG2 LYS A 65 6.065 -17.194 -10.332 1.00 22.54 H new ATOM 0 HG3 LYS A 65 6.859 -18.585 -11.043 1.00 22.54 H new ATOM 0 HD2 LYS A 65 7.926 -17.248 -12.729 1.00 64.11 H new ATOM 0 HD3 LYS A 65 6.900 -15.867 -12.394 1.00 64.11 H new ATOM 0 HE2 LYS A 65 8.597 -16.958 -10.159 1.00 75.14 H new ATOM 0 HE3 LYS A 65 9.385 -16.033 -11.422 1.00 75.14 H new ATOM 0 HZ1 LYS A 65 8.702 -14.619 -9.597 1.00 55.11 H new ATOM 0 HZ2 LYS A 65 7.846 -14.203 -11.003 1.00 55.11 H new ATOM 0 HZ3 LYS A 65 7.084 -15.099 -9.779 1.00 55.11 H new ATOM 986 N LEU A 66 2.448 -17.534 -10.938 1.00 62.23 N ATOM 987 CA LEU A 66 1.524 -16.947 -9.973 1.00 42.40 C ATOM 988 C LEU A 66 0.496 -17.975 -9.509 1.00 34.31 C ATOM 989 O LEU A 66 0.070 -17.963 -8.355 1.00 43.55 O ATOM 990 CB LEU A 66 0.814 -15.740 -10.587 1.00 35.22 C ATOM 991 CG LEU A 66 1.574 -14.415 -10.534 1.00 12.31 C ATOM 992 CD1 LEU A 66 1.893 -14.040 -9.095 1.00 3.13 C ATOM 993 CD2 LEU A 66 2.850 -14.498 -11.360 1.00 20.50 C ATOM 0 H LEU A 66 2.331 -17.197 -11.893 1.00 62.23 H new ATOM 0 HA LEU A 66 2.100 -16.620 -9.107 1.00 42.40 H new ATOM 0 HB2 LEU A 66 0.591 -15.967 -11.630 1.00 35.22 H new ATOM 0 HB3 LEU A 66 -0.141 -15.608 -10.079 1.00 35.22 H new ATOM 0 HG LEU A 66 0.939 -13.637 -10.959 1.00 12.31 H new ATOM 0 HD11 LEU A 66 2.434 -13.094 -9.077 1.00 3.13 H new ATOM 0 HD12 LEU A 66 0.966 -13.938 -8.531 1.00 3.13 H new ATOM 0 HD13 LEU A 66 2.508 -14.819 -8.644 1.00 3.13 H new ATOM 0 HD21 LEU A 66 3.378 -13.546 -11.311 1.00 20.50 H new ATOM 0 HD22 LEU A 66 3.489 -15.288 -10.965 1.00 20.50 H new ATOM 0 HD23 LEU A 66 2.598 -14.720 -12.397 1.00 20.50 H new ATOM 1005 N ALA A 67 0.104 -18.863 -10.417 1.00 62.40 N ATOM 1006 CA ALA A 67 -0.870 -19.900 -10.100 1.00 31.15 C ATOM 1007 C ALA A 67 -0.440 -20.700 -8.875 1.00 1.14 C ATOM 1008 O ALA A 67 -1.278 -21.171 -8.106 1.00 75.05 O ATOM 1009 CB ALA A 67 -1.067 -20.822 -11.294 1.00 20.14 C ATOM 0 H ALA A 67 0.446 -18.885 -11.378 1.00 62.40 H new ATOM 0 HA ALA A 67 -1.819 -19.415 -9.870 1.00 31.15 H new ATOM 0 HB1 ALA A 67 -1.797 -21.592 -11.043 1.00 20.14 H new ATOM 0 HB2 ALA A 67 -1.427 -20.244 -12.145 1.00 20.14 H new ATOM 0 HB3 ALA A 67 -0.118 -21.292 -11.551 1.00 20.14 H new ATOM 1015 N GLN A 68 0.869 -20.852 -8.703 1.00 12.15 N ATOM 1016 CA GLN A 68 1.408 -21.598 -7.572 1.00 64.31 C ATOM 1017 C GLN A 68 1.374 -20.758 -6.299 1.00 50.20 C ATOM 1018 O GLN A 68 1.230 -21.288 -5.199 1.00 5.42 O ATOM 1019 CB GLN A 68 2.842 -22.044 -7.865 1.00 4.24 C ATOM 1020 CG GLN A 68 2.931 -23.191 -8.859 1.00 32.35 C ATOM 1021 CD GLN A 68 4.324 -23.357 -9.434 1.00 43.12 C ATOM 1022 OE1 GLN A 68 5.299 -23.509 -8.697 1.00 72.41 O ATOM 1023 NE2 GLN A 68 4.425 -23.331 -10.758 1.00 1.41 N ATOM 0 H GLN A 68 1.575 -20.469 -9.332 1.00 12.15 H new ATOM 0 HA GLN A 68 0.785 -22.479 -7.420 1.00 64.31 H new ATOM 0 HB2 GLN A 68 3.406 -21.195 -8.251 1.00 4.24 H new ATOM 0 HB3 GLN A 68 3.318 -22.345 -6.932 1.00 4.24 H new ATOM 0 HG2 GLN A 68 2.632 -24.117 -8.368 1.00 32.35 H new ATOM 0 HG3 GLN A 68 2.225 -23.019 -9.671 1.00 32.35 H new ATOM 0 HE21 GLN A 68 3.591 -23.203 -11.331 1.00 1.41 H new ATOM 0 HE22 GLN A 68 5.337 -23.439 -11.202 1.00 1.41 H new ATOM 1032 N GLN A 69 1.510 -19.446 -6.460 1.00 75.41 N ATOM 1033 CA GLN A 69 1.496 -18.532 -5.323 1.00 73.40 C ATOM 1034 C GLN A 69 0.088 -18.392 -4.755 1.00 43.13 C ATOM 1035 O GLN A 69 -0.092 -18.237 -3.546 1.00 45.10 O ATOM 1036 CB GLN A 69 2.031 -17.160 -5.736 1.00 50.41 C ATOM 1037 CG GLN A 69 3.482 -17.184 -6.188 1.00 72.14 C ATOM 1038 CD GLN A 69 4.135 -15.817 -6.127 1.00 5.22 C ATOM 1039 OE1 GLN A 69 3.469 -14.809 -5.887 1.00 1.33 O ATOM 1040 NE2 GLN A 69 5.444 -15.775 -6.346 1.00 61.43 N ATOM 0 H GLN A 69 1.631 -18.992 -7.365 1.00 75.41 H new ATOM 0 HA GLN A 69 2.141 -18.947 -4.549 1.00 73.40 H new ATOM 0 HB2 GLN A 69 1.414 -16.767 -6.544 1.00 50.41 H new ATOM 0 HB3 GLN A 69 1.932 -16.473 -4.896 1.00 50.41 H new ATOM 0 HG2 GLN A 69 4.042 -17.878 -5.562 1.00 72.14 H new ATOM 0 HG3 GLN A 69 3.534 -17.562 -7.209 1.00 72.14 H new ATOM 0 HE21 GLN A 69 5.956 -16.635 -6.541 1.00 61.43 H new ATOM 0 HE22 GLN A 69 5.937 -14.883 -6.319 1.00 61.43 H new ATOM 1049 N TYR A 70 -0.907 -18.448 -5.632 1.00 25.32 N ATOM 1050 CA TYR A 70 -2.300 -18.324 -5.218 1.00 13.24 C ATOM 1051 C TYR A 70 -3.072 -19.607 -5.513 1.00 13.40 C ATOM 1052 O TYR A 70 -4.298 -19.595 -5.632 1.00 60.12 O ATOM 1053 CB TYR A 70 -2.962 -17.142 -5.929 1.00 73.14 C ATOM 1054 CG TYR A 70 -2.289 -15.817 -5.653 1.00 2.41 C ATOM 1055 CD1 TYR A 70 -2.170 -15.331 -4.357 1.00 41.41 C ATOM 1056 CD2 TYR A 70 -1.771 -15.050 -6.689 1.00 54.44 C ATOM 1057 CE1 TYR A 70 -1.556 -14.120 -4.101 1.00 63.31 C ATOM 1058 CE2 TYR A 70 -1.155 -13.838 -6.443 1.00 43.53 C ATOM 1059 CZ TYR A 70 -1.051 -13.378 -5.148 1.00 60.24 C ATOM 1060 OH TYR A 70 -0.437 -12.171 -4.897 1.00 32.23 O ATOM 0 H TYR A 70 -0.775 -18.579 -6.635 1.00 25.32 H new ATOM 0 HA TYR A 70 -2.319 -18.149 -4.142 1.00 13.24 H new ATOM 0 HB2 TYR A 70 -2.957 -17.326 -7.003 1.00 73.14 H new ATOM 0 HB3 TYR A 70 -4.006 -17.081 -5.621 1.00 73.14 H new ATOM 0 HD1 TYR A 70 -2.564 -15.910 -3.535 1.00 41.41 H new ATOM 0 HD2 TYR A 70 -1.851 -15.408 -7.705 1.00 54.44 H new ATOM 0 HE1 TYR A 70 -1.472 -13.757 -3.087 1.00 63.31 H new ATOM 0 HE2 TYR A 70 -0.757 -13.255 -7.260 1.00 43.53 H new ATOM 0 HH TYR A 70 -0.136 -11.775 -5.742 1.00 32.23 H new ATOM 1070 N THR A 71 -2.346 -20.714 -5.630 1.00 53.31 N ATOM 1071 CA THR A 71 -2.959 -22.005 -5.911 1.00 63.45 C ATOM 1072 C THR A 71 -4.037 -22.337 -4.885 1.00 25.02 C ATOM 1073 O THR A 71 -4.936 -23.132 -5.152 1.00 11.42 O ATOM 1074 CB THR A 71 -1.912 -23.135 -5.925 1.00 51.51 C ATOM 1075 OG1 THR A 71 -2.492 -24.335 -6.446 1.00 70.04 O ATOM 1076 CG2 THR A 71 -1.377 -23.392 -4.523 1.00 62.15 C ATOM 0 H THR A 71 -1.331 -20.742 -5.534 1.00 53.31 H new ATOM 0 HA THR A 71 -3.413 -21.930 -6.899 1.00 63.45 H new ATOM 0 HB THR A 71 -1.084 -22.826 -6.563 1.00 51.51 H new ATOM 0 HG1 THR A 71 -1.819 -25.047 -6.453 1.00 70.04 H new ATOM 0 HG21 THR A 71 -0.639 -24.194 -4.556 1.00 62.15 H new ATOM 0 HG22 THR A 71 -0.910 -22.485 -4.140 1.00 62.15 H new ATOM 0 HG23 THR A 71 -2.198 -23.682 -3.868 1.00 62.15 H new ATOM 1084 N GLU A 72 -3.937 -21.724 -3.710 1.00 42.03 N ATOM 1085 CA GLU A 72 -4.904 -21.955 -2.643 1.00 25.13 C ATOM 1086 C GLU A 72 -6.326 -21.706 -3.135 1.00 64.22 C ATOM 1087 O GLU A 72 -7.256 -22.424 -2.769 1.00 31.12 O ATOM 1088 CB GLU A 72 -4.601 -21.053 -1.445 1.00 62.10 C ATOM 1089 CG GLU A 72 -3.379 -21.486 -0.652 1.00 10.13 C ATOM 1090 CD GLU A 72 -2.936 -20.439 0.352 1.00 41.34 C ATOM 1091 OE1 GLU A 72 -3.261 -19.251 0.152 1.00 3.33 O ATOM 1092 OE2 GLU A 72 -2.264 -20.809 1.337 1.00 54.20 O ATOM 0 H GLU A 72 -3.197 -21.064 -3.473 1.00 42.03 H new ATOM 0 HA GLU A 72 -4.823 -22.997 -2.333 1.00 25.13 H new ATOM 0 HB2 GLU A 72 -4.452 -20.032 -1.798 1.00 62.10 H new ATOM 0 HB3 GLU A 72 -5.467 -21.039 -0.783 1.00 62.10 H new ATOM 0 HG2 GLU A 72 -3.601 -22.416 -0.128 1.00 10.13 H new ATOM 0 HG3 GLU A 72 -2.559 -21.695 -1.339 1.00 10.13 H new ATOM 1099 N ASN A 73 -6.487 -20.682 -3.967 1.00 43.45 N ATOM 1100 CA ASN A 73 -7.797 -20.336 -4.509 1.00 72.45 C ATOM 1101 C ASN A 73 -7.700 -20.000 -5.994 1.00 43.54 C ATOM 1102 O ASN A 73 -8.545 -19.287 -6.537 1.00 5.44 O ATOM 1103 CB ASN A 73 -8.392 -19.152 -3.744 1.00 62.14 C ATOM 1104 CG ASN A 73 -9.879 -19.313 -3.495 1.00 62.35 C ATOM 1105 OD1 ASN A 73 -10.299 -20.164 -2.711 1.00 54.33 O ATOM 1106 ND2 ASN A 73 -10.682 -18.493 -4.161 1.00 12.25 N ATOM 0 H ASN A 73 -5.728 -20.078 -4.281 1.00 43.45 H new ATOM 0 HA ASN A 73 -8.451 -21.200 -4.393 1.00 72.45 H new ATOM 0 HB2 ASN A 73 -7.876 -19.043 -2.790 1.00 62.14 H new ATOM 0 HB3 ASN A 73 -8.218 -18.235 -4.307 1.00 62.14 H new ATOM 0 HD21 ASN A 73 -11.692 -18.553 -4.033 1.00 12.25 H new ATOM 0 HD22 ASN A 73 -10.289 -17.803 -4.801 1.00 12.25 H new ATOM 1113 N VAL A 74 -6.663 -20.518 -6.646 1.00 43.23 N ATOM 1114 CA VAL A 74 -6.457 -20.275 -8.069 1.00 42.34 C ATOM 1115 C VAL A 74 -6.072 -21.558 -8.795 1.00 24.52 C ATOM 1116 O VAL A 74 -5.159 -22.272 -8.380 1.00 11.33 O ATOM 1117 CB VAL A 74 -5.360 -19.218 -8.303 1.00 72.22 C ATOM 1118 CG1 VAL A 74 -5.180 -18.957 -9.791 1.00 21.22 C ATOM 1119 CG2 VAL A 74 -5.694 -17.932 -7.564 1.00 13.41 C ATOM 0 H VAL A 74 -5.953 -21.108 -6.212 1.00 43.23 H new ATOM 0 HA VAL A 74 -7.401 -19.905 -8.468 1.00 42.34 H new ATOM 0 HB VAL A 74 -4.419 -19.602 -7.909 1.00 72.22 H new ATOM 0 HG11 VAL A 74 -4.402 -18.208 -9.938 1.00 21.22 H new ATOM 0 HG12 VAL A 74 -4.892 -19.882 -10.290 1.00 21.22 H new ATOM 0 HG13 VAL A 74 -6.117 -18.593 -10.213 1.00 21.22 H new ATOM 0 HG21 VAL A 74 -4.909 -17.197 -7.740 1.00 13.41 H new ATOM 0 HG22 VAL A 74 -6.645 -17.541 -7.926 1.00 13.41 H new ATOM 0 HG23 VAL A 74 -5.768 -18.135 -6.496 1.00 13.41 H new ATOM 1129 N LYS A 75 -6.776 -21.847 -9.885 1.00 41.33 N ATOM 1130 CA LYS A 75 -6.510 -23.046 -10.673 1.00 54.30 C ATOM 1131 C LYS A 75 -6.404 -22.707 -12.157 1.00 41.22 C ATOM 1132 O LYS A 75 -6.919 -21.684 -12.608 1.00 54.54 O ATOM 1133 CB LYS A 75 -7.614 -24.082 -10.452 1.00 44.23 C ATOM 1134 CG LYS A 75 -7.206 -25.494 -10.833 1.00 44.22 C ATOM 1135 CD LYS A 75 -6.154 -26.047 -9.886 1.00 22.44 C ATOM 1136 CE LYS A 75 -6.699 -26.192 -8.473 1.00 73.13 C ATOM 1137 NZ LYS A 75 -5.846 -27.085 -7.640 1.00 54.32 N ATOM 0 H LYS A 75 -7.535 -21.267 -10.243 1.00 41.33 H new ATOM 0 HA LYS A 75 -5.559 -23.464 -10.345 1.00 54.30 H new ATOM 0 HB2 LYS A 75 -7.909 -24.068 -9.403 1.00 44.23 H new ATOM 0 HB3 LYS A 75 -8.491 -23.796 -11.033 1.00 44.23 H new ATOM 0 HG2 LYS A 75 -8.082 -26.142 -10.823 1.00 44.22 H new ATOM 0 HG3 LYS A 75 -6.818 -25.499 -11.852 1.00 44.22 H new ATOM 0 HD2 LYS A 75 -5.812 -27.017 -10.247 1.00 22.44 H new ATOM 0 HD3 LYS A 75 -5.287 -25.386 -9.877 1.00 22.44 H new ATOM 0 HE2 LYS A 75 -6.762 -25.210 -8.005 1.00 73.13 H new ATOM 0 HE3 LYS A 75 -7.712 -26.591 -8.513 1.00 73.13 H new ATOM 0 HZ1 LYS A 75 -6.250 -27.159 -6.685 1.00 54.32 H new ATOM 0 HZ2 LYS A 75 -5.806 -28.030 -8.073 1.00 54.32 H new ATOM 0 HZ3 LYS A 75 -4.885 -26.691 -7.580 1.00 54.32 H new ATOM 1151 N ILE A 76 -5.736 -23.574 -12.910 1.00 32.00 N ATOM 1152 CA ILE A 76 -5.566 -23.369 -14.343 1.00 74.21 C ATOM 1153 C ILE A 76 -5.665 -24.687 -15.104 1.00 73.53 C ATOM 1154 O ILE A 76 -5.018 -25.671 -14.748 1.00 22.14 O ATOM 1155 CB ILE A 76 -4.210 -22.708 -14.660 1.00 4.33 C ATOM 1156 CG1 ILE A 76 -4.099 -21.357 -13.950 1.00 15.14 C ATOM 1157 CG2 ILE A 76 -4.043 -22.538 -16.163 1.00 3.40 C ATOM 1158 CD1 ILE A 76 -2.821 -20.612 -14.265 1.00 71.25 C ATOM 0 H ILE A 76 -5.304 -24.425 -12.551 1.00 32.00 H new ATOM 0 HA ILE A 76 -6.370 -22.706 -14.664 1.00 74.21 H new ATOM 0 HB ILE A 76 -3.412 -23.355 -14.296 1.00 4.33 H new ATOM 0 HG12 ILE A 76 -4.950 -20.737 -14.231 1.00 15.14 H new ATOM 0 HG13 ILE A 76 -4.162 -21.515 -12.873 1.00 15.14 H new ATOM 0 HG21 ILE A 76 -3.081 -22.070 -16.372 1.00 3.40 H new ATOM 0 HG22 ILE A 76 -4.084 -23.514 -16.646 1.00 3.40 H new ATOM 0 HG23 ILE A 76 -4.844 -21.908 -16.549 1.00 3.40 H new ATOM 0 HD11 ILE A 76 -2.811 -19.664 -13.727 1.00 71.25 H new ATOM 0 HD12 ILE A 76 -1.965 -21.212 -13.958 1.00 71.25 H new ATOM 0 HD13 ILE A 76 -2.765 -20.422 -15.337 1.00 71.25 H new ATOM 1170 N TYR A 77 -6.480 -24.698 -16.153 1.00 44.05 N ATOM 1171 CA TYR A 77 -6.667 -25.894 -16.963 1.00 41.33 C ATOM 1172 C TYR A 77 -6.602 -25.560 -18.451 1.00 64.33 C ATOM 1173 O TYR A 77 -7.129 -24.540 -18.894 1.00 10.43 O ATOM 1174 CB TYR A 77 -8.006 -26.555 -16.636 1.00 72.10 C ATOM 1175 CG TYR A 77 -7.985 -27.366 -15.360 1.00 12.23 C ATOM 1176 CD1 TYR A 77 -6.959 -28.265 -15.101 1.00 21.01 C ATOM 1177 CD2 TYR A 77 -8.993 -27.232 -14.411 1.00 20.02 C ATOM 1178 CE1 TYR A 77 -6.936 -29.009 -13.938 1.00 1.23 C ATOM 1179 CE2 TYR A 77 -8.978 -27.971 -13.245 1.00 23.03 C ATOM 1180 CZ TYR A 77 -7.948 -28.857 -13.012 1.00 14.33 C ATOM 1181 OH TYR A 77 -7.929 -29.596 -11.850 1.00 41.31 O ATOM 0 H TYR A 77 -7.022 -23.891 -16.462 1.00 44.05 H new ATOM 0 HA TYR A 77 -5.861 -26.589 -16.729 1.00 41.33 H new ATOM 0 HB2 TYR A 77 -8.772 -25.784 -16.554 1.00 72.10 H new ATOM 0 HB3 TYR A 77 -8.294 -27.203 -17.464 1.00 72.10 H new ATOM 0 HD1 TYR A 77 -6.164 -28.385 -15.822 1.00 21.01 H new ATOM 0 HD2 TYR A 77 -9.801 -26.538 -14.589 1.00 20.02 H new ATOM 0 HE1 TYR A 77 -6.131 -29.705 -13.754 1.00 1.23 H new ATOM 0 HE2 TYR A 77 -9.769 -27.856 -12.519 1.00 23.03 H new ATOM 0 HH TYR A 77 -8.712 -29.370 -11.306 1.00 41.31 H new ATOM 1191 N LYS A 78 -5.951 -26.428 -19.218 1.00 23.53 N ATOM 1192 CA LYS A 78 -5.817 -26.229 -20.656 1.00 3.52 C ATOM 1193 C LYS A 78 -6.631 -27.264 -21.426 1.00 53.52 C ATOM 1194 O LYS A 78 -7.303 -28.106 -20.831 1.00 32.22 O ATOM 1195 CB LYS A 78 -4.345 -26.313 -21.068 1.00 32.21 C ATOM 1196 CG LYS A 78 -3.718 -24.960 -21.360 1.00 32.34 C ATOM 1197 CD LYS A 78 -2.935 -24.439 -20.167 1.00 31.11 C ATOM 1198 CE LYS A 78 -1.542 -25.047 -20.106 1.00 21.42 C ATOM 1199 NZ LYS A 78 -0.613 -24.224 -19.283 1.00 41.41 N ATOM 0 H LYS A 78 -5.508 -27.277 -18.867 1.00 23.53 H new ATOM 0 HA LYS A 78 -6.200 -25.238 -20.898 1.00 3.52 H new ATOM 0 HB2 LYS A 78 -3.781 -26.802 -20.274 1.00 32.21 H new ATOM 0 HB3 LYS A 78 -4.259 -26.943 -21.954 1.00 32.21 H new ATOM 0 HG2 LYS A 78 -3.056 -25.043 -22.222 1.00 32.34 H new ATOM 0 HG3 LYS A 78 -4.498 -24.246 -21.624 1.00 32.34 H new ATOM 0 HD2 LYS A 78 -2.857 -23.353 -20.228 1.00 31.11 H new ATOM 0 HD3 LYS A 78 -3.474 -24.669 -19.248 1.00 31.11 H new ATOM 0 HE2 LYS A 78 -1.603 -26.052 -19.689 1.00 21.42 H new ATOM 0 HE3 LYS A 78 -1.144 -25.144 -21.116 1.00 21.42 H new ATOM 0 HZ1 LYS A 78 0.187 -23.912 -19.870 1.00 41.41 H new ATOM 0 HZ2 LYS A 78 -1.118 -23.392 -18.916 1.00 41.41 H new ATOM 0 HZ3 LYS A 78 -0.258 -24.792 -18.488 1.00 41.41 H new ATOM 1490 N THR A 98 -7.758 -17.862 -25.231 1.00 45.20 N ATOM 1491 CA THR A 98 -8.559 -17.110 -24.274 1.00 23.33 C ATOM 1492 C THR A 98 -8.735 -17.888 -22.974 1.00 42.13 C ATOM 1493 O THR A 98 -8.868 -19.113 -22.986 1.00 12.55 O ATOM 1494 CB THR A 98 -9.947 -16.770 -24.847 1.00 62.14 C ATOM 1495 OG1 THR A 98 -9.808 -15.966 -26.023 1.00 63.21 O ATOM 1496 CG2 THR A 98 -10.791 -16.030 -23.819 1.00 55.04 C ATOM 0 HA THR A 98 -8.022 -16.184 -24.071 1.00 23.33 H new ATOM 0 HB THR A 98 -10.448 -17.704 -25.102 1.00 62.14 H new ATOM 0 HG1 THR A 98 -8.941 -16.148 -26.443 1.00 63.21 H new ATOM 0 HG21 THR A 98 -11.767 -15.801 -24.247 1.00 55.04 H new ATOM 0 HG22 THR A 98 -10.920 -16.656 -22.936 1.00 55.04 H new ATOM 0 HG23 THR A 98 -10.291 -15.103 -23.537 1.00 55.04 H new ATOM 1504 N ILE A 99 -8.736 -17.171 -21.856 1.00 62.15 N ATOM 1505 CA ILE A 99 -8.898 -17.795 -20.548 1.00 43.54 C ATOM 1506 C ILE A 99 -10.248 -17.442 -19.934 1.00 65.44 C ATOM 1507 O ILE A 99 -10.714 -16.308 -20.045 1.00 5.15 O ATOM 1508 CB ILE A 99 -7.778 -17.371 -19.580 1.00 53.20 C ATOM 1509 CG1 ILE A 99 -6.407 -17.570 -20.230 1.00 62.33 C ATOM 1510 CG2 ILE A 99 -7.875 -18.158 -18.281 1.00 14.24 C ATOM 1511 CD1 ILE A 99 -5.252 -17.177 -19.337 1.00 74.33 C ATOM 0 H ILE A 99 -8.626 -16.157 -21.829 1.00 62.15 H new ATOM 0 HA ILE A 99 -8.844 -18.873 -20.703 1.00 43.54 H new ATOM 0 HB ILE A 99 -7.898 -16.312 -19.351 1.00 53.20 H new ATOM 0 HG12 ILE A 99 -6.297 -18.617 -20.513 1.00 62.33 H new ATOM 0 HG13 ILE A 99 -6.361 -16.985 -21.148 1.00 62.33 H new ATOM 0 HG21 ILE A 99 -7.077 -17.847 -17.607 1.00 14.24 H new ATOM 0 HG22 ILE A 99 -8.840 -17.968 -17.812 1.00 14.24 H new ATOM 0 HG23 ILE A 99 -7.777 -19.223 -18.493 1.00 14.24 H new ATOM 0 HD11 ILE A 99 -4.312 -17.345 -19.863 1.00 74.33 H new ATOM 0 HD12 ILE A 99 -5.338 -16.123 -19.074 1.00 74.33 H new ATOM 0 HD13 ILE A 99 -5.272 -17.780 -18.429 1.00 74.33 H new ATOM 1523 N LEU A 100 -10.870 -18.420 -19.286 1.00 14.13 N ATOM 1524 CA LEU A 100 -12.167 -18.212 -18.650 1.00 74.13 C ATOM 1525 C LEU A 100 -12.165 -18.745 -17.221 1.00 51.03 C ATOM 1526 O LEU A 100 -11.887 -19.921 -16.987 1.00 42.25 O ATOM 1527 CB LEU A 100 -13.269 -18.898 -19.461 1.00 11.41 C ATOM 1528 CG LEU A 100 -13.440 -18.416 -20.902 1.00 23.02 C ATOM 1529 CD1 LEU A 100 -14.342 -19.364 -21.677 1.00 75.25 C ATOM 1530 CD2 LEU A 100 -13.999 -17.002 -20.930 1.00 10.22 C ATOM 0 H LEU A 100 -10.498 -19.365 -19.187 1.00 14.13 H new ATOM 0 HA LEU A 100 -12.361 -17.140 -18.617 1.00 74.13 H new ATOM 0 HB2 LEU A 100 -13.066 -19.969 -19.479 1.00 11.41 H new ATOM 0 HB3 LEU A 100 -14.216 -18.761 -18.938 1.00 11.41 H new ATOM 0 HG LEU A 100 -12.461 -18.406 -21.380 1.00 23.02 H new ATOM 0 HD11 LEU A 100 -14.453 -19.006 -22.700 1.00 75.25 H new ATOM 0 HD12 LEU A 100 -13.900 -20.360 -21.687 1.00 75.25 H new ATOM 0 HD13 LEU A 100 -15.321 -19.407 -21.200 1.00 75.25 H new ATOM 0 HD21 LEU A 100 -14.114 -16.676 -21.964 1.00 10.22 H new ATOM 0 HD22 LEU A 100 -14.970 -16.985 -20.434 1.00 10.22 H new ATOM 0 HD23 LEU A 100 -13.315 -16.330 -20.412 1.00 10.22 H new ATOM 1542 N MET A 101 -12.480 -17.872 -16.270 1.00 44.04 N ATOM 1543 CA MET A 101 -12.518 -18.256 -14.863 1.00 51.33 C ATOM 1544 C MET A 101 -13.881 -18.830 -14.492 1.00 12.11 C ATOM 1545 O MET A 101 -14.914 -18.197 -14.716 1.00 52.43 O ATOM 1546 CB MET A 101 -12.200 -17.052 -13.975 1.00 34.22 C ATOM 1547 CG MET A 101 -10.721 -16.706 -13.926 1.00 12.34 C ATOM 1548 SD MET A 101 -10.424 -14.990 -13.459 1.00 53.14 S ATOM 1549 CE MET A 101 -9.003 -15.173 -12.384 1.00 41.24 C ATOM 0 H MET A 101 -12.712 -16.895 -16.447 1.00 44.04 H new ATOM 0 HA MET A 101 -11.764 -19.026 -14.702 1.00 51.33 H new ATOM 0 HB2 MET A 101 -12.755 -16.187 -14.338 1.00 34.22 H new ATOM 0 HB3 MET A 101 -12.551 -17.255 -12.963 1.00 34.22 H new ATOM 0 HG2 MET A 101 -10.221 -17.364 -13.215 1.00 12.34 H new ATOM 0 HG3 MET A 101 -10.275 -16.895 -14.902 1.00 12.34 H new ATOM 0 HE1 MET A 101 -8.818 -14.234 -11.862 1.00 41.24 H new ATOM 0 HE2 MET A 101 -9.196 -15.961 -11.656 1.00 41.24 H new ATOM 0 HE3 MET A 101 -8.128 -15.435 -12.979 1.00 41.24 H new ATOM 1559 N PHE A 102 -13.879 -20.032 -13.927 1.00 41.14 N ATOM 1560 CA PHE A 102 -15.116 -20.692 -13.527 1.00 22.24 C ATOM 1561 C PHE A 102 -15.131 -20.954 -12.024 1.00 24.11 C ATOM 1562 O PHE A 102 -14.082 -21.086 -11.394 1.00 24.33 O ATOM 1563 CB PHE A 102 -15.286 -22.009 -14.287 1.00 14.11 C ATOM 1564 CG PHE A 102 -15.582 -21.824 -15.749 1.00 43.34 C ATOM 1565 CD1 PHE A 102 -16.839 -21.420 -16.168 1.00 33.42 C ATOM 1566 CD2 PHE A 102 -14.603 -22.051 -16.702 1.00 24.13 C ATOM 1567 CE1 PHE A 102 -17.114 -21.249 -17.512 1.00 43.32 C ATOM 1568 CE2 PHE A 102 -14.873 -21.882 -18.047 1.00 54.11 C ATOM 1569 CZ PHE A 102 -16.130 -21.479 -18.452 1.00 21.31 C ATOM 0 H PHE A 102 -13.034 -20.570 -13.735 1.00 41.14 H new ATOM 0 HA PHE A 102 -15.947 -20.030 -13.771 1.00 22.24 H new ATOM 0 HB2 PHE A 102 -14.377 -22.601 -14.181 1.00 14.11 H new ATOM 0 HB3 PHE A 102 -16.094 -22.581 -13.830 1.00 14.11 H new ATOM 0 HD1 PHE A 102 -17.612 -21.237 -15.437 1.00 33.42 H new ATOM 0 HD2 PHE A 102 -13.617 -22.364 -16.391 1.00 24.13 H new ATOM 0 HE1 PHE A 102 -18.099 -20.936 -17.826 1.00 43.32 H new ATOM 0 HE2 PHE A 102 -14.102 -22.065 -18.780 1.00 54.11 H new ATOM 0 HZ PHE A 102 -16.343 -21.344 -19.502 1.00 21.31 H new ATOM 1579 N LYS A 103 -16.330 -21.029 -11.455 1.00 0.52 N ATOM 1580 CA LYS A 103 -16.485 -21.277 -10.026 1.00 14.34 C ATOM 1581 C LYS A 103 -17.937 -21.593 -9.683 1.00 42.13 C ATOM 1582 O LYS A 103 -18.843 -20.828 -10.009 1.00 4.33 O ATOM 1583 CB LYS A 103 -16.013 -20.063 -9.223 1.00 55.11 C ATOM 1584 CG LYS A 103 -16.368 -20.134 -7.748 1.00 53.23 C ATOM 1585 CD LYS A 103 -17.382 -19.069 -7.366 1.00 73.44 C ATOM 1586 CE LYS A 103 -16.745 -17.958 -6.548 1.00 31.03 C ATOM 1587 NZ LYS A 103 -15.512 -17.429 -7.195 1.00 61.33 N ATOM 0 H LYS A 103 -17.209 -20.922 -11.962 1.00 0.52 H new ATOM 0 HA LYS A 103 -15.872 -22.139 -9.764 1.00 14.34 H new ATOM 0 HB2 LYS A 103 -14.932 -19.969 -9.324 1.00 55.11 H new ATOM 0 HB3 LYS A 103 -16.452 -19.162 -9.651 1.00 55.11 H new ATOM 0 HG2 LYS A 103 -16.770 -21.120 -7.517 1.00 53.23 H new ATOM 0 HG3 LYS A 103 -15.466 -20.010 -7.149 1.00 53.23 H new ATOM 0 HD2 LYS A 103 -17.826 -18.648 -8.268 1.00 73.44 H new ATOM 0 HD3 LYS A 103 -18.191 -19.524 -6.795 1.00 73.44 H new ATOM 0 HE2 LYS A 103 -17.462 -17.148 -6.416 1.00 31.03 H new ATOM 0 HE3 LYS A 103 -16.501 -18.333 -5.554 1.00 31.03 H new ATOM 0 HZ1 LYS A 103 -15.455 -16.401 -7.045 1.00 61.33 H new ATOM 0 HZ2 LYS A 103 -14.677 -17.887 -6.777 1.00 61.33 H new ATOM 0 HZ3 LYS A 103 -15.542 -17.629 -8.215 1.00 61.33 H new ATOM 1601 N ASN A 104 -18.150 -22.726 -9.021 1.00 42.33 N ATOM 1602 CA ASN A 104 -19.493 -23.142 -8.633 1.00 62.34 C ATOM 1603 C ASN A 104 -20.426 -23.165 -9.840 1.00 50.33 C ATOM 1604 O ASN A 104 -21.625 -22.918 -9.715 1.00 40.20 O ATOM 1605 CB ASN A 104 -20.050 -22.205 -7.560 1.00 11.23 C ATOM 1606 CG ASN A 104 -21.329 -22.734 -6.938 1.00 4.44 C ATOM 1607 OD1 ASN A 104 -22.412 -22.197 -7.169 1.00 62.54 O ATOM 1608 ND2 ASN A 104 -21.207 -23.790 -6.143 1.00 61.13 N ATOM 0 H ASN A 104 -17.411 -23.371 -8.742 1.00 42.33 H new ATOM 0 HA ASN A 104 -19.430 -24.151 -8.226 1.00 62.34 H new ATOM 0 HB2 ASN A 104 -19.301 -22.064 -6.780 1.00 11.23 H new ATOM 0 HB3 ASN A 104 -20.241 -21.226 -8.000 1.00 11.23 H new ATOM 0 HD21 ASN A 104 -22.032 -24.189 -5.695 1.00 61.13 H new ATOM 0 HD22 ASN A 104 -20.288 -24.202 -5.980 1.00 61.13 H new ATOM 1615 N GLY A 105 -19.866 -23.462 -11.009 1.00 52.35 N ATOM 1616 CA GLY A 105 -20.663 -23.511 -12.221 1.00 3.40 C ATOM 1617 C GLY A 105 -21.061 -22.133 -12.709 1.00 72.24 C ATOM 1618 O GLY A 105 -22.094 -21.970 -13.361 1.00 44.34 O ATOM 0 H GLY A 105 -18.876 -23.669 -11.138 1.00 52.35 H new ATOM 0 HA2 GLY A 105 -20.099 -24.021 -13.002 1.00 3.40 H new ATOM 0 HA3 GLY A 105 -21.561 -24.102 -12.038 1.00 3.40 H new ATOM 1622 N LYS A 106 -20.242 -21.135 -12.393 1.00 63.04 N ATOM 1623 CA LYS A 106 -20.513 -19.761 -12.803 1.00 23.53 C ATOM 1624 C LYS A 106 -19.243 -19.081 -13.300 1.00 52.51 C ATOM 1625 O LYS A 106 -18.140 -19.399 -12.854 1.00 15.21 O ATOM 1626 CB LYS A 106 -21.107 -18.968 -11.637 1.00 4.42 C ATOM 1627 CG LYS A 106 -21.319 -17.497 -11.948 1.00 13.01 C ATOM 1628 CD LYS A 106 -21.844 -16.741 -10.740 1.00 34.42 C ATOM 1629 CE LYS A 106 -22.168 -15.295 -11.084 1.00 12.25 C ATOM 1630 NZ LYS A 106 -20.978 -14.411 -10.940 1.00 53.44 N ATOM 0 H LYS A 106 -19.384 -21.252 -11.854 1.00 63.04 H new ATOM 0 HA LYS A 106 -21.233 -19.787 -13.621 1.00 23.53 H new ATOM 0 HB2 LYS A 106 -22.062 -19.412 -11.355 1.00 4.42 H new ATOM 0 HB3 LYS A 106 -20.447 -19.057 -10.774 1.00 4.42 H new ATOM 0 HG2 LYS A 106 -20.378 -17.054 -12.275 1.00 13.01 H new ATOM 0 HG3 LYS A 106 -22.022 -17.397 -12.775 1.00 13.01 H new ATOM 0 HD2 LYS A 106 -22.739 -17.235 -10.361 1.00 34.42 H new ATOM 0 HD3 LYS A 106 -21.102 -16.769 -9.942 1.00 34.42 H new ATOM 0 HE2 LYS A 106 -22.540 -15.240 -12.107 1.00 12.25 H new ATOM 0 HE3 LYS A 106 -22.967 -14.937 -10.435 1.00 12.25 H new ATOM 0 HZ1 LYS A 106 -21.240 -13.434 -11.183 1.00 53.44 H new ATOM 0 HZ2 LYS A 106 -20.638 -14.444 -9.958 1.00 53.44 H new ATOM 0 HZ3 LYS A 106 -20.224 -14.737 -11.578 1.00 53.44 H new ATOM 1644 N LYS A 107 -19.404 -18.142 -14.227 1.00 5.15 N ATOM 1645 CA LYS A 107 -18.270 -17.414 -14.785 1.00 22.41 C ATOM 1646 C LYS A 107 -17.916 -16.212 -13.915 1.00 2.12 C ATOM 1647 O LYS A 107 -18.798 -15.523 -13.401 1.00 70.34 O ATOM 1648 CB LYS A 107 -18.585 -16.952 -16.209 1.00 42.32 C ATOM 1649 CG LYS A 107 -19.711 -15.935 -16.285 1.00 53.43 C ATOM 1650 CD LYS A 107 -19.987 -15.515 -17.718 1.00 74.10 C ATOM 1651 CE LYS A 107 -20.574 -16.658 -18.531 1.00 71.11 C ATOM 1652 NZ LYS A 107 -21.873 -17.126 -17.973 1.00 25.43 N ATOM 0 H LYS A 107 -20.309 -17.867 -14.608 1.00 5.15 H new ATOM 0 HA LYS A 107 -17.413 -18.088 -14.810 1.00 22.41 H new ATOM 0 HB2 LYS A 107 -17.686 -16.520 -16.649 1.00 42.32 H new ATOM 0 HB3 LYS A 107 -18.849 -17.820 -16.813 1.00 42.32 H new ATOM 0 HG2 LYS A 107 -20.615 -16.359 -15.849 1.00 53.43 H new ATOM 0 HG3 LYS A 107 -19.451 -15.058 -15.692 1.00 53.43 H new ATOM 0 HD2 LYS A 107 -20.677 -14.671 -17.724 1.00 74.10 H new ATOM 0 HD3 LYS A 107 -19.062 -15.174 -18.183 1.00 74.10 H new ATOM 0 HE2 LYS A 107 -20.717 -16.334 -19.562 1.00 71.11 H new ATOM 0 HE3 LYS A 107 -19.868 -17.488 -18.553 1.00 71.11 H new ATOM 0 HZ1 LYS A 107 -22.376 -17.688 -18.689 1.00 25.43 H new ATOM 0 HZ2 LYS A 107 -21.698 -17.713 -17.133 1.00 25.43 H new ATOM 0 HZ3 LYS A 107 -22.453 -16.305 -17.707 1.00 25.43 H new ATOM 1666 N LEU A 108 -16.621 -15.962 -13.757 1.00 62.00 N ATOM 1667 CA LEU A 108 -16.150 -14.841 -12.952 1.00 31.31 C ATOM 1668 C LEU A 108 -15.497 -13.777 -13.828 1.00 60.45 C ATOM 1669 O LEU A 108 -15.865 -12.603 -13.776 1.00 22.20 O ATOM 1670 CB LEU A 108 -15.157 -15.328 -11.895 1.00 53.53 C ATOM 1671 CG LEU A 108 -15.398 -16.734 -11.344 1.00 64.34 C ATOM 1672 CD1 LEU A 108 -14.190 -17.211 -10.552 1.00 21.01 C ATOM 1673 CD2 LEU A 108 -16.650 -16.761 -10.480 1.00 44.43 C ATOM 0 H LEU A 108 -15.878 -16.521 -14.176 1.00 62.00 H new ATOM 0 HA LEU A 108 -17.012 -14.396 -12.454 1.00 31.31 H new ATOM 0 HB2 LEU A 108 -14.155 -15.294 -12.324 1.00 53.53 H new ATOM 0 HB3 LEU A 108 -15.171 -14.626 -11.062 1.00 53.53 H new ATOM 0 HG LEU A 108 -15.547 -17.412 -12.184 1.00 64.34 H new ATOM 0 HD11 LEU A 108 -14.380 -18.213 -10.168 1.00 21.01 H new ATOM 0 HD12 LEU A 108 -13.314 -17.231 -11.201 1.00 21.01 H new ATOM 0 HD13 LEU A 108 -14.009 -16.531 -9.719 1.00 21.01 H new ATOM 0 HD21 LEU A 108 -16.806 -17.769 -10.097 1.00 44.43 H new ATOM 0 HD22 LEU A 108 -16.531 -16.070 -9.646 1.00 44.43 H new ATOM 0 HD23 LEU A 108 -17.511 -16.463 -11.078 1.00 44.43 H new ATOM 1685 N SER A 109 -14.528 -14.196 -14.635 1.00 64.12 N ATOM 1686 CA SER A 109 -13.822 -13.279 -15.523 1.00 55.15 C ATOM 1687 C SER A 109 -13.280 -14.014 -16.745 1.00 41.05 C ATOM 1688 O SER A 109 -13.327 -15.242 -16.814 1.00 33.13 O ATOM 1689 CB SER A 109 -12.677 -12.593 -14.776 1.00 52.45 C ATOM 1690 OG SER A 109 -13.007 -11.252 -14.456 1.00 54.05 O ATOM 0 H SER A 109 -14.213 -15.165 -14.693 1.00 64.12 H new ATOM 0 HA SER A 109 -14.530 -12.523 -15.861 1.00 55.15 H new ATOM 0 HB2 SER A 109 -12.453 -13.144 -13.862 1.00 52.45 H new ATOM 0 HB3 SER A 109 -11.776 -12.613 -15.389 1.00 52.45 H new ATOM 0 HG SER A 109 -12.259 -10.836 -13.978 1.00 54.05 H new ATOM 1696 N GLN A 110 -12.764 -13.253 -17.704 1.00 73.42 N ATOM 1697 CA GLN A 110 -12.213 -13.832 -18.924 1.00 42.33 C ATOM 1698 C GLN A 110 -11.060 -12.987 -19.455 1.00 70.12 C ATOM 1699 O GLN A 110 -11.275 -11.958 -20.094 1.00 44.53 O ATOM 1700 CB GLN A 110 -13.302 -13.959 -19.991 1.00 72.44 C ATOM 1701 CG GLN A 110 -14.073 -12.671 -20.228 1.00 35.44 C ATOM 1702 CD GLN A 110 -15.365 -12.898 -20.990 1.00 64.20 C ATOM 1703 OE1 GLN A 110 -16.255 -13.611 -20.527 1.00 14.10 O ATOM 1704 NE2 GLN A 110 -15.474 -12.288 -22.164 1.00 21.42 N ATOM 0 H GLN A 110 -12.716 -12.235 -17.660 1.00 73.42 H new ATOM 0 HA GLN A 110 -11.832 -14.825 -18.685 1.00 42.33 H new ATOM 0 HB2 GLN A 110 -12.846 -14.277 -20.928 1.00 72.44 H new ATOM 0 HB3 GLN A 110 -14.000 -14.742 -19.694 1.00 72.44 H new ATOM 0 HG2 GLN A 110 -14.298 -12.205 -19.269 1.00 35.44 H new ATOM 0 HG3 GLN A 110 -13.446 -11.973 -20.783 1.00 35.44 H new ATOM 0 HE21 GLN A 110 -14.711 -11.706 -22.509 1.00 21.42 H new ATOM 0 HE22 GLN A 110 -16.321 -12.401 -22.721 1.00 21.42 H new ATOM 1713 N VAL A 111 -9.836 -13.429 -19.185 1.00 61.10 N ATOM 1714 CA VAL A 111 -8.648 -12.713 -19.635 1.00 4.43 C ATOM 1715 C VAL A 111 -8.217 -13.182 -21.021 1.00 3.33 C ATOM 1716 O VAL A 111 -8.314 -14.367 -21.344 1.00 41.10 O ATOM 1717 CB VAL A 111 -7.475 -12.899 -18.654 1.00 34.54 C ATOM 1718 CG1 VAL A 111 -6.229 -12.197 -19.174 1.00 53.12 C ATOM 1719 CG2 VAL A 111 -7.850 -12.385 -17.273 1.00 22.25 C ATOM 0 H VAL A 111 -9.641 -14.280 -18.657 1.00 61.10 H new ATOM 0 HA VAL A 111 -8.912 -11.656 -19.677 1.00 4.43 H new ATOM 0 HB VAL A 111 -7.256 -13.964 -18.573 1.00 34.54 H new ATOM 0 HG11 VAL A 111 -5.410 -12.339 -18.468 1.00 53.12 H new ATOM 0 HG12 VAL A 111 -5.952 -12.617 -20.141 1.00 53.12 H new ATOM 0 HG13 VAL A 111 -6.431 -11.132 -19.286 1.00 53.12 H new ATOM 0 HG21 VAL A 111 -7.010 -12.524 -16.593 1.00 22.25 H new ATOM 0 HG22 VAL A 111 -8.096 -11.325 -17.334 1.00 22.25 H new ATOM 0 HG23 VAL A 111 -8.713 -12.937 -16.901 1.00 22.25 H new ATOM 1729 N ILE A 112 -7.740 -12.246 -21.835 1.00 40.51 N ATOM 1730 CA ILE A 112 -7.293 -12.565 -23.185 1.00 13.53 C ATOM 1731 C ILE A 112 -5.949 -11.911 -23.486 1.00 35.44 C ATOM 1732 O ILE A 112 -5.839 -10.686 -23.536 1.00 64.54 O ATOM 1733 CB ILE A 112 -8.319 -12.112 -24.239 1.00 10.42 C ATOM 1734 CG1 ILE A 112 -9.723 -12.580 -23.851 1.00 64.13 C ATOM 1735 CG2 ILE A 112 -7.939 -12.645 -25.613 1.00 61.22 C ATOM 1736 CD1 ILE A 112 -10.795 -12.160 -24.833 1.00 11.41 C ATOM 0 H ILE A 112 -7.653 -11.261 -21.583 1.00 40.51 H new ATOM 0 HA ILE A 112 -7.187 -13.649 -23.236 1.00 13.53 H new ATOM 0 HB ILE A 112 -8.317 -11.023 -24.280 1.00 10.42 H new ATOM 0 HG12 ILE A 112 -9.724 -13.667 -23.767 1.00 64.13 H new ATOM 0 HG13 ILE A 112 -9.969 -12.184 -22.866 1.00 64.13 H new ATOM 0 HG21 ILE A 112 -8.674 -12.316 -26.347 1.00 61.22 H new ATOM 0 HG22 ILE A 112 -6.955 -12.267 -25.891 1.00 61.22 H new ATOM 0 HG23 ILE A 112 -7.915 -13.734 -25.587 1.00 61.22 H new ATOM 0 HD11 ILE A 112 -11.764 -12.527 -24.493 1.00 11.41 H new ATOM 0 HD12 ILE A 112 -10.822 -11.072 -24.899 1.00 11.41 H new ATOM 0 HD13 ILE A 112 -10.573 -12.578 -25.815 1.00 11.41 H new ATOM 1748 N GLY A 113 -4.927 -12.738 -23.689 1.00 53.21 N ATOM 1749 CA GLY A 113 -3.603 -12.221 -23.985 1.00 14.23 C ATOM 1750 C GLY A 113 -2.585 -12.592 -22.925 1.00 44.34 C ATOM 1751 O GLY A 113 -2.758 -13.576 -22.207 1.00 21.13 O ATOM 0 H GLY A 113 -4.992 -13.755 -23.654 1.00 53.21 H new ATOM 0 HA2 GLY A 113 -3.274 -12.605 -24.951 1.00 14.23 H new ATOM 0 HA3 GLY A 113 -3.652 -11.136 -24.074 1.00 14.23 H new ATOM 1755 N ALA A 114 -1.521 -11.803 -22.828 1.00 2.12 N ATOM 1756 CA ALA A 114 -0.472 -12.054 -21.846 1.00 50.23 C ATOM 1757 C ALA A 114 -0.258 -10.840 -20.948 1.00 73.31 C ATOM 1758 O ALA A 114 0.772 -10.171 -21.026 1.00 1.34 O ATOM 1759 CB ALA A 114 0.826 -12.429 -22.547 1.00 34.24 C ATOM 0 H ALA A 114 -1.362 -10.985 -23.416 1.00 2.12 H new ATOM 0 HA ALA A 114 -0.788 -12.887 -21.217 1.00 50.23 H new ATOM 0 HB1 ALA A 114 1.601 -12.614 -21.803 1.00 34.24 H new ATOM 0 HB2 ALA A 114 0.671 -13.329 -23.141 1.00 34.24 H new ATOM 0 HB3 ALA A 114 1.136 -11.613 -23.199 1.00 34.24 H new ATOM 1765 N ASP A 115 -1.240 -10.561 -20.097 1.00 11.22 N ATOM 1766 CA ASP A 115 -1.159 -9.428 -19.183 1.00 33.14 C ATOM 1767 C ASP A 115 -1.056 -9.902 -17.737 1.00 50.50 C ATOM 1768 O ASP A 115 -2.068 -10.143 -17.078 1.00 41.34 O ATOM 1769 CB ASP A 115 -2.381 -8.523 -19.350 1.00 73.33 C ATOM 1770 CG ASP A 115 -2.256 -7.593 -20.540 1.00 45.55 C ATOM 1771 OD1 ASP A 115 -1.307 -6.780 -20.561 1.00 15.43 O ATOM 1772 OD2 ASP A 115 -3.104 -7.679 -21.451 1.00 51.32 O ATOM 0 H ASP A 115 -2.100 -11.104 -20.021 1.00 11.22 H new ATOM 0 HA ASP A 115 -0.260 -8.861 -19.425 1.00 33.14 H new ATOM 0 HB2 ASP A 115 -3.272 -9.139 -19.467 1.00 73.33 H new ATOM 0 HB3 ASP A 115 -2.518 -7.932 -18.444 1.00 73.33 H new ATOM 1777 N ILE A 116 0.173 -10.035 -17.250 1.00 43.41 N ATOM 1778 CA ILE A 116 0.409 -10.481 -15.882 1.00 44.52 C ATOM 1779 C ILE A 116 -0.216 -9.521 -14.876 1.00 11.00 C ATOM 1780 O ILE A 116 -0.822 -9.945 -13.892 1.00 0.15 O ATOM 1781 CB ILE A 116 1.914 -10.611 -15.583 1.00 1.13 C ATOM 1782 CG1 ILE A 116 2.133 -11.051 -14.135 1.00 20.02 C ATOM 1783 CG2 ILE A 116 2.624 -9.293 -15.856 1.00 15.41 C ATOM 1784 CD1 ILE A 116 1.570 -12.422 -13.828 1.00 45.32 C ATOM 0 H ILE A 116 1.021 -9.840 -17.782 1.00 43.41 H new ATOM 0 HA ILE A 116 -0.058 -11.461 -15.785 1.00 44.52 H new ATOM 0 HB ILE A 116 2.336 -11.371 -16.241 1.00 1.13 H new ATOM 0 HG12 ILE A 116 3.202 -11.050 -13.921 1.00 20.02 H new ATOM 0 HG13 ILE A 116 1.674 -10.321 -13.469 1.00 20.02 H new ATOM 0 HG21 ILE A 116 3.687 -9.401 -15.640 1.00 15.41 H new ATOM 0 HG22 ILE A 116 2.492 -9.019 -16.903 1.00 15.41 H new ATOM 0 HG23 ILE A 116 2.202 -8.514 -15.221 1.00 15.41 H new ATOM 0 HD11 ILE A 116 1.762 -12.669 -12.784 1.00 45.32 H new ATOM 0 HD12 ILE A 116 0.495 -12.423 -14.010 1.00 45.32 H new ATOM 0 HD13 ILE A 116 2.047 -13.163 -14.469 1.00 45.32 H new ATOM 1796 N SER A 117 -0.067 -8.225 -15.131 1.00 21.43 N ATOM 1797 CA SER A 117 -0.616 -7.203 -14.246 1.00 43.32 C ATOM 1798 C SER A 117 -2.139 -7.265 -14.225 1.00 21.20 C ATOM 1799 O SER A 117 -2.781 -6.759 -13.303 1.00 13.41 O ATOM 1800 CB SER A 117 -0.156 -5.814 -14.691 1.00 12.44 C ATOM 1801 OG SER A 117 -1.004 -4.805 -14.169 1.00 62.05 O ATOM 0 H SER A 117 0.429 -7.857 -15.943 1.00 21.43 H new ATOM 0 HA SER A 117 -0.249 -7.394 -13.238 1.00 43.32 H new ATOM 0 HB2 SER A 117 0.867 -5.642 -14.357 1.00 12.44 H new ATOM 0 HB3 SER A 117 -0.150 -5.761 -15.780 1.00 12.44 H new ATOM 0 HG SER A 117 -0.688 -3.926 -14.466 1.00 62.05 H new ATOM 1807 N LYS A 118 -2.715 -7.889 -15.248 1.00 15.20 N ATOM 1808 CA LYS A 118 -4.164 -8.019 -15.348 1.00 45.15 C ATOM 1809 C LYS A 118 -4.656 -9.233 -14.568 1.00 64.05 C ATOM 1810 O LYS A 118 -5.485 -9.109 -13.666 1.00 21.20 O ATOM 1811 CB LYS A 118 -4.585 -8.136 -16.815 1.00 45.12 C ATOM 1812 CG LYS A 118 -6.036 -8.544 -17.000 1.00 72.13 C ATOM 1813 CD LYS A 118 -6.979 -7.591 -16.285 1.00 21.24 C ATOM 1814 CE LYS A 118 -8.357 -7.580 -16.929 1.00 12.53 C ATOM 1815 NZ LYS A 118 -8.914 -8.954 -17.067 1.00 64.22 N ATOM 0 H LYS A 118 -2.200 -8.313 -16.020 1.00 15.20 H new ATOM 0 HA LYS A 118 -4.615 -7.125 -14.917 1.00 45.15 H new ATOM 0 HB2 LYS A 118 -4.420 -7.179 -17.309 1.00 45.12 H new ATOM 0 HB3 LYS A 118 -3.945 -8.866 -17.311 1.00 45.12 H new ATOM 0 HG2 LYS A 118 -6.276 -8.565 -18.063 1.00 72.13 H new ATOM 0 HG3 LYS A 118 -6.182 -9.555 -16.620 1.00 72.13 H new ATOM 0 HD2 LYS A 118 -7.068 -7.883 -15.239 1.00 21.24 H new ATOM 0 HD3 LYS A 118 -6.561 -6.584 -16.301 1.00 21.24 H new ATOM 0 HE2 LYS A 118 -9.034 -6.972 -16.329 1.00 12.53 H new ATOM 0 HE3 LYS A 118 -8.295 -7.112 -17.912 1.00 12.53 H new ATOM 0 HZ1 LYS A 118 -9.922 -8.947 -16.812 1.00 64.22 H new ATOM 0 HZ2 LYS A 118 -8.808 -9.274 -18.051 1.00 64.22 H new ATOM 0 HZ3 LYS A 118 -8.401 -9.602 -16.435 1.00 64.22 H new ATOM 1829 N ILE A 119 -4.140 -10.406 -14.921 1.00 65.15 N ATOM 1830 CA ILE A 119 -4.526 -11.642 -14.250 1.00 50.12 C ATOM 1831 C ILE A 119 -4.328 -11.535 -12.742 1.00 70.05 C ATOM 1832 O ILE A 119 -5.089 -12.110 -11.964 1.00 1.10 O ATOM 1833 CB ILE A 119 -3.720 -12.844 -14.779 1.00 20.21 C ATOM 1834 CG1 ILE A 119 -2.274 -12.772 -14.286 1.00 2.20 C ATOM 1835 CG2 ILE A 119 -3.767 -12.885 -16.299 1.00 22.50 C ATOM 1836 CD1 ILE A 119 -2.020 -13.582 -13.035 1.00 60.34 C ATOM 0 H ILE A 119 -3.455 -10.526 -15.667 1.00 65.15 H new ATOM 0 HA ILE A 119 -5.583 -11.801 -14.464 1.00 50.12 H new ATOM 0 HB ILE A 119 -4.169 -13.761 -14.397 1.00 20.21 H new ATOM 0 HG12 ILE A 119 -1.611 -13.123 -15.077 1.00 2.20 H new ATOM 0 HG13 ILE A 119 -2.016 -11.731 -14.093 1.00 2.20 H new ATOM 0 HG21 ILE A 119 -3.193 -13.739 -16.658 1.00 22.50 H new ATOM 0 HG22 ILE A 119 -4.802 -12.979 -16.629 1.00 22.50 H new ATOM 0 HG23 ILE A 119 -3.340 -11.966 -16.701 1.00 22.50 H new ATOM 0 HD11 ILE A 119 -0.974 -13.484 -12.744 1.00 60.34 H new ATOM 0 HD12 ILE A 119 -2.657 -13.217 -12.229 1.00 60.34 H new ATOM 0 HD13 ILE A 119 -2.246 -14.631 -13.228 1.00 60.34 H new ATOM 1848 N ILE A 120 -3.302 -10.794 -12.337 1.00 42.50 N ATOM 1849 CA ILE A 120 -3.006 -10.610 -10.922 1.00 1.51 C ATOM 1850 C ILE A 120 -3.989 -9.640 -10.276 1.00 62.35 C ATOM 1851 O ILE A 120 -4.340 -9.783 -9.106 1.00 43.52 O ATOM 1852 CB ILE A 120 -1.572 -10.087 -10.710 1.00 53.45 C ATOM 1853 CG1 ILE A 120 -1.402 -8.720 -11.374 1.00 1.40 C ATOM 1854 CG2 ILE A 120 -0.560 -11.080 -11.261 1.00 71.24 C ATOM 1855 CD1 ILE A 120 -1.657 -7.558 -10.440 1.00 14.01 C ATOM 0 H ILE A 120 -2.662 -10.312 -12.968 1.00 42.50 H new ATOM 0 HA ILE A 120 -3.101 -11.588 -10.450 1.00 1.51 H new ATOM 0 HB ILE A 120 -1.396 -9.974 -9.640 1.00 53.45 H new ATOM 0 HG12 ILE A 120 -0.390 -8.641 -11.771 1.00 1.40 H new ATOM 0 HG13 ILE A 120 -2.083 -8.650 -12.222 1.00 1.40 H new ATOM 0 HG21 ILE A 120 0.448 -10.697 -11.104 1.00 71.24 H new ATOM 0 HG22 ILE A 120 -0.670 -12.035 -10.746 1.00 71.24 H new ATOM 0 HG23 ILE A 120 -0.732 -11.221 -12.328 1.00 71.24 H new ATOM 0 HD11 ILE A 120 -1.518 -6.621 -10.979 1.00 14.01 H new ATOM 0 HD12 ILE A 120 -2.678 -7.612 -10.063 1.00 14.01 H new ATOM 0 HD13 ILE A 120 -0.959 -7.603 -9.604 1.00 14.01 H new ATOM 1867 N SER A 121 -4.432 -8.653 -11.049 1.00 0.12 N ATOM 1868 CA SER A 121 -5.374 -7.657 -10.553 1.00 73.21 C ATOM 1869 C SER A 121 -6.755 -8.272 -10.343 1.00 61.43 C ATOM 1870 O SER A 121 -7.458 -7.935 -9.392 1.00 43.23 O ATOM 1871 CB SER A 121 -5.470 -6.482 -11.529 1.00 52.11 C ATOM 1872 OG SER A 121 -4.453 -5.528 -11.278 1.00 1.41 O ATOM 0 H SER A 121 -4.153 -8.522 -12.021 1.00 0.12 H new ATOM 0 HA SER A 121 -5.007 -7.293 -9.593 1.00 73.21 H new ATOM 0 HB2 SER A 121 -5.386 -6.847 -12.553 1.00 52.11 H new ATOM 0 HB3 SER A 121 -6.448 -6.009 -11.439 1.00 52.11 H new ATOM 0 HG SER A 121 -3.688 -5.704 -11.865 1.00 1.41 H new ATOM 1878 N GLU A 122 -7.135 -9.176 -11.241 1.00 41.41 N ATOM 1879 CA GLU A 122 -8.432 -9.838 -11.155 1.00 61.12 C ATOM 1880 C GLU A 122 -8.416 -10.931 -10.091 1.00 33.11 C ATOM 1881 O GLU A 122 -9.247 -10.939 -9.182 1.00 50.32 O ATOM 1882 CB GLU A 122 -8.814 -10.436 -12.511 1.00 22.41 C ATOM 1883 CG GLU A 122 -8.907 -9.408 -13.626 1.00 53.03 C ATOM 1884 CD GLU A 122 -10.000 -8.385 -13.387 1.00 22.05 C ATOM 1885 OE1 GLU A 122 -9.788 -7.471 -12.563 1.00 35.23 O ATOM 1886 OE2 GLU A 122 -11.068 -8.498 -14.024 1.00 60.42 O ATOM 0 H GLU A 122 -6.564 -9.466 -12.035 1.00 41.41 H new ATOM 0 HA GLU A 122 -9.174 -9.092 -10.872 1.00 61.12 H new ATOM 0 HB2 GLU A 122 -8.078 -11.192 -12.786 1.00 22.41 H new ATOM 0 HB3 GLU A 122 -9.773 -10.945 -12.417 1.00 22.41 H new ATOM 0 HG2 GLU A 122 -7.950 -8.895 -13.723 1.00 53.03 H new ATOM 0 HG3 GLU A 122 -9.093 -9.918 -14.571 1.00 53.03 H new ATOM 1893 N ILE A 123 -7.465 -11.850 -10.210 1.00 72.25 N ATOM 1894 CA ILE A 123 -7.339 -12.947 -9.258 1.00 54.04 C ATOM 1895 C ILE A 123 -7.248 -12.426 -7.828 1.00 62.52 C ATOM 1896 O ILE A 123 -8.064 -12.774 -6.976 1.00 23.52 O ATOM 1897 CB ILE A 123 -6.103 -13.814 -9.557 1.00 31.40 C ATOM 1898 CG1 ILE A 123 -6.256 -14.513 -10.909 1.00 34.31 C ATOM 1899 CG2 ILE A 123 -5.890 -14.834 -8.449 1.00 30.35 C ATOM 1900 CD1 ILE A 123 -4.956 -15.055 -11.462 1.00 24.43 C ATOM 0 H ILE A 123 -6.770 -11.857 -10.956 1.00 72.25 H new ATOM 0 HA ILE A 123 -8.235 -13.559 -9.363 1.00 54.04 H new ATOM 0 HB ILE A 123 -5.227 -13.166 -9.602 1.00 31.40 H new ATOM 0 HG12 ILE A 123 -6.967 -15.333 -10.806 1.00 34.31 H new ATOM 0 HG13 ILE A 123 -6.681 -13.810 -11.626 1.00 34.31 H new ATOM 0 HG21 ILE A 123 -5.012 -15.439 -8.675 1.00 30.35 H new ATOM 0 HG22 ILE A 123 -5.739 -14.316 -7.502 1.00 30.35 H new ATOM 0 HG23 ILE A 123 -6.766 -15.479 -8.375 1.00 30.35 H new ATOM 0 HD11 ILE A 123 -5.142 -15.537 -12.422 1.00 24.43 H new ATOM 0 HD12 ILE A 123 -4.249 -14.237 -11.598 1.00 24.43 H new ATOM 0 HD13 ILE A 123 -4.540 -15.783 -10.765 1.00 24.43 H new ATOM 1912 N ASN A 124 -6.248 -11.587 -7.572 1.00 75.21 N ATOM 1913 CA ASN A 124 -6.050 -11.016 -6.245 1.00 73.45 C ATOM 1914 C ASN A 124 -7.294 -10.261 -5.787 1.00 64.11 C ATOM 1915 O ASN A 124 -7.493 -10.039 -4.593 1.00 42.22 O ATOM 1916 CB ASN A 124 -4.841 -10.078 -6.246 1.00 11.21 C ATOM 1917 CG ASN A 124 -3.556 -10.793 -6.616 1.00 25.22 C ATOM 1918 OD1 ASN A 124 -3.535 -12.013 -6.775 1.00 22.41 O ATOM 1919 ND2 ASN A 124 -2.475 -10.033 -6.753 1.00 11.02 N ATOM 0 H ASN A 124 -5.563 -11.288 -8.266 1.00 75.21 H new ATOM 0 HA ASN A 124 -5.866 -11.834 -5.548 1.00 73.45 H new ATOM 0 HB2 ASN A 124 -5.016 -9.264 -6.950 1.00 11.21 H new ATOM 0 HB3 ASN A 124 -4.732 -9.628 -5.259 1.00 11.21 H new ATOM 0 HD21 ASN A 124 -1.581 -10.458 -7.000 1.00 11.02 H new ATOM 0 HD22 ASN A 124 -2.539 -9.025 -6.612 1.00 11.02 H new ATOM 1926 N ASN A 125 -8.128 -9.869 -6.744 1.00 51.03 N ATOM 1927 CA ASN A 125 -9.352 -9.138 -6.439 1.00 1.33 C ATOM 1928 C ASN A 125 -10.506 -10.099 -6.168 1.00 30.23 C ATOM 1929 O ASN A 125 -11.462 -9.757 -5.473 1.00 34.25 O ATOM 1930 CB ASN A 125 -9.714 -8.202 -7.594 1.00 2.44 C ATOM 1931 CG ASN A 125 -11.135 -7.681 -7.493 1.00 64.22 C ATOM 1932 OD1 ASN A 125 -11.425 -6.791 -6.695 1.00 75.13 O ATOM 1933 ND2 ASN A 125 -12.028 -8.236 -8.304 1.00 2.34 N ATOM 0 H ASN A 125 -7.979 -10.045 -7.737 1.00 51.03 H new ATOM 0 HA ASN A 125 -9.177 -8.545 -5.541 1.00 1.33 H new ATOM 0 HB2 ASN A 125 -9.021 -7.360 -7.607 1.00 2.44 H new ATOM 0 HB3 ASN A 125 -9.590 -8.731 -8.539 1.00 2.44 H new ATOM 0 HD21 ASN A 125 -13.000 -7.927 -8.281 1.00 2.34 H new ATOM 0 HD22 ASN A 125 -11.742 -8.972 -8.950 1.00 2.34 H new ATOM 1940 N ASN A 126 -10.409 -11.303 -6.722 1.00 22.12 N ATOM 1941 CA ASN A 126 -11.443 -12.315 -6.540 1.00 5.34 C ATOM 1942 C ASN A 126 -10.973 -13.410 -5.588 1.00 72.44 C ATOM 1943 O ASN A 126 -11.616 -14.452 -5.458 1.00 24.00 O ATOM 1944 CB ASN A 126 -11.831 -12.926 -7.888 1.00 64.41 C ATOM 1945 CG ASN A 126 -12.608 -11.959 -8.760 1.00 31.12 C ATOM 1946 OD1 ASN A 126 -13.818 -11.795 -8.601 1.00 60.44 O ATOM 1947 ND2 ASN A 126 -11.914 -11.311 -9.688 1.00 44.34 N ATOM 0 H ASN A 126 -9.624 -11.602 -7.301 1.00 22.12 H new ATOM 0 HA ASN A 126 -12.317 -11.831 -6.103 1.00 5.34 H new ATOM 0 HB2 ASN A 126 -10.930 -13.241 -8.414 1.00 64.41 H new ATOM 0 HB3 ASN A 126 -12.430 -13.821 -7.719 1.00 64.41 H new ATOM 0 HD21 ASN A 126 -12.382 -10.647 -10.304 1.00 44.34 H new ATOM 0 HD22 ASN A 126 -10.912 -11.478 -9.785 1.00 44.34 H new ATOM 1954 N ILE A 127 -9.847 -13.167 -4.925 1.00 64.21 N ATOM 1955 CA ILE A 127 -9.291 -14.132 -3.985 1.00 53.31 C ATOM 1956 C ILE A 127 -9.732 -13.825 -2.558 1.00 13.41 C ATOM 1957 O ILE A 127 -9.787 -12.666 -2.151 1.00 22.03 O ATOM 1958 CB ILE A 127 -7.752 -14.151 -4.042 1.00 71.21 C ATOM 1959 CG1 ILE A 127 -7.272 -15.134 -5.112 1.00 12.14 C ATOM 1960 CG2 ILE A 127 -7.176 -14.517 -2.682 1.00 2.33 C ATOM 1961 CD1 ILE A 127 -5.766 -15.208 -5.232 1.00 51.21 C ATOM 0 H ILE A 127 -9.302 -12.310 -5.022 1.00 64.21 H new ATOM 0 HA ILE A 127 -9.669 -15.112 -4.277 1.00 53.31 H new ATOM 0 HB ILE A 127 -7.400 -13.154 -4.307 1.00 71.21 H new ATOM 0 HG12 ILE A 127 -7.659 -16.127 -4.882 1.00 12.14 H new ATOM 0 HG13 ILE A 127 -7.691 -14.843 -6.075 1.00 12.14 H new ATOM 0 HG21 ILE A 127 -6.088 -14.526 -2.738 1.00 2.33 H new ATOM 0 HG22 ILE A 127 -7.495 -13.783 -1.942 1.00 2.33 H new ATOM 0 HG23 ILE A 127 -7.533 -15.505 -2.390 1.00 2.33 H new ATOM 0 HD11 ILE A 127 -5.498 -15.924 -6.009 1.00 51.21 H new ATOM 0 HD12 ILE A 127 -5.373 -14.225 -5.493 1.00 51.21 H new ATOM 0 HD13 ILE A 127 -5.341 -15.528 -4.281 1.00 51.21 H new ATOM 1973 N ASN A 128 -10.043 -14.873 -1.802 1.00 2.43 N ATOM 1974 CA ASN A 128 -10.478 -14.716 -0.419 1.00 53.34 C ATOM 1975 C ASN A 128 -9.505 -13.838 0.360 1.00 63.41 C ATOM 1976 O ASN A 128 -9.876 -13.217 1.356 1.00 72.01 O ATOM 1977 CB ASN A 128 -10.602 -16.083 0.257 1.00 3.42 C ATOM 1978 CG ASN A 128 -9.260 -16.635 0.696 1.00 11.34 C ATOM 1979 OD1 ASN A 128 -9.028 -16.860 1.884 1.00 54.30 O ATOM 1980 ND2 ASN A 128 -8.368 -16.855 -0.262 1.00 25.45 N ATOM 0 H ASN A 128 -10.002 -15.840 -2.124 1.00 2.43 H new ATOM 0 HA ASN A 128 -11.454 -14.231 -0.424 1.00 53.34 H new ATOM 0 HB2 ASN A 128 -11.258 -15.999 1.123 1.00 3.42 H new ATOM 0 HB3 ASN A 128 -11.073 -16.785 -0.432 1.00 3.42 H new ATOM 0 HD21 ASN A 128 -7.447 -17.225 -0.026 1.00 25.45 H new ATOM 0 HD22 ASN A 128 -8.603 -16.654 -1.234 1.00 25.45 H new