USER MOD reduce.3.24.130724 H: found=0, std=0, add=616, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 619 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 109 SER OG : rot 36:sc= 1.34 USER MOD Set 1.2: A 125 ASN : amide:sc= -0.0112 X(o=0.96,f=1.1) USER MOD Set 1.3: A 126 ASN : amide:sc= -0.361 X(o=0.96,f=1.1) USER MOD Set 2.1: A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.311 K(o=-0.31,f=-1.3!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 150:sc= -0.649 (180deg=-1.71) 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 -150:sc= -0.125 USER MOD Single : A 39 ASN : amide:sc= -0.0617 X(o=-0.062,f=0.0048) USER MOD Single : A 41 ASN : amide:sc= -0.422 X(o=-0.42,f=-0.076) USER MOD Single : A 62 GLN : amide:sc= -2.34 K(o=-2.3,f=-5!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 GLN : amide:sc= -0.0274 X(o=-0.027,f=-0.23) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0.137 X(o=0.14,f=-0.037) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 29:sc= 0.0706 USER MOD Single : A 101 MET CE :methyl 157:sc= -4.96! (180deg=-6.7!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= -0.585 X(o=-0.59,f=-1) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0886) USER MOD Single : A 110 GLN : amide:sc= -0.2 K(o=-0.2,f=-0.93) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00562) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.926 K(o=-0.93,f=-2.1) USER MOD Single : A 128 ASN :FLIP amide:sc= 0 F(o=-0.76,f=0) USER MOD ----------------------------------------------------------------- ATOM 316 N ILE A 23 -0.352 -27.230 -14.114 1.00 52.50 N ATOM 317 CA ILE A 23 -1.497 -27.192 -15.015 1.00 71.21 C ATOM 318 C ILE A 23 -1.654 -28.514 -15.760 1.00 10.42 C ATOM 319 O ILE A 23 -0.673 -29.101 -16.213 1.00 53.52 O ATOM 320 CB ILE A 23 -1.370 -26.049 -16.040 1.00 41.35 C ATOM 321 CG1 ILE A 23 -1.153 -24.715 -15.324 1.00 13.10 C ATOM 322 CG2 ILE A 23 -2.608 -25.989 -16.922 1.00 73.31 C ATOM 323 CD1 ILE A 23 -0.844 -23.570 -16.261 1.00 74.23 C ATOM 0 HA ILE A 23 -2.379 -27.018 -14.398 1.00 71.21 H new ATOM 0 HB ILE A 23 -0.505 -26.243 -16.675 1.00 41.35 H new ATOM 0 HG12 ILE A 23 -2.046 -24.472 -14.748 1.00 13.10 H new ATOM 0 HG13 ILE A 23 -0.334 -24.823 -14.613 1.00 13.10 H new ATOM 0 HG21 ILE A 23 -2.503 -25.177 -17.641 1.00 73.31 H new ATOM 0 HG22 ILE A 23 -2.721 -26.933 -17.455 1.00 73.31 H new ATOM 0 HG23 ILE A 23 -3.488 -25.814 -16.303 1.00 73.31 H new ATOM 0 HD11 ILE A 23 -0.702 -22.656 -15.684 1.00 74.23 H new ATOM 0 HD12 ILE A 23 0.066 -23.792 -16.819 1.00 74.23 H new ATOM 0 HD13 ILE A 23 -1.672 -23.435 -16.956 1.00 74.23 H new ATOM 335 N GLU A 24 -2.895 -28.972 -15.885 1.00 71.32 N ATOM 336 CA GLU A 24 -3.180 -30.224 -16.577 1.00 63.12 C ATOM 337 C GLU A 24 -4.319 -30.046 -17.576 1.00 45.22 C ATOM 338 O GLU A 24 -5.154 -29.155 -17.428 1.00 40.33 O ATOM 339 CB GLU A 24 -3.537 -31.320 -15.570 1.00 43.20 C ATOM 340 CG GLU A 24 -4.986 -31.280 -15.114 1.00 24.25 C ATOM 341 CD GLU A 24 -5.141 -31.579 -13.636 1.00 12.10 C ATOM 342 OE1 GLU A 24 -4.279 -31.139 -12.847 1.00 51.31 O ATOM 343 OE2 GLU A 24 -6.126 -32.254 -13.268 1.00 52.34 O ATOM 0 H GLU A 24 -3.719 -28.496 -15.517 1.00 71.32 H new ATOM 0 HA GLU A 24 -2.284 -30.520 -17.122 1.00 63.12 H new ATOM 0 HB2 GLU A 24 -3.332 -32.293 -16.017 1.00 43.20 H new ATOM 0 HB3 GLU A 24 -2.888 -31.227 -14.699 1.00 43.20 H new ATOM 0 HG2 GLU A 24 -5.403 -30.296 -15.327 1.00 24.25 H new ATOM 0 HG3 GLU A 24 -5.564 -32.003 -15.690 1.00 24.25 H new ATOM 350 N GLN A 25 -4.346 -30.901 -18.594 1.00 72.41 N ATOM 351 CA GLN A 25 -5.381 -30.837 -19.618 1.00 70.32 C ATOM 352 C GLN A 25 -6.628 -31.598 -19.180 1.00 34.23 C ATOM 353 O GLN A 25 -6.534 -32.661 -18.564 1.00 3.23 O ATOM 354 CB GLN A 25 -4.858 -31.409 -20.938 1.00 62.23 C ATOM 355 CG GLN A 25 -4.297 -32.817 -20.812 1.00 24.51 C ATOM 356 CD GLN A 25 -2.783 -32.844 -20.816 1.00 33.21 C ATOM 357 OE1 GLN A 25 -2.138 -32.051 -21.504 1.00 64.03 O ATOM 358 NE2 GLN A 25 -2.205 -33.759 -20.046 1.00 41.21 N ATOM 0 H GLN A 25 -3.663 -31.646 -18.731 1.00 72.41 H new ATOM 0 HA GLN A 25 -5.648 -29.790 -19.764 1.00 70.32 H new ATOM 0 HB2 GLN A 25 -5.667 -31.413 -21.668 1.00 62.23 H new ATOM 0 HB3 GLN A 25 -4.081 -30.751 -21.327 1.00 62.23 H new ATOM 0 HG2 GLN A 25 -4.662 -33.268 -19.889 1.00 24.51 H new ATOM 0 HG3 GLN A 25 -4.670 -33.427 -21.635 1.00 24.51 H new ATOM 0 HE21 GLN A 25 -2.778 -34.396 -19.493 1.00 41.21 H new ATOM 0 HE22 GLN A 25 -1.188 -33.825 -20.008 1.00 41.21 H new ATOM 367 N ILE A 26 -7.794 -31.049 -19.500 1.00 31.52 N ATOM 368 CA ILE A 26 -9.059 -31.676 -19.139 1.00 43.51 C ATOM 369 C ILE A 26 -9.939 -31.885 -20.368 1.00 72.10 C ATOM 370 O ILE A 26 -9.536 -31.587 -21.491 1.00 74.50 O ATOM 371 CB ILE A 26 -9.831 -30.834 -18.107 1.00 53.31 C ATOM 372 CG1 ILE A 26 -10.132 -29.444 -18.671 1.00 70.00 C ATOM 373 CG2 ILE A 26 -9.039 -30.726 -16.813 1.00 53.23 C ATOM 374 CD1 ILE A 26 -11.536 -29.304 -19.215 1.00 44.33 C ATOM 0 H ILE A 26 -7.889 -30.170 -20.009 1.00 31.52 H new ATOM 0 HA ILE A 26 -8.817 -32.643 -18.698 1.00 43.51 H new ATOM 0 HB ILE A 26 -10.777 -31.330 -17.891 1.00 53.31 H new ATOM 0 HG12 ILE A 26 -9.979 -28.702 -17.887 1.00 70.00 H new ATOM 0 HG13 ILE A 26 -9.419 -29.221 -19.465 1.00 70.00 H new ATOM 0 HG21 ILE A 26 -9.598 -30.128 -16.093 1.00 53.23 H new ATOM 0 HG22 ILE A 26 -8.872 -31.723 -16.404 1.00 53.23 H new ATOM 0 HG23 ILE A 26 -8.079 -30.250 -17.013 1.00 53.23 H new ATOM 0 HD11 ILE A 26 -11.679 -28.294 -19.598 1.00 44.33 H new ATOM 0 HD12 ILE A 26 -11.687 -30.022 -20.021 1.00 44.33 H new ATOM 0 HD13 ILE A 26 -12.255 -29.495 -18.419 1.00 44.33 H new ATOM 386 N GLY A 27 -11.145 -32.398 -20.145 1.00 34.03 N ATOM 387 CA GLY A 27 -12.064 -32.636 -21.243 1.00 51.40 C ATOM 388 C GLY A 27 -13.392 -31.931 -21.050 1.00 43.34 C ATOM 389 O GLY A 27 -13.672 -31.401 -19.974 1.00 62.43 O ATOM 0 H GLY A 27 -11.502 -32.653 -19.224 1.00 34.03 H new ATOM 0 HA2 GLY A 27 -11.609 -32.298 -22.174 1.00 51.40 H new ATOM 0 HA3 GLY A 27 -12.236 -33.708 -21.343 1.00 51.40 H new ATOM 393 N ASP A 28 -14.211 -31.922 -22.096 1.00 72.03 N ATOM 394 CA ASP A 28 -15.517 -31.275 -22.037 1.00 72.25 C ATOM 395 C ASP A 28 -16.451 -32.020 -21.087 1.00 30.43 C ATOM 396 O ASP A 28 -17.313 -31.416 -20.449 1.00 45.30 O ATOM 397 CB ASP A 28 -16.139 -31.207 -23.433 1.00 20.12 C ATOM 398 CG ASP A 28 -17.412 -30.384 -23.460 1.00 62.32 C ATOM 399 OD1 ASP A 28 -17.715 -29.725 -22.443 1.00 61.43 O ATOM 400 OD2 ASP A 28 -18.104 -30.398 -24.499 1.00 15.13 O ATOM 0 H ASP A 28 -13.994 -32.355 -22.994 1.00 72.03 H new ATOM 0 HA ASP A 28 -15.376 -30.262 -21.660 1.00 72.25 H new ATOM 0 HB2 ASP A 28 -15.418 -30.778 -24.129 1.00 20.12 H new ATOM 0 HB3 ASP A 28 -16.355 -32.217 -23.781 1.00 20.12 H new ATOM 405 N SER A 29 -16.272 -33.334 -20.999 1.00 34.14 N ATOM 406 CA SER A 29 -17.102 -34.162 -20.131 1.00 40.21 C ATOM 407 C SER A 29 -16.627 -34.076 -18.684 1.00 24.42 C ATOM 408 O SER A 29 -17.398 -34.304 -17.753 1.00 3.01 O ATOM 409 CB SER A 29 -17.077 -35.616 -20.604 1.00 63.34 C ATOM 410 OG SER A 29 -17.796 -35.773 -21.814 1.00 42.24 O ATOM 0 H SER A 29 -15.560 -33.848 -21.518 1.00 34.14 H new ATOM 0 HA SER A 29 -18.125 -33.789 -20.181 1.00 40.21 H new ATOM 0 HB2 SER A 29 -16.045 -35.937 -20.747 1.00 63.34 H new ATOM 0 HB3 SER A 29 -17.508 -36.259 -19.836 1.00 63.34 H new ATOM 0 HG SER A 29 -17.763 -36.711 -22.095 1.00 42.24 H new ATOM 416 N GLU A 30 -15.353 -33.745 -18.505 1.00 3.41 N ATOM 417 CA GLU A 30 -14.774 -33.630 -17.171 1.00 21.44 C ATOM 418 C GLU A 30 -14.756 -32.176 -16.709 1.00 70.14 C ATOM 419 O GLU A 30 -14.468 -31.885 -15.548 1.00 61.05 O ATOM 420 CB GLU A 30 -13.354 -34.200 -17.156 1.00 71.22 C ATOM 421 CG GLU A 30 -13.180 -35.426 -18.035 1.00 52.14 C ATOM 422 CD GLU A 30 -14.294 -36.438 -17.851 1.00 63.22 C ATOM 423 OE1 GLU A 30 -14.836 -36.526 -16.729 1.00 62.15 O ATOM 424 OE2 GLU A 30 -14.625 -37.141 -18.829 1.00 33.44 O ATOM 0 H GLU A 30 -14.702 -33.552 -19.266 1.00 3.41 H new ATOM 0 HA GLU A 30 -15.395 -34.204 -16.483 1.00 21.44 H new ATOM 0 HB2 GLU A 30 -12.658 -33.427 -17.483 1.00 71.22 H new ATOM 0 HB3 GLU A 30 -13.086 -34.457 -16.131 1.00 71.22 H new ATOM 0 HG2 GLU A 30 -13.143 -35.117 -19.080 1.00 52.14 H new ATOM 0 HG3 GLU A 30 -12.224 -35.898 -17.809 1.00 52.14 H new ATOM 431 N PHE A 31 -15.064 -31.267 -17.627 1.00 51.15 N ATOM 432 CA PHE A 31 -15.082 -29.842 -17.316 1.00 15.33 C ATOM 433 C PHE A 31 -15.826 -29.579 -16.010 1.00 52.25 C ATOM 434 O PHE A 31 -15.215 -29.261 -14.989 1.00 53.02 O ATOM 435 CB PHE A 31 -15.738 -29.057 -18.455 1.00 75.15 C ATOM 436 CG PHE A 31 -16.047 -27.631 -18.100 1.00 65.24 C ATOM 437 CD1 PHE A 31 -15.033 -26.757 -17.744 1.00 33.35 C ATOM 438 CD2 PHE A 31 -17.351 -27.165 -18.122 1.00 72.53 C ATOM 439 CE1 PHE A 31 -15.316 -25.444 -17.417 1.00 31.30 C ATOM 440 CE2 PHE A 31 -17.640 -25.853 -17.795 1.00 51.23 C ATOM 441 CZ PHE A 31 -16.620 -24.992 -17.444 1.00 13.43 C ATOM 0 H PHE A 31 -15.305 -31.491 -18.593 1.00 51.15 H new ATOM 0 HA PHE A 31 -14.051 -29.509 -17.200 1.00 15.33 H new ATOM 0 HB2 PHE A 31 -15.079 -29.072 -19.323 1.00 75.15 H new ATOM 0 HB3 PHE A 31 -16.661 -29.558 -18.747 1.00 75.15 H new ATOM 0 HD1 PHE A 31 -14.011 -27.105 -17.722 1.00 33.35 H new ATOM 0 HD2 PHE A 31 -18.152 -27.835 -18.398 1.00 72.53 H new ATOM 0 HE1 PHE A 31 -14.517 -24.772 -17.140 1.00 31.30 H new ATOM 0 HE2 PHE A 31 -18.661 -25.503 -17.814 1.00 51.23 H new ATOM 0 HZ PHE A 31 -16.842 -23.966 -17.191 1.00 13.43 H new ATOM 451 N ASP A 32 -17.146 -29.716 -16.049 1.00 14.24 N ATOM 452 CA ASP A 32 -17.974 -29.494 -14.869 1.00 72.32 C ATOM 453 C ASP A 32 -17.703 -30.557 -13.809 1.00 72.42 C ATOM 454 O ASP A 32 -17.925 -30.331 -12.619 1.00 33.44 O ATOM 455 CB ASP A 32 -19.455 -29.504 -15.250 1.00 63.01 C ATOM 456 CG ASP A 32 -19.828 -30.704 -16.097 1.00 24.01 C ATOM 457 OD1 ASP A 32 -19.603 -30.657 -17.325 1.00 50.53 O ATOM 458 OD2 ASP A 32 -20.346 -31.691 -15.533 1.00 24.23 O ATOM 0 H ASP A 32 -17.667 -29.980 -16.885 1.00 14.24 H new ATOM 0 HA ASP A 32 -17.720 -28.518 -14.455 1.00 72.32 H new ATOM 0 HB2 ASP A 32 -20.060 -29.501 -14.343 1.00 63.01 H new ATOM 0 HB3 ASP A 32 -19.693 -28.591 -15.795 1.00 63.01 H new ATOM 463 N ASN A 33 -17.221 -31.715 -14.247 1.00 0.41 N ATOM 464 CA ASN A 33 -16.920 -32.813 -13.335 1.00 71.43 C ATOM 465 C ASN A 33 -15.943 -32.368 -12.252 1.00 5.31 C ATOM 466 O ASN A 33 -16.012 -32.826 -11.112 1.00 42.22 O ATOM 467 CB ASN A 33 -16.339 -34.000 -14.107 1.00 3.30 C ATOM 468 CG ASN A 33 -16.615 -35.325 -13.423 1.00 61.22 C ATOM 469 OD1 ASN A 33 -15.721 -35.929 -12.832 1.00 43.52 O ATOM 470 ND2 ASN A 33 -17.860 -35.782 -13.501 1.00 2.02 N ATOM 0 H ASN A 33 -17.030 -31.918 -15.228 1.00 0.41 H new ATOM 0 HA ASN A 33 -17.850 -33.120 -12.856 1.00 71.43 H new ATOM 0 HB2 ASN A 33 -16.761 -34.018 -15.112 1.00 3.30 H new ATOM 0 HB3 ASN A 33 -15.263 -33.868 -14.216 1.00 3.30 H new ATOM 0 HD21 ASN A 33 -18.107 -36.668 -13.060 1.00 2.02 H new ATOM 0 HD22 ASN A 33 -18.569 -35.247 -14.002 1.00 2.02 H new ATOM 477 N LYS A 34 -15.032 -31.471 -12.617 1.00 61.14 N ATOM 478 CA LYS A 34 -14.042 -30.961 -11.676 1.00 61.34 C ATOM 479 C LYS A 34 -14.240 -29.468 -11.432 1.00 34.21 C ATOM 480 O LYS A 34 -13.703 -28.909 -10.477 1.00 0.52 O ATOM 481 CB LYS A 34 -12.628 -31.219 -12.204 1.00 4.45 C ATOM 482 CG LYS A 34 -12.395 -30.684 -13.605 1.00 54.12 C ATOM 483 CD LYS A 34 -11.810 -31.748 -14.520 1.00 72.43 C ATOM 484 CE LYS A 34 -10.349 -32.021 -14.192 1.00 73.13 C ATOM 485 NZ LYS A 34 -10.204 -32.965 -13.050 1.00 34.51 N ATOM 0 H LYS A 34 -14.959 -31.083 -13.557 1.00 61.14 H new ATOM 0 HA LYS A 34 -14.173 -31.486 -10.730 1.00 61.34 H new ATOM 0 HB2 LYS A 34 -11.907 -30.763 -11.525 1.00 4.45 H new ATOM 0 HB3 LYS A 34 -12.437 -32.292 -12.198 1.00 4.45 H new ATOM 0 HG2 LYS A 34 -13.337 -30.325 -14.019 1.00 54.12 H new ATOM 0 HG3 LYS A 34 -11.720 -29.830 -13.561 1.00 54.12 H new ATOM 0 HD2 LYS A 34 -12.384 -32.669 -14.423 1.00 72.43 H new ATOM 0 HD3 LYS A 34 -11.897 -31.426 -15.558 1.00 72.43 H new ATOM 0 HE2 LYS A 34 -9.851 -32.433 -15.069 1.00 73.13 H new ATOM 0 HE3 LYS A 34 -9.849 -31.082 -13.953 1.00 73.13 H new ATOM 0 HZ1 LYS A 34 -9.326 -33.511 -13.160 1.00 34.51 H new ATOM 0 HZ2 LYS A 34 -10.169 -32.429 -12.159 1.00 34.51 H new ATOM 0 HZ3 LYS A 34 -11.016 -33.615 -13.032 1.00 34.51 H new ATOM 499 N VAL A 35 -15.016 -28.830 -12.303 1.00 34.33 N ATOM 500 CA VAL A 35 -15.287 -27.403 -12.180 1.00 51.44 C ATOM 501 C VAL A 35 -16.503 -27.147 -11.297 1.00 12.33 C ATOM 502 O VAL A 35 -16.428 -26.410 -10.314 1.00 34.24 O ATOM 503 CB VAL A 35 -15.523 -26.755 -13.558 1.00 22.45 C ATOM 504 CG1 VAL A 35 -16.158 -25.383 -13.402 1.00 52.31 C ATOM 505 CG2 VAL A 35 -14.218 -26.664 -14.334 1.00 15.43 C ATOM 0 H VAL A 35 -15.467 -29.278 -13.100 1.00 34.33 H new ATOM 0 HA VAL A 35 -14.407 -26.954 -11.720 1.00 51.44 H new ATOM 0 HB VAL A 35 -16.211 -27.384 -14.123 1.00 22.45 H new ATOM 0 HG11 VAL A 35 -16.317 -24.942 -14.386 1.00 52.31 H new ATOM 0 HG12 VAL A 35 -17.115 -25.481 -12.890 1.00 52.31 H new ATOM 0 HG13 VAL A 35 -15.498 -24.741 -12.818 1.00 52.31 H new ATOM 0 HG21 VAL A 35 -14.403 -26.204 -15.305 1.00 15.43 H new ATOM 0 HG22 VAL A 35 -13.504 -26.058 -13.776 1.00 15.43 H new ATOM 0 HG23 VAL A 35 -13.810 -27.664 -14.479 1.00 15.43 H new ATOM 515 N THR A 36 -17.626 -27.764 -11.653 1.00 23.22 N ATOM 516 CA THR A 36 -18.860 -27.604 -10.893 1.00 25.31 C ATOM 517 C THR A 36 -18.743 -28.245 -9.514 1.00 21.25 C ATOM 518 O THR A 36 -19.506 -27.924 -8.605 1.00 61.41 O ATOM 519 CB THR A 36 -20.060 -28.224 -11.634 1.00 24.40 C ATOM 520 OG1 THR A 36 -21.229 -27.423 -11.427 1.00 52.21 O ATOM 521 CG2 THR A 36 -20.319 -29.643 -11.153 1.00 14.11 C ATOM 0 H THR A 36 -17.706 -28.379 -12.463 1.00 23.22 H new ATOM 0 HA THR A 36 -19.026 -26.533 -10.780 1.00 25.31 H new ATOM 0 HB THR A 36 -19.825 -28.256 -12.698 1.00 24.40 H new ATOM 0 HG1 THR A 36 -21.987 -27.822 -11.902 1.00 52.21 H new ATOM 0 HG21 THR A 36 -21.171 -30.060 -11.691 1.00 14.11 H new ATOM 0 HG22 THR A 36 -19.437 -30.257 -11.338 1.00 14.11 H new ATOM 0 HG23 THR A 36 -20.535 -29.631 -10.085 1.00 14.11 H new ATOM 529 N SER A 37 -17.782 -29.150 -9.367 1.00 14.22 N ATOM 530 CA SER A 37 -17.567 -29.838 -8.099 1.00 52.32 C ATOM 531 C SER A 37 -16.724 -28.987 -7.155 1.00 53.20 C ATOM 532 O SER A 37 -16.752 -29.176 -5.939 1.00 32.53 O ATOM 533 CB SER A 37 -16.884 -31.187 -8.335 1.00 12.31 C ATOM 534 OG SER A 37 -16.412 -31.739 -7.119 1.00 23.30 O ATOM 0 H SER A 37 -17.139 -29.424 -10.110 1.00 14.22 H new ATOM 0 HA SER A 37 -18.540 -30.007 -7.637 1.00 52.32 H new ATOM 0 HB2 SER A 37 -17.586 -31.877 -8.803 1.00 12.31 H new ATOM 0 HB3 SER A 37 -16.052 -31.061 -9.028 1.00 12.31 H new ATOM 0 HG SER A 37 -15.981 -32.601 -7.297 1.00 23.30 H new ATOM 540 N CYS A 38 -15.975 -28.049 -7.724 1.00 31.15 N ATOM 541 CA CYS A 38 -15.122 -27.167 -6.935 1.00 55.44 C ATOM 542 C CYS A 38 -15.931 -26.450 -5.858 1.00 24.01 C ATOM 543 O CYS A 38 -16.620 -25.470 -6.137 1.00 1.31 O ATOM 544 CB CYS A 38 -14.433 -26.145 -7.839 1.00 50.43 C ATOM 545 SG CYS A 38 -13.022 -25.314 -7.074 1.00 51.34 S ATOM 0 H CYS A 38 -15.941 -27.880 -8.729 1.00 31.15 H new ATOM 0 HA CYS A 38 -14.362 -27.778 -6.447 1.00 55.44 H new ATOM 0 HB2 CYS A 38 -14.097 -26.647 -8.746 1.00 50.43 H new ATOM 0 HB3 CYS A 38 -15.163 -25.394 -8.142 1.00 50.43 H new ATOM 0 HG CYS A 38 -12.904 -24.117 -7.566 1.00 51.34 H new ATOM 551 N ASN A 39 -15.840 -26.945 -4.629 1.00 43.53 N ATOM 552 CA ASN A 39 -16.565 -26.352 -3.511 1.00 34.53 C ATOM 553 C ASN A 39 -15.628 -25.537 -2.626 1.00 40.14 C ATOM 554 O ASN A 39 -15.973 -25.182 -1.499 1.00 34.52 O ATOM 555 CB ASN A 39 -17.246 -27.443 -2.682 1.00 62.21 C ATOM 556 CG ASN A 39 -18.564 -27.891 -3.285 1.00 2.12 C ATOM 557 OD1 ASN A 39 -18.626 -28.900 -3.988 1.00 62.30 O ATOM 558 ND2 ASN A 39 -19.625 -27.140 -3.014 1.00 54.11 N ATOM 0 H ASN A 39 -15.272 -27.755 -4.381 1.00 43.53 H new ATOM 0 HA ASN A 39 -17.325 -25.685 -3.917 1.00 34.53 H new ATOM 0 HB2 ASN A 39 -16.579 -28.301 -2.597 1.00 62.21 H new ATOM 0 HB3 ASN A 39 -17.419 -27.073 -1.672 1.00 62.21 H new ATOM 0 HD21 ASN A 39 -20.538 -27.391 -3.393 1.00 54.11 H new ATOM 0 HD22 ASN A 39 -19.527 -26.312 -2.426 1.00 54.11 H new ATOM 565 N ASP A 40 -14.441 -25.240 -3.146 1.00 45.34 N ATOM 566 CA ASP A 40 -13.455 -24.465 -2.405 1.00 20.02 C ATOM 567 C ASP A 40 -13.506 -22.994 -2.807 1.00 50.34 C ATOM 568 O ASP A 40 -12.630 -22.210 -2.445 1.00 73.13 O ATOM 569 CB ASP A 40 -12.051 -25.022 -2.644 1.00 44.11 C ATOM 570 CG ASP A 40 -11.817 -26.333 -1.918 1.00 41.31 C ATOM 571 OD1 ASP A 40 -12.297 -26.471 -0.773 1.00 41.24 O ATOM 572 OD2 ASP A 40 -11.157 -27.221 -2.497 1.00 0.11 O ATOM 0 H ASP A 40 -14.140 -25.525 -4.078 1.00 45.34 H new ATOM 0 HA ASP A 40 -13.692 -24.543 -1.344 1.00 20.02 H new ATOM 0 HB2 ASP A 40 -11.899 -25.170 -3.713 1.00 44.11 H new ATOM 0 HB3 ASP A 40 -11.312 -24.291 -2.315 1.00 44.11 H new ATOM 577 N ASN A 41 -14.539 -22.627 -3.559 1.00 64.15 N ATOM 578 CA ASN A 41 -14.703 -21.250 -4.013 1.00 33.45 C ATOM 579 C ASN A 41 -13.472 -20.779 -4.779 1.00 33.24 C ATOM 580 O ASN A 41 -13.167 -19.587 -4.812 1.00 50.23 O ATOM 581 CB ASN A 41 -14.961 -20.326 -2.820 1.00 65.20 C ATOM 582 CG ASN A 41 -16.432 -20.234 -2.467 1.00 23.13 C ATOM 583 OD1 ASN A 41 -16.817 -20.413 -1.311 1.00 25.31 O ATOM 584 ND2 ASN A 41 -17.264 -19.956 -3.465 1.00 63.34 N ATOM 0 H ASN A 41 -15.275 -23.263 -3.867 1.00 64.15 H new ATOM 0 HA ASN A 41 -15.561 -21.214 -4.684 1.00 33.45 H new ATOM 0 HB2 ASN A 41 -14.405 -20.689 -1.956 1.00 65.20 H new ATOM 0 HB3 ASN A 41 -14.582 -19.330 -3.047 1.00 65.20 H new ATOM 0 HD21 ASN A 41 -18.266 -19.883 -3.288 1.00 63.34 H new ATOM 0 HD22 ASN A 41 -16.901 -19.815 -4.408 1.00 63.34 H new ATOM 591 N ILE A 42 -12.767 -21.723 -5.395 1.00 30.15 N ATOM 592 CA ILE A 42 -11.570 -21.404 -6.162 1.00 31.32 C ATOM 593 C ILE A 42 -11.893 -21.248 -7.643 1.00 41.34 C ATOM 594 O ILE A 42 -12.538 -22.108 -8.244 1.00 12.51 O ATOM 595 CB ILE A 42 -10.489 -22.488 -5.995 1.00 40.33 C ATOM 596 CG1 ILE A 42 -10.259 -22.786 -4.513 1.00 31.15 C ATOM 597 CG2 ILE A 42 -9.193 -22.051 -6.660 1.00 3.31 C ATOM 598 CD1 ILE A 42 -9.289 -23.921 -4.268 1.00 74.15 C ATOM 0 H ILE A 42 -13.005 -22.715 -5.377 1.00 30.15 H new ATOM 0 HA ILE A 42 -11.188 -20.460 -5.774 1.00 31.32 H new ATOM 0 HB ILE A 42 -10.834 -23.401 -6.481 1.00 40.33 H new ATOM 0 HG12 ILE A 42 -9.884 -21.887 -4.024 1.00 31.15 H new ATOM 0 HG13 ILE A 42 -11.214 -23.028 -4.047 1.00 31.15 H new ATOM 0 HG21 ILE A 42 -8.439 -22.828 -6.533 1.00 3.31 H new ATOM 0 HG22 ILE A 42 -9.368 -21.885 -7.723 1.00 3.31 H new ATOM 0 HG23 ILE A 42 -8.842 -21.127 -6.201 1.00 3.31 H new ATOM 0 HD11 ILE A 42 -9.174 -24.076 -3.195 1.00 74.15 H new ATOM 0 HD12 ILE A 42 -9.672 -24.832 -4.728 1.00 74.15 H new ATOM 0 HD13 ILE A 42 -8.321 -23.673 -4.704 1.00 74.15 H new ATOM 610 N LEU A 43 -11.438 -20.145 -8.229 1.00 40.54 N ATOM 611 CA LEU A 43 -11.677 -19.875 -9.642 1.00 63.50 C ATOM 612 C LEU A 43 -10.706 -20.661 -10.518 1.00 24.21 C ATOM 613 O LEU A 43 -9.495 -20.633 -10.298 1.00 62.32 O ATOM 614 CB LEU A 43 -11.541 -18.378 -9.927 1.00 50.44 C ATOM 615 CG LEU A 43 -10.214 -17.736 -9.520 1.00 62.42 C ATOM 616 CD1 LEU A 43 -9.220 -17.790 -10.670 1.00 51.24 C ATOM 617 CD2 LEU A 43 -10.433 -16.299 -9.068 1.00 42.21 C ATOM 0 H LEU A 43 -10.902 -19.424 -7.747 1.00 40.54 H new ATOM 0 HA LEU A 43 -12.692 -20.193 -9.880 1.00 63.50 H new ATOM 0 HB2 LEU A 43 -11.687 -18.217 -10.995 1.00 50.44 H new ATOM 0 HB3 LEU A 43 -12.348 -17.856 -9.412 1.00 50.44 H new ATOM 0 HG LEU A 43 -9.801 -18.300 -8.683 1.00 62.42 H new ATOM 0 HD11 LEU A 43 -8.282 -17.329 -10.362 1.00 51.24 H new ATOM 0 HD12 LEU A 43 -9.040 -18.829 -10.947 1.00 51.24 H new ATOM 0 HD13 LEU A 43 -9.625 -17.251 -11.527 1.00 51.24 H new ATOM 0 HD21 LEU A 43 -9.478 -15.858 -8.782 1.00 42.21 H new ATOM 0 HD22 LEU A 43 -10.869 -15.723 -9.884 1.00 42.21 H new ATOM 0 HD23 LEU A 43 -11.109 -16.285 -8.213 1.00 42.21 H new ATOM 629 N ILE A 44 -11.246 -21.358 -11.512 1.00 21.31 N ATOM 630 CA ILE A 44 -10.426 -22.148 -12.423 1.00 65.53 C ATOM 631 C ILE A 44 -10.240 -21.433 -13.757 1.00 4.02 C ATOM 632 O ILE A 44 -11.212 -21.098 -14.434 1.00 24.12 O ATOM 633 CB ILE A 44 -11.047 -23.534 -12.679 1.00 53.24 C ATOM 634 CG1 ILE A 44 -11.170 -24.313 -11.368 1.00 74.33 C ATOM 635 CG2 ILE A 44 -10.212 -24.311 -13.686 1.00 30.21 C ATOM 636 CD1 ILE A 44 -12.491 -24.102 -10.661 1.00 1.45 C ATOM 0 H ILE A 44 -12.247 -21.392 -11.707 1.00 21.31 H new ATOM 0 HA ILE A 44 -9.455 -22.275 -11.944 1.00 65.53 H new ATOM 0 HB ILE A 44 -12.046 -23.397 -13.093 1.00 53.24 H new ATOM 0 HG12 ILE A 44 -11.043 -25.376 -11.573 1.00 74.33 H new ATOM 0 HG13 ILE A 44 -10.359 -24.018 -10.702 1.00 74.33 H new ATOM 0 HG21 ILE A 44 -10.664 -25.288 -13.856 1.00 30.21 H new ATOM 0 HG22 ILE A 44 -10.171 -23.761 -14.626 1.00 30.21 H new ATOM 0 HG23 ILE A 44 -9.202 -24.441 -13.298 1.00 30.21 H new ATOM 0 HD11 ILE A 44 -12.508 -24.684 -9.740 1.00 1.45 H new ATOM 0 HD12 ILE A 44 -12.612 -23.045 -10.424 1.00 1.45 H new ATOM 0 HD13 ILE A 44 -13.306 -24.424 -11.309 1.00 1.45 H new ATOM 648 N LEU A 45 -8.986 -21.203 -14.128 1.00 43.35 N ATOM 649 CA LEU A 45 -8.670 -20.528 -15.382 1.00 3.23 C ATOM 650 C LEU A 45 -8.400 -21.540 -16.492 1.00 11.21 C ATOM 651 O LEU A 45 -7.314 -22.115 -16.570 1.00 74.13 O ATOM 652 CB LEU A 45 -7.456 -19.615 -15.202 1.00 44.40 C ATOM 653 CG LEU A 45 -7.748 -18.201 -14.697 1.00 62.25 C ATOM 654 CD1 LEU A 45 -6.509 -17.596 -14.058 1.00 40.02 C ATOM 655 CD2 LEU A 45 -8.249 -17.322 -15.833 1.00 41.32 C ATOM 0 H LEU A 45 -8.171 -21.474 -13.578 1.00 43.35 H new ATOM 0 HA LEU A 45 -9.531 -19.924 -15.668 1.00 3.23 H new ATOM 0 HB2 LEU A 45 -6.767 -20.093 -14.505 1.00 44.40 H new ATOM 0 HB3 LEU A 45 -6.939 -19.538 -16.159 1.00 44.40 H new ATOM 0 HG LEU A 45 -8.529 -18.260 -13.939 1.00 62.25 H new ATOM 0 HD11 LEU A 45 -6.736 -16.590 -13.705 1.00 40.02 H new ATOM 0 HD12 LEU A 45 -6.195 -18.214 -13.217 1.00 40.02 H new ATOM 0 HD13 LEU A 45 -5.706 -17.550 -14.794 1.00 40.02 H new ATOM 0 HD21 LEU A 45 -8.452 -16.320 -15.455 1.00 41.32 H new ATOM 0 HD22 LEU A 45 -7.490 -17.269 -16.614 1.00 41.32 H new ATOM 0 HD23 LEU A 45 -9.165 -17.746 -16.245 1.00 41.32 H new ATOM 667 N VAL A 46 -9.394 -21.750 -17.348 1.00 2.42 N ATOM 668 CA VAL A 46 -9.262 -22.690 -18.456 1.00 64.44 C ATOM 669 C VAL A 46 -8.814 -21.980 -19.728 1.00 14.45 C ATOM 670 O VAL A 46 -9.569 -21.207 -20.319 1.00 14.22 O ATOM 671 CB VAL A 46 -10.589 -23.424 -18.730 1.00 13.24 C ATOM 672 CG1 VAL A 46 -10.445 -24.361 -19.918 1.00 34.10 C ATOM 673 CG2 VAL A 46 -11.042 -24.184 -17.492 1.00 71.13 C ATOM 0 H VAL A 46 -10.299 -21.283 -17.296 1.00 2.42 H new ATOM 0 HA VAL A 46 -8.506 -23.419 -18.165 1.00 64.44 H new ATOM 0 HB VAL A 46 -11.351 -22.683 -18.973 1.00 13.24 H new ATOM 0 HG11 VAL A 46 -11.392 -24.871 -20.096 1.00 34.10 H new ATOM 0 HG12 VAL A 46 -10.169 -23.787 -20.803 1.00 34.10 H new ATOM 0 HG13 VAL A 46 -9.670 -25.098 -19.708 1.00 34.10 H new ATOM 0 HG21 VAL A 46 -11.981 -24.697 -17.703 1.00 71.13 H new ATOM 0 HG22 VAL A 46 -10.283 -24.916 -17.216 1.00 71.13 H new ATOM 0 HG23 VAL A 46 -11.188 -23.485 -16.669 1.00 71.13 H new ATOM 683 N ASP A 47 -7.582 -22.249 -20.146 1.00 71.33 N ATOM 684 CA ASP A 47 -7.033 -21.636 -21.350 1.00 75.44 C ATOM 685 C ASP A 47 -7.190 -22.565 -22.551 1.00 44.42 C ATOM 686 O ASP A 47 -7.335 -23.777 -22.397 1.00 2.15 O ATOM 687 CB ASP A 47 -5.556 -21.292 -21.145 1.00 2.13 C ATOM 688 CG ASP A 47 -4.685 -22.527 -21.033 1.00 51.30 C ATOM 689 OD1 ASP A 47 -4.349 -23.114 -22.083 1.00 35.11 O ATOM 690 OD2 ASP A 47 -4.338 -22.907 -19.894 1.00 25.30 O ATOM 0 H ASP A 47 -6.945 -22.887 -19.669 1.00 71.33 H new ATOM 0 HA ASP A 47 -7.587 -20.718 -21.547 1.00 75.44 H new ATOM 0 HB2 ASP A 47 -5.209 -20.681 -21.978 1.00 2.13 H new ATOM 0 HB3 ASP A 47 -5.448 -20.691 -20.242 1.00 2.13 H new ATOM 695 N PHE A 48 -7.161 -21.986 -23.747 1.00 52.31 N ATOM 696 CA PHE A 48 -7.302 -22.760 -24.975 1.00 61.22 C ATOM 697 C PHE A 48 -6.037 -22.670 -25.823 1.00 3.21 C ATOM 698 O PHE A 48 -5.755 -21.637 -26.429 1.00 44.32 O ATOM 699 CB PHE A 48 -8.506 -22.266 -25.780 1.00 14.53 C ATOM 700 CG PHE A 48 -9.789 -22.960 -25.427 1.00 12.12 C ATOM 701 CD1 PHE A 48 -10.413 -22.717 -24.214 1.00 11.40 C ATOM 702 CD2 PHE A 48 -10.374 -23.855 -26.308 1.00 52.21 C ATOM 703 CE1 PHE A 48 -11.595 -23.355 -23.886 1.00 0.41 C ATOM 704 CE2 PHE A 48 -11.555 -24.496 -25.987 1.00 54.22 C ATOM 705 CZ PHE A 48 -12.166 -24.245 -24.774 1.00 2.15 C ATOM 0 H PHE A 48 -7.041 -20.983 -23.892 1.00 52.31 H new ATOM 0 HA PHE A 48 -7.461 -23.803 -24.701 1.00 61.22 H new ATOM 0 HB2 PHE A 48 -8.626 -21.195 -25.619 1.00 14.53 H new ATOM 0 HB3 PHE A 48 -8.306 -22.408 -26.842 1.00 14.53 H new ATOM 0 HD1 PHE A 48 -9.971 -22.021 -23.516 1.00 11.40 H new ATOM 0 HD2 PHE A 48 -9.901 -24.054 -27.258 1.00 52.21 H new ATOM 0 HE1 PHE A 48 -12.071 -23.158 -22.937 1.00 0.41 H new ATOM 0 HE2 PHE A 48 -12.000 -25.192 -26.683 1.00 54.22 H new ATOM 0 HZ PHE A 48 -13.089 -24.744 -24.520 1.00 2.15 H new ATOM 884 N GLU A 60 4.488 -17.317 -21.730 1.00 12.25 N ATOM 885 CA GLU A 60 3.928 -16.599 -20.592 1.00 32.45 C ATOM 886 C GLU A 60 3.855 -17.500 -19.362 1.00 55.42 C ATOM 887 O GLU A 60 2.786 -17.955 -18.957 1.00 62.12 O ATOM 888 CB GLU A 60 2.533 -16.068 -20.930 1.00 30.34 C ATOM 889 CG GLU A 60 1.605 -17.121 -21.512 1.00 32.33 C ATOM 890 CD GLU A 60 0.146 -16.845 -21.205 1.00 23.13 C ATOM 891 OE1 GLU A 60 -0.151 -15.769 -20.646 1.00 50.14 O ATOM 892 OE2 GLU A 60 -0.700 -17.706 -21.525 1.00 35.42 O ATOM 0 HA GLU A 60 4.585 -15.758 -20.368 1.00 32.45 H new ATOM 0 HB2 GLU A 60 2.081 -15.657 -20.027 1.00 30.34 H new ATOM 0 HB3 GLU A 60 2.628 -15.247 -21.641 1.00 30.34 H new ATOM 0 HG2 GLU A 60 1.743 -17.165 -22.592 1.00 32.33 H new ATOM 0 HG3 GLU A 60 1.877 -18.099 -21.116 1.00 32.33 H new ATOM 899 N PRO A 61 5.021 -17.765 -18.753 1.00 14.41 N ATOM 900 CA PRO A 61 5.117 -18.613 -17.561 1.00 50.20 C ATOM 901 C PRO A 61 4.512 -17.951 -16.329 1.00 41.53 C ATOM 902 O PRO A 61 4.398 -18.573 -15.273 1.00 22.32 O ATOM 903 CB PRO A 61 6.626 -18.801 -17.382 1.00 62.02 C ATOM 904 CG PRO A 61 7.236 -17.608 -18.031 1.00 1.52 C ATOM 905 CD PRO A 61 6.335 -17.255 -19.182 1.00 3.21 C ATOM 0 HA PRO A 61 4.568 -19.547 -17.679 1.00 50.20 H new ATOM 0 HB2 PRO A 61 6.895 -18.859 -16.327 1.00 62.02 H new ATOM 0 HB3 PRO A 61 6.968 -19.724 -17.850 1.00 62.02 H new ATOM 0 HG2 PRO A 61 7.314 -16.779 -17.328 1.00 1.52 H new ATOM 0 HG3 PRO A 61 8.246 -17.827 -18.379 1.00 1.52 H new ATOM 0 HD2 PRO A 61 6.311 -16.180 -19.359 1.00 3.21 H new ATOM 0 HD3 PRO A 61 6.665 -17.723 -20.109 1.00 3.21 H new ATOM 913 N GLN A 62 4.124 -16.687 -16.470 1.00 11.15 N ATOM 914 CA GLN A 62 3.531 -15.942 -15.367 1.00 4.33 C ATOM 915 C GLN A 62 2.322 -16.679 -14.801 1.00 54.12 C ATOM 916 O GLN A 62 2.064 -16.639 -13.597 1.00 64.54 O ATOM 917 CB GLN A 62 3.119 -14.544 -15.831 1.00 70.43 C ATOM 918 CG GLN A 62 4.231 -13.785 -16.537 1.00 42.43 C ATOM 919 CD GLN A 62 4.150 -13.901 -18.047 1.00 2.22 C ATOM 920 OE1 GLN A 62 5.120 -14.279 -18.705 1.00 72.41 O ATOM 921 NE2 GLN A 62 2.989 -13.577 -18.605 1.00 53.33 N ATOM 0 H GLN A 62 4.210 -16.158 -17.338 1.00 11.15 H new ATOM 0 HA GLN A 62 4.279 -15.850 -14.580 1.00 4.33 H new ATOM 0 HB2 GLN A 62 2.266 -14.630 -16.504 1.00 70.43 H new ATOM 0 HB3 GLN A 62 2.788 -13.967 -14.968 1.00 70.43 H new ATOM 0 HG2 GLN A 62 4.184 -12.733 -16.254 1.00 42.43 H new ATOM 0 HG3 GLN A 62 5.196 -14.163 -16.199 1.00 42.43 H new ATOM 0 HE21 GLN A 62 2.211 -13.269 -18.022 1.00 53.33 H new ATOM 0 HE22 GLN A 62 2.875 -13.637 -19.617 1.00 53.33 H new ATOM 930 N LEU A 63 1.582 -17.352 -15.676 1.00 3.30 N ATOM 931 CA LEU A 63 0.399 -18.099 -15.262 1.00 51.52 C ATOM 932 C LEU A 63 0.778 -19.249 -14.335 1.00 11.10 C ATOM 933 O LEU A 63 0.140 -19.461 -13.303 1.00 50.22 O ATOM 934 CB LEU A 63 -0.341 -18.639 -16.488 1.00 63.14 C ATOM 935 CG LEU A 63 0.518 -19.364 -17.525 1.00 4.31 C ATOM 936 CD1 LEU A 63 0.414 -20.870 -17.345 1.00 33.34 C ATOM 937 CD2 LEU A 63 0.105 -18.963 -18.933 1.00 44.21 C ATOM 0 H LEU A 63 1.780 -17.396 -16.676 1.00 3.30 H new ATOM 0 HA LEU A 63 -0.258 -17.420 -14.718 1.00 51.52 H new ATOM 0 HB2 LEU A 63 -1.118 -19.323 -16.146 1.00 63.14 H new ATOM 0 HB3 LEU A 63 -0.844 -17.806 -16.980 1.00 63.14 H new ATOM 0 HG LEU A 63 1.558 -19.072 -17.376 1.00 4.31 H new ATOM 0 HD11 LEU A 63 1.032 -21.369 -18.092 1.00 33.34 H new ATOM 0 HD12 LEU A 63 0.759 -21.142 -16.348 1.00 33.34 H new ATOM 0 HD13 LEU A 63 -0.624 -21.180 -17.467 1.00 33.34 H new ATOM 0 HD21 LEU A 63 0.727 -19.488 -19.658 1.00 44.21 H new ATOM 0 HD22 LEU A 63 -0.941 -19.225 -19.094 1.00 44.21 H new ATOM 0 HD23 LEU A 63 0.233 -17.888 -19.057 1.00 44.21 H new ATOM 949 N GLU A 64 1.818 -19.986 -14.709 1.00 45.21 N ATOM 950 CA GLU A 64 2.281 -21.114 -13.909 1.00 2.31 C ATOM 951 C GLU A 64 2.835 -20.638 -12.569 1.00 45.41 C ATOM 952 O GLU A 64 2.610 -21.266 -11.533 1.00 21.22 O ATOM 953 CB GLU A 64 3.353 -21.899 -14.667 1.00 23.31 C ATOM 954 CG GLU A 64 2.887 -22.419 -16.016 1.00 22.31 C ATOM 955 CD GLU A 64 3.681 -23.624 -16.484 1.00 12.53 C ATOM 956 OE1 GLU A 64 4.798 -23.431 -17.007 1.00 51.52 O ATOM 957 OE2 GLU A 64 3.186 -24.759 -16.325 1.00 32.21 O ATOM 0 H GLU A 64 2.356 -19.823 -15.560 1.00 45.21 H new ATOM 0 HA GLU A 64 1.429 -21.767 -13.719 1.00 2.31 H new ATOM 0 HB2 GLU A 64 4.223 -21.260 -14.815 1.00 23.31 H new ATOM 0 HB3 GLU A 64 3.676 -22.741 -14.055 1.00 23.31 H new ATOM 0 HG2 GLU A 64 1.832 -22.686 -15.953 1.00 22.31 H new ATOM 0 HG3 GLU A 64 2.971 -21.624 -16.756 1.00 22.31 H new ATOM 964 N LYS A 65 3.562 -19.527 -12.596 1.00 53.21 N ATOM 965 CA LYS A 65 4.149 -18.966 -11.385 1.00 34.44 C ATOM 966 C LYS A 65 3.065 -18.443 -10.447 1.00 3.12 C ATOM 967 O LYS A 65 2.976 -18.861 -9.292 1.00 2.53 O ATOM 968 CB LYS A 65 5.119 -17.836 -11.741 1.00 20.12 C ATOM 969 CG LYS A 65 6.288 -18.287 -12.598 1.00 22.54 C ATOM 970 CD LYS A 65 7.485 -17.364 -12.438 1.00 64.11 C ATOM 971 CE LYS A 65 7.337 -16.106 -13.279 1.00 75.14 C ATOM 972 NZ LYS A 65 8.141 -14.976 -12.735 1.00 55.11 N ATOM 0 H LYS A 65 3.759 -18.996 -13.444 1.00 53.21 H new ATOM 0 HA LYS A 65 4.695 -19.759 -10.874 1.00 34.44 H new ATOM 0 HB2 LYS A 65 4.574 -17.053 -12.268 1.00 20.12 H new ATOM 0 HB3 LYS A 65 5.502 -17.394 -10.821 1.00 20.12 H new ATOM 0 HG2 LYS A 65 6.571 -19.303 -12.323 1.00 22.54 H new ATOM 0 HG3 LYS A 65 5.985 -18.313 -13.645 1.00 22.54 H new ATOM 0 HD2 LYS A 65 7.597 -17.090 -11.389 1.00 64.11 H new ATOM 0 HD3 LYS A 65 8.394 -17.892 -12.728 1.00 64.11 H new ATOM 0 HE2 LYS A 65 7.650 -16.314 -14.302 1.00 75.14 H new ATOM 0 HE3 LYS A 65 6.287 -15.818 -13.319 1.00 75.14 H new ATOM 0 HZ1 LYS A 65 8.013 -14.137 -13.337 1.00 55.11 H new ATOM 0 HZ2 LYS A 65 7.826 -14.760 -11.768 1.00 55.11 H new ATOM 0 HZ3 LYS A 65 9.147 -15.241 -12.720 1.00 55.11 H new ATOM 986 N LEU A 66 2.244 -17.530 -10.952 1.00 62.23 N ATOM 987 CA LEU A 66 1.163 -16.951 -10.158 1.00 42.40 C ATOM 988 C LEU A 66 0.177 -18.027 -9.715 1.00 34.31 C ATOM 989 O LEU A 66 -0.444 -17.916 -8.658 1.00 43.55 O ATOM 990 CB LEU A 66 0.433 -15.874 -10.964 1.00 35.22 C ATOM 991 CG LEU A 66 0.975 -14.451 -10.828 1.00 12.31 C ATOM 992 CD1 LEU A 66 0.917 -13.994 -9.379 1.00 3.13 C ATOM 993 CD2 LEU A 66 2.399 -14.371 -11.358 1.00 20.50 C ATOM 0 H LEU A 66 2.305 -17.174 -11.906 1.00 62.23 H new ATOM 0 HA LEU A 66 1.600 -16.497 -9.269 1.00 42.40 H new ATOM 0 HB2 LEU A 66 0.463 -16.154 -12.017 1.00 35.22 H new ATOM 0 HB3 LEU A 66 -0.615 -15.872 -10.665 1.00 35.22 H new ATOM 0 HG LEU A 66 0.349 -13.785 -11.422 1.00 12.31 H new ATOM 0 HD11 LEU A 66 1.307 -12.979 -9.302 1.00 3.13 H new ATOM 0 HD12 LEU A 66 -0.116 -14.013 -9.033 1.00 3.13 H new ATOM 0 HD13 LEU A 66 1.519 -14.662 -8.763 1.00 3.13 H new ATOM 0 HD21 LEU A 66 2.769 -13.351 -11.254 1.00 20.50 H new ATOM 0 HD22 LEU A 66 3.037 -15.049 -10.791 1.00 20.50 H new ATOM 0 HD23 LEU A 66 2.412 -14.656 -12.410 1.00 20.50 H new ATOM 1005 N ALA A 67 0.040 -19.069 -10.528 1.00 62.40 N ATOM 1006 CA ALA A 67 -0.867 -20.167 -10.217 1.00 31.15 C ATOM 1007 C ALA A 67 -0.626 -20.695 -8.807 1.00 1.14 C ATOM 1008 O ALA A 67 -1.570 -20.914 -8.048 1.00 75.05 O ATOM 1009 CB ALA A 67 -0.710 -21.286 -11.235 1.00 20.14 C ATOM 0 H ALA A 67 0.546 -19.176 -11.407 1.00 62.40 H new ATOM 0 HA ALA A 67 -1.888 -19.787 -10.266 1.00 31.15 H new ATOM 0 HB1 ALA A 67 -1.393 -22.099 -10.990 1.00 20.14 H new ATOM 0 HB2 ALA A 67 -0.939 -20.907 -12.231 1.00 20.14 H new ATOM 0 HB3 ALA A 67 0.315 -21.655 -11.215 1.00 20.14 H new ATOM 1015 N GLN A 68 0.642 -20.896 -8.464 1.00 12.15 N ATOM 1016 CA GLN A 68 1.005 -21.401 -7.145 1.00 64.31 C ATOM 1017 C GLN A 68 0.986 -20.280 -6.110 1.00 50.20 C ATOM 1018 O GLN A 68 0.702 -20.512 -4.935 1.00 5.42 O ATOM 1019 CB GLN A 68 2.390 -22.049 -7.187 1.00 4.24 C ATOM 1020 CG GLN A 68 2.426 -23.353 -7.966 1.00 32.35 C ATOM 1021 CD GLN A 68 3.830 -23.911 -8.105 1.00 43.12 C ATOM 1022 OE1 GLN A 68 4.198 -24.873 -7.432 1.00 72.41 O ATOM 1023 NE2 GLN A 68 4.622 -23.307 -8.984 1.00 1.41 N ATOM 0 H GLN A 68 1.435 -20.717 -9.080 1.00 12.15 H new ATOM 0 HA GLN A 68 0.270 -22.152 -6.855 1.00 64.31 H new ATOM 0 HB2 GLN A 68 3.096 -21.349 -7.633 1.00 4.24 H new ATOM 0 HB3 GLN A 68 2.726 -22.235 -6.167 1.00 4.24 H new ATOM 0 HG2 GLN A 68 1.795 -24.088 -7.466 1.00 32.35 H new ATOM 0 HG3 GLN A 68 2.003 -23.191 -8.958 1.00 32.35 H new ATOM 0 HE21 GLN A 68 4.275 -22.512 -9.521 1.00 1.41 H new ATOM 0 HE22 GLN A 68 5.577 -23.638 -9.122 1.00 1.41 H new ATOM 1032 N GLN A 69 1.293 -19.066 -6.555 1.00 75.41 N ATOM 1033 CA GLN A 69 1.312 -17.909 -5.667 1.00 73.40 C ATOM 1034 C GLN A 69 -0.079 -17.631 -5.105 1.00 43.13 C ATOM 1035 O GLN A 69 -0.219 -17.095 -4.004 1.00 45.10 O ATOM 1036 CB GLN A 69 1.831 -16.677 -6.410 1.00 50.41 C ATOM 1037 CG GLN A 69 3.301 -16.767 -6.785 1.00 72.14 C ATOM 1038 CD GLN A 69 3.994 -15.420 -6.758 1.00 5.22 C ATOM 1039 OE1 GLN A 69 3.865 -14.662 -5.796 1.00 1.33 O ATOM 1040 NE2 GLN A 69 4.734 -15.112 -7.816 1.00 61.43 N ATOM 0 H GLN A 69 1.532 -18.858 -7.525 1.00 75.41 H new ATOM 0 HA GLN A 69 1.982 -18.131 -4.836 1.00 73.40 H new ATOM 0 HB2 GLN A 69 1.242 -16.534 -7.316 1.00 50.41 H new ATOM 0 HB3 GLN A 69 1.677 -15.796 -5.787 1.00 50.41 H new ATOM 0 HG2 GLN A 69 3.806 -17.445 -6.097 1.00 72.14 H new ATOM 0 HG3 GLN A 69 3.392 -17.198 -7.782 1.00 72.14 H new ATOM 0 HE21 GLN A 69 4.814 -15.770 -8.592 1.00 61.43 H new ATOM 0 HE22 GLN A 69 5.223 -14.218 -7.853 1.00 61.43 H new ATOM 1049 N TYR A 70 -1.103 -17.999 -5.865 1.00 25.32 N ATOM 1050 CA TYR A 70 -2.483 -17.786 -5.445 1.00 13.24 C ATOM 1051 C TYR A 70 -3.307 -19.058 -5.618 1.00 13.40 C ATOM 1052 O TYR A 70 -4.533 -19.008 -5.734 1.00 60.12 O ATOM 1053 CB TYR A 70 -3.112 -16.644 -6.245 1.00 73.14 C ATOM 1054 CG TYR A 70 -2.402 -15.320 -6.071 1.00 2.41 C ATOM 1055 CD1 TYR A 70 -2.204 -14.775 -4.809 1.00 41.41 C ATOM 1056 CD2 TYR A 70 -1.928 -14.615 -7.171 1.00 54.44 C ATOM 1057 CE1 TYR A 70 -1.557 -13.566 -4.646 1.00 63.31 C ATOM 1058 CE2 TYR A 70 -1.278 -13.406 -7.017 1.00 43.53 C ATOM 1059 CZ TYR A 70 -1.095 -12.886 -5.754 1.00 60.24 C ATOM 1060 OH TYR A 70 -0.449 -11.681 -5.596 1.00 32.23 O ATOM 0 H TYR A 70 -1.004 -18.447 -6.776 1.00 25.32 H new ATOM 0 HA TYR A 70 -2.477 -17.519 -4.388 1.00 13.24 H new ATOM 0 HB2 TYR A 70 -3.113 -16.910 -7.302 1.00 73.14 H new ATOM 0 HB3 TYR A 70 -4.153 -16.531 -5.943 1.00 73.14 H new ATOM 0 HD1 TYR A 70 -2.562 -15.306 -3.940 1.00 41.41 H new ATOM 0 HD2 TYR A 70 -2.070 -15.019 -8.162 1.00 54.44 H new ATOM 0 HE1 TYR A 70 -1.414 -13.155 -3.657 1.00 63.31 H new ATOM 0 HE2 TYR A 70 -0.915 -12.871 -7.882 1.00 43.53 H new ATOM 0 HH TYR A 70 -0.186 -11.333 -6.474 1.00 32.23 H new ATOM 1070 N THR A 71 -2.626 -20.199 -5.634 1.00 53.31 N ATOM 1071 CA THR A 71 -3.293 -21.486 -5.792 1.00 63.45 C ATOM 1072 C THR A 71 -4.380 -21.675 -4.740 1.00 25.02 C ATOM 1073 O THR A 71 -5.311 -22.456 -4.931 1.00 11.42 O ATOM 1074 CB THR A 71 -2.293 -22.653 -5.698 1.00 51.51 C ATOM 1075 OG1 THR A 71 -2.993 -23.902 -5.721 1.00 70.04 O ATOM 1076 CG2 THR A 71 -1.464 -22.554 -4.427 1.00 62.15 C ATOM 0 H THR A 71 -1.612 -20.259 -5.539 1.00 53.31 H new ATOM 0 HA THR A 71 -3.747 -21.487 -6.783 1.00 63.45 H new ATOM 0 HB THR A 71 -1.623 -22.597 -6.556 1.00 51.51 H new ATOM 0 HG1 THR A 71 -2.349 -24.639 -5.662 1.00 70.04 H new ATOM 0 HG21 THR A 71 -0.765 -23.389 -4.383 1.00 62.15 H new ATOM 0 HG22 THR A 71 -0.909 -21.616 -4.427 1.00 62.15 H new ATOM 0 HG23 THR A 71 -2.123 -22.586 -3.559 1.00 62.15 H new ATOM 1084 N GLU A 72 -4.253 -20.957 -3.629 1.00 42.03 N ATOM 1085 CA GLU A 72 -5.224 -21.048 -2.545 1.00 25.13 C ATOM 1086 C GLU A 72 -6.638 -20.796 -3.062 1.00 64.22 C ATOM 1087 O GLU A 72 -7.588 -21.459 -2.646 1.00 31.12 O ATOM 1088 CB GLU A 72 -4.887 -20.043 -1.442 1.00 62.10 C ATOM 1089 CG GLU A 72 -3.579 -20.341 -0.727 1.00 10.13 C ATOM 1090 CD GLU A 72 -3.045 -19.144 0.035 1.00 41.34 C ATOM 1091 OE1 GLU A 72 -2.310 -18.336 -0.569 1.00 54.20 O ATOM 1092 OE2 GLU A 72 -3.363 -19.017 1.237 1.00 3.33 O ATOM 0 H GLU A 72 -3.487 -20.306 -3.456 1.00 42.03 H new ATOM 0 HA GLU A 72 -5.178 -22.056 -2.133 1.00 25.13 H new ATOM 0 HB2 GLU A 72 -4.835 -19.044 -1.875 1.00 62.10 H new ATOM 0 HB3 GLU A 72 -5.696 -20.032 -0.712 1.00 62.10 H new ATOM 0 HG2 GLU A 72 -3.728 -21.170 -0.035 1.00 10.13 H new ATOM 0 HG3 GLU A 72 -2.836 -20.664 -1.456 1.00 10.13 H new ATOM 1099 N ASN A 73 -6.769 -19.835 -3.969 1.00 43.45 N ATOM 1100 CA ASN A 73 -8.067 -19.494 -4.541 1.00 72.45 C ATOM 1101 C ASN A 73 -7.958 -19.283 -6.048 1.00 43.54 C ATOM 1102 O ASN A 73 -8.779 -18.591 -6.649 1.00 5.44 O ATOM 1103 CB ASN A 73 -8.626 -18.235 -3.876 1.00 62.14 C ATOM 1104 CG ASN A 73 -10.141 -18.184 -3.917 1.00 62.35 C ATOM 1105 OD1 ASN A 73 -10.727 -17.343 -4.599 1.00 54.33 O ATOM 1106 ND2 ASN A 73 -10.783 -19.087 -3.184 1.00 12.25 N ATOM 0 H ASN A 73 -5.992 -19.278 -4.325 1.00 43.45 H new ATOM 0 HA ASN A 73 -8.748 -20.325 -4.357 1.00 72.45 H new ATOM 0 HB2 ASN A 73 -8.292 -18.196 -2.839 1.00 62.14 H new ATOM 0 HB3 ASN A 73 -8.222 -17.354 -4.375 1.00 62.14 H new ATOM 0 HD21 ASN A 73 -11.803 -19.102 -3.171 1.00 12.25 H new ATOM 0 HD22 ASN A 73 -10.256 -19.765 -2.634 1.00 12.25 H new ATOM 1113 N VAL A 74 -6.939 -19.885 -6.653 1.00 43.23 N ATOM 1114 CA VAL A 74 -6.723 -19.763 -8.090 1.00 42.34 C ATOM 1115 C VAL A 74 -6.339 -21.105 -8.703 1.00 24.52 C ATOM 1116 O VAL A 74 -5.572 -21.870 -8.119 1.00 11.33 O ATOM 1117 CB VAL A 74 -5.622 -18.733 -8.407 1.00 72.22 C ATOM 1118 CG1 VAL A 74 -5.475 -18.556 -9.910 1.00 21.22 C ATOM 1119 CG2 VAL A 74 -5.927 -17.404 -7.732 1.00 13.41 C ATOM 0 H VAL A 74 -6.250 -20.462 -6.170 1.00 43.23 H new ATOM 0 HA VAL A 74 -7.664 -19.424 -8.524 1.00 42.34 H new ATOM 0 HB VAL A 74 -4.675 -19.105 -8.015 1.00 72.22 H new ATOM 0 HG11 VAL A 74 -4.693 -17.825 -10.116 1.00 21.22 H new ATOM 0 HG12 VAL A 74 -5.208 -19.510 -10.364 1.00 21.22 H new ATOM 0 HG13 VAL A 74 -6.418 -18.206 -10.329 1.00 21.22 H new ATOM 0 HG21 VAL A 74 -5.139 -16.688 -7.966 1.00 13.41 H new ATOM 0 HG22 VAL A 74 -6.883 -17.023 -8.093 1.00 13.41 H new ATOM 0 HG23 VAL A 74 -5.978 -17.547 -6.653 1.00 13.41 H new ATOM 1129 N LYS A 75 -6.879 -21.385 -9.885 1.00 41.33 N ATOM 1130 CA LYS A 75 -6.593 -22.634 -10.580 1.00 54.30 C ATOM 1131 C LYS A 75 -6.361 -22.388 -12.067 1.00 41.22 C ATOM 1132 O LYS A 75 -6.730 -21.340 -12.597 1.00 54.54 O ATOM 1133 CB LYS A 75 -7.745 -23.623 -10.389 1.00 44.23 C ATOM 1134 CG LYS A 75 -7.573 -24.532 -9.183 1.00 44.22 C ATOM 1135 CD LYS A 75 -6.503 -25.583 -9.425 1.00 22.44 C ATOM 1136 CE LYS A 75 -6.209 -26.380 -8.164 1.00 73.13 C ATOM 1137 NZ LYS A 75 -5.506 -27.657 -8.465 1.00 54.32 N ATOM 0 H LYS A 75 -7.517 -20.763 -10.381 1.00 41.33 H new ATOM 0 HA LYS A 75 -5.684 -23.058 -10.154 1.00 54.30 H new ATOM 0 HB2 LYS A 75 -8.677 -23.067 -10.284 1.00 44.23 H new ATOM 0 HB3 LYS A 75 -7.839 -24.236 -11.285 1.00 44.23 H new ATOM 0 HG2 LYS A 75 -7.307 -23.935 -8.311 1.00 44.22 H new ATOM 0 HG3 LYS A 75 -8.520 -25.021 -8.957 1.00 44.22 H new ATOM 0 HD2 LYS A 75 -6.828 -26.259 -10.216 1.00 22.44 H new ATOM 0 HD3 LYS A 75 -5.590 -25.100 -9.773 1.00 22.44 H new ATOM 0 HE2 LYS A 75 -5.598 -25.780 -7.489 1.00 73.13 H new ATOM 0 HE3 LYS A 75 -7.143 -26.594 -7.644 1.00 73.13 H new ATOM 0 HZ1 LYS A 75 -5.324 -28.170 -7.579 1.00 54.32 H new ATOM 0 HZ2 LYS A 75 -6.099 -28.241 -9.088 1.00 54.32 H new ATOM 0 HZ3 LYS A 75 -4.603 -27.453 -8.939 1.00 54.32 H new ATOM 1151 N ILE A 76 -5.750 -23.361 -12.735 1.00 32.00 N ATOM 1152 CA ILE A 76 -5.472 -23.250 -14.162 1.00 74.21 C ATOM 1153 C ILE A 76 -5.474 -24.621 -14.830 1.00 73.53 C ATOM 1154 O ILE A 76 -4.848 -25.562 -14.343 1.00 22.14 O ATOM 1155 CB ILE A 76 -4.116 -22.568 -14.419 1.00 4.33 C ATOM 1156 CG1 ILE A 76 -4.094 -21.174 -13.789 1.00 15.14 C ATOM 1157 CG2 ILE A 76 -3.842 -22.483 -15.914 1.00 3.40 C ATOM 1158 CD1 ILE A 76 -2.802 -20.424 -14.027 1.00 71.25 C ATOM 0 H ILE A 76 -5.438 -24.235 -12.311 1.00 32.00 H new ATOM 0 HA ILE A 76 -6.265 -22.638 -14.592 1.00 74.21 H new ATOM 0 HB ILE A 76 -3.331 -23.167 -13.958 1.00 4.33 H new ATOM 0 HG12 ILE A 76 -4.923 -20.590 -14.189 1.00 15.14 H new ATOM 0 HG13 ILE A 76 -4.259 -21.267 -12.715 1.00 15.14 H new ATOM 0 HG21 ILE A 76 -2.880 -21.999 -16.081 1.00 3.40 H new ATOM 0 HG22 ILE A 76 -3.821 -23.487 -16.338 1.00 3.40 H new ATOM 0 HG23 ILE A 76 -4.629 -21.902 -16.396 1.00 3.40 H new ATOM 0 HD11 ILE A 76 -2.857 -19.444 -13.552 1.00 71.25 H new ATOM 0 HD12 ILE A 76 -1.971 -20.987 -13.602 1.00 71.25 H new ATOM 0 HD13 ILE A 76 -2.646 -20.300 -15.099 1.00 71.25 H new ATOM 1170 N TYR A 77 -6.182 -24.725 -15.950 1.00 44.05 N ATOM 1171 CA TYR A 77 -6.267 -25.981 -16.686 1.00 41.33 C ATOM 1172 C TYR A 77 -6.241 -25.733 -18.191 1.00 64.33 C ATOM 1173 O TYR A 77 -6.522 -24.628 -18.656 1.00 10.43 O ATOM 1174 CB TYR A 77 -7.541 -26.735 -16.304 1.00 72.10 C ATOM 1175 CG TYR A 77 -7.486 -27.357 -14.928 1.00 12.23 C ATOM 1176 CD1 TYR A 77 -6.354 -28.034 -14.493 1.00 21.01 C ATOM 1177 CD2 TYR A 77 -8.569 -27.268 -14.061 1.00 20.02 C ATOM 1178 CE1 TYR A 77 -6.300 -28.605 -13.236 1.00 1.23 C ATOM 1179 CE2 TYR A 77 -8.524 -27.835 -12.801 1.00 23.03 C ATOM 1180 CZ TYR A 77 -7.387 -28.503 -12.394 1.00 14.33 C ATOM 1181 OH TYR A 77 -7.338 -29.068 -11.141 1.00 41.31 O ATOM 0 H TYR A 77 -6.705 -23.955 -16.367 1.00 44.05 H new ATOM 0 HA TYR A 77 -5.401 -26.587 -16.421 1.00 41.33 H new ATOM 0 HB2 TYR A 77 -8.387 -26.049 -16.350 1.00 72.10 H new ATOM 0 HB3 TYR A 77 -7.725 -27.517 -17.040 1.00 72.10 H new ATOM 0 HD1 TYR A 77 -5.500 -28.116 -15.149 1.00 21.01 H new ATOM 0 HD2 TYR A 77 -9.461 -26.747 -14.377 1.00 20.02 H new ATOM 0 HE1 TYR A 77 -5.411 -29.128 -12.915 1.00 1.23 H new ATOM 0 HE2 TYR A 77 -9.374 -27.756 -12.139 1.00 23.03 H new ATOM 0 HH TYR A 77 -8.185 -28.905 -10.675 1.00 41.31 H new ATOM 1191 N LYS A 78 -5.902 -26.770 -18.950 1.00 23.53 N ATOM 1192 CA LYS A 78 -5.840 -26.669 -20.403 1.00 3.52 C ATOM 1193 C LYS A 78 -6.669 -27.766 -21.060 1.00 53.52 C ATOM 1194 O LYS A 78 -7.413 -28.482 -20.388 1.00 32.22 O ATOM 1195 CB LYS A 78 -4.388 -26.755 -20.879 1.00 32.21 C ATOM 1196 CG LYS A 78 -3.472 -25.732 -20.231 1.00 32.34 C ATOM 1197 CD LYS A 78 -2.042 -26.241 -20.139 1.00 31.11 C ATOM 1198 CE LYS A 78 -1.052 -25.095 -20.008 1.00 21.42 C ATOM 1199 NZ LYS A 78 0.272 -25.436 -20.600 1.00 41.41 N ATOM 0 H LYS A 78 -5.666 -27.691 -18.582 1.00 23.53 H new ATOM 0 HA LYS A 78 -6.254 -25.703 -20.694 1.00 3.52 H new ATOM 0 HB2 LYS A 78 -4.006 -27.755 -20.672 1.00 32.21 H new ATOM 0 HB3 LYS A 78 -4.361 -26.621 -21.960 1.00 32.21 H new ATOM 0 HG2 LYS A 78 -3.493 -24.807 -20.807 1.00 32.34 H new ATOM 0 HG3 LYS A 78 -3.839 -25.494 -19.233 1.00 32.34 H new ATOM 0 HD2 LYS A 78 -1.946 -26.907 -19.281 1.00 31.11 H new ATOM 0 HD3 LYS A 78 -1.806 -26.828 -21.026 1.00 31.11 H new ATOM 0 HE2 LYS A 78 -1.453 -24.210 -20.501 1.00 21.42 H new ATOM 0 HE3 LYS A 78 -0.925 -24.843 -18.955 1.00 21.42 H new ATOM 0 HZ1 LYS A 78 0.919 -24.629 -20.491 1.00 41.41 H new ATOM 0 HZ2 LYS A 78 0.667 -26.265 -20.112 1.00 41.41 H new ATOM 0 HZ3 LYS A 78 0.155 -25.652 -21.611 1.00 41.41 H new ATOM 1490 N THR A 98 -7.485 -17.794 -25.450 1.00 45.20 N ATOM 1491 CA THR A 98 -8.339 -17.123 -24.480 1.00 23.33 C ATOM 1492 C THR A 98 -8.579 -18.003 -23.257 1.00 42.13 C ATOM 1493 O THR A 98 -8.730 -19.219 -23.377 1.00 12.55 O ATOM 1494 CB THR A 98 -9.697 -16.739 -25.096 1.00 62.14 C ATOM 1495 OG1 THR A 98 -9.498 -15.878 -26.222 1.00 63.21 O ATOM 1496 CG2 THR A 98 -10.581 -16.046 -24.071 1.00 55.04 C ATOM 0 HA THR A 98 -7.818 -16.215 -24.175 1.00 23.33 H new ATOM 0 HB THR A 98 -10.194 -17.653 -25.421 1.00 62.14 H new ATOM 0 HG1 THR A 98 -8.631 -16.074 -26.634 1.00 63.21 H new ATOM 0 HG21 THR A 98 -11.534 -15.785 -24.530 1.00 55.04 H new ATOM 0 HG22 THR A 98 -10.755 -16.716 -23.229 1.00 55.04 H new ATOM 0 HG23 THR A 98 -10.088 -15.140 -23.718 1.00 55.04 H new ATOM 1504 N ILE A 99 -8.614 -17.381 -22.084 1.00 62.15 N ATOM 1505 CA ILE A 99 -8.837 -18.108 -20.841 1.00 43.54 C ATOM 1506 C ILE A 99 -10.130 -17.659 -20.167 1.00 65.44 C ATOM 1507 O ILE A 99 -10.494 -16.483 -20.219 1.00 5.15 O ATOM 1508 CB ILE A 99 -7.666 -17.919 -19.860 1.00 53.20 C ATOM 1509 CG1 ILE A 99 -6.339 -18.255 -20.543 1.00 62.33 C ATOM 1510 CG2 ILE A 99 -7.865 -18.783 -18.623 1.00 14.24 C ATOM 1511 CD1 ILE A 99 -5.591 -17.039 -21.041 1.00 74.33 C ATOM 0 H ILE A 99 -8.491 -16.375 -21.968 1.00 62.15 H new ATOM 0 HA ILE A 99 -8.913 -19.164 -21.102 1.00 43.54 H new ATOM 0 HB ILE A 99 -7.638 -16.875 -19.549 1.00 53.20 H new ATOM 0 HG12 ILE A 99 -5.706 -18.799 -19.842 1.00 62.33 H new ATOM 0 HG13 ILE A 99 -6.531 -18.923 -21.383 1.00 62.33 H new ATOM 0 HG21 ILE A 99 -7.029 -18.638 -17.939 1.00 14.24 H new ATOM 0 HG22 ILE A 99 -8.793 -18.499 -18.126 1.00 14.24 H new ATOM 0 HG23 ILE A 99 -7.916 -19.832 -18.916 1.00 14.24 H new ATOM 0 HD11 ILE A 99 -4.660 -17.353 -21.514 1.00 74.33 H new ATOM 0 HD12 ILE A 99 -6.205 -16.506 -21.767 1.00 74.33 H new ATOM 0 HD13 ILE A 99 -5.368 -16.380 -20.202 1.00 74.33 H new ATOM 1523 N LEU A 100 -10.816 -18.601 -19.531 1.00 14.13 N ATOM 1524 CA LEU A 100 -12.068 -18.302 -18.841 1.00 74.13 C ATOM 1525 C LEU A 100 -11.993 -18.713 -17.374 1.00 51.03 C ATOM 1526 O LEU A 100 -11.352 -19.705 -17.029 1.00 42.25 O ATOM 1527 CB LEU A 100 -13.233 -19.021 -19.526 1.00 11.41 C ATOM 1528 CG LEU A 100 -13.583 -18.539 -20.934 1.00 23.02 C ATOM 1529 CD1 LEU A 100 -14.231 -19.659 -21.734 1.00 75.25 C ATOM 1530 CD2 LEU A 100 -14.501 -17.328 -20.871 1.00 10.22 C ATOM 0 H LEU A 100 -10.528 -19.578 -19.478 1.00 14.13 H new ATOM 0 HA LEU A 100 -12.234 -17.226 -18.889 1.00 74.13 H new ATOM 0 HB2 LEU A 100 -12.999 -20.085 -19.575 1.00 11.41 H new ATOM 0 HB3 LEU A 100 -14.118 -18.918 -18.898 1.00 11.41 H new ATOM 0 HG LEU A 100 -12.661 -18.245 -21.436 1.00 23.02 H new ATOM 0 HD11 LEU A 100 -14.474 -19.299 -22.734 1.00 75.25 H new ATOM 0 HD12 LEU A 100 -13.541 -20.499 -21.809 1.00 75.25 H new ATOM 0 HD13 LEU A 100 -15.144 -19.983 -21.234 1.00 75.25 H new ATOM 0 HD21 LEU A 100 -14.739 -16.999 -21.882 1.00 10.22 H new ATOM 0 HD22 LEU A 100 -15.421 -17.595 -20.350 1.00 10.22 H new ATOM 0 HD23 LEU A 100 -14.002 -16.521 -20.335 1.00 10.22 H new ATOM 1542 N MET A 101 -12.655 -17.944 -16.516 1.00 44.04 N ATOM 1543 CA MET A 101 -12.666 -18.231 -15.086 1.00 51.33 C ATOM 1544 C MET A 101 -14.006 -18.823 -14.661 1.00 12.11 C ATOM 1545 O MET A 101 -15.011 -18.117 -14.580 1.00 52.43 O ATOM 1546 CB MET A 101 -12.383 -16.956 -14.288 1.00 34.22 C ATOM 1547 CG MET A 101 -10.915 -16.567 -14.265 1.00 12.34 C ATOM 1548 SD MET A 101 -10.493 -15.526 -12.855 1.00 53.14 S ATOM 1549 CE MET A 101 -8.938 -14.825 -13.404 1.00 41.24 C ATOM 0 H MET A 101 -13.190 -17.118 -16.785 1.00 44.04 H new ATOM 0 HA MET A 101 -11.884 -18.962 -14.880 1.00 51.33 H new ATOM 0 HB2 MET A 101 -12.961 -16.135 -14.713 1.00 34.22 H new ATOM 0 HB3 MET A 101 -12.730 -17.094 -13.264 1.00 34.22 H new ATOM 0 HG2 MET A 101 -10.305 -17.470 -14.241 1.00 12.34 H new ATOM 0 HG3 MET A 101 -10.668 -16.040 -15.187 1.00 12.34 H new ATOM 0 HE1 MET A 101 -8.753 -13.891 -12.874 1.00 41.24 H new ATOM 0 HE2 MET A 101 -8.130 -15.526 -13.197 1.00 41.24 H new ATOM 0 HE3 MET A 101 -8.985 -14.631 -14.476 1.00 41.24 H new ATOM 1559 N PHE A 102 -14.013 -20.125 -14.392 1.00 41.14 N ATOM 1560 CA PHE A 102 -15.229 -20.813 -13.977 1.00 22.24 C ATOM 1561 C PHE A 102 -15.167 -21.185 -12.499 1.00 24.11 C ATOM 1562 O PHE A 102 -14.120 -21.592 -11.992 1.00 24.33 O ATOM 1563 CB PHE A 102 -15.443 -22.071 -14.822 1.00 14.11 C ATOM 1564 CG PHE A 102 -15.807 -21.779 -16.250 1.00 43.34 C ATOM 1565 CD1 PHE A 102 -17.065 -21.295 -16.573 1.00 33.42 C ATOM 1566 CD2 PHE A 102 -14.891 -21.987 -17.269 1.00 24.13 C ATOM 1567 CE1 PHE A 102 -17.402 -21.027 -17.886 1.00 43.32 C ATOM 1568 CE2 PHE A 102 -15.223 -21.720 -18.583 1.00 54.11 C ATOM 1569 CZ PHE A 102 -16.479 -21.238 -18.893 1.00 21.31 C ATOM 0 H PHE A 102 -13.190 -20.724 -14.454 1.00 41.14 H new ATOM 0 HA PHE A 102 -16.069 -20.135 -14.128 1.00 22.24 H new ATOM 0 HB2 PHE A 102 -14.533 -22.671 -14.803 1.00 14.11 H new ATOM 0 HB3 PHE A 102 -16.232 -22.673 -14.370 1.00 14.11 H new ATOM 0 HD1 PHE A 102 -17.789 -21.126 -15.790 1.00 33.42 H new ATOM 0 HD2 PHE A 102 -13.906 -22.362 -17.033 1.00 24.13 H new ATOM 0 HE1 PHE A 102 -18.386 -20.653 -18.125 1.00 43.32 H new ATOM 0 HE2 PHE A 102 -14.500 -21.888 -19.368 1.00 54.11 H new ATOM 0 HZ PHE A 102 -16.740 -21.026 -19.919 1.00 21.31 H new ATOM 1579 N LYS A 103 -16.294 -21.042 -11.810 1.00 0.52 N ATOM 1580 CA LYS A 103 -16.369 -21.363 -10.390 1.00 14.34 C ATOM 1581 C LYS A 103 -17.779 -21.804 -10.006 1.00 42.13 C ATOM 1582 O LYS A 103 -18.744 -21.065 -10.196 1.00 4.33 O ATOM 1583 CB LYS A 103 -15.956 -20.153 -9.550 1.00 55.11 C ATOM 1584 CG LYS A 103 -16.209 -20.329 -8.062 1.00 53.23 C ATOM 1585 CD LYS A 103 -15.734 -19.124 -7.269 1.00 73.44 C ATOM 1586 CE LYS A 103 -16.893 -18.215 -6.888 1.00 31.03 C ATOM 1587 NZ LYS A 103 -16.428 -16.990 -6.180 1.00 61.33 N ATOM 0 H LYS A 103 -17.169 -20.706 -12.213 1.00 0.52 H new ATOM 0 HA LYS A 103 -15.682 -22.186 -10.192 1.00 14.34 H new ATOM 0 HB2 LYS A 103 -14.896 -19.956 -9.709 1.00 55.11 H new ATOM 0 HB3 LYS A 103 -16.499 -19.275 -9.901 1.00 55.11 H new ATOM 0 HG2 LYS A 103 -17.274 -20.483 -7.889 1.00 53.23 H new ATOM 0 HG3 LYS A 103 -15.696 -21.223 -7.708 1.00 53.23 H new ATOM 0 HD2 LYS A 103 -15.222 -19.460 -6.367 1.00 73.44 H new ATOM 0 HD3 LYS A 103 -15.008 -18.563 -7.858 1.00 73.44 H new ATOM 0 HE2 LYS A 103 -17.441 -17.929 -7.786 1.00 31.03 H new ATOM 0 HE3 LYS A 103 -17.588 -18.761 -6.250 1.00 31.03 H new ATOM 0 HZ1 LYS A 103 -17.247 -16.397 -5.938 1.00 61.33 H new ATOM 0 HZ2 LYS A 103 -15.927 -17.261 -5.310 1.00 61.33 H new ATOM 0 HZ3 LYS A 103 -15.784 -16.455 -6.798 1.00 61.33 H new ATOM 1601 N ASN A 104 -17.889 -23.012 -9.463 1.00 42.33 N ATOM 1602 CA ASN A 104 -19.180 -23.549 -9.051 1.00 62.34 C ATOM 1603 C ASN A 104 -20.189 -23.476 -10.193 1.00 50.33 C ATOM 1604 O ASN A 104 -21.392 -23.353 -9.965 1.00 40.20 O ATOM 1605 CB ASN A 104 -19.711 -22.785 -7.837 1.00 11.23 C ATOM 1606 CG ASN A 104 -20.921 -23.455 -7.215 1.00 4.44 C ATOM 1607 OD1 ASN A 104 -22.056 -23.026 -7.421 1.00 62.54 O ATOM 1608 ND2 ASN A 104 -20.682 -24.513 -6.449 1.00 61.13 N ATOM 0 H ASN A 104 -17.100 -23.637 -9.298 1.00 42.33 H new ATOM 0 HA ASN A 104 -19.040 -24.595 -8.780 1.00 62.34 H new ATOM 0 HB2 ASN A 104 -18.922 -22.702 -7.090 1.00 11.23 H new ATOM 0 HB3 ASN A 104 -19.975 -21.771 -8.137 1.00 11.23 H new ATOM 0 HD21 ASN A 104 -21.456 -25.005 -6.003 1.00 61.13 H new ATOM 0 HD22 ASN A 104 -19.724 -24.833 -6.306 1.00 61.13 H new ATOM 1615 N GLY A 105 -19.690 -23.556 -11.423 1.00 52.35 N ATOM 1616 CA GLY A 105 -20.561 -23.497 -12.582 1.00 3.40 C ATOM 1617 C GLY A 105 -21.013 -22.085 -12.897 1.00 72.24 C ATOM 1618 O GLY A 105 -22.088 -21.880 -13.462 1.00 44.34 O ATOM 0 H GLY A 105 -18.698 -23.661 -11.637 1.00 52.35 H new ATOM 0 HA2 GLY A 105 -20.039 -23.909 -13.446 1.00 3.40 H new ATOM 0 HA3 GLY A 105 -21.435 -24.125 -12.408 1.00 3.40 H new ATOM 1622 N LYS A 106 -20.193 -21.107 -12.528 1.00 63.04 N ATOM 1623 CA LYS A 106 -20.514 -19.706 -12.774 1.00 23.53 C ATOM 1624 C LYS A 106 -19.342 -18.987 -13.436 1.00 52.51 C ATOM 1625 O LYS A 106 -18.216 -19.486 -13.440 1.00 15.21 O ATOM 1626 CB LYS A 106 -20.878 -19.008 -11.462 1.00 4.42 C ATOM 1627 CG LYS A 106 -22.364 -19.035 -11.151 1.00 13.01 C ATOM 1628 CD LYS A 106 -22.796 -17.802 -10.375 1.00 34.42 C ATOM 1629 CE LYS A 106 -24.283 -17.530 -10.542 1.00 12.25 C ATOM 1630 NZ LYS A 106 -24.793 -16.584 -9.511 1.00 53.44 N ATOM 0 H LYS A 106 -19.301 -21.259 -12.057 1.00 63.04 H new ATOM 0 HA LYS A 106 -21.369 -19.668 -13.449 1.00 23.53 H new ATOM 0 HB2 LYS A 106 -20.336 -19.483 -10.645 1.00 4.42 H new ATOM 0 HB3 LYS A 106 -20.543 -17.972 -11.507 1.00 4.42 H new ATOM 0 HG2 LYS A 106 -22.930 -19.097 -12.081 1.00 13.01 H new ATOM 0 HG3 LYS A 106 -22.599 -19.929 -10.574 1.00 13.01 H new ATOM 0 HD2 LYS A 106 -22.566 -17.937 -9.318 1.00 34.42 H new ATOM 0 HD3 LYS A 106 -22.226 -16.938 -10.717 1.00 34.42 H new ATOM 0 HE2 LYS A 106 -24.468 -17.120 -11.535 1.00 12.25 H new ATOM 0 HE3 LYS A 106 -24.833 -18.469 -10.478 1.00 12.25 H new ATOM 0 HZ1 LYS A 106 -25.810 -16.424 -9.659 1.00 53.44 H new ATOM 0 HZ2 LYS A 106 -24.640 -16.987 -8.564 1.00 53.44 H new ATOM 0 HZ3 LYS A 106 -24.286 -15.679 -9.589 1.00 53.44 H new ATOM 1644 N LYS A 107 -19.613 -17.812 -13.993 1.00 5.15 N ATOM 1645 CA LYS A 107 -18.581 -17.022 -14.654 1.00 22.41 C ATOM 1646 C LYS A 107 -18.047 -15.936 -13.727 1.00 2.12 C ATOM 1647 O LYS A 107 -18.816 -15.199 -13.109 1.00 70.34 O ATOM 1648 CB LYS A 107 -19.137 -16.387 -15.932 1.00 42.32 C ATOM 1649 CG LYS A 107 -20.411 -15.590 -15.710 1.00 53.43 C ATOM 1650 CD LYS A 107 -21.623 -16.304 -16.285 1.00 74.10 C ATOM 1651 CE LYS A 107 -22.621 -15.319 -16.875 1.00 71.11 C ATOM 1652 NZ LYS A 107 -23.042 -14.293 -15.881 1.00 25.43 N ATOM 0 H LYS A 107 -20.539 -17.385 -14.000 1.00 5.15 H new ATOM 0 HA LYS A 107 -17.759 -17.690 -14.913 1.00 22.41 H new ATOM 0 HB2 LYS A 107 -18.379 -15.732 -16.362 1.00 42.32 H new ATOM 0 HB3 LYS A 107 -19.332 -17.172 -16.663 1.00 42.32 H new ATOM 0 HG2 LYS A 107 -20.557 -15.426 -14.642 1.00 53.43 H new ATOM 0 HG3 LYS A 107 -20.312 -14.608 -16.173 1.00 53.43 H new ATOM 0 HD2 LYS A 107 -21.302 -17.005 -17.056 1.00 74.10 H new ATOM 0 HD3 LYS A 107 -22.107 -16.890 -15.503 1.00 74.10 H new ATOM 0 HE2 LYS A 107 -22.177 -14.826 -17.740 1.00 71.11 H new ATOM 0 HE3 LYS A 107 -23.497 -15.860 -17.232 1.00 71.11 H new ATOM 0 HZ1 LYS A 107 -23.830 -13.737 -16.269 1.00 25.43 H new ATOM 0 HZ2 LYS A 107 -23.348 -14.763 -15.005 1.00 25.43 H new ATOM 0 HZ3 LYS A 107 -22.242 -13.662 -15.674 1.00 25.43 H new ATOM 1666 N LEU A 108 -16.725 -15.842 -13.632 1.00 62.00 N ATOM 1667 CA LEU A 108 -16.087 -14.845 -12.780 1.00 31.31 C ATOM 1668 C LEU A 108 -15.357 -13.800 -13.617 1.00 60.45 C ATOM 1669 O LEU A 108 -15.440 -12.603 -13.344 1.00 22.20 O ATOM 1670 CB LEU A 108 -15.108 -15.519 -11.817 1.00 53.53 C ATOM 1671 CG LEU A 108 -15.570 -16.843 -11.209 1.00 64.34 C ATOM 1672 CD1 LEU A 108 -14.393 -17.790 -11.033 1.00 21.01 C ATOM 1673 CD2 LEU A 108 -16.267 -16.605 -9.877 1.00 44.43 C ATOM 0 H LEU A 108 -16.074 -16.445 -14.135 1.00 62.00 H new ATOM 0 HA LEU A 108 -16.865 -14.344 -12.205 1.00 31.31 H new ATOM 0 HB2 LEU A 108 -14.171 -15.692 -12.346 1.00 53.53 H new ATOM 0 HB3 LEU A 108 -14.892 -14.825 -11.005 1.00 53.53 H new ATOM 0 HG LEU A 108 -16.283 -17.304 -11.893 1.00 64.34 H new ATOM 0 HD11 LEU A 108 -14.742 -18.727 -10.599 1.00 21.01 H new ATOM 0 HD12 LEU A 108 -13.936 -17.987 -12.003 1.00 21.01 H new ATOM 0 HD13 LEU A 108 -13.656 -17.335 -10.371 1.00 21.01 H new ATOM 0 HD21 LEU A 108 -16.589 -17.559 -9.459 1.00 44.43 H new ATOM 0 HD22 LEU A 108 -15.576 -16.121 -9.186 1.00 44.43 H new ATOM 0 HD23 LEU A 108 -17.136 -15.964 -10.030 1.00 44.43 H new ATOM 1685 N SER A 109 -14.643 -14.261 -14.639 1.00 64.12 N ATOM 1686 CA SER A 109 -13.897 -13.367 -15.516 1.00 55.15 C ATOM 1687 C SER A 109 -13.364 -14.118 -16.733 1.00 41.05 C ATOM 1688 O SER A 109 -13.455 -15.343 -16.806 1.00 33.13 O ATOM 1689 CB SER A 109 -12.739 -12.721 -14.754 1.00 52.45 C ATOM 1690 OG SER A 109 -13.139 -11.500 -14.157 1.00 54.05 O ATOM 0 H SER A 109 -14.566 -15.249 -14.880 1.00 64.12 H new ATOM 0 HA SER A 109 -14.576 -12.587 -15.861 1.00 55.15 H new ATOM 0 HB2 SER A 109 -12.379 -13.405 -13.985 1.00 52.45 H new ATOM 0 HB3 SER A 109 -11.907 -12.541 -15.435 1.00 52.45 H new ATOM 0 HG SER A 109 -14.065 -11.576 -13.845 1.00 54.05 H new ATOM 1696 N GLN A 110 -12.809 -13.374 -17.684 1.00 73.42 N ATOM 1697 CA GLN A 110 -12.262 -13.968 -18.897 1.00 42.33 C ATOM 1698 C GLN A 110 -11.000 -13.236 -19.341 1.00 70.12 C ATOM 1699 O GLN A 110 -11.051 -12.070 -19.732 1.00 44.53 O ATOM 1700 CB GLN A 110 -13.303 -13.942 -20.018 1.00 72.44 C ATOM 1701 CG GLN A 110 -13.851 -12.553 -20.305 1.00 35.44 C ATOM 1702 CD GLN A 110 -13.467 -12.047 -21.682 1.00 64.20 C ATOM 1703 OE1 GLN A 110 -12.490 -11.313 -21.835 1.00 14.10 O ATOM 1704 NE2 GLN A 110 -14.235 -12.438 -22.692 1.00 21.42 N ATOM 0 H GLN A 110 -12.726 -12.358 -17.637 1.00 73.42 H new ATOM 0 HA GLN A 110 -12.001 -15.003 -18.678 1.00 42.33 H new ATOM 0 HB2 GLN A 110 -12.856 -14.343 -20.928 1.00 72.44 H new ATOM 0 HB3 GLN A 110 -14.129 -14.602 -19.752 1.00 72.44 H new ATOM 0 HG2 GLN A 110 -14.937 -12.570 -20.218 1.00 35.44 H new ATOM 0 HG3 GLN A 110 -13.482 -11.858 -19.551 1.00 35.44 H new ATOM 0 HE21 GLN A 110 -15.035 -13.047 -22.519 1.00 21.42 H new ATOM 0 HE22 GLN A 110 -14.025 -12.130 -23.641 1.00 21.42 H new ATOM 1713 N VAL A 111 -9.867 -13.929 -19.279 1.00 61.10 N ATOM 1714 CA VAL A 111 -8.592 -13.345 -19.675 1.00 4.43 C ATOM 1715 C VAL A 111 -8.313 -13.586 -21.155 1.00 3.33 C ATOM 1716 O VAL A 111 -8.619 -14.653 -21.689 1.00 41.10 O ATOM 1717 CB VAL A 111 -7.429 -13.920 -18.845 1.00 34.54 C ATOM 1718 CG1 VAL A 111 -6.115 -13.262 -19.238 1.00 53.12 C ATOM 1719 CG2 VAL A 111 -7.699 -13.746 -17.359 1.00 22.25 C ATOM 0 H VAL A 111 -9.807 -14.895 -18.958 1.00 61.10 H new ATOM 0 HA VAL A 111 -8.665 -12.273 -19.491 1.00 4.43 H new ATOM 0 HB VAL A 111 -7.349 -14.987 -19.054 1.00 34.54 H new ATOM 0 HG11 VAL A 111 -5.305 -13.681 -18.641 1.00 53.12 H new ATOM 0 HG12 VAL A 111 -5.919 -13.444 -20.295 1.00 53.12 H new ATOM 0 HG13 VAL A 111 -6.178 -12.188 -19.061 1.00 53.12 H new ATOM 0 HG21 VAL A 111 -6.867 -14.158 -16.787 1.00 22.25 H new ATOM 0 HG22 VAL A 111 -7.807 -12.686 -17.130 1.00 22.25 H new ATOM 0 HG23 VAL A 111 -8.617 -14.270 -17.092 1.00 22.25 H new ATOM 1729 N ILE A 112 -7.731 -12.588 -21.812 1.00 40.51 N ATOM 1730 CA ILE A 112 -7.410 -12.692 -23.229 1.00 13.53 C ATOM 1731 C ILE A 112 -6.025 -12.124 -23.523 1.00 35.44 C ATOM 1732 O ILE A 112 -5.818 -10.913 -23.477 1.00 64.54 O ATOM 1733 CB ILE A 112 -8.448 -11.958 -24.097 1.00 10.42 C ATOM 1734 CG1 ILE A 112 -9.861 -12.440 -23.760 1.00 64.13 C ATOM 1735 CG2 ILE A 112 -8.150 -12.171 -25.574 1.00 61.22 C ATOM 1736 CD1 ILE A 112 -10.944 -11.732 -24.541 1.00 11.41 C ATOM 0 H ILE A 112 -7.472 -11.699 -21.385 1.00 40.51 H new ATOM 0 HA ILE A 112 -7.425 -13.753 -23.478 1.00 13.53 H new ATOM 0 HB ILE A 112 -8.387 -10.891 -23.883 1.00 10.42 H new ATOM 0 HG12 ILE A 112 -9.926 -13.511 -23.953 1.00 64.13 H new ATOM 0 HG13 ILE A 112 -10.040 -12.297 -22.694 1.00 64.13 H new ATOM 0 HG21 ILE A 112 -8.893 -11.646 -26.174 1.00 61.22 H new ATOM 0 HG22 ILE A 112 -7.157 -11.784 -25.804 1.00 61.22 H new ATOM 0 HG23 ILE A 112 -8.186 -13.236 -25.803 1.00 61.22 H new ATOM 0 HD11 ILE A 112 -11.918 -12.125 -24.250 1.00 11.41 H new ATOM 0 HD12 ILE A 112 -10.906 -10.663 -24.329 1.00 11.41 H new ATOM 0 HD13 ILE A 112 -10.790 -11.896 -25.607 1.00 11.41 H new ATOM 1748 N GLY A 113 -5.081 -13.009 -23.826 1.00 53.21 N ATOM 1749 CA GLY A 113 -3.727 -12.577 -24.125 1.00 14.23 C ATOM 1750 C GLY A 113 -2.724 -13.061 -23.097 1.00 44.34 C ATOM 1751 O GLY A 113 -2.940 -14.079 -22.440 1.00 21.13 O ATOM 0 H GLY A 113 -5.229 -14.017 -23.870 1.00 53.21 H new ATOM 0 HA2 GLY A 113 -3.440 -12.946 -25.110 1.00 14.23 H new ATOM 0 HA3 GLY A 113 -3.698 -11.488 -24.172 1.00 14.23 H new ATOM 1755 N ALA A 114 -1.622 -12.331 -22.959 1.00 2.12 N ATOM 1756 CA ALA A 114 -0.581 -12.693 -22.005 1.00 50.23 C ATOM 1757 C ALA A 114 -0.115 -11.474 -21.215 1.00 73.31 C ATOM 1758 O ALA A 114 1.047 -11.076 -21.299 1.00 1.34 O ATOM 1759 CB ALA A 114 0.593 -13.339 -22.723 1.00 34.24 C ATOM 0 H ALA A 114 -1.427 -11.486 -23.496 1.00 2.12 H new ATOM 0 HA ALA A 114 -1.001 -13.412 -21.302 1.00 50.23 H new ATOM 0 HB1 ALA A 114 1.362 -13.604 -21.997 1.00 34.24 H new ATOM 0 HB2 ALA A 114 0.255 -14.238 -23.238 1.00 34.24 H new ATOM 0 HB3 ALA A 114 1.005 -12.639 -23.450 1.00 34.24 H new ATOM 1765 N ASP A 115 -1.027 -10.888 -20.448 1.00 11.22 N ATOM 1766 CA ASP A 115 -0.708 -9.714 -19.642 1.00 33.14 C ATOM 1767 C ASP A 115 -0.756 -10.048 -18.155 1.00 50.50 C ATOM 1768 O ASP A 115 -1.831 -10.252 -17.588 1.00 41.34 O ATOM 1769 CB ASP A 115 -1.679 -8.576 -19.954 1.00 73.33 C ATOM 1770 CG ASP A 115 -1.297 -7.815 -21.208 1.00 45.55 C ATOM 1771 OD1 ASP A 115 -1.669 -8.265 -22.313 1.00 15.43 O ATOM 1772 OD2 ASP A 115 -0.627 -6.769 -21.086 1.00 51.32 O ATOM 0 H ASP A 115 -1.993 -11.206 -20.367 1.00 11.22 H new ATOM 0 HA ASP A 115 0.304 -9.395 -19.892 1.00 33.14 H new ATOM 0 HB2 ASP A 115 -2.684 -8.982 -20.071 1.00 73.33 H new ATOM 0 HB3 ASP A 115 -1.710 -7.887 -19.110 1.00 73.33 H new ATOM 1777 N ILE A 116 0.413 -10.102 -17.527 1.00 43.41 N ATOM 1778 CA ILE A 116 0.504 -10.410 -16.105 1.00 44.52 C ATOM 1779 C ILE A 116 -0.285 -9.405 -15.273 1.00 11.00 C ATOM 1780 O ILE A 116 -0.981 -9.776 -14.328 1.00 0.15 O ATOM 1781 CB ILE A 116 1.967 -10.422 -15.624 1.00 1.13 C ATOM 1782 CG1 ILE A 116 2.030 -10.711 -14.123 1.00 20.02 C ATOM 1783 CG2 ILE A 116 2.640 -9.095 -15.941 1.00 15.41 C ATOM 1784 CD1 ILE A 116 1.509 -12.081 -13.749 1.00 45.32 C ATOM 0 H ILE A 116 1.311 -9.936 -17.981 1.00 43.41 H new ATOM 0 HA ILE A 116 0.078 -11.404 -15.970 1.00 44.52 H new ATOM 0 HB ILE A 116 2.501 -11.213 -16.151 1.00 1.13 H new ATOM 0 HG12 ILE A 116 3.063 -10.620 -13.787 1.00 20.02 H new ATOM 0 HG13 ILE A 116 1.453 -9.954 -13.591 1.00 20.02 H new ATOM 0 HG21 ILE A 116 3.673 -9.119 -15.595 1.00 15.41 H new ATOM 0 HG22 ILE A 116 2.622 -8.926 -17.018 1.00 15.41 H new ATOM 0 HG23 ILE A 116 2.108 -8.288 -15.438 1.00 15.41 H new ATOM 0 HD11 ILE A 116 1.584 -12.217 -12.670 1.00 45.32 H new ATOM 0 HD12 ILE A 116 0.466 -12.170 -14.054 1.00 45.32 H new ATOM 0 HD13 ILE A 116 2.101 -12.845 -14.253 1.00 45.32 H new ATOM 1796 N SER A 117 -0.173 -8.130 -15.633 1.00 21.43 N ATOM 1797 CA SER A 117 -0.875 -7.070 -14.918 1.00 43.32 C ATOM 1798 C SER A 117 -2.386 -7.228 -15.058 1.00 21.20 C ATOM 1799 O SER A 117 -3.155 -6.686 -14.265 1.00 13.41 O ATOM 1800 CB SER A 117 -0.444 -5.700 -15.445 1.00 12.44 C ATOM 1801 OG SER A 117 -1.490 -4.752 -15.318 1.00 62.05 O ATOM 0 H SER A 117 0.397 -7.806 -16.415 1.00 21.43 H new ATOM 0 HA SER A 117 -0.616 -7.144 -13.862 1.00 43.32 H new ATOM 0 HB2 SER A 117 0.432 -5.355 -14.896 1.00 12.44 H new ATOM 0 HB3 SER A 117 -0.151 -5.785 -16.492 1.00 12.44 H new ATOM 0 HG SER A 117 -1.189 -3.885 -15.660 1.00 62.05 H new ATOM 1807 N LYS A 118 -2.804 -7.977 -16.073 1.00 15.20 N ATOM 1808 CA LYS A 118 -4.222 -8.210 -16.318 1.00 45.15 C ATOM 1809 C LYS A 118 -4.733 -9.382 -15.486 1.00 64.05 C ATOM 1810 O LYS A 118 -5.665 -9.234 -14.695 1.00 21.20 O ATOM 1811 CB LYS A 118 -4.466 -8.482 -17.804 1.00 45.12 C ATOM 1812 CG LYS A 118 -5.878 -8.153 -18.260 1.00 72.13 C ATOM 1813 CD LYS A 118 -6.861 -9.238 -17.858 1.00 21.24 C ATOM 1814 CE LYS A 118 -8.085 -9.244 -18.761 1.00 12.53 C ATOM 1815 NZ LYS A 118 -8.877 -7.990 -18.630 1.00 64.22 N ATOM 0 H LYS A 118 -2.181 -8.433 -16.739 1.00 15.20 H new ATOM 0 HA LYS A 118 -4.768 -7.313 -16.024 1.00 45.15 H new ATOM 0 HB2 LYS A 118 -3.758 -7.898 -18.392 1.00 45.12 H new ATOM 0 HB3 LYS A 118 -4.262 -9.533 -18.011 1.00 45.12 H new ATOM 0 HG2 LYS A 118 -6.188 -7.202 -17.828 1.00 72.13 H new ATOM 0 HG3 LYS A 118 -5.892 -8.031 -19.343 1.00 72.13 H new ATOM 0 HD2 LYS A 118 -6.370 -10.210 -17.903 1.00 21.24 H new ATOM 0 HD3 LYS A 118 -7.171 -9.085 -16.824 1.00 21.24 H new ATOM 0 HE2 LYS A 118 -7.771 -9.369 -19.797 1.00 12.53 H new ATOM 0 HE3 LYS A 118 -8.715 -10.099 -18.514 1.00 12.53 H new ATOM 0 HZ1 LYS A 118 -9.729 -8.054 -19.223 1.00 64.22 H new ATOM 0 HZ2 LYS A 118 -9.155 -7.857 -17.637 1.00 64.22 H new ATOM 0 HZ3 LYS A 118 -8.301 -7.181 -18.939 1.00 64.22 H new ATOM 1829 N ILE A 119 -4.117 -10.544 -15.669 1.00 65.15 N ATOM 1830 CA ILE A 119 -4.508 -11.740 -14.932 1.00 50.12 C ATOM 1831 C ILE A 119 -4.493 -11.489 -13.429 1.00 70.05 C ATOM 1832 O ILE A 119 -5.307 -12.044 -12.689 1.00 1.10 O ATOM 1833 CB ILE A 119 -3.581 -12.927 -15.253 1.00 20.21 C ATOM 1834 CG1 ILE A 119 -2.206 -12.716 -14.615 1.00 2.20 C ATOM 1835 CG2 ILE A 119 -3.451 -13.107 -16.758 1.00 22.50 C ATOM 1836 CD1 ILE A 119 -2.052 -13.394 -13.272 1.00 60.34 C ATOM 0 H ILE A 119 -3.345 -10.684 -16.321 1.00 65.15 H new ATOM 0 HA ILE A 119 -5.522 -11.987 -15.246 1.00 50.12 H new ATOM 0 HB ILE A 119 -4.019 -13.834 -14.836 1.00 20.21 H new ATOM 0 HG12 ILE A 119 -1.439 -13.091 -15.292 1.00 2.20 H new ATOM 0 HG13 ILE A 119 -2.030 -11.647 -14.495 1.00 2.20 H new ATOM 0 HG21 ILE A 119 -2.793 -13.950 -16.968 1.00 22.50 H new ATOM 0 HG22 ILE A 119 -4.434 -13.299 -17.188 1.00 22.50 H new ATOM 0 HG23 ILE A 119 -3.033 -12.202 -17.198 1.00 22.50 H new ATOM 0 HD11 ILE A 119 -1.053 -13.202 -12.880 1.00 60.34 H new ATOM 0 HD12 ILE A 119 -2.796 -13.002 -12.579 1.00 60.34 H new ATOM 0 HD13 ILE A 119 -2.195 -14.468 -13.388 1.00 60.34 H new ATOM 1848 N ILE A 120 -3.565 -10.649 -12.984 1.00 42.50 N ATOM 1849 CA ILE A 120 -3.447 -10.322 -11.568 1.00 1.51 C ATOM 1850 C ILE A 120 -4.557 -9.374 -11.129 1.00 62.35 C ATOM 1851 O ILE A 120 -5.029 -9.437 -9.993 1.00 43.52 O ATOM 1852 CB ILE A 120 -2.083 -9.679 -11.251 1.00 53.45 C ATOM 1853 CG1 ILE A 120 -1.921 -8.368 -12.022 1.00 1.40 C ATOM 1854 CG2 ILE A 120 -0.953 -10.642 -11.588 1.00 71.24 C ATOM 1855 CD1 ILE A 120 -2.363 -7.149 -11.243 1.00 14.01 C ATOM 0 H ILE A 120 -2.884 -10.182 -13.583 1.00 42.50 H new ATOM 0 HA ILE A 120 -3.534 -11.259 -11.019 1.00 1.51 H new ATOM 0 HB ILE A 120 -2.041 -9.458 -10.184 1.00 53.45 H new ATOM 0 HG12 ILE A 120 -0.875 -8.249 -12.304 1.00 1.40 H new ATOM 0 HG13 ILE A 120 -2.496 -8.426 -12.946 1.00 1.40 H new ATOM 0 HG21 ILE A 120 0.004 -10.174 -11.359 1.00 71.24 H new ATOM 0 HG22 ILE A 120 -1.062 -11.552 -10.998 1.00 71.24 H new ATOM 0 HG23 ILE A 120 -0.991 -10.890 -12.649 1.00 71.24 H new ATOM 0 HD11 ILE A 120 -2.219 -6.256 -11.852 1.00 14.01 H new ATOM 0 HD12 ILE A 120 -3.417 -7.246 -10.984 1.00 14.01 H new ATOM 0 HD13 ILE A 120 -1.771 -7.065 -10.331 1.00 14.01 H new ATOM 1867 N SER A 121 -4.972 -8.496 -12.036 1.00 0.12 N ATOM 1868 CA SER A 121 -6.026 -7.531 -11.741 1.00 73.21 C ATOM 1869 C SER A 121 -7.379 -8.226 -11.623 1.00 61.43 C ATOM 1870 O SER A 121 -8.207 -7.859 -10.789 1.00 43.23 O ATOM 1871 CB SER A 121 -6.084 -6.459 -12.830 1.00 52.11 C ATOM 1872 OG SER A 121 -7.361 -5.846 -12.874 1.00 1.41 O ATOM 0 H SER A 121 -4.595 -8.432 -12.982 1.00 0.12 H new ATOM 0 HA SER A 121 -5.795 -7.057 -10.787 1.00 73.21 H new ATOM 0 HB2 SER A 121 -5.321 -5.704 -12.642 1.00 52.11 H new ATOM 0 HB3 SER A 121 -5.858 -6.907 -13.798 1.00 52.11 H new ATOM 0 HG SER A 121 -7.372 -5.163 -13.577 1.00 1.41 H new ATOM 1878 N GLU A 122 -7.597 -9.233 -12.464 1.00 41.41 N ATOM 1879 CA GLU A 122 -8.849 -9.978 -12.455 1.00 61.12 C ATOM 1880 C GLU A 122 -8.887 -10.963 -11.290 1.00 33.11 C ATOM 1881 O GLU A 122 -9.822 -10.956 -10.488 1.00 50.32 O ATOM 1882 CB GLU A 122 -9.033 -10.728 -13.776 1.00 22.41 C ATOM 1883 CG GLU A 122 -9.051 -9.818 -14.994 1.00 53.03 C ATOM 1884 CD GLU A 122 -10.153 -8.778 -14.929 1.00 22.05 C ATOM 1885 OE1 GLU A 122 -11.317 -9.161 -14.690 1.00 35.23 O ATOM 1886 OE2 GLU A 122 -9.850 -7.581 -15.117 1.00 60.42 O ATOM 0 H GLU A 122 -6.922 -9.551 -13.160 1.00 41.41 H new ATOM 0 HA GLU A 122 -9.665 -9.265 -12.334 1.00 61.12 H new ATOM 0 HB2 GLU A 122 -8.228 -11.454 -13.887 1.00 22.41 H new ATOM 0 HB3 GLU A 122 -9.966 -11.290 -13.739 1.00 22.41 H new ATOM 0 HG2 GLU A 122 -8.088 -9.316 -15.082 1.00 53.03 H new ATOM 0 HG3 GLU A 122 -9.179 -10.422 -15.892 1.00 53.03 H new ATOM 1893 N ILE A 123 -7.867 -11.810 -11.204 1.00 72.25 N ATOM 1894 CA ILE A 123 -7.783 -12.800 -10.138 1.00 54.04 C ATOM 1895 C ILE A 123 -7.896 -12.143 -8.767 1.00 62.52 C ATOM 1896 O ILE A 123 -8.776 -12.480 -7.976 1.00 23.52 O ATOM 1897 CB ILE A 123 -6.465 -13.592 -10.209 1.00 31.40 C ATOM 1898 CG1 ILE A 123 -6.409 -14.421 -11.493 1.00 34.31 C ATOM 1899 CG2 ILE A 123 -6.319 -14.488 -8.988 1.00 30.35 C ATOM 1900 CD1 ILE A 123 -5.028 -14.950 -11.812 1.00 24.43 C ATOM 0 H ILE A 123 -7.087 -11.830 -11.861 1.00 72.25 H new ATOM 0 HA ILE A 123 -8.618 -13.487 -10.278 1.00 54.04 H new ATOM 0 HB ILE A 123 -5.635 -12.885 -10.219 1.00 31.40 H new ATOM 0 HG12 ILE A 123 -7.099 -15.260 -11.404 1.00 34.31 H new ATOM 0 HG13 ILE A 123 -6.756 -13.810 -12.326 1.00 34.31 H new ATOM 0 HG21 ILE A 123 -5.382 -15.042 -9.053 1.00 30.35 H new ATOM 0 HG22 ILE A 123 -6.317 -13.876 -8.086 1.00 30.35 H new ATOM 0 HG23 ILE A 123 -7.153 -15.189 -8.949 1.00 30.35 H new ATOM 0 HD11 ILE A 123 -5.064 -15.528 -12.735 1.00 24.43 H new ATOM 0 HD12 ILE A 123 -4.338 -14.115 -11.933 1.00 24.43 H new ATOM 0 HD13 ILE A 123 -4.686 -15.588 -10.997 1.00 24.43 H new ATOM 1912 N ASN A 124 -7.000 -11.200 -8.494 1.00 75.21 N ATOM 1913 CA ASN A 124 -7.000 -10.493 -7.218 1.00 73.45 C ATOM 1914 C ASN A 124 -8.361 -9.859 -6.947 1.00 64.11 C ATOM 1915 O ASN A 124 -8.737 -9.642 -5.796 1.00 42.22 O ATOM 1916 CB ASN A 124 -5.913 -9.416 -7.208 1.00 11.21 C ATOM 1917 CG ASN A 124 -4.517 -10.003 -7.293 1.00 25.22 C ATOM 1918 OD1 ASN A 124 -4.337 -11.218 -7.214 1.00 22.41 O ATOM 1919 ND2 ASN A 124 -3.521 -9.140 -7.455 1.00 11.02 N ATOM 0 H ASN A 124 -6.265 -10.908 -9.138 1.00 75.21 H new ATOM 0 HA ASN A 124 -6.793 -11.217 -6.430 1.00 73.45 H new ATOM 0 HB2 ASN A 124 -6.070 -8.737 -8.046 1.00 11.21 H new ATOM 0 HB3 ASN A 124 -6.000 -8.824 -6.297 1.00 11.21 H new ATOM 0 HD21 ASN A 124 -2.560 -9.476 -7.519 1.00 11.02 H new ATOM 0 HD22 ASN A 124 -3.717 -8.141 -7.515 1.00 11.02 H new ATOM 1926 N ASN A 125 -9.095 -9.567 -8.015 1.00 51.03 N ATOM 1927 CA ASN A 125 -10.415 -8.959 -7.893 1.00 1.33 C ATOM 1928 C ASN A 125 -11.479 -10.018 -7.623 1.00 30.23 C ATOM 1929 O ASN A 125 -12.505 -9.738 -7.004 1.00 34.25 O ATOM 1930 CB ASN A 125 -10.762 -8.183 -9.165 1.00 2.44 C ATOM 1931 CG ASN A 125 -12.244 -7.883 -9.273 1.00 64.22 C ATOM 1932 OD1 ASN A 125 -12.792 -7.109 -8.487 1.00 75.13 O ATOM 1933 ND2 ASN A 125 -12.902 -8.496 -10.250 1.00 2.34 N ATOM 0 H ASN A 125 -8.798 -9.741 -8.975 1.00 51.03 H new ATOM 0 HA ASN A 125 -10.393 -8.269 -7.050 1.00 1.33 H new ATOM 0 HB2 ASN A 125 -10.203 -7.248 -9.181 1.00 2.44 H new ATOM 0 HB3 ASN A 125 -10.446 -8.758 -10.036 1.00 2.44 H new ATOM 0 HD21 ASN A 125 -13.902 -8.333 -10.372 1.00 2.34 H new ATOM 0 HD22 ASN A 125 -12.408 -9.129 -10.878 1.00 2.34 H new ATOM 1940 N ASN A 126 -11.226 -11.236 -8.092 1.00 22.12 N ATOM 1941 CA ASN A 126 -12.163 -12.337 -7.901 1.00 5.34 C ATOM 1942 C ASN A 126 -11.710 -13.244 -6.761 1.00 72.44 C ATOM 1943 O ASN A 126 -12.249 -14.335 -6.571 1.00 24.00 O ATOM 1944 CB ASN A 126 -12.296 -13.149 -9.192 1.00 64.41 C ATOM 1945 CG ASN A 126 -12.566 -12.274 -10.400 1.00 31.12 C ATOM 1946 OD1 ASN A 126 -13.414 -11.383 -10.358 1.00 60.44 O ATOM 1947 ND2 ASN A 126 -11.844 -12.526 -11.486 1.00 44.34 N ATOM 0 H ASN A 126 -10.381 -11.485 -8.606 1.00 22.12 H new ATOM 0 HA ASN A 126 -13.134 -11.916 -7.642 1.00 5.34 H new ATOM 0 HB2 ASN A 126 -11.381 -13.718 -9.356 1.00 64.41 H new ATOM 0 HB3 ASN A 126 -13.105 -13.871 -9.082 1.00 64.41 H new ATOM 0 HD21 ASN A 126 -11.982 -11.971 -12.330 1.00 44.34 H new ATOM 0 HD22 ASN A 126 -11.152 -13.275 -11.476 1.00 44.34 H new ATOM 1954 N ILE A 127 -10.719 -12.785 -6.004 1.00 64.21 N ATOM 1955 CA ILE A 127 -10.197 -13.554 -4.882 1.00 53.31 C ATOM 1956 C ILE A 127 -10.790 -13.072 -3.562 1.00 13.41 C ATOM 1957 O ILE A 127 -10.967 -11.873 -3.351 1.00 22.03 O ATOM 1958 CB ILE A 127 -8.661 -13.464 -4.804 1.00 71.21 C ATOM 1959 CG1 ILE A 127 -8.022 -14.520 -5.708 1.00 12.14 C ATOM 1960 CG2 ILE A 127 -8.192 -13.635 -3.367 1.00 2.33 C ATOM 1961 CD1 ILE A 127 -6.509 -14.492 -5.692 1.00 51.21 C ATOM 0 H ILE A 127 -10.262 -11.885 -6.148 1.00 64.21 H new ATOM 0 HA ILE A 127 -10.485 -14.592 -5.050 1.00 53.31 H new ATOM 0 HB ILE A 127 -8.351 -12.478 -5.151 1.00 71.21 H new ATOM 0 HG12 ILE A 127 -8.363 -15.508 -5.397 1.00 12.14 H new ATOM 0 HG13 ILE A 127 -8.370 -14.370 -6.730 1.00 12.14 H new ATOM 0 HG21 ILE A 127 -7.105 -13.569 -3.329 1.00 2.33 H new ATOM 0 HG22 ILE A 127 -8.625 -12.850 -2.747 1.00 2.33 H new ATOM 0 HG23 ILE A 127 -8.510 -14.609 -2.994 1.00 2.33 H new ATOM 0 HD11 ILE A 127 -6.124 -15.267 -6.355 1.00 51.21 H new ATOM 0 HD12 ILE A 127 -6.160 -13.517 -6.032 1.00 51.21 H new ATOM 0 HD13 ILE A 127 -6.152 -14.672 -4.678 1.00 51.21 H new ATOM 1973 N ASN A 128 -11.093 -14.015 -2.676 1.00 2.43 N ATOM 1974 CA ASN A 128 -11.664 -13.687 -1.375 1.00 53.34 C ATOM 1975 C ASN A 128 -10.844 -12.607 -0.677 1.00 63.41 C ATOM 1976 O ASN A 128 -11.174 -12.180 0.429 1.00 72.01 O ATOM 1977 CB ASN A 128 -11.735 -14.937 -0.497 1.00 3.42 C ATOM 1978 CG ASN A 128 -10.394 -15.290 0.117 1.00 11.34 C ATOM 1979 OD1 ASN A 128 -9.425 -15.615 -0.729 1.00 54.30 O flip ATOM 1980 ND2 ASN A 128 -10.232 -15.270 1.337 1.00 25.45 N flip ATOM 0 H ASN A 128 -10.953 -15.013 -2.835 1.00 2.43 H new ATOM 0 HA ASN A 128 -12.672 -13.305 -1.534 1.00 53.34 H new ATOM 0 HB2 ASN A 128 -12.465 -14.779 0.297 1.00 3.42 H new ATOM 0 HB3 ASN A 128 -12.091 -15.777 -1.094 1.00 3.42 H new ATOM 0 HD21 ASN A 128 -11.006 -15.014 1.950 1.00 25.45 H new ATOM 0 HD22 ASN A 128 -9.324 -15.510 1.735 1.00 25.45 H new