USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 769 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 120 MET CE :methyl -162:sc= -1.64 (180deg=-0.276) USER MOD Set 1.2: A 125 GLN : amide:sc= -7.08! C(o=-8.7!,f=-11!) USER MOD Set 2.1: A 86 HIS : no HD1:sc= -0.791 K(o=-8.1,f=-10!) USER MOD Set 2.2: A 110 MET CE :methyl -136:sc= -7.26! (180deg=-8.94!) USER MOD Set 3.1: A 70 THR OG1 : rot -57:sc= 0.549 USER MOD Set 3.2: A 109 THR OG1 : rot 53:sc= 0.596 USER MOD Set 4.1: A 88 ASN : amide:sc= -3.74 K(o=-3.3,f=-10!) USER MOD Set 4.2: A 108 SER OG : rot -76:sc= 0.409 USER MOD Set 5.1: A 36 ASN : amide:sc= -0.148 K(o=-0.15,f=-0.87) USER MOD Set 5.2: A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 118:sc= -2.72! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 119:sc= -2.57! USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.148 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 GLN : amide:sc= -1.53 X(o=-1.5,f=-1.1) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 24:sc= -2.3 USER MOD Single : A 62 MET CE :methyl -166:sc= -3.04 (180deg=-4.53!) USER MOD Single : A 65 THR OG1 : rot -150:sc= -0.229 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 141:sc= -1.21! (180deg=-2.98!) USER MOD Single : A 82 LYS NZ :NH3+ -130:sc= -0.149 (180deg=-0.378) USER MOD Single : A 83 LYS NZ :NH3+ -137:sc= -1.34 (180deg=-1.99) USER MOD Single : A 85 THR OG1 : rot 108:sc= 1.29 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 173:sc= 0.259 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.0199 USER MOD Single : A 119 SER OG : rot -64:sc= 0.137 USER MOD Single : A 121 THR OG1 : rot 180:sc=1.33e-07 USER MOD Single : A 123 GLN : amide:sc= -1.97 X(o=-2,f=-2.4!) USER MOD Single : A 124 SER OG : rot -43:sc= 0.00244 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 180:sc= -1.41! USER MOD ----------------------------------------------------------------- ATOM 318 N ASP A 21 -4.634 -13.797 -8.218 1.00 0.00 N ATOM 319 CA ASP A 21 -4.487 -14.771 -7.142 1.00 0.00 C ATOM 320 C ASP A 21 -3.538 -14.252 -6.063 1.00 0.00 C ATOM 321 O ASP A 21 -2.370 -13.976 -6.331 1.00 0.00 O ATOM 322 CB ASP A 21 -3.978 -16.102 -7.700 1.00 0.00 C ATOM 323 CG ASP A 21 -4.803 -17.282 -7.219 1.00 0.00 C ATOM 324 OD1 ASP A 21 -5.899 -17.503 -7.773 1.00 0.00 O ATOM 325 OD2 ASP A 21 -4.350 -17.981 -6.289 1.00 0.00 O ATOM 0 HA ASP A 21 -5.465 -14.929 -6.688 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.998 -16.068 -8.789 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -2.939 -16.244 -7.404 1.00 0.00 H new ATOM 330 N ARG A 22 -4.058 -14.120 -4.844 1.00 0.00 N ATOM 331 CA ARG A 22 -3.276 -13.628 -3.710 1.00 0.00 C ATOM 332 C ARG A 22 -1.876 -14.248 -3.659 1.00 0.00 C ATOM 333 O ARG A 22 -0.933 -13.624 -3.175 1.00 0.00 O ATOM 334 CB ARG A 22 -4.018 -13.917 -2.402 1.00 0.00 C ATOM 335 CG ARG A 22 -4.411 -12.665 -1.635 1.00 0.00 C ATOM 336 CD ARG A 22 -5.803 -12.190 -2.019 1.00 0.00 C ATOM 337 NE ARG A 22 -6.844 -13.095 -1.535 1.00 0.00 N ATOM 338 CZ ARG A 22 -8.121 -12.747 -1.391 1.00 0.00 C ATOM 339 NH1 ARG A 22 -8.520 -11.517 -1.694 1.00 0.00 N ATOM 340 NH2 ARG A 22 -9.002 -13.631 -0.944 1.00 0.00 N ATOM 0 H ARG A 22 -5.025 -14.349 -4.615 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.154 -12.553 -3.840 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -4.916 -14.494 -2.623 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.388 -14.539 -1.767 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.377 -12.867 -0.564 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -3.688 -11.874 -1.833 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -5.971 -11.193 -1.611 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -5.871 -12.106 -3.104 1.00 0.00 H new ATOM 0 HE ARG A 22 -6.576 -14.049 -1.293 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -7.847 -10.833 -2.039 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -9.500 -11.256 -1.582 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.701 -14.577 -0.711 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.980 -13.365 -0.834 1.00 0.00 H new ATOM 354 N GLU A 23 -1.750 -15.477 -4.150 1.00 0.00 N ATOM 355 CA GLU A 23 -0.465 -16.173 -4.143 1.00 0.00 C ATOM 356 C GLU A 23 0.280 -15.991 -5.463 1.00 0.00 C ATOM 357 O GLU A 23 1.444 -15.595 -5.480 1.00 0.00 O ATOM 358 CB GLU A 23 -0.670 -17.662 -3.862 1.00 0.00 C ATOM 359 CG GLU A 23 0.441 -18.282 -3.031 1.00 0.00 C ATOM 360 CD GLU A 23 0.259 -18.047 -1.545 1.00 0.00 C ATOM 361 OE1 GLU A 23 0.535 -16.919 -1.084 1.00 0.00 O ATOM 362 OE2 GLU A 23 -0.162 -18.989 -0.841 1.00 0.00 O ATOM 0 H GLU A 23 -2.518 -16.011 -4.557 1.00 0.00 H new ATOM 0 HA GLU A 23 0.142 -15.736 -3.350 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -1.619 -17.798 -3.344 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.745 -18.195 -4.810 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.478 -19.354 -3.223 1.00 0.00 H new ATOM 0 HG3 GLU A 23 1.399 -17.868 -3.346 1.00 0.00 H new ATOM 369 N LYS A 24 -0.397 -16.290 -6.568 1.00 0.00 N ATOM 370 CA LYS A 24 0.203 -16.167 -7.894 1.00 0.00 C ATOM 371 C LYS A 24 0.005 -14.763 -8.466 1.00 0.00 C ATOM 372 O LYS A 24 -0.076 -14.582 -9.681 1.00 0.00 O ATOM 373 CB LYS A 24 -0.397 -17.206 -8.845 1.00 0.00 C ATOM 374 CG LYS A 24 0.455 -18.456 -8.995 1.00 0.00 C ATOM 375 CD LYS A 24 1.374 -18.359 -10.203 1.00 0.00 C ATOM 376 CE LYS A 24 2.745 -17.823 -9.819 1.00 0.00 C ATOM 377 NZ LYS A 24 3.776 -18.898 -9.797 1.00 0.00 N ATOM 0 H LYS A 24 -1.362 -16.620 -6.572 1.00 0.00 H new ATOM 0 HA LYS A 24 1.274 -16.346 -7.794 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.385 -17.491 -8.482 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -0.536 -16.751 -9.826 1.00 0.00 H new ATOM 0 HG2 LYS A 24 1.050 -18.603 -8.094 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -0.191 -19.328 -9.096 1.00 0.00 H new ATOM 0 HD2 LYS A 24 1.482 -19.343 -10.659 1.00 0.00 H new ATOM 0 HD3 LYS A 24 0.924 -17.707 -10.952 1.00 0.00 H new ATOM 0 HE2 LYS A 24 3.043 -17.049 -10.526 1.00 0.00 H new ATOM 0 HE3 LYS A 24 2.689 -17.354 -8.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 4.696 -18.492 -9.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 3.505 -19.625 -9.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 3.848 -19.329 -10.741 1.00 0.00 H new ATOM 391 N THR A 25 -0.074 -13.773 -7.583 1.00 0.00 N ATOM 392 CA THR A 25 -0.267 -12.390 -7.996 1.00 0.00 C ATOM 393 C THR A 25 1.017 -11.794 -8.567 1.00 0.00 C ATOM 394 O THR A 25 2.108 -12.325 -8.360 1.00 0.00 O ATOM 395 CB THR A 25 -0.729 -11.552 -6.805 1.00 0.00 C ATOM 396 OG1 THR A 25 -0.938 -10.208 -7.192 1.00 0.00 O ATOM 397 CG2 THR A 25 0.256 -11.557 -5.657 1.00 0.00 C ATOM 0 H THR A 25 -0.007 -13.905 -6.574 1.00 0.00 H new ATOM 0 HA THR A 25 -1.028 -12.378 -8.777 1.00 0.00 H new ATOM 0 HB THR A 25 -1.658 -12.011 -6.466 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.879 -9.971 -7.057 1.00 0.00 H new ATOM 0 HG21 THR A 25 -0.131 -10.944 -4.843 1.00 0.00 H new ATOM 0 HG22 THR A 25 0.400 -12.579 -5.305 1.00 0.00 H new ATOM 0 HG23 THR A 25 1.210 -11.152 -5.994 1.00 0.00 H new ATOM 405 N SER A 26 0.876 -10.680 -9.280 1.00 0.00 N ATOM 406 CA SER A 26 2.020 -9.997 -9.874 1.00 0.00 C ATOM 407 C SER A 26 2.340 -8.717 -9.103 1.00 0.00 C ATOM 408 O SER A 26 1.439 -8.046 -8.601 1.00 0.00 O ATOM 409 CB SER A 26 1.739 -9.668 -11.343 1.00 0.00 C ATOM 410 OG SER A 26 2.287 -10.654 -12.200 1.00 0.00 O ATOM 0 H SER A 26 -0.022 -10.231 -9.460 1.00 0.00 H new ATOM 0 HA SER A 26 2.882 -10.661 -9.820 1.00 0.00 H new ATOM 0 HB2 SER A 26 0.663 -9.599 -11.504 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.161 -8.693 -11.588 1.00 0.00 H new ATOM 0 HG SER A 26 2.093 -10.422 -13.132 1.00 0.00 H new ATOM 416 N PRO A 27 3.632 -8.364 -8.992 1.00 0.00 N ATOM 417 CA PRO A 27 4.060 -7.162 -8.271 1.00 0.00 C ATOM 418 C PRO A 27 3.848 -5.882 -9.077 1.00 0.00 C ATOM 419 O PRO A 27 3.771 -5.916 -10.304 1.00 0.00 O ATOM 420 CB PRO A 27 5.550 -7.411 -8.044 1.00 0.00 C ATOM 421 CG PRO A 27 5.967 -8.253 -9.201 1.00 0.00 C ATOM 422 CD PRO A 27 4.777 -9.109 -9.551 1.00 0.00 C ATOM 0 HA PRO A 27 3.488 -7.010 -7.356 1.00 0.00 H new ATOM 0 HB2 PRO A 27 6.109 -6.476 -8.012 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.728 -7.921 -7.097 1.00 0.00 H new ATOM 0 HG2 PRO A 27 6.262 -7.633 -10.047 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.828 -8.870 -8.943 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.681 -9.240 -10.629 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.858 -10.105 -9.115 1.00 0.00 H new ATOM 430 N LEU A 28 3.758 -4.759 -8.372 1.00 0.00 N ATOM 431 CA LEU A 28 3.559 -3.461 -9.011 1.00 0.00 C ATOM 432 C LEU A 28 4.223 -2.353 -8.199 1.00 0.00 C ATOM 433 O LEU A 28 4.337 -2.450 -6.978 1.00 0.00 O ATOM 434 CB LEU A 28 2.063 -3.167 -9.169 1.00 0.00 C ATOM 435 CG LEU A 28 1.333 -2.786 -7.878 1.00 0.00 C ATOM 436 CD1 LEU A 28 1.311 -1.275 -7.697 1.00 0.00 C ATOM 437 CD2 LEU A 28 -0.080 -3.348 -7.881 1.00 0.00 C ATOM 0 H LEU A 28 3.820 -4.721 -7.355 1.00 0.00 H new ATOM 0 HA LEU A 28 4.020 -3.494 -9.998 1.00 0.00 H new ATOM 0 HB2 LEU A 28 1.942 -2.357 -9.888 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.579 -4.046 -9.595 1.00 0.00 H new ATOM 0 HG LEU A 28 1.874 -3.220 -7.037 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.788 -1.027 -6.774 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.333 -0.900 -7.647 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.797 -0.815 -8.541 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.585 -3.068 -6.956 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.630 -2.945 -8.731 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.039 -4.435 -7.957 1.00 0.00 H new ATOM 449 N LEU A 29 4.656 -1.300 -8.885 1.00 0.00 N ATOM 450 CA LEU A 29 5.305 -0.176 -8.221 1.00 0.00 C ATOM 451 C LEU A 29 4.272 0.741 -7.572 1.00 0.00 C ATOM 452 O LEU A 29 3.440 1.337 -8.256 1.00 0.00 O ATOM 453 CB LEU A 29 6.158 0.614 -9.219 1.00 0.00 C ATOM 454 CG LEU A 29 6.655 1.980 -8.728 1.00 0.00 C ATOM 455 CD1 LEU A 29 7.066 1.913 -7.263 1.00 0.00 C ATOM 456 CD2 LEU A 29 7.813 2.464 -9.588 1.00 0.00 C ATOM 0 H LEU A 29 4.570 -1.202 -9.897 1.00 0.00 H new ATOM 0 HA LEU A 29 5.953 -0.572 -7.439 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.023 0.008 -9.490 1.00 0.00 H new ATOM 0 HB3 LEU A 29 5.576 0.764 -10.128 1.00 0.00 H new ATOM 0 HG LEU A 29 5.836 2.694 -8.817 1.00 0.00 H new ATOM 0 HD11 LEU A 29 7.415 2.893 -6.938 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.210 1.613 -6.658 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.868 1.184 -7.143 1.00 0.00 H new ATOM 0 HD21 LEU A 29 8.154 3.434 -9.227 1.00 0.00 H new ATOM 0 HD22 LEU A 29 8.632 1.747 -9.532 1.00 0.00 H new ATOM 0 HD23 LEU A 29 7.483 2.558 -10.623 1.00 0.00 H new ATOM 468 N LEU A 30 4.333 0.849 -6.249 1.00 0.00 N ATOM 469 CA LEU A 30 3.404 1.692 -5.506 1.00 0.00 C ATOM 470 C LEU A 30 4.161 2.657 -4.591 1.00 0.00 C ATOM 471 O LEU A 30 5.048 2.250 -3.840 1.00 0.00 O ATOM 472 CB LEU A 30 2.433 0.812 -4.702 1.00 0.00 C ATOM 473 CG LEU A 30 1.905 1.414 -3.398 1.00 0.00 C ATOM 474 CD1 LEU A 30 1.228 2.748 -3.662 1.00 0.00 C ATOM 475 CD2 LEU A 30 0.942 0.450 -2.718 1.00 0.00 C ATOM 0 H LEU A 30 5.017 0.363 -5.669 1.00 0.00 H new ATOM 0 HA LEU A 30 2.827 2.291 -6.211 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.582 0.570 -5.338 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.934 -0.128 -4.469 1.00 0.00 H new ATOM 0 HG LEU A 30 2.750 1.585 -2.730 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.859 3.161 -2.723 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.945 3.439 -4.105 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.393 2.603 -4.348 1.00 0.00 H new ATOM 0 HD21 LEU A 30 0.576 0.894 -1.792 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.101 0.248 -3.381 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.459 -0.483 -2.493 1.00 0.00 H new ATOM 487 N ARG A 31 3.808 3.939 -4.671 1.00 0.00 N ATOM 488 CA ARG A 31 4.451 4.970 -3.860 1.00 0.00 C ATOM 489 C ARG A 31 3.830 5.048 -2.466 1.00 0.00 C ATOM 490 O ARG A 31 2.618 5.233 -2.322 1.00 0.00 O ATOM 491 CB ARG A 31 4.345 6.328 -4.555 1.00 0.00 C ATOM 492 CG ARG A 31 5.601 7.176 -4.434 1.00 0.00 C ATOM 493 CD ARG A 31 5.280 8.657 -4.535 1.00 0.00 C ATOM 494 NE ARG A 31 5.252 9.117 -5.924 1.00 0.00 N ATOM 495 CZ ARG A 31 4.320 9.929 -6.424 1.00 0.00 C ATOM 496 NH1 ARG A 31 3.334 10.383 -5.660 1.00 0.00 N ATOM 497 NH2 ARG A 31 4.377 10.289 -7.699 1.00 0.00 N ATOM 0 H ARG A 31 3.078 4.289 -5.291 1.00 0.00 H new ATOM 0 HA ARG A 31 5.502 4.702 -3.748 1.00 0.00 H new ATOM 0 HB2 ARG A 31 4.124 6.170 -5.611 1.00 0.00 H new ATOM 0 HB3 ARG A 31 3.504 6.878 -4.133 1.00 0.00 H new ATOM 0 HG2 ARG A 31 6.089 6.972 -3.481 1.00 0.00 H new ATOM 0 HG3 ARG A 31 6.305 6.900 -5.219 1.00 0.00 H new ATOM 0 HD2 ARG A 31 4.314 8.851 -4.069 1.00 0.00 H new ATOM 0 HD3 ARG A 31 6.023 9.228 -3.979 1.00 0.00 H new ATOM 0 HE ARG A 31 5.992 8.796 -6.549 1.00 0.00 H new ATOM 0 HH11 ARG A 31 3.283 10.111 -4.678 1.00 0.00 H new ATOM 0 HH12 ARG A 31 2.627 11.004 -6.055 1.00 0.00 H new ATOM 0 HH21 ARG A 31 5.132 9.945 -8.293 1.00 0.00 H new ATOM 0 HH22 ARG A 31 3.666 10.910 -8.086 1.00 0.00 H new ATOM 511 N VAL A 32 4.670 4.904 -1.444 1.00 0.00 N ATOM 512 CA VAL A 32 4.207 4.954 -0.062 1.00 0.00 C ATOM 513 C VAL A 32 5.008 5.954 0.766 1.00 0.00 C ATOM 514 O VAL A 32 6.236 5.963 0.724 1.00 0.00 O ATOM 515 CB VAL A 32 4.307 3.574 0.611 1.00 0.00 C ATOM 516 CG1 VAL A 32 3.172 2.674 0.157 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.655 2.933 0.320 1.00 0.00 C ATOM 0 H VAL A 32 5.673 4.752 -1.548 1.00 0.00 H new ATOM 0 HA VAL A 32 3.165 5.271 -0.099 1.00 0.00 H new ATOM 0 HB VAL A 32 4.221 3.710 1.689 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.261 1.703 0.644 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.218 3.128 0.424 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.221 2.543 -0.924 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.706 1.958 0.804 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.775 2.810 -0.756 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.452 3.571 0.703 1.00 0.00 H new ATOM 527 N PHE A 33 4.305 6.776 1.535 1.00 0.00 N ATOM 528 CA PHE A 33 4.950 7.763 2.391 1.00 0.00 C ATOM 529 C PHE A 33 4.850 7.325 3.844 1.00 0.00 C ATOM 530 O PHE A 33 3.761 7.283 4.416 1.00 0.00 O ATOM 531 CB PHE A 33 4.305 9.136 2.212 1.00 0.00 C ATOM 532 CG PHE A 33 4.181 9.560 0.777 1.00 0.00 C ATOM 533 CD1 PHE A 33 3.327 8.892 -0.085 1.00 0.00 C ATOM 534 CD2 PHE A 33 4.921 10.626 0.291 1.00 0.00 C ATOM 535 CE1 PHE A 33 3.211 9.281 -1.406 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.810 11.019 -1.029 1.00 0.00 C ATOM 537 CZ PHE A 33 3.955 10.347 -1.878 1.00 0.00 C ATOM 0 H PHE A 33 3.286 6.778 1.583 1.00 0.00 H new ATOM 0 HA PHE A 33 6.000 7.838 2.108 1.00 0.00 H new ATOM 0 HB2 PHE A 33 3.314 9.124 2.666 1.00 0.00 H new ATOM 0 HB3 PHE A 33 4.894 9.878 2.752 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.745 8.058 0.279 1.00 0.00 H new ATOM 0 HD2 PHE A 33 5.592 11.155 0.951 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.541 8.754 -2.068 1.00 0.00 H new ATOM 0 HE2 PHE A 33 5.392 11.852 -1.396 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.867 10.653 -2.910 1.00 0.00 H new ATOM 547 N THR A 34 5.986 6.976 4.437 1.00 0.00 N ATOM 548 CA THR A 34 6.004 6.516 5.821 1.00 0.00 C ATOM 549 C THR A 34 6.635 7.539 6.760 1.00 0.00 C ATOM 550 O THR A 34 7.821 7.854 6.649 1.00 0.00 O ATOM 551 CB THR A 34 6.750 5.187 5.924 1.00 0.00 C ATOM 552 OG1 THR A 34 7.899 5.189 5.099 1.00 0.00 O ATOM 553 CG2 THR A 34 5.904 3.996 5.529 1.00 0.00 C ATOM 0 H THR A 34 6.900 7.002 3.985 1.00 0.00 H new ATOM 0 HA THR A 34 4.968 6.381 6.131 1.00 0.00 H new ATOM 0 HB THR A 34 7.021 5.090 6.975 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.699 5.065 5.652 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.493 3.084 5.624 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.033 3.936 6.182 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.576 4.110 4.496 1.00 0.00 H new ATOM 561 N THR A 35 5.832 8.029 7.695 1.00 0.00 N ATOM 562 CA THR A 35 6.299 8.991 8.684 1.00 0.00 C ATOM 563 C THR A 35 6.596 8.256 9.996 1.00 0.00 C ATOM 564 O THR A 35 6.141 7.131 10.177 1.00 0.00 O ATOM 565 CB THR A 35 5.256 10.094 8.911 1.00 0.00 C ATOM 566 OG1 THR A 35 5.453 10.719 10.176 1.00 0.00 O ATOM 567 CG2 THR A 35 3.823 9.595 8.850 1.00 0.00 C ATOM 0 H THR A 35 4.849 7.774 7.789 1.00 0.00 H new ATOM 0 HA THR A 35 7.209 9.466 8.318 1.00 0.00 H new ATOM 0 HB THR A 35 5.403 10.803 8.096 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.780 11.420 10.303 1.00 0.00 H new ATOM 0 HG21 THR A 35 3.140 10.428 9.019 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.630 9.161 7.869 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.669 8.837 9.618 1.00 0.00 H new ATOM 575 N ASN A 36 7.349 8.877 10.890 1.00 0.00 N ATOM 576 CA ASN A 36 7.683 8.234 12.166 1.00 0.00 C ATOM 577 C ASN A 36 6.870 8.829 13.310 1.00 0.00 C ATOM 578 O ASN A 36 7.292 8.784 14.469 1.00 0.00 O ATOM 579 CB ASN A 36 9.173 8.362 12.451 1.00 0.00 C ATOM 580 CG ASN A 36 9.725 7.170 13.203 1.00 0.00 C ATOM 581 OD1 ASN A 36 10.344 6.280 12.623 1.00 0.00 O ATOM 582 ND2 ASN A 36 9.503 7.146 14.515 1.00 0.00 N ATOM 0 H ASN A 36 7.739 9.811 10.766 1.00 0.00 H new ATOM 0 HA ASN A 36 7.431 7.177 12.087 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.711 8.474 11.510 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.352 9.268 13.031 1.00 0.00 H new ATOM 0 HD21 ASN A 36 9.851 6.369 15.077 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.985 7.904 14.958 1.00 0.00 H new ATOM 589 N ASN A 37 5.711 9.384 12.980 1.00 0.00 N ATOM 590 CA ASN A 37 4.842 9.990 13.986 1.00 0.00 C ATOM 591 C ASN A 37 3.443 9.380 13.942 1.00 0.00 C ATOM 592 O ASN A 37 2.629 9.595 14.842 1.00 0.00 O ATOM 593 CB ASN A 37 4.756 11.502 13.774 1.00 0.00 C ATOM 594 CG ASN A 37 4.725 12.267 15.082 1.00 0.00 C ATOM 595 OD1 ASN A 37 5.769 12.629 15.628 1.00 0.00 O ATOM 596 ND2 ASN A 37 3.527 12.517 15.593 1.00 0.00 N ATOM 0 H ASN A 37 5.350 9.428 12.027 1.00 0.00 H new ATOM 0 HA ASN A 37 5.275 9.790 14.966 1.00 0.00 H new ATOM 0 HB2 ASN A 37 5.610 11.833 13.183 1.00 0.00 H new ATOM 0 HB3 ASN A 37 3.860 11.735 13.198 1.00 0.00 H new ATOM 0 HD21 ASN A 37 3.444 13.028 16.472 1.00 0.00 H new ATOM 0 HD22 ASN A 37 2.689 12.199 15.107 1.00 0.00 H new ATOM 603 N GLY A 38 3.163 8.613 12.890 1.00 0.00 N ATOM 604 CA GLY A 38 1.861 7.984 12.752 1.00 0.00 C ATOM 605 C GLY A 38 0.722 8.978 12.798 1.00 0.00 C ATOM 606 O GLY A 38 -0.178 8.861 13.628 1.00 0.00 O ATOM 0 H GLY A 38 3.815 8.416 12.131 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.824 7.439 11.809 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.730 7.251 13.548 1.00 0.00 H new ATOM 610 N ARG A 39 0.761 9.960 11.905 1.00 0.00 N ATOM 611 CA ARG A 39 -0.280 10.979 11.859 1.00 0.00 C ATOM 612 C ARG A 39 -0.271 11.724 10.527 1.00 0.00 C ATOM 613 O ARG A 39 0.604 12.551 10.271 1.00 0.00 O ATOM 614 CB ARG A 39 -0.104 11.965 13.014 1.00 0.00 C ATOM 615 CG ARG A 39 -1.382 12.218 13.799 1.00 0.00 C ATOM 616 CD ARG A 39 -1.250 13.443 14.689 1.00 0.00 C ATOM 617 NE ARG A 39 -0.376 13.194 15.835 1.00 0.00 N ATOM 618 CZ ARG A 39 0.429 14.109 16.373 1.00 0.00 C ATOM 619 NH1 ARG A 39 0.470 15.343 15.885 1.00 0.00 N ATOM 620 NH2 ARG A 39 1.193 13.788 17.407 1.00 0.00 N ATOM 0 H ARG A 39 1.497 10.072 11.208 1.00 0.00 H new ATOM 0 HA ARG A 39 -1.243 10.479 11.958 1.00 0.00 H new ATOM 0 HB2 ARG A 39 0.660 11.585 13.692 1.00 0.00 H new ATOM 0 HB3 ARG A 39 0.264 12.912 12.619 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -2.214 12.355 13.109 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -1.615 11.346 14.410 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -0.855 14.275 14.105 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -2.236 13.742 15.043 1.00 0.00 H new ATOM 0 HE ARG A 39 -0.383 12.261 16.248 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -0.118 15.597 15.091 1.00 0.00 H new ATOM 0 HH12 ARG A 39 1.090 16.037 16.304 1.00 0.00 H new ATOM 0 HH21 ARG A 39 1.164 12.843 17.789 1.00 0.00 H new ATOM 0 HH22 ARG A 39 1.810 14.486 17.821 1.00 0.00 H new ATOM 864 N GLU A 55 8.917 9.226 0.697 1.00 0.00 N ATOM 865 CA GLU A 55 8.226 8.162 -0.021 1.00 0.00 C ATOM 866 C GLU A 55 9.179 7.032 -0.405 1.00 0.00 C ATOM 867 O GLU A 55 10.363 7.259 -0.654 1.00 0.00 O ATOM 868 CB GLU A 55 7.551 8.721 -1.274 1.00 0.00 C ATOM 869 CG GLU A 55 8.500 9.474 -2.194 1.00 0.00 C ATOM 870 CD GLU A 55 8.431 10.975 -1.999 1.00 0.00 C ATOM 871 OE1 GLU A 55 7.522 11.608 -2.576 1.00 0.00 O ATOM 872 OE2 GLU A 55 9.286 11.520 -1.268 1.00 0.00 O ATOM 0 HA GLU A 55 7.468 7.752 0.646 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.096 7.900 -1.828 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.743 9.389 -0.974 1.00 0.00 H new ATOM 0 HG2 GLU A 55 9.520 9.134 -2.015 1.00 0.00 H new ATOM 0 HG3 GLU A 55 8.262 9.235 -3.230 1.00 0.00 H new ATOM 879 N LEU A 56 8.642 5.815 -0.458 1.00 0.00 N ATOM 880 CA LEU A 56 9.423 4.636 -0.820 1.00 0.00 C ATOM 881 C LEU A 56 8.702 3.836 -1.905 1.00 0.00 C ATOM 882 O LEU A 56 7.572 4.156 -2.270 1.00 0.00 O ATOM 883 CB LEU A 56 9.671 3.737 0.401 1.00 0.00 C ATOM 884 CG LEU A 56 8.751 3.973 1.607 1.00 0.00 C ATOM 885 CD1 LEU A 56 8.116 2.664 2.056 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.523 4.614 2.755 1.00 0.00 C ATOM 0 H LEU A 56 7.662 5.620 -0.253 1.00 0.00 H new ATOM 0 HA LEU A 56 10.386 4.979 -1.199 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.569 2.698 0.089 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.703 3.873 0.724 1.00 0.00 H new ATOM 0 HG LEU A 56 7.957 4.656 1.305 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.467 2.849 2.912 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.529 2.245 1.239 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.897 1.959 2.339 1.00 0.00 H new ATOM 0 HD21 LEU A 56 8.853 4.773 3.600 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.338 3.957 3.057 1.00 0.00 H new ATOM 0 HD23 LEU A 56 9.930 5.571 2.430 1.00 0.00 H new ATOM 898 N GLN A 57 9.364 2.803 -2.403 1.00 0.00 N ATOM 899 CA GLN A 57 8.784 1.955 -3.442 1.00 0.00 C ATOM 900 C GLN A 57 8.517 0.556 -2.903 1.00 0.00 C ATOM 901 O GLN A 57 9.346 -0.013 -2.193 1.00 0.00 O ATOM 902 CB GLN A 57 9.713 1.886 -4.651 1.00 0.00 C ATOM 903 CG GLN A 57 10.325 3.223 -5.035 1.00 0.00 C ATOM 904 CD GLN A 57 9.385 4.080 -5.862 1.00 0.00 C ATOM 905 OE1 GLN A 57 9.616 4.309 -7.048 1.00 0.00 O ATOM 906 NE2 GLN A 57 8.318 4.561 -5.235 1.00 0.00 N ATOM 0 H GLN A 57 10.301 2.529 -2.108 1.00 0.00 H new ATOM 0 HA GLN A 57 7.836 2.393 -3.754 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.514 1.178 -4.441 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.157 1.494 -5.502 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.603 3.764 -4.131 1.00 0.00 H new ATOM 0 HG3 GLN A 57 11.242 3.050 -5.598 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.165 4.346 -4.250 1.00 0.00 H new ATOM 0 HE22 GLN A 57 7.651 5.146 -5.739 1.00 0.00 H new ATOM 915 N ILE A 58 7.357 0.006 -3.240 1.00 0.00 N ATOM 916 CA ILE A 58 6.985 -1.334 -2.792 1.00 0.00 C ATOM 917 C ILE A 58 6.368 -2.137 -3.923 1.00 0.00 C ATOM 918 O ILE A 58 5.378 -1.723 -4.525 1.00 0.00 O ATOM 919 CB ILE A 58 5.980 -1.303 -1.619 1.00 0.00 C ATOM 920 CG1 ILE A 58 5.093 -0.060 -1.679 1.00 0.00 C ATOM 921 CG2 ILE A 58 6.711 -1.383 -0.295 1.00 0.00 C ATOM 922 CD1 ILE A 58 3.638 -0.350 -1.390 1.00 0.00 C ATOM 0 H ILE A 58 6.656 0.466 -3.822 1.00 0.00 H new ATOM 0 HA ILE A 58 7.909 -1.804 -2.455 1.00 0.00 H new ATOM 0 HB ILE A 58 5.330 -2.174 -1.708 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.459 0.674 -0.962 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.177 0.391 -2.668 1.00 0.00 H new ATOM 0 HG21 ILE A 58 5.989 -1.360 0.521 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.281 -2.311 -0.249 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.390 -0.535 -0.203 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.064 0.575 -1.449 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.256 -1.061 -2.122 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.543 -0.773 -0.390 1.00 0.00 H new ATOM 934 N TYR A 59 6.943 -3.304 -4.193 1.00 0.00 N ATOM 935 CA TYR A 59 6.421 -4.171 -5.233 1.00 0.00 C ATOM 936 C TYR A 59 5.302 -5.025 -4.653 1.00 0.00 C ATOM 937 O TYR A 59 5.510 -6.182 -4.292 1.00 0.00 O ATOM 938 CB TYR A 59 7.531 -5.057 -5.801 1.00 0.00 C ATOM 939 CG TYR A 59 8.621 -4.282 -6.502 1.00 0.00 C ATOM 940 CD1 TYR A 59 8.373 -3.621 -7.699 1.00 0.00 C ATOM 941 CD2 TYR A 59 9.902 -4.210 -5.968 1.00 0.00 C ATOM 942 CE1 TYR A 59 9.368 -2.910 -8.342 1.00 0.00 C ATOM 943 CE2 TYR A 59 10.904 -3.501 -6.605 1.00 0.00 C ATOM 944 CZ TYR A 59 10.631 -2.854 -7.791 1.00 0.00 C ATOM 945 OH TYR A 59 11.625 -2.146 -8.428 1.00 0.00 O ATOM 0 H TYR A 59 7.764 -3.666 -3.708 1.00 0.00 H new ATOM 0 HA TYR A 59 6.028 -3.562 -6.047 1.00 0.00 H new ATOM 0 HB2 TYR A 59 7.972 -5.637 -4.991 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.094 -5.769 -6.501 1.00 0.00 H new ATOM 0 HD1 TYR A 59 7.385 -3.664 -8.134 1.00 0.00 H new ATOM 0 HD2 TYR A 59 10.119 -4.717 -5.039 1.00 0.00 H new ATOM 0 HE1 TYR A 59 9.158 -2.401 -9.271 1.00 0.00 H new ATOM 0 HE2 TYR A 59 11.894 -3.455 -6.176 1.00 0.00 H new ATOM 0 HH TYR A 59 12.454 -2.206 -7.908 1.00 0.00 H new ATOM 955 N THR A 60 4.112 -4.433 -4.551 1.00 0.00 N ATOM 956 CA THR A 60 2.958 -5.122 -3.995 1.00 0.00 C ATOM 957 C THR A 60 1.953 -5.461 -5.077 1.00 0.00 C ATOM 958 O THR A 60 2.169 -5.208 -6.265 1.00 0.00 O ATOM 959 CB THR A 60 2.311 -4.259 -2.906 1.00 0.00 C ATOM 960 OG1 THR A 60 1.436 -5.035 -2.105 1.00 0.00 O ATOM 961 CG2 THR A 60 1.532 -3.079 -3.452 1.00 0.00 C ATOM 0 H THR A 60 3.926 -3.475 -4.848 1.00 0.00 H new ATOM 0 HA THR A 60 3.294 -6.059 -3.550 1.00 0.00 H new ATOM 0 HB THR A 60 3.140 -3.871 -2.315 1.00 0.00 H new ATOM 0 HG1 THR A 60 1.701 -5.977 -2.150 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.102 -2.513 -2.626 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.200 -2.435 -4.024 1.00 0.00 H new ATOM 0 HG23 THR A 60 0.733 -3.439 -4.100 1.00 0.00 H new ATOM 969 N TRP A 61 0.850 -6.041 -4.669 1.00 0.00 N ATOM 970 CA TRP A 61 -0.208 -6.424 -5.623 1.00 0.00 C ATOM 971 C TRP A 61 -1.612 -5.982 -5.188 1.00 0.00 C ATOM 972 O TRP A 61 -2.070 -6.312 -4.105 1.00 0.00 O ATOM 973 CB TRP A 61 -0.209 -7.934 -5.877 1.00 0.00 C ATOM 974 CG TRP A 61 -0.247 -8.764 -4.634 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.326 -9.411 -4.115 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.853 -9.043 -3.759 1.00 0.00 C ATOM 977 NE1 TRP A 61 -0.967 -10.081 -2.971 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.366 -9.870 -2.731 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.203 -8.677 -3.746 1.00 0.00 C ATOM 980 CZ2 TRP A 61 1.177 -10.337 -1.701 1.00 0.00 C ATOM 981 CZ3 TRP A 61 3.008 -9.140 -2.722 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.493 -9.962 -1.713 1.00 0.00 C ATOM 0 H TRP A 61 0.646 -6.264 -3.695 1.00 0.00 H new ATOM 0 HA TRP A 61 0.031 -5.895 -6.545 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -1.070 -8.187 -6.496 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.682 -8.196 -6.448 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.319 -9.399 -4.540 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.591 -10.644 -2.394 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.609 -8.044 -4.522 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.782 -10.972 -0.921 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 4.052 -8.863 -2.700 1.00 0.00 H new ATOM 0 HH2 TRP A 61 3.148 -10.308 -0.927 1.00 0.00 H new ATOM 993 N MET A 62 -2.254 -5.198 -6.066 1.00 0.00 N ATOM 994 CA MET A 62 -3.581 -4.657 -5.827 1.00 0.00 C ATOM 995 C MET A 62 -4.450 -5.596 -4.982 1.00 0.00 C ATOM 996 O MET A 62 -5.214 -5.149 -4.129 1.00 0.00 O ATOM 997 CB MET A 62 -4.272 -4.375 -7.161 1.00 0.00 C ATOM 998 CG MET A 62 -3.443 -3.531 -8.114 1.00 0.00 C ATOM 999 SD MET A 62 -2.901 -1.980 -7.375 1.00 0.00 S ATOM 1000 CE MET A 62 -4.405 -1.453 -6.560 1.00 0.00 C ATOM 0 H MET A 62 -1.856 -4.925 -6.965 1.00 0.00 H new ATOM 0 HA MET A 62 -3.459 -3.731 -5.265 1.00 0.00 H new ATOM 0 HB2 MET A 62 -4.511 -5.323 -7.644 1.00 0.00 H new ATOM 0 HB3 MET A 62 -5.218 -3.868 -6.970 1.00 0.00 H new ATOM 0 HG2 MET A 62 -2.571 -4.101 -8.433 1.00 0.00 H new ATOM 0 HG3 MET A 62 -4.029 -3.318 -9.008 1.00 0.00 H new ATOM 0 HE1 MET A 62 -4.314 -0.406 -6.270 1.00 0.00 H new ATOM 0 HE2 MET A 62 -5.248 -1.569 -7.241 1.00 0.00 H new ATOM 0 HE3 MET A 62 -4.570 -2.062 -5.671 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.345 -6.901 -5.238 1.00 0.00 N ATOM 1011 CA ASP A 63 -5.137 -7.892 -4.508 1.00 0.00 C ATOM 1012 C ASP A 63 -4.386 -8.434 -3.289 1.00 0.00 C ATOM 1013 O ASP A 63 -4.582 -9.584 -2.892 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.521 -9.046 -5.436 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.668 -8.689 -6.358 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -6.578 -7.648 -7.043 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.658 -9.450 -6.398 1.00 0.00 O ATOM 0 H ASP A 63 -3.722 -7.295 -5.943 1.00 0.00 H new ATOM 0 HA ASP A 63 -6.038 -7.394 -4.151 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.655 -9.332 -6.032 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.797 -9.914 -4.837 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.526 -7.610 -2.703 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.749 -8.013 -1.536 1.00 0.00 C ATOM 1024 C ALA A 64 -3.437 -7.613 -0.235 1.00 0.00 C ATOM 1025 O ALA A 64 -4.026 -6.539 -0.143 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.357 -7.397 -1.589 1.00 0.00 C ATOM 0 H ALA A 64 -3.348 -6.656 -3.017 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.668 -9.100 -1.557 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.789 -7.706 -0.712 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.845 -7.733 -2.491 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.440 -6.310 -1.603 1.00 0.00 H new ATOM 1032 N THR A 65 -3.347 -8.480 0.771 1.00 0.00 N ATOM 1033 CA THR A 65 -3.951 -8.202 2.065 1.00 0.00 C ATOM 1034 C THR A 65 -3.062 -7.243 2.850 1.00 0.00 C ATOM 1035 O THR A 65 -1.841 -7.248 2.694 1.00 0.00 O ATOM 1036 CB THR A 65 -4.165 -9.490 2.860 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.546 -10.589 2.210 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.630 -9.831 3.047 1.00 0.00 C ATOM 0 H THR A 65 -2.863 -9.376 0.712 1.00 0.00 H new ATOM 0 HA THR A 65 -4.925 -7.742 1.900 1.00 0.00 H new ATOM 0 HB THR A 65 -3.718 -9.310 3.838 1.00 0.00 H new ATOM 0 HG1 THR A 65 -4.043 -11.410 2.410 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.718 -10.755 3.618 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.126 -9.023 3.585 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.101 -9.961 2.072 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.679 -6.391 3.680 1.00 0.00 N ATOM 1047 CA LEU A 66 -2.939 -5.409 4.465 1.00 0.00 C ATOM 1048 C LEU A 66 -1.678 -6.008 5.074 1.00 0.00 C ATOM 1049 O LEU A 66 -0.669 -5.321 5.232 1.00 0.00 O ATOM 1050 CB LEU A 66 -3.839 -4.848 5.562 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.488 -3.496 5.243 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -5.373 -3.038 6.392 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -3.418 -2.458 4.939 1.00 0.00 C ATOM 0 H LEU A 66 -4.689 -6.367 3.821 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.629 -4.605 3.797 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.627 -5.572 5.769 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.252 -4.745 6.475 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.117 -3.613 4.361 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -5.823 -2.077 6.144 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.159 -3.774 6.561 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.772 -2.935 7.295 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.892 -1.502 4.714 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.765 -2.345 5.804 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.830 -2.782 4.081 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.737 -7.290 5.415 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.585 -7.961 5.999 1.00 0.00 C ATOM 1067 C LYS A 67 0.623 -7.914 5.040 1.00 0.00 C ATOM 1068 O LYS A 67 1.708 -7.518 5.459 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.917 -9.411 6.370 1.00 0.00 C ATOM 1070 CG LYS A 67 -1.664 -10.177 5.287 1.00 0.00 C ATOM 1071 CD LYS A 67 -0.908 -11.428 4.870 1.00 0.00 C ATOM 1072 CE LYS A 67 -1.850 -12.514 4.375 1.00 0.00 C ATOM 1073 NZ LYS A 67 -1.151 -13.816 4.192 1.00 0.00 N ATOM 0 H LYS A 67 -2.561 -7.879 5.298 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.321 -7.429 6.913 1.00 0.00 H new ATOM 0 HB2 LYS A 67 0.010 -9.937 6.598 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -1.517 -9.413 7.280 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -2.654 -10.453 5.651 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -1.811 -9.533 4.420 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -0.196 -11.178 4.084 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -0.331 -11.804 5.715 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -2.667 -12.638 5.086 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -2.295 -12.205 3.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -1.828 -14.529 3.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.388 -13.705 3.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -0.748 -14.124 5.100 1.00 0.00 H new ATOM 1087 N GLU A 68 0.407 -8.300 3.789 1.00 0.00 N ATOM 1088 CA GLU A 68 1.476 -8.278 2.799 1.00 0.00 C ATOM 1089 C GLU A 68 2.077 -6.880 2.705 1.00 0.00 C ATOM 1090 O GLU A 68 3.277 -6.726 2.475 1.00 0.00 O ATOM 1091 CB GLU A 68 0.943 -8.720 1.447 1.00 0.00 C ATOM 1092 CG GLU A 68 0.427 -10.149 1.440 1.00 0.00 C ATOM 1093 CD GLU A 68 1.547 -11.170 1.415 1.00 0.00 C ATOM 1094 OE1 GLU A 68 2.647 -10.858 1.916 1.00 0.00 O ATOM 1095 OE2 GLU A 68 1.325 -12.285 0.896 1.00 0.00 O ATOM 0 H GLU A 68 -0.492 -8.630 3.438 1.00 0.00 H new ATOM 0 HA GLU A 68 2.259 -8.971 3.108 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.138 -8.050 1.145 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.734 -8.624 0.704 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.191 -10.313 2.323 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.214 -10.296 0.571 1.00 0.00 H new ATOM 1102 N LEU A 69 1.235 -5.870 2.888 1.00 0.00 N ATOM 1103 CA LEU A 69 1.686 -4.485 2.818 1.00 0.00 C ATOM 1104 C LEU A 69 2.496 -4.130 4.063 1.00 0.00 C ATOM 1105 O LEU A 69 3.349 -3.245 4.028 1.00 0.00 O ATOM 1106 CB LEU A 69 0.490 -3.536 2.673 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.339 -3.721 1.398 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.563 -3.820 0.177 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.218 -4.954 1.516 1.00 0.00 C ATOM 0 H LEU A 69 0.241 -5.983 3.085 1.00 0.00 H new ATOM 0 HA LEU A 69 2.323 -4.373 1.941 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.164 -3.668 3.535 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.855 -2.510 2.704 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.980 -2.848 1.274 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.047 -3.951 -0.717 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.151 -2.907 0.084 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.232 -4.673 0.287 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.802 -5.073 0.603 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.592 -5.834 1.664 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.892 -4.841 2.365 1.00 0.00 H new ATOM 1121 N THR A 70 2.228 -4.837 5.161 1.00 0.00 N ATOM 1122 CA THR A 70 2.942 -4.606 6.411 1.00 0.00 C ATOM 1123 C THR A 70 4.411 -5.016 6.263 1.00 0.00 C ATOM 1124 O THR A 70 5.298 -4.391 6.842 1.00 0.00 O ATOM 1125 CB THR A 70 2.283 -5.388 7.552 1.00 0.00 C ATOM 1126 OG1 THR A 70 0.981 -4.894 7.812 1.00 0.00 O ATOM 1127 CG2 THR A 70 3.062 -5.338 8.850 1.00 0.00 C ATOM 0 H THR A 70 1.523 -5.572 5.208 1.00 0.00 H new ATOM 0 HA THR A 70 2.898 -3.543 6.649 1.00 0.00 H new ATOM 0 HB THR A 70 2.254 -6.422 7.209 1.00 0.00 H new ATOM 0 HG1 THR A 70 1.030 -3.939 8.027 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.536 -5.913 9.612 1.00 0.00 H new ATOM 0 HG22 THR A 70 4.054 -5.762 8.695 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.157 -4.303 9.178 1.00 0.00 H new ATOM 1135 N SER A 71 4.651 -6.060 5.474 1.00 0.00 N ATOM 1136 CA SER A 71 6.008 -6.544 5.247 1.00 0.00 C ATOM 1137 C SER A 71 6.700 -5.688 4.197 1.00 0.00 C ATOM 1138 O SER A 71 7.866 -5.324 4.343 1.00 0.00 O ATOM 1139 CB SER A 71 5.986 -8.006 4.806 1.00 0.00 C ATOM 1140 OG SER A 71 7.104 -8.709 5.318 1.00 0.00 O ATOM 0 H SER A 71 3.927 -6.584 4.984 1.00 0.00 H new ATOM 0 HA SER A 71 6.564 -6.473 6.182 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.066 -8.479 5.150 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.985 -8.061 3.717 1.00 0.00 H new ATOM 0 HG SER A 71 7.066 -9.643 5.023 1.00 0.00 H new ATOM 1146 N LEU A 72 5.965 -5.361 3.139 1.00 0.00 N ATOM 1147 CA LEU A 72 6.494 -4.539 2.054 1.00 0.00 C ATOM 1148 C LEU A 72 7.133 -3.269 2.608 1.00 0.00 C ATOM 1149 O LEU A 72 8.277 -2.948 2.293 1.00 0.00 O ATOM 1150 CB LEU A 72 5.368 -4.194 1.076 1.00 0.00 C ATOM 1151 CG LEU A 72 5.185 -5.191 -0.071 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.711 -5.375 -0.393 1.00 0.00 C ATOM 1153 CD2 LEU A 72 5.949 -4.732 -1.303 1.00 0.00 C ATOM 0 H LEU A 72 4.997 -5.654 3.009 1.00 0.00 H new ATOM 0 HA LEU A 72 7.264 -5.100 1.524 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.432 -4.125 1.631 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.562 -3.208 0.654 1.00 0.00 H new ATOM 0 HG LEU A 72 5.587 -6.154 0.245 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.603 -6.087 -1.211 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.191 -5.752 0.487 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.280 -4.418 -0.687 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.808 -5.453 -2.108 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.578 -3.757 -1.619 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.010 -4.657 -1.066 1.00 0.00 H new ATOM 1165 N VAL A 73 6.398 -2.557 3.452 1.00 0.00 N ATOM 1166 CA VAL A 73 6.913 -1.336 4.056 1.00 0.00 C ATOM 1167 C VAL A 73 8.115 -1.639 4.945 1.00 0.00 C ATOM 1168 O VAL A 73 9.099 -0.901 4.949 1.00 0.00 O ATOM 1169 CB VAL A 73 5.834 -0.620 4.894 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.384 0.667 5.493 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.603 -0.336 4.049 1.00 0.00 C ATOM 0 H VAL A 73 5.449 -2.802 3.733 1.00 0.00 H new ATOM 0 HA VAL A 73 7.217 -0.679 3.241 1.00 0.00 H new ATOM 0 HB VAL A 73 5.543 -1.279 5.712 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.607 1.156 6.080 1.00 0.00 H new ATOM 0 HG12 VAL A 73 7.233 0.435 6.136 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.707 1.332 4.692 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.853 0.169 4.657 1.00 0.00 H new ATOM 0 HG22 VAL A 73 4.878 0.301 3.208 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.194 -1.275 3.675 1.00 0.00 H new ATOM 1181 N LYS A 74 8.021 -2.728 5.704 1.00 0.00 N ATOM 1182 CA LYS A 74 9.098 -3.123 6.602 1.00 0.00 C ATOM 1183 C LYS A 74 10.398 -3.408 5.835 1.00 0.00 C ATOM 1184 O LYS A 74 11.471 -3.067 6.325 1.00 0.00 O ATOM 1185 CB LYS A 74 8.681 -4.347 7.420 1.00 0.00 C ATOM 1186 CG LYS A 74 7.742 -4.022 8.575 1.00 0.00 C ATOM 1187 CD LYS A 74 7.030 -2.691 8.369 1.00 0.00 C ATOM 1188 CE LYS A 74 6.045 -2.400 9.487 1.00 0.00 C ATOM 1189 NZ LYS A 74 5.506 -1.012 9.404 1.00 0.00 N ATOM 0 H LYS A 74 7.212 -3.349 5.714 1.00 0.00 H new ATOM 0 HA LYS A 74 9.291 -2.291 7.279 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.195 -5.066 6.760 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.575 -4.830 7.815 1.00 0.00 H new ATOM 0 HG2 LYS A 74 7.003 -4.817 8.678 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.308 -3.991 9.506 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.766 -1.889 8.315 1.00 0.00 H new ATOM 0 HD3 LYS A 74 6.503 -2.704 7.415 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.222 -3.113 9.441 1.00 0.00 H new ATOM 0 HE3 LYS A 74 6.536 -2.542 10.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 4.496 -1.017 9.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 6.022 -0.399 10.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 5.624 -0.651 8.436 1.00 0.00 H new ATOM 1203 N GLU A 75 10.286 -4.012 4.656 1.00 0.00 N ATOM 1204 CA GLU A 75 11.471 -4.312 3.860 1.00 0.00 C ATOM 1205 C GLU A 75 12.128 -3.017 3.390 1.00 0.00 C ATOM 1206 O GLU A 75 13.343 -2.962 3.212 1.00 0.00 O ATOM 1207 CB GLU A 75 11.119 -5.213 2.681 1.00 0.00 C ATOM 1208 CG GLU A 75 10.313 -4.527 1.586 1.00 0.00 C ATOM 1209 CD GLU A 75 10.817 -4.865 0.195 1.00 0.00 C ATOM 1210 OE1 GLU A 75 11.766 -4.199 -0.269 1.00 0.00 O ATOM 1211 OE2 GLU A 75 10.262 -5.795 -0.428 1.00 0.00 O ATOM 0 H GLU A 75 9.402 -4.299 4.236 1.00 0.00 H new ATOM 0 HA GLU A 75 12.184 -4.851 4.483 1.00 0.00 H new ATOM 0 HB2 GLU A 75 12.041 -5.602 2.248 1.00 0.00 H new ATOM 0 HB3 GLU A 75 10.554 -6.069 3.049 1.00 0.00 H new ATOM 0 HG2 GLU A 75 9.267 -4.821 1.671 1.00 0.00 H new ATOM 0 HG3 GLU A 75 10.354 -3.448 1.731 1.00 0.00 H new ATOM 1218 N VAL A 76 11.318 -1.977 3.197 1.00 0.00 N ATOM 1219 CA VAL A 76 11.836 -0.685 2.747 1.00 0.00 C ATOM 1220 C VAL A 76 11.936 0.296 3.911 1.00 0.00 C ATOM 1221 O VAL A 76 12.215 1.480 3.713 1.00 0.00 O ATOM 1222 CB VAL A 76 10.953 -0.049 1.654 1.00 0.00 C ATOM 1223 CG1 VAL A 76 11.776 0.884 0.780 1.00 0.00 C ATOM 1224 CG2 VAL A 76 10.275 -1.117 0.813 1.00 0.00 C ATOM 0 H VAL A 76 10.309 -2.002 3.344 1.00 0.00 H new ATOM 0 HA VAL A 76 12.824 -0.883 2.332 1.00 0.00 H new ATOM 0 HB VAL A 76 10.175 0.536 2.144 1.00 0.00 H new ATOM 0 HG11 VAL A 76 11.137 1.324 0.014 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.203 1.676 1.395 1.00 0.00 H new ATOM 0 HG13 VAL A 76 12.579 0.322 0.303 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.658 -0.642 0.050 1.00 0.00 H new ATOM 0 HG22 VAL A 76 11.032 -1.738 0.334 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.647 -1.739 1.451 1.00 0.00 H new ATOM 1234 N TYR A 77 11.701 -0.195 5.123 1.00 0.00 N ATOM 1235 CA TYR A 77 11.757 0.646 6.310 1.00 0.00 C ATOM 1236 C TYR A 77 12.241 -0.151 7.519 1.00 0.00 C ATOM 1237 O TYR A 77 11.502 -0.966 8.071 1.00 0.00 O ATOM 1238 CB TYR A 77 10.377 1.245 6.584 1.00 0.00 C ATOM 1239 CG TYR A 77 10.418 2.583 7.291 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.324 2.823 8.319 1.00 0.00 C ATOM 1241 CD2 TYR A 77 9.552 3.606 6.929 1.00 0.00 C ATOM 1242 CE1 TYR A 77 11.362 4.044 8.963 1.00 0.00 C ATOM 1243 CE2 TYR A 77 9.587 4.830 7.567 1.00 0.00 C ATOM 1244 CZ TYR A 77 10.492 5.044 8.584 1.00 0.00 C ATOM 1245 OH TYR A 77 10.529 6.262 9.222 1.00 0.00 O ATOM 0 H TYR A 77 11.470 -1.171 5.308 1.00 0.00 H new ATOM 0 HA TYR A 77 12.468 1.453 6.133 1.00 0.00 H new ATOM 0 HB2 TYR A 77 9.848 1.361 5.638 1.00 0.00 H new ATOM 0 HB3 TYR A 77 9.801 0.544 7.188 1.00 0.00 H new ATOM 0 HD1 TYR A 77 12.008 2.043 8.618 1.00 0.00 H new ATOM 0 HD2 TYR A 77 8.839 3.442 6.135 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.070 4.215 9.760 1.00 0.00 H new ATOM 0 HE2 TYR A 77 8.908 5.616 7.270 1.00 0.00 H new ATOM 0 HH TYR A 77 9.852 6.855 8.834 1.00 0.00 H new ATOM 1255 N PRO A 78 13.498 0.068 7.942 1.00 0.00 N ATOM 1256 CA PRO A 78 14.083 -0.641 9.085 1.00 0.00 C ATOM 1257 C PRO A 78 13.399 -0.302 10.409 1.00 0.00 C ATOM 1258 O PRO A 78 12.976 -1.195 11.143 1.00 0.00 O ATOM 1259 CB PRO A 78 15.538 -0.162 9.103 1.00 0.00 C ATOM 1260 CG PRO A 78 15.534 1.131 8.366 1.00 0.00 C ATOM 1261 CD PRO A 78 14.451 1.017 7.334 1.00 0.00 C ATOM 0 HA PRO A 78 13.973 -1.720 8.980 1.00 0.00 H new ATOM 0 HB2 PRO A 78 15.897 -0.032 10.124 1.00 0.00 H new ATOM 0 HB3 PRO A 78 16.197 -0.886 8.624 1.00 0.00 H new ATOM 0 HG2 PRO A 78 15.342 1.964 9.042 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.501 1.316 7.898 1.00 0.00 H new ATOM 0 HD2 PRO A 78 13.985 1.981 7.133 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.838 0.646 6.385 1.00 0.00 H new ATOM 1269 N GLU A 79 13.302 0.988 10.710 1.00 0.00 N ATOM 1270 CA GLU A 79 12.678 1.443 11.951 1.00 0.00 C ATOM 1271 C GLU A 79 11.289 0.838 12.137 1.00 0.00 C ATOM 1272 O GLU A 79 10.805 0.712 13.261 1.00 0.00 O ATOM 1273 CB GLU A 79 12.587 2.969 11.971 1.00 0.00 C ATOM 1274 CG GLU A 79 12.549 3.557 13.373 1.00 0.00 C ATOM 1275 CD GLU A 79 13.505 4.721 13.545 1.00 0.00 C ATOM 1276 OE1 GLU A 79 14.728 4.477 13.635 1.00 0.00 O ATOM 1277 OE2 GLU A 79 13.033 5.877 13.589 1.00 0.00 O ATOM 0 H GLU A 79 13.647 1.739 10.112 1.00 0.00 H new ATOM 0 HA GLU A 79 13.305 1.107 12.777 1.00 0.00 H new ATOM 0 HB2 GLU A 79 13.441 3.383 11.435 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.692 3.279 11.432 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.535 3.889 13.596 1.00 0.00 H new ATOM 0 HG3 GLU A 79 12.796 2.779 14.096 1.00 0.00 H new ATOM 1284 N ALA A 80 10.648 0.473 11.032 1.00 0.00 N ATOM 1285 CA ALA A 80 9.312 -0.110 11.082 1.00 0.00 C ATOM 1286 C ALA A 80 9.350 -1.546 11.595 1.00 0.00 C ATOM 1287 O ALA A 80 8.409 -2.010 12.239 1.00 0.00 O ATOM 1288 CB ALA A 80 8.663 -0.061 9.710 1.00 0.00 C ATOM 0 H ALA A 80 11.031 0.570 10.092 1.00 0.00 H new ATOM 0 HA ALA A 80 8.717 0.480 11.779 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.667 -0.500 9.763 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.586 0.975 9.381 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.270 -0.623 9.000 1.00 0.00 H new ATOM 1294 N ARG A 81 10.439 -2.248 11.302 1.00 0.00 N ATOM 1295 CA ARG A 81 10.599 -3.635 11.729 1.00 0.00 C ATOM 1296 C ARG A 81 10.448 -3.780 13.244 1.00 0.00 C ATOM 1297 O ARG A 81 10.238 -4.884 13.748 1.00 0.00 O ATOM 1298 CB ARG A 81 11.962 -4.170 11.284 1.00 0.00 C ATOM 1299 CG ARG A 81 11.874 -5.422 10.426 1.00 0.00 C ATOM 1300 CD ARG A 81 12.982 -5.465 9.386 1.00 0.00 C ATOM 1301 NE ARG A 81 13.484 -6.822 9.178 1.00 0.00 N ATOM 1302 CZ ARG A 81 14.371 -7.416 9.973 1.00 0.00 C ATOM 1303 NH1 ARG A 81 14.855 -6.779 11.032 1.00 0.00 N ATOM 1304 NH2 ARG A 81 14.774 -8.651 9.709 1.00 0.00 N ATOM 0 H ARG A 81 11.227 -1.879 10.769 1.00 0.00 H new ATOM 0 HA ARG A 81 9.809 -4.220 11.258 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.483 -3.393 10.725 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.564 -4.386 12.167 1.00 0.00 H new ATOM 0 HG2 ARG A 81 11.936 -6.305 11.062 1.00 0.00 H new ATOM 0 HG3 ARG A 81 10.905 -5.456 9.928 1.00 0.00 H new ATOM 0 HD2 ARG A 81 12.609 -5.068 8.442 1.00 0.00 H new ATOM 0 HD3 ARG A 81 13.801 -4.820 9.702 1.00 0.00 H new ATOM 0 HE ARG A 81 13.134 -7.345 8.376 1.00 0.00 H new ATOM 0 HH11 ARG A 81 14.547 -5.829 11.240 1.00 0.00 H new ATOM 0 HH12 ARG A 81 15.534 -7.239 11.638 1.00 0.00 H new ATOM 0 HH21 ARG A 81 14.404 -9.145 8.897 1.00 0.00 H new ATOM 0 HH22 ARG A 81 15.454 -9.107 10.318 1.00 0.00 H new ATOM 1318 N LYS A 82 10.556 -2.668 13.968 1.00 0.00 N ATOM 1319 CA LYS A 82 10.431 -2.688 15.421 1.00 0.00 C ATOM 1320 C LYS A 82 9.085 -3.267 15.846 1.00 0.00 C ATOM 1321 O LYS A 82 8.053 -2.975 15.239 1.00 0.00 O ATOM 1322 CB LYS A 82 10.599 -1.276 15.986 1.00 0.00 C ATOM 1323 CG LYS A 82 11.833 -1.112 16.858 1.00 0.00 C ATOM 1324 CD LYS A 82 12.433 0.279 16.720 1.00 0.00 C ATOM 1325 CE LYS A 82 12.798 0.864 18.075 1.00 0.00 C ATOM 1326 NZ LYS A 82 11.600 1.370 18.801 1.00 0.00 N ATOM 0 H LYS A 82 10.729 -1.744 13.572 1.00 0.00 H new ATOM 0 HA LYS A 82 11.219 -3.327 15.821 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.652 -0.567 15.160 1.00 0.00 H new ATOM 0 HB3 LYS A 82 9.715 -1.020 16.570 1.00 0.00 H new ATOM 0 HG2 LYS A 82 11.570 -1.294 17.900 1.00 0.00 H new ATOM 0 HG3 LYS A 82 12.577 -1.859 16.582 1.00 0.00 H new ATOM 0 HD2 LYS A 82 13.322 0.232 16.091 1.00 0.00 H new ATOM 0 HD3 LYS A 82 11.722 0.935 16.219 1.00 0.00 H new ATOM 0 HE2 LYS A 82 13.293 0.103 18.678 1.00 0.00 H new ATOM 0 HE3 LYS A 82 13.511 1.677 17.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.780 2.338 19.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.781 1.372 18.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 11.401 0.754 19.615 1.00 0.00 H new ATOM 1340 N LYS A 83 9.103 -4.085 16.892 1.00 0.00 N ATOM 1341 CA LYS A 83 7.883 -4.704 17.399 1.00 0.00 C ATOM 1342 C LYS A 83 7.025 -3.683 18.139 1.00 0.00 C ATOM 1343 O LYS A 83 7.534 -2.877 18.916 1.00 0.00 O ATOM 1344 CB LYS A 83 8.226 -5.869 18.327 1.00 0.00 C ATOM 1345 CG LYS A 83 8.673 -7.121 17.592 1.00 0.00 C ATOM 1346 CD LYS A 83 7.525 -8.102 17.412 1.00 0.00 C ATOM 1347 CE LYS A 83 7.873 -9.189 16.406 1.00 0.00 C ATOM 1348 NZ LYS A 83 6.721 -9.516 15.521 1.00 0.00 N ATOM 0 H LYS A 83 9.948 -4.335 17.406 1.00 0.00 H new ATOM 0 HA LYS A 83 7.315 -5.082 16.549 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.016 -5.558 19.011 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.353 -6.107 18.935 1.00 0.00 H new ATOM 0 HG2 LYS A 83 9.075 -6.847 16.617 1.00 0.00 H new ATOM 0 HG3 LYS A 83 9.480 -7.601 18.146 1.00 0.00 H new ATOM 0 HD2 LYS A 83 7.281 -8.558 18.372 1.00 0.00 H new ATOM 0 HD3 LYS A 83 6.636 -7.566 17.078 1.00 0.00 H new ATOM 0 HE2 LYS A 83 8.717 -8.864 15.798 1.00 0.00 H new ATOM 0 HE3 LYS A 83 8.189 -10.087 16.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 6.651 -10.548 15.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 5.843 -9.153 15.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.863 -9.076 14.589 1.00 0.00 H new ATOM 1362 N GLY A 84 5.721 -3.725 17.890 1.00 0.00 N ATOM 1363 CA GLY A 84 4.813 -2.800 18.540 1.00 0.00 C ATOM 1364 C GLY A 84 4.559 -1.548 17.718 1.00 0.00 C ATOM 1365 O GLY A 84 3.927 -0.606 18.194 1.00 0.00 O ATOM 0 H GLY A 84 5.277 -4.383 17.250 1.00 0.00 H new ATOM 0 HA2 GLY A 84 3.865 -3.303 18.730 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.223 -2.516 19.509 1.00 0.00 H new ATOM 1369 N THR A 85 5.054 -1.533 16.481 1.00 0.00 N ATOM 1370 CA THR A 85 4.872 -0.383 15.603 1.00 0.00 C ATOM 1371 C THR A 85 3.477 -0.381 14.981 1.00 0.00 C ATOM 1372 O THR A 85 3.099 -1.316 14.277 1.00 0.00 O ATOM 1373 CB THR A 85 5.936 -0.391 14.505 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.236 -0.419 15.065 1.00 0.00 O ATOM 1375 CG2 THR A 85 5.856 0.811 13.591 1.00 0.00 C ATOM 0 H THR A 85 5.582 -2.302 16.068 1.00 0.00 H new ATOM 0 HA THR A 85 4.978 0.522 16.201 1.00 0.00 H new ATOM 0 HB THR A 85 5.741 -1.289 13.919 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.631 -1.306 14.931 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.638 0.745 12.834 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.881 0.834 13.105 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.992 1.722 14.175 1.00 0.00 H new ATOM 1383 N HIS A 86 2.721 0.681 15.244 1.00 0.00 N ATOM 1384 CA HIS A 86 1.368 0.816 14.708 1.00 0.00 C ATOM 1385 C HIS A 86 1.358 1.764 13.511 1.00 0.00 C ATOM 1386 O HIS A 86 1.590 2.964 13.659 1.00 0.00 O ATOM 1387 CB HIS A 86 0.397 1.333 15.783 1.00 0.00 C ATOM 1388 CG HIS A 86 0.906 1.220 17.190 1.00 0.00 C ATOM 1389 ND1 HIS A 86 1.945 1.984 17.681 1.00 0.00 N ATOM 1390 CD2 HIS A 86 0.503 0.433 18.217 1.00 0.00 C ATOM 1391 CE1 HIS A 86 2.160 1.669 18.946 1.00 0.00 C ATOM 1392 NE2 HIS A 86 1.300 0.732 19.296 1.00 0.00 N ATOM 0 H HIS A 86 3.022 1.463 15.826 1.00 0.00 H new ATOM 0 HA HIS A 86 1.039 -0.172 14.386 1.00 0.00 H new ATOM 0 HB2 HIS A 86 0.169 2.379 15.576 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -0.540 0.781 15.704 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -0.296 -0.294 18.192 1.00 0.00 H new ATOM 0 HE1 HIS A 86 2.913 2.105 19.586 1.00 0.00 H new ATOM 0 HE2 HIS A 86 1.237 0.300 20.218 1.00 0.00 H new ATOM 1400 N PHE A 87 1.091 1.223 12.324 1.00 0.00 N ATOM 1401 CA PHE A 87 1.061 2.035 11.109 1.00 0.00 C ATOM 1402 C PHE A 87 -0.356 2.153 10.554 1.00 0.00 C ATOM 1403 O PHE A 87 -1.068 1.158 10.420 1.00 0.00 O ATOM 1404 CB PHE A 87 2.001 1.462 10.040 1.00 0.00 C ATOM 1405 CG PHE A 87 2.476 0.067 10.328 1.00 0.00 C ATOM 1406 CD1 PHE A 87 3.347 -0.179 11.378 1.00 0.00 C ATOM 1407 CD2 PHE A 87 2.048 -0.995 9.553 1.00 0.00 C ATOM 1408 CE1 PHE A 87 3.780 -1.461 11.647 1.00 0.00 C ATOM 1409 CE2 PHE A 87 2.478 -2.279 9.817 1.00 0.00 C ATOM 1410 CZ PHE A 87 3.347 -2.514 10.866 1.00 0.00 C ATOM 0 H PHE A 87 0.894 0.233 12.178 1.00 0.00 H new ATOM 0 HA PHE A 87 1.407 3.033 11.377 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.488 1.469 9.078 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.867 2.117 9.944 1.00 0.00 H new ATOM 0 HD1 PHE A 87 3.690 0.641 11.991 1.00 0.00 H new ATOM 0 HD2 PHE A 87 1.369 -0.817 8.732 1.00 0.00 H new ATOM 0 HE1 PHE A 87 4.458 -1.641 12.468 1.00 0.00 H new ATOM 0 HE2 PHE A 87 2.136 -3.100 9.204 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.686 -3.518 11.074 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.752 3.382 10.231 1.00 0.00 N ATOM 1421 CA ASN A 88 -2.081 3.656 9.692 1.00 0.00 C ATOM 1422 C ASN A 88 -2.031 3.831 8.176 1.00 0.00 C ATOM 1423 O ASN A 88 -1.138 4.493 7.649 1.00 0.00 O ATOM 1424 CB ASN A 88 -2.654 4.914 10.348 1.00 0.00 C ATOM 1425 CG ASN A 88 -4.056 5.236 9.873 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -5.000 4.494 10.140 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -4.198 6.352 9.166 1.00 0.00 N ATOM 0 H ASN A 88 -0.165 4.210 10.335 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.726 2.806 9.913 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -2.663 4.782 11.430 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -2.000 5.760 10.135 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -5.119 6.623 8.821 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -3.386 6.937 8.968 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.997 3.234 7.479 1.00 0.00 N ATOM 1435 CA PHE A 89 -3.057 3.331 6.022 1.00 0.00 C ATOM 1436 C PHE A 89 -4.169 4.272 5.571 1.00 0.00 C ATOM 1437 O PHE A 89 -5.332 4.110 5.956 1.00 0.00 O ATOM 1438 CB PHE A 89 -3.270 1.951 5.397 1.00 0.00 C ATOM 1439 CG PHE A 89 -2.237 0.940 5.792 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -1.030 0.857 5.117 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -2.474 0.069 6.840 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -0.080 -0.078 5.484 1.00 0.00 C ATOM 1443 CE2 PHE A 89 -1.534 -0.864 7.211 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.332 -0.940 6.534 1.00 0.00 C ATOM 0 H PHE A 89 -3.745 2.681 7.897 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.103 3.736 5.685 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -4.254 1.581 5.684 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -3.270 2.051 4.312 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -0.829 1.529 4.296 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.411 0.122 7.375 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.858 -0.135 4.951 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.735 -1.537 8.031 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.408 -1.671 6.825 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.794 5.246 4.745 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.735 6.225 4.214 1.00 0.00 C ATOM 1456 C ALA A 90 -4.226 6.796 2.891 1.00 0.00 C ATOM 1457 O ALA A 90 -3.019 6.911 2.678 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.957 7.341 5.223 1.00 0.00 C ATOM 0 H ALA A 90 -2.834 5.377 4.427 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.687 5.727 4.029 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.661 8.066 4.815 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -5.360 6.923 6.145 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -4.009 7.836 5.433 1.00 0.00 H new ATOM 1464 N ILE A 91 -5.153 7.150 2.004 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.792 7.704 0.703 1.00 0.00 C ATOM 1466 C ILE A 91 -4.776 9.230 0.737 1.00 0.00 C ATOM 1467 O ILE A 91 -5.804 9.865 0.980 1.00 0.00 O ATOM 1468 CB ILE A 91 -5.765 7.238 -0.396 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -5.960 5.721 -0.331 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.252 7.654 -1.769 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -7.413 5.299 -0.319 1.00 0.00 C ATOM 0 H ILE A 91 -6.157 7.063 2.162 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.791 7.338 0.472 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.731 7.715 -0.229 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -5.464 5.262 -1.186 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -5.471 5.338 0.565 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -5.950 7.318 -2.536 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.163 8.740 -1.811 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.275 7.203 -1.945 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -7.476 4.212 -0.272 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -7.910 5.729 0.551 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -7.902 5.652 -1.227 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.603 9.812 0.492 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.454 11.265 0.494 1.00 0.00 C ATOM 1485 C VAL A 92 -2.634 11.743 -0.701 1.00 0.00 C ATOM 1486 O VAL A 92 -1.867 10.979 -1.284 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.788 11.764 1.794 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -1.310 11.404 1.819 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -2.977 13.266 1.946 1.00 0.00 C ATOM 0 H VAL A 92 -2.744 9.300 0.290 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.459 11.681 0.427 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.270 11.268 2.636 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.863 11.766 2.745 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.198 10.321 1.761 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.808 11.866 0.969 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.501 13.601 2.868 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.524 13.778 1.097 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -4.042 13.497 1.982 1.00 0.00 H new ATOM 1673 N VAL A 103 -8.259 13.295 1.754 1.00 0.00 N ATOM 1674 CA VAL A 103 -7.506 12.165 2.283 1.00 0.00 C ATOM 1675 C VAL A 103 -8.353 11.364 3.268 1.00 0.00 C ATOM 1676 O VAL A 103 -9.052 11.934 4.105 1.00 0.00 O ATOM 1677 CB VAL A 103 -6.210 12.636 2.978 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -6.511 13.748 3.970 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -5.500 11.475 3.664 1.00 0.00 C ATOM 0 HA VAL A 103 -7.239 11.526 1.441 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.540 13.029 2.213 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.586 14.067 4.450 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.958 14.592 3.445 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.205 13.382 4.727 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.591 11.837 4.145 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -6.158 11.039 4.415 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.242 10.718 2.924 1.00 0.00 H new ATOM 1689 N LYS A 104 -8.288 10.041 3.159 1.00 0.00 N ATOM 1690 CA LYS A 104 -9.053 9.166 4.041 1.00 0.00 C ATOM 1691 C LYS A 104 -8.286 7.885 4.351 1.00 0.00 C ATOM 1692 O LYS A 104 -7.500 7.406 3.533 1.00 0.00 O ATOM 1693 CB LYS A 104 -10.402 8.824 3.405 1.00 0.00 C ATOM 1694 CG LYS A 104 -11.450 9.915 3.575 1.00 0.00 C ATOM 1695 CD LYS A 104 -12.568 9.483 4.513 1.00 0.00 C ATOM 1696 CE LYS A 104 -13.911 9.441 3.801 1.00 0.00 C ATOM 1697 NZ LYS A 104 -14.438 10.806 3.526 1.00 0.00 N ATOM 0 H LYS A 104 -7.715 9.552 2.471 1.00 0.00 H new ATOM 0 HA LYS A 104 -9.220 9.698 4.978 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.255 8.635 2.342 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.777 7.900 3.844 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -10.977 10.816 3.964 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -11.870 10.170 2.602 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -12.341 8.498 4.921 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -12.624 10.172 5.356 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -13.807 8.896 2.863 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -14.628 8.891 4.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -15.355 10.733 3.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -14.562 11.318 4.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -13.766 11.322 2.923 1.00 0.00 H new ATOM 1711 N GLU A 105 -8.524 7.335 5.537 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.862 6.107 5.963 1.00 0.00 C ATOM 1713 C GLU A 105 -8.785 4.906 5.776 1.00 0.00 C ATOM 1714 O GLU A 105 -10.007 5.026 5.871 1.00 0.00 O ATOM 1715 CB GLU A 105 -7.416 6.237 7.427 1.00 0.00 C ATOM 1716 CG GLU A 105 -6.978 4.931 8.076 1.00 0.00 C ATOM 1717 CD GLU A 105 -7.615 4.714 9.435 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -7.403 5.557 10.330 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -8.325 3.700 9.602 1.00 0.00 O ATOM 0 H GLU A 105 -9.173 7.722 6.223 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.979 5.947 5.344 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.591 6.948 7.480 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.237 6.658 8.007 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.236 4.099 7.421 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.893 4.928 8.182 1.00 0.00 H new ATOM 1726 N ILE A 106 -8.191 3.748 5.505 1.00 0.00 N ATOM 1727 CA ILE A 106 -8.958 2.525 5.301 1.00 0.00 C ATOM 1728 C ILE A 106 -8.674 1.489 6.386 1.00 0.00 C ATOM 1729 O ILE A 106 -9.486 0.596 6.627 1.00 0.00 O ATOM 1730 CB ILE A 106 -8.685 1.894 3.915 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -7.182 1.849 3.616 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -9.424 2.666 2.833 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -6.496 0.608 4.145 1.00 0.00 C ATOM 0 H ILE A 106 -7.181 3.631 5.422 1.00 0.00 H new ATOM 0 HA ILE A 106 -10.007 2.817 5.354 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.053 0.868 3.927 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.033 1.905 2.538 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.707 2.729 4.050 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -9.224 2.213 1.862 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.495 2.638 3.033 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.083 3.701 2.827 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.435 0.645 3.897 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.614 0.561 5.228 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.944 -0.276 3.692 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.523 1.609 7.045 1.00 0.00 N ATOM 1746 CA GLY A 107 -7.181 0.667 8.102 1.00 0.00 C ATOM 1747 C GLY A 107 -5.721 0.747 8.505 1.00 0.00 C ATOM 1748 O GLY A 107 -4.901 1.275 7.758 1.00 0.00 O ATOM 0 H GLY A 107 -6.827 2.333 6.870 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.806 0.862 8.974 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.407 -0.346 7.768 1.00 0.00 H new ATOM 1752 N SER A 108 -5.404 0.224 9.682 1.00 0.00 N ATOM 1753 CA SER A 108 -4.033 0.252 10.194 1.00 0.00 C ATOM 1754 C SER A 108 -3.577 -1.136 10.636 1.00 0.00 C ATOM 1755 O SER A 108 -4.339 -1.888 11.243 1.00 0.00 O ATOM 1756 CB SER A 108 -3.934 1.225 11.372 1.00 0.00 C ATOM 1757 OG SER A 108 -4.848 2.295 11.221 1.00 0.00 O ATOM 0 H SER A 108 -6.076 -0.226 10.304 1.00 0.00 H new ATOM 0 HA SER A 108 -3.381 0.585 9.387 1.00 0.00 H new ATOM 0 HB2 SER A 108 -4.137 0.697 12.303 1.00 0.00 H new ATOM 0 HB3 SER A 108 -2.919 1.616 11.442 1.00 0.00 H new ATOM 0 HG SER A 108 -4.509 2.922 10.549 1.00 0.00 H new ATOM 1763 N THR A 109 -2.320 -1.463 10.340 1.00 0.00 N ATOM 1764 CA THR A 109 -1.752 -2.754 10.723 1.00 0.00 C ATOM 1765 C THR A 109 -0.689 -2.561 11.800 1.00 0.00 C ATOM 1766 O THR A 109 -0.566 -1.480 12.373 1.00 0.00 O ATOM 1767 CB THR A 109 -1.158 -3.481 9.515 1.00 0.00 C ATOM 1768 OG1 THR A 109 -0.150 -2.703 8.891 1.00 0.00 O ATOM 1769 CG2 THR A 109 -2.188 -3.832 8.465 1.00 0.00 C ATOM 0 H THR A 109 -1.676 -0.852 9.837 1.00 0.00 H new ATOM 0 HA THR A 109 -2.556 -3.372 11.122 1.00 0.00 H new ATOM 0 HB THR A 109 -0.740 -4.404 9.917 1.00 0.00 H new ATOM 0 HG1 THR A 109 0.517 -2.436 9.558 1.00 0.00 H new ATOM 0 HG21 THR A 109 -1.702 -4.345 7.636 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.945 -4.484 8.901 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.661 -2.920 8.100 1.00 0.00 H new ATOM 1777 N MET A 110 0.073 -3.612 12.078 1.00 0.00 N ATOM 1778 CA MET A 110 1.112 -3.540 13.095 1.00 0.00 C ATOM 1779 C MET A 110 2.259 -4.495 12.783 1.00 0.00 C ATOM 1780 O MET A 110 2.080 -5.494 12.085 1.00 0.00 O ATOM 1781 CB MET A 110 0.523 -3.860 14.466 1.00 0.00 C ATOM 1782 CG MET A 110 -0.270 -2.716 15.072 1.00 0.00 C ATOM 1783 SD MET A 110 0.023 -2.533 16.840 1.00 0.00 S ATOM 1784 CE MET A 110 1.811 -2.428 16.876 1.00 0.00 C ATOM 0 H MET A 110 -0.009 -4.518 11.616 1.00 0.00 H new ATOM 0 HA MET A 110 1.510 -2.525 13.101 1.00 0.00 H new ATOM 0 HB2 MET A 110 -0.124 -4.733 14.379 1.00 0.00 H new ATOM 0 HB3 MET A 110 1.332 -4.129 15.145 1.00 0.00 H new ATOM 0 HG2 MET A 110 -0.007 -1.787 14.565 1.00 0.00 H new ATOM 0 HG3 MET A 110 -1.333 -2.883 14.899 1.00 0.00 H new ATOM 0 HE1 MET A 110 2.196 -3.048 17.686 1.00 0.00 H new ATOM 0 HE2 MET A 110 2.215 -2.779 15.927 1.00 0.00 H new ATOM 0 HE3 MET A 110 2.111 -1.393 17.038 1.00 0.00 H new ATOM 1794 N SER A 111 3.441 -4.174 13.301 1.00 0.00 N ATOM 1795 CA SER A 111 4.628 -4.992 13.078 1.00 0.00 C ATOM 1796 C SER A 111 4.531 -6.327 13.811 1.00 0.00 C ATOM 1797 O SER A 111 4.874 -6.426 14.989 1.00 0.00 O ATOM 1798 CB SER A 111 5.878 -4.240 13.537 1.00 0.00 C ATOM 1799 OG SER A 111 6.477 -3.541 12.458 1.00 0.00 O ATOM 0 H SER A 111 3.602 -3.350 13.880 1.00 0.00 H new ATOM 0 HA SER A 111 4.697 -5.195 12.009 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.614 -3.538 14.328 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.594 -4.943 13.961 1.00 0.00 H new ATOM 0 HG SER A 111 7.206 -2.980 12.796 1.00 0.00 H new ATOM 1805 N GLY A 112 4.074 -7.355 13.104 1.00 0.00 N ATOM 1806 CA GLY A 112 3.954 -8.673 13.700 1.00 0.00 C ATOM 1807 C GLY A 112 2.694 -8.838 14.531 1.00 0.00 C ATOM 1808 O GLY A 112 2.639 -9.692 15.416 1.00 0.00 O ATOM 0 H GLY A 112 3.784 -7.299 12.128 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.962 -9.424 12.910 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.824 -8.862 14.329 1.00 0.00 H new ATOM 1812 N ARG A 113 1.681 -8.029 14.246 1.00 0.00 N ATOM 1813 CA ARG A 113 0.420 -8.102 14.976 1.00 0.00 C ATOM 1814 C ARG A 113 -0.753 -8.208 14.008 1.00 0.00 C ATOM 1815 O ARG A 113 -0.906 -7.385 13.105 1.00 0.00 O ATOM 1816 CB ARG A 113 0.257 -6.879 15.878 1.00 0.00 C ATOM 1817 CG ARG A 113 0.861 -7.057 17.262 1.00 0.00 C ATOM 1818 CD ARG A 113 2.229 -6.397 17.357 1.00 0.00 C ATOM 1819 NE ARG A 113 2.427 -5.728 18.642 1.00 0.00 N ATOM 1820 CZ ARG A 113 2.982 -6.306 19.707 1.00 0.00 C ATOM 1821 NH1 ARG A 113 3.380 -7.571 19.658 1.00 0.00 N ATOM 1822 NH2 ARG A 113 3.134 -5.615 20.829 1.00 0.00 N ATOM 0 H ARG A 113 1.707 -7.316 13.517 1.00 0.00 H new ATOM 0 HA ARG A 113 0.433 -8.996 15.600 1.00 0.00 H new ATOM 0 HB2 ARG A 113 0.721 -6.019 15.396 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.804 -6.653 15.981 1.00 0.00 H new ATOM 0 HG2 ARG A 113 0.195 -6.627 18.010 1.00 0.00 H new ATOM 0 HG3 ARG A 113 0.951 -8.120 17.488 1.00 0.00 H new ATOM 0 HD2 ARG A 113 3.005 -7.150 17.217 1.00 0.00 H new ATOM 0 HD3 ARG A 113 2.339 -5.672 16.550 1.00 0.00 H new ATOM 0 HE ARG A 113 2.121 -4.759 18.729 1.00 0.00 H new ATOM 0 HH11 ARG A 113 3.262 -8.110 18.800 1.00 0.00 H new ATOM 0 HH12 ARG A 113 3.804 -8.004 20.478 1.00 0.00 H new ATOM 0 HH21 ARG A 113 2.826 -4.644 20.875 1.00 0.00 H new ATOM 0 HH22 ARG A 113 3.558 -6.055 21.645 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.573 -9.238 14.193 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.725 -9.466 13.328 1.00 0.00 C ATOM 1838 C LYS A 114 -3.922 -8.617 13.748 1.00 0.00 C ATOM 1839 O LYS A 114 -4.608 -8.929 14.721 1.00 0.00 O ATOM 1840 CB LYS A 114 -3.108 -10.947 13.341 1.00 0.00 C ATOM 1841 CG LYS A 114 -3.932 -11.374 12.137 1.00 0.00 C ATOM 1842 CD LYS A 114 -3.123 -12.237 11.183 1.00 0.00 C ATOM 1843 CE LYS A 114 -3.992 -12.807 10.073 1.00 0.00 C ATOM 1844 NZ LYS A 114 -4.142 -11.851 8.940 1.00 0.00 N ATOM 0 H LYS A 114 -1.461 -9.929 14.935 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.443 -9.171 12.317 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.200 -11.548 13.380 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.671 -11.160 14.250 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -4.809 -11.927 12.473 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -4.294 -10.490 11.611 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.318 -11.644 10.748 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -2.656 -13.052 11.736 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -3.553 -13.736 9.709 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -4.976 -13.054 10.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.741 -12.276 8.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.584 -10.974 9.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.206 -11.635 8.542 1.00 0.00 H new ATOM 1858 N GLY A 115 -4.179 -7.554 12.990 1.00 0.00 N ATOM 1859 CA GLY A 115 -5.310 -6.689 13.280 1.00 0.00 C ATOM 1860 C GLY A 115 -6.545 -7.115 12.521 1.00 0.00 C ATOM 1861 O GLY A 115 -6.586 -8.205 11.947 1.00 0.00 O ATOM 0 H GLY A 115 -3.624 -7.276 12.180 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -5.516 -6.705 14.350 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -5.059 -5.661 13.019 1.00 0.00 H new ATOM 1865 N THR A 116 -7.544 -6.274 12.506 1.00 0.00 N ATOM 1866 CA THR A 116 -8.800 -6.583 11.785 1.00 0.00 C ATOM 1867 C THR A 116 -8.704 -6.178 10.316 1.00 0.00 C ATOM 1868 O THR A 116 -9.274 -6.828 9.438 1.00 0.00 O ATOM 1869 CB THR A 116 -9.994 -5.875 12.437 1.00 0.00 C ATOM 1870 OG1 THR A 116 -9.650 -4.548 12.787 1.00 0.00 O ATOM 1871 CG2 THR A 116 -10.485 -6.572 13.689 1.00 0.00 C ATOM 0 H THR A 116 -7.536 -5.368 12.975 1.00 0.00 H new ATOM 0 HA THR A 116 -8.953 -7.661 11.843 1.00 0.00 H new ATOM 0 HB THR A 116 -10.792 -5.893 11.695 1.00 0.00 H new ATOM 0 HG1 THR A 116 -10.422 -4.108 13.200 1.00 0.00 H new ATOM 0 HG21 THR A 116 -11.331 -6.023 14.103 1.00 0.00 H new ATOM 0 HG22 THR A 116 -10.797 -7.587 13.442 1.00 0.00 H new ATOM 0 HG23 THR A 116 -9.681 -6.609 14.424 1.00 0.00 H new ATOM 1879 N ASP A 117 -7.972 -5.099 10.057 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.788 -4.604 8.697 1.00 0.00 C ATOM 1881 C ASP A 117 -6.751 -5.429 7.945 1.00 0.00 C ATOM 1882 O ASP A 117 -6.776 -5.513 6.719 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.372 -3.130 8.719 1.00 0.00 C ATOM 1884 CG ASP A 117 -8.220 -2.300 9.661 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -9.334 -1.904 9.260 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -7.771 -2.046 10.799 1.00 0.00 O ATOM 0 H ASP A 117 -7.496 -4.550 10.772 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.740 -4.698 8.175 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.326 -3.056 9.017 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.447 -2.720 7.712 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.832 -6.039 8.692 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.780 -6.863 8.103 1.00 0.00 C ATOM 1893 C ASP A 118 -5.347 -7.854 7.089 1.00 0.00 C ATOM 1894 O ASP A 118 -4.766 -8.070 6.027 1.00 0.00 O ATOM 1895 CB ASP A 118 -4.029 -7.618 9.202 1.00 0.00 C ATOM 1896 CG ASP A 118 -2.545 -7.738 8.912 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -1.999 -6.843 8.234 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -1.930 -8.727 9.364 1.00 0.00 O ATOM 0 H ASP A 118 -5.796 -5.977 9.709 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.091 -6.200 7.579 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.170 -7.104 10.153 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.457 -8.615 9.311 1.00 0.00 H new ATOM 1903 N SER A 119 -6.483 -8.458 7.427 1.00 0.00 N ATOM 1904 CA SER A 119 -7.123 -9.429 6.547 1.00 0.00 C ATOM 1905 C SER A 119 -7.743 -8.754 5.322 1.00 0.00 C ATOM 1906 O SER A 119 -8.144 -9.427 4.372 1.00 0.00 O ATOM 1907 CB SER A 119 -8.196 -10.210 7.309 1.00 0.00 C ATOM 1908 OG SER A 119 -9.242 -9.355 7.738 1.00 0.00 O ATOM 0 H SER A 119 -6.978 -8.292 8.303 1.00 0.00 H new ATOM 0 HA SER A 119 -6.353 -10.118 6.200 1.00 0.00 H new ATOM 0 HB2 SER A 119 -8.602 -10.994 6.670 1.00 0.00 H new ATOM 0 HB3 SER A 119 -7.748 -10.702 8.172 1.00 0.00 H new ATOM 0 HG SER A 119 -8.891 -8.706 8.383 1.00 0.00 H new ATOM 1914 N MET A 120 -7.810 -7.427 5.343 1.00 0.00 N ATOM 1915 CA MET A 120 -8.372 -6.672 4.228 1.00 0.00 C ATOM 1916 C MET A 120 -7.346 -6.546 3.108 1.00 0.00 C ATOM 1917 O MET A 120 -6.153 -6.722 3.335 1.00 0.00 O ATOM 1918 CB MET A 120 -8.810 -5.283 4.696 1.00 0.00 C ATOM 1919 CG MET A 120 -10.115 -4.813 4.072 1.00 0.00 C ATOM 1920 SD MET A 120 -11.115 -3.829 5.208 1.00 0.00 S ATOM 1921 CE MET A 120 -9.934 -2.577 5.706 1.00 0.00 C ATOM 0 H MET A 120 -7.482 -6.852 6.119 1.00 0.00 H new ATOM 0 HA MET A 120 -9.244 -7.206 3.850 1.00 0.00 H new ATOM 0 HB2 MET A 120 -8.918 -5.292 5.781 1.00 0.00 H new ATOM 0 HB3 MET A 120 -8.025 -4.565 4.460 1.00 0.00 H new ATOM 0 HG2 MET A 120 -9.896 -4.222 3.182 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.690 -5.680 3.746 1.00 0.00 H new ATOM 0 HE1 MET A 120 -10.277 -2.097 6.622 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.964 -3.041 5.881 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.841 -1.830 4.918 1.00 0.00 H new ATOM 1931 N THR A 121 -7.813 -6.244 1.902 1.00 0.00 N ATOM 1932 CA THR A 121 -6.920 -6.098 0.756 1.00 0.00 C ATOM 1933 C THR A 121 -6.852 -4.645 0.304 1.00 0.00 C ATOM 1934 O THR A 121 -7.776 -3.867 0.542 1.00 0.00 O ATOM 1935 CB THR A 121 -7.386 -6.987 -0.399 1.00 0.00 C ATOM 1936 OG1 THR A 121 -8.799 -7.039 -0.451 1.00 0.00 O ATOM 1937 CG2 THR A 121 -6.875 -8.408 -0.302 1.00 0.00 C ATOM 0 H THR A 121 -8.800 -6.096 1.692 1.00 0.00 H new ATOM 0 HA THR A 121 -5.922 -6.411 1.062 1.00 0.00 H new ATOM 0 HB THR A 121 -6.975 -6.532 -1.300 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.078 -7.610 -1.197 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.242 -8.985 -1.151 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.785 -8.404 -0.309 1.00 0.00 H new ATOM 0 HG23 THR A 121 -7.230 -8.860 0.624 1.00 0.00 H new ATOM 1945 N LEU A 122 -5.752 -4.280 -0.346 1.00 0.00 N ATOM 1946 CA LEU A 122 -5.575 -2.913 -0.831 1.00 0.00 C ATOM 1947 C LEU A 122 -6.661 -2.555 -1.843 1.00 0.00 C ATOM 1948 O LEU A 122 -7.278 -1.493 -1.760 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.192 -2.745 -1.464 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.374 -1.565 -0.933 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -2.009 -1.518 -1.607 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -4.123 -0.258 -1.145 1.00 0.00 C ATOM 0 H LEU A 122 -4.973 -4.906 -0.549 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.657 -2.237 0.020 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.623 -3.661 -1.306 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.314 -2.627 -2.541 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.224 -1.702 0.138 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.440 -0.673 -1.218 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.470 -2.443 -1.403 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.138 -1.404 -2.683 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.526 0.570 -0.761 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.305 -0.111 -2.210 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.075 -0.294 -0.616 1.00 0.00 H new ATOM 1964 N GLN A 123 -6.892 -3.455 -2.795 1.00 0.00 N ATOM 1965 CA GLN A 123 -7.906 -3.242 -3.821 1.00 0.00 C ATOM 1966 C GLN A 123 -9.252 -2.889 -3.192 1.00 0.00 C ATOM 1967 O GLN A 123 -10.024 -2.105 -3.745 1.00 0.00 O ATOM 1968 CB GLN A 123 -8.052 -4.493 -4.689 1.00 0.00 C ATOM 1969 CG GLN A 123 -8.386 -5.747 -3.895 1.00 0.00 C ATOM 1970 CD GLN A 123 -8.838 -6.894 -4.778 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -9.407 -6.682 -5.848 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -8.585 -8.118 -4.330 1.00 0.00 N ATOM 0 H GLN A 123 -6.390 -4.339 -2.876 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.586 -2.408 -4.445 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -8.833 -4.323 -5.430 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -7.124 -4.656 -5.237 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -7.510 -6.056 -3.325 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -9.171 -5.518 -3.174 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -8.110 -8.246 -3.436 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -8.865 -8.930 -4.880 1.00 0.00 H new ATOM 1981 N SER A 124 -9.524 -3.471 -2.028 1.00 0.00 N ATOM 1982 CA SER A 124 -10.773 -3.217 -1.316 1.00 0.00 C ATOM 1983 C SER A 124 -10.788 -1.815 -0.710 1.00 0.00 C ATOM 1984 O SER A 124 -11.823 -1.350 -0.234 1.00 0.00 O ATOM 1985 CB SER A 124 -10.978 -4.261 -0.217 1.00 0.00 C ATOM 1986 OG SER A 124 -12.348 -4.386 0.117 1.00 0.00 O ATOM 0 H SER A 124 -8.896 -4.122 -1.557 1.00 0.00 H new ATOM 0 HA SER A 124 -11.589 -3.287 -2.035 1.00 0.00 H new ATOM 0 HB2 SER A 124 -10.592 -5.225 -0.550 1.00 0.00 H new ATOM 0 HB3 SER A 124 -10.409 -3.978 0.669 1.00 0.00 H new ATOM 0 HG SER A 124 -12.752 -3.495 0.181 1.00 0.00 H new ATOM 1992 N GLN A 125 -9.638 -1.144 -0.732 1.00 0.00 N ATOM 1993 CA GLN A 125 -9.529 0.204 -0.186 1.00 0.00 C ATOM 1994 C GLN A 125 -9.710 1.253 -1.281 1.00 0.00 C ATOM 1995 O GLN A 125 -9.291 2.401 -1.126 1.00 0.00 O ATOM 1996 CB GLN A 125 -8.171 0.402 0.495 1.00 0.00 C ATOM 1997 CG GLN A 125 -7.603 -0.861 1.125 1.00 0.00 C ATOM 1998 CD GLN A 125 -8.362 -1.292 2.364 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -9.516 -0.913 2.564 1.00 0.00 O ATOM 2000 NE2 GLN A 125 -7.714 -2.089 3.205 1.00 0.00 N ATOM 0 H GLN A 125 -8.771 -1.513 -1.122 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.321 0.328 0.553 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.460 0.780 -0.239 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -8.271 1.166 1.266 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.624 -1.668 0.393 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -6.558 -0.694 1.385 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -6.758 -2.378 2.999 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -8.172 -2.412 4.057 1.00 0.00 H new ATOM 2009 N LYS A 126 -10.327 0.851 -2.389 1.00 0.00 N ATOM 2010 CA LYS A 126 -10.555 1.758 -3.509 1.00 0.00 C ATOM 2011 C LYS A 126 -9.232 2.256 -4.091 1.00 0.00 C ATOM 2012 O LYS A 126 -9.203 3.248 -4.821 1.00 0.00 O ATOM 2013 CB LYS A 126 -11.413 2.946 -3.068 1.00 0.00 C ATOM 2014 CG LYS A 126 -12.838 2.565 -2.705 1.00 0.00 C ATOM 2015 CD LYS A 126 -12.973 2.256 -1.222 1.00 0.00 C ATOM 2016 CE LYS A 126 -12.955 3.524 -0.385 1.00 0.00 C ATOM 2017 NZ LYS A 126 -13.531 3.303 0.971 1.00 0.00 N ATOM 0 H LYS A 126 -10.677 -0.096 -2.535 1.00 0.00 H new ATOM 0 HA LYS A 126 -11.085 1.206 -4.285 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -10.943 3.424 -2.208 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -11.436 3.684 -3.870 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -13.512 3.379 -2.971 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -13.143 1.696 -3.288 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -13.903 1.715 -1.045 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -12.159 1.601 -0.910 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -11.930 3.882 -0.290 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -13.519 4.304 -0.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -13.500 4.192 1.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -14.518 2.986 0.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -12.978 2.577 1.469 1.00 0.00 H new ATOM 2031 N PHE A 127 -8.142 1.565 -3.769 1.00 0.00 N ATOM 2032 CA PHE A 127 -6.825 1.943 -4.267 1.00 0.00 C ATOM 2033 C PHE A 127 -6.606 1.419 -5.682 1.00 0.00 C ATOM 2034 O PHE A 127 -7.307 0.516 -6.136 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.733 1.406 -3.339 1.00 0.00 C ATOM 2036 CG PHE A 127 -4.401 2.063 -3.542 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -4.080 3.234 -2.875 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -3.468 1.512 -4.407 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -2.855 3.843 -3.065 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -2.241 2.116 -4.600 1.00 0.00 C ATOM 2041 CZ PHE A 127 -1.935 3.283 -3.929 1.00 0.00 C ATOM 0 H PHE A 127 -8.146 0.742 -3.166 1.00 0.00 H new ATOM 0 HA PHE A 127 -6.772 3.031 -4.290 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -6.045 1.547 -2.304 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.628 0.333 -3.497 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -4.796 3.676 -2.198 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -3.703 0.600 -4.936 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -2.617 4.756 -2.539 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.522 1.676 -5.275 1.00 0.00 H new ATOM 0 HZ PHE A 127 -0.977 3.758 -4.080 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.626 1.992 -6.374 1.00 0.00 N ATOM 2052 CA GLN A 128 -5.312 1.582 -7.737 1.00 0.00 C ATOM 2053 C GLN A 128 -3.819 1.720 -8.015 1.00 0.00 C ATOM 2054 O GLN A 128 -3.079 2.294 -7.217 1.00 0.00 O ATOM 2055 CB GLN A 128 -6.109 2.418 -8.741 1.00 0.00 C ATOM 2056 CG GLN A 128 -7.555 1.969 -8.891 1.00 0.00 C ATOM 2057 CD GLN A 128 -8.434 3.037 -9.513 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -8.716 3.006 -10.710 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -8.872 3.990 -8.698 1.00 0.00 N ATOM 0 H GLN A 128 -5.036 2.742 -6.013 1.00 0.00 H new ATOM 0 HA GLN A 128 -5.589 0.534 -7.848 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -6.091 3.462 -8.428 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -5.619 2.369 -9.713 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -7.591 1.070 -9.506 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -7.952 1.701 -7.912 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -8.613 3.976 -7.712 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -9.467 4.736 -9.059 1.00 0.00 H new ATOM 2068 N ILE A 129 -3.381 1.191 -9.153 1.00 0.00 N ATOM 2069 CA ILE A 129 -1.976 1.257 -9.536 1.00 0.00 C ATOM 2070 C ILE A 129 -1.559 2.689 -9.850 1.00 0.00 C ATOM 2071 O ILE A 129 -1.981 3.262 -10.855 1.00 0.00 O ATOM 2072 CB ILE A 129 -1.684 0.365 -10.759 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -2.202 -1.054 -10.517 1.00 0.00 C ATOM 2074 CG2 ILE A 129 -0.193 0.345 -11.059 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -2.036 -1.971 -11.710 1.00 0.00 C ATOM 0 H ILE A 129 -3.979 0.712 -9.826 1.00 0.00 H new ATOM 0 HA ILE A 129 -1.398 0.893 -8.686 1.00 0.00 H new ATOM 0 HB ILE A 129 -2.202 0.780 -11.623 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -1.677 -1.483 -9.664 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -3.258 -1.006 -10.250 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -0.005 -0.289 -11.925 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.149 1.358 -11.270 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.346 -0.048 -10.197 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -2.425 -2.960 -11.466 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -2.584 -1.565 -12.560 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.979 -2.050 -11.964 1.00 0.00 H new ATOM 2087 N GLY A 130 -0.730 3.261 -8.984 1.00 0.00 N ATOM 2088 CA GLY A 130 -0.270 4.623 -9.187 1.00 0.00 C ATOM 2089 C GLY A 130 -0.813 5.587 -8.148 1.00 0.00 C ATOM 2090 O GLY A 130 -0.329 6.710 -8.024 1.00 0.00 O ATOM 0 H GLY A 130 -0.368 2.807 -8.145 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.819 4.642 -9.159 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.570 4.959 -10.180 1.00 0.00 H new ATOM 2094 N ASP A 131 -1.823 5.150 -7.399 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.428 5.987 -6.372 1.00 0.00 C ATOM 2096 C ASP A 131 -1.430 6.309 -5.275 1.00 0.00 C ATOM 2097 O ASP A 131 -0.406 5.638 -5.115 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.662 5.301 -5.779 1.00 0.00 C ATOM 2099 CG ASP A 131 -4.955 5.821 -6.375 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -5.124 5.721 -7.610 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -5.800 6.328 -5.608 1.00 0.00 O ATOM 0 H ASP A 131 -2.237 4.222 -7.486 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.736 6.922 -6.839 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.593 4.226 -5.948 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -3.676 5.453 -4.700 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.722 7.356 -4.511 1.00 0.00 N ATOM 2107 CA TYR A 132 -0.848 7.786 -3.426 1.00 0.00 C ATOM 2108 C TYR A 132 -1.284 7.198 -2.081 1.00 0.00 C ATOM 2109 O TYR A 132 -2.267 7.641 -1.480 1.00 0.00 O ATOM 2110 CB TYR A 132 -0.836 9.316 -3.334 1.00 0.00 C ATOM 2111 CG TYR A 132 -0.652 10.000 -4.669 1.00 0.00 C ATOM 2112 CD1 TYR A 132 0.256 9.517 -5.602 1.00 0.00 C ATOM 2113 CD2 TYR A 132 -1.391 11.132 -4.997 1.00 0.00 C ATOM 2114 CE1 TYR A 132 0.425 10.142 -6.824 1.00 0.00 C ATOM 2115 CE2 TYR A 132 -1.229 11.761 -6.216 1.00 0.00 C ATOM 2116 CZ TYR A 132 -0.319 11.262 -7.126 1.00 0.00 C ATOM 2117 OH TYR A 132 -0.156 11.887 -8.342 1.00 0.00 O ATOM 0 H TYR A 132 -2.561 7.925 -4.624 1.00 0.00 H new ATOM 0 HA TYR A 132 0.155 7.421 -3.648 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.772 9.652 -2.889 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -0.035 9.625 -2.663 1.00 0.00 H new ATOM 0 HD1 TYR A 132 0.840 8.639 -5.369 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -2.103 11.526 -4.287 1.00 0.00 H new ATOM 0 HE1 TYR A 132 1.136 9.754 -7.538 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -1.811 12.638 -6.456 1.00 0.00 H new ATOM 0 HH TYR A 132 -0.756 12.660 -8.396 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.537 6.198 -1.615 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.836 5.538 -0.354 1.00 0.00 C ATOM 2129 C LEU A 133 0.094 6.040 0.722 1.00 0.00 C ATOM 2130 O LEU A 133 1.313 5.846 0.666 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.690 4.023 -0.498 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.656 3.178 0.337 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.285 3.236 1.809 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -3.093 3.634 0.125 1.00 0.00 C ATOM 0 H LEU A 133 0.282 5.829 -2.098 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.865 5.767 -0.076 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -0.823 3.762 -1.548 1.00 0.00 H new ATOM 0 HB3 LEU A 133 0.330 3.748 -0.228 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.576 2.143 0.006 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -1.984 2.629 2.385 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.274 2.852 1.945 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.331 4.268 2.155 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -3.762 3.020 0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.191 4.678 0.423 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.356 3.531 -0.928 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.446 6.719 1.771 1.00 0.00 N ATOM 2147 CA ASP A 134 0.370 7.235 2.830 1.00 0.00 C ATOM 2148 C ASP A 134 0.228 6.382 4.094 1.00 0.00 C ATOM 2149 O ASP A 134 -0.878 6.149 4.590 1.00 0.00 O ATOM 2150 CB ASP A 134 -0.057 8.679 3.153 1.00 0.00 C ATOM 2151 CG ASP A 134 1.108 9.539 3.612 1.00 0.00 C ATOM 2152 OD1 ASP A 134 1.667 9.257 4.692 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.462 10.493 2.887 1.00 0.00 O ATOM 0 H ASP A 134 -1.443 6.905 1.877 1.00 0.00 H new ATOM 0 HA ASP A 134 1.409 7.212 2.502 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.510 9.127 2.269 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -0.822 8.664 3.930 1.00 0.00 H new ATOM 2158 N ILE A 135 1.360 5.926 4.618 1.00 0.00 N ATOM 2159 CA ILE A 135 1.369 5.098 5.818 1.00 0.00 C ATOM 2160 C ILE A 135 1.932 5.860 7.014 1.00 0.00 C ATOM 2161 O ILE A 135 3.087 6.284 7.009 1.00 0.00 O ATOM 2162 CB ILE A 135 2.182 3.800 5.596 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.468 2.895 4.587 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.399 3.063 6.913 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.275 2.628 3.336 1.00 0.00 C ATOM 0 H ILE A 135 2.284 6.116 4.230 1.00 0.00 H new ATOM 0 HA ILE A 135 0.334 4.832 6.031 1.00 0.00 H new ATOM 0 HB ILE A 135 3.159 4.071 5.195 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.232 1.945 5.067 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.520 3.354 4.307 1.00 0.00 H new ATOM 0 HG21 ILE A 135 2.973 2.154 6.731 1.00 0.00 H new ATOM 0 HG22 ILE A 135 2.946 3.705 7.604 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.434 2.802 7.347 1.00 0.00 H new ATOM 0 HD11 ILE A 135 1.707 1.981 2.668 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.489 3.571 2.833 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.212 2.140 3.605 1.00 0.00 H new ATOM 2177 N ALA A 136 1.108 6.021 8.042 1.00 0.00 N ATOM 2178 CA ALA A 136 1.521 6.721 9.251 1.00 0.00 C ATOM 2179 C ALA A 136 2.050 5.733 10.285 1.00 0.00 C ATOM 2180 O ALA A 136 1.275 5.068 10.968 1.00 0.00 O ATOM 2181 CB ALA A 136 0.355 7.516 9.821 1.00 0.00 C ATOM 0 H ALA A 136 0.148 5.676 8.062 1.00 0.00 H new ATOM 0 HA ALA A 136 2.324 7.413 8.997 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.676 8.035 10.724 1.00 0.00 H new ATOM 0 HB2 ALA A 136 0.017 8.245 9.084 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.464 6.838 10.063 1.00 0.00 H new ATOM 2187 N ILE A 137 3.372 5.640 10.393 1.00 0.00 N ATOM 2188 CA ILE A 137 3.998 4.725 11.341 1.00 0.00 C ATOM 2189 C ILE A 137 4.133 5.356 12.726 1.00 0.00 C ATOM 2190 O ILE A 137 4.633 6.472 12.867 1.00 0.00 O ATOM 2191 CB ILE A 137 5.388 4.277 10.854 1.00 0.00 C ATOM 2192 CG1 ILE A 137 5.315 3.802 9.402 1.00 0.00 C ATOM 2193 CG2 ILE A 137 5.935 3.176 11.749 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.648 3.353 8.843 1.00 0.00 C ATOM 0 H ILE A 137 4.029 6.186 9.837 1.00 0.00 H new ATOM 0 HA ILE A 137 3.345 3.855 11.410 1.00 0.00 H new ATOM 0 HB ILE A 137 6.065 5.129 10.905 1.00 0.00 H new ATOM 0 HG12 ILE A 137 4.606 2.977 9.334 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.925 4.610 8.783 1.00 0.00 H new ATOM 0 HG21 ILE A 137 6.918 2.871 11.391 1.00 0.00 H new ATOM 0 HG22 ILE A 137 6.020 3.546 12.771 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.260 2.321 11.728 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.519 3.030 7.810 1.00 0.00 H new ATOM 0 HD12 ILE A 137 7.355 4.182 8.879 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.031 2.523 9.437 1.00 0.00 H new ATOM 2206 N THR A 138 3.685 4.626 13.745 1.00 0.00 N ATOM 2207 CA THR A 138 3.752 5.099 15.123 1.00 0.00 C ATOM 2208 C THR A 138 4.774 4.292 15.924 1.00 0.00 C ATOM 2209 O THR A 138 4.562 3.111 16.197 1.00 0.00 O ATOM 2210 CB THR A 138 2.376 4.992 15.789 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.420 5.784 15.107 1.00 0.00 O ATOM 2212 CG2 THR A 138 2.377 5.420 17.243 1.00 0.00 C ATOM 0 H THR A 138 3.270 3.700 13.640 1.00 0.00 H new ATOM 0 HA THR A 138 4.064 6.143 15.107 1.00 0.00 H new ATOM 0 HB THR A 138 2.116 3.935 15.739 1.00 0.00 H new ATOM 0 HG1 THR A 138 0.549 5.699 15.549 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.372 5.319 17.653 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.064 4.789 17.807 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.696 6.460 17.316 1.00 0.00 H new ATOM 2220 N PRO A 139 5.900 4.917 16.317 1.00 0.00 N ATOM 2221 CA PRO A 139 6.944 4.236 17.094 1.00 0.00 C ATOM 2222 C PRO A 139 6.464 3.863 18.495 1.00 0.00 C ATOM 2223 O PRO A 139 5.514 4.452 19.011 1.00 0.00 O ATOM 2224 CB PRO A 139 8.069 5.270 17.168 1.00 0.00 C ATOM 2225 CG PRO A 139 7.389 6.583 16.987 1.00 0.00 C ATOM 2226 CD PRO A 139 6.244 6.325 16.047 1.00 0.00 C ATOM 0 HA PRO A 139 7.248 3.295 16.635 1.00 0.00 H new ATOM 0 HB2 PRO A 139 8.589 5.222 18.125 1.00 0.00 H new ATOM 0 HB3 PRO A 139 8.815 5.100 16.391 1.00 0.00 H new ATOM 0 HG2 PRO A 139 7.032 6.973 17.940 1.00 0.00 H new ATOM 0 HG3 PRO A 139 8.074 7.324 16.575 1.00 0.00 H new ATOM 0 HD2 PRO A 139 5.403 6.990 16.244 1.00 0.00 H new ATOM 0 HD3 PRO A 139 6.534 6.477 15.007 1.00 0.00 H new ATOM 2234 N PRO A 140 7.110 2.868 19.126 1.00 0.00 N ATOM 2235 CA PRO A 140 6.741 2.412 20.467 1.00 0.00 C ATOM 2236 C PRO A 140 7.341 3.270 21.578 1.00 0.00 C ATOM 2237 O PRO A 140 7.952 2.751 22.511 1.00 0.00 O ATOM 2238 CB PRO A 140 7.321 1.001 20.509 1.00 0.00 C ATOM 2239 CG PRO A 140 8.537 1.073 19.647 1.00 0.00 C ATOM 2240 CD PRO A 140 8.246 2.101 18.580 1.00 0.00 C ATOM 0 HA PRO A 140 5.665 2.465 20.636 1.00 0.00 H new ATOM 0 HB2 PRO A 140 7.573 0.705 21.527 1.00 0.00 H new ATOM 0 HB3 PRO A 140 6.609 0.267 20.131 1.00 0.00 H new ATOM 0 HG2 PRO A 140 9.411 1.358 20.232 1.00 0.00 H new ATOM 0 HG3 PRO A 140 8.755 0.102 19.201 1.00 0.00 H new ATOM 0 HD2 PRO A 140 9.109 2.741 18.396 1.00 0.00 H new ATOM 0 HD3 PRO A 140 7.991 1.630 17.631 1.00 0.00 H new