USER MOD reduce.3.24.130724 H: found=0, std=0, add=1134, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1136 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 21 SER OG : rot 103:sc= 1.05 USER MOD Set 1.2: B 84 HIS : no HE2:sc= 0.252 K(o=1.3,f=-4.2!) USER MOD Set 2.1: B 73 MET CE :methyl 163:sc= -1.99 (180deg=-2.72) USER MOD Set 2.2: B 77 THR OG1 : rot 79:sc= 0.515 USER MOD Set 3.1: B 37 ASN : amide:sc= 1.18 K(o=1.2,f=-1.4!) USER MOD Set 3.2: B 40 ASN : amide:sc=-0.00812 K(o=1.2,f=-1.4) USER MOD Set 4.1: A 84 HIS : no HE2:sc= 0.0906 K(o=0.57,f=-3.5!) USER MOD Set 4.2: B 21 SER OG : rot 139:sc= 0.481 USER MOD Set 5.1: A 83 ASN : amide:sc= 0.414 K(o=-0.088,f=-0.66) USER MOD Set 5.2: B 83 ASN : amide:sc= -0.502 K(o=-0.088,f=-1.3!) USER MOD Set 6.1: A 73 MET CE :methyl 156:sc= -1.08 (180deg=-1.94) USER MOD Set 6.2: A 77 THR OG1 : rot 84:sc= 0.64 USER MOD Set 7.1: A 48 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 74:sc= 0.422 USER MOD Single : A 26 THR OG1 : rot 61:sc= 1.16 USER MOD Single : A 28 TYR OH : rot 53:sc= 0.502 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 40 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 41 GLN : amide:sc= 0.937 K(o=0.94,f=-0.19) USER MOD Single : A 45 TYR OH : rot -31:sc= 0.425 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0.132 K(o=0.13,f=-0.48) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 67 HIS : no HE2:sc= 0.93 K(o=0.93,f=-6.4!) USER MOD Single : A 78 LYS NZ :NH3+ -158:sc= 1.23 (180deg=0.877) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 120:sc= -0.284 USER MOD Single : B 23 THR OG1 : rot 70:sc= 0.295 USER MOD Single : B 26 THR OG1 : rot 99:sc= 1.27 USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 41 GLN : amide:sc=0.000414 K(o=0.00041,f=-0.81) USER MOD Single : B 45 TYR OH : rot -22:sc= -0.597! USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 GLN : amide:sc= -0.153 X(o=-0.15,f=-0.62) USER MOD Single : B 62 ASN : amide:sc= -0.0932 K(o=-0.093,f=-0.7!) USER MOD Single : B 67 HIS : no HE2:sc= 1.22 K(o=1.2,f=-4.3!) USER MOD Single : B 78 LYS NZ :NH3+ -149:sc= 1.23 (180deg=1.08) USER MOD Single : B 79 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 TYR OH : rot 150:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 300 N ALA A 19 13.728 0.618 6.712 1.00 51.44 N ATOM 301 CA ALA A 19 12.902 1.083 7.820 1.00 23.22 C ATOM 302 C ALA A 19 11.426 1.073 7.466 1.00 3.14 C ATOM 303 O ALA A 19 10.587 0.772 8.306 1.00 42.33 O ATOM 304 CB ALA A 19 13.303 2.476 8.176 1.00 74.12 C ATOM 0 HA ALA A 19 13.055 0.406 8.661 1.00 23.22 H new ATOM 0 HB1 ALA A 19 12.689 2.831 9.004 1.00 74.12 H new ATOM 0 HB2 ALA A 19 14.352 2.489 8.470 1.00 74.12 H new ATOM 0 HB3 ALA A 19 13.160 3.127 7.314 1.00 74.12 H new ATOM 310 N ILE A 20 11.111 1.400 6.214 1.00 54.12 N ATOM 311 CA ILE A 20 9.730 1.370 5.756 1.00 3.22 C ATOM 312 C ILE A 20 9.205 -0.053 5.841 1.00 1.45 C ATOM 313 O ILE A 20 8.053 -0.298 6.223 1.00 41.31 O ATOM 314 CB ILE A 20 9.581 1.931 4.305 1.00 12.24 C ATOM 315 CG1 ILE A 20 9.893 3.443 4.274 1.00 25.00 C ATOM 316 CG2 ILE A 20 8.206 1.631 3.720 1.00 13.22 C ATOM 317 CD1 ILE A 20 9.712 4.091 2.912 1.00 63.34 C ATOM 0 H ILE A 20 11.789 1.686 5.507 1.00 54.12 H new ATOM 0 HA ILE A 20 9.140 2.017 6.404 1.00 3.22 H new ATOM 0 HB ILE A 20 10.309 1.421 3.674 1.00 12.24 H new ATOM 0 HG12 ILE A 20 9.249 3.950 4.993 1.00 25.00 H new ATOM 0 HG13 ILE A 20 10.921 3.597 4.603 1.00 25.00 H new ATOM 0 HG21 ILE A 20 8.143 2.038 2.711 1.00 13.22 H new ATOM 0 HG22 ILE A 20 8.052 0.552 3.687 1.00 13.22 H new ATOM 0 HG23 ILE A 20 7.438 2.088 4.344 1.00 13.22 H new ATOM 0 HD11 ILE A 20 9.952 5.152 2.979 1.00 63.34 H new ATOM 0 HD12 ILE A 20 10.376 3.614 2.191 1.00 63.34 H new ATOM 0 HD13 ILE A 20 8.678 3.972 2.587 1.00 63.34 H new ATOM 329 N SER A 21 10.080 -0.981 5.561 1.00 42.14 N ATOM 330 CA SER A 21 9.745 -2.372 5.620 1.00 41.31 C ATOM 331 C SER A 21 9.655 -2.800 7.065 1.00 32.55 C ATOM 332 O SER A 21 8.744 -3.527 7.439 1.00 11.34 O ATOM 333 CB SER A 21 10.771 -3.221 4.879 1.00 55.31 C ATOM 334 OG SER A 21 10.425 -4.590 4.937 1.00 2.11 O ATOM 0 H SER A 21 11.044 -0.791 5.286 1.00 42.14 H new ATOM 0 HA SER A 21 8.782 -2.521 5.132 1.00 41.31 H new ATOM 0 HB2 SER A 21 10.832 -2.900 3.839 1.00 55.31 H new ATOM 0 HB3 SER A 21 11.758 -3.072 5.317 1.00 55.31 H new ATOM 0 HG SER A 21 10.041 -4.867 4.079 1.00 2.11 H new ATOM 340 N GLU A 22 10.592 -2.315 7.873 1.00 24.20 N ATOM 341 CA GLU A 22 10.636 -2.609 9.295 1.00 23.22 C ATOM 342 C GLU A 22 9.306 -2.246 9.928 1.00 65.23 C ATOM 343 O GLU A 22 8.741 -3.024 10.695 1.00 24.51 O ATOM 344 CB GLU A 22 11.766 -1.817 9.961 1.00 34.32 C ATOM 345 CG GLU A 22 13.158 -2.122 9.421 1.00 13.52 C ATOM 346 CD GLU A 22 13.630 -3.517 9.731 1.00 43.51 C ATOM 347 OE1 GLU A 22 14.295 -3.704 10.772 1.00 73.43 O ATOM 348 OE2 GLU A 22 13.341 -4.445 8.958 1.00 52.12 O ATOM 0 H GLU A 22 11.345 -1.704 7.555 1.00 24.20 H new ATOM 0 HA GLU A 22 10.824 -3.673 9.436 1.00 23.22 H new ATOM 0 HB2 GLU A 22 11.568 -0.752 9.837 1.00 34.32 H new ATOM 0 HB3 GLU A 22 11.753 -2.021 11.032 1.00 34.32 H new ATOM 0 HG2 GLU A 22 13.159 -1.978 8.341 1.00 13.52 H new ATOM 0 HG3 GLU A 22 13.866 -1.406 9.839 1.00 13.52 H new ATOM 355 N THR A 23 8.802 -1.080 9.573 1.00 1.04 N ATOM 356 CA THR A 23 7.525 -0.618 10.040 1.00 51.24 C ATOM 357 C THR A 23 6.400 -1.573 9.600 1.00 41.52 C ATOM 358 O THR A 23 5.653 -2.091 10.438 1.00 75.22 O ATOM 359 CB THR A 23 7.251 0.804 9.489 1.00 12.41 C ATOM 360 OG1 THR A 23 8.264 1.708 9.962 1.00 1.43 O ATOM 361 CG2 THR A 23 5.873 1.312 9.892 1.00 3.21 C ATOM 0 H THR A 23 9.276 -0.428 8.948 1.00 1.04 H new ATOM 0 HA THR A 23 7.545 -0.591 11.129 1.00 51.24 H new ATOM 0 HB THR A 23 7.278 0.753 8.401 1.00 12.41 H new ATOM 0 HG1 THR A 23 9.101 1.543 9.480 1.00 1.43 H new ATOM 0 HG21 THR A 23 5.721 2.312 9.486 1.00 3.21 H new ATOM 0 HG22 THR A 23 5.109 0.641 9.500 1.00 3.21 H new ATOM 0 HG23 THR A 23 5.802 1.347 10.979 1.00 3.21 H new ATOM 369 N LEU A 24 6.340 -1.858 8.308 1.00 14.43 N ATOM 370 CA LEU A 24 5.277 -2.682 7.738 1.00 0.41 C ATOM 371 C LEU A 24 5.285 -4.102 8.281 1.00 24.15 C ATOM 372 O LEU A 24 4.238 -4.628 8.652 1.00 54.01 O ATOM 373 CB LEU A 24 5.351 -2.693 6.219 1.00 14.35 C ATOM 374 CG LEU A 24 5.176 -1.343 5.529 1.00 51.04 C ATOM 375 CD1 LEU A 24 5.327 -1.499 4.034 1.00 42.42 C ATOM 376 CD2 LEU A 24 3.820 -0.739 5.863 1.00 41.44 C ATOM 0 H LEU A 24 7.022 -1.528 7.625 1.00 14.43 H new ATOM 0 HA LEU A 24 4.334 -2.227 8.041 1.00 0.41 H new ATOM 0 HB2 LEU A 24 6.316 -3.106 5.925 1.00 14.35 H new ATOM 0 HB3 LEU A 24 4.586 -3.372 5.843 1.00 14.35 H new ATOM 0 HG LEU A 24 5.950 -0.667 5.893 1.00 51.04 H new ATOM 0 HD11 LEU A 24 5.200 -0.529 3.552 1.00 42.42 H new ATOM 0 HD12 LEU A 24 6.319 -1.890 3.807 1.00 42.42 H new ATOM 0 HD13 LEU A 24 4.571 -2.191 3.662 1.00 42.42 H new ATOM 0 HD21 LEU A 24 3.716 0.223 5.361 1.00 41.44 H new ATOM 0 HD22 LEU A 24 3.030 -1.411 5.527 1.00 41.44 H new ATOM 0 HD23 LEU A 24 3.741 -0.596 6.941 1.00 41.44 H new ATOM 388 N GLU A 25 6.462 -4.711 8.344 1.00 53.02 N ATOM 389 CA GLU A 25 6.593 -6.067 8.846 1.00 3.11 C ATOM 390 C GLU A 25 6.149 -6.143 10.315 1.00 13.04 C ATOM 391 O GLU A 25 5.523 -7.114 10.737 1.00 34.24 O ATOM 392 CB GLU A 25 8.028 -6.563 8.683 1.00 73.41 C ATOM 393 CG GLU A 25 8.470 -6.627 7.230 1.00 60.31 C ATOM 394 CD GLU A 25 9.882 -7.101 7.061 1.00 35.33 C ATOM 395 OE1 GLU A 25 10.089 -8.296 6.852 1.00 15.45 O ATOM 396 OE2 GLU A 25 10.809 -6.270 7.125 1.00 23.24 O ATOM 0 H GLU A 25 7.341 -4.283 8.052 1.00 53.02 H new ATOM 0 HA GLU A 25 5.942 -6.717 8.261 1.00 3.11 H new ATOM 0 HB2 GLU A 25 8.700 -5.904 9.233 1.00 73.41 H new ATOM 0 HB3 GLU A 25 8.118 -7.554 9.129 1.00 73.41 H new ATOM 0 HG2 GLU A 25 7.802 -7.293 6.683 1.00 60.31 H new ATOM 0 HG3 GLU A 25 8.370 -5.638 6.783 1.00 60.31 H new ATOM 403 N THR A 26 6.443 -5.085 11.072 1.00 54.30 N ATOM 404 CA THR A 26 6.047 -5.003 12.469 1.00 54.05 C ATOM 405 C THR A 26 4.519 -4.869 12.589 1.00 1.11 C ATOM 406 O THR A 26 3.886 -5.568 13.394 1.00 4.32 O ATOM 407 CB THR A 26 6.731 -3.807 13.169 1.00 42.14 C ATOM 408 OG1 THR A 26 8.161 -3.931 13.041 1.00 31.11 O ATOM 409 CG2 THR A 26 6.364 -3.759 14.647 1.00 2.45 C ATOM 0 H THR A 26 6.957 -4.271 10.734 1.00 54.30 H new ATOM 0 HA THR A 26 6.365 -5.923 12.960 1.00 54.05 H new ATOM 0 HB THR A 26 6.388 -2.888 12.694 1.00 42.14 H new ATOM 0 HG1 THR A 26 8.406 -3.928 12.092 1.00 31.11 H new ATOM 0 HG21 THR A 26 6.858 -2.909 15.117 1.00 2.45 H new ATOM 0 HG22 THR A 26 5.284 -3.654 14.751 1.00 2.45 H new ATOM 0 HG23 THR A 26 6.687 -4.680 15.132 1.00 2.45 H new ATOM 417 N VAL A 27 3.929 -3.982 11.770 1.00 63.14 N ATOM 418 CA VAL A 27 2.477 -3.789 11.759 1.00 52.24 C ATOM 419 C VAL A 27 1.800 -5.105 11.384 1.00 63.30 C ATOM 420 O VAL A 27 0.788 -5.495 11.970 1.00 34.32 O ATOM 421 CB VAL A 27 2.037 -2.673 10.754 1.00 73.43 C ATOM 422 CG1 VAL A 27 0.536 -2.475 10.794 1.00 72.50 C ATOM 423 CG2 VAL A 27 2.731 -1.352 11.047 1.00 2.25 C ATOM 0 H VAL A 27 4.437 -3.392 11.111 1.00 63.14 H new ATOM 0 HA VAL A 27 2.175 -3.471 12.757 1.00 52.24 H new ATOM 0 HB VAL A 27 2.330 -3.004 9.758 1.00 73.43 H new ATOM 0 HG11 VAL A 27 0.253 -1.695 10.088 1.00 72.50 H new ATOM 0 HG12 VAL A 27 0.039 -3.407 10.524 1.00 72.50 H new ATOM 0 HG13 VAL A 27 0.234 -2.181 11.799 1.00 72.50 H new ATOM 0 HG21 VAL A 27 2.401 -0.601 10.329 1.00 2.25 H new ATOM 0 HG22 VAL A 27 2.480 -1.025 12.056 1.00 2.25 H new ATOM 0 HG23 VAL A 27 3.810 -1.482 10.966 1.00 2.25 H new ATOM 433 N TYR A 28 2.397 -5.793 10.429 1.00 33.12 N ATOM 434 CA TYR A 28 1.916 -7.077 9.978 1.00 75.30 C ATOM 435 C TYR A 28 1.871 -8.094 11.131 1.00 1.12 C ATOM 436 O TYR A 28 0.835 -8.725 11.374 1.00 62.42 O ATOM 437 CB TYR A 28 2.780 -7.596 8.808 1.00 51.03 C ATOM 438 CG TYR A 28 2.402 -8.980 8.350 1.00 11.30 C ATOM 439 CD1 TYR A 28 3.103 -10.079 8.804 1.00 65.42 C ATOM 440 CD2 TYR A 28 1.335 -9.192 7.487 1.00 72.44 C ATOM 441 CE1 TYR A 28 2.759 -11.343 8.419 1.00 52.31 C ATOM 442 CE2 TYR A 28 0.977 -10.468 7.105 1.00 74.14 C ATOM 443 CZ TYR A 28 1.699 -11.538 7.578 1.00 63.24 C ATOM 444 OH TYR A 28 1.345 -12.816 7.230 1.00 0.41 O ATOM 0 H TYR A 28 3.234 -5.471 9.944 1.00 33.12 H new ATOM 0 HA TYR A 28 0.895 -6.950 9.618 1.00 75.30 H new ATOM 0 HB2 TYR A 28 2.692 -6.907 7.968 1.00 51.03 H new ATOM 0 HB3 TYR A 28 3.827 -7.596 9.112 1.00 51.03 H new ATOM 0 HD1 TYR A 28 3.937 -9.937 9.475 1.00 65.42 H new ATOM 0 HD2 TYR A 28 0.778 -8.347 7.110 1.00 72.44 H new ATOM 0 HE1 TYR A 28 3.325 -12.189 8.779 1.00 52.31 H new ATOM 0 HE2 TYR A 28 0.139 -10.625 6.442 1.00 74.14 H new ATOM 0 HH TYR A 28 1.227 -13.355 8.040 1.00 0.41 H new ATOM 454 N ARG A 29 2.982 -8.231 11.849 1.00 60.15 N ATOM 455 CA ARG A 29 3.065 -9.185 12.959 1.00 14.05 C ATOM 456 C ARG A 29 2.082 -8.839 14.068 1.00 3.35 C ATOM 457 O ARG A 29 1.507 -9.736 14.702 1.00 13.11 O ATOM 458 CB ARG A 29 4.491 -9.270 13.522 1.00 13.35 C ATOM 459 CG ARG A 29 5.531 -9.765 12.528 1.00 31.21 C ATOM 460 CD ARG A 29 5.190 -11.152 12.011 1.00 70.33 C ATOM 461 NE ARG A 29 6.192 -11.656 11.080 1.00 3.51 N ATOM 462 CZ ARG A 29 6.024 -12.695 10.255 1.00 21.02 C ATOM 463 NH1 ARG A 29 4.836 -13.296 10.153 1.00 41.45 N ATOM 464 NH2 ARG A 29 7.041 -13.110 9.517 1.00 45.04 N ATOM 0 H ARG A 29 3.836 -7.698 11.686 1.00 60.15 H new ATOM 0 HA ARG A 29 2.796 -10.162 12.557 1.00 14.05 H new ATOM 0 HB2 ARG A 29 4.787 -8.283 13.878 1.00 13.35 H new ATOM 0 HB3 ARG A 29 4.488 -9.933 14.387 1.00 13.35 H new ATOM 0 HG2 ARG A 29 5.596 -9.069 11.691 1.00 31.21 H new ATOM 0 HG3 ARG A 29 6.511 -9.784 13.004 1.00 31.21 H new ATOM 0 HD2 ARG A 29 5.100 -11.839 12.852 1.00 70.33 H new ATOM 0 HD3 ARG A 29 4.219 -11.125 11.517 1.00 70.33 H new ATOM 0 HE ARG A 29 7.093 -11.178 11.056 1.00 3.51 H new ATOM 0 HH11 ARG A 29 4.047 -12.963 10.707 1.00 41.45 H new ATOM 0 HH12 ARG A 29 4.718 -14.088 9.521 1.00 41.45 H new ATOM 0 HH21 ARG A 29 7.943 -12.638 9.580 1.00 45.04 H new ATOM 0 HH22 ARG A 29 6.923 -13.902 8.885 1.00 45.04 H new ATOM 478 N ALA A 30 1.871 -7.545 14.273 1.00 2.24 N ATOM 479 CA ALA A 30 0.962 -7.052 15.294 1.00 52.14 C ATOM 480 C ALA A 30 -0.457 -7.575 15.076 1.00 13.45 C ATOM 481 O ALA A 30 -1.102 -8.049 16.014 1.00 50.52 O ATOM 482 CB ALA A 30 0.975 -5.529 15.334 1.00 14.52 C ATOM 0 H ALA A 30 2.327 -6.809 13.734 1.00 2.24 H new ATOM 0 HA ALA A 30 1.309 -7.426 16.257 1.00 52.14 H new ATOM 0 HB1 ALA A 30 0.288 -5.179 16.105 1.00 14.52 H new ATOM 0 HB2 ALA A 30 1.982 -5.180 15.560 1.00 14.52 H new ATOM 0 HB3 ALA A 30 0.664 -5.137 14.366 1.00 14.52 H new ATOM 488 N LEU A 31 -0.943 -7.512 13.845 1.00 42.23 N ATOM 489 CA LEU A 31 -2.285 -7.995 13.569 1.00 52.22 C ATOM 490 C LEU A 31 -2.417 -9.500 13.597 1.00 31.21 C ATOM 491 O LEU A 31 -3.492 -10.006 13.914 1.00 10.14 O ATOM 492 CB LEU A 31 -2.981 -7.376 12.349 1.00 51.22 C ATOM 493 CG LEU A 31 -3.432 -5.917 12.488 1.00 31.05 C ATOM 494 CD1 LEU A 31 -2.286 -4.935 12.413 1.00 21.43 C ATOM 495 CD2 LEU A 31 -4.522 -5.573 11.505 1.00 73.35 C ATOM 0 H LEU A 31 -0.441 -7.140 13.039 1.00 42.23 H new ATOM 0 HA LEU A 31 -2.844 -7.615 14.424 1.00 52.22 H new ATOM 0 HB2 LEU A 31 -2.303 -7.444 11.498 1.00 51.22 H new ATOM 0 HB3 LEU A 31 -3.855 -7.982 12.110 1.00 51.22 H new ATOM 0 HG LEU A 31 -3.849 -5.824 13.491 1.00 31.05 H new ATOM 0 HD11 LEU A 31 -2.669 -3.920 12.518 1.00 21.43 H new ATOM 0 HD12 LEU A 31 -1.578 -5.140 13.216 1.00 21.43 H new ATOM 0 HD13 LEU A 31 -1.783 -5.035 11.451 1.00 21.43 H new ATOM 0 HD21 LEU A 31 -4.814 -4.531 11.635 1.00 73.35 H new ATOM 0 HD22 LEU A 31 -4.156 -5.723 10.489 1.00 73.35 H new ATOM 0 HD23 LEU A 31 -5.385 -6.216 11.679 1.00 73.35 H new ATOM 507 N GLU A 32 -1.344 -10.229 13.273 1.00 74.24 N ATOM 508 CA GLU A 32 -1.395 -11.695 13.358 1.00 1.11 C ATOM 509 C GLU A 32 -1.597 -12.118 14.807 1.00 2.41 C ATOM 510 O GLU A 32 -2.341 -13.049 15.099 1.00 32.21 O ATOM 511 CB GLU A 32 -0.132 -12.366 12.818 1.00 21.53 C ATOM 512 CG GLU A 32 0.186 -12.086 11.367 1.00 42.33 C ATOM 513 CD GLU A 32 1.363 -12.904 10.882 1.00 34.14 C ATOM 514 OE1 GLU A 32 2.498 -12.680 11.366 1.00 14.41 O ATOM 515 OE2 GLU A 32 1.175 -13.778 9.993 1.00 13.42 O ATOM 0 H GLU A 32 -0.453 -9.844 12.958 1.00 74.24 H new ATOM 0 HA GLU A 32 -2.231 -12.018 12.738 1.00 1.11 H new ATOM 0 HB2 GLU A 32 0.715 -12.047 13.425 1.00 21.53 H new ATOM 0 HB3 GLU A 32 -0.230 -13.444 12.949 1.00 21.53 H new ATOM 0 HG2 GLU A 32 -0.688 -12.307 10.754 1.00 42.33 H new ATOM 0 HG3 GLU A 32 0.404 -11.025 11.241 1.00 42.33 H new ATOM 522 N GLU A 33 -0.943 -11.411 15.713 1.00 25.21 N ATOM 523 CA GLU A 33 -1.069 -11.679 17.141 1.00 75.34 C ATOM 524 C GLU A 33 -2.431 -11.266 17.675 1.00 64.54 C ATOM 525 O GLU A 33 -2.891 -11.776 18.683 1.00 12.43 O ATOM 526 CB GLU A 33 0.049 -11.000 17.921 1.00 42.24 C ATOM 527 CG GLU A 33 1.415 -11.602 17.662 1.00 71.43 C ATOM 528 CD GLU A 33 1.482 -13.046 18.106 1.00 21.34 C ATOM 529 OE1 GLU A 33 1.675 -13.299 19.308 1.00 44.01 O ATOM 530 OE2 GLU A 33 1.330 -13.953 17.264 1.00 40.23 O ATOM 0 H GLU A 33 -0.314 -10.641 15.485 1.00 25.21 H new ATOM 0 HA GLU A 33 -0.979 -12.756 17.279 1.00 75.34 H new ATOM 0 HB2 GLU A 33 0.072 -9.941 17.662 1.00 42.24 H new ATOM 0 HB3 GLU A 33 -0.171 -11.063 18.987 1.00 42.24 H new ATOM 0 HG2 GLU A 33 1.646 -11.537 16.599 1.00 71.43 H new ATOM 0 HG3 GLU A 33 2.174 -11.023 18.189 1.00 71.43 H new ATOM 537 N LYS A 34 -3.061 -10.341 16.999 1.00 43.23 N ATOM 538 CA LYS A 34 -4.373 -9.863 17.396 1.00 52.31 C ATOM 539 C LYS A 34 -5.490 -10.605 16.655 1.00 43.41 C ATOM 540 O LYS A 34 -6.672 -10.325 16.848 1.00 44.05 O ATOM 541 CB LYS A 34 -4.459 -8.351 17.188 1.00 21.41 C ATOM 542 CG LYS A 34 -3.548 -7.553 18.120 1.00 11.45 C ATOM 543 CD LYS A 34 -4.020 -7.618 19.574 1.00 72.23 C ATOM 544 CE LYS A 34 -5.279 -6.794 19.776 1.00 40.54 C ATOM 545 NZ LYS A 34 -5.840 -6.920 21.140 1.00 71.35 N ATOM 0 H LYS A 34 -2.687 -9.895 16.161 1.00 43.23 H new ATOM 0 HA LYS A 34 -4.514 -10.071 18.457 1.00 52.31 H new ATOM 0 HB2 LYS A 34 -4.200 -8.119 16.155 1.00 21.41 H new ATOM 0 HB3 LYS A 34 -5.490 -8.030 17.338 1.00 21.41 H new ATOM 0 HG2 LYS A 34 -2.531 -7.939 18.051 1.00 11.45 H new ATOM 0 HG3 LYS A 34 -3.517 -6.513 17.795 1.00 11.45 H new ATOM 0 HD2 LYS A 34 -4.211 -8.655 19.852 1.00 72.23 H new ATOM 0 HD3 LYS A 34 -3.232 -7.252 20.232 1.00 72.23 H new ATOM 0 HE2 LYS A 34 -5.057 -5.746 19.576 1.00 40.54 H new ATOM 0 HE3 LYS A 34 -6.030 -7.105 19.050 1.00 40.54 H new ATOM 0 HZ1 LYS A 34 -6.697 -6.336 21.218 1.00 71.35 H new ATOM 0 HZ2 LYS A 34 -6.080 -7.915 21.326 1.00 71.35 H new ATOM 0 HZ3 LYS A 34 -5.137 -6.598 21.836 1.00 71.35 H new ATOM 559 N GLY A 35 -5.099 -11.545 15.809 1.00 23.11 N ATOM 560 CA GLY A 35 -6.049 -12.377 15.095 1.00 23.13 C ATOM 561 C GLY A 35 -6.859 -11.640 14.037 1.00 41.30 C ATOM 562 O GLY A 35 -7.966 -12.065 13.700 1.00 53.51 O ATOM 0 H GLY A 35 -4.122 -11.750 15.600 1.00 23.11 H new ATOM 0 HA2 GLY A 35 -5.510 -13.195 14.618 1.00 23.13 H new ATOM 0 HA3 GLY A 35 -6.735 -12.824 15.815 1.00 23.13 H new ATOM 566 N TYR A 36 -6.324 -10.560 13.517 1.00 3.33 N ATOM 567 CA TYR A 36 -7.012 -9.800 12.479 1.00 23.14 C ATOM 568 C TYR A 36 -6.345 -10.052 11.142 1.00 22.23 C ATOM 569 O TYR A 36 -5.417 -10.859 11.051 1.00 73.51 O ATOM 570 CB TYR A 36 -6.984 -8.286 12.765 1.00 61.32 C ATOM 571 CG TYR A 36 -7.669 -7.841 14.036 1.00 62.04 C ATOM 572 CD1 TYR A 36 -6.941 -7.326 15.092 1.00 21.01 C ATOM 573 CD2 TYR A 36 -9.042 -7.926 14.172 1.00 14.03 C ATOM 574 CE1 TYR A 36 -7.560 -6.905 16.252 1.00 72.12 C ATOM 575 CE2 TYR A 36 -9.672 -7.510 15.328 1.00 42.25 C ATOM 576 CZ TYR A 36 -8.922 -6.999 16.365 1.00 31.14 C ATOM 577 OH TYR A 36 -9.544 -6.580 17.522 1.00 12.41 O ATOM 0 H TYR A 36 -5.417 -10.182 13.790 1.00 3.33 H new ATOM 0 HA TYR A 36 -8.051 -10.130 12.463 1.00 23.14 H new ATOM 0 HB2 TYR A 36 -5.944 -7.962 12.804 1.00 61.32 H new ATOM 0 HB3 TYR A 36 -7.448 -7.769 11.925 1.00 61.32 H new ATOM 0 HD1 TYR A 36 -5.867 -7.251 15.008 1.00 21.01 H new ATOM 0 HD2 TYR A 36 -9.632 -8.325 13.360 1.00 14.03 H new ATOM 0 HE1 TYR A 36 -6.974 -6.504 17.066 1.00 72.12 H new ATOM 0 HE2 TYR A 36 -10.746 -7.585 15.419 1.00 42.25 H new ATOM 0 HH TYR A 36 -10.511 -6.713 17.440 1.00 12.41 H new ATOM 587 N ASN A 37 -6.819 -9.380 10.114 1.00 1.21 N ATOM 588 CA ASN A 37 -6.190 -9.440 8.804 1.00 5.54 C ATOM 589 C ASN A 37 -5.315 -8.211 8.634 1.00 31.33 C ATOM 590 O ASN A 37 -5.828 -7.096 8.405 1.00 65.20 O ATOM 591 CB ASN A 37 -7.226 -9.534 7.670 1.00 35.35 C ATOM 592 CG ASN A 37 -8.040 -10.816 7.689 1.00 50.34 C ATOM 593 OD1 ASN A 37 -7.568 -11.878 8.132 1.00 72.32 O ATOM 594 ND2 ASN A 37 -9.258 -10.737 7.214 1.00 20.33 N ATOM 0 H ASN A 37 -7.643 -8.781 10.158 1.00 1.21 H new ATOM 0 HA ASN A 37 -5.584 -10.344 8.745 1.00 5.54 H new ATOM 0 HB2 ASN A 37 -7.904 -8.683 7.738 1.00 35.35 H new ATOM 0 HB3 ASN A 37 -6.711 -9.456 6.712 1.00 35.35 H new ATOM 0 HD21 ASN A 37 -9.854 -11.564 7.199 1.00 20.33 H new ATOM 0 HD22 ASN A 37 -9.610 -9.848 6.859 1.00 20.33 H new ATOM 601 N PRO A 38 -3.982 -8.386 8.809 1.00 5.04 N ATOM 602 CA PRO A 38 -2.995 -7.302 8.772 1.00 42.23 C ATOM 603 C PRO A 38 -3.096 -6.377 7.577 1.00 34.54 C ATOM 604 O PRO A 38 -2.996 -5.156 7.727 1.00 73.21 O ATOM 605 CB PRO A 38 -1.667 -8.043 8.716 1.00 41.40 C ATOM 606 CG PRO A 38 -1.919 -9.335 9.391 1.00 1.43 C ATOM 607 CD PRO A 38 -3.338 -9.688 9.086 1.00 3.03 C ATOM 0 HA PRO A 38 -3.137 -6.643 9.629 1.00 42.23 H new ATOM 0 HB2 PRO A 38 -1.342 -8.193 7.686 1.00 41.40 H new ATOM 0 HB3 PRO A 38 -0.880 -7.481 9.220 1.00 41.40 H new ATOM 0 HG2 PRO A 38 -1.238 -10.105 9.027 1.00 1.43 H new ATOM 0 HG3 PRO A 38 -1.760 -9.251 10.466 1.00 1.43 H new ATOM 0 HD2 PRO A 38 -3.407 -10.357 8.228 1.00 3.03 H new ATOM 0 HD3 PRO A 38 -3.812 -10.196 9.926 1.00 3.03 H new ATOM 615 N ILE A 39 -3.336 -6.933 6.412 1.00 52.42 N ATOM 616 CA ILE A 39 -3.286 -6.154 5.195 1.00 54.43 C ATOM 617 C ILE A 39 -4.397 -5.116 5.121 1.00 11.13 C ATOM 618 O ILE A 39 -4.145 -3.974 4.742 1.00 44.21 O ATOM 619 CB ILE A 39 -3.261 -7.048 3.926 1.00 21.34 C ATOM 620 CG1 ILE A 39 -2.064 -8.018 3.994 1.00 30.03 C ATOM 621 CG2 ILE A 39 -3.184 -6.198 2.661 1.00 34.52 C ATOM 622 CD1 ILE A 39 -0.716 -7.330 4.190 1.00 22.22 C ATOM 0 H ILE A 39 -3.567 -7.918 6.281 1.00 52.42 H new ATOM 0 HA ILE A 39 -2.343 -5.609 5.226 1.00 54.43 H new ATOM 0 HB ILE A 39 -4.186 -7.623 3.889 1.00 21.34 H new ATOM 0 HG12 ILE A 39 -2.224 -8.719 4.813 1.00 30.03 H new ATOM 0 HG13 ILE A 39 -2.031 -8.603 3.075 1.00 30.03 H new ATOM 0 HG21 ILE A 39 -3.168 -6.848 1.786 1.00 34.52 H new ATOM 0 HG22 ILE A 39 -4.053 -5.542 2.610 1.00 34.52 H new ATOM 0 HG23 ILE A 39 -2.276 -5.596 2.682 1.00 34.52 H new ATOM 0 HD11 ILE A 39 0.074 -8.081 4.227 1.00 22.22 H new ATOM 0 HD12 ILE A 39 -0.531 -6.649 3.359 1.00 22.22 H new ATOM 0 HD13 ILE A 39 -0.727 -6.768 5.124 1.00 22.22 H new ATOM 634 N ASN A 40 -5.602 -5.497 5.535 1.00 24.43 N ATOM 635 CA ASN A 40 -6.773 -4.599 5.481 1.00 34.03 C ATOM 636 C ASN A 40 -6.552 -3.313 6.237 1.00 35.41 C ATOM 637 O ASN A 40 -6.893 -2.233 5.756 1.00 13.03 O ATOM 638 CB ASN A 40 -8.039 -5.278 6.006 1.00 63.50 C ATOM 639 CG ASN A 40 -8.516 -6.394 5.120 1.00 4.22 C ATOM 640 OD1 ASN A 40 -8.105 -7.538 5.277 1.00 43.43 O ATOM 641 ND2 ASN A 40 -9.399 -6.076 4.196 1.00 64.20 N ATOM 0 H ASN A 40 -5.803 -6.422 5.914 1.00 24.43 H new ATOM 0 HA ASN A 40 -6.907 -4.360 4.426 1.00 34.03 H new ATOM 0 HB2 ASN A 40 -7.847 -5.671 7.004 1.00 63.50 H new ATOM 0 HB3 ASN A 40 -8.830 -4.535 6.103 1.00 63.50 H new ATOM 0 HD21 ASN A 40 -9.769 -6.796 3.575 1.00 64.20 H new ATOM 0 HD22 ASN A 40 -9.713 -5.110 4.101 1.00 64.20 H new ATOM 648 N GLN A 41 -5.972 -3.409 7.406 1.00 3.52 N ATOM 649 CA GLN A 41 -5.774 -2.232 8.209 1.00 32.12 C ATOM 650 C GLN A 41 -4.654 -1.360 7.660 1.00 70.40 C ATOM 651 O GLN A 41 -4.712 -0.136 7.760 1.00 44.43 O ATOM 652 CB GLN A 41 -5.590 -2.575 9.677 1.00 21.34 C ATOM 653 CG GLN A 41 -6.754 -3.388 10.250 1.00 32.50 C ATOM 654 CD GLN A 41 -8.112 -2.734 10.051 1.00 61.10 C ATOM 655 OE1 GLN A 41 -8.783 -2.961 9.045 1.00 62.15 O ATOM 656 NE2 GLN A 41 -8.526 -1.945 10.992 1.00 15.21 N ATOM 0 H GLN A 41 -5.633 -4.278 7.818 1.00 3.52 H new ATOM 0 HA GLN A 41 -6.685 -1.636 8.149 1.00 32.12 H new ATOM 0 HB2 GLN A 41 -4.665 -3.138 9.800 1.00 21.34 H new ATOM 0 HB3 GLN A 41 -5.481 -1.654 10.249 1.00 21.34 H new ATOM 0 HG2 GLN A 41 -6.763 -4.373 9.783 1.00 32.50 H new ATOM 0 HG3 GLN A 41 -6.588 -3.543 11.316 1.00 32.50 H new ATOM 0 HE21 GLN A 41 -7.943 -1.780 11.812 1.00 15.21 H new ATOM 0 HE22 GLN A 41 -9.435 -1.489 10.912 1.00 15.21 H new ATOM 665 N ILE A 42 -3.640 -1.989 7.070 1.00 74.13 N ATOM 666 CA ILE A 42 -2.544 -1.243 6.472 1.00 52.54 C ATOM 667 C ILE A 42 -3.042 -0.489 5.236 1.00 13.21 C ATOM 668 O ILE A 42 -2.874 0.724 5.141 1.00 2.12 O ATOM 669 CB ILE A 42 -1.335 -2.145 6.086 1.00 31.51 C ATOM 670 CG1 ILE A 42 -0.799 -2.882 7.322 1.00 13.43 C ATOM 671 CG2 ILE A 42 -0.225 -1.294 5.454 1.00 42.23 C ATOM 672 CD1 ILE A 42 0.354 -3.832 7.033 1.00 71.13 C ATOM 0 H ILE A 42 -3.557 -3.003 6.995 1.00 74.13 H new ATOM 0 HA ILE A 42 -2.190 -0.540 7.226 1.00 52.54 H new ATOM 0 HB ILE A 42 -1.670 -2.886 5.360 1.00 31.51 H new ATOM 0 HG12 ILE A 42 -0.472 -2.146 8.056 1.00 13.43 H new ATOM 0 HG13 ILE A 42 -1.614 -3.446 7.776 1.00 13.43 H new ATOM 0 HG21 ILE A 42 0.616 -1.933 5.187 1.00 42.23 H new ATOM 0 HG22 ILE A 42 -0.607 -0.805 4.558 1.00 42.23 H new ATOM 0 HG23 ILE A 42 0.105 -0.539 6.167 1.00 42.23 H new ATOM 0 HD11 ILE A 42 0.672 -4.311 7.959 1.00 71.13 H new ATOM 0 HD12 ILE A 42 0.029 -4.593 6.324 1.00 71.13 H new ATOM 0 HD13 ILE A 42 1.188 -3.273 6.609 1.00 71.13 H new ATOM 684 N VAL A 43 -3.698 -1.207 4.313 1.00 60.42 N ATOM 685 CA VAL A 43 -4.232 -0.573 3.100 1.00 22.10 C ATOM 686 C VAL A 43 -5.244 0.527 3.464 1.00 3.00 C ATOM 687 O VAL A 43 -5.261 1.594 2.843 1.00 32.31 O ATOM 688 CB VAL A 43 -4.831 -1.614 2.066 1.00 15.24 C ATOM 689 CG1 VAL A 43 -5.915 -2.465 2.685 1.00 71.43 C ATOM 690 CG2 VAL A 43 -5.386 -0.909 0.832 1.00 71.43 C ATOM 0 H VAL A 43 -3.869 -2.210 4.381 1.00 60.42 H new ATOM 0 HA VAL A 43 -3.391 -0.106 2.587 1.00 22.10 H new ATOM 0 HB VAL A 43 -4.008 -2.264 1.770 1.00 15.24 H new ATOM 0 HG11 VAL A 43 -6.298 -3.164 1.942 1.00 71.43 H new ATOM 0 HG12 VAL A 43 -5.505 -3.020 3.528 1.00 71.43 H new ATOM 0 HG13 VAL A 43 -6.726 -1.825 3.032 1.00 71.43 H new ATOM 0 HG21 VAL A 43 -5.790 -1.649 0.141 1.00 71.43 H new ATOM 0 HG22 VAL A 43 -6.177 -0.222 1.131 1.00 71.43 H new ATOM 0 HG23 VAL A 43 -4.588 -0.352 0.341 1.00 71.43 H new ATOM 700 N GLY A 44 -6.046 0.279 4.506 1.00 71.30 N ATOM 701 CA GLY A 44 -6.967 1.272 4.985 1.00 42.41 C ATOM 702 C GLY A 44 -6.240 2.508 5.466 1.00 14.34 C ATOM 703 O GLY A 44 -6.620 3.628 5.131 1.00 13.21 O ATOM 0 H GLY A 44 -6.063 -0.602 5.020 1.00 71.30 H new ATOM 0 HA2 GLY A 44 -7.661 1.542 4.189 1.00 42.41 H new ATOM 0 HA3 GLY A 44 -7.562 0.857 5.799 1.00 42.41 H new ATOM 707 N TYR A 45 -5.171 2.313 6.237 1.00 60.41 N ATOM 708 CA TYR A 45 -4.397 3.434 6.734 1.00 53.31 C ATOM 709 C TYR A 45 -3.751 4.203 5.606 1.00 13.55 C ATOM 710 O TYR A 45 -3.793 5.419 5.591 1.00 41.40 O ATOM 711 CB TYR A 45 -3.326 3.027 7.761 1.00 21.33 C ATOM 712 CG TYR A 45 -2.497 4.218 8.244 1.00 43.22 C ATOM 713 CD1 TYR A 45 -1.211 4.450 7.774 1.00 52.32 C ATOM 714 CD2 TYR A 45 -3.014 5.107 9.149 1.00 23.23 C ATOM 715 CE1 TYR A 45 -0.479 5.541 8.210 1.00 53.04 C ATOM 716 CE2 TYR A 45 -2.295 6.197 9.587 1.00 75.42 C ATOM 717 CZ TYR A 45 -1.033 6.412 9.118 1.00 33.43 C ATOM 718 OH TYR A 45 -0.310 7.504 9.565 1.00 74.53 O ATOM 0 H TYR A 45 -4.829 1.396 6.525 1.00 60.41 H new ATOM 0 HA TYR A 45 -5.114 4.076 7.247 1.00 53.31 H new ATOM 0 HB2 TYR A 45 -3.808 2.553 8.616 1.00 21.33 H new ATOM 0 HB3 TYR A 45 -2.664 2.284 7.316 1.00 21.33 H new ATOM 0 HD1 TYR A 45 -0.776 3.769 7.058 1.00 52.32 H new ATOM 0 HD2 TYR A 45 -4.012 4.949 9.529 1.00 23.23 H new ATOM 0 HE1 TYR A 45 0.522 5.707 7.839 1.00 53.04 H new ATOM 0 HE2 TYR A 45 -2.730 6.880 10.301 1.00 75.42 H new ATOM 0 HH TYR A 45 0.645 7.283 9.572 1.00 74.53 H new ATOM 728 N LEU A 46 -3.154 3.510 4.669 1.00 75.42 N ATOM 729 CA LEU A 46 -2.498 4.195 3.591 1.00 32.42 C ATOM 730 C LEU A 46 -3.437 4.927 2.643 1.00 63.21 C ATOM 731 O LEU A 46 -3.100 6.006 2.156 1.00 63.32 O ATOM 732 CB LEU A 46 -1.398 3.390 2.878 1.00 25.53 C ATOM 733 CG LEU A 46 -0.079 3.163 3.675 1.00 54.45 C ATOM 734 CD1 LEU A 46 -0.248 2.232 4.847 1.00 3.10 C ATOM 735 CD2 LEU A 46 1.053 2.717 2.774 1.00 45.15 C ATOM 0 H LEU A 46 -3.110 2.492 4.632 1.00 75.42 H new ATOM 0 HA LEU A 46 -1.951 4.987 4.103 1.00 32.42 H new ATOM 0 HB2 LEU A 46 -1.807 2.416 2.610 1.00 25.53 H new ATOM 0 HB3 LEU A 46 -1.151 3.900 1.947 1.00 25.53 H new ATOM 0 HG LEU A 46 0.189 4.134 4.091 1.00 54.45 H new ATOM 0 HD11 LEU A 46 0.707 2.116 5.360 1.00 3.10 H new ATOM 0 HD12 LEU A 46 -0.983 2.646 5.537 1.00 3.10 H new ATOM 0 HD13 LEU A 46 -0.590 1.260 4.493 1.00 3.10 H new ATOM 0 HD21 LEU A 46 1.955 2.570 3.368 1.00 45.15 H new ATOM 0 HD22 LEU A 46 0.783 1.780 2.287 1.00 45.15 H new ATOM 0 HD23 LEU A 46 1.238 3.480 2.017 1.00 45.15 H new ATOM 747 N LEU A 47 -4.604 4.381 2.395 1.00 21.01 N ATOM 748 CA LEU A 47 -5.544 5.048 1.508 1.00 61.41 C ATOM 749 C LEU A 47 -6.327 6.154 2.224 1.00 70.01 C ATOM 750 O LEU A 47 -6.439 7.271 1.714 1.00 22.25 O ATOM 751 CB LEU A 47 -6.513 4.056 0.854 1.00 31.34 C ATOM 752 CG LEU A 47 -5.883 2.953 -0.006 1.00 63.11 C ATOM 753 CD1 LEU A 47 -6.959 2.091 -0.632 1.00 32.45 C ATOM 754 CD2 LEU A 47 -4.976 3.539 -1.075 1.00 33.40 C ATOM 0 H LEU A 47 -4.927 3.495 2.783 1.00 21.01 H new ATOM 0 HA LEU A 47 -4.945 5.511 0.724 1.00 61.41 H new ATOM 0 HB2 LEU A 47 -7.100 3.582 1.641 1.00 31.34 H new ATOM 0 HB3 LEU A 47 -7.209 4.618 0.232 1.00 31.34 H new ATOM 0 HG LEU A 47 -5.271 2.328 0.644 1.00 63.11 H new ATOM 0 HD11 LEU A 47 -6.495 1.313 -1.239 1.00 32.45 H new ATOM 0 HD12 LEU A 47 -7.558 1.630 0.153 1.00 32.45 H new ATOM 0 HD13 LEU A 47 -7.600 2.709 -1.261 1.00 32.45 H new ATOM 0 HD21 LEU A 47 -4.544 2.733 -1.668 1.00 33.40 H new ATOM 0 HD22 LEU A 47 -5.555 4.196 -1.723 1.00 33.40 H new ATOM 0 HD23 LEU A 47 -4.177 4.109 -0.601 1.00 33.40 H new ATOM 766 N SER A 48 -6.815 5.865 3.414 1.00 24.11 N ATOM 767 CA SER A 48 -7.671 6.801 4.115 1.00 45.12 C ATOM 768 C SER A 48 -6.878 7.764 5.024 1.00 4.14 C ATOM 769 O SER A 48 -7.347 8.872 5.320 1.00 65.45 O ATOM 770 CB SER A 48 -8.700 6.022 4.938 1.00 53.41 C ATOM 771 OG SER A 48 -9.425 5.104 4.117 1.00 63.41 O ATOM 0 H SER A 48 -6.635 4.994 3.914 1.00 24.11 H new ATOM 0 HA SER A 48 -8.173 7.417 3.369 1.00 45.12 H new ATOM 0 HB2 SER A 48 -8.196 5.480 5.738 1.00 53.41 H new ATOM 0 HB3 SER A 48 -9.393 6.717 5.412 1.00 53.41 H new ATOM 0 HG SER A 48 -10.075 4.617 4.666 1.00 63.41 H new ATOM 777 N GLY A 49 -5.677 7.359 5.447 1.00 34.11 N ATOM 778 CA GLY A 49 -4.873 8.197 6.313 1.00 61.00 C ATOM 779 C GLY A 49 -5.321 8.169 7.766 1.00 3.03 C ATOM 780 O GLY A 49 -4.929 9.026 8.553 1.00 14.14 O ATOM 0 H GLY A 49 -5.252 6.465 5.202 1.00 34.11 H new ATOM 0 HA2 GLY A 49 -3.833 7.875 6.255 1.00 61.00 H new ATOM 0 HA3 GLY A 49 -4.910 9.224 5.949 1.00 61.00 H new ATOM 784 N ASP A 50 -6.133 7.188 8.128 1.00 20.33 N ATOM 785 CA ASP A 50 -6.657 7.099 9.496 1.00 53.14 C ATOM 786 C ASP A 50 -5.905 6.084 10.326 1.00 21.45 C ATOM 787 O ASP A 50 -5.969 4.886 10.059 1.00 75.51 O ATOM 788 CB ASP A 50 -8.153 6.777 9.522 1.00 52.43 C ATOM 789 CG ASP A 50 -8.998 7.860 8.922 1.00 54.35 C ATOM 790 OD1 ASP A 50 -9.426 7.719 7.771 1.00 32.20 O ATOM 791 OD2 ASP A 50 -9.248 8.885 9.608 1.00 60.23 O ATOM 0 H ASP A 50 -6.446 6.444 7.504 1.00 20.33 H new ATOM 0 HA ASP A 50 -6.509 8.085 9.936 1.00 53.14 H new ATOM 0 HB2 ASP A 50 -8.328 5.847 8.982 1.00 52.43 H new ATOM 0 HB3 ASP A 50 -8.465 6.610 10.553 1.00 52.43 H new ATOM 796 N PRO A 51 -5.182 6.550 11.368 1.00 43.42 N ATOM 797 CA PRO A 51 -4.378 5.683 12.249 1.00 12.45 C ATOM 798 C PRO A 51 -5.219 4.690 13.037 1.00 61.10 C ATOM 799 O PRO A 51 -4.725 3.645 13.457 1.00 31.41 O ATOM 800 CB PRO A 51 -3.652 6.656 13.180 1.00 13.20 C ATOM 801 CG PRO A 51 -4.455 7.908 13.134 1.00 40.23 C ATOM 802 CD PRO A 51 -5.082 7.971 11.770 1.00 2.42 C ATOM 0 HA PRO A 51 -3.697 5.059 11.671 1.00 12.45 H new ATOM 0 HB2 PRO A 51 -3.594 6.262 14.195 1.00 13.20 H new ATOM 0 HB3 PRO A 51 -2.629 6.831 12.847 1.00 13.20 H new ATOM 0 HG2 PRO A 51 -5.219 7.906 13.911 1.00 40.23 H new ATOM 0 HG3 PRO A 51 -3.824 8.779 13.310 1.00 40.23 H new ATOM 0 HD2 PRO A 51 -6.061 8.449 11.800 1.00 2.42 H new ATOM 0 HD3 PRO A 51 -4.469 8.543 11.073 1.00 2.42 H new ATOM 810 N ALA A 52 -6.495 5.030 13.215 1.00 65.12 N ATOM 811 CA ALA A 52 -7.450 4.242 13.995 1.00 2.25 C ATOM 812 C ALA A 52 -7.577 2.791 13.504 1.00 23.34 C ATOM 813 O ALA A 52 -8.029 1.924 14.253 1.00 14.43 O ATOM 814 CB ALA A 52 -8.812 4.922 13.974 1.00 61.52 C ATOM 0 H ALA A 52 -6.902 5.875 12.814 1.00 65.12 H new ATOM 0 HA ALA A 52 -7.068 4.194 15.015 1.00 2.25 H new ATOM 0 HB1 ALA A 52 -9.522 4.333 14.555 1.00 61.52 H new ATOM 0 HB2 ALA A 52 -8.728 5.919 14.406 1.00 61.52 H new ATOM 0 HB3 ALA A 52 -9.163 5.001 12.945 1.00 61.52 H new ATOM 820 N TYR A 53 -7.172 2.525 12.262 1.00 22.10 N ATOM 821 CA TYR A 53 -7.222 1.174 11.732 1.00 72.33 C ATOM 822 C TYR A 53 -6.248 0.244 12.441 1.00 23.34 C ATOM 823 O TYR A 53 -6.527 -0.944 12.600 1.00 52.32 O ATOM 824 CB TYR A 53 -6.945 1.142 10.229 1.00 64.12 C ATOM 825 CG TYR A 53 -8.034 1.752 9.411 1.00 31.04 C ATOM 826 CD1 TYR A 53 -9.293 1.195 9.415 1.00 42.42 C ATOM 827 CD2 TYR A 53 -7.813 2.865 8.630 1.00 42.42 C ATOM 828 CE1 TYR A 53 -10.306 1.725 8.670 1.00 43.20 C ATOM 829 CE2 TYR A 53 -8.822 3.412 7.875 1.00 65.11 C ATOM 830 CZ TYR A 53 -10.070 2.839 7.895 1.00 22.45 C ATOM 831 OH TYR A 53 -11.089 3.388 7.148 1.00 62.32 O ATOM 0 H TYR A 53 -6.810 3.224 11.614 1.00 22.10 H new ATOM 0 HA TYR A 53 -8.237 0.820 11.913 1.00 72.33 H new ATOM 0 HB2 TYR A 53 -6.012 1.668 10.028 1.00 64.12 H new ATOM 0 HB3 TYR A 53 -6.802 0.108 9.916 1.00 64.12 H new ATOM 0 HD1 TYR A 53 -9.483 0.321 10.020 1.00 42.42 H new ATOM 0 HD2 TYR A 53 -6.831 3.315 8.611 1.00 42.42 H new ATOM 0 HE1 TYR A 53 -11.287 1.274 8.688 1.00 43.20 H new ATOM 0 HE2 TYR A 53 -8.635 4.287 7.270 1.00 65.11 H new ATOM 0 HH TYR A 53 -10.753 4.169 6.661 1.00 62.32 H new ATOM 841 N ILE A 54 -5.135 0.779 12.897 1.00 21.10 N ATOM 842 CA ILE A 54 -4.119 -0.045 13.515 1.00 40.41 C ATOM 843 C ILE A 54 -4.428 -0.227 14.997 1.00 44.45 C ATOM 844 O ILE A 54 -4.503 0.758 15.752 1.00 22.41 O ATOM 845 CB ILE A 54 -2.685 0.555 13.345 1.00 1.34 C ATOM 846 CG1 ILE A 54 -2.388 0.837 11.857 1.00 22.40 C ATOM 847 CG2 ILE A 54 -1.629 -0.386 13.932 1.00 62.03 C ATOM 848 CD1 ILE A 54 -2.496 -0.379 10.947 1.00 22.30 C ATOM 0 H ILE A 54 -4.912 1.773 12.852 1.00 21.10 H new ATOM 0 HA ILE A 54 -4.133 -1.011 13.010 1.00 40.41 H new ATOM 0 HB ILE A 54 -2.645 1.498 13.891 1.00 1.34 H new ATOM 0 HG12 ILE A 54 -3.077 1.603 11.501 1.00 22.40 H new ATOM 0 HG13 ILE A 54 -1.383 1.249 11.773 1.00 22.40 H new ATOM 0 HG21 ILE A 54 -0.639 0.052 13.802 1.00 62.03 H new ATOM 0 HG22 ILE A 54 -1.824 -0.534 14.994 1.00 62.03 H new ATOM 0 HG23 ILE A 54 -1.671 -1.346 13.418 1.00 62.03 H new ATOM 0 HD11 ILE A 54 -2.271 -0.087 9.921 1.00 22.30 H new ATOM 0 HD12 ILE A 54 -1.787 -1.140 11.271 1.00 22.30 H new ATOM 0 HD13 ILE A 54 -3.508 -0.781 10.996 1.00 22.30 H new ATOM 860 N PRO A 55 -4.643 -1.480 15.433 1.00 74.00 N ATOM 861 CA PRO A 55 -4.911 -1.778 16.829 1.00 63.31 C ATOM 862 C PRO A 55 -3.666 -1.535 17.676 1.00 42.04 C ATOM 863 O PRO A 55 -2.534 -1.849 17.257 1.00 1.02 O ATOM 864 CB PRO A 55 -5.283 -3.269 16.825 1.00 31.04 C ATOM 865 CG PRO A 55 -4.649 -3.820 15.595 1.00 31.53 C ATOM 866 CD PRO A 55 -4.636 -2.698 14.595 1.00 4.33 C ATOM 0 HA PRO A 55 -5.696 -1.151 17.252 1.00 63.31 H new ATOM 0 HB2 PRO A 55 -4.913 -3.771 17.719 1.00 31.04 H new ATOM 0 HB3 PRO A 55 -6.364 -3.406 16.807 1.00 31.04 H new ATOM 0 HG2 PRO A 55 -3.638 -4.170 15.801 1.00 31.53 H new ATOM 0 HG3 PRO A 55 -5.211 -4.674 15.216 1.00 31.53 H new ATOM 0 HD2 PRO A 55 -3.753 -2.740 13.958 1.00 4.33 H new ATOM 0 HD3 PRO A 55 -5.505 -2.737 13.938 1.00 4.33 H new ATOM 874 N ARG A 56 -3.856 -0.994 18.850 1.00 34.50 N ATOM 875 CA ARG A 56 -2.746 -0.665 19.716 1.00 62.51 C ATOM 876 C ARG A 56 -2.235 -1.871 20.474 1.00 65.53 C ATOM 877 O ARG A 56 -2.508 -2.054 21.654 1.00 51.53 O ATOM 878 CB ARG A 56 -3.028 0.540 20.648 1.00 73.01 C ATOM 879 CG ARG A 56 -3.063 1.916 19.953 1.00 65.01 C ATOM 880 CD ARG A 56 -4.149 2.034 18.887 1.00 53.51 C ATOM 881 NE ARG A 56 -5.499 1.924 19.438 1.00 2.05 N ATOM 882 CZ ARG A 56 -6.625 1.866 18.715 1.00 75.15 C ATOM 883 NH1 ARG A 56 -6.579 1.811 17.378 1.00 14.00 N ATOM 884 NH2 ARG A 56 -7.793 1.844 19.328 1.00 71.31 N ATOM 0 H ARG A 56 -4.774 -0.769 19.234 1.00 34.50 H new ATOM 0 HA ARG A 56 -1.942 -0.341 19.055 1.00 62.51 H new ATOM 0 HB2 ARG A 56 -3.984 0.378 21.145 1.00 73.01 H new ATOM 0 HB3 ARG A 56 -2.265 0.563 21.426 1.00 73.01 H new ATOM 0 HG2 ARG A 56 -3.218 2.690 20.705 1.00 65.01 H new ATOM 0 HG3 ARG A 56 -2.093 2.107 19.494 1.00 65.01 H new ATOM 0 HD2 ARG A 56 -4.047 2.991 18.376 1.00 53.51 H new ATOM 0 HD3 ARG A 56 -4.003 1.256 18.138 1.00 53.51 H new ATOM 0 HE ARG A 56 -5.590 1.889 20.453 1.00 2.05 H new ATOM 0 HH11 ARG A 56 -5.679 1.813 16.898 1.00 14.00 H new ATOM 0 HH12 ARG A 56 -7.444 1.767 16.839 1.00 14.00 H new ATOM 0 HH21 ARG A 56 -7.835 1.871 20.347 1.00 71.31 H new ATOM 0 HH22 ARG A 56 -8.654 1.800 18.783 1.00 71.31 H new ATOM 898 N TYR A 57 -1.591 -2.742 19.743 1.00 40.34 N ATOM 899 CA TYR A 57 -0.946 -3.901 20.295 1.00 21.32 C ATOM 900 C TYR A 57 0.514 -3.609 20.593 1.00 20.41 C ATOM 901 O TYR A 57 1.048 -4.037 21.612 1.00 34.53 O ATOM 902 CB TYR A 57 -1.055 -5.082 19.312 1.00 22.15 C ATOM 903 CG TYR A 57 -0.242 -6.296 19.715 1.00 5.42 C ATOM 904 CD1 TYR A 57 -0.670 -7.143 20.718 1.00 53.11 C ATOM 905 CD2 TYR A 57 0.972 -6.569 19.101 1.00 2.51 C ATOM 906 CE1 TYR A 57 0.075 -8.232 21.097 1.00 73.15 C ATOM 907 CE2 TYR A 57 1.730 -7.649 19.476 1.00 42.23 C ATOM 908 CZ TYR A 57 1.280 -8.483 20.473 1.00 73.53 C ATOM 909 OH TYR A 57 2.050 -9.562 20.860 1.00 60.22 O ATOM 0 H TYR A 57 -1.499 -2.663 18.730 1.00 40.34 H new ATOM 0 HA TYR A 57 -1.445 -4.163 21.228 1.00 21.32 H new ATOM 0 HB2 TYR A 57 -2.102 -5.372 19.223 1.00 22.15 H new ATOM 0 HB3 TYR A 57 -0.731 -4.751 18.325 1.00 22.15 H new ATOM 0 HD1 TYR A 57 -1.609 -6.945 21.214 1.00 53.11 H new ATOM 0 HD2 TYR A 57 1.326 -5.920 18.314 1.00 2.51 H new ATOM 0 HE1 TYR A 57 -0.280 -8.888 21.878 1.00 73.15 H new ATOM 0 HE2 TYR A 57 2.675 -7.843 18.991 1.00 42.23 H new ATOM 0 HH TYR A 57 2.866 -9.593 20.317 1.00 60.22 H new ATOM 919 N GLN A 58 1.151 -2.871 19.715 1.00 43.45 N ATOM 920 CA GLN A 58 2.564 -2.637 19.828 1.00 63.33 C ATOM 921 C GLN A 58 2.868 -1.221 19.306 1.00 11.52 C ATOM 922 O GLN A 58 1.952 -0.510 18.852 1.00 55.34 O ATOM 923 CB GLN A 58 3.300 -3.706 18.976 1.00 20.32 C ATOM 924 CG GLN A 58 4.794 -3.817 19.221 1.00 52.04 C ATOM 925 CD GLN A 58 5.463 -4.828 18.329 1.00 42.23 C ATOM 926 OE1 GLN A 58 4.866 -5.823 17.930 1.00 64.02 O ATOM 927 NE2 GLN A 58 6.695 -4.568 17.994 1.00 60.44 N ATOM 0 H GLN A 58 0.708 -2.423 18.913 1.00 43.45 H new ATOM 0 HA GLN A 58 2.898 -2.710 20.863 1.00 63.33 H new ATOM 0 HB2 GLN A 58 2.844 -4.677 19.169 1.00 20.32 H new ATOM 0 HB3 GLN A 58 3.137 -3.481 17.922 1.00 20.32 H new ATOM 0 HG2 GLN A 58 5.255 -2.842 19.066 1.00 52.04 H new ATOM 0 HG3 GLN A 58 4.967 -4.089 20.262 1.00 52.04 H new ATOM 0 HE21 GLN A 58 7.154 -3.729 18.349 1.00 60.44 H new ATOM 0 HE22 GLN A 58 7.201 -5.204 17.377 1.00 60.44 H new ATOM 936 N ASP A 59 4.144 -0.840 19.343 1.00 32.13 N ATOM 937 CA ASP A 59 4.659 0.459 18.866 1.00 51.02 C ATOM 938 C ASP A 59 4.379 0.691 17.377 1.00 50.22 C ATOM 939 O ASP A 59 4.568 1.785 16.875 1.00 31.35 O ATOM 940 CB ASP A 59 6.166 0.619 19.175 1.00 65.33 C ATOM 941 CG ASP A 59 7.055 -0.406 18.491 1.00 0.33 C ATOM 942 OD1 ASP A 59 7.811 -0.042 17.573 1.00 60.14 O ATOM 943 OD2 ASP A 59 7.022 -1.596 18.885 1.00 62.24 O ATOM 0 H ASP A 59 4.878 -1.441 19.717 1.00 32.13 H new ATOM 0 HA ASP A 59 4.115 1.226 19.417 1.00 51.02 H new ATOM 0 HB2 ASP A 59 6.483 1.617 18.873 1.00 65.33 H new ATOM 0 HB3 ASP A 59 6.314 0.550 20.253 1.00 65.33 H new ATOM 948 N ALA A 60 3.941 -0.355 16.691 1.00 53.54 N ATOM 949 CA ALA A 60 3.598 -0.319 15.266 1.00 70.14 C ATOM 950 C ALA A 60 2.660 0.862 14.906 1.00 52.24 C ATOM 951 O ALA A 60 2.821 1.483 13.858 1.00 52.14 O ATOM 952 CB ALA A 60 2.956 -1.639 14.872 1.00 33.15 C ATOM 0 H ALA A 60 3.809 -1.274 17.113 1.00 53.54 H new ATOM 0 HA ALA A 60 4.521 -0.166 14.707 1.00 70.14 H new ATOM 0 HB1 ALA A 60 2.699 -1.617 13.813 1.00 33.15 H new ATOM 0 HB2 ALA A 60 3.655 -2.454 15.059 1.00 33.15 H new ATOM 0 HB3 ALA A 60 2.052 -1.794 15.461 1.00 33.15 H new ATOM 958 N ARG A 61 1.699 1.172 15.794 1.00 41.12 N ATOM 959 CA ARG A 61 0.768 2.292 15.586 1.00 40.05 C ATOM 960 C ARG A 61 1.562 3.619 15.522 1.00 14.41 C ATOM 961 O ARG A 61 1.219 4.524 14.774 1.00 44.55 O ATOM 962 CB ARG A 61 -0.289 2.289 16.734 1.00 44.21 C ATOM 963 CG ARG A 61 -1.530 3.212 16.581 1.00 4.13 C ATOM 964 CD ARG A 61 -1.231 4.705 16.683 1.00 51.33 C ATOM 965 NE ARG A 61 -2.467 5.508 16.638 1.00 42.40 N ATOM 966 CZ ARG A 61 -2.538 6.832 16.836 1.00 52.25 C ATOM 967 NH1 ARG A 61 -1.438 7.538 17.041 1.00 1.21 N ATOM 968 NH2 ARG A 61 -3.719 7.441 16.827 1.00 14.45 N ATOM 0 H ARG A 61 1.548 0.661 16.664 1.00 41.12 H new ATOM 0 HA ARG A 61 0.238 2.185 14.640 1.00 40.05 H new ATOM 0 HB2 ARG A 61 -0.646 1.266 16.858 1.00 44.21 H new ATOM 0 HB3 ARG A 61 0.220 2.563 17.658 1.00 44.21 H new ATOM 0 HG2 ARG A 61 -1.996 3.014 15.616 1.00 4.13 H new ATOM 0 HG3 ARG A 61 -2.259 2.948 17.347 1.00 4.13 H new ATOM 0 HD2 ARG A 61 -0.698 4.908 17.612 1.00 51.33 H new ATOM 0 HD3 ARG A 61 -0.573 5.002 15.866 1.00 51.33 H new ATOM 0 HE ARG A 61 -3.338 5.016 16.440 1.00 42.40 H new ATOM 0 HH11 ARG A 61 -0.529 7.075 17.049 1.00 1.21 H new ATOM 0 HH12 ARG A 61 -1.499 8.545 17.191 1.00 1.21 H new ATOM 0 HH21 ARG A 61 -4.570 6.901 16.670 1.00 14.45 H new ATOM 0 HH22 ARG A 61 -3.775 8.448 16.978 1.00 14.45 H new ATOM 982 N ASN A 62 2.631 3.699 16.296 1.00 2.45 N ATOM 983 CA ASN A 62 3.502 4.876 16.322 1.00 0.14 C ATOM 984 C ASN A 62 4.374 4.905 15.071 1.00 41.11 C ATOM 985 O ASN A 62 4.515 5.936 14.420 1.00 2.41 O ATOM 986 CB ASN A 62 4.394 4.855 17.581 1.00 62.42 C ATOM 987 CG ASN A 62 5.356 6.036 17.659 1.00 42.23 C ATOM 988 OD1 ASN A 62 6.485 5.979 17.150 1.00 43.40 O ATOM 989 ND2 ASN A 62 4.941 7.088 18.316 1.00 52.10 N ATOM 0 H ASN A 62 2.925 2.953 16.927 1.00 2.45 H new ATOM 0 HA ASN A 62 2.880 5.771 16.347 1.00 0.14 H new ATOM 0 HB2 ASN A 62 3.759 4.853 18.467 1.00 62.42 H new ATOM 0 HB3 ASN A 62 4.966 3.928 17.597 1.00 62.42 H new ATOM 0 HD21 ASN A 62 5.553 7.897 18.423 1.00 52.10 H new ATOM 0 HD22 ASN A 62 4.005 7.100 18.722 1.00 52.10 H new ATOM 996 N LEU A 63 4.932 3.748 14.733 1.00 22.13 N ATOM 997 CA LEU A 63 5.820 3.589 13.573 1.00 45.44 C ATOM 998 C LEU A 63 5.140 4.007 12.275 1.00 1.45 C ATOM 999 O LEU A 63 5.736 4.689 11.429 1.00 0.11 O ATOM 1000 CB LEU A 63 6.265 2.130 13.442 1.00 70.13 C ATOM 1001 CG LEU A 63 7.068 1.546 14.593 1.00 71.34 C ATOM 1002 CD1 LEU A 63 7.346 0.075 14.340 1.00 35.45 C ATOM 1003 CD2 LEU A 63 8.374 2.304 14.762 1.00 70.13 C ATOM 0 H LEU A 63 4.784 2.885 15.256 1.00 22.13 H new ATOM 0 HA LEU A 63 6.681 4.236 13.741 1.00 45.44 H new ATOM 0 HB2 LEU A 63 5.375 1.516 13.304 1.00 70.13 H new ATOM 0 HB3 LEU A 63 6.860 2.038 12.533 1.00 70.13 H new ATOM 0 HG LEU A 63 6.487 1.643 15.510 1.00 71.34 H new ATOM 0 HD11 LEU A 63 7.922 -0.334 15.170 1.00 35.45 H new ATOM 0 HD12 LEU A 63 6.403 -0.464 14.252 1.00 35.45 H new ATOM 0 HD13 LEU A 63 7.914 -0.034 13.416 1.00 35.45 H new ATOM 0 HD21 LEU A 63 8.939 1.875 15.590 1.00 70.13 H new ATOM 0 HD22 LEU A 63 8.959 2.229 13.846 1.00 70.13 H new ATOM 0 HD23 LEU A 63 8.162 3.352 14.972 1.00 70.13 H new ATOM 1015 N ILE A 64 3.891 3.627 12.129 1.00 31.52 N ATOM 1016 CA ILE A 64 3.165 3.883 10.907 1.00 24.14 C ATOM 1017 C ILE A 64 2.763 5.392 10.807 1.00 60.43 C ATOM 1018 O ILE A 64 2.400 5.890 9.743 1.00 42.43 O ATOM 1019 CB ILE A 64 1.944 2.919 10.796 1.00 42.24 C ATOM 1020 CG1 ILE A 64 1.419 2.846 9.364 1.00 3.34 C ATOM 1021 CG2 ILE A 64 0.829 3.344 11.752 1.00 14.31 C ATOM 1022 CD1 ILE A 64 0.335 1.797 9.166 1.00 4.22 C ATOM 0 H ILE A 64 3.355 3.137 12.845 1.00 31.52 H new ATOM 0 HA ILE A 64 3.810 3.680 10.052 1.00 24.14 H new ATOM 0 HB ILE A 64 2.285 1.923 11.079 1.00 42.24 H new ATOM 0 HG12 ILE A 64 1.025 3.822 9.080 1.00 3.34 H new ATOM 0 HG13 ILE A 64 2.249 2.630 8.692 1.00 3.34 H new ATOM 0 HG21 ILE A 64 -0.012 2.658 11.658 1.00 14.31 H new ATOM 0 HG22 ILE A 64 1.201 3.324 12.776 1.00 14.31 H new ATOM 0 HG23 ILE A 64 0.503 4.354 11.504 1.00 14.31 H new ATOM 0 HD11 ILE A 64 0.010 1.802 8.126 1.00 4.22 H new ATOM 0 HD12 ILE A 64 0.730 0.813 9.418 1.00 4.22 H new ATOM 0 HD13 ILE A 64 -0.513 2.024 9.812 1.00 4.22 H new ATOM 1034 N ARG A 65 2.881 6.104 11.935 1.00 50.41 N ATOM 1035 CA ARG A 65 2.637 7.553 12.000 1.00 55.50 C ATOM 1036 C ARG A 65 3.904 8.329 11.650 1.00 21.44 C ATOM 1037 O ARG A 65 3.859 9.525 11.366 1.00 32.44 O ATOM 1038 CB ARG A 65 2.182 7.971 13.415 1.00 61.31 C ATOM 1039 CG ARG A 65 0.751 7.609 13.789 1.00 11.54 C ATOM 1040 CD ARG A 65 -0.232 8.367 12.913 1.00 33.24 C ATOM 1041 NE ARG A 65 -0.008 9.824 12.985 1.00 30.25 N ATOM 1042 CZ ARG A 65 0.211 10.607 11.921 1.00 21.01 C ATOM 1043 NH1 ARG A 65 0.148 10.098 10.709 1.00 14.44 N ATOM 1044 NH2 ARG A 65 0.473 11.912 12.075 1.00 73.12 N ATOM 0 H ARG A 65 3.148 5.693 12.829 1.00 50.41 H new ATOM 0 HA ARG A 65 1.852 7.784 11.280 1.00 55.50 H new ATOM 0 HB2 ARG A 65 2.853 7.513 14.141 1.00 61.31 H new ATOM 0 HB3 ARG A 65 2.299 9.051 13.509 1.00 61.31 H new ATOM 0 HG2 ARG A 65 0.598 6.536 13.674 1.00 11.54 H new ATOM 0 HG3 ARG A 65 0.571 7.846 14.838 1.00 11.54 H new ATOM 0 HD2 ARG A 65 -0.133 8.033 11.880 1.00 33.24 H new ATOM 0 HD3 ARG A 65 -1.251 8.138 13.226 1.00 33.24 H new ATOM 0 HE ARG A 65 -0.021 10.263 13.905 1.00 30.25 H new ATOM 0 HH11 ARG A 65 -0.067 9.109 10.582 1.00 14.44 H new ATOM 0 HH12 ARG A 65 0.314 10.692 9.897 1.00 14.44 H new ATOM 0 HH21 ARG A 65 0.507 12.318 13.010 1.00 73.12 H new ATOM 0 HH22 ARG A 65 0.638 12.499 11.257 1.00 73.12 H new ATOM 1058 N ARG A 66 5.024 7.635 11.656 1.00 50.04 N ATOM 1059 CA ARG A 66 6.329 8.254 11.463 1.00 63.22 C ATOM 1060 C ARG A 66 6.567 8.574 9.981 1.00 11.01 C ATOM 1061 O ARG A 66 7.157 9.596 9.644 1.00 61.43 O ATOM 1062 CB ARG A 66 7.415 7.290 11.975 1.00 13.55 C ATOM 1063 CG ARG A 66 8.849 7.832 12.039 1.00 62.20 C ATOM 1064 CD ARG A 66 9.033 8.885 13.136 1.00 20.14 C ATOM 1065 NE ARG A 66 8.316 10.135 12.883 1.00 15.32 N ATOM 1066 CZ ARG A 66 7.748 10.903 13.826 1.00 61.21 C ATOM 1067 NH1 ARG A 66 7.642 10.475 15.089 1.00 2.11 N ATOM 1068 NH2 ARG A 66 7.267 12.091 13.498 1.00 32.43 N ATOM 0 H ARG A 66 5.060 6.625 11.795 1.00 50.04 H new ATOM 0 HA ARG A 66 6.368 9.190 12.020 1.00 63.22 H new ATOM 0 HB2 ARG A 66 7.132 6.960 12.975 1.00 13.55 H new ATOM 0 HB3 ARG A 66 7.414 6.407 11.336 1.00 13.55 H new ATOM 0 HG2 ARG A 66 9.538 7.006 12.214 1.00 62.20 H new ATOM 0 HG3 ARG A 66 9.112 8.267 11.075 1.00 62.20 H new ATOM 0 HD2 ARG A 66 8.695 8.469 14.085 1.00 20.14 H new ATOM 0 HD3 ARG A 66 10.096 9.102 13.243 1.00 20.14 H new ATOM 0 HE ARG A 66 8.242 10.447 11.915 1.00 15.32 H new ATOM 0 HH11 ARG A 66 7.995 9.553 15.347 1.00 2.11 H new ATOM 0 HH12 ARG A 66 7.208 11.070 15.794 1.00 2.11 H new ATOM 0 HH21 ARG A 66 7.329 12.418 12.534 1.00 32.43 H new ATOM 0 HH22 ARG A 66 6.834 12.680 14.209 1.00 32.43 H new ATOM 1082 N HIS A 67 6.083 7.709 9.113 1.00 52.42 N ATOM 1083 CA HIS A 67 6.292 7.857 7.665 1.00 1.41 C ATOM 1084 C HIS A 67 4.982 8.236 7.005 1.00 13.15 C ATOM 1085 O HIS A 67 3.914 7.902 7.534 1.00 53.03 O ATOM 1086 CB HIS A 67 6.765 6.531 7.046 1.00 1.23 C ATOM 1087 CG HIS A 67 8.053 5.982 7.579 1.00 55.33 C ATOM 1088 ND1 HIS A 67 9.259 6.210 6.988 1.00 2.45 N ATOM 1089 CD2 HIS A 67 8.306 5.171 8.630 1.00 22.43 C ATOM 1090 CE1 HIS A 67 10.197 5.579 7.634 1.00 3.22 C ATOM 1091 NE2 HIS A 67 9.649 4.935 8.640 1.00 45.10 N ATOM 0 H HIS A 67 5.538 6.888 9.375 1.00 52.42 H new ATOM 0 HA HIS A 67 7.047 8.627 7.507 1.00 1.41 H new ATOM 0 HB2 HIS A 67 5.985 5.784 7.195 1.00 1.23 H new ATOM 0 HB3 HIS A 67 6.870 6.672 5.970 1.00 1.23 H new ATOM 0 HD1 HIS A 67 9.406 6.789 6.161 1.00 2.45 H new ATOM 0 HD2 HIS A 67 7.581 4.783 9.330 1.00 22.43 H new ATOM 0 HE1 HIS A 67 11.248 5.584 7.385 1.00 3.22 H new ATOM 1100 N GLU A 68 5.036 8.918 5.858 1.00 65.52 N ATOM 1101 CA GLU A 68 3.799 9.255 5.134 1.00 75.20 C ATOM 1102 C GLU A 68 3.228 8.011 4.487 1.00 64.21 C ATOM 1103 O GLU A 68 3.948 7.038 4.250 1.00 55.51 O ATOM 1104 CB GLU A 68 3.999 10.291 4.016 1.00 5.15 C ATOM 1105 CG GLU A 68 4.467 11.655 4.433 1.00 63.15 C ATOM 1106 CD GLU A 68 4.485 12.613 3.257 1.00 24.41 C ATOM 1107 OE1 GLU A 68 5.481 12.665 2.526 1.00 5.40 O ATOM 1108 OE2 GLU A 68 3.477 13.320 3.040 1.00 0.43 O ATOM 0 H GLU A 68 5.896 9.242 5.417 1.00 65.52 H new ATOM 0 HA GLU A 68 3.130 9.680 5.882 1.00 75.20 H new ATOM 0 HB2 GLU A 68 4.719 9.888 3.304 1.00 5.15 H new ATOM 0 HB3 GLU A 68 3.054 10.404 3.484 1.00 5.15 H new ATOM 0 HG2 GLU A 68 3.812 12.044 5.212 1.00 63.15 H new ATOM 0 HG3 GLU A 68 5.466 11.584 4.863 1.00 63.15 H new ATOM 1115 N ARG A 69 1.944 8.047 4.176 1.00 42.30 N ATOM 1116 CA ARG A 69 1.323 6.957 3.470 1.00 14.43 C ATOM 1117 C ARG A 69 1.871 6.979 2.055 1.00 24.34 C ATOM 1118 O ARG A 69 2.188 5.954 1.484 1.00 41.32 O ATOM 1119 CB ARG A 69 -0.238 7.042 3.433 1.00 23.33 C ATOM 1120 CG ARG A 69 -1.032 6.934 4.764 1.00 13.24 C ATOM 1121 CD ARG A 69 -0.957 8.142 5.680 1.00 62.24 C ATOM 1122 NE ARG A 69 0.318 8.309 6.368 1.00 3.05 N ATOM 1123 CZ ARG A 69 0.611 9.376 7.099 1.00 45.53 C ATOM 1124 NH1 ARG A 69 -0.240 10.385 7.160 1.00 40.15 N ATOM 1125 NH2 ARG A 69 1.751 9.448 7.763 1.00 30.24 N ATOM 0 H ARG A 69 1.319 8.820 4.404 1.00 42.30 H new ATOM 0 HA ARG A 69 1.554 6.029 3.993 1.00 14.43 H new ATOM 0 HB2 ARG A 69 -0.504 7.991 2.967 1.00 23.33 H new ATOM 0 HB3 ARG A 69 -0.595 6.252 2.773 1.00 23.33 H new ATOM 0 HG2 ARG A 69 -2.079 6.747 4.526 1.00 13.24 H new ATOM 0 HG3 ARG A 69 -0.669 6.064 5.311 1.00 13.24 H new ATOM 0 HD2 ARG A 69 -1.157 9.038 5.093 1.00 62.24 H new ATOM 0 HD3 ARG A 69 -1.749 8.065 6.425 1.00 62.24 H new ATOM 0 HE ARG A 69 1.017 7.571 6.283 1.00 3.05 H new ATOM 0 HH11 ARG A 69 -1.120 10.342 6.646 1.00 40.15 H new ATOM 0 HH12 ARG A 69 -0.017 11.207 7.721 1.00 40.15 H new ATOM 0 HH21 ARG A 69 2.418 8.677 7.717 1.00 30.24 H new ATOM 0 HH22 ARG A 69 1.964 10.274 8.322 1.00 30.24 H new ATOM 1139 N ASP A 70 2.004 8.194 1.543 1.00 75.12 N ATOM 1140 CA ASP A 70 2.587 8.501 0.222 1.00 14.43 C ATOM 1141 C ASP A 70 3.989 7.887 0.104 1.00 2.13 C ATOM 1142 O ASP A 70 4.290 7.142 -0.836 1.00 41.24 O ATOM 1143 CB ASP A 70 2.703 10.033 0.121 1.00 61.10 C ATOM 1144 CG ASP A 70 3.302 10.556 -1.175 1.00 31.45 C ATOM 1145 OD1 ASP A 70 2.537 11.070 -2.022 1.00 20.23 O ATOM 1146 OD2 ASP A 70 4.544 10.512 -1.338 1.00 50.23 O ATOM 0 H ASP A 70 1.702 9.030 2.044 1.00 75.12 H new ATOM 0 HA ASP A 70 1.961 8.093 -0.571 1.00 14.43 H new ATOM 0 HB2 ASP A 70 1.710 10.465 0.243 1.00 61.10 H new ATOM 0 HB3 ASP A 70 3.310 10.390 0.953 1.00 61.10 H new ATOM 1151 N GLU A 71 4.801 8.190 1.107 1.00 32.41 N ATOM 1152 CA GLU A 71 6.201 7.776 1.214 1.00 51.44 C ATOM 1153 C GLU A 71 6.338 6.253 1.074 1.00 73.23 C ATOM 1154 O GLU A 71 7.155 5.746 0.293 1.00 3.34 O ATOM 1155 CB GLU A 71 6.708 8.214 2.595 1.00 14.53 C ATOM 1156 CG GLU A 71 8.189 8.072 2.830 1.00 43.41 C ATOM 1157 CD GLU A 71 8.562 8.321 4.273 1.00 53.43 C ATOM 1158 OE1 GLU A 71 9.358 7.537 4.810 1.00 20.45 O ATOM 1159 OE2 GLU A 71 8.017 9.267 4.907 1.00 43.11 O ATOM 0 H GLU A 71 4.495 8.752 1.901 1.00 32.41 H new ATOM 0 HA GLU A 71 6.784 8.236 0.416 1.00 51.44 H new ATOM 0 HB2 GLU A 71 6.435 9.258 2.746 1.00 14.53 H new ATOM 0 HB3 GLU A 71 6.183 7.634 3.354 1.00 14.53 H new ATOM 0 HG2 GLU A 71 8.507 7.070 2.542 1.00 43.41 H new ATOM 0 HG3 GLU A 71 8.726 8.773 2.191 1.00 43.41 H new ATOM 1166 N ILE A 72 5.532 5.544 1.834 1.00 41.01 N ATOM 1167 CA ILE A 72 5.550 4.101 1.855 1.00 0.30 C ATOM 1168 C ILE A 72 4.905 3.507 0.592 1.00 14.42 C ATOM 1169 O ILE A 72 5.440 2.577 -0.015 1.00 24.20 O ATOM 1170 CB ILE A 72 4.796 3.572 3.105 1.00 41.22 C ATOM 1171 CG1 ILE A 72 5.447 4.093 4.399 1.00 65.12 C ATOM 1172 CG2 ILE A 72 4.720 2.049 3.105 1.00 74.02 C ATOM 1173 CD1 ILE A 72 4.749 3.633 5.671 1.00 0.32 C ATOM 0 H ILE A 72 4.841 5.958 2.459 1.00 41.01 H new ATOM 0 HA ILE A 72 6.594 3.791 1.890 1.00 0.30 H new ATOM 0 HB ILE A 72 3.775 3.952 3.063 1.00 41.22 H new ATOM 0 HG12 ILE A 72 6.486 3.766 4.428 1.00 65.12 H new ATOM 0 HG13 ILE A 72 5.457 5.183 4.376 1.00 65.12 H new ATOM 0 HG21 ILE A 72 4.186 1.711 3.993 1.00 74.02 H new ATOM 0 HG22 ILE A 72 4.191 1.711 2.214 1.00 74.02 H new ATOM 0 HG23 ILE A 72 5.728 1.634 3.108 1.00 74.02 H new ATOM 0 HD11 ILE A 72 5.267 4.042 6.539 1.00 0.32 H new ATOM 0 HD12 ILE A 72 3.717 3.983 5.667 1.00 0.32 H new ATOM 0 HD13 ILE A 72 4.762 2.544 5.720 1.00 0.32 H new ATOM 1185 N MET A 73 3.776 4.067 0.198 1.00 32.34 N ATOM 1186 CA MET A 73 2.969 3.509 -0.879 1.00 34.52 C ATOM 1187 C MET A 73 3.692 3.546 -2.228 1.00 22.33 C ATOM 1188 O MET A 73 3.607 2.572 -2.998 1.00 73.52 O ATOM 1189 CB MET A 73 1.568 4.179 -0.924 1.00 74.35 C ATOM 1190 CG MET A 73 0.518 3.506 -1.825 1.00 2.32 C ATOM 1191 SD MET A 73 0.856 3.603 -3.587 1.00 65.34 S ATOM 1192 CE MET A 73 -0.507 2.669 -4.239 1.00 62.11 C ATOM 0 H MET A 73 3.392 4.917 0.611 1.00 32.34 H new ATOM 0 HA MET A 73 2.812 2.452 -0.664 1.00 34.52 H new ATOM 0 HB2 MET A 73 1.174 4.216 0.092 1.00 74.35 H new ATOM 0 HB3 MET A 73 1.692 5.210 -1.255 1.00 74.35 H new ATOM 0 HG2 MET A 73 0.438 2.456 -1.543 1.00 2.32 H new ATOM 0 HG3 MET A 73 -0.452 3.963 -1.631 1.00 2.32 H new ATOM 0 HE1 MET A 73 -0.697 2.973 -5.268 1.00 62.11 H new ATOM 0 HE2 MET A 73 -0.265 1.606 -4.213 1.00 62.11 H new ATOM 0 HE3 MET A 73 -1.396 2.854 -3.636 1.00 62.11 H new ATOM 1202 N GLU A 74 4.437 4.629 -2.524 1.00 24.51 N ATOM 1203 CA GLU A 74 5.149 4.665 -3.801 1.00 61.24 C ATOM 1204 C GLU A 74 6.186 3.556 -3.845 1.00 3.13 C ATOM 1205 O GLU A 74 6.409 2.941 -4.892 1.00 55.13 O ATOM 1206 CB GLU A 74 5.839 6.008 -4.110 1.00 72.21 C ATOM 1207 CG GLU A 74 7.009 6.373 -3.214 1.00 61.53 C ATOM 1208 CD GLU A 74 7.839 7.474 -3.814 1.00 52.10 C ATOM 1209 OE1 GLU A 74 7.528 8.658 -3.590 1.00 50.13 O ATOM 1210 OE2 GLU A 74 8.827 7.163 -4.547 1.00 1.30 O ATOM 0 H GLU A 74 4.555 5.447 -1.927 1.00 24.51 H new ATOM 0 HA GLU A 74 4.385 4.526 -4.566 1.00 61.24 H new ATOM 0 HB2 GLU A 74 6.190 5.985 -5.142 1.00 72.21 H new ATOM 0 HB3 GLU A 74 5.094 6.801 -4.044 1.00 72.21 H new ATOM 0 HG2 GLU A 74 6.638 6.686 -2.238 1.00 61.53 H new ATOM 0 HG3 GLU A 74 7.632 5.494 -3.051 1.00 61.53 H new ATOM 1217 N GLU A 75 6.791 3.290 -2.691 1.00 11.23 N ATOM 1218 CA GLU A 75 7.799 2.278 -2.576 1.00 3.14 C ATOM 1219 C GLU A 75 7.179 0.921 -2.843 1.00 31.41 C ATOM 1220 O GLU A 75 7.710 0.143 -3.610 1.00 42.31 O ATOM 1221 CB GLU A 75 8.466 2.323 -1.194 1.00 32.45 C ATOM 1222 CG GLU A 75 9.641 1.374 -1.050 1.00 72.30 C ATOM 1223 CD GLU A 75 10.738 1.680 -2.049 1.00 62.14 C ATOM 1224 OE1 GLU A 75 11.676 2.423 -1.705 1.00 32.30 O ATOM 1225 OE2 GLU A 75 10.670 1.193 -3.183 1.00 2.51 O ATOM 0 H GLU A 75 6.586 3.777 -1.819 1.00 11.23 H new ATOM 0 HA GLU A 75 8.578 2.462 -3.316 1.00 3.14 H new ATOM 0 HB2 GLU A 75 8.806 3.340 -0.998 1.00 32.45 H new ATOM 0 HB3 GLU A 75 7.722 2.084 -0.434 1.00 32.45 H new ATOM 0 HG2 GLU A 75 10.041 1.442 -0.038 1.00 72.30 H new ATOM 0 HG3 GLU A 75 9.299 0.348 -1.189 1.00 72.30 H new ATOM 1232 N LEU A 76 6.021 0.676 -2.238 1.00 21.32 N ATOM 1233 CA LEU A 76 5.283 -0.576 -2.428 1.00 3.03 C ATOM 1234 C LEU A 76 5.036 -0.819 -3.913 1.00 33.01 C ATOM 1235 O LEU A 76 5.297 -1.908 -4.436 1.00 3.22 O ATOM 1236 CB LEU A 76 3.928 -0.514 -1.707 1.00 43.14 C ATOM 1237 CG LEU A 76 3.961 -0.265 -0.201 1.00 73.11 C ATOM 1238 CD1 LEU A 76 2.553 -0.197 0.352 1.00 12.55 C ATOM 1239 CD2 LEU A 76 4.746 -1.344 0.502 1.00 33.54 C ATOM 0 H LEU A 76 5.566 1.334 -1.605 1.00 21.32 H new ATOM 0 HA LEU A 76 5.880 -1.388 -2.014 1.00 3.03 H new ATOM 0 HB2 LEU A 76 3.333 0.274 -2.169 1.00 43.14 H new ATOM 0 HB3 LEU A 76 3.405 -1.454 -1.885 1.00 43.14 H new ATOM 0 HG LEU A 76 4.455 0.690 -0.023 1.00 73.11 H new ATOM 0 HD11 LEU A 76 2.592 -0.019 1.427 1.00 12.55 H new ATOM 0 HD12 LEU A 76 2.011 0.616 -0.131 1.00 12.55 H new ATOM 0 HD13 LEU A 76 2.040 -1.139 0.159 1.00 12.55 H new ATOM 0 HD21 LEU A 76 4.757 -1.147 1.574 1.00 33.54 H new ATOM 0 HD22 LEU A 76 4.281 -2.312 0.316 1.00 33.54 H new ATOM 0 HD23 LEU A 76 5.769 -1.354 0.125 1.00 33.54 H new ATOM 1251 N THR A 77 4.567 0.217 -4.579 1.00 71.31 N ATOM 1252 CA THR A 77 4.235 0.156 -5.977 1.00 31.34 C ATOM 1253 C THR A 77 5.474 -0.136 -6.855 1.00 72.12 C ATOM 1254 O THR A 77 5.472 -1.075 -7.667 1.00 43.33 O ATOM 1255 CB THR A 77 3.603 1.497 -6.400 1.00 13.52 C ATOM 1256 OG1 THR A 77 2.464 1.761 -5.568 1.00 73.11 O ATOM 1257 CG2 THR A 77 3.164 1.467 -7.854 1.00 42.40 C ATOM 0 H THR A 77 4.406 1.131 -4.155 1.00 71.31 H new ATOM 0 HA THR A 77 3.531 -0.663 -6.124 1.00 31.34 H new ATOM 0 HB THR A 77 4.351 2.282 -6.286 1.00 13.52 H new ATOM 0 HG1 THR A 77 2.760 2.175 -4.730 1.00 73.11 H new ATOM 0 HG21 THR A 77 2.723 2.427 -8.121 1.00 42.40 H new ATOM 0 HG22 THR A 77 4.028 1.275 -8.491 1.00 42.40 H new ATOM 0 HG23 THR A 77 2.426 0.677 -7.995 1.00 42.40 H new ATOM 1265 N LYS A 78 6.527 0.643 -6.680 1.00 31.43 N ATOM 1266 CA LYS A 78 7.707 0.486 -7.506 1.00 61.52 C ATOM 1267 C LYS A 78 8.512 -0.776 -7.159 1.00 11.14 C ATOM 1268 O LYS A 78 9.086 -1.407 -8.035 1.00 5.42 O ATOM 1269 CB LYS A 78 8.555 1.772 -7.548 1.00 24.14 C ATOM 1270 CG LYS A 78 9.166 2.173 -6.270 1.00 55.40 C ATOM 1271 CD LYS A 78 9.774 3.570 -6.340 1.00 32.33 C ATOM 1272 CE LYS A 78 10.390 3.950 -5.013 1.00 21.11 C ATOM 1273 NZ LYS A 78 10.931 5.332 -5.001 1.00 64.24 N ATOM 0 H LYS A 78 6.588 1.383 -5.980 1.00 31.43 H new ATOM 0 HA LYS A 78 7.362 0.324 -8.527 1.00 61.52 H new ATOM 0 HB2 LYS A 78 9.348 1.639 -8.283 1.00 24.14 H new ATOM 0 HB3 LYS A 78 7.926 2.589 -7.902 1.00 24.14 H new ATOM 0 HG2 LYS A 78 8.412 2.145 -5.483 1.00 55.40 H new ATOM 0 HG3 LYS A 78 9.939 1.455 -5.997 1.00 55.40 H new ATOM 0 HD2 LYS A 78 10.533 3.603 -7.122 1.00 32.33 H new ATOM 0 HD3 LYS A 78 9.005 4.294 -6.611 1.00 32.33 H new ATOM 0 HE2 LYS A 78 9.639 3.852 -4.229 1.00 21.11 H new ATOM 0 HE3 LYS A 78 11.191 3.250 -4.776 1.00 21.11 H new ATOM 0 HZ1 LYS A 78 11.645 5.419 -4.250 1.00 64.24 H new ATOM 0 HZ2 LYS A 78 11.369 5.541 -5.921 1.00 64.24 H new ATOM 0 HZ3 LYS A 78 10.159 6.006 -4.824 1.00 64.24 H new ATOM 1287 N TYR A 79 8.526 -1.152 -5.886 1.00 42.22 N ATOM 1288 CA TYR A 79 9.240 -2.353 -5.441 1.00 34.14 C ATOM 1289 C TYR A 79 8.580 -3.591 -6.050 1.00 32.01 C ATOM 1290 O TYR A 79 9.254 -4.556 -6.420 1.00 10.23 O ATOM 1291 CB TYR A 79 9.222 -2.431 -3.913 1.00 64.12 C ATOM 1292 CG TYR A 79 10.037 -3.549 -3.298 1.00 41.22 C ATOM 1293 CD1 TYR A 79 11.335 -3.322 -2.866 1.00 60.30 C ATOM 1294 CD2 TYR A 79 9.500 -4.819 -3.114 1.00 40.32 C ATOM 1295 CE1 TYR A 79 12.077 -4.325 -2.278 1.00 4.44 C ATOM 1296 CE2 TYR A 79 10.235 -5.819 -2.525 1.00 24.43 C ATOM 1297 CZ TYR A 79 11.519 -5.571 -2.111 1.00 15.44 C ATOM 1298 OH TYR A 79 12.247 -6.570 -1.515 1.00 62.33 O ATOM 0 H TYR A 79 8.052 -0.645 -5.139 1.00 42.22 H new ATOM 0 HA TYR A 79 10.277 -2.307 -5.772 1.00 34.14 H new ATOM 0 HB2 TYR A 79 9.584 -1.483 -3.516 1.00 64.12 H new ATOM 0 HB3 TYR A 79 8.188 -2.539 -3.586 1.00 64.12 H new ATOM 0 HD1 TYR A 79 11.773 -2.343 -2.992 1.00 60.30 H new ATOM 0 HD2 TYR A 79 8.490 -5.022 -3.439 1.00 40.32 H new ATOM 0 HE1 TYR A 79 13.088 -4.133 -1.951 1.00 4.44 H new ATOM 0 HE2 TYR A 79 9.802 -6.799 -2.388 1.00 24.43 H new ATOM 0 HH TYR A 79 11.708 -7.387 -1.472 1.00 62.33 H new ATOM 1308 N TYR A 80 7.260 -3.541 -6.172 1.00 21.34 N ATOM 1309 CA TYR A 80 6.490 -4.611 -6.787 1.00 64.32 C ATOM 1310 C TYR A 80 6.993 -4.831 -8.222 1.00 63.24 C ATOM 1311 O TYR A 80 7.213 -5.965 -8.660 1.00 73.40 O ATOM 1312 CB TYR A 80 4.998 -4.229 -6.788 1.00 53.11 C ATOM 1313 CG TYR A 80 4.059 -5.278 -7.344 1.00 32.21 C ATOM 1314 CD1 TYR A 80 3.460 -6.208 -6.509 1.00 71.03 C ATOM 1315 CD2 TYR A 80 3.763 -5.333 -8.700 1.00 5.11 C ATOM 1316 CE1 TYR A 80 2.601 -7.164 -7.007 1.00 75.33 C ATOM 1317 CE2 TYR A 80 2.906 -6.284 -9.203 1.00 53.53 C ATOM 1318 CZ TYR A 80 2.325 -7.198 -8.353 1.00 31.22 C ATOM 1319 OH TYR A 80 1.477 -8.160 -8.856 1.00 72.00 O ATOM 0 H TYR A 80 6.694 -2.757 -5.847 1.00 21.34 H new ATOM 0 HA TYR A 80 6.613 -5.536 -6.224 1.00 64.32 H new ATOM 0 HB2 TYR A 80 4.698 -4.003 -5.765 1.00 53.11 H new ATOM 0 HB3 TYR A 80 4.875 -3.313 -7.366 1.00 53.11 H new ATOM 0 HD1 TYR A 80 3.670 -6.183 -5.450 1.00 71.03 H new ATOM 0 HD2 TYR A 80 4.214 -4.617 -9.371 1.00 5.11 H new ATOM 0 HE1 TYR A 80 2.147 -7.884 -6.342 1.00 75.33 H new ATOM 0 HE2 TYR A 80 2.690 -6.314 -10.261 1.00 53.53 H new ATOM 0 HH TYR A 80 0.709 -7.727 -9.284 1.00 72.00 H new ATOM 1329 N LEU A 81 7.202 -3.736 -8.923 1.00 42.41 N ATOM 1330 CA LEU A 81 7.693 -3.769 -10.288 1.00 21.12 C ATOM 1331 C LEU A 81 9.171 -4.169 -10.335 1.00 15.32 C ATOM 1332 O LEU A 81 9.615 -4.829 -11.284 1.00 32.33 O ATOM 1333 CB LEU A 81 7.480 -2.417 -10.957 1.00 34.51 C ATOM 1334 CG LEU A 81 6.027 -1.949 -11.074 1.00 52.52 C ATOM 1335 CD1 LEU A 81 5.958 -0.578 -11.715 1.00 4.54 C ATOM 1336 CD2 LEU A 81 5.206 -2.951 -11.872 1.00 31.01 C ATOM 0 H LEU A 81 7.036 -2.796 -8.563 1.00 42.41 H new ATOM 0 HA LEU A 81 7.128 -4.523 -10.835 1.00 21.12 H new ATOM 0 HB2 LEU A 81 8.039 -1.666 -10.400 1.00 34.51 H new ATOM 0 HB3 LEU A 81 7.910 -2.457 -11.958 1.00 34.51 H new ATOM 0 HG LEU A 81 5.608 -1.881 -10.070 1.00 52.52 H new ATOM 0 HD11 LEU A 81 4.917 -0.263 -11.789 1.00 4.54 H new ATOM 0 HD12 LEU A 81 6.511 0.137 -11.106 1.00 4.54 H new ATOM 0 HD13 LEU A 81 6.396 -0.620 -12.712 1.00 4.54 H new ATOM 0 HD21 LEU A 81 4.176 -2.602 -11.945 1.00 31.01 H new ATOM 0 HD22 LEU A 81 5.627 -3.051 -12.873 1.00 31.01 H new ATOM 0 HD23 LEU A 81 5.226 -3.919 -11.371 1.00 31.01 H new ATOM 1348 N ALA A 82 9.915 -3.802 -9.294 1.00 64.13 N ATOM 1349 CA ALA A 82 11.338 -4.125 -9.188 1.00 44.31 C ATOM 1350 C ALA A 82 11.557 -5.636 -9.182 1.00 24.22 C ATOM 1351 O ALA A 82 12.579 -6.128 -9.671 1.00 24.42 O ATOM 1352 CB ALA A 82 11.950 -3.485 -7.952 1.00 2.02 C ATOM 0 H ALA A 82 9.551 -3.274 -8.501 1.00 64.13 H new ATOM 0 HA ALA A 82 11.840 -3.715 -10.064 1.00 44.31 H new ATOM 0 HB1 ALA A 82 13.008 -3.740 -7.896 1.00 2.02 H new ATOM 0 HB2 ALA A 82 11.841 -2.402 -8.011 1.00 2.02 H new ATOM 0 HB3 ALA A 82 11.441 -3.853 -7.062 1.00 2.02 H new ATOM 1358 N ASN A 83 10.568 -6.373 -8.669 1.00 22.51 N ATOM 1359 CA ASN A 83 10.617 -7.849 -8.654 1.00 35.23 C ATOM 1360 C ASN A 83 10.532 -8.441 -10.053 1.00 30.32 C ATOM 1361 O ASN A 83 10.701 -9.636 -10.237 1.00 3.52 O ATOM 1362 CB ASN A 83 9.519 -8.475 -7.775 1.00 14.52 C ATOM 1363 CG ASN A 83 9.759 -8.350 -6.284 1.00 14.14 C ATOM 1364 OD1 ASN A 83 10.388 -9.222 -5.670 1.00 21.12 O ATOM 1365 ND2 ASN A 83 9.269 -7.300 -5.683 1.00 74.34 N ATOM 0 H ASN A 83 9.722 -5.978 -8.258 1.00 22.51 H new ATOM 0 HA ASN A 83 11.586 -8.095 -8.221 1.00 35.23 H new ATOM 0 HB2 ASN A 83 8.566 -8.005 -8.017 1.00 14.52 H new ATOM 0 HB3 ASN A 83 9.427 -9.531 -8.028 1.00 14.52 H new ATOM 0 HD21 ASN A 83 9.400 -7.180 -4.679 1.00 74.34 H new ATOM 0 HD22 ASN A 83 8.755 -6.600 -6.218 1.00 74.34 H new ATOM 1372 N HIS A 84 10.263 -7.607 -11.044 1.00 52.42 N ATOM 1373 CA HIS A 84 10.171 -8.084 -12.414 1.00 22.55 C ATOM 1374 C HIS A 84 11.463 -7.811 -13.162 1.00 40.52 C ATOM 1375 O HIS A 84 11.555 -8.032 -14.373 1.00 73.22 O ATOM 1376 CB HIS A 84 8.991 -7.448 -13.159 1.00 13.24 C ATOM 1377 CG HIS A 84 7.669 -7.668 -12.501 1.00 33.10 C ATOM 1378 ND1 HIS A 84 7.287 -8.874 -11.968 1.00 2.44 N ATOM 1379 CD2 HIS A 84 6.658 -6.812 -12.243 1.00 63.24 C ATOM 1380 CE1 HIS A 84 6.111 -8.752 -11.413 1.00 10.30 C ATOM 1381 NE2 HIS A 84 5.701 -7.513 -11.559 1.00 1.10 N ATOM 0 H HIS A 84 10.106 -6.606 -10.928 1.00 52.42 H new ATOM 0 HA HIS A 84 10.002 -9.160 -12.372 1.00 22.55 H new ATOM 0 HB2 HIS A 84 9.167 -6.376 -13.249 1.00 13.24 H new ATOM 0 HB3 HIS A 84 8.953 -7.851 -14.171 1.00 13.24 H new ATOM 0 HD1 HIS A 84 7.837 -9.733 -12.000 1.00 2.44 H new ATOM 0 HD2 HIS A 84 6.612 -5.770 -12.523 1.00 63.24 H new ATOM 0 HE1 HIS A 84 5.565 -9.540 -10.916 1.00 10.30 H new ATOM 1390 N GLY A 85 12.462 -7.336 -12.438 1.00 15.05 N ATOM 1391 CA GLY A 85 13.738 -7.025 -13.050 1.00 44.01 C ATOM 1392 C GLY A 85 13.738 -5.640 -13.638 1.00 62.42 C ATOM 1393 O GLY A 85 14.596 -5.289 -14.433 1.00 51.43 O ATOM 0 H GLY A 85 12.414 -7.159 -11.435 1.00 15.05 H new ATOM 0 HA2 GLY A 85 14.530 -7.107 -12.306 1.00 44.01 H new ATOM 0 HA3 GLY A 85 13.957 -7.754 -13.830 1.00 44.01 H new ATOM 1397 N ILE A 86 12.760 -4.861 -13.248 1.00 64.55 N ATOM 1398 CA ILE A 86 12.637 -3.510 -13.714 1.00 40.12 C ATOM 1399 C ILE A 86 13.345 -2.597 -12.745 1.00 72.34 C ATOM 1400 O ILE A 86 13.133 -2.685 -11.528 1.00 0.12 O ATOM 1401 CB ILE A 86 11.150 -3.084 -13.834 1.00 70.53 C ATOM 1402 CG1 ILE A 86 10.414 -4.007 -14.811 1.00 54.45 C ATOM 1403 CG2 ILE A 86 11.028 -1.618 -14.276 1.00 52.55 C ATOM 1404 CD1 ILE A 86 8.951 -3.676 -14.973 1.00 22.20 C ATOM 0 H ILE A 86 12.029 -5.149 -12.598 1.00 64.55 H new ATOM 0 HA ILE A 86 13.086 -3.441 -14.705 1.00 40.12 H new ATOM 0 HB ILE A 86 10.688 -3.174 -12.851 1.00 70.53 H new ATOM 0 HG12 ILE A 86 10.900 -3.952 -15.785 1.00 54.45 H new ATOM 0 HG13 ILE A 86 10.508 -5.036 -14.466 1.00 54.45 H new ATOM 0 HG21 ILE A 86 9.975 -1.347 -14.352 1.00 52.55 H new ATOM 0 HG22 ILE A 86 11.516 -0.975 -13.543 1.00 52.55 H new ATOM 0 HG23 ILE A 86 11.506 -1.490 -15.247 1.00 52.55 H new ATOM 0 HD11 ILE A 86 8.497 -4.371 -15.679 1.00 22.20 H new ATOM 0 HD12 ILE A 86 8.450 -3.759 -14.008 1.00 22.20 H new ATOM 0 HD13 ILE A 86 8.848 -2.658 -15.349 1.00 22.20 H new ATOM 1416 N ASP A 87 14.186 -1.757 -13.257 1.00 61.32 N ATOM 1417 CA ASP A 87 14.901 -0.814 -12.430 1.00 73.00 C ATOM 1418 C ASP A 87 14.212 0.512 -12.477 1.00 21.43 C ATOM 1419 O ASP A 87 14.057 1.113 -13.544 1.00 53.23 O ATOM 1420 CB ASP A 87 16.373 -0.682 -12.825 1.00 23.22 C ATOM 1421 CG ASP A 87 17.119 0.348 -11.986 1.00 61.13 C ATOM 1422 OD1 ASP A 87 17.405 0.083 -10.796 1.00 42.12 O ATOM 1423 OD2 ASP A 87 17.447 1.435 -12.518 1.00 22.24 O ATOM 0 H ASP A 87 14.402 -1.698 -14.252 1.00 61.32 H new ATOM 0 HA ASP A 87 14.894 -1.193 -11.408 1.00 73.00 H new ATOM 0 HB2 ASP A 87 16.861 -1.651 -12.721 1.00 23.22 H new ATOM 0 HB3 ASP A 87 16.439 -0.404 -13.877 1.00 23.22 H new ATOM 1428 N ILE A 88 13.786 0.961 -11.342 1.00 65.42 N ATOM 1429 CA ILE A 88 13.044 2.183 -11.238 1.00 14.24 C ATOM 1430 C ILE A 88 13.892 3.244 -10.565 1.00 3.35 C ATOM 1431 O ILE A 88 14.743 2.929 -9.719 1.00 42.24 O ATOM 1432 CB ILE A 88 11.723 1.943 -10.448 1.00 5.41 C ATOM 1433 CG1 ILE A 88 10.883 0.883 -11.171 1.00 3.34 C ATOM 1434 CG2 ILE A 88 10.925 3.234 -10.273 1.00 2.23 C ATOM 1435 CD1 ILE A 88 9.578 0.565 -10.497 1.00 4.14 C ATOM 0 H ILE A 88 13.942 0.489 -10.451 1.00 65.42 H new ATOM 0 HA ILE A 88 12.783 2.532 -12.237 1.00 14.24 H new ATOM 0 HB ILE A 88 11.979 1.587 -9.450 1.00 5.41 H new ATOM 0 HG12 ILE A 88 10.681 1.226 -12.186 1.00 3.34 H new ATOM 0 HG13 ILE A 88 11.468 -0.033 -11.255 1.00 3.34 H new ATOM 0 HG21 ILE A 88 10.011 3.024 -9.717 1.00 2.23 H new ATOM 0 HG22 ILE A 88 11.524 3.961 -9.725 1.00 2.23 H new ATOM 0 HG23 ILE A 88 10.669 3.639 -11.252 1.00 2.23 H new ATOM 0 HD11 ILE A 88 9.046 -0.193 -11.072 1.00 4.14 H new ATOM 0 HD12 ILE A 88 9.770 0.189 -9.492 1.00 4.14 H new ATOM 0 HD13 ILE A 88 8.970 1.468 -10.437 1.00 4.14 H new ATOM 1767 N ALA B 19 -2.607 -10.076 -13.274 1.00 11.11 N ATOM 1768 CA ALA B 19 -3.127 -9.203 -14.314 1.00 24.42 C ATOM 1769 C ALA B 19 -2.961 -7.761 -13.862 1.00 11.14 C ATOM 1770 O ALA B 19 -2.754 -6.856 -14.664 1.00 35.23 O ATOM 1771 CB ALA B 19 -4.580 -9.490 -14.539 1.00 34.32 C ATOM 0 HA ALA B 19 -2.584 -9.372 -15.244 1.00 24.42 H new ATOM 0 HB1 ALA B 19 -4.964 -8.833 -15.319 1.00 34.32 H new ATOM 0 HB2 ALA B 19 -4.702 -10.529 -14.846 1.00 34.32 H new ATOM 0 HB3 ALA B 19 -5.132 -9.318 -13.615 1.00 34.32 H new ATOM 1777 N ILE B 20 -3.036 -7.567 -12.542 1.00 21.01 N ATOM 1778 CA ILE B 20 -2.805 -6.276 -11.932 1.00 10.44 C ATOM 1779 C ILE B 20 -1.372 -5.841 -12.223 1.00 64.21 C ATOM 1780 O ILE B 20 -1.090 -4.666 -12.434 1.00 2.23 O ATOM 1781 CB ILE B 20 -3.036 -6.324 -10.389 1.00 74.15 C ATOM 1782 CG1 ILE B 20 -4.502 -6.663 -10.066 1.00 64.23 C ATOM 1783 CG2 ILE B 20 -2.621 -5.015 -9.725 1.00 32.03 C ATOM 1784 CD1 ILE B 20 -4.812 -6.734 -8.579 1.00 61.44 C ATOM 0 H ILE B 20 -3.259 -8.307 -11.876 1.00 21.01 H new ATOM 0 HA ILE B 20 -3.512 -5.561 -12.353 1.00 10.44 H new ATOM 0 HB ILE B 20 -2.406 -7.115 -9.983 1.00 74.15 H new ATOM 0 HG12 ILE B 20 -5.146 -5.913 -10.525 1.00 64.23 H new ATOM 0 HG13 ILE B 20 -4.751 -7.620 -10.524 1.00 64.23 H new ATOM 0 HG21 ILE B 20 -2.794 -5.081 -8.651 1.00 32.03 H new ATOM 0 HG22 ILE B 20 -1.563 -4.832 -9.911 1.00 32.03 H new ATOM 0 HG23 ILE B 20 -3.209 -4.195 -10.138 1.00 32.03 H new ATOM 0 HD11 ILE B 20 -5.865 -6.978 -8.438 1.00 61.44 H new ATOM 0 HD12 ILE B 20 -4.196 -7.505 -8.115 1.00 61.44 H new ATOM 0 HD13 ILE B 20 -4.597 -5.771 -8.116 1.00 61.44 H new ATOM 1796 N SER B 21 -0.485 -6.815 -12.302 1.00 44.25 N ATOM 1797 CA SER B 21 0.913 -6.543 -12.560 1.00 72.54 C ATOM 1798 C SER B 21 1.070 -6.106 -14.000 1.00 14.22 C ATOM 1799 O SER B 21 1.800 -5.165 -14.287 1.00 74.50 O ATOM 1800 CB SER B 21 1.788 -7.765 -12.267 1.00 10.43 C ATOM 1801 OG SER B 21 3.173 -7.469 -12.436 1.00 0.41 O ATOM 0 H SER B 21 -0.710 -7.804 -12.191 1.00 44.25 H new ATOM 0 HA SER B 21 1.245 -5.746 -11.895 1.00 72.54 H new ATOM 0 HB2 SER B 21 1.609 -8.105 -11.247 1.00 10.43 H new ATOM 0 HB3 SER B 21 1.506 -8.583 -12.930 1.00 10.43 H new ATOM 0 HG SER B 21 3.688 -7.888 -11.715 1.00 0.41 H new ATOM 1807 N GLU B 22 0.355 -6.785 -14.898 1.00 74.22 N ATOM 1808 CA GLU B 22 0.324 -6.424 -16.310 1.00 53.41 C ATOM 1809 C GLU B 22 -0.120 -4.966 -16.443 1.00 65.31 C ATOM 1810 O GLU B 22 0.417 -4.207 -17.251 1.00 61.42 O ATOM 1811 CB GLU B 22 -0.651 -7.333 -17.066 1.00 33.30 C ATOM 1812 CG GLU B 22 -0.282 -8.812 -17.086 1.00 25.35 C ATOM 1813 CD GLU B 22 0.989 -9.085 -17.849 1.00 1.31 C ATOM 1814 OE1 GLU B 22 0.958 -9.020 -19.104 1.00 31.32 O ATOM 1815 OE2 GLU B 22 2.025 -9.388 -17.226 1.00 52.00 O ATOM 0 H GLU B 22 -0.216 -7.597 -14.665 1.00 74.22 H new ATOM 0 HA GLU B 22 1.319 -6.547 -16.737 1.00 53.41 H new ATOM 0 HB2 GLU B 22 -1.640 -7.228 -16.619 1.00 33.30 H new ATOM 0 HB3 GLU B 22 -0.727 -6.981 -18.095 1.00 33.30 H new ATOM 0 HG2 GLU B 22 -0.170 -9.168 -16.062 1.00 25.35 H new ATOM 0 HG3 GLU B 22 -1.098 -9.380 -17.533 1.00 25.35 H new ATOM 1822 N THR B 23 -1.087 -4.588 -15.621 1.00 1.13 N ATOM 1823 CA THR B 23 -1.575 -3.232 -15.574 1.00 30.34 C ATOM 1824 C THR B 23 -0.469 -2.267 -15.084 1.00 42.02 C ATOM 1825 O THR B 23 -0.134 -1.303 -15.772 1.00 35.01 O ATOM 1826 CB THR B 23 -2.793 -3.151 -14.621 1.00 14.23 C ATOM 1827 OG1 THR B 23 -3.843 -4.011 -15.092 1.00 64.52 O ATOM 1828 CG2 THR B 23 -3.308 -1.723 -14.484 1.00 34.24 C ATOM 0 H THR B 23 -1.552 -5.220 -14.969 1.00 1.13 H new ATOM 0 HA THR B 23 -1.873 -2.936 -16.580 1.00 30.34 H new ATOM 0 HB THR B 23 -2.467 -3.481 -13.635 1.00 14.23 H new ATOM 0 HG1 THR B 23 -3.576 -4.947 -14.975 1.00 64.52 H new ATOM 0 HG21 THR B 23 -4.163 -1.708 -13.807 1.00 34.24 H new ATOM 0 HG22 THR B 23 -2.517 -1.088 -14.084 1.00 34.24 H new ATOM 0 HG23 THR B 23 -3.613 -1.351 -15.462 1.00 34.24 H new ATOM 1836 N LEU B 24 0.125 -2.580 -13.935 1.00 54.33 N ATOM 1837 CA LEU B 24 1.148 -1.734 -13.303 1.00 12.35 C ATOM 1838 C LEU B 24 2.356 -1.526 -14.203 1.00 63.33 C ATOM 1839 O LEU B 24 2.821 -0.397 -14.376 1.00 42.13 O ATOM 1840 CB LEU B 24 1.577 -2.325 -11.962 1.00 25.25 C ATOM 1841 CG LEU B 24 0.482 -2.458 -10.910 1.00 42.12 C ATOM 1842 CD1 LEU B 24 1.015 -3.152 -9.683 1.00 62.25 C ATOM 1843 CD2 LEU B 24 -0.067 -1.096 -10.537 1.00 61.22 C ATOM 0 H LEU B 24 -0.086 -3.429 -13.410 1.00 54.33 H new ATOM 0 HA LEU B 24 0.698 -0.756 -13.133 1.00 12.35 H new ATOM 0 HB2 LEU B 24 2.002 -3.312 -12.142 1.00 25.25 H new ATOM 0 HB3 LEU B 24 2.374 -1.704 -11.552 1.00 25.25 H new ATOM 0 HG LEU B 24 -0.326 -3.056 -11.331 1.00 42.12 H new ATOM 0 HD11 LEU B 24 0.221 -3.240 -8.941 1.00 62.25 H new ATOM 0 HD12 LEU B 24 1.371 -4.146 -9.953 1.00 62.25 H new ATOM 0 HD13 LEU B 24 1.839 -2.573 -9.266 1.00 62.25 H new ATOM 0 HD21 LEU B 24 -0.847 -1.212 -9.785 1.00 61.22 H new ATOM 0 HD22 LEU B 24 0.736 -0.478 -10.135 1.00 61.22 H new ATOM 0 HD23 LEU B 24 -0.485 -0.617 -11.423 1.00 61.22 H new ATOM 1855 N GLU B 25 2.844 -2.613 -14.788 1.00 52.14 N ATOM 1856 CA GLU B 25 3.972 -2.568 -15.705 1.00 12.32 C ATOM 1857 C GLU B 25 3.662 -1.640 -16.895 1.00 72.13 C ATOM 1858 O GLU B 25 4.506 -0.841 -17.322 1.00 71.00 O ATOM 1859 CB GLU B 25 4.307 -3.984 -16.180 1.00 62.00 C ATOM 1860 CG GLU B 25 4.838 -4.881 -15.068 1.00 32.40 C ATOM 1861 CD GLU B 25 5.029 -6.311 -15.498 1.00 73.53 C ATOM 1862 OE1 GLU B 25 5.723 -6.551 -16.504 1.00 2.40 O ATOM 1863 OE2 GLU B 25 4.523 -7.231 -14.806 1.00 71.15 O ATOM 0 H GLU B 25 2.468 -3.549 -14.639 1.00 52.14 H new ATOM 0 HA GLU B 25 4.841 -2.163 -15.187 1.00 12.32 H new ATOM 0 HB2 GLU B 25 3.413 -4.438 -16.608 1.00 62.00 H new ATOM 0 HB3 GLU B 25 5.048 -3.927 -16.977 1.00 62.00 H new ATOM 0 HG2 GLU B 25 5.790 -4.485 -14.714 1.00 32.40 H new ATOM 0 HG3 GLU B 25 4.147 -4.851 -14.225 1.00 32.40 H new ATOM 1870 N THR B 26 2.426 -1.720 -17.384 1.00 64.05 N ATOM 1871 CA THR B 26 1.970 -0.887 -18.479 1.00 53.45 C ATOM 1872 C THR B 26 1.911 0.589 -18.054 1.00 2.40 C ATOM 1873 O THR B 26 2.384 1.473 -18.782 1.00 75.21 O ATOM 1874 CB THR B 26 0.572 -1.337 -18.974 1.00 41.23 C ATOM 1875 OG1 THR B 26 0.625 -2.703 -19.413 1.00 32.13 O ATOM 1876 CG2 THR B 26 0.095 -0.461 -20.122 1.00 45.24 C ATOM 0 H THR B 26 1.719 -2.364 -17.029 1.00 64.05 H new ATOM 0 HA THR B 26 2.686 -0.996 -19.294 1.00 53.45 H new ATOM 0 HB THR B 26 -0.128 -1.242 -18.144 1.00 41.23 H new ATOM 0 HG1 THR B 26 0.287 -3.288 -18.703 1.00 32.13 H new ATOM 0 HG21 THR B 26 -0.888 -0.797 -20.452 1.00 45.24 H new ATOM 0 HG22 THR B 26 0.031 0.574 -19.787 1.00 45.24 H new ATOM 0 HG23 THR B 26 0.799 -0.532 -20.951 1.00 45.24 H new ATOM 1884 N VAL B 27 1.342 0.849 -16.874 1.00 34.13 N ATOM 1885 CA VAL B 27 1.212 2.213 -16.371 1.00 60.33 C ATOM 1886 C VAL B 27 2.590 2.836 -16.178 1.00 72.24 C ATOM 1887 O VAL B 27 2.811 4.000 -16.525 1.00 62.23 O ATOM 1888 CB VAL B 27 0.405 2.284 -15.036 1.00 12.40 C ATOM 1889 CG1 VAL B 27 0.245 3.724 -14.583 1.00 54.51 C ATOM 1890 CG2 VAL B 27 -0.964 1.635 -15.183 1.00 35.41 C ATOM 0 H VAL B 27 0.966 0.133 -16.253 1.00 34.13 H new ATOM 0 HA VAL B 27 0.653 2.777 -17.118 1.00 60.33 H new ATOM 0 HB VAL B 27 0.968 1.734 -14.282 1.00 12.40 H new ATOM 0 HG11 VAL B 27 -0.320 3.752 -13.651 1.00 54.51 H new ATOM 0 HG12 VAL B 27 1.228 4.167 -14.424 1.00 54.51 H new ATOM 0 HG13 VAL B 27 -0.288 4.289 -15.348 1.00 54.51 H new ATOM 0 HG21 VAL B 27 -1.501 1.701 -14.237 1.00 35.41 H new ATOM 0 HG22 VAL B 27 -1.530 2.151 -15.958 1.00 35.41 H new ATOM 0 HG23 VAL B 27 -0.842 0.588 -15.459 1.00 35.41 H new ATOM 1900 N TYR B 28 3.520 2.043 -15.661 1.00 3.42 N ATOM 1901 CA TYR B 28 4.878 2.496 -15.448 1.00 40.30 C ATOM 1902 C TYR B 28 5.506 2.989 -16.744 1.00 52.13 C ATOM 1903 O TYR B 28 5.951 4.131 -16.827 1.00 60.54 O ATOM 1904 CB TYR B 28 5.743 1.388 -14.822 1.00 42.10 C ATOM 1905 CG TYR B 28 7.198 1.781 -14.655 1.00 33.40 C ATOM 1906 CD1 TYR B 28 8.167 1.333 -15.547 1.00 72.23 C ATOM 1907 CD2 TYR B 28 7.599 2.608 -13.620 1.00 60.22 C ATOM 1908 CE1 TYR B 28 9.490 1.698 -15.409 1.00 11.32 C ATOM 1909 CE2 TYR B 28 8.919 2.982 -13.476 1.00 25.42 C ATOM 1910 CZ TYR B 28 9.860 2.526 -14.373 1.00 64.23 C ATOM 1911 OH TYR B 28 11.180 2.899 -14.230 1.00 54.14 O ATOM 0 H TYR B 28 3.351 1.077 -15.381 1.00 3.42 H new ATOM 0 HA TYR B 28 4.835 3.332 -14.750 1.00 40.30 H new ATOM 0 HB2 TYR B 28 5.332 1.123 -13.848 1.00 42.10 H new ATOM 0 HB3 TYR B 28 5.685 0.496 -15.446 1.00 42.10 H new ATOM 0 HD1 TYR B 28 7.878 0.687 -16.363 1.00 72.23 H new ATOM 0 HD2 TYR B 28 6.866 2.967 -12.913 1.00 60.22 H new ATOM 0 HE1 TYR B 28 10.230 1.337 -16.108 1.00 11.32 H new ATOM 0 HE2 TYR B 28 9.214 3.630 -12.663 1.00 25.42 H new ATOM 0 HH TYR B 28 11.272 3.485 -13.450 1.00 54.14 H new ATOM 1921 N ARG B 29 5.512 2.141 -17.755 1.00 3.43 N ATOM 1922 CA ARG B 29 6.113 2.495 -19.032 1.00 41.23 C ATOM 1923 C ARG B 29 5.371 3.612 -19.746 1.00 21.45 C ATOM 1924 O ARG B 29 5.987 4.397 -20.453 1.00 44.34 O ATOM 1925 CB ARG B 29 6.330 1.280 -19.927 1.00 42.51 C ATOM 1926 CG ARG B 29 7.374 0.302 -19.397 1.00 14.24 C ATOM 1927 CD ARG B 29 8.762 0.950 -19.306 1.00 3.11 C ATOM 1928 NE ARG B 29 9.773 0.016 -18.797 1.00 41.54 N ATOM 1929 CZ ARG B 29 11.076 0.303 -18.587 1.00 42.22 C ATOM 1930 NH1 ARG B 29 11.569 1.526 -18.859 1.00 0.25 N ATOM 1931 NH2 ARG B 29 11.887 -0.638 -18.113 1.00 72.13 N ATOM 0 H ARG B 29 5.109 1.204 -17.720 1.00 3.43 H new ATOM 0 HA ARG B 29 7.101 2.892 -18.799 1.00 41.23 H new ATOM 0 HB2 ARG B 29 5.382 0.755 -20.047 1.00 42.51 H new ATOM 0 HB3 ARG B 29 6.634 1.620 -20.917 1.00 42.51 H new ATOM 0 HG2 ARG B 29 7.073 -0.054 -18.412 1.00 14.24 H new ATOM 0 HG3 ARG B 29 7.421 -0.570 -20.050 1.00 14.24 H new ATOM 0 HD2 ARG B 29 9.061 1.306 -20.292 1.00 3.11 H new ATOM 0 HD3 ARG B 29 8.713 1.822 -18.654 1.00 3.11 H new ATOM 0 HE ARG B 29 9.465 -0.933 -18.583 1.00 41.54 H new ATOM 0 HH11 ARG B 29 10.956 2.252 -19.229 1.00 0.25 H new ATOM 0 HH12 ARG B 29 12.556 1.726 -18.695 1.00 0.25 H new ATOM 0 HH21 ARG B 29 11.524 -1.569 -17.910 1.00 72.13 H new ATOM 0 HH22 ARG B 29 12.872 -0.428 -17.952 1.00 72.13 H new ATOM 1945 N ALA B 30 4.065 3.695 -19.531 1.00 72.54 N ATOM 1946 CA ALA B 30 3.246 4.733 -20.154 1.00 73.43 C ATOM 1947 C ALA B 30 3.767 6.127 -19.805 1.00 35.53 C ATOM 1948 O ALA B 30 4.056 6.930 -20.690 1.00 61.51 O ATOM 1949 CB ALA B 30 1.787 4.591 -19.746 1.00 73.11 C ATOM 0 H ALA B 30 3.546 3.056 -18.929 1.00 72.54 H new ATOM 0 HA ALA B 30 3.314 4.606 -21.234 1.00 73.43 H new ATOM 0 HB1 ALA B 30 1.198 5.375 -20.222 1.00 73.11 H new ATOM 0 HB2 ALA B 30 1.415 3.616 -20.060 1.00 73.11 H new ATOM 0 HB3 ALA B 30 1.702 4.681 -18.663 1.00 73.11 H new ATOM 1955 N LEU B 31 3.896 6.415 -18.513 1.00 12.43 N ATOM 1956 CA LEU B 31 4.409 7.715 -18.097 1.00 14.03 C ATOM 1957 C LEU B 31 5.897 7.837 -18.323 1.00 42.31 C ATOM 1958 O LEU B 31 6.402 8.934 -18.549 1.00 71.14 O ATOM 1959 CB LEU B 31 4.075 8.098 -16.652 1.00 3.45 C ATOM 1960 CG LEU B 31 2.604 8.290 -16.293 1.00 64.12 C ATOM 1961 CD1 LEU B 31 1.900 6.983 -16.025 1.00 61.40 C ATOM 1962 CD2 LEU B 31 2.459 9.232 -15.139 1.00 1.41 C ATOM 0 H LEU B 31 3.658 5.780 -17.751 1.00 12.43 H new ATOM 0 HA LEU B 31 3.884 8.423 -18.739 1.00 14.03 H new ATOM 0 HB2 LEU B 31 4.483 7.327 -15.998 1.00 3.45 H new ATOM 0 HB3 LEU B 31 4.601 9.024 -16.420 1.00 3.45 H new ATOM 0 HG LEU B 31 2.117 8.732 -17.162 1.00 64.12 H new ATOM 0 HD11 LEU B 31 0.857 7.176 -15.774 1.00 61.40 H new ATOM 0 HD12 LEU B 31 1.949 6.354 -16.914 1.00 61.40 H new ATOM 0 HD13 LEU B 31 2.385 6.473 -15.193 1.00 61.40 H new ATOM 0 HD21 LEU B 31 1.403 9.355 -14.900 1.00 1.41 H new ATOM 0 HD22 LEU B 31 2.983 8.829 -14.272 1.00 1.41 H new ATOM 0 HD23 LEU B 31 2.886 10.200 -15.403 1.00 1.41 H new ATOM 1974 N GLU B 32 6.588 6.707 -18.252 1.00 2.20 N ATOM 1975 CA GLU B 32 8.025 6.633 -18.420 1.00 51.23 C ATOM 1976 C GLU B 32 8.394 7.169 -19.823 1.00 75.43 C ATOM 1977 O GLU B 32 9.273 8.015 -19.959 1.00 22.10 O ATOM 1978 CB GLU B 32 8.425 5.161 -18.261 1.00 53.25 C ATOM 1979 CG GLU B 32 9.811 4.884 -17.715 1.00 44.31 C ATOM 1980 CD GLU B 32 10.942 5.333 -18.590 1.00 4.25 C ATOM 1981 OE1 GLU B 32 11.525 6.410 -18.327 1.00 11.11 O ATOM 1982 OE2 GLU B 32 11.283 4.601 -19.533 1.00 34.15 O ATOM 0 H GLU B 32 6.153 5.802 -18.073 1.00 2.20 H new ATOM 0 HA GLU B 32 8.554 7.236 -17.682 1.00 51.23 H new ATOM 0 HB2 GLU B 32 7.699 4.681 -17.605 1.00 53.25 H new ATOM 0 HB3 GLU B 32 8.341 4.679 -19.235 1.00 53.25 H new ATOM 0 HG2 GLU B 32 9.907 5.373 -16.745 1.00 44.31 H new ATOM 0 HG3 GLU B 32 9.909 3.812 -17.543 1.00 44.31 H new ATOM 1989 N GLU B 33 7.672 6.695 -20.851 1.00 0.45 N ATOM 1990 CA GLU B 33 7.875 7.152 -22.238 1.00 14.21 C ATOM 1991 C GLU B 33 7.499 8.629 -22.386 1.00 34.55 C ATOM 1992 O GLU B 33 8.090 9.367 -23.172 1.00 24.11 O ATOM 1993 CB GLU B 33 7.015 6.336 -23.216 1.00 22.12 C ATOM 1994 CG GLU B 33 7.319 4.846 -23.282 1.00 55.43 C ATOM 1995 CD GLU B 33 8.729 4.549 -23.719 1.00 25.31 C ATOM 1996 OE1 GLU B 33 9.093 4.878 -24.879 1.00 24.41 O ATOM 1997 OE2 GLU B 33 9.486 3.951 -22.935 1.00 53.33 O ATOM 0 H GLU B 33 6.939 5.993 -20.748 1.00 0.45 H new ATOM 0 HA GLU B 33 8.931 7.014 -22.471 1.00 14.21 H new ATOM 0 HB2 GLU B 33 5.968 6.462 -22.941 1.00 22.12 H new ATOM 0 HB3 GLU B 33 7.136 6.757 -24.214 1.00 22.12 H new ATOM 0 HG2 GLU B 33 7.148 4.403 -22.301 1.00 55.43 H new ATOM 0 HG3 GLU B 33 6.623 4.370 -23.973 1.00 55.43 H new ATOM 2004 N LYS B 34 6.516 9.049 -21.618 1.00 33.42 N ATOM 2005 CA LYS B 34 6.003 10.417 -21.672 1.00 53.51 C ATOM 2006 C LYS B 34 6.850 11.400 -20.860 1.00 22.44 C ATOM 2007 O LYS B 34 6.599 12.606 -20.884 1.00 1.34 O ATOM 2008 CB LYS B 34 4.554 10.453 -21.205 1.00 24.15 C ATOM 2009 CG LYS B 34 3.563 9.765 -22.136 1.00 75.41 C ATOM 2010 CD LYS B 34 3.405 10.511 -23.463 1.00 11.32 C ATOM 2011 CE LYS B 34 2.784 11.891 -23.255 1.00 23.00 C ATOM 2012 NZ LYS B 34 2.609 12.623 -24.521 1.00 1.40 N ATOM 0 H LYS B 34 6.044 8.457 -20.935 1.00 33.42 H new ATOM 0 HA LYS B 34 6.059 10.738 -22.712 1.00 53.51 H new ATOM 0 HB2 LYS B 34 4.492 9.985 -20.222 1.00 24.15 H new ATOM 0 HB3 LYS B 34 4.253 11.493 -21.082 1.00 24.15 H new ATOM 0 HG2 LYS B 34 3.897 8.746 -22.331 1.00 75.41 H new ATOM 0 HG3 LYS B 34 2.593 9.693 -21.643 1.00 75.41 H new ATOM 0 HD2 LYS B 34 4.379 10.617 -23.941 1.00 11.32 H new ATOM 0 HD3 LYS B 34 2.780 9.927 -24.139 1.00 11.32 H new ATOM 0 HE2 LYS B 34 1.817 11.781 -22.765 1.00 23.00 H new ATOM 0 HE3 LYS B 34 3.416 12.474 -22.585 1.00 23.00 H new ATOM 0 HZ1 LYS B 34 2.185 13.553 -24.329 1.00 1.40 H new ATOM 0 HZ2 LYS B 34 3.534 12.752 -24.978 1.00 1.40 H new ATOM 0 HZ3 LYS B 34 1.984 12.081 -25.152 1.00 1.40 H new ATOM 2026 N GLY B 35 7.822 10.886 -20.137 1.00 23.41 N ATOM 2027 CA GLY B 35 8.716 11.732 -19.380 1.00 45.15 C ATOM 2028 C GLY B 35 8.097 12.280 -18.105 1.00 43.34 C ATOM 2029 O GLY B 35 8.532 13.317 -17.593 1.00 40.51 O ATOM 0 H GLY B 35 8.012 9.887 -20.058 1.00 23.41 H new ATOM 0 HA2 GLY B 35 9.611 11.165 -19.125 1.00 45.15 H new ATOM 0 HA3 GLY B 35 9.034 12.565 -20.007 1.00 45.15 H new ATOM 2033 N TYR B 36 7.090 11.607 -17.597 1.00 35.32 N ATOM 2034 CA TYR B 36 6.463 12.016 -16.347 1.00 33.03 C ATOM 2035 C TYR B 36 6.972 11.109 -15.238 1.00 12.15 C ATOM 2036 O TYR B 36 7.901 10.330 -15.458 1.00 2.13 O ATOM 2037 CB TYR B 36 4.926 11.928 -16.423 1.00 1.53 C ATOM 2038 CG TYR B 36 4.270 12.779 -17.488 1.00 1.22 C ATOM 2039 CD1 TYR B 36 3.520 12.194 -18.491 1.00 4.31 C ATOM 2040 CD2 TYR B 36 4.402 14.162 -17.492 1.00 41.01 C ATOM 2041 CE1 TYR B 36 2.915 12.952 -19.471 1.00 51.14 C ATOM 2042 CE2 TYR B 36 3.797 14.931 -18.473 1.00 63.20 C ATOM 2043 CZ TYR B 36 3.054 14.315 -19.460 1.00 72.53 C ATOM 2044 OH TYR B 36 2.450 15.067 -20.445 1.00 62.20 O ATOM 0 H TYR B 36 6.683 10.775 -18.024 1.00 35.32 H new ATOM 0 HA TYR B 36 6.721 13.056 -16.149 1.00 33.03 H new ATOM 0 HB2 TYR B 36 4.648 10.888 -16.594 1.00 1.53 H new ATOM 0 HB3 TYR B 36 4.516 12.212 -15.454 1.00 1.53 H new ATOM 0 HD1 TYR B 36 3.405 11.120 -18.507 1.00 4.31 H new ATOM 0 HD2 TYR B 36 4.984 14.644 -16.720 1.00 41.01 H new ATOM 0 HE1 TYR B 36 2.333 12.473 -20.245 1.00 51.14 H new ATOM 0 HE2 TYR B 36 3.906 16.005 -18.466 1.00 63.20 H new ATOM 0 HH TYR B 36 2.642 16.016 -20.296 1.00 62.20 H new ATOM 2054 N ASN B 37 6.388 11.204 -14.063 1.00 11.44 N ATOM 2055 CA ASN B 37 6.784 10.352 -12.943 1.00 32.43 C ATOM 2056 C ASN B 37 5.750 9.246 -12.746 1.00 1.53 C ATOM 2057 O ASN B 37 4.736 9.457 -12.075 1.00 45.42 O ATOM 2058 CB ASN B 37 6.942 11.155 -11.633 1.00 15.24 C ATOM 2059 CG ASN B 37 8.077 12.175 -11.646 1.00 53.25 C ATOM 2060 OD1 ASN B 37 8.444 12.727 -12.684 1.00 34.21 O ATOM 2061 ND2 ASN B 37 8.632 12.442 -10.491 1.00 14.52 N ATOM 0 H ASN B 37 5.637 11.860 -13.850 1.00 11.44 H new ATOM 0 HA ASN B 37 7.754 9.918 -13.185 1.00 32.43 H new ATOM 0 HB2 ASN B 37 6.007 11.675 -11.426 1.00 15.24 H new ATOM 0 HB3 ASN B 37 7.108 10.457 -10.812 1.00 15.24 H new ATOM 0 HD21 ASN B 37 9.389 13.123 -10.434 1.00 14.52 H new ATOM 0 HD22 ASN B 37 8.307 11.969 -9.648 1.00 14.52 H new ATOM 2068 N PRO B 38 5.977 8.048 -13.336 1.00 14.45 N ATOM 2069 CA PRO B 38 4.994 6.958 -13.308 1.00 31.31 C ATOM 2070 C PRO B 38 4.624 6.504 -11.911 1.00 61.44 C ATOM 2071 O PRO B 38 3.456 6.328 -11.614 1.00 11.04 O ATOM 2072 CB PRO B 38 5.689 5.814 -14.059 1.00 51.22 C ATOM 2073 CG PRO B 38 7.131 6.181 -14.102 1.00 34.43 C ATOM 2074 CD PRO B 38 7.188 7.670 -14.084 1.00 11.10 C ATOM 0 HA PRO B 38 4.053 7.282 -13.752 1.00 31.31 H new ATOM 0 HB2 PRO B 38 5.542 4.863 -13.547 1.00 51.22 H new ATOM 0 HB3 PRO B 38 5.283 5.701 -15.064 1.00 51.22 H new ATOM 0 HG2 PRO B 38 7.664 5.762 -13.248 1.00 34.43 H new ATOM 0 HG3 PRO B 38 7.606 5.785 -15.000 1.00 34.43 H new ATOM 0 HD2 PRO B 38 8.092 8.032 -13.594 1.00 11.10 H new ATOM 0 HD3 PRO B 38 7.184 8.085 -15.092 1.00 11.10 H new ATOM 2082 N ILE B 39 5.602 6.384 -11.036 1.00 51.24 N ATOM 2083 CA ILE B 39 5.331 5.893 -9.697 1.00 61.42 C ATOM 2084 C ILE B 39 4.573 6.931 -8.887 1.00 14.15 C ATOM 2085 O ILE B 39 3.609 6.607 -8.197 1.00 33.25 O ATOM 2086 CB ILE B 39 6.621 5.464 -8.941 1.00 53.03 C ATOM 2087 CG1 ILE B 39 7.373 4.360 -9.710 1.00 60.22 C ATOM 2088 CG2 ILE B 39 6.275 4.984 -7.539 1.00 62.11 C ATOM 2089 CD1 ILE B 39 6.535 3.121 -10.002 1.00 74.42 C ATOM 0 H ILE B 39 6.578 6.615 -11.222 1.00 51.24 H new ATOM 0 HA ILE B 39 4.713 5.002 -9.813 1.00 61.42 H new ATOM 0 HB ILE B 39 7.275 6.333 -8.868 1.00 53.03 H new ATOM 0 HG12 ILE B 39 7.734 4.771 -10.653 1.00 60.22 H new ATOM 0 HG13 ILE B 39 8.250 4.064 -9.134 1.00 60.22 H new ATOM 0 HG21 ILE B 39 7.187 4.687 -7.021 1.00 62.11 H new ATOM 0 HG22 ILE B 39 5.791 5.790 -6.988 1.00 62.11 H new ATOM 0 HG23 ILE B 39 5.599 4.131 -7.603 1.00 62.11 H new ATOM 0 HD11 ILE B 39 7.138 2.394 -10.545 1.00 74.42 H new ATOM 0 HD12 ILE B 39 6.195 2.682 -9.064 1.00 74.42 H new ATOM 0 HD13 ILE B 39 5.672 3.400 -10.606 1.00 74.42 H new ATOM 2101 N ASN B 40 4.985 8.178 -9.022 1.00 53.15 N ATOM 2102 CA ASN B 40 4.371 9.275 -8.277 1.00 22.22 C ATOM 2103 C ASN B 40 2.923 9.480 -8.671 1.00 34.40 C ATOM 2104 O ASN B 40 2.096 9.875 -7.843 1.00 15.34 O ATOM 2105 CB ASN B 40 5.168 10.578 -8.430 1.00 34.11 C ATOM 2106 CG ASN B 40 6.556 10.520 -7.794 1.00 72.44 C ATOM 2107 OD1 ASN B 40 7.498 11.139 -8.285 1.00 55.11 O ATOM 2108 ND2 ASN B 40 6.688 9.823 -6.686 1.00 73.21 N ATOM 0 H ASN B 40 5.744 8.463 -9.641 1.00 53.15 H new ATOM 0 HA ASN B 40 4.391 8.992 -7.224 1.00 22.22 H new ATOM 0 HB2 ASN B 40 5.272 10.809 -9.490 1.00 34.11 H new ATOM 0 HB3 ASN B 40 4.604 11.395 -7.980 1.00 34.11 H new ATOM 0 HD21 ASN B 40 7.590 9.786 -6.211 1.00 73.21 H new ATOM 0 HD22 ASN B 40 5.888 9.319 -6.302 1.00 73.21 H new ATOM 2115 N GLN B 41 2.604 9.241 -9.922 1.00 61.22 N ATOM 2116 CA GLN B 41 1.240 9.353 -10.347 1.00 73.33 C ATOM 2117 C GLN B 41 0.397 8.171 -9.868 1.00 12.35 C ATOM 2118 O GLN B 41 -0.744 8.357 -9.447 1.00 65.42 O ATOM 2119 CB GLN B 41 1.139 9.568 -11.838 1.00 11.15 C ATOM 2120 CG GLN B 41 1.787 10.871 -12.305 1.00 10.43 C ATOM 2121 CD GLN B 41 1.182 12.108 -11.667 1.00 54.45 C ATOM 2122 OE1 GLN B 41 1.628 12.575 -10.622 1.00 53.32 O ATOM 2123 NE2 GLN B 41 0.165 12.639 -12.276 1.00 22.53 N ATOM 0 H GLN B 41 3.265 8.972 -10.650 1.00 61.22 H new ATOM 0 HA GLN B 41 0.822 10.241 -9.874 1.00 73.33 H new ATOM 0 HB2 GLN B 41 1.611 8.731 -12.352 1.00 11.15 H new ATOM 0 HB3 GLN B 41 0.088 9.568 -12.128 1.00 11.15 H new ATOM 0 HG2 GLN B 41 2.853 10.839 -12.079 1.00 10.43 H new ATOM 0 HG3 GLN B 41 1.693 10.947 -13.388 1.00 10.43 H new ATOM 0 HE21 GLN B 41 -0.182 12.228 -13.142 1.00 22.53 H new ATOM 0 HE22 GLN B 41 -0.286 13.467 -11.888 1.00 22.53 H new ATOM 2132 N ILE B 42 0.971 6.958 -9.910 1.00 43.33 N ATOM 2133 CA ILE B 42 0.255 5.762 -9.449 1.00 11.10 C ATOM 2134 C ILE B 42 -0.110 5.897 -7.976 1.00 14.21 C ATOM 2135 O ILE B 42 -1.280 5.763 -7.616 1.00 4.03 O ATOM 2136 CB ILE B 42 1.057 4.439 -9.665 1.00 53.34 C ATOM 2137 CG1 ILE B 42 1.352 4.223 -11.152 1.00 32.43 C ATOM 2138 CG2 ILE B 42 0.270 3.244 -9.111 1.00 4.45 C ATOM 2139 CD1 ILE B 42 2.190 2.987 -11.449 1.00 55.45 C ATOM 0 H ILE B 42 1.915 6.782 -10.254 1.00 43.33 H new ATOM 0 HA ILE B 42 -0.646 5.695 -10.058 1.00 11.10 H new ATOM 0 HB ILE B 42 2.003 4.522 -9.130 1.00 53.34 H new ATOM 0 HG12 ILE B 42 0.408 4.146 -11.691 1.00 32.43 H new ATOM 0 HG13 ILE B 42 1.869 5.101 -11.539 1.00 32.43 H new ATOM 0 HG21 ILE B 42 0.840 2.328 -9.268 1.00 4.45 H new ATOM 0 HG22 ILE B 42 0.097 3.385 -8.044 1.00 4.45 H new ATOM 0 HG23 ILE B 42 -0.687 3.168 -9.627 1.00 4.45 H new ATOM 0 HD11 ILE B 42 2.353 2.908 -12.524 1.00 55.45 H new ATOM 0 HD12 ILE B 42 3.151 3.068 -10.941 1.00 55.45 H new ATOM 0 HD13 ILE B 42 1.667 2.099 -11.095 1.00 55.45 H new ATOM 2151 N VAL B 43 0.883 6.202 -7.134 1.00 71.31 N ATOM 2152 CA VAL B 43 0.638 6.359 -5.699 1.00 74.43 C ATOM 2153 C VAL B 43 -0.468 7.387 -5.435 1.00 13.53 C ATOM 2154 O VAL B 43 -1.405 7.117 -4.681 1.00 32.31 O ATOM 2155 CB VAL B 43 1.950 6.677 -4.876 1.00 63.43 C ATOM 2156 CG1 VAL B 43 2.680 7.882 -5.422 1.00 21.50 C ATOM 2157 CG2 VAL B 43 1.634 6.899 -3.404 1.00 13.40 C ATOM 0 H VAL B 43 1.852 6.343 -7.418 1.00 71.31 H new ATOM 0 HA VAL B 43 0.289 5.392 -5.336 1.00 74.43 H new ATOM 0 HB VAL B 43 2.599 5.807 -4.976 1.00 63.43 H new ATOM 0 HG11 VAL B 43 3.575 8.065 -4.828 1.00 21.50 H new ATOM 0 HG12 VAL B 43 2.964 7.697 -6.458 1.00 21.50 H new ATOM 0 HG13 VAL B 43 2.028 8.754 -5.375 1.00 21.50 H new ATOM 0 HG21 VAL B 43 2.555 7.116 -2.863 1.00 13.40 H new ATOM 0 HG22 VAL B 43 0.947 7.739 -3.302 1.00 13.40 H new ATOM 0 HG23 VAL B 43 1.173 6.001 -2.991 1.00 13.40 H new ATOM 2167 N GLY B 44 -0.388 8.524 -6.121 1.00 22.52 N ATOM 2168 CA GLY B 44 -1.380 9.562 -5.969 1.00 62.41 C ATOM 2169 C GLY B 44 -2.768 9.105 -6.395 1.00 63.12 C ATOM 2170 O GLY B 44 -3.776 9.502 -5.788 1.00 55.44 O ATOM 0 H GLY B 44 0.356 8.741 -6.784 1.00 22.52 H new ATOM 0 HA2 GLY B 44 -1.410 9.883 -4.928 1.00 62.41 H new ATOM 0 HA3 GLY B 44 -1.088 10.429 -6.561 1.00 62.41 H new ATOM 2174 N TYR B 45 -2.830 8.271 -7.429 1.00 54.24 N ATOM 2175 CA TYR B 45 -4.098 7.766 -7.917 1.00 4.52 C ATOM 2176 C TYR B 45 -4.791 6.920 -6.882 1.00 10.30 C ATOM 2177 O TYR B 45 -5.914 7.197 -6.528 1.00 15.43 O ATOM 2178 CB TYR B 45 -3.957 6.965 -9.229 1.00 20.42 C ATOM 2179 CG TYR B 45 -5.280 6.337 -9.684 1.00 52.10 C ATOM 2180 CD1 TYR B 45 -5.580 4.999 -9.425 1.00 41.10 C ATOM 2181 CD2 TYR B 45 -6.223 7.082 -10.348 1.00 43.23 C ATOM 2182 CE1 TYR B 45 -6.775 4.446 -9.823 1.00 40.04 C ATOM 2183 CE2 TYR B 45 -7.422 6.533 -10.745 1.00 71.54 C ATOM 2184 CZ TYR B 45 -7.691 5.224 -10.481 1.00 13.50 C ATOM 2185 OH TYR B 45 -8.882 4.688 -10.891 1.00 2.23 O ATOM 0 H TYR B 45 -2.015 7.934 -7.941 1.00 54.24 H new ATOM 0 HA TYR B 45 -4.706 8.646 -8.126 1.00 4.52 H new ATOM 0 HB2 TYR B 45 -3.583 7.623 -10.013 1.00 20.42 H new ATOM 0 HB3 TYR B 45 -3.215 6.179 -9.092 1.00 20.42 H new ATOM 0 HD1 TYR B 45 -4.861 4.386 -8.902 1.00 41.10 H new ATOM 0 HD2 TYR B 45 -6.020 8.121 -10.564 1.00 43.23 H new ATOM 0 HE1 TYR B 45 -6.989 3.407 -9.619 1.00 40.04 H new ATOM 0 HE2 TYR B 45 -8.148 7.140 -11.265 1.00 71.54 H new ATOM 0 HH TYR B 45 -8.794 3.715 -10.966 1.00 2.23 H new ATOM 2195 N LEU B 46 -4.120 5.904 -6.390 1.00 30.12 N ATOM 2196 CA LEU B 46 -4.757 4.978 -5.466 1.00 4.34 C ATOM 2197 C LEU B 46 -5.152 5.629 -4.150 1.00 2.04 C ATOM 2198 O LEU B 46 -6.197 5.291 -3.581 1.00 61.13 O ATOM 2199 CB LEU B 46 -3.964 3.666 -5.244 1.00 33.41 C ATOM 2200 CG LEU B 46 -3.826 2.700 -6.456 1.00 41.41 C ATOM 2201 CD1 LEU B 46 -2.930 3.240 -7.538 1.00 75.11 C ATOM 2202 CD2 LEU B 46 -3.359 1.334 -6.013 1.00 13.14 C ATOM 0 H LEU B 46 -3.146 5.694 -6.607 1.00 30.12 H new ATOM 0 HA LEU B 46 -5.681 4.687 -5.966 1.00 4.34 H new ATOM 0 HB2 LEU B 46 -2.961 3.931 -4.908 1.00 33.41 H new ATOM 0 HB3 LEU B 46 -4.439 3.119 -4.429 1.00 33.41 H new ATOM 0 HG LEU B 46 -4.823 2.608 -6.888 1.00 41.41 H new ATOM 0 HD11 LEU B 46 -2.874 2.522 -8.356 1.00 75.11 H new ATOM 0 HD12 LEU B 46 -3.335 4.182 -7.909 1.00 75.11 H new ATOM 0 HD13 LEU B 46 -1.932 3.408 -7.134 1.00 75.11 H new ATOM 0 HD21 LEU B 46 -3.272 0.680 -6.881 1.00 13.14 H new ATOM 0 HD22 LEU B 46 -2.388 1.422 -5.526 1.00 13.14 H new ATOM 0 HD23 LEU B 46 -4.080 0.913 -5.312 1.00 13.14 H new ATOM 2214 N LEU B 47 -4.338 6.577 -3.683 1.00 2.42 N ATOM 2215 CA LEU B 47 -4.591 7.255 -2.407 1.00 43.24 C ATOM 2216 C LEU B 47 -5.972 7.939 -2.343 1.00 22.22 C ATOM 2217 O LEU B 47 -6.624 7.894 -1.316 1.00 23.21 O ATOM 2218 CB LEU B 47 -3.493 8.275 -2.068 1.00 35.23 C ATOM 2219 CG LEU B 47 -2.066 7.737 -1.891 1.00 43.53 C ATOM 2220 CD1 LEU B 47 -1.115 8.861 -1.513 1.00 55.31 C ATOM 2221 CD2 LEU B 47 -2.013 6.613 -0.863 1.00 31.53 C ATOM 0 H LEU B 47 -3.498 6.894 -4.167 1.00 2.42 H new ATOM 0 HA LEU B 47 -4.581 6.462 -1.660 1.00 43.24 H new ATOM 0 HB2 LEU B 47 -3.475 9.027 -2.857 1.00 35.23 H new ATOM 0 HB3 LEU B 47 -3.778 8.785 -1.148 1.00 35.23 H new ATOM 0 HG LEU B 47 -1.748 7.320 -2.847 1.00 43.53 H new ATOM 0 HD11 LEU B 47 -0.108 8.461 -1.392 1.00 55.31 H new ATOM 0 HD12 LEU B 47 -1.113 9.616 -2.299 1.00 55.31 H new ATOM 0 HD13 LEU B 47 -1.441 9.314 -0.576 1.00 55.31 H new ATOM 0 HD21 LEU B 47 -0.987 6.258 -0.765 1.00 31.53 H new ATOM 0 HD22 LEU B 47 -2.362 6.984 0.100 1.00 31.53 H new ATOM 0 HD23 LEU B 47 -2.652 5.792 -1.188 1.00 31.53 H new ATOM 2233 N SER B 48 -6.410 8.575 -3.420 1.00 53.14 N ATOM 2234 CA SER B 48 -7.707 9.271 -3.388 1.00 44.01 C ATOM 2235 C SER B 48 -8.637 8.892 -4.555 1.00 64.22 C ATOM 2236 O SER B 48 -9.773 9.370 -4.632 1.00 44.42 O ATOM 2237 CB SER B 48 -7.498 10.770 -3.376 1.00 21.22 C ATOM 2238 OG SER B 48 -6.658 11.179 -2.304 1.00 33.34 O ATOM 0 H SER B 48 -5.910 8.629 -4.307 1.00 53.14 H new ATOM 0 HA SER B 48 -8.200 8.948 -2.471 1.00 44.01 H new ATOM 0 HB2 SER B 48 -7.057 11.083 -4.323 1.00 21.22 H new ATOM 0 HB3 SER B 48 -8.463 11.271 -3.293 1.00 21.22 H new ATOM 0 HG SER B 48 -6.545 12.152 -2.330 1.00 33.34 H new ATOM 2244 N GLY B 49 -8.162 8.065 -5.461 1.00 3.34 N ATOM 2245 CA GLY B 49 -8.951 7.699 -6.612 1.00 35.23 C ATOM 2246 C GLY B 49 -9.129 8.831 -7.591 1.00 70.25 C ATOM 2247 O GLY B 49 -10.212 9.005 -8.146 1.00 2.14 O ATOM 0 H GLY B 49 -7.237 7.636 -5.422 1.00 3.34 H new ATOM 0 HA2 GLY B 49 -8.475 6.859 -7.119 1.00 35.23 H new ATOM 0 HA3 GLY B 49 -9.931 7.357 -6.279 1.00 35.23 H new ATOM 2251 N ASP B 50 -8.077 9.607 -7.796 1.00 51.00 N ATOM 2252 CA ASP B 50 -8.122 10.713 -8.758 1.00 13.44 C ATOM 2253 C ASP B 50 -7.535 10.242 -10.077 1.00 11.04 C ATOM 2254 O ASP B 50 -6.322 10.086 -10.184 1.00 14.30 O ATOM 2255 CB ASP B 50 -7.308 11.936 -8.296 1.00 70.33 C ATOM 2256 CG ASP B 50 -7.728 12.542 -6.978 1.00 45.14 C ATOM 2257 OD1 ASP B 50 -6.944 12.471 -6.000 1.00 51.24 O ATOM 2258 OD2 ASP B 50 -8.830 13.112 -6.896 1.00 72.41 O ATOM 0 H ASP B 50 -7.184 9.498 -7.316 1.00 51.00 H new ATOM 0 HA ASP B 50 -9.166 11.011 -8.854 1.00 13.44 H new ATOM 0 HB2 ASP B 50 -6.260 11.646 -8.224 1.00 70.33 H new ATOM 0 HB3 ASP B 50 -7.373 12.705 -9.066 1.00 70.33 H new ATOM 2263 N PRO B 51 -8.367 9.992 -11.099 1.00 22.23 N ATOM 2264 CA PRO B 51 -7.902 9.495 -12.406 1.00 32.53 C ATOM 2265 C PRO B 51 -6.932 10.446 -13.112 1.00 53.12 C ATOM 2266 O PRO B 51 -6.107 10.010 -13.918 1.00 53.21 O ATOM 2267 CB PRO B 51 -9.194 9.302 -13.205 1.00 31.41 C ATOM 2268 CG PRO B 51 -10.184 10.191 -12.539 1.00 10.44 C ATOM 2269 CD PRO B 51 -9.836 10.159 -11.082 1.00 44.44 C ATOM 0 HA PRO B 51 -7.323 8.578 -12.300 1.00 32.53 H new ATOM 0 HB2 PRO B 51 -9.057 9.575 -14.251 1.00 31.41 H new ATOM 0 HB3 PRO B 51 -9.520 8.262 -13.187 1.00 31.41 H new ATOM 0 HG2 PRO B 51 -10.128 11.206 -12.933 1.00 10.44 H new ATOM 0 HG3 PRO B 51 -11.202 9.840 -12.707 1.00 10.44 H new ATOM 0 HD2 PRO B 51 -10.133 11.077 -10.575 1.00 44.44 H new ATOM 0 HD3 PRO B 51 -10.331 9.336 -10.566 1.00 44.44 H new ATOM 2277 N ALA B 52 -7.015 11.735 -12.769 1.00 41.01 N ATOM 2278 CA ALA B 52 -6.199 12.801 -13.379 1.00 35.23 C ATOM 2279 C ALA B 52 -4.683 12.559 -13.275 1.00 40.23 C ATOM 2280 O ALA B 52 -3.901 13.222 -13.953 1.00 32.44 O ATOM 2281 CB ALA B 52 -6.547 14.140 -12.765 1.00 55.34 C ATOM 0 H ALA B 52 -7.656 12.076 -12.053 1.00 41.01 H new ATOM 0 HA ALA B 52 -6.441 12.796 -14.442 1.00 35.23 H new ATOM 0 HB1 ALA B 52 -5.938 14.920 -13.223 1.00 55.34 H new ATOM 0 HB2 ALA B 52 -7.602 14.356 -12.936 1.00 55.34 H new ATOM 0 HB3 ALA B 52 -6.352 14.110 -11.693 1.00 55.34 H new ATOM 2287 N TYR B 53 -4.273 11.628 -12.442 1.00 34.14 N ATOM 2288 CA TYR B 53 -2.875 11.308 -12.313 1.00 20.25 C ATOM 2289 C TYR B 53 -2.300 10.605 -13.545 1.00 41.50 C ATOM 2290 O TYR B 53 -1.135 10.811 -13.892 1.00 5.10 O ATOM 2291 CB TYR B 53 -2.622 10.479 -11.065 1.00 71.14 C ATOM 2292 CG TYR B 53 -2.675 11.300 -9.815 1.00 62.23 C ATOM 2293 CD1 TYR B 53 -1.574 12.024 -9.427 1.00 32.32 C ATOM 2294 CD2 TYR B 53 -3.805 11.367 -9.037 1.00 21.53 C ATOM 2295 CE1 TYR B 53 -1.588 12.791 -8.304 1.00 51.10 C ATOM 2296 CE2 TYR B 53 -3.833 12.139 -7.900 1.00 40.34 C ATOM 2297 CZ TYR B 53 -2.725 12.849 -7.535 1.00 54.41 C ATOM 2298 OH TYR B 53 -2.751 13.614 -6.386 1.00 74.31 O ATOM 0 H TYR B 53 -4.892 11.080 -11.844 1.00 34.14 H new ATOM 0 HA TYR B 53 -2.353 12.261 -12.224 1.00 20.25 H new ATOM 0 HB2 TYR B 53 -3.363 9.682 -11.005 1.00 71.14 H new ATOM 0 HB3 TYR B 53 -1.645 10.001 -11.141 1.00 71.14 H new ATOM 0 HD1 TYR B 53 -0.677 11.983 -10.027 1.00 32.32 H new ATOM 0 HD2 TYR B 53 -4.683 10.806 -9.322 1.00 21.53 H new ATOM 0 HE1 TYR B 53 -0.710 13.351 -8.018 1.00 51.10 H new ATOM 0 HE2 TYR B 53 -4.728 12.184 -7.297 1.00 40.34 H new ATOM 0 HH TYR B 53 -3.633 13.542 -5.965 1.00 74.31 H new ATOM 2308 N ILE B 54 -3.102 9.819 -14.237 1.00 2.54 N ATOM 2309 CA ILE B 54 -2.569 9.057 -15.359 1.00 71.35 C ATOM 2310 C ILE B 54 -2.967 9.685 -16.690 1.00 72.25 C ATOM 2311 O ILE B 54 -4.153 9.935 -16.931 1.00 30.42 O ATOM 2312 CB ILE B 54 -3.010 7.547 -15.329 1.00 62.30 C ATOM 2313 CG1 ILE B 54 -2.670 6.911 -13.964 1.00 23.12 C ATOM 2314 CG2 ILE B 54 -2.344 6.757 -16.461 1.00 44.23 C ATOM 2315 CD1 ILE B 54 -1.198 6.975 -13.581 1.00 34.30 C ATOM 0 H ILE B 54 -4.097 9.690 -14.053 1.00 2.54 H new ATOM 0 HA ILE B 54 -1.484 9.087 -15.259 1.00 71.35 H new ATOM 0 HB ILE B 54 -4.090 7.510 -15.475 1.00 62.30 H new ATOM 0 HG12 ILE B 54 -3.255 7.409 -13.191 1.00 23.12 H new ATOM 0 HG13 ILE B 54 -2.983 5.867 -13.977 1.00 23.12 H new ATOM 0 HG21 ILE B 54 -2.666 5.717 -16.417 1.00 44.23 H new ATOM 0 HG22 ILE B 54 -2.631 7.185 -17.421 1.00 44.23 H new ATOM 0 HG23 ILE B 54 -1.261 6.806 -16.351 1.00 44.23 H new ATOM 0 HD11 ILE B 54 -1.054 6.504 -12.608 1.00 34.30 H new ATOM 0 HD12 ILE B 54 -0.604 6.450 -14.329 1.00 34.30 H new ATOM 0 HD13 ILE B 54 -0.880 8.016 -13.531 1.00 34.30 H new ATOM 2327 N PRO B 55 -1.976 9.983 -17.558 1.00 45.45 N ATOM 2328 CA PRO B 55 -2.230 10.511 -18.900 1.00 41.13 C ATOM 2329 C PRO B 55 -2.986 9.493 -19.760 1.00 25.22 C ATOM 2330 O PRO B 55 -2.969 8.288 -19.477 1.00 43.15 O ATOM 2331 CB PRO B 55 -0.823 10.747 -19.474 1.00 24.43 C ATOM 2332 CG PRO B 55 0.077 9.901 -18.652 1.00 34.31 C ATOM 2333 CD PRO B 55 -0.536 9.848 -17.288 1.00 72.12 C ATOM 0 HA PRO B 55 -2.844 11.411 -18.881 1.00 41.13 H new ATOM 0 HB2 PRO B 55 -0.775 10.467 -20.526 1.00 24.43 H new ATOM 0 HB3 PRO B 55 -0.543 11.798 -19.410 1.00 24.43 H new ATOM 0 HG2 PRO B 55 0.169 8.902 -19.077 1.00 34.31 H new ATOM 0 HG3 PRO B 55 1.081 10.324 -18.612 1.00 34.31 H new ATOM 0 HD2 PRO B 55 -0.308 8.910 -16.781 1.00 72.12 H new ATOM 0 HD3 PRO B 55 -0.169 10.653 -16.651 1.00 72.12 H new ATOM 2341 N ARG B 56 -3.618 9.958 -20.815 1.00 74.41 N ATOM 2342 CA ARG B 56 -4.427 9.086 -21.649 1.00 52.04 C ATOM 2343 C ARG B 56 -3.620 8.569 -22.836 1.00 41.22 C ATOM 2344 O ARG B 56 -4.184 8.056 -23.803 1.00 44.01 O ATOM 2345 CB ARG B 56 -5.687 9.804 -22.139 1.00 13.40 C ATOM 2346 CG ARG B 56 -6.501 10.468 -21.039 1.00 70.40 C ATOM 2347 CD ARG B 56 -7.850 10.924 -21.557 1.00 23.12 C ATOM 2348 NE ARG B 56 -8.715 9.781 -21.843 1.00 65.40 N ATOM 2349 CZ ARG B 56 -9.464 9.608 -22.930 1.00 63.10 C ATOM 2350 NH1 ARG B 56 -9.421 10.488 -23.932 1.00 23.34 N ATOM 2351 NH2 ARG B 56 -10.254 8.543 -23.013 1.00 23.01 N ATOM 0 H ARG B 56 -3.590 10.932 -21.118 1.00 74.41 H new ATOM 0 HA ARG B 56 -4.733 8.236 -21.039 1.00 52.04 H new ATOM 0 HB2 ARG B 56 -5.398 10.561 -22.868 1.00 13.40 H new ATOM 0 HB3 ARG B 56 -6.320 9.086 -22.659 1.00 13.40 H new ATOM 0 HG2 ARG B 56 -6.642 9.769 -20.215 1.00 70.40 H new ATOM 0 HG3 ARG B 56 -5.953 11.322 -20.642 1.00 70.40 H new ATOM 0 HD2 ARG B 56 -8.327 11.570 -20.820 1.00 23.12 H new ATOM 0 HD3 ARG B 56 -7.715 11.517 -22.461 1.00 23.12 H new ATOM 0 HE ARG B 56 -8.748 9.043 -21.140 1.00 65.40 H new ATOM 0 HH11 ARG B 56 -8.810 11.303 -23.870 1.00 23.34 H new ATOM 0 HH12 ARG B 56 -9.999 10.346 -24.760 1.00 23.34 H new ATOM 0 HH21 ARG B 56 -10.282 7.868 -22.249 1.00 23.01 H new ATOM 0 HH22 ARG B 56 -10.832 8.400 -23.841 1.00 23.01 H new ATOM 2365 N TYR B 57 -2.299 8.708 -22.739 1.00 0.31 N ATOM 2366 CA TYR B 57 -1.349 8.225 -23.741 1.00 30.11 C ATOM 2367 C TYR B 57 -1.616 6.780 -24.171 1.00 4.42 C ATOM 2368 O TYR B 57 -1.649 6.480 -25.365 1.00 62.14 O ATOM 2369 CB TYR B 57 0.090 8.365 -23.208 1.00 60.41 C ATOM 2370 CG TYR B 57 1.145 7.645 -24.035 1.00 74.32 C ATOM 2371 CD1 TYR B 57 1.513 8.092 -25.296 1.00 61.22 C ATOM 2372 CD2 TYR B 57 1.757 6.495 -23.545 1.00 11.24 C ATOM 2373 CE1 TYR B 57 2.464 7.417 -26.041 1.00 50.44 C ATOM 2374 CE2 TYR B 57 2.699 5.817 -24.280 1.00 44.13 C ATOM 2375 CZ TYR B 57 3.051 6.281 -25.526 1.00 61.40 C ATOM 2376 OH TYR B 57 3.987 5.599 -26.261 1.00 44.34 O ATOM 0 H TYR B 57 -1.850 9.168 -21.947 1.00 0.31 H new ATOM 0 HA TYR B 57 -1.479 8.844 -24.629 1.00 30.11 H new ATOM 0 HB2 TYR B 57 0.345 9.424 -23.161 1.00 60.41 H new ATOM 0 HB3 TYR B 57 0.124 7.983 -22.188 1.00 60.41 H new ATOM 0 HD1 TYR B 57 1.051 8.980 -25.702 1.00 61.22 H new ATOM 0 HD2 TYR B 57 1.486 6.128 -22.566 1.00 11.24 H new ATOM 0 HE1 TYR B 57 2.744 7.778 -27.020 1.00 50.44 H new ATOM 0 HE2 TYR B 57 3.160 4.925 -23.882 1.00 44.13 H new ATOM 0 HH TYR B 57 4.301 4.823 -25.751 1.00 44.34 H new ATOM 2386 N GLN B 58 -1.817 5.903 -23.221 1.00 54.30 N ATOM 2387 CA GLN B 58 -1.990 4.520 -23.544 1.00 23.03 C ATOM 2388 C GLN B 58 -3.173 3.985 -22.760 1.00 32.43 C ATOM 2389 O GLN B 58 -3.717 4.688 -21.894 1.00 33.02 O ATOM 2390 CB GLN B 58 -0.710 3.745 -23.170 1.00 3.04 C ATOM 2391 CG GLN B 58 -0.589 2.376 -23.815 1.00 2.13 C ATOM 2392 CD GLN B 58 0.654 1.638 -23.404 1.00 4.31 C ATOM 2393 OE1 GLN B 58 1.675 2.240 -23.100 1.00 50.52 O ATOM 2394 NE2 GLN B 58 0.572 0.334 -23.385 1.00 54.45 N ATOM 0 H GLN B 58 -1.864 6.124 -22.226 1.00 54.30 H new ATOM 0 HA GLN B 58 -2.175 4.399 -24.611 1.00 23.03 H new ATOM 0 HB2 GLN B 58 0.157 4.343 -23.452 1.00 3.04 H new ATOM 0 HB3 GLN B 58 -0.676 3.626 -22.087 1.00 3.04 H new ATOM 0 HG2 GLN B 58 -1.462 1.779 -23.552 1.00 2.13 H new ATOM 0 HG3 GLN B 58 -0.595 2.490 -24.899 1.00 2.13 H new ATOM 0 HE21 GLN B 58 -0.300 -0.126 -23.646 1.00 54.45 H new ATOM 0 HE22 GLN B 58 1.380 -0.224 -23.109 1.00 54.45 H new ATOM 2403 N ASP B 59 -3.537 2.744 -23.037 1.00 74.44 N ATOM 2404 CA ASP B 59 -4.624 2.020 -22.367 1.00 35.34 C ATOM 2405 C ASP B 59 -4.427 1.930 -20.854 1.00 2.01 C ATOM 2406 O ASP B 59 -5.353 1.586 -20.136 1.00 70.11 O ATOM 2407 CB ASP B 59 -4.815 0.617 -22.986 1.00 54.23 C ATOM 2408 CG ASP B 59 -3.562 -0.241 -22.960 1.00 60.11 C ATOM 2409 OD1 ASP B 59 -3.440 -1.108 -22.096 1.00 3.40 O ATOM 2410 OD2 ASP B 59 -2.682 -0.058 -23.834 1.00 24.20 O ATOM 0 H ASP B 59 -3.074 2.188 -23.756 1.00 74.44 H new ATOM 0 HA ASP B 59 -5.534 2.598 -22.529 1.00 35.34 H new ATOM 0 HB2 ASP B 59 -5.610 0.099 -22.450 1.00 54.23 H new ATOM 0 HB3 ASP B 59 -5.147 0.728 -24.018 1.00 54.23 H new ATOM 2415 N ALA B 60 -3.211 2.250 -20.386 1.00 64.13 N ATOM 2416 CA ALA B 60 -2.875 2.306 -18.959 1.00 65.33 C ATOM 2417 C ALA B 60 -3.901 3.145 -18.194 1.00 43.52 C ATOM 2418 O ALA B 60 -4.306 2.788 -17.089 1.00 53.03 O ATOM 2419 CB ALA B 60 -1.499 2.916 -18.794 1.00 43.53 C ATOM 0 H ALA B 60 -2.426 2.479 -20.996 1.00 64.13 H new ATOM 0 HA ALA B 60 -2.885 1.293 -18.556 1.00 65.33 H new ATOM 0 HB1 ALA B 60 -1.245 2.960 -17.735 1.00 43.53 H new ATOM 0 HB2 ALA B 60 -0.765 2.305 -19.318 1.00 43.53 H new ATOM 0 HB3 ALA B 60 -1.495 3.924 -19.210 1.00 43.53 H new ATOM 2425 N ARG B 61 -4.307 4.257 -18.808 1.00 31.32 N ATOM 2426 CA ARG B 61 -5.336 5.139 -18.286 1.00 23.34 C ATOM 2427 C ARG B 61 -6.614 4.362 -17.962 1.00 12.51 C ATOM 2428 O ARG B 61 -7.150 4.471 -16.870 1.00 41.00 O ATOM 2429 CB ARG B 61 -5.642 6.221 -19.334 1.00 13.21 C ATOM 2430 CG ARG B 61 -6.826 7.123 -19.005 1.00 43.33 C ATOM 2431 CD ARG B 61 -6.600 7.983 -17.774 1.00 73.30 C ATOM 2432 NE ARG B 61 -7.805 8.743 -17.454 1.00 11.52 N ATOM 2433 CZ ARG B 61 -7.862 9.963 -16.926 1.00 12.15 C ATOM 2434 NH1 ARG B 61 -6.756 10.646 -16.664 1.00 0.12 N ATOM 2435 NH2 ARG B 61 -9.042 10.498 -16.667 1.00 43.32 N ATOM 0 H ARG B 61 -3.919 4.570 -19.698 1.00 31.32 H new ATOM 0 HA ARG B 61 -4.974 5.596 -17.365 1.00 23.34 H new ATOM 0 HB2 ARG B 61 -4.756 6.843 -19.461 1.00 13.21 H new ATOM 0 HB3 ARG B 61 -5.830 5.735 -20.291 1.00 13.21 H new ATOM 0 HG2 ARG B 61 -7.030 7.769 -19.859 1.00 43.33 H new ATOM 0 HG3 ARG B 61 -7.712 6.507 -18.852 1.00 43.33 H new ATOM 0 HD2 ARG B 61 -6.325 7.353 -16.928 1.00 73.30 H new ATOM 0 HD3 ARG B 61 -5.768 8.665 -17.947 1.00 73.30 H new ATOM 0 HE ARG B 61 -8.697 8.291 -17.656 1.00 11.52 H new ATOM 0 HH11 ARG B 61 -5.844 10.237 -16.867 1.00 0.12 H new ATOM 0 HH12 ARG B 61 -6.817 11.580 -16.259 1.00 0.12 H new ATOM 0 HH21 ARG B 61 -9.894 9.977 -16.872 1.00 43.32 H new ATOM 0 HH22 ARG B 61 -9.101 11.432 -16.262 1.00 43.32 H new ATOM 2449 N ASN B 62 -7.077 3.569 -18.905 1.00 61.35 N ATOM 2450 CA ASN B 62 -8.316 2.834 -18.732 1.00 3.15 C ATOM 2451 C ASN B 62 -8.082 1.652 -17.784 1.00 73.31 C ATOM 2452 O ASN B 62 -8.910 1.353 -16.942 1.00 12.02 O ATOM 2453 CB ASN B 62 -8.849 2.356 -20.100 1.00 70.40 C ATOM 2454 CG ASN B 62 -10.286 1.822 -20.072 1.00 72.11 C ATOM 2455 OD1 ASN B 62 -10.765 1.281 -19.076 1.00 44.24 O ATOM 2456 ND2 ASN B 62 -10.984 1.982 -21.169 1.00 35.22 N ATOM 0 H ASN B 62 -6.615 3.415 -19.801 1.00 61.35 H new ATOM 0 HA ASN B 62 -9.069 3.488 -18.291 1.00 3.15 H new ATOM 0 HB2 ASN B 62 -8.797 3.185 -20.806 1.00 70.40 H new ATOM 0 HB3 ASN B 62 -8.191 1.573 -20.478 1.00 70.40 H new ATOM 0 HD21 ASN B 62 -11.949 1.655 -21.212 1.00 35.22 H new ATOM 0 HD22 ASN B 62 -10.562 2.434 -21.980 1.00 35.22 H new ATOM 2463 N LEU B 63 -6.917 1.022 -17.906 1.00 51.25 N ATOM 2464 CA LEU B 63 -6.545 -0.132 -17.075 1.00 45.04 C ATOM 2465 C LEU B 63 -6.553 0.203 -15.586 1.00 42.12 C ATOM 2466 O LEU B 63 -7.024 -0.590 -14.762 1.00 41.35 O ATOM 2467 CB LEU B 63 -5.156 -0.656 -17.445 1.00 23.14 C ATOM 2468 CG LEU B 63 -4.956 -1.189 -18.856 1.00 63.32 C ATOM 2469 CD1 LEU B 63 -3.501 -1.591 -19.052 1.00 70.12 C ATOM 2470 CD2 LEU B 63 -5.870 -2.378 -19.115 1.00 23.24 C ATOM 0 H LEU B 63 -6.201 1.292 -18.581 1.00 51.25 H new ATOM 0 HA LEU B 63 -7.296 -0.898 -17.270 1.00 45.04 H new ATOM 0 HB2 LEU B 63 -4.440 0.150 -17.286 1.00 23.14 H new ATOM 0 HB3 LEU B 63 -4.900 -1.452 -16.746 1.00 23.14 H new ATOM 0 HG LEU B 63 -5.209 -0.403 -19.567 1.00 63.32 H new ATOM 0 HD11 LEU B 63 -3.362 -1.972 -20.064 1.00 70.12 H new ATOM 0 HD12 LEU B 63 -2.860 -0.723 -18.900 1.00 70.12 H new ATOM 0 HD13 LEU B 63 -3.238 -2.367 -18.333 1.00 70.12 H new ATOM 0 HD21 LEU B 63 -5.712 -2.744 -20.129 1.00 23.24 H new ATOM 0 HD22 LEU B 63 -5.645 -3.172 -18.403 1.00 23.24 H new ATOM 0 HD23 LEU B 63 -6.909 -2.070 -18.998 1.00 23.24 H new ATOM 2482 N ILE B 64 -6.058 1.376 -15.240 1.00 41.04 N ATOM 2483 CA ILE B 64 -5.947 1.754 -13.840 1.00 2.03 C ATOM 2484 C ILE B 64 -7.337 2.143 -13.276 1.00 61.44 C ATOM 2485 O ILE B 64 -7.564 2.112 -12.079 1.00 11.41 O ATOM 2486 CB ILE B 64 -4.897 2.895 -13.642 1.00 41.21 C ATOM 2487 CG1 ILE B 64 -4.485 2.997 -12.167 1.00 14.21 C ATOM 2488 CG2 ILE B 64 -5.450 4.238 -14.139 1.00 31.40 C ATOM 2489 CD1 ILE B 64 -3.355 3.977 -11.909 1.00 71.14 C ATOM 0 H ILE B 64 -5.728 2.080 -15.901 1.00 41.04 H new ATOM 0 HA ILE B 64 -5.587 0.893 -13.277 1.00 2.03 H new ATOM 0 HB ILE B 64 -4.014 2.651 -14.232 1.00 41.21 H new ATOM 0 HG12 ILE B 64 -5.352 3.295 -11.578 1.00 14.21 H new ATOM 0 HG13 ILE B 64 -4.184 2.010 -11.815 1.00 14.21 H new ATOM 0 HG21 ILE B 64 -4.702 5.017 -13.991 1.00 31.40 H new ATOM 0 HG22 ILE B 64 -5.690 4.162 -15.200 1.00 31.40 H new ATOM 0 HG23 ILE B 64 -6.351 4.490 -13.580 1.00 31.40 H new ATOM 0 HD11 ILE B 64 -3.122 3.992 -10.844 1.00 71.14 H new ATOM 0 HD12 ILE B 64 -2.472 3.670 -12.469 1.00 71.14 H new ATOM 0 HD13 ILE B 64 -3.658 4.974 -12.228 1.00 71.14 H new ATOM 2501 N ARG B 65 -8.259 2.478 -14.179 1.00 24.14 N ATOM 2502 CA ARG B 65 -9.644 2.803 -13.819 1.00 33.44 C ATOM 2503 C ARG B 65 -10.460 1.518 -13.793 1.00 52.01 C ATOM 2504 O ARG B 65 -11.556 1.451 -13.229 1.00 22.41 O ATOM 2505 CB ARG B 65 -10.241 3.738 -14.876 1.00 12.01 C ATOM 2506 CG ARG B 65 -9.516 5.052 -14.998 1.00 30.23 C ATOM 2507 CD ARG B 65 -9.666 5.886 -13.747 1.00 53.14 C ATOM 2508 NE ARG B 65 -11.037 6.424 -13.583 1.00 52.13 N ATOM 2509 CZ ARG B 65 -11.720 6.525 -12.419 1.00 3.53 C ATOM 2510 NH1 ARG B 65 -11.228 6.017 -11.299 1.00 23.02 N ATOM 2511 NH2 ARG B 65 -12.904 7.125 -12.397 1.00 24.13 N ATOM 0 H ARG B 65 -8.070 2.532 -15.180 1.00 24.14 H new ATOM 0 HA ARG B 65 -9.663 3.287 -12.843 1.00 33.44 H new ATOM 0 HB2 ARG B 65 -10.228 3.235 -15.843 1.00 12.01 H new ATOM 0 HB3 ARG B 65 -11.285 3.930 -14.630 1.00 12.01 H new ATOM 0 HG2 ARG B 65 -8.459 4.869 -15.190 1.00 30.23 H new ATOM 0 HG3 ARG B 65 -9.904 5.605 -15.854 1.00 30.23 H new ATOM 0 HD2 ARG B 65 -9.411 5.280 -12.878 1.00 53.14 H new ATOM 0 HD3 ARG B 65 -8.956 6.713 -13.778 1.00 53.14 H new ATOM 0 HE ARG B 65 -11.510 6.749 -14.426 1.00 52.13 H new ATOM 0 HH11 ARG B 65 -10.325 5.543 -11.308 1.00 23.02 H new ATOM 0 HH12 ARG B 65 -11.752 6.100 -10.428 1.00 23.02 H new ATOM 0 HH21 ARG B 65 -13.297 7.509 -13.256 1.00 24.13 H new ATOM 0 HH22 ARG B 65 -13.420 7.202 -11.521 1.00 24.13 H new ATOM 2525 N ARG B 66 -9.909 0.504 -14.432 1.00 45.31 N ATOM 2526 CA ARG B 66 -10.534 -0.790 -14.567 1.00 63.24 C ATOM 2527 C ARG B 66 -10.384 -1.579 -13.279 1.00 2.42 C ATOM 2528 O ARG B 66 -11.265 -2.336 -12.902 1.00 61.22 O ATOM 2529 CB ARG B 66 -9.901 -1.553 -15.750 1.00 23.11 C ATOM 2530 CG ARG B 66 -10.525 -2.912 -16.104 1.00 1.40 C ATOM 2531 CD ARG B 66 -11.975 -2.781 -16.579 1.00 44.55 C ATOM 2532 NE ARG B 66 -12.883 -2.340 -15.515 1.00 73.25 N ATOM 2533 CZ ARG B 66 -13.922 -1.515 -15.683 1.00 55.34 C ATOM 2534 NH1 ARG B 66 -14.190 -1.003 -16.888 1.00 21.33 N ATOM 2535 NH2 ARG B 66 -14.679 -1.185 -14.644 1.00 5.24 N ATOM 0 H ARG B 66 -8.995 0.562 -14.880 1.00 45.31 H new ATOM 0 HA ARG B 66 -11.598 -0.657 -14.765 1.00 63.24 H new ATOM 0 HB2 ARG B 66 -9.950 -0.915 -16.632 1.00 23.11 H new ATOM 0 HB3 ARG B 66 -8.845 -1.710 -15.529 1.00 23.11 H new ATOM 0 HG2 ARG B 66 -9.932 -3.389 -16.884 1.00 1.40 H new ATOM 0 HG3 ARG B 66 -10.489 -3.564 -15.231 1.00 1.40 H new ATOM 0 HD2 ARG B 66 -12.019 -2.072 -17.406 1.00 44.55 H new ATOM 0 HD3 ARG B 66 -12.314 -3.742 -16.965 1.00 44.55 H new ATOM 0 HE ARG B 66 -12.708 -2.690 -14.573 1.00 73.25 H new ATOM 0 HH11 ARG B 66 -13.601 -1.241 -17.686 1.00 21.33 H new ATOM 0 HH12 ARG B 66 -14.984 -0.374 -17.010 1.00 21.33 H new ATOM 0 HH21 ARG B 66 -14.468 -1.560 -13.719 1.00 5.24 H new ATOM 0 HH22 ARG B 66 -15.472 -0.556 -14.770 1.00 5.24 H new ATOM 2549 N HIS B 67 -9.274 -1.393 -12.614 1.00 45.44 N ATOM 2550 CA HIS B 67 -9.026 -2.057 -11.349 1.00 10.55 C ATOM 2551 C HIS B 67 -9.166 -1.084 -10.207 1.00 3.14 C ATOM 2552 O HIS B 67 -9.053 0.123 -10.394 1.00 42.51 O ATOM 2553 CB HIS B 67 -7.659 -2.749 -11.313 1.00 74.54 C ATOM 2554 CG HIS B 67 -7.568 -3.987 -12.151 1.00 2.31 C ATOM 2555 ND1 HIS B 67 -7.786 -5.237 -11.639 1.00 23.21 N ATOM 2556 CD2 HIS B 67 -7.269 -4.167 -13.460 1.00 75.44 C ATOM 2557 CE1 HIS B 67 -7.626 -6.138 -12.579 1.00 34.42 C ATOM 2558 NE2 HIS B 67 -7.313 -5.517 -13.703 1.00 1.15 N ATOM 0 H HIS B 67 -8.518 -0.783 -12.926 1.00 45.44 H new ATOM 0 HA HIS B 67 -9.778 -2.838 -11.240 1.00 10.55 H new ATOM 0 HB2 HIS B 67 -6.899 -2.042 -11.647 1.00 74.54 H new ATOM 0 HB3 HIS B 67 -7.423 -3.006 -10.280 1.00 74.54 H new ATOM 0 HD1 HIS B 67 -8.036 -5.438 -10.671 1.00 23.21 H new ATOM 0 HD2 HIS B 67 -7.039 -3.393 -14.178 1.00 75.44 H new ATOM 0 HE1 HIS B 67 -7.732 -7.206 -12.455 1.00 34.42 H new ATOM 2567 N GLU B 68 -9.430 -1.595 -9.034 1.00 13.33 N ATOM 2568 CA GLU B 68 -9.609 -0.760 -7.892 1.00 43.31 C ATOM 2569 C GLU B 68 -8.368 -0.370 -7.158 1.00 3.12 C ATOM 2570 O GLU B 68 -7.388 -1.103 -7.090 1.00 50.01 O ATOM 2571 CB GLU B 68 -10.673 -1.285 -6.968 1.00 63.13 C ATOM 2572 CG GLU B 68 -12.013 -0.686 -7.254 1.00 20.23 C ATOM 2573 CD GLU B 68 -12.081 0.769 -6.803 1.00 10.01 C ATOM 2574 OE1 GLU B 68 -13.019 1.128 -6.068 1.00 32.42 O ATOM 2575 OE2 GLU B 68 -11.164 1.563 -7.123 1.00 2.25 O ATOM 0 H GLU B 68 -9.525 -2.594 -8.851 1.00 13.33 H new ATOM 0 HA GLU B 68 -9.957 0.181 -8.318 1.00 43.31 H new ATOM 0 HB2 GLU B 68 -10.733 -2.369 -7.064 1.00 63.13 H new ATOM 0 HB3 GLU B 68 -10.394 -1.072 -5.936 1.00 63.13 H new ATOM 0 HG2 GLU B 68 -12.220 -0.747 -8.322 1.00 20.23 H new ATOM 0 HG3 GLU B 68 -12.786 -1.262 -6.746 1.00 20.23 H new ATOM 2582 N ARG B 69 -8.460 0.807 -6.597 1.00 4.20 N ATOM 2583 CA ARG B 69 -7.431 1.435 -5.789 1.00 25.31 C ATOM 2584 C ARG B 69 -7.124 0.531 -4.604 1.00 21.33 C ATOM 2585 O ARG B 69 -5.982 0.163 -4.356 1.00 60.43 O ATOM 2586 CB ARG B 69 -8.011 2.748 -5.277 1.00 70.21 C ATOM 2587 CG ARG B 69 -8.494 3.675 -6.373 1.00 32.21 C ATOM 2588 CD ARG B 69 -9.620 4.546 -5.861 1.00 42.25 C ATOM 2589 NE ARG B 69 -10.805 3.734 -5.532 1.00 55.43 N ATOM 2590 CZ ARG B 69 -11.673 3.969 -4.538 1.00 1.45 C ATOM 2591 NH1 ARG B 69 -11.492 4.990 -3.701 1.00 13.12 N ATOM 2592 NH2 ARG B 69 -12.719 3.164 -4.383 1.00 52.54 N ATOM 0 H ARG B 69 -9.293 1.388 -6.692 1.00 4.20 H new ATOM 0 HA ARG B 69 -6.519 1.605 -6.362 1.00 25.31 H new ATOM 0 HB2 ARG B 69 -8.842 2.530 -4.607 1.00 70.21 H new ATOM 0 HB3 ARG B 69 -7.253 3.263 -4.687 1.00 70.21 H new ATOM 0 HG2 ARG B 69 -7.671 4.299 -6.721 1.00 32.21 H new ATOM 0 HG3 ARG B 69 -8.835 3.092 -7.228 1.00 32.21 H new ATOM 0 HD2 ARG B 69 -9.290 5.091 -4.976 1.00 42.25 H new ATOM 0 HD3 ARG B 69 -9.881 5.289 -6.614 1.00 42.25 H new ATOM 0 HE ARG B 69 -10.981 2.916 -6.116 1.00 55.43 H new ATOM 0 HH11 ARG B 69 -10.685 5.604 -3.813 1.00 13.12 H new ATOM 0 HH12 ARG B 69 -12.160 5.157 -2.949 1.00 13.12 H new ATOM 0 HH21 ARG B 69 -12.855 2.377 -5.017 1.00 52.54 H new ATOM 0 HH22 ARG B 69 -13.386 3.333 -3.630 1.00 52.54 H new ATOM 2606 N ASP B 70 -8.187 0.174 -3.907 1.00 43.03 N ATOM 2607 CA ASP B 70 -8.158 -0.712 -2.738 1.00 52.04 C ATOM 2608 C ASP B 70 -7.559 -2.068 -3.133 1.00 42.31 C ATOM 2609 O ASP B 70 -6.625 -2.568 -2.507 1.00 22.44 O ATOM 2610 CB ASP B 70 -9.617 -0.892 -2.262 1.00 70.02 C ATOM 2611 CG ASP B 70 -9.783 -1.754 -1.031 1.00 14.34 C ATOM 2612 OD1 ASP B 70 -9.974 -1.187 0.089 1.00 34.33 O ATOM 2613 OD2 ASP B 70 -9.756 -2.989 -1.159 1.00 35.43 O ATOM 0 H ASP B 70 -9.126 0.497 -4.138 1.00 43.03 H new ATOM 0 HA ASP B 70 -7.546 -0.289 -1.942 1.00 52.04 H new ATOM 0 HB2 ASP B 70 -10.042 0.091 -2.059 1.00 70.02 H new ATOM 0 HB3 ASP B 70 -10.198 -1.329 -3.075 1.00 70.02 H new ATOM 2618 N GLU B 71 -8.086 -2.587 -4.220 1.00 61.40 N ATOM 2619 CA GLU B 71 -7.744 -3.885 -4.798 1.00 21.15 C ATOM 2620 C GLU B 71 -6.242 -4.013 -5.096 1.00 10.41 C ATOM 2621 O GLU B 71 -5.579 -4.932 -4.624 1.00 50.23 O ATOM 2622 CB GLU B 71 -8.540 -3.992 -6.084 1.00 1.13 C ATOM 2623 CG GLU B 71 -8.464 -5.290 -6.834 1.00 2.41 C ATOM 2624 CD GLU B 71 -9.332 -5.232 -8.062 1.00 44.03 C ATOM 2625 OE1 GLU B 71 -10.571 -5.329 -7.928 1.00 13.44 O ATOM 2626 OE2 GLU B 71 -8.807 -5.064 -9.181 1.00 61.15 O ATOM 0 H GLU B 71 -8.801 -2.097 -4.758 1.00 61.40 H new ATOM 0 HA GLU B 71 -7.982 -4.683 -4.095 1.00 21.15 H new ATOM 0 HB2 GLU B 71 -9.587 -3.798 -5.850 1.00 1.13 H new ATOM 0 HB3 GLU B 71 -8.210 -3.196 -6.752 1.00 1.13 H new ATOM 0 HG2 GLU B 71 -7.432 -5.494 -7.119 1.00 2.41 H new ATOM 0 HG3 GLU B 71 -8.785 -6.109 -6.191 1.00 2.41 H new ATOM 2633 N ILE B 72 -5.722 -3.080 -5.867 1.00 33.11 N ATOM 2634 CA ILE B 72 -4.326 -3.107 -6.275 1.00 22.22 C ATOM 2635 C ILE B 72 -3.396 -2.862 -5.091 1.00 74.21 C ATOM 2636 O ILE B 72 -2.391 -3.557 -4.918 1.00 61.21 O ATOM 2637 CB ILE B 72 -4.043 -2.033 -7.366 1.00 33.30 C ATOM 2638 CG1 ILE B 72 -4.890 -2.288 -8.624 1.00 4.15 C ATOM 2639 CG2 ILE B 72 -2.555 -1.972 -7.717 1.00 54.44 C ATOM 2640 CD1 ILE B 72 -4.685 -1.258 -9.721 1.00 71.14 C ATOM 0 H ILE B 72 -6.249 -2.285 -6.228 1.00 33.11 H new ATOM 0 HA ILE B 72 -4.134 -4.100 -6.682 1.00 22.22 H new ATOM 0 HB ILE B 72 -4.328 -1.065 -6.955 1.00 33.30 H new ATOM 0 HG12 ILE B 72 -4.651 -3.276 -9.017 1.00 4.15 H new ATOM 0 HG13 ILE B 72 -5.943 -2.302 -8.344 1.00 4.15 H new ATOM 0 HG21 ILE B 72 -2.392 -1.212 -8.481 1.00 54.44 H new ATOM 0 HG22 ILE B 72 -1.981 -1.719 -6.826 1.00 54.44 H new ATOM 0 HG23 ILE B 72 -2.230 -2.942 -8.094 1.00 54.44 H new ATOM 0 HD11 ILE B 72 -5.316 -1.505 -10.575 1.00 71.14 H new ATOM 0 HD12 ILE B 72 -4.952 -0.270 -9.347 1.00 71.14 H new ATOM 0 HD13 ILE B 72 -3.640 -1.259 -10.030 1.00 71.14 H new ATOM 2652 N MET B 73 -3.755 -1.898 -4.266 1.00 1.14 N ATOM 2653 CA MET B 73 -2.888 -1.459 -3.190 1.00 4.11 C ATOM 2654 C MET B 73 -2.682 -2.551 -2.142 1.00 15.11 C ATOM 2655 O MET B 73 -1.556 -2.731 -1.634 1.00 14.44 O ATOM 2656 CB MET B 73 -3.412 -0.138 -2.579 1.00 10.40 C ATOM 2657 CG MET B 73 -2.468 0.566 -1.601 1.00 62.51 C ATOM 2658 SD MET B 73 -2.231 -0.288 -0.045 1.00 63.44 S ATOM 2659 CE MET B 73 -1.022 0.756 0.710 1.00 62.44 C ATOM 0 H MET B 73 -4.645 -1.402 -4.321 1.00 1.14 H new ATOM 0 HA MET B 73 -1.901 -1.258 -3.607 1.00 4.11 H new ATOM 0 HB2 MET B 73 -3.641 0.551 -3.392 1.00 10.40 H new ATOM 0 HB3 MET B 73 -4.350 -0.345 -2.063 1.00 10.40 H new ATOM 0 HG2 MET B 73 -1.498 0.693 -2.081 1.00 62.51 H new ATOM 0 HG3 MET B 73 -2.856 1.564 -1.397 1.00 62.51 H new ATOM 0 HE1 MET B 73 -0.983 0.553 1.780 1.00 62.44 H new ATOM 0 HE2 MET B 73 -0.045 0.561 0.268 1.00 62.44 H new ATOM 0 HE3 MET B 73 -1.291 1.800 0.549 1.00 62.44 H new ATOM 2669 N GLU B 74 -3.727 -3.307 -1.835 1.00 74.43 N ATOM 2670 CA GLU B 74 -3.597 -4.318 -0.816 1.00 13.21 C ATOM 2671 C GLU B 74 -2.647 -5.444 -1.254 1.00 31.10 C ATOM 2672 O GLU B 74 -1.869 -5.957 -0.440 1.00 42.45 O ATOM 2673 CB GLU B 74 -4.974 -4.787 -0.261 1.00 22.44 C ATOM 2674 CG GLU B 74 -5.900 -5.582 -1.181 1.00 2.22 C ATOM 2675 CD GLU B 74 -5.515 -7.038 -1.294 1.00 31.20 C ATOM 2676 OE1 GLU B 74 -5.541 -7.747 -0.255 1.00 4.11 O ATOM 2677 OE2 GLU B 74 -5.231 -7.511 -2.398 1.00 73.41 O ATOM 0 H GLU B 74 -4.648 -3.238 -2.268 1.00 74.43 H new ATOM 0 HA GLU B 74 -3.112 -3.866 0.049 1.00 13.21 H new ATOM 0 HB2 GLU B 74 -4.785 -5.395 0.624 1.00 22.44 H new ATOM 0 HB3 GLU B 74 -5.517 -3.902 0.070 1.00 22.44 H new ATOM 0 HG2 GLU B 74 -6.922 -5.510 -0.808 1.00 2.22 H new ATOM 0 HG3 GLU B 74 -5.890 -5.132 -2.174 1.00 2.22 H new ATOM 2684 N GLU B 75 -2.672 -5.776 -2.550 1.00 41.11 N ATOM 2685 CA GLU B 75 -1.734 -6.741 -3.113 1.00 72.12 C ATOM 2686 C GLU B 75 -0.312 -6.189 -3.023 1.00 23.32 C ATOM 2687 O GLU B 75 0.609 -6.891 -2.605 1.00 73.23 O ATOM 2688 CB GLU B 75 -2.078 -7.065 -4.579 1.00 62.23 C ATOM 2689 CG GLU B 75 -1.070 -7.992 -5.278 1.00 21.23 C ATOM 2690 CD GLU B 75 -0.997 -9.405 -4.704 1.00 5.04 C ATOM 2691 OE1 GLU B 75 -0.767 -9.570 -3.489 1.00 3.55 O ATOM 2692 OE2 GLU B 75 -1.111 -10.377 -5.496 1.00 74.13 O ATOM 0 H GLU B 75 -3.332 -5.389 -3.224 1.00 41.11 H new ATOM 0 HA GLU B 75 -1.807 -7.664 -2.537 1.00 72.12 H new ATOM 0 HB2 GLU B 75 -3.064 -7.528 -4.614 1.00 62.23 H new ATOM 0 HB3 GLU B 75 -2.144 -6.132 -5.139 1.00 62.23 H new ATOM 0 HG2 GLU B 75 -1.329 -8.057 -6.335 1.00 21.23 H new ATOM 0 HG3 GLU B 75 -0.080 -7.539 -5.220 1.00 21.23 H new ATOM 2699 N LEU B 76 -0.152 -4.913 -3.391 1.00 74.10 N ATOM 2700 CA LEU B 76 1.152 -4.239 -3.346 1.00 52.34 C ATOM 2701 C LEU B 76 1.777 -4.359 -1.970 1.00 73.51 C ATOM 2702 O LEU B 76 2.949 -4.718 -1.840 1.00 54.43 O ATOM 2703 CB LEU B 76 1.024 -2.749 -3.707 1.00 60.42 C ATOM 2704 CG LEU B 76 0.524 -2.418 -5.113 1.00 62.11 C ATOM 2705 CD1 LEU B 76 0.412 -0.917 -5.294 1.00 50.14 C ATOM 2706 CD2 LEU B 76 1.452 -2.996 -6.157 1.00 51.31 C ATOM 0 H LEU B 76 -0.914 -4.323 -3.725 1.00 74.10 H new ATOM 0 HA LEU B 76 1.791 -4.731 -4.080 1.00 52.34 H new ATOM 0 HB2 LEU B 76 0.350 -2.283 -2.989 1.00 60.42 H new ATOM 0 HB3 LEU B 76 2.001 -2.283 -3.576 1.00 60.42 H new ATOM 0 HG LEU B 76 -0.463 -2.863 -5.238 1.00 62.11 H new ATOM 0 HD11 LEU B 76 0.055 -0.697 -6.300 1.00 50.14 H new ATOM 0 HD12 LEU B 76 -0.290 -0.514 -4.564 1.00 50.14 H new ATOM 0 HD13 LEU B 76 1.390 -0.459 -5.148 1.00 50.14 H new ATOM 0 HD21 LEU B 76 1.079 -2.750 -7.151 1.00 51.31 H new ATOM 0 HD22 LEU B 76 2.450 -2.576 -6.029 1.00 51.31 H new ATOM 0 HD23 LEU B 76 1.497 -4.079 -6.044 1.00 51.31 H new ATOM 2718 N THR B 77 0.982 -4.084 -0.951 1.00 42.23 N ATOM 2719 CA THR B 77 1.444 -4.131 0.409 1.00 12.12 C ATOM 2720 C THR B 77 1.886 -5.554 0.811 1.00 53.04 C ATOM 2721 O THR B 77 3.001 -5.757 1.313 1.00 73.44 O ATOM 2722 CB THR B 77 0.327 -3.652 1.353 1.00 70.14 C ATOM 2723 OG1 THR B 77 -0.098 -2.346 0.948 1.00 20.22 O ATOM 2724 CG2 THR B 77 0.818 -3.593 2.795 1.00 64.44 C ATOM 0 H THR B 77 0.001 -3.823 -1.051 1.00 42.23 H new ATOM 0 HA THR B 77 2.309 -3.474 0.491 1.00 12.12 H new ATOM 0 HB THR B 77 -0.502 -4.358 1.298 1.00 70.14 H new ATOM 0 HG1 THR B 77 -0.703 -2.422 0.181 1.00 20.22 H new ATOM 0 HG21 THR B 77 0.009 -3.252 3.441 1.00 64.44 H new ATOM 0 HG22 THR B 77 1.140 -4.585 3.111 1.00 64.44 H new ATOM 0 HG23 THR B 77 1.656 -2.900 2.866 1.00 64.44 H new ATOM 2732 N LYS B 78 1.029 -6.526 0.574 1.00 73.21 N ATOM 2733 CA LYS B 78 1.311 -7.877 0.997 1.00 70.55 C ATOM 2734 C LYS B 78 2.395 -8.575 0.182 1.00 23.03 C ATOM 2735 O LYS B 78 3.184 -9.336 0.736 1.00 34.14 O ATOM 2736 CB LYS B 78 0.040 -8.700 1.170 1.00 32.40 C ATOM 2737 CG LYS B 78 -0.784 -8.869 -0.043 1.00 11.53 C ATOM 2738 CD LYS B 78 -2.143 -9.436 0.308 1.00 70.31 C ATOM 2739 CE LYS B 78 -2.989 -9.701 -0.922 1.00 31.34 C ATOM 2740 NZ LYS B 78 -4.357 -10.123 -0.555 1.00 0.23 N ATOM 0 H LYS B 78 0.137 -6.404 0.094 1.00 73.21 H new ATOM 0 HA LYS B 78 1.754 -7.791 1.989 1.00 70.55 H new ATOM 0 HB2 LYS B 78 0.316 -9.688 1.540 1.00 32.40 H new ATOM 0 HB3 LYS B 78 -0.572 -8.231 1.940 1.00 32.40 H new ATOM 0 HG2 LYS B 78 -0.904 -7.908 -0.544 1.00 11.53 H new ATOM 0 HG3 LYS B 78 -0.277 -9.533 -0.743 1.00 11.53 H new ATOM 0 HD2 LYS B 78 -2.015 -10.364 0.865 1.00 70.31 H new ATOM 0 HD3 LYS B 78 -2.667 -8.740 0.964 1.00 70.31 H new ATOM 0 HE2 LYS B 78 -3.036 -8.800 -1.534 1.00 31.34 H new ATOM 0 HE3 LYS B 78 -2.519 -10.474 -1.529 1.00 31.34 H new ATOM 0 HZ1 LYS B 78 -4.728 -10.768 -1.281 1.00 0.23 H new ATOM 0 HZ2 LYS B 78 -4.335 -10.611 0.363 1.00 0.23 H new ATOM 0 HZ3 LYS B 78 -4.972 -9.287 -0.488 1.00 0.23 H new ATOM 2754 N TYR B 79 2.463 -8.308 -1.108 1.00 20.44 N ATOM 2755 CA TYR B 79 3.499 -8.917 -1.926 1.00 31.20 C ATOM 2756 C TYR B 79 4.868 -8.389 -1.496 1.00 23.45 C ATOM 2757 O TYR B 79 5.840 -9.137 -1.434 1.00 42.52 O ATOM 2758 CB TYR B 79 3.254 -8.681 -3.422 1.00 13.21 C ATOM 2759 CG TYR B 79 4.257 -9.382 -4.316 1.00 60.31 C ATOM 2760 CD1 TYR B 79 4.191 -10.755 -4.508 1.00 53.32 C ATOM 2761 CD2 TYR B 79 5.272 -8.681 -4.955 1.00 71.43 C ATOM 2762 CE1 TYR B 79 5.102 -11.407 -5.309 1.00 0.33 C ATOM 2763 CE2 TYR B 79 6.189 -9.329 -5.760 1.00 0.11 C ATOM 2764 CZ TYR B 79 6.097 -10.693 -5.933 1.00 3.40 C ATOM 2765 OH TYR B 79 7.008 -11.346 -6.726 1.00 65.20 O ATOM 0 H TYR B 79 1.827 -7.686 -1.607 1.00 20.44 H new ATOM 0 HA TYR B 79 3.472 -9.996 -1.772 1.00 31.20 H new ATOM 0 HB2 TYR B 79 2.251 -9.023 -3.676 1.00 13.21 H new ATOM 0 HB3 TYR B 79 3.286 -7.610 -3.623 1.00 13.21 H new ATOM 0 HD1 TYR B 79 3.412 -11.322 -4.021 1.00 53.32 H new ATOM 0 HD2 TYR B 79 5.345 -7.612 -4.820 1.00 71.43 H new ATOM 0 HE1 TYR B 79 5.035 -12.476 -5.446 1.00 0.33 H new ATOM 0 HE2 TYR B 79 6.973 -8.770 -6.250 1.00 0.11 H new ATOM 0 HH TYR B 79 7.645 -10.698 -7.094 1.00 65.20 H new ATOM 2775 N TYR B 80 4.904 -7.102 -1.157 1.00 63.14 N ATOM 2776 CA TYR B 80 6.106 -6.433 -0.657 1.00 23.15 C ATOM 2777 C TYR B 80 6.617 -7.164 0.589 1.00 40.40 C ATOM 2778 O TYR B 80 7.820 -7.397 0.754 1.00 1.25 O ATOM 2779 CB TYR B 80 5.743 -4.978 -0.304 1.00 31.21 C ATOM 2780 CG TYR B 80 6.870 -4.109 0.221 1.00 61.31 C ATOM 2781 CD1 TYR B 80 7.659 -3.377 -0.645 1.00 14.40 C ATOM 2782 CD2 TYR B 80 7.122 -3.997 1.585 1.00 63.52 C ATOM 2783 CE1 TYR B 80 8.668 -2.560 -0.181 1.00 62.13 C ATOM 2784 CE2 TYR B 80 8.134 -3.184 2.057 1.00 63.34 C ATOM 2785 CZ TYR B 80 8.903 -2.469 1.166 1.00 35.31 C ATOM 2786 OH TYR B 80 9.905 -1.652 1.626 1.00 33.22 O ATOM 0 H TYR B 80 4.093 -6.487 -1.222 1.00 63.14 H new ATOM 0 HA TYR B 80 6.889 -6.444 -1.415 1.00 23.15 H new ATOM 0 HB2 TYR B 80 5.332 -4.503 -1.195 1.00 31.21 H new ATOM 0 HB3 TYR B 80 4.949 -4.996 0.443 1.00 31.21 H new ATOM 0 HD1 TYR B 80 7.482 -3.446 -1.708 1.00 14.40 H new ATOM 0 HD2 TYR B 80 6.517 -4.554 2.285 1.00 63.52 H new ATOM 0 HE1 TYR B 80 9.271 -1.994 -0.876 1.00 62.13 H new ATOM 0 HE2 TYR B 80 8.321 -3.110 3.118 1.00 63.34 H new ATOM 0 HH TYR B 80 9.670 -1.315 2.516 1.00 33.22 H new ATOM 2796 N LEU B 81 5.692 -7.530 1.451 1.00 42.01 N ATOM 2797 CA LEU B 81 6.012 -8.241 2.667 1.00 64.24 C ATOM 2798 C LEU B 81 6.413 -9.684 2.372 1.00 30.21 C ATOM 2799 O LEU B 81 7.355 -10.210 2.977 1.00 33.22 O ATOM 2800 CB LEU B 81 4.841 -8.183 3.642 1.00 33.22 C ATOM 2801 CG LEU B 81 4.434 -6.782 4.112 1.00 33.23 C ATOM 2802 CD1 LEU B 81 3.240 -6.856 5.045 1.00 71.33 C ATOM 2803 CD2 LEU B 81 5.602 -6.087 4.797 1.00 33.11 C ATOM 0 H LEU B 81 4.697 -7.342 1.327 1.00 42.01 H new ATOM 0 HA LEU B 81 6.868 -7.752 3.133 1.00 64.24 H new ATOM 0 HB2 LEU B 81 3.977 -8.653 3.172 1.00 33.22 H new ATOM 0 HB3 LEU B 81 5.092 -8.781 4.518 1.00 33.22 H new ATOM 0 HG LEU B 81 4.150 -6.198 3.237 1.00 33.23 H new ATOM 0 HD11 LEU B 81 2.967 -5.851 5.367 1.00 71.33 H new ATOM 0 HD12 LEU B 81 2.398 -7.311 4.523 1.00 71.33 H new ATOM 0 HD13 LEU B 81 3.496 -7.459 5.916 1.00 71.33 H new ATOM 0 HD21 LEU B 81 5.294 -5.094 5.124 1.00 33.11 H new ATOM 0 HD22 LEU B 81 5.917 -6.672 5.661 1.00 33.11 H new ATOM 0 HD23 LEU B 81 6.433 -5.997 4.097 1.00 33.11 H new ATOM 2815 N ALA B 82 5.726 -10.305 1.418 1.00 62.04 N ATOM 2816 CA ALA B 82 6.010 -11.682 1.015 1.00 22.34 C ATOM 2817 C ALA B 82 7.434 -11.812 0.495 1.00 35.11 C ATOM 2818 O ALA B 82 8.083 -12.847 0.674 1.00 63.11 O ATOM 2819 CB ALA B 82 5.018 -12.147 -0.035 1.00 34.22 C ATOM 0 H ALA B 82 4.959 -9.872 0.903 1.00 62.04 H new ATOM 0 HA ALA B 82 5.908 -12.319 1.894 1.00 22.34 H new ATOM 0 HB1 ALA B 82 5.246 -13.174 -0.322 1.00 34.22 H new ATOM 0 HB2 ALA B 82 4.008 -12.100 0.372 1.00 34.22 H new ATOM 0 HB3 ALA B 82 5.086 -11.502 -0.911 1.00 34.22 H new ATOM 2825 N ASN B 83 7.934 -10.731 -0.098 1.00 24.04 N ATOM 2826 CA ASN B 83 9.299 -10.675 -0.645 1.00 62.33 C ATOM 2827 C ASN B 83 10.362 -10.751 0.446 1.00 61.33 C ATOM 2828 O ASN B 83 11.549 -10.831 0.154 1.00 53.11 O ATOM 2829 CB ASN B 83 9.520 -9.402 -1.478 1.00 32.13 C ATOM 2830 CG ASN B 83 8.661 -9.314 -2.729 1.00 63.02 C ATOM 2831 OD1 ASN B 83 8.297 -8.225 -3.160 1.00 12.01 O ATOM 2832 ND2 ASN B 83 8.339 -10.438 -3.323 1.00 34.30 N ATOM 0 H ASN B 83 7.408 -9.865 -0.216 1.00 24.04 H new ATOM 0 HA ASN B 83 9.401 -11.549 -1.289 1.00 62.33 H new ATOM 0 HB2 ASN B 83 9.319 -8.533 -0.852 1.00 32.13 H new ATOM 0 HB3 ASN B 83 10.569 -9.350 -1.768 1.00 32.13 H new ATOM 0 HD21 ASN B 83 7.770 -10.423 -4.169 1.00 34.30 H new ATOM 0 HD22 ASN B 83 8.658 -11.327 -2.939 1.00 34.30 H new ATOM 2839 N HIS B 84 9.945 -10.712 1.700 1.00 54.32 N ATOM 2840 CA HIS B 84 10.893 -10.809 2.808 1.00 34.42 C ATOM 2841 C HIS B 84 10.921 -12.224 3.349 1.00 22.45 C ATOM 2842 O HIS B 84 11.619 -12.516 4.309 1.00 54.54 O ATOM 2843 CB HIS B 84 10.544 -9.839 3.948 1.00 54.13 C ATOM 2844 CG HIS B 84 10.457 -8.407 3.534 1.00 55.21 C ATOM 2845 ND1 HIS B 84 11.432 -7.769 2.809 1.00 64.03 N ATOM 2846 CD2 HIS B 84 9.472 -7.502 3.709 1.00 64.23 C ATOM 2847 CE1 HIS B 84 11.058 -6.546 2.554 1.00 32.11 C ATOM 2848 NE2 HIS B 84 9.871 -6.349 3.087 1.00 32.12 N ATOM 0 H HIS B 84 8.969 -10.615 1.979 1.00 54.32 H new ATOM 0 HA HIS B 84 11.874 -10.538 2.418 1.00 34.42 H new ATOM 0 HB2 HIS B 84 9.590 -10.137 4.383 1.00 54.13 H new ATOM 0 HB3 HIS B 84 11.296 -9.933 4.732 1.00 54.13 H new ATOM 0 HD1 HIS B 84 12.314 -8.187 2.515 1.00 64.03 H new ATOM 0 HD2 HIS B 84 8.544 -7.657 4.239 1.00 64.23 H new ATOM 0 HE1 HIS B 84 11.628 -5.816 1.998 1.00 32.11 H new ATOM 2857 N GLY B 85 10.159 -13.101 2.726 1.00 21.22 N ATOM 2858 CA GLY B 85 10.074 -14.463 3.200 1.00 51.15 C ATOM 2859 C GLY B 85 8.913 -14.632 4.145 1.00 51.40 C ATOM 2860 O GLY B 85 8.853 -15.582 4.921 1.00 74.20 O ATOM 0 H GLY B 85 9.597 -12.896 1.900 1.00 21.22 H new ATOM 0 HA2 GLY B 85 9.961 -15.140 2.354 1.00 51.15 H new ATOM 0 HA3 GLY B 85 11.001 -14.735 3.704 1.00 51.15 H new ATOM 2864 N ILE B 86 8.006 -13.692 4.093 1.00 54.41 N ATOM 2865 CA ILE B 86 6.814 -13.711 4.901 1.00 61.22 C ATOM 2866 C ILE B 86 5.697 -14.350 4.109 1.00 25.03 C ATOM 2867 O ILE B 86 5.543 -14.075 2.921 1.00 20.22 O ATOM 2868 CB ILE B 86 6.395 -12.266 5.305 1.00 63.24 C ATOM 2869 CG1 ILE B 86 7.483 -11.609 6.162 1.00 15.31 C ATOM 2870 CG2 ILE B 86 5.050 -12.257 6.029 1.00 44.43 C ATOM 2871 CD1 ILE B 86 7.162 -10.193 6.584 1.00 72.12 C ATOM 0 H ILE B 86 8.075 -12.880 3.480 1.00 54.41 H new ATOM 0 HA ILE B 86 7.012 -14.280 5.809 1.00 61.22 H new ATOM 0 HB ILE B 86 6.279 -11.684 4.391 1.00 63.24 H new ATOM 0 HG12 ILE B 86 7.644 -12.215 7.053 1.00 15.31 H new ATOM 0 HG13 ILE B 86 8.419 -11.607 5.604 1.00 15.31 H new ATOM 0 HG21 ILE B 86 4.788 -11.233 6.297 1.00 44.43 H new ATOM 0 HG22 ILE B 86 4.282 -12.669 5.375 1.00 44.43 H new ATOM 0 HG23 ILE B 86 5.119 -12.862 6.933 1.00 44.43 H new ATOM 0 HD11 ILE B 86 7.980 -9.799 7.187 1.00 72.12 H new ATOM 0 HD12 ILE B 86 7.030 -9.571 5.699 1.00 72.12 H new ATOM 0 HD13 ILE B 86 6.244 -10.188 7.171 1.00 72.12 H new ATOM 2883 N ASP B 87 4.952 -15.219 4.732 1.00 3.44 N ATOM 2884 CA ASP B 87 3.826 -15.836 4.068 1.00 24.35 C ATOM 2885 C ASP B 87 2.554 -15.213 4.505 1.00 10.53 C ATOM 2886 O ASP B 87 2.216 -15.229 5.695 1.00 31.11 O ATOM 2887 CB ASP B 87 3.773 -17.346 4.252 1.00 31.41 C ATOM 2888 CG ASP B 87 4.898 -18.039 3.555 1.00 64.43 C ATOM 2889 OD1 ASP B 87 5.819 -18.524 4.236 1.00 74.10 O ATOM 2890 OD2 ASP B 87 4.887 -18.085 2.307 1.00 51.44 O ATOM 0 H ASP B 87 5.099 -15.519 5.696 1.00 3.44 H new ATOM 0 HA ASP B 87 3.965 -15.659 3.001 1.00 24.35 H new ATOM 0 HB2 ASP B 87 3.806 -17.582 5.316 1.00 31.41 H new ATOM 0 HB3 ASP B 87 2.824 -17.724 3.871 1.00 31.41 H new ATOM 2895 N ILE B 88 1.862 -14.661 3.563 1.00 4.23 N ATOM 2896 CA ILE B 88 0.613 -14.009 3.804 1.00 34.31 C ATOM 2897 C ILE B 88 -0.472 -14.819 3.123 1.00 32.14 C ATOM 2898 O ILE B 88 -0.193 -15.484 2.116 1.00 0.00 O ATOM 2899 CB ILE B 88 0.629 -12.547 3.251 1.00 3.44 C ATOM 2900 CG1 ILE B 88 1.771 -11.762 3.897 1.00 72.10 C ATOM 2901 CG2 ILE B 88 -0.705 -11.837 3.499 1.00 25.44 C ATOM 2902 CD1 ILE B 88 1.874 -10.336 3.433 1.00 34.25 C ATOM 0 H ILE B 88 2.153 -14.649 2.585 1.00 4.23 H new ATOM 0 HA ILE B 88 0.427 -13.948 4.876 1.00 34.31 H new ATOM 0 HB ILE B 88 0.783 -12.595 2.173 1.00 3.44 H new ATOM 0 HG12 ILE B 88 1.638 -11.772 4.979 1.00 72.10 H new ATOM 0 HG13 ILE B 88 2.712 -12.270 3.686 1.00 72.10 H new ATOM 0 HG21 ILE B 88 -0.657 -10.823 3.101 1.00 25.44 H new ATOM 0 HG22 ILE B 88 -1.506 -12.384 3.002 1.00 25.44 H new ATOM 0 HG23 ILE B 88 -0.903 -11.798 4.570 1.00 25.44 H new ATOM 0 HD11 ILE B 88 2.708 -9.848 3.938 1.00 34.25 H new ATOM 0 HD12 ILE B 88 2.039 -10.315 2.356 1.00 34.25 H new ATOM 0 HD13 ILE B 88 0.949 -9.809 3.668 1.00 34.25 H new