USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 911 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 83 ASN :FLIP amide:sc= -0.0915 F(o=-7.8,f=-5.7) USER MOD Set 1.2: A 118 ASN : amide:sc= -5.64! C(o=-5.7!,f=-14!) USER MOD Set 2.1: A 66 HIS :FLIP no HD1:sc= 0 X(o=-0.85,f=-0.75) USER MOD Set 2.2: A 121 ASN :FLIP amide:sc= -0.748 F(o=-1.4,f=-0.75) USER MOD Set 3.1: A 51 SER OG : rot 37:sc= 0.356 USER MOD Set 3.2: A 64 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 35 LYS NZ :NH3+ 169:sc= -1.97! (180deg=-0.257) USER MOD Set 4.2: A 39 ASN :FLIP amide:sc= -3.65! C(o=-11!,f=-5.6!) USER MOD Set 5.1: A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.274 X(o=-0.27,f=-0.28) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 TYR OH : rot 150:sc= -0.32 USER MOD Single : A 54 LYS NZ :NH3+ 160:sc= -7.8! (180deg=-10.2!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot -78:sc= 2.21 USER MOD Single : A 65 ASN : amide:sc= -2.28! C(o=-2.3!,f=-3.6!) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 161:sc= -0.0347 (180deg=-0.495) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 161:sc= -0.0338 (180deg=-0.451) USER MOD Single : A 90 ASN : amide:sc= -1.59! C(o=-1.6!,f=-12!) USER MOD Single : A 97 ASN : amide:sc= -0.144 K(o=-0.14,f=-1.9!) USER MOD Single : A 98 LYS NZ :NH3+ -139:sc= 0.646 (180deg=-0.883!) USER MOD Single : A 101 LYS NZ :NH3+ -121:sc=-0.00938 (180deg=-2.42!) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 159:sc= -1.16 (180deg=-1.64) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 TYR OH : rot -140:sc= -0.151 USER MOD Single : A 120 THR OG1 : rot 109:sc= 0.42 USER MOD Single : A 124 HIS : no HD1:sc= -1.17 K(o=-1.2,f=-4.3!) USER MOD Single : A 127 LYS NZ :NH3+ -161:sc= -0.0617 (180deg=-0.496) USER MOD Single : A 128 CYS SG : rot -133:sc= -15.6! USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ -152:sc= -0.163 (180deg=-0.674) USER MOD Single : A 134 LYS NZ :NH3+ 171:sc= 0.927 (180deg=0.608) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 162:sc= -0.0366 (180deg=-0.506) USER MOD Single : A 137 LYS NZ :NH3+ -132:sc= -0.111 (180deg=-0.511) USER MOD ----------------------------------------------------------------- ATOM 409 N ARG A 24 18.130 -1.923 -1.619 1.00 0.00 N ATOM 410 CA ARG A 24 19.044 -2.937 -2.129 1.00 0.00 C ATOM 411 C ARG A 24 20.441 -2.733 -1.551 1.00 0.00 C ATOM 412 O ARG A 24 21.072 -3.678 -1.079 1.00 0.00 O ATOM 413 CB ARG A 24 19.106 -2.867 -3.655 1.00 0.00 C ATOM 414 CG ARG A 24 20.109 -3.898 -4.175 1.00 0.00 C ATOM 415 CD ARG A 24 19.635 -5.303 -3.804 1.00 0.00 C ATOM 416 NE ARG A 24 20.576 -6.301 -4.300 1.00 0.00 N ATOM 417 CZ ARG A 24 20.517 -6.736 -5.554 1.00 0.00 C ATOM 418 NH1 ARG A 24 19.606 -6.272 -6.364 1.00 0.00 N ATOM 419 NH2 ARG A 24 21.371 -7.629 -5.975 1.00 0.00 N ATOM 0 HA ARG A 24 18.675 -3.917 -1.827 1.00 0.00 H new ATOM 0 HB2 ARG A 24 18.120 -3.058 -4.078 1.00 0.00 H new ATOM 0 HB3 ARG A 24 19.400 -1.866 -3.972 1.00 0.00 H new ATOM 0 HG2 ARG A 24 20.209 -3.810 -5.257 1.00 0.00 H new ATOM 0 HG3 ARG A 24 21.094 -3.710 -3.748 1.00 0.00 H new ATOM 0 HD2 ARG A 24 19.540 -5.388 -2.721 1.00 0.00 H new ATOM 0 HD3 ARG A 24 18.646 -5.484 -4.226 1.00 0.00 H new ATOM 0 HE ARG A 24 21.291 -6.671 -3.674 1.00 0.00 H new ATOM 0 HH11 ARG A 24 18.938 -5.575 -6.035 1.00 0.00 H new ATOM 0 HH12 ARG A 24 19.561 -6.606 -7.327 1.00 0.00 H new ATOM 0 HH21 ARG A 24 22.083 -7.992 -5.341 1.00 0.00 H new ATOM 0 HH22 ARG A 24 21.326 -7.963 -6.938 1.00 0.00 H new ATOM 433 N GLU A 25 20.912 -1.491 -1.583 1.00 0.00 N ATOM 434 CA GLU A 25 22.230 -1.173 -1.048 1.00 0.00 C ATOM 435 C GLU A 25 22.265 -1.426 0.455 1.00 0.00 C ATOM 436 O GLU A 25 23.240 -1.957 0.985 1.00 0.00 O ATOM 437 CB GLU A 25 22.572 0.291 -1.332 1.00 0.00 C ATOM 438 CG GLU A 25 24.017 0.568 -0.917 1.00 0.00 C ATOM 439 CD GLU A 25 24.089 0.831 0.584 1.00 0.00 C ATOM 440 OE1 GLU A 25 23.093 1.269 1.136 1.00 0.00 O ATOM 441 OE2 GLU A 25 25.138 0.590 1.158 1.00 0.00 O ATOM 0 H GLU A 25 20.406 -0.695 -1.970 1.00 0.00 H new ATOM 0 HA GLU A 25 22.966 -1.814 -1.533 1.00 0.00 H new ATOM 0 HB2 GLU A 25 22.439 0.507 -2.392 1.00 0.00 H new ATOM 0 HB3 GLU A 25 21.894 0.946 -0.786 1.00 0.00 H new ATOM 0 HG2 GLU A 25 24.648 -0.283 -1.176 1.00 0.00 H new ATOM 0 HG3 GLU A 25 24.402 1.429 -1.464 1.00 0.00 H new ATOM 448 N TYR A 26 21.190 -1.038 1.132 1.00 0.00 N ATOM 449 CA TYR A 26 21.095 -1.221 2.575 1.00 0.00 C ATOM 450 C TYR A 26 21.192 -2.699 2.935 1.00 0.00 C ATOM 451 O TYR A 26 21.956 -3.085 3.819 1.00 0.00 O ATOM 452 CB TYR A 26 19.767 -0.654 3.080 1.00 0.00 C ATOM 453 CG TYR A 26 19.643 -0.897 4.565 1.00 0.00 C ATOM 454 CD1 TYR A 26 20.320 -0.068 5.468 1.00 0.00 C ATOM 455 CD2 TYR A 26 18.851 -1.949 5.038 1.00 0.00 C ATOM 456 CE1 TYR A 26 20.204 -0.291 6.844 1.00 0.00 C ATOM 457 CE2 TYR A 26 18.735 -2.172 6.415 1.00 0.00 C ATOM 458 CZ TYR A 26 19.411 -1.343 7.319 1.00 0.00 C ATOM 459 OH TYR A 26 19.297 -1.564 8.676 1.00 0.00 O ATOM 0 H TYR A 26 20.375 -0.596 0.706 1.00 0.00 H new ATOM 0 HA TYR A 26 21.922 -0.692 3.049 1.00 0.00 H new ATOM 0 HB2 TYR A 26 19.713 0.414 2.871 1.00 0.00 H new ATOM 0 HB3 TYR A 26 18.936 -1.124 2.554 1.00 0.00 H new ATOM 0 HD1 TYR A 26 20.932 0.743 5.102 1.00 0.00 H new ATOM 0 HD2 TYR A 26 18.330 -2.588 4.341 1.00 0.00 H new ATOM 0 HE1 TYR A 26 20.726 0.348 7.540 1.00 0.00 H new ATOM 0 HE2 TYR A 26 18.124 -2.984 6.781 1.00 0.00 H new ATOM 0 HH TYR A 26 18.709 -2.332 8.834 1.00 0.00 H new ATOM 469 N ALA A 27 20.411 -3.523 2.242 1.00 0.00 N ATOM 470 CA ALA A 27 20.416 -4.960 2.496 1.00 0.00 C ATOM 471 C ALA A 27 21.797 -5.547 2.222 1.00 0.00 C ATOM 472 O ALA A 27 22.273 -6.407 2.963 1.00 0.00 O ATOM 473 CB ALA A 27 19.380 -5.650 1.608 1.00 0.00 C ATOM 0 H ALA A 27 19.772 -3.223 1.506 1.00 0.00 H new ATOM 0 HA ALA A 27 20.165 -5.127 3.543 1.00 0.00 H new ATOM 0 HB1 ALA A 27 19.390 -6.722 1.803 1.00 0.00 H new ATOM 0 HB2 ALA A 27 18.390 -5.250 1.826 1.00 0.00 H new ATOM 0 HB3 ALA A 27 19.621 -5.470 0.560 1.00 0.00 H new ATOM 479 N GLN A 28 22.432 -5.078 1.153 1.00 0.00 N ATOM 480 CA GLN A 28 23.757 -5.565 0.790 1.00 0.00 C ATOM 481 C GLN A 28 24.763 -5.246 1.891 1.00 0.00 C ATOM 482 O GLN A 28 25.622 -6.066 2.217 1.00 0.00 O ATOM 483 CB GLN A 28 24.211 -4.919 -0.521 1.00 0.00 C ATOM 484 CG GLN A 28 25.521 -5.560 -0.980 1.00 0.00 C ATOM 485 CD GLN A 28 25.309 -7.046 -1.247 1.00 0.00 C ATOM 486 OE1 GLN A 28 24.447 -7.419 -2.042 1.00 0.00 O ATOM 487 NE2 GLN A 28 26.048 -7.924 -0.623 1.00 0.00 N ATOM 0 H GLN A 28 22.054 -4.367 0.527 1.00 0.00 H new ATOM 0 HA GLN A 28 23.704 -6.646 0.662 1.00 0.00 H new ATOM 0 HB2 GLN A 28 23.445 -5.046 -1.286 1.00 0.00 H new ATOM 0 HB3 GLN A 28 24.348 -3.847 -0.382 1.00 0.00 H new ATOM 0 HG2 GLN A 28 25.879 -5.067 -1.884 1.00 0.00 H new ATOM 0 HG3 GLN A 28 26.288 -5.425 -0.218 1.00 0.00 H new ATOM 0 HE21 GLN A 28 26.762 -7.613 0.036 1.00 0.00 H new ATOM 0 HE22 GLN A 28 25.911 -8.920 -0.795 1.00 0.00 H new ATOM 496 N GLU A 29 24.651 -4.050 2.458 1.00 0.00 N ATOM 497 CA GLU A 29 25.555 -3.633 3.523 1.00 0.00 C ATOM 498 C GLU A 29 25.403 -4.540 4.739 1.00 0.00 C ATOM 499 O GLU A 29 26.387 -4.889 5.390 1.00 0.00 O ATOM 500 CB GLU A 29 25.265 -2.186 3.922 1.00 0.00 C ATOM 501 CG GLU A 29 25.691 -1.249 2.791 1.00 0.00 C ATOM 502 CD GLU A 29 27.177 -1.427 2.497 1.00 0.00 C ATOM 503 OE1 GLU A 29 27.953 -1.407 3.438 1.00 0.00 O ATOM 504 OE2 GLU A 29 27.517 -1.582 1.336 1.00 0.00 O ATOM 0 H GLU A 29 23.949 -3.357 2.200 1.00 0.00 H new ATOM 0 HA GLU A 29 26.578 -3.707 3.154 1.00 0.00 H new ATOM 0 HB2 GLU A 29 24.202 -2.061 4.131 1.00 0.00 H new ATOM 0 HB3 GLU A 29 25.801 -1.936 4.837 1.00 0.00 H new ATOM 0 HG2 GLU A 29 25.107 -1.459 1.895 1.00 0.00 H new ATOM 0 HG3 GLU A 29 25.488 -0.215 3.069 1.00 0.00 H new ATOM 511 N MET A 30 24.165 -4.920 5.040 1.00 0.00 N ATOM 512 CA MET A 30 23.905 -5.787 6.181 1.00 0.00 C ATOM 513 C MET A 30 24.635 -7.115 6.013 1.00 0.00 C ATOM 514 O MET A 30 25.292 -7.594 6.937 1.00 0.00 O ATOM 515 CB MET A 30 22.402 -6.042 6.315 1.00 0.00 C ATOM 516 CG MET A 30 22.143 -6.940 7.526 1.00 0.00 C ATOM 517 SD MET A 30 20.360 -7.171 7.734 1.00 0.00 S ATOM 518 CE MET A 30 20.439 -8.250 9.184 1.00 0.00 C ATOM 0 H MET A 30 23.335 -4.644 4.515 1.00 0.00 H new ATOM 0 HA MET A 30 24.268 -5.293 7.082 1.00 0.00 H new ATOM 0 HB2 MET A 30 21.871 -5.097 6.429 1.00 0.00 H new ATOM 0 HB3 MET A 30 22.020 -6.515 5.410 1.00 0.00 H new ATOM 0 HG2 MET A 30 22.632 -7.904 7.388 1.00 0.00 H new ATOM 0 HG3 MET A 30 22.570 -6.491 8.423 1.00 0.00 H new ATOM 0 HE1 MET A 30 19.429 -8.522 9.491 1.00 0.00 H new ATOM 0 HE2 MET A 30 20.998 -9.152 8.936 1.00 0.00 H new ATOM 0 HE3 MET A 30 20.938 -7.727 10.000 1.00 0.00 H new ATOM 528 N ASP A 31 24.524 -7.701 4.825 1.00 0.00 N ATOM 529 CA ASP A 31 25.190 -8.966 4.549 1.00 0.00 C ATOM 530 C ASP A 31 26.701 -8.798 4.662 1.00 0.00 C ATOM 531 O ASP A 31 27.396 -9.664 5.193 1.00 0.00 O ATOM 532 CB ASP A 31 24.830 -9.454 3.145 1.00 0.00 C ATOM 533 CG ASP A 31 23.379 -9.921 3.110 1.00 0.00 C ATOM 534 OD1 ASP A 31 22.806 -10.086 4.175 1.00 0.00 O ATOM 535 OD2 ASP A 31 22.863 -10.107 2.021 1.00 0.00 O ATOM 0 H ASP A 31 23.984 -7.324 4.046 1.00 0.00 H new ATOM 0 HA ASP A 31 24.857 -9.703 5.280 1.00 0.00 H new ATOM 0 HB2 ASP A 31 24.980 -8.651 2.423 1.00 0.00 H new ATOM 0 HB3 ASP A 31 25.491 -10.271 2.855 1.00 0.00 H new ATOM 540 N ARG A 32 27.199 -7.671 4.162 1.00 0.00 N ATOM 541 CA ARG A 32 28.627 -7.387 4.214 1.00 0.00 C ATOM 542 C ARG A 32 29.101 -7.315 5.661 1.00 0.00 C ATOM 543 O ARG A 32 30.148 -7.859 6.010 1.00 0.00 O ATOM 544 CB ARG A 32 28.919 -6.060 3.511 1.00 0.00 C ATOM 545 CG ARG A 32 30.424 -5.780 3.547 1.00 0.00 C ATOM 546 CD ARG A 32 30.753 -4.919 4.768 1.00 0.00 C ATOM 547 NE ARG A 32 32.154 -4.514 4.736 1.00 0.00 N ATOM 548 CZ ARG A 32 32.667 -3.739 5.686 1.00 0.00 C ATOM 549 NH1 ARG A 32 31.915 -3.327 6.669 1.00 0.00 N ATOM 550 NH2 ARG A 32 33.923 -3.389 5.634 1.00 0.00 N ATOM 0 H ARG A 32 26.637 -6.944 3.719 1.00 0.00 H new ATOM 0 HA ARG A 32 29.161 -8.191 3.707 1.00 0.00 H new ATOM 0 HB2 ARG A 32 28.571 -6.099 2.479 1.00 0.00 H new ATOM 0 HB3 ARG A 32 28.376 -5.251 4.000 1.00 0.00 H new ATOM 0 HG2 ARG A 32 30.978 -6.718 3.590 1.00 0.00 H new ATOM 0 HG3 ARG A 32 30.732 -5.269 2.635 1.00 0.00 H new ATOM 0 HD2 ARG A 32 30.112 -4.037 4.784 1.00 0.00 H new ATOM 0 HD3 ARG A 32 30.549 -5.478 5.682 1.00 0.00 H new ATOM 0 HE ARG A 32 32.750 -4.831 3.971 1.00 0.00 H new ATOM 0 HH11 ARG A 32 30.933 -3.600 6.709 1.00 0.00 H new ATOM 0 HH12 ARG A 32 32.309 -2.732 7.398 1.00 0.00 H new ATOM 0 HH21 ARG A 32 34.510 -3.710 4.865 1.00 0.00 H new ATOM 0 HH22 ARG A 32 34.317 -2.794 6.363 1.00 0.00 H new ATOM 564 N LEU A 33 28.320 -6.639 6.498 1.00 0.00 N ATOM 565 CA LEU A 33 28.666 -6.502 7.907 1.00 0.00 C ATOM 566 C LEU A 33 28.720 -7.873 8.572 1.00 0.00 C ATOM 567 O LEU A 33 29.641 -8.170 9.334 1.00 0.00 O ATOM 568 CB LEU A 33 27.630 -5.627 8.616 1.00 0.00 C ATOM 569 CG LEU A 33 28.011 -5.477 10.088 1.00 0.00 C ATOM 570 CD1 LEU A 33 29.372 -4.786 10.190 1.00 0.00 C ATOM 571 CD2 LEU A 33 26.957 -4.631 10.805 1.00 0.00 C ATOM 0 H LEU A 33 27.450 -6.181 6.227 1.00 0.00 H new ATOM 0 HA LEU A 33 29.647 -6.032 7.982 1.00 0.00 H new ATOM 0 HB2 LEU A 33 27.580 -4.647 8.141 1.00 0.00 H new ATOM 0 HB3 LEU A 33 26.640 -6.075 8.529 1.00 0.00 H new ATOM 0 HG LEU A 33 28.064 -6.461 10.553 1.00 0.00 H new ATOM 0 HD11 LEU A 33 29.647 -4.677 11.239 1.00 0.00 H new ATOM 0 HD12 LEU A 33 30.124 -5.386 9.678 1.00 0.00 H new ATOM 0 HD13 LEU A 33 29.316 -3.801 9.726 1.00 0.00 H new ATOM 0 HD21 LEU A 33 27.229 -4.524 11.855 1.00 0.00 H new ATOM 0 HD22 LEU A 33 26.904 -3.646 10.342 1.00 0.00 H new ATOM 0 HD23 LEU A 33 25.986 -5.120 10.730 1.00 0.00 H new ATOM 583 N GLU A 34 27.729 -8.707 8.270 1.00 0.00 N ATOM 584 CA GLU A 34 27.672 -10.050 8.835 1.00 0.00 C ATOM 585 C GLU A 34 28.879 -10.863 8.385 1.00 0.00 C ATOM 586 O GLU A 34 29.442 -11.639 9.158 1.00 0.00 O ATOM 587 CB GLU A 34 26.387 -10.751 8.391 1.00 0.00 C ATOM 588 CG GLU A 34 25.187 -10.092 9.073 1.00 0.00 C ATOM 589 CD GLU A 34 25.336 -10.179 10.588 1.00 0.00 C ATOM 590 OE1 GLU A 34 25.607 -11.263 11.075 1.00 0.00 O ATOM 591 OE2 GLU A 34 25.177 -9.159 11.239 1.00 0.00 O ATOM 0 H GLU A 34 26.959 -8.478 7.641 1.00 0.00 H new ATOM 0 HA GLU A 34 27.682 -9.971 9.922 1.00 0.00 H new ATOM 0 HB2 GLU A 34 26.282 -10.690 7.308 1.00 0.00 H new ATOM 0 HB3 GLU A 34 26.430 -11.809 8.648 1.00 0.00 H new ATOM 0 HG2 GLU A 34 25.111 -9.049 8.766 1.00 0.00 H new ATOM 0 HG3 GLU A 34 24.266 -10.584 8.761 1.00 0.00 H new ATOM 598 N LYS A 35 29.272 -10.675 7.130 1.00 0.00 N ATOM 599 CA LYS A 35 30.417 -11.391 6.584 1.00 0.00 C ATOM 600 C LYS A 35 31.668 -11.069 7.394 1.00 0.00 C ATOM 601 O LYS A 35 32.465 -11.954 7.705 1.00 0.00 O ATOM 602 CB LYS A 35 30.634 -10.994 5.123 1.00 0.00 C ATOM 603 CG LYS A 35 31.830 -11.759 4.557 1.00 0.00 C ATOM 604 CD LYS A 35 31.525 -13.258 4.558 1.00 0.00 C ATOM 605 CE LYS A 35 32.609 -14.001 3.778 1.00 0.00 C ATOM 606 NZ LYS A 35 33.925 -13.809 4.451 1.00 0.00 N ATOM 0 H LYS A 35 28.818 -10.037 6.476 1.00 0.00 H new ATOM 0 HA LYS A 35 30.221 -12.462 6.639 1.00 0.00 H new ATOM 0 HB2 LYS A 35 29.740 -11.213 4.539 1.00 0.00 H new ATOM 0 HB3 LYS A 35 30.808 -9.920 5.049 1.00 0.00 H new ATOM 0 HG2 LYS A 35 32.044 -11.421 3.543 1.00 0.00 H new ATOM 0 HG3 LYS A 35 32.719 -11.558 5.154 1.00 0.00 H new ATOM 0 HD2 LYS A 35 31.480 -13.630 5.582 1.00 0.00 H new ATOM 0 HD3 LYS A 35 30.549 -13.441 4.109 1.00 0.00 H new ATOM 0 HE2 LYS A 35 32.369 -15.063 3.722 1.00 0.00 H new ATOM 0 HE3 LYS A 35 32.654 -13.630 2.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 34.625 -14.457 4.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 34.242 -12.827 4.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 33.828 -14.008 5.467 1.00 0.00 H new ATOM 620 N ALA A 36 31.826 -9.796 7.739 1.00 0.00 N ATOM 621 CA ALA A 36 32.976 -9.364 8.522 1.00 0.00 C ATOM 622 C ALA A 36 32.990 -10.073 9.873 1.00 0.00 C ATOM 623 O ALA A 36 34.044 -10.464 10.364 1.00 0.00 O ATOM 624 CB ALA A 36 32.927 -7.850 8.736 1.00 0.00 C ATOM 0 H ALA A 36 31.176 -9.050 7.490 1.00 0.00 H new ATOM 0 HA ALA A 36 33.884 -9.619 7.976 1.00 0.00 H new ATOM 0 HB1 ALA A 36 33.791 -7.537 9.322 1.00 0.00 H new ATOM 0 HB2 ALA A 36 32.942 -7.345 7.770 1.00 0.00 H new ATOM 0 HB3 ALA A 36 32.013 -7.587 9.268 1.00 0.00 H new ATOM 630 N PHE A 37 31.809 -10.241 10.459 1.00 0.00 N ATOM 631 CA PHE A 37 31.685 -10.907 11.754 1.00 0.00 C ATOM 632 C PHE A 37 32.271 -12.312 11.705 1.00 0.00 C ATOM 633 O PHE A 37 33.023 -12.712 12.595 1.00 0.00 O ATOM 634 CB PHE A 37 30.212 -10.983 12.161 1.00 0.00 C ATOM 635 CG PHE A 37 30.068 -11.894 13.358 1.00 0.00 C ATOM 636 CD1 PHE A 37 30.478 -11.466 14.626 1.00 0.00 C ATOM 637 CD2 PHE A 37 29.525 -13.175 13.195 1.00 0.00 C ATOM 638 CE1 PHE A 37 30.344 -12.318 15.730 1.00 0.00 C ATOM 639 CE2 PHE A 37 29.392 -14.026 14.297 1.00 0.00 C ATOM 640 CZ PHE A 37 29.802 -13.598 15.565 1.00 0.00 C ATOM 0 H PHE A 37 30.925 -9.926 10.060 1.00 0.00 H new ATOM 0 HA PHE A 37 32.241 -10.325 12.489 1.00 0.00 H new ATOM 0 HB2 PHE A 37 29.838 -9.988 12.401 1.00 0.00 H new ATOM 0 HB3 PHE A 37 29.613 -11.358 11.331 1.00 0.00 H new ATOM 0 HD1 PHE A 37 30.898 -10.479 14.753 1.00 0.00 H new ATOM 0 HD2 PHE A 37 29.209 -13.506 12.217 1.00 0.00 H new ATOM 0 HE1 PHE A 37 30.659 -11.987 16.709 1.00 0.00 H new ATOM 0 HE2 PHE A 37 28.973 -15.013 14.170 1.00 0.00 H new ATOM 0 HZ PHE A 37 29.700 -14.255 16.416 1.00 0.00 H new ATOM 650 N GLU A 38 31.917 -13.061 10.672 1.00 0.00 N ATOM 651 CA GLU A 38 32.407 -14.425 10.527 1.00 0.00 C ATOM 652 C GLU A 38 33.933 -14.455 10.469 1.00 0.00 C ATOM 653 O GLU A 38 34.564 -15.349 11.032 1.00 0.00 O ATOM 654 CB GLU A 38 31.838 -15.048 9.251 1.00 0.00 C ATOM 655 CG GLU A 38 32.322 -16.494 9.127 1.00 0.00 C ATOM 656 CD GLU A 38 31.732 -17.135 7.876 1.00 0.00 C ATOM 657 OE1 GLU A 38 30.997 -16.458 7.178 1.00 0.00 O ATOM 658 OE2 GLU A 38 32.025 -18.295 7.634 1.00 0.00 O ATOM 0 H GLU A 38 31.296 -12.751 9.925 1.00 0.00 H new ATOM 0 HA GLU A 38 32.080 -14.998 11.395 1.00 0.00 H new ATOM 0 HB2 GLU A 38 30.749 -15.019 9.274 1.00 0.00 H new ATOM 0 HB3 GLU A 38 32.154 -14.472 8.381 1.00 0.00 H new ATOM 0 HG2 GLU A 38 33.411 -16.519 9.080 1.00 0.00 H new ATOM 0 HG3 GLU A 38 32.028 -17.062 10.010 1.00 0.00 H new ATOM 665 N ASN A 39 34.522 -13.488 9.774 1.00 0.00 N ATOM 666 CA ASN A 39 35.977 -13.436 9.642 1.00 0.00 C ATOM 667 C ASN A 39 36.606 -12.461 10.638 1.00 0.00 C ATOM 668 O ASN A 39 37.797 -12.163 10.546 1.00 0.00 O ATOM 669 CB ASN A 39 36.353 -13.016 8.220 1.00 0.00 C ATOM 670 CG ASN A 39 36.017 -14.133 7.239 1.00 0.00 C ATOM 671 OD1 ASN A 39 35.879 -13.854 5.972 1.00 0.00 O flip ATOM 672 ND2 ASN A 39 35.879 -15.290 7.636 1.00 0.00 N flip ATOM 0 H ASN A 39 34.023 -12.737 9.298 1.00 0.00 H new ATOM 0 HA ASN A 39 36.362 -14.433 9.856 1.00 0.00 H new ATOM 0 HB2 ASN A 39 35.816 -12.108 7.947 1.00 0.00 H new ATOM 0 HB3 ASN A 39 37.417 -12.785 8.170 1.00 0.00 H new ATOM 0 HD21 ASN A 39 35.987 -15.505 8.627 1.00 0.00 H new ATOM 0 HD22 ASN A 39 35.656 -16.033 6.974 1.00 0.00 H new ATOM 679 N LEU A 40 35.817 -11.965 11.588 1.00 0.00 N ATOM 680 CA LEU A 40 36.348 -11.029 12.577 1.00 0.00 C ATOM 681 C LEU A 40 36.353 -11.653 13.969 1.00 0.00 C ATOM 682 O LEU A 40 35.425 -11.454 14.753 1.00 0.00 O ATOM 683 CB LEU A 40 35.516 -9.746 12.602 1.00 0.00 C ATOM 684 CG LEU A 40 36.171 -8.691 11.704 1.00 0.00 C ATOM 685 CD1 LEU A 40 37.602 -8.427 12.177 1.00 0.00 C ATOM 686 CD2 LEU A 40 36.200 -9.196 10.260 1.00 0.00 C ATOM 0 H LEU A 40 34.828 -12.189 11.694 1.00 0.00 H new ATOM 0 HA LEU A 40 37.372 -10.790 12.291 1.00 0.00 H new ATOM 0 HB2 LEU A 40 34.502 -9.951 12.259 1.00 0.00 H new ATOM 0 HB3 LEU A 40 35.437 -9.371 13.623 1.00 0.00 H new ATOM 0 HG LEU A 40 35.596 -7.767 11.757 1.00 0.00 H new ATOM 0 HD11 LEU A 40 38.064 -7.676 11.536 1.00 0.00 H new ATOM 0 HD12 LEU A 40 37.584 -8.065 13.205 1.00 0.00 H new ATOM 0 HD13 LEU A 40 38.178 -9.351 12.127 1.00 0.00 H new ATOM 0 HD21 LEU A 40 36.666 -8.446 9.621 1.00 0.00 H new ATOM 0 HD22 LEU A 40 36.773 -10.122 10.210 1.00 0.00 H new ATOM 0 HD23 LEU A 40 35.181 -9.381 9.919 1.00 0.00 H new ATOM 698 N ASP A 41 37.408 -12.402 14.269 1.00 0.00 N ATOM 699 CA ASP A 41 37.535 -13.045 15.572 1.00 0.00 C ATOM 700 C ASP A 41 37.716 -12.004 16.674 1.00 0.00 C ATOM 701 O ASP A 41 38.531 -11.090 16.547 1.00 0.00 O ATOM 702 CB ASP A 41 38.731 -13.999 15.567 1.00 0.00 C ATOM 703 CG ASP A 41 38.799 -14.758 16.887 1.00 0.00 C ATOM 704 OD1 ASP A 41 38.047 -14.416 17.785 1.00 0.00 O ATOM 705 OD2 ASP A 41 39.604 -15.671 16.982 1.00 0.00 O ATOM 0 H ASP A 41 38.184 -12.579 13.631 1.00 0.00 H new ATOM 0 HA ASP A 41 36.621 -13.606 15.768 1.00 0.00 H new ATOM 0 HB2 ASP A 41 38.643 -14.702 14.738 1.00 0.00 H new ATOM 0 HB3 ASP A 41 39.653 -13.438 15.413 1.00 0.00 H new ATOM 710 N GLY A 42 36.960 -12.152 17.756 1.00 0.00 N ATOM 711 CA GLY A 42 37.057 -11.221 18.876 1.00 0.00 C ATOM 712 C GLY A 42 36.045 -10.084 18.753 1.00 0.00 C ATOM 713 O GLY A 42 35.914 -9.261 19.660 1.00 0.00 O ATOM 0 H GLY A 42 36.279 -12.901 17.882 1.00 0.00 H new ATOM 0 HA2 GLY A 42 36.891 -11.757 19.810 1.00 0.00 H new ATOM 0 HA3 GLY A 42 38.065 -10.808 18.920 1.00 0.00 H new ATOM 717 N TRP A 43 35.326 -10.044 17.634 1.00 0.00 N ATOM 718 CA TRP A 43 34.328 -8.999 17.423 1.00 0.00 C ATOM 719 C TRP A 43 32.950 -9.627 17.248 1.00 0.00 C ATOM 720 O TRP A 43 32.830 -10.748 16.754 1.00 0.00 O ATOM 721 CB TRP A 43 34.682 -8.173 16.187 1.00 0.00 C ATOM 722 CG TRP A 43 36.133 -7.817 16.228 1.00 0.00 C ATOM 723 CD1 TRP A 43 36.983 -7.914 15.180 1.00 0.00 C ATOM 724 CD2 TRP A 43 36.926 -7.340 17.354 1.00 0.00 C ATOM 725 NE1 TRP A 43 38.242 -7.508 15.584 1.00 0.00 N ATOM 726 CE2 TRP A 43 38.259 -7.148 16.917 1.00 0.00 C ATOM 727 CE3 TRP A 43 36.621 -7.052 18.695 1.00 0.00 C ATOM 728 CZ2 TRP A 43 39.253 -6.688 17.781 1.00 0.00 C ATOM 729 CZ3 TRP A 43 37.621 -6.591 19.569 1.00 0.00 C ATOM 730 CH2 TRP A 43 38.934 -6.409 19.112 1.00 0.00 C ATOM 0 H TRP A 43 35.413 -10.713 16.869 1.00 0.00 H new ATOM 0 HA TRP A 43 34.316 -8.343 18.293 1.00 0.00 H new ATOM 0 HB2 TRP A 43 34.460 -8.739 15.282 1.00 0.00 H new ATOM 0 HB3 TRP A 43 34.075 -7.268 16.154 1.00 0.00 H new ATOM 0 HD1 TRP A 43 36.721 -8.253 14.189 1.00 0.00 H new ATOM 0 HE1 TRP A 43 39.058 -7.478 14.972 1.00 0.00 H new ATOM 0 HE3 TRP A 43 35.612 -7.186 19.057 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 40.262 -6.549 17.423 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 37.376 -6.376 20.599 1.00 0.00 H new ATOM 0 HH2 TRP A 43 39.698 -6.054 19.788 1.00 0.00 H new ATOM 741 N TYR A 44 31.913 -8.916 17.683 1.00 0.00 N ATOM 742 CA TYR A 44 30.559 -9.448 17.591 1.00 0.00 C ATOM 743 C TYR A 44 29.592 -8.404 17.042 1.00 0.00 C ATOM 744 O TYR A 44 29.757 -7.210 17.276 1.00 0.00 O ATOM 745 CB TYR A 44 30.110 -9.874 18.986 1.00 0.00 C ATOM 746 CG TYR A 44 31.122 -10.845 19.542 1.00 0.00 C ATOM 747 CD1 TYR A 44 32.248 -10.355 20.211 1.00 0.00 C ATOM 748 CD2 TYR A 44 30.945 -12.224 19.383 1.00 0.00 C ATOM 749 CE1 TYR A 44 33.200 -11.240 20.722 1.00 0.00 C ATOM 750 CE2 TYR A 44 31.898 -13.113 19.896 1.00 0.00 C ATOM 751 CZ TYR A 44 33.026 -12.620 20.566 1.00 0.00 C ATOM 752 OH TYR A 44 33.966 -13.497 21.070 1.00 0.00 O ATOM 0 H TYR A 44 31.982 -7.986 18.096 1.00 0.00 H new ATOM 0 HA TYR A 44 30.558 -10.299 16.909 1.00 0.00 H new ATOM 0 HB2 TYR A 44 30.023 -9.004 19.637 1.00 0.00 H new ATOM 0 HB3 TYR A 44 29.125 -10.339 18.941 1.00 0.00 H new ATOM 0 HD1 TYR A 44 32.382 -9.290 20.333 1.00 0.00 H new ATOM 0 HD2 TYR A 44 30.075 -12.602 18.866 1.00 0.00 H new ATOM 0 HE1 TYR A 44 34.070 -10.860 21.237 1.00 0.00 H new ATOM 0 HE2 TYR A 44 31.764 -14.178 19.775 1.00 0.00 H new ATOM 0 HH TYR A 44 33.692 -14.418 20.876 1.00 0.00 H new ATOM 762 N LEU A 45 28.578 -8.863 16.318 1.00 0.00 N ATOM 763 CA LEU A 45 27.584 -7.955 15.754 1.00 0.00 C ATOM 764 C LEU A 45 26.180 -8.524 15.933 1.00 0.00 C ATOM 765 O LEU A 45 25.936 -9.694 15.635 1.00 0.00 O ATOM 766 CB LEU A 45 27.863 -7.739 14.265 1.00 0.00 C ATOM 767 CG LEU A 45 29.154 -6.937 14.096 1.00 0.00 C ATOM 768 CD1 LEU A 45 29.569 -6.945 12.625 1.00 0.00 C ATOM 769 CD2 LEU A 45 28.919 -5.492 14.545 1.00 0.00 C ATOM 0 H LEU A 45 28.422 -9.849 16.108 1.00 0.00 H new ATOM 0 HA LEU A 45 27.648 -7.001 16.278 1.00 0.00 H new ATOM 0 HB2 LEU A 45 27.951 -8.700 13.758 1.00 0.00 H new ATOM 0 HB3 LEU A 45 27.031 -7.209 13.802 1.00 0.00 H new ATOM 0 HG LEU A 45 29.941 -7.386 14.702 1.00 0.00 H new ATOM 0 HD11 LEU A 45 30.489 -6.374 12.503 1.00 0.00 H new ATOM 0 HD12 LEU A 45 29.734 -7.972 12.299 1.00 0.00 H new ATOM 0 HD13 LEU A 45 28.780 -6.495 12.022 1.00 0.00 H new ATOM 0 HD21 LEU A 45 29.839 -4.920 14.425 1.00 0.00 H new ATOM 0 HD22 LEU A 45 28.132 -5.046 13.937 1.00 0.00 H new ATOM 0 HD23 LEU A 45 28.619 -5.481 15.593 1.00 0.00 H new ATOM 781 N SER A 46 25.254 -7.694 16.408 1.00 0.00 N ATOM 782 CA SER A 46 23.881 -8.149 16.598 1.00 0.00 C ATOM 783 C SER A 46 22.943 -7.438 15.626 1.00 0.00 C ATOM 784 O SER A 46 22.936 -6.210 15.539 1.00 0.00 O ATOM 785 CB SER A 46 23.434 -7.873 18.034 1.00 0.00 C ATOM 786 OG SER A 46 24.243 -8.625 18.929 1.00 0.00 O ATOM 0 H SER A 46 25.425 -6.721 16.664 1.00 0.00 H new ATOM 0 HA SER A 46 23.843 -9.221 16.405 1.00 0.00 H new ATOM 0 HB2 SER A 46 23.518 -6.809 18.255 1.00 0.00 H new ATOM 0 HB3 SER A 46 22.385 -8.143 18.159 1.00 0.00 H new ATOM 0 HG SER A 46 23.961 -8.450 19.851 1.00 0.00 H new ATOM 792 N SER A 47 22.154 -8.225 14.898 1.00 0.00 N ATOM 793 CA SER A 47 21.211 -7.675 13.930 1.00 0.00 C ATOM 794 C SER A 47 20.105 -6.877 14.618 1.00 0.00 C ATOM 795 O SER A 47 19.746 -5.786 14.177 1.00 0.00 O ATOM 796 CB SER A 47 20.587 -8.809 13.115 1.00 0.00 C ATOM 797 OG SER A 47 19.668 -8.262 12.179 1.00 0.00 O ATOM 0 H SER A 47 22.150 -9.243 14.960 1.00 0.00 H new ATOM 0 HA SER A 47 21.760 -7.001 13.273 1.00 0.00 H new ATOM 0 HB2 SER A 47 21.364 -9.369 12.595 1.00 0.00 H new ATOM 0 HB3 SER A 47 20.077 -9.510 13.776 1.00 0.00 H new ATOM 0 HG SER A 47 19.267 -8.985 11.653 1.00 0.00 H new ATOM 803 N MET A 48 19.557 -7.443 15.688 1.00 0.00 N ATOM 804 CA MET A 48 18.476 -6.791 16.422 1.00 0.00 C ATOM 805 C MET A 48 18.967 -5.540 17.144 1.00 0.00 C ATOM 806 O MET A 48 18.206 -4.593 17.344 1.00 0.00 O ATOM 807 CB MET A 48 17.878 -7.769 17.436 1.00 0.00 C ATOM 808 CG MET A 48 18.927 -8.115 18.493 1.00 0.00 C ATOM 809 SD MET A 48 18.230 -9.303 19.668 1.00 0.00 S ATOM 810 CE MET A 48 19.683 -9.448 20.735 1.00 0.00 C ATOM 0 H MET A 48 19.841 -8.347 16.066 1.00 0.00 H new ATOM 0 HA MET A 48 17.714 -6.490 15.703 1.00 0.00 H new ATOM 0 HB2 MET A 48 17.001 -7.327 17.910 1.00 0.00 H new ATOM 0 HB3 MET A 48 17.544 -8.675 16.930 1.00 0.00 H new ATOM 0 HG2 MET A 48 19.813 -8.535 18.017 1.00 0.00 H new ATOM 0 HG3 MET A 48 19.243 -7.213 19.016 1.00 0.00 H new ATOM 0 HE1 MET A 48 19.472 -10.146 21.545 1.00 0.00 H new ATOM 0 HE2 MET A 48 20.528 -9.814 20.152 1.00 0.00 H new ATOM 0 HE3 MET A 48 19.927 -8.471 21.153 1.00 0.00 H new ATOM 820 N LYS A 49 20.234 -5.542 17.536 1.00 0.00 N ATOM 821 CA LYS A 49 20.802 -4.397 18.238 1.00 0.00 C ATOM 822 C LYS A 49 21.954 -3.792 17.444 1.00 0.00 C ATOM 823 O LYS A 49 22.961 -3.392 18.024 1.00 0.00 O ATOM 824 CB LYS A 49 21.302 -4.824 19.619 1.00 0.00 C ATOM 825 CG LYS A 49 20.109 -5.031 20.555 1.00 0.00 C ATOM 826 CD LYS A 49 20.597 -5.606 21.885 1.00 0.00 C ATOM 827 CE LYS A 49 21.458 -4.568 22.605 1.00 0.00 C ATOM 828 NZ LYS A 49 21.888 -5.107 23.926 1.00 0.00 N ATOM 0 H LYS A 49 20.883 -6.314 17.383 1.00 0.00 H new ATOM 0 HA LYS A 49 20.021 -3.645 18.350 1.00 0.00 H new ATOM 0 HB2 LYS A 49 21.879 -5.745 19.539 1.00 0.00 H new ATOM 0 HB3 LYS A 49 21.969 -4.064 20.026 1.00 0.00 H new ATOM 0 HG2 LYS A 49 19.596 -4.084 20.723 1.00 0.00 H new ATOM 0 HG3 LYS A 49 19.387 -5.708 20.097 1.00 0.00 H new ATOM 0 HD2 LYS A 49 19.746 -5.883 22.507 1.00 0.00 H new ATOM 0 HD3 LYS A 49 21.174 -6.514 21.711 1.00 0.00 H new ATOM 0 HE2 LYS A 49 22.330 -4.321 22.000 1.00 0.00 H new ATOM 0 HE3 LYS A 49 20.894 -3.645 22.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 22.474 -4.400 24.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.050 -5.321 24.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 22.441 -5.976 23.783 1.00 0.00 H new ATOM 842 N ASP A 50 21.791 -3.733 16.120 1.00 0.00 N ATOM 843 CA ASP A 50 22.819 -3.179 15.235 1.00 0.00 C ATOM 844 C ASP A 50 23.940 -2.529 16.038 1.00 0.00 C ATOM 845 O ASP A 50 24.018 -1.305 16.142 1.00 0.00 O ATOM 846 CB ASP A 50 22.195 -2.143 14.298 1.00 0.00 C ATOM 847 CG ASP A 50 21.664 -0.961 15.105 1.00 0.00 C ATOM 848 OD1 ASP A 50 21.815 -0.980 16.314 1.00 0.00 O ATOM 849 OD2 ASP A 50 21.113 -0.057 14.499 1.00 0.00 O ATOM 0 H ASP A 50 20.956 -4.063 15.636 1.00 0.00 H new ATOM 0 HA ASP A 50 23.241 -3.997 14.651 1.00 0.00 H new ATOM 0 HB2 ASP A 50 22.937 -1.798 13.578 1.00 0.00 H new ATOM 0 HB3 ASP A 50 21.385 -2.598 13.728 1.00 0.00 H new ATOM 854 N SER A 51 24.800 -3.364 16.612 1.00 0.00 N ATOM 855 CA SER A 51 25.911 -2.874 17.418 1.00 0.00 C ATOM 856 C SER A 51 27.048 -3.889 17.427 1.00 0.00 C ATOM 857 O SER A 51 26.824 -5.085 17.239 1.00 0.00 O ATOM 858 CB SER A 51 25.443 -2.616 18.850 1.00 0.00 C ATOM 859 OG SER A 51 26.537 -2.140 19.624 1.00 0.00 O ATOM 0 H SER A 51 24.749 -4.380 16.534 1.00 0.00 H new ATOM 0 HA SER A 51 26.272 -1.942 16.982 1.00 0.00 H new ATOM 0 HB2 SER A 51 24.634 -1.885 18.854 1.00 0.00 H new ATOM 0 HB3 SER A 51 25.046 -3.533 19.286 1.00 0.00 H new ATOM 0 HG SER A 51 27.093 -1.548 19.075 1.00 0.00 H new ATOM 865 N ALA A 52 28.267 -3.409 17.644 1.00 0.00 N ATOM 866 CA ALA A 52 29.423 -4.294 17.670 1.00 0.00 C ATOM 867 C ALA A 52 29.939 -4.460 19.094 1.00 0.00 C ATOM 868 O ALA A 52 30.139 -3.484 19.815 1.00 0.00 O ATOM 869 CB ALA A 52 30.537 -3.731 16.787 1.00 0.00 C ATOM 0 H ALA A 52 28.478 -2.424 17.803 1.00 0.00 H new ATOM 0 HA ALA A 52 29.116 -5.268 17.289 1.00 0.00 H new ATOM 0 HB1 ALA A 52 31.396 -4.401 16.814 1.00 0.00 H new ATOM 0 HB2 ALA A 52 30.178 -3.642 15.762 1.00 0.00 H new ATOM 0 HB3 ALA A 52 30.831 -2.748 17.155 1.00 0.00 H new ATOM 875 N TYR A 53 30.144 -5.711 19.489 1.00 0.00 N ATOM 876 CA TYR A 53 30.627 -6.021 20.824 1.00 0.00 C ATOM 877 C TYR A 53 32.077 -6.482 20.766 1.00 0.00 C ATOM 878 O TYR A 53 32.457 -7.255 19.889 1.00 0.00 O ATOM 879 CB TYR A 53 29.768 -7.131 21.426 1.00 0.00 C ATOM 880 CG TYR A 53 29.454 -6.796 22.858 1.00 0.00 C ATOM 881 CD1 TYR A 53 28.242 -6.177 23.174 1.00 0.00 C ATOM 882 CD2 TYR A 53 30.375 -7.097 23.865 1.00 0.00 C ATOM 883 CE1 TYR A 53 27.948 -5.858 24.503 1.00 0.00 C ATOM 884 CE2 TYR A 53 30.083 -6.780 25.194 1.00 0.00 C ATOM 885 CZ TYR A 53 28.868 -6.159 25.515 1.00 0.00 C ATOM 886 OH TYR A 53 28.578 -5.845 26.827 1.00 0.00 O ATOM 0 H TYR A 53 29.982 -6.528 18.900 1.00 0.00 H new ATOM 0 HA TYR A 53 30.564 -5.125 21.442 1.00 0.00 H new ATOM 0 HB2 TYR A 53 28.846 -7.242 20.856 1.00 0.00 H new ATOM 0 HB3 TYR A 53 30.294 -8.084 21.370 1.00 0.00 H new ATOM 0 HD1 TYR A 53 27.533 -5.945 22.393 1.00 0.00 H new ATOM 0 HD2 TYR A 53 31.311 -7.574 23.616 1.00 0.00 H new ATOM 0 HE1 TYR A 53 27.012 -5.380 24.749 1.00 0.00 H new ATOM 0 HE2 TYR A 53 30.793 -7.013 25.974 1.00 0.00 H new ATOM 0 HH TYR A 53 29.016 -6.489 27.422 1.00 0.00 H new ATOM 896 N LYS A 54 32.886 -6.005 21.703 1.00 0.00 N ATOM 897 CA LYS A 54 34.291 -6.385 21.733 1.00 0.00 C ATOM 898 C LYS A 54 34.674 -6.919 23.108 1.00 0.00 C ATOM 899 O LYS A 54 34.437 -6.267 24.125 1.00 0.00 O ATOM 900 CB LYS A 54 35.153 -5.171 21.398 1.00 0.00 C ATOM 901 CG LYS A 54 34.796 -4.666 19.999 1.00 0.00 C ATOM 902 CD LYS A 54 35.584 -3.392 19.704 1.00 0.00 C ATOM 903 CE LYS A 54 37.064 -3.738 19.558 1.00 0.00 C ATOM 904 NZ LYS A 54 37.832 -2.501 19.242 1.00 0.00 N ATOM 0 H LYS A 54 32.599 -5.363 22.442 1.00 0.00 H new ATOM 0 HA LYS A 54 34.457 -7.171 20.996 1.00 0.00 H new ATOM 0 HB2 LYS A 54 34.992 -4.383 22.133 1.00 0.00 H new ATOM 0 HB3 LYS A 54 36.209 -5.437 21.442 1.00 0.00 H new ATOM 0 HG2 LYS A 54 35.025 -5.429 19.255 1.00 0.00 H new ATOM 0 HG3 LYS A 54 33.726 -4.468 19.934 1.00 0.00 H new ATOM 0 HD2 LYS A 54 35.216 -2.926 18.790 1.00 0.00 H new ATOM 0 HD3 LYS A 54 35.445 -2.670 20.509 1.00 0.00 H new ATOM 0 HE2 LYS A 54 37.437 -4.186 20.479 1.00 0.00 H new ATOM 0 HE3 LYS A 54 37.200 -4.476 18.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 38.836 -2.648 19.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 37.736 -2.282 18.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 37.461 -1.709 19.804 1.00 0.00 H new ATOM 918 N ASP A 55 35.270 -8.106 23.132 1.00 0.00 N ATOM 919 CA ASP A 55 35.684 -8.711 24.391 1.00 0.00 C ATOM 920 C ASP A 55 37.204 -8.824 24.465 1.00 0.00 C ATOM 921 O ASP A 55 37.829 -9.467 23.621 1.00 0.00 O ATOM 922 CB ASP A 55 35.061 -10.102 24.528 1.00 0.00 C ATOM 923 CG ASP A 55 33.561 -9.977 24.772 1.00 0.00 C ATOM 924 OD1 ASP A 55 33.118 -8.882 25.075 1.00 0.00 O ATOM 925 OD2 ASP A 55 32.876 -10.980 24.650 1.00 0.00 O ATOM 0 H ASP A 55 35.475 -8.663 22.303 1.00 0.00 H new ATOM 0 HA ASP A 55 35.342 -8.074 25.206 1.00 0.00 H new ATOM 0 HB2 ASP A 55 35.244 -10.683 23.624 1.00 0.00 H new ATOM 0 HB3 ASP A 55 35.529 -10.640 25.353 1.00 0.00 H new ATOM 930 N PHE A 56 37.793 -8.209 25.485 1.00 0.00 N ATOM 931 CA PHE A 56 39.240 -8.263 25.662 1.00 0.00 C ATOM 932 C PHE A 56 39.593 -9.055 26.917 1.00 0.00 C ATOM 933 O PHE A 56 40.735 -9.477 27.100 1.00 0.00 O ATOM 934 CB PHE A 56 39.811 -6.848 25.764 1.00 0.00 C ATOM 935 CG PHE A 56 39.592 -6.123 24.457 1.00 0.00 C ATOM 936 CD1 PHE A 56 38.442 -5.347 24.267 1.00 0.00 C ATOM 937 CD2 PHE A 56 40.542 -6.228 23.435 1.00 0.00 C ATOM 938 CE1 PHE A 56 38.244 -4.676 23.054 1.00 0.00 C ATOM 939 CE2 PHE A 56 40.344 -5.558 22.221 1.00 0.00 C ATOM 940 CZ PHE A 56 39.195 -4.782 22.032 1.00 0.00 C ATOM 0 H PHE A 56 37.296 -7.672 26.196 1.00 0.00 H new ATOM 0 HA PHE A 56 39.676 -8.762 24.797 1.00 0.00 H new ATOM 0 HB2 PHE A 56 39.328 -6.307 26.578 1.00 0.00 H new ATOM 0 HB3 PHE A 56 40.875 -6.889 25.996 1.00 0.00 H new ATOM 0 HD1 PHE A 56 37.708 -5.266 25.055 1.00 0.00 H new ATOM 0 HD2 PHE A 56 41.429 -6.826 23.582 1.00 0.00 H new ATOM 0 HE1 PHE A 56 37.358 -4.077 22.907 1.00 0.00 H new ATOM 0 HE2 PHE A 56 41.077 -5.640 21.432 1.00 0.00 H new ATOM 0 HZ PHE A 56 39.042 -4.264 21.097 1.00 0.00 H new ATOM 950 N GLY A 57 38.599 -9.256 27.776 1.00 0.00 N ATOM 951 CA GLY A 57 38.801 -10.001 29.014 1.00 0.00 C ATOM 952 C GLY A 57 39.228 -9.069 30.142 1.00 0.00 C ATOM 953 O GLY A 57 39.241 -9.458 31.310 1.00 0.00 O ATOM 0 H GLY A 57 37.648 -8.914 27.638 1.00 0.00 H new ATOM 0 HA2 GLY A 57 37.880 -10.515 29.289 1.00 0.00 H new ATOM 0 HA3 GLY A 57 39.560 -10.768 28.863 1.00 0.00 H new ATOM 957 N LYS A 58 39.568 -7.836 29.784 1.00 0.00 N ATOM 958 CA LYS A 58 39.985 -6.850 30.774 1.00 0.00 C ATOM 959 C LYS A 58 38.989 -5.698 30.822 1.00 0.00 C ATOM 960 O LYS A 58 38.802 -5.064 31.861 1.00 0.00 O ATOM 961 CB LYS A 58 41.373 -6.313 30.418 1.00 0.00 C ATOM 962 CG LYS A 58 42.385 -7.460 30.438 1.00 0.00 C ATOM 963 CD LYS A 58 43.747 -6.950 29.961 1.00 0.00 C ATOM 964 CE LYS A 58 44.317 -5.976 30.995 1.00 0.00 C ATOM 965 NZ LYS A 58 45.668 -5.525 30.558 1.00 0.00 N ATOM 0 H LYS A 58 39.563 -7.497 28.822 1.00 0.00 H new ATOM 0 HA LYS A 58 40.021 -7.329 31.752 1.00 0.00 H new ATOM 0 HB2 LYS A 58 41.353 -5.849 29.432 1.00 0.00 H new ATOM 0 HB3 LYS A 58 41.669 -5.541 31.128 1.00 0.00 H new ATOM 0 HG2 LYS A 58 42.470 -7.866 31.446 1.00 0.00 H new ATOM 0 HG3 LYS A 58 42.043 -8.271 29.795 1.00 0.00 H new ATOM 0 HD2 LYS A 58 44.431 -7.787 29.818 1.00 0.00 H new ATOM 0 HD3 LYS A 58 43.644 -6.454 28.996 1.00 0.00 H new ATOM 0 HE2 LYS A 58 43.654 -5.118 31.107 1.00 0.00 H new ATOM 0 HE3 LYS A 58 44.381 -6.459 31.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 46.057 -4.863 31.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 46.298 -6.348 30.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 45.594 -5.049 29.637 1.00 0.00 H new ATOM 979 N TYR A 59 38.352 -5.437 29.685 1.00 0.00 N ATOM 980 CA TYR A 59 37.372 -4.361 29.591 1.00 0.00 C ATOM 981 C TYR A 59 36.381 -4.642 28.466 1.00 0.00 C ATOM 982 O TYR A 59 36.648 -5.454 27.579 1.00 0.00 O ATOM 983 CB TYR A 59 38.083 -3.032 29.333 1.00 0.00 C ATOM 984 CG TYR A 59 38.841 -3.111 28.028 1.00 0.00 C ATOM 985 CD1 TYR A 59 38.207 -2.769 26.828 1.00 0.00 C ATOM 986 CD2 TYR A 59 40.179 -3.524 28.021 1.00 0.00 C ATOM 987 CE1 TYR A 59 38.911 -2.843 25.619 1.00 0.00 C ATOM 988 CE2 TYR A 59 40.882 -3.597 26.812 1.00 0.00 C ATOM 989 CZ TYR A 59 40.248 -3.257 25.612 1.00 0.00 C ATOM 990 OH TYR A 59 40.941 -3.329 24.420 1.00 0.00 O ATOM 0 H TYR A 59 38.496 -5.954 28.818 1.00 0.00 H new ATOM 0 HA TYR A 59 36.827 -4.302 30.533 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.357 -2.220 29.295 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.768 -2.809 30.151 1.00 0.00 H new ATOM 0 HD1 TYR A 59 37.176 -2.448 26.834 1.00 0.00 H new ATOM 0 HD2 TYR A 59 40.668 -3.786 28.947 1.00 0.00 H new ATOM 0 HE1 TYR A 59 38.422 -2.581 24.692 1.00 0.00 H new ATOM 0 HE2 TYR A 59 41.914 -3.916 26.806 1.00 0.00 H new ATOM 0 HH TYR A 59 40.684 -4.144 23.941 1.00 0.00 H new ATOM 1000 N GLU A 60 35.235 -3.967 28.508 1.00 0.00 N ATOM 1001 CA GLU A 60 34.217 -4.159 27.482 1.00 0.00 C ATOM 1002 C GLU A 60 33.970 -2.864 26.713 1.00 0.00 C ATOM 1003 O GLU A 60 33.633 -1.833 27.297 1.00 0.00 O ATOM 1004 CB GLU A 60 32.910 -4.630 28.124 1.00 0.00 C ATOM 1005 CG GLU A 60 31.937 -5.078 27.030 1.00 0.00 C ATOM 1006 CD GLU A 60 31.245 -3.864 26.421 1.00 0.00 C ATOM 1007 OE1 GLU A 60 31.136 -2.862 27.107 1.00 0.00 O ATOM 1008 OE2 GLU A 60 30.836 -3.955 25.275 1.00 0.00 O ATOM 0 H GLU A 60 34.991 -3.291 29.232 1.00 0.00 H new ATOM 0 HA GLU A 60 34.575 -4.916 26.784 1.00 0.00 H new ATOM 0 HB2 GLU A 60 33.106 -5.453 28.811 1.00 0.00 H new ATOM 0 HB3 GLU A 60 32.469 -3.824 28.710 1.00 0.00 H new ATOM 0 HG2 GLU A 60 32.474 -5.627 26.257 1.00 0.00 H new ATOM 0 HG3 GLU A 60 31.195 -5.759 27.448 1.00 0.00 H new ATOM 1015 N ILE A 61 34.136 -2.929 25.398 1.00 0.00 N ATOM 1016 CA ILE A 61 33.926 -1.763 24.548 1.00 0.00 C ATOM 1017 C ILE A 61 33.056 -2.137 23.354 1.00 0.00 C ATOM 1018 O ILE A 61 33.227 -3.201 22.760 1.00 0.00 O ATOM 1019 CB ILE A 61 35.266 -1.218 24.053 1.00 0.00 C ATOM 1020 CG1 ILE A 61 35.952 -2.273 23.186 1.00 0.00 C ATOM 1021 CG2 ILE A 61 36.156 -0.883 25.249 1.00 0.00 C ATOM 1022 CD1 ILE A 61 37.186 -1.667 22.519 1.00 0.00 C ATOM 0 H ILE A 61 34.414 -3.773 24.898 1.00 0.00 H new ATOM 0 HA ILE A 61 33.424 -0.993 25.134 1.00 0.00 H new ATOM 0 HB ILE A 61 35.097 -0.316 23.465 1.00 0.00 H new ATOM 0 HG12 ILE A 61 36.240 -3.129 23.797 1.00 0.00 H new ATOM 0 HG13 ILE A 61 35.260 -2.641 22.428 1.00 0.00 H new ATOM 0 HG21 ILE A 61 37.111 -0.495 24.895 1.00 0.00 H new ATOM 0 HG22 ILE A 61 35.666 -0.132 25.868 1.00 0.00 H new ATOM 0 HG23 ILE A 61 36.327 -1.784 25.839 1.00 0.00 H new ATOM 0 HD11 ILE A 61 37.673 -2.421 21.901 1.00 0.00 H new ATOM 0 HD12 ILE A 61 36.886 -0.826 21.895 1.00 0.00 H new ATOM 0 HD13 ILE A 61 37.880 -1.321 23.285 1.00 0.00 H new ATOM 1034 N ARG A 62 32.122 -1.260 23.008 1.00 0.00 N ATOM 1035 CA ARG A 62 31.235 -1.519 21.882 1.00 0.00 C ATOM 1036 C ARG A 62 31.070 -0.263 21.038 1.00 0.00 C ATOM 1037 O ARG A 62 31.310 0.849 21.508 1.00 0.00 O ATOM 1038 CB ARG A 62 29.865 -1.975 22.388 1.00 0.00 C ATOM 1039 CG ARG A 62 29.164 -0.809 23.089 1.00 0.00 C ATOM 1040 CD ARG A 62 27.802 -1.274 23.610 1.00 0.00 C ATOM 1041 NE ARG A 62 27.977 -2.279 24.653 1.00 0.00 N ATOM 1042 CZ ARG A 62 26.940 -2.956 25.134 1.00 0.00 C ATOM 1043 NH1 ARG A 62 25.741 -2.735 24.668 1.00 0.00 N ATOM 1044 NH2 ARG A 62 27.119 -3.843 26.075 1.00 0.00 N ATOM 0 H ARG A 62 31.960 -0.373 23.485 1.00 0.00 H new ATOM 0 HA ARG A 62 31.676 -2.305 21.269 1.00 0.00 H new ATOM 0 HB2 ARG A 62 29.258 -2.330 21.555 1.00 0.00 H new ATOM 0 HB3 ARG A 62 29.980 -2.811 23.078 1.00 0.00 H new ATOM 0 HG2 ARG A 62 29.776 -0.445 23.914 1.00 0.00 H new ATOM 0 HG3 ARG A 62 29.036 0.023 22.396 1.00 0.00 H new ATOM 0 HD2 ARG A 62 27.246 -0.424 24.004 1.00 0.00 H new ATOM 0 HD3 ARG A 62 27.213 -1.688 22.791 1.00 0.00 H new ATOM 0 HE ARG A 62 28.911 -2.465 25.019 1.00 0.00 H new ATOM 0 HH11 ARG A 62 25.599 -2.042 23.933 1.00 0.00 H new ATOM 0 HH12 ARG A 62 24.946 -3.256 25.038 1.00 0.00 H new ATOM 0 HH21 ARG A 62 28.055 -4.016 26.441 1.00 0.00 H new ATOM 0 HH22 ARG A 62 26.323 -4.363 26.444 1.00 0.00 H new ATOM 1058 N LEU A 63 30.663 -0.449 19.789 1.00 0.00 N ATOM 1059 CA LEU A 63 30.474 0.677 18.888 1.00 0.00 C ATOM 1060 C LEU A 63 29.037 0.725 18.384 1.00 0.00 C ATOM 1061 O LEU A 63 28.430 -0.308 18.100 1.00 0.00 O ATOM 1062 CB LEU A 63 31.437 0.565 17.703 1.00 0.00 C ATOM 1063 CG LEU A 63 31.407 -0.858 17.148 1.00 0.00 C ATOM 1064 CD1 LEU A 63 31.062 -0.817 15.659 1.00 0.00 C ATOM 1065 CD2 LEU A 63 32.782 -1.503 17.334 1.00 0.00 C ATOM 0 H LEU A 63 30.459 -1.361 19.381 1.00 0.00 H new ATOM 0 HA LEU A 63 30.682 1.597 19.435 1.00 0.00 H new ATOM 0 HB2 LEU A 63 31.156 1.275 16.925 1.00 0.00 H new ATOM 0 HB3 LEU A 63 32.448 0.821 18.018 1.00 0.00 H new ATOM 0 HG LEU A 63 30.655 -1.441 17.679 1.00 0.00 H new ATOM 0 HD11 LEU A 63 31.040 -1.832 15.262 1.00 0.00 H new ATOM 0 HD12 LEU A 63 30.084 -0.354 15.525 1.00 0.00 H new ATOM 0 HD13 LEU A 63 31.815 -0.236 15.127 1.00 0.00 H new ATOM 0 HD21 LEU A 63 32.764 -2.519 16.939 1.00 0.00 H new ATOM 0 HD22 LEU A 63 33.533 -0.920 16.801 1.00 0.00 H new ATOM 0 HD23 LEU A 63 33.030 -1.531 18.395 1.00 0.00 H new ATOM 1077 N SER A 64 28.501 1.935 18.281 1.00 0.00 N ATOM 1078 CA SER A 64 27.135 2.124 17.817 1.00 0.00 C ATOM 1079 C SER A 64 27.106 3.120 16.665 1.00 0.00 C ATOM 1080 O SER A 64 28.096 3.800 16.396 1.00 0.00 O ATOM 1081 CB SER A 64 26.254 2.634 18.959 1.00 0.00 C ATOM 1082 OG SER A 64 26.280 1.694 20.026 1.00 0.00 O ATOM 0 H SER A 64 28.992 2.798 18.513 1.00 0.00 H new ATOM 0 HA SER A 64 26.750 1.165 17.471 1.00 0.00 H new ATOM 0 HB2 SER A 64 26.611 3.604 19.304 1.00 0.00 H new ATOM 0 HB3 SER A 64 25.232 2.777 18.609 1.00 0.00 H new ATOM 0 HG SER A 64 25.718 2.018 20.761 1.00 0.00 H new ATOM 1088 N ASN A 65 25.968 3.204 15.990 1.00 0.00 N ATOM 1089 CA ASN A 65 25.827 4.122 14.870 1.00 0.00 C ATOM 1090 C ASN A 65 26.182 5.536 15.308 1.00 0.00 C ATOM 1091 O ASN A 65 26.649 5.749 16.427 1.00 0.00 O ATOM 1092 CB ASN A 65 24.386 4.101 14.362 1.00 0.00 C ATOM 1093 CG ASN A 65 24.330 4.626 12.931 1.00 0.00 C ATOM 1094 OD1 ASN A 65 25.245 4.387 12.144 1.00 0.00 O ATOM 1095 ND2 ASN A 65 23.301 5.330 12.545 1.00 0.00 N ATOM 0 H ASN A 65 25.135 2.652 16.197 1.00 0.00 H new ATOM 0 HA ASN A 65 26.501 3.809 14.073 1.00 0.00 H new ATOM 0 HB2 ASN A 65 23.993 3.085 14.401 1.00 0.00 H new ATOM 0 HB3 ASN A 65 23.755 4.712 15.007 1.00 0.00 H new ATOM 0 HD21 ASN A 65 23.254 5.683 11.589 1.00 0.00 H new ATOM 0 HD22 ASN A 65 22.544 5.527 13.199 1.00 0.00 H new ATOM 1102 N HIS A 66 25.961 6.502 14.425 1.00 0.00 N ATOM 1103 CA HIS A 66 26.264 7.888 14.750 1.00 0.00 C ATOM 1104 C HIS A 66 25.434 8.324 15.948 1.00 0.00 C ATOM 1105 O HIS A 66 25.920 9.028 16.834 1.00 0.00 O ATOM 1106 CB HIS A 66 25.957 8.788 13.551 1.00 0.00 C ATOM 1107 CG HIS A 66 26.964 8.534 12.464 1.00 0.00 C ATOM 1108 ND1 HIS A 66 28.131 7.810 12.446 1.00 0.00 N flip ATOM 1109 CD2 HIS A 66 26.826 9.060 11.189 1.00 0.00 C flip ATOM 1110 CE1 HIS A 66 28.708 7.883 11.181 1.00 0.00 C flip ATOM 1111 NE2 HIS A 66 27.881 8.648 10.463 1.00 0.00 N flip ATOM 0 H HIS A 66 25.578 6.354 13.491 1.00 0.00 H new ATOM 0 HA HIS A 66 27.323 7.974 14.993 1.00 0.00 H new ATOM 0 HB2 HIS A 66 24.950 8.590 13.183 1.00 0.00 H new ATOM 0 HB3 HIS A 66 25.987 9.835 13.852 1.00 0.00 H new ATOM 0 HD2 HIS A 66 26.018 9.687 10.841 1.00 0.00 H new ATOM 0 HE1 HIS A 66 29.627 7.421 10.851 1.00 0.00 H new ATOM 0 HE2 HIS A 66 28.031 8.890 9.484 1.00 0.00 H new ATOM 1119 N SER A 67 24.181 7.886 15.975 1.00 0.00 N ATOM 1120 CA SER A 67 23.288 8.219 17.075 1.00 0.00 C ATOM 1121 C SER A 67 23.698 7.462 18.335 1.00 0.00 C ATOM 1122 O SER A 67 24.175 6.329 18.264 1.00 0.00 O ATOM 1123 CB SER A 67 21.847 7.863 16.708 1.00 0.00 C ATOM 1124 OG SER A 67 21.438 8.651 15.598 1.00 0.00 O ATOM 0 H SER A 67 23.763 7.302 15.251 1.00 0.00 H new ATOM 0 HA SER A 67 23.355 9.290 17.265 1.00 0.00 H new ATOM 0 HB2 SER A 67 21.773 6.803 16.464 1.00 0.00 H new ATOM 0 HB3 SER A 67 21.188 8.041 17.558 1.00 0.00 H new ATOM 0 HG SER A 67 20.515 8.425 15.358 1.00 0.00 H new ATOM 1286 N GLY A 78 30.110 -3.942 35.349 1.00 0.00 N ATOM 1287 CA GLY A 78 31.224 -3.772 36.275 1.00 0.00 C ATOM 1288 C GLY A 78 32.541 -3.679 35.514 1.00 0.00 C ATOM 1289 O GLY A 78 33.614 -3.879 36.081 1.00 0.00 O ATOM 0 HA2 GLY A 78 31.076 -2.870 36.869 1.00 0.00 H new ATOM 0 HA3 GLY A 78 31.258 -4.610 36.971 1.00 0.00 H new ATOM 1293 N ARG A 79 32.446 -3.376 34.224 1.00 0.00 N ATOM 1294 CA ARG A 79 33.630 -3.263 33.384 1.00 0.00 C ATOM 1295 C ARG A 79 33.615 -1.947 32.616 1.00 0.00 C ATOM 1296 O ARG A 79 32.556 -1.361 32.391 1.00 0.00 O ATOM 1297 CB ARG A 79 33.687 -4.429 32.396 1.00 0.00 C ATOM 1298 CG ARG A 79 33.811 -5.745 33.165 1.00 0.00 C ATOM 1299 CD ARG A 79 33.778 -6.915 32.181 1.00 0.00 C ATOM 1300 NE ARG A 79 34.956 -6.884 31.321 1.00 0.00 N ATOM 1301 CZ ARG A 79 35.077 -7.717 30.293 1.00 0.00 C ATOM 1302 NH1 ARG A 79 34.133 -8.581 30.039 1.00 0.00 N ATOM 1303 NH2 ARG A 79 36.140 -7.670 29.538 1.00 0.00 N ATOM 0 H ARG A 79 31.565 -3.205 33.740 1.00 0.00 H new ATOM 0 HA ARG A 79 34.510 -3.289 34.026 1.00 0.00 H new ATOM 0 HB2 ARG A 79 32.789 -4.440 31.778 1.00 0.00 H new ATOM 0 HB3 ARG A 79 34.536 -4.308 31.723 1.00 0.00 H new ATOM 0 HG2 ARG A 79 34.741 -5.760 33.734 1.00 0.00 H new ATOM 0 HG3 ARG A 79 32.996 -5.837 33.883 1.00 0.00 H new ATOM 0 HD2 ARG A 79 33.742 -7.858 32.727 1.00 0.00 H new ATOM 0 HD3 ARG A 79 32.874 -6.864 31.574 1.00 0.00 H new ATOM 0 HE ARG A 79 35.699 -6.212 31.512 1.00 0.00 H new ATOM 0 HH11 ARG A 79 33.302 -8.617 30.630 1.00 0.00 H new ATOM 0 HH12 ARG A 79 34.226 -9.221 29.250 1.00 0.00 H new ATOM 0 HH21 ARG A 79 36.877 -6.994 29.737 1.00 0.00 H new ATOM 0 HH22 ARG A 79 36.234 -8.309 28.749 1.00 0.00 H new ATOM 1317 N LEU A 80 34.794 -1.487 32.220 1.00 0.00 N ATOM 1318 CA LEU A 80 34.904 -0.238 31.479 1.00 0.00 C ATOM 1319 C LEU A 80 34.044 -0.294 30.223 1.00 0.00 C ATOM 1320 O LEU A 80 34.029 -1.299 29.513 1.00 0.00 O ATOM 1321 CB LEU A 80 36.360 0.010 31.084 1.00 0.00 C ATOM 1322 CG LEU A 80 36.563 1.497 30.785 1.00 0.00 C ATOM 1323 CD1 LEU A 80 38.028 1.750 30.442 1.00 0.00 C ATOM 1324 CD2 LEU A 80 35.686 1.908 29.600 1.00 0.00 C ATOM 0 H LEU A 80 35.682 -1.956 32.398 1.00 0.00 H new ATOM 0 HA LEU A 80 34.557 0.575 32.117 1.00 0.00 H new ATOM 0 HB2 LEU A 80 37.025 -0.304 31.889 1.00 0.00 H new ATOM 0 HB3 LEU A 80 36.617 -0.586 30.208 1.00 0.00 H new ATOM 0 HG LEU A 80 36.286 2.083 31.661 1.00 0.00 H new ATOM 0 HD11 LEU A 80 38.174 2.809 30.229 1.00 0.00 H new ATOM 0 HD12 LEU A 80 38.655 1.460 31.285 1.00 0.00 H new ATOM 0 HD13 LEU A 80 38.303 1.162 29.566 1.00 0.00 H new ATOM 0 HD21 LEU A 80 35.832 2.967 29.389 1.00 0.00 H new ATOM 0 HD22 LEU A 80 35.961 1.322 28.723 1.00 0.00 H new ATOM 0 HD23 LEU A 80 34.639 1.728 29.843 1.00 0.00 H new ATOM 1336 N ILE A 81 33.327 0.792 29.955 1.00 0.00 N ATOM 1337 CA ILE A 81 32.469 0.850 28.782 1.00 0.00 C ATOM 1338 C ILE A 81 32.940 1.943 27.831 1.00 0.00 C ATOM 1339 O ILE A 81 33.135 3.094 28.232 1.00 0.00 O ATOM 1340 CB ILE A 81 31.026 1.129 29.206 1.00 0.00 C ATOM 1341 CG1 ILE A 81 30.089 0.855 28.029 1.00 0.00 C ATOM 1342 CG2 ILE A 81 30.893 2.592 29.631 1.00 0.00 C ATOM 1343 CD1 ILE A 81 30.121 -0.637 27.691 1.00 0.00 C ATOM 0 H ILE A 81 33.324 1.635 30.529 1.00 0.00 H new ATOM 0 HA ILE A 81 32.518 -0.110 28.269 1.00 0.00 H new ATOM 0 HB ILE A 81 30.761 0.482 30.042 1.00 0.00 H new ATOM 0 HG12 ILE A 81 29.073 1.161 28.280 1.00 0.00 H new ATOM 0 HG13 ILE A 81 30.394 1.442 27.163 1.00 0.00 H new ATOM 0 HG21 ILE A 81 29.865 2.791 29.933 1.00 0.00 H new ATOM 0 HG22 ILE A 81 31.562 2.790 30.468 1.00 0.00 H new ATOM 0 HG23 ILE A 81 31.157 3.239 28.795 1.00 0.00 H new ATOM 0 HD11 ILE A 81 29.454 -0.834 26.852 1.00 0.00 H new ATOM 0 HD12 ILE A 81 31.137 -0.928 27.423 1.00 0.00 H new ATOM 0 HD13 ILE A 81 29.795 -1.213 28.557 1.00 0.00 H new ATOM 1355 N VAL A 82 33.127 1.577 26.568 1.00 0.00 N ATOM 1356 CA VAL A 82 33.578 2.539 25.571 1.00 0.00 C ATOM 1357 C VAL A 82 32.629 2.547 24.376 1.00 0.00 C ATOM 1358 O VAL A 82 32.380 1.507 23.764 1.00 0.00 O ATOM 1359 CB VAL A 82 34.989 2.177 25.106 1.00 0.00 C ATOM 1360 CG1 VAL A 82 35.483 3.218 24.100 1.00 0.00 C ATOM 1361 CG2 VAL A 82 35.925 2.132 26.315 1.00 0.00 C ATOM 0 H VAL A 82 32.975 0.633 26.214 1.00 0.00 H new ATOM 0 HA VAL A 82 33.588 3.532 26.020 1.00 0.00 H new ATOM 0 HB VAL A 82 34.976 1.199 24.625 1.00 0.00 H new ATOM 0 HG11 VAL A 82 36.489 2.957 23.771 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.814 3.239 23.240 1.00 0.00 H new ATOM 0 HG13 VAL A 82 35.499 4.201 24.571 1.00 0.00 H new ATOM 0 HG21 VAL A 82 36.932 1.874 25.986 1.00 0.00 H new ATOM 0 HG22 VAL A 82 35.940 3.108 26.800 1.00 0.00 H new ATOM 0 HG23 VAL A 82 35.571 1.382 27.022 1.00 0.00 H new ATOM 1371 N ASN A 83 32.105 3.721 24.048 1.00 0.00 N ATOM 1372 CA ASN A 83 31.187 3.849 22.922 1.00 0.00 C ATOM 1373 C ASN A 83 31.913 4.399 21.700 1.00 0.00 C ATOM 1374 O ASN A 83 32.328 5.556 21.685 1.00 0.00 O ATOM 1375 CB ASN A 83 30.028 4.775 23.290 1.00 0.00 C ATOM 1376 CG ASN A 83 29.033 4.846 22.137 1.00 0.00 C ATOM 1377 OD1 ASN A 83 28.770 5.999 21.583 1.00 0.00 O flip ATOM 1378 ND2 ASN A 83 28.479 3.825 21.730 1.00 0.00 N flip ATOM 0 H ASN A 83 32.298 4.593 24.541 1.00 0.00 H new ATOM 0 HA ASN A 83 30.796 2.860 22.684 1.00 0.00 H new ATOM 0 HB2 ASN A 83 29.531 4.410 24.189 1.00 0.00 H new ATOM 0 HB3 ASN A 83 30.406 5.772 23.517 1.00 0.00 H new ATOM 0 HD21 ASN A 83 28.686 2.925 22.164 1.00 0.00 H new ATOM 0 HD22 ASN A 83 27.813 3.879 20.959 1.00 0.00 H new ATOM 1385 N ILE A 84 32.067 3.565 20.680 1.00 0.00 N ATOM 1386 CA ILE A 84 32.749 3.987 19.463 1.00 0.00 C ATOM 1387 C ILE A 84 31.769 4.036 18.297 1.00 0.00 C ATOM 1388 O ILE A 84 31.128 3.038 17.973 1.00 0.00 O ATOM 1389 CB ILE A 84 33.881 3.011 19.138 1.00 0.00 C ATOM 1390 CG1 ILE A 84 34.871 2.972 20.305 1.00 0.00 C ATOM 1391 CG2 ILE A 84 34.606 3.474 17.873 1.00 0.00 C ATOM 1392 CD1 ILE A 84 35.866 1.830 20.092 1.00 0.00 C ATOM 0 H ILE A 84 31.733 2.601 20.670 1.00 0.00 H new ATOM 0 HA ILE A 84 33.162 4.983 19.622 1.00 0.00 H new ATOM 0 HB ILE A 84 33.467 2.016 18.977 1.00 0.00 H new ATOM 0 HG12 ILE A 84 35.401 3.922 20.378 1.00 0.00 H new ATOM 0 HG13 ILE A 84 34.337 2.832 21.245 1.00 0.00 H new ATOM 0 HG21 ILE A 84 35.413 2.779 17.641 1.00 0.00 H new ATOM 0 HG22 ILE A 84 33.903 3.504 17.041 1.00 0.00 H new ATOM 0 HG23 ILE A 84 35.020 4.469 18.035 1.00 0.00 H new ATOM 0 HD11 ILE A 84 36.571 1.802 20.923 1.00 0.00 H new ATOM 0 HD12 ILE A 84 35.328 0.883 20.041 1.00 0.00 H new ATOM 0 HD13 ILE A 84 36.409 1.990 19.161 1.00 0.00 H new ATOM 1404 N LYS A 85 31.658 5.199 17.668 1.00 0.00 N ATOM 1405 CA LYS A 85 30.750 5.351 16.539 1.00 0.00 C ATOM 1406 C LYS A 85 31.359 4.727 15.290 1.00 0.00 C ATOM 1407 O LYS A 85 32.547 4.899 15.014 1.00 0.00 O ATOM 1408 CB LYS A 85 30.463 6.834 16.290 1.00 0.00 C ATOM 1409 CG LYS A 85 29.684 7.407 17.475 1.00 0.00 C ATOM 1410 CD LYS A 85 29.391 8.887 17.227 1.00 0.00 C ATOM 1411 CE LYS A 85 28.571 9.448 18.391 1.00 0.00 C ATOM 1412 NZ LYS A 85 29.366 9.358 19.648 1.00 0.00 N ATOM 0 H LYS A 85 32.178 6.041 17.916 1.00 0.00 H new ATOM 0 HA LYS A 85 29.815 4.842 16.771 1.00 0.00 H new ATOM 0 HB2 LYS A 85 31.397 7.379 16.157 1.00 0.00 H new ATOM 0 HB3 LYS A 85 29.890 6.955 15.371 1.00 0.00 H new ATOM 0 HG2 LYS A 85 28.752 6.859 17.610 1.00 0.00 H new ATOM 0 HG3 LYS A 85 30.259 7.288 18.393 1.00 0.00 H new ATOM 0 HD2 LYS A 85 30.324 9.441 17.125 1.00 0.00 H new ATOM 0 HD3 LYS A 85 28.845 9.009 16.292 1.00 0.00 H new ATOM 0 HE2 LYS A 85 28.301 10.485 18.193 1.00 0.00 H new ATOM 0 HE3 LYS A 85 27.640 8.890 18.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 28.970 10.008 20.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 29.330 8.385 20.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 30.354 9.619 19.453 1.00 0.00 H new ATOM 1426 N ALA A 86 30.542 3.994 14.546 1.00 0.00 N ATOM 1427 CA ALA A 86 31.013 3.339 13.332 1.00 0.00 C ATOM 1428 C ALA A 86 29.866 3.111 12.354 1.00 0.00 C ATOM 1429 O ALA A 86 28.697 3.110 12.739 1.00 0.00 O ATOM 1430 CB ALA A 86 31.655 1.996 13.682 1.00 0.00 C ATOM 0 H ALA A 86 29.557 3.838 14.759 1.00 0.00 H new ATOM 0 HA ALA A 86 31.750 3.989 12.860 1.00 0.00 H new ATOM 0 HB1 ALA A 86 32.005 1.511 12.770 1.00 0.00 H new ATOM 0 HB2 ALA A 86 32.498 2.160 14.353 1.00 0.00 H new ATOM 0 HB3 ALA A 86 30.920 1.358 14.173 1.00 0.00 H new ATOM 1436 N SER A 87 30.216 2.913 11.088 1.00 0.00 N ATOM 1437 CA SER A 87 29.218 2.675 10.054 1.00 0.00 C ATOM 1438 C SER A 87 29.442 1.309 9.416 1.00 0.00 C ATOM 1439 O SER A 87 30.581 0.888 9.218 1.00 0.00 O ATOM 1440 CB SER A 87 29.302 3.764 8.983 1.00 0.00 C ATOM 1441 OG SER A 87 28.374 3.475 7.945 1.00 0.00 O ATOM 0 H SER A 87 31.180 2.913 10.755 1.00 0.00 H new ATOM 0 HA SER A 87 28.228 2.698 10.510 1.00 0.00 H new ATOM 0 HB2 SER A 87 29.084 4.738 9.421 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.313 3.815 8.579 1.00 0.00 H new ATOM 0 HG SER A 87 28.424 4.172 7.258 1.00 0.00 H new ATOM 1447 N LYS A 88 28.353 0.616 9.101 1.00 0.00 N ATOM 1448 CA LYS A 88 28.458 -0.705 8.493 1.00 0.00 C ATOM 1449 C LYS A 88 29.267 -0.632 7.204 1.00 0.00 C ATOM 1450 O LYS A 88 29.925 -1.598 6.816 1.00 0.00 O ATOM 1451 CB LYS A 88 27.061 -1.255 8.196 1.00 0.00 C ATOM 1452 CG LYS A 88 26.403 -0.411 7.103 1.00 0.00 C ATOM 1453 CD LYS A 88 25.006 -0.961 6.806 1.00 0.00 C ATOM 1454 CE LYS A 88 24.124 -0.820 8.049 1.00 0.00 C ATOM 1455 NZ LYS A 88 23.922 0.626 8.352 1.00 0.00 N ATOM 0 H LYS A 88 27.399 0.942 9.254 1.00 0.00 H new ATOM 0 HA LYS A 88 28.966 -1.371 9.191 1.00 0.00 H new ATOM 0 HB2 LYS A 88 27.128 -2.295 7.876 1.00 0.00 H new ATOM 0 HB3 LYS A 88 26.452 -1.238 9.100 1.00 0.00 H new ATOM 0 HG2 LYS A 88 26.336 0.629 7.423 1.00 0.00 H new ATOM 0 HG3 LYS A 88 27.012 -0.428 6.199 1.00 0.00 H new ATOM 0 HD2 LYS A 88 24.562 -0.421 5.969 1.00 0.00 H new ATOM 0 HD3 LYS A 88 25.072 -2.008 6.511 1.00 0.00 H new ATOM 0 HE2 LYS A 88 23.162 -1.306 7.883 1.00 0.00 H new ATOM 0 HE3 LYS A 88 24.591 -1.319 8.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 23.093 0.739 8.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 24.765 1.001 8.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 23.767 1.148 7.466 1.00 0.00 H new ATOM 1469 N LEU A 89 29.227 0.525 6.552 1.00 0.00 N ATOM 1470 CA LEU A 89 29.974 0.719 5.316 1.00 0.00 C ATOM 1471 C LEU A 89 31.473 0.627 5.586 1.00 0.00 C ATOM 1472 O LEU A 89 32.227 0.063 4.793 1.00 0.00 O ATOM 1473 CB LEU A 89 29.645 2.089 4.719 1.00 0.00 C ATOM 1474 CG LEU A 89 28.206 2.095 4.203 1.00 0.00 C ATOM 1475 CD1 LEU A 89 27.801 3.523 3.836 1.00 0.00 C ATOM 1476 CD2 LEU A 89 28.105 1.207 2.960 1.00 0.00 C ATOM 0 H LEU A 89 28.689 1.337 6.856 1.00 0.00 H new ATOM 0 HA LEU A 89 29.691 -0.062 4.610 1.00 0.00 H new ATOM 0 HB2 LEU A 89 29.774 2.865 5.473 1.00 0.00 H new ATOM 0 HB3 LEU A 89 30.334 2.317 3.906 1.00 0.00 H new ATOM 0 HG LEU A 89 27.542 1.715 4.980 1.00 0.00 H new ATOM 0 HD11 LEU A 89 26.775 3.527 3.468 1.00 0.00 H new ATOM 0 HD12 LEU A 89 27.873 4.160 4.718 1.00 0.00 H new ATOM 0 HD13 LEU A 89 28.466 3.902 3.060 1.00 0.00 H new ATOM 0 HD21 LEU A 89 27.079 1.211 2.592 1.00 0.00 H new ATOM 0 HD22 LEU A 89 28.770 1.589 2.185 1.00 0.00 H new ATOM 0 HD23 LEU A 89 28.394 0.188 3.216 1.00 0.00 H new ATOM 1488 N ASN A 90 31.892 1.193 6.713 1.00 0.00 N ATOM 1489 CA ASN A 90 33.300 1.185 7.094 1.00 0.00 C ATOM 1490 C ASN A 90 33.494 0.474 8.430 1.00 0.00 C ATOM 1491 O ASN A 90 34.402 0.804 9.192 1.00 0.00 O ATOM 1492 CB ASN A 90 33.819 2.620 7.198 1.00 0.00 C ATOM 1493 CG ASN A 90 33.070 3.367 8.296 1.00 0.00 C ATOM 1494 OD1 ASN A 90 32.452 2.745 9.160 1.00 0.00 O ATOM 1495 ND2 ASN A 90 33.087 4.672 8.312 1.00 0.00 N ATOM 0 H ASN A 90 31.277 1.663 7.378 1.00 0.00 H new ATOM 0 HA ASN A 90 33.860 0.649 6.328 1.00 0.00 H new ATOM 0 HB2 ASN A 90 34.887 2.614 7.414 1.00 0.00 H new ATOM 0 HB3 ASN A 90 33.689 3.132 6.245 1.00 0.00 H new ATOM 0 HD21 ASN A 90 32.587 5.180 9.042 1.00 0.00 H new ATOM 0 HD22 ASN A 90 33.600 5.184 7.595 1.00 0.00 H new ATOM 1502 N PHE A 91 32.630 -0.495 8.716 1.00 0.00 N ATOM 1503 CA PHE A 91 32.716 -1.232 9.974 1.00 0.00 C ATOM 1504 C PHE A 91 34.076 -1.913 10.111 1.00 0.00 C ATOM 1505 O PHE A 91 34.739 -1.789 11.139 1.00 0.00 O ATOM 1506 CB PHE A 91 31.608 -2.287 10.025 1.00 0.00 C ATOM 1507 CG PHE A 91 31.771 -3.140 11.260 1.00 0.00 C ATOM 1508 CD1 PHE A 91 31.333 -2.667 12.503 1.00 0.00 C ATOM 1509 CD2 PHE A 91 32.357 -4.407 11.159 1.00 0.00 C ATOM 1510 CE1 PHE A 91 31.481 -3.463 13.645 1.00 0.00 C ATOM 1511 CE2 PHE A 91 32.504 -5.203 12.302 1.00 0.00 C ATOM 1512 CZ PHE A 91 32.066 -4.731 13.545 1.00 0.00 C ATOM 0 H PHE A 91 31.870 -0.787 8.102 1.00 0.00 H new ATOM 0 HA PHE A 91 32.596 -0.528 10.798 1.00 0.00 H new ATOM 0 HB2 PHE A 91 30.632 -1.802 10.033 1.00 0.00 H new ATOM 0 HB3 PHE A 91 31.647 -2.912 9.133 1.00 0.00 H new ATOM 0 HD1 PHE A 91 30.881 -1.689 12.581 1.00 0.00 H new ATOM 0 HD2 PHE A 91 32.696 -4.771 10.200 1.00 0.00 H new ATOM 0 HE1 PHE A 91 31.144 -3.099 14.604 1.00 0.00 H new ATOM 0 HE2 PHE A 91 32.955 -6.181 12.224 1.00 0.00 H new ATOM 0 HZ PHE A 91 32.179 -5.345 14.426 1.00 0.00 H new ATOM 1522 N VAL A 92 34.490 -2.627 9.072 1.00 0.00 N ATOM 1523 CA VAL A 92 35.779 -3.313 9.094 1.00 0.00 C ATOM 1524 C VAL A 92 36.928 -2.305 9.148 1.00 0.00 C ATOM 1525 O VAL A 92 37.903 -2.494 9.875 1.00 0.00 O ATOM 1526 CB VAL A 92 35.925 -4.191 7.850 1.00 0.00 C ATOM 1527 CG1 VAL A 92 37.354 -4.733 7.773 1.00 0.00 C ATOM 1528 CG2 VAL A 92 34.942 -5.359 7.937 1.00 0.00 C ATOM 0 H VAL A 92 33.959 -2.747 8.210 1.00 0.00 H new ATOM 0 HA VAL A 92 35.819 -3.937 9.987 1.00 0.00 H new ATOM 0 HB VAL A 92 35.713 -3.600 6.959 1.00 0.00 H new ATOM 0 HG11 VAL A 92 37.459 -5.359 6.887 1.00 0.00 H new ATOM 0 HG12 VAL A 92 38.056 -3.901 7.715 1.00 0.00 H new ATOM 0 HG13 VAL A 92 37.567 -5.326 8.663 1.00 0.00 H new ATOM 0 HG21 VAL A 92 35.044 -5.987 7.052 1.00 0.00 H new ATOM 0 HG22 VAL A 92 35.157 -5.950 8.827 1.00 0.00 H new ATOM 0 HG23 VAL A 92 33.924 -4.974 7.994 1.00 0.00 H new ATOM 1538 N ASP A 93 36.811 -1.249 8.352 1.00 0.00 N ATOM 1539 CA ASP A 93 37.846 -0.220 8.291 1.00 0.00 C ATOM 1540 C ASP A 93 38.023 0.502 9.628 1.00 0.00 C ATOM 1541 O ASP A 93 39.148 0.784 10.040 1.00 0.00 O ATOM 1542 CB ASP A 93 37.493 0.800 7.209 1.00 0.00 C ATOM 1543 CG ASP A 93 38.618 1.819 7.065 1.00 0.00 C ATOM 1544 OD1 ASP A 93 39.521 1.795 7.886 1.00 0.00 O ATOM 1545 OD2 ASP A 93 38.561 2.609 6.138 1.00 0.00 O ATOM 0 H ASP A 93 36.012 -1.081 7.740 1.00 0.00 H new ATOM 0 HA ASP A 93 38.787 -0.717 8.054 1.00 0.00 H new ATOM 0 HB2 ASP A 93 37.328 0.292 6.259 1.00 0.00 H new ATOM 0 HB3 ASP A 93 36.563 1.307 7.465 1.00 0.00 H new ATOM 1550 N ILE A 94 36.914 0.830 10.285 1.00 0.00 N ATOM 1551 CA ILE A 94 36.981 1.555 11.553 1.00 0.00 C ATOM 1552 C ILE A 94 37.705 0.744 12.622 1.00 0.00 C ATOM 1553 O ILE A 94 38.448 1.298 13.428 1.00 0.00 O ATOM 1554 CB ILE A 94 35.575 1.873 12.058 1.00 0.00 C ATOM 1555 CG1 ILE A 94 35.634 3.096 12.976 1.00 0.00 C ATOM 1556 CG2 ILE A 94 35.055 0.678 12.862 1.00 0.00 C ATOM 1557 CD1 ILE A 94 34.223 3.648 13.185 1.00 0.00 C ATOM 0 H ILE A 94 35.970 0.610 9.967 1.00 0.00 H new ATOM 0 HA ILE A 94 37.533 2.476 11.368 1.00 0.00 H new ATOM 0 HB ILE A 94 34.916 2.074 11.213 1.00 0.00 H new ATOM 0 HG12 ILE A 94 36.074 2.823 13.935 1.00 0.00 H new ATOM 0 HG13 ILE A 94 36.274 3.862 12.538 1.00 0.00 H new ATOM 0 HG21 ILE A 94 34.051 0.894 13.228 1.00 0.00 H new ATOM 0 HG22 ILE A 94 35.026 -0.205 12.224 1.00 0.00 H new ATOM 0 HG23 ILE A 94 35.717 0.493 13.708 1.00 0.00 H new ATOM 0 HD11 ILE A 94 34.266 4.519 13.839 1.00 0.00 H new ATOM 0 HD12 ILE A 94 33.799 3.937 12.223 1.00 0.00 H new ATOM 0 HD13 ILE A 94 33.597 2.882 13.642 1.00 0.00 H new ATOM 1569 N ILE A 95 37.480 -0.565 12.636 1.00 0.00 N ATOM 1570 CA ILE A 95 38.122 -1.414 13.632 1.00 0.00 C ATOM 1571 C ILE A 95 39.596 -1.604 13.302 1.00 0.00 C ATOM 1572 O ILE A 95 40.403 -1.872 14.184 1.00 0.00 O ATOM 1573 CB ILE A 95 37.429 -2.777 13.707 1.00 0.00 C ATOM 1574 CG1 ILE A 95 37.612 -3.517 12.385 1.00 0.00 C ATOM 1575 CG2 ILE A 95 35.936 -2.576 13.973 1.00 0.00 C ATOM 1576 CD1 ILE A 95 37.119 -4.959 12.532 1.00 0.00 C ATOM 0 H ILE A 95 36.869 -1.054 11.982 1.00 0.00 H new ATOM 0 HA ILE A 95 38.036 -0.921 14.601 1.00 0.00 H new ATOM 0 HB ILE A 95 37.869 -3.362 14.515 1.00 0.00 H new ATOM 0 HG12 ILE A 95 37.058 -3.011 11.594 1.00 0.00 H new ATOM 0 HG13 ILE A 95 38.662 -3.509 12.094 1.00 0.00 H new ATOM 0 HG21 ILE A 95 35.442 -3.546 14.026 1.00 0.00 H new ATOM 0 HG22 ILE A 95 35.802 -2.048 14.917 1.00 0.00 H new ATOM 0 HG23 ILE A 95 35.498 -1.990 13.165 1.00 0.00 H new ATOM 0 HD11 ILE A 95 37.250 -5.486 11.587 1.00 0.00 H new ATOM 0 HD12 ILE A 95 37.692 -5.462 13.311 1.00 0.00 H new ATOM 0 HD13 ILE A 95 36.063 -4.957 12.803 1.00 0.00 H new ATOM 1588 N GLU A 96 39.947 -1.466 12.031 1.00 0.00 N ATOM 1589 CA GLU A 96 41.337 -1.629 11.626 1.00 0.00 C ATOM 1590 C GLU A 96 42.222 -0.589 12.311 1.00 0.00 C ATOM 1591 O GLU A 96 43.285 -0.915 12.841 1.00 0.00 O ATOM 1592 CB GLU A 96 41.461 -1.488 10.108 1.00 0.00 C ATOM 1593 CG GLU A 96 42.918 -1.695 9.693 1.00 0.00 C ATOM 1594 CD GLU A 96 43.047 -1.599 8.177 1.00 0.00 C ATOM 1595 OE1 GLU A 96 42.034 -1.388 7.529 1.00 0.00 O ATOM 1596 OE2 GLU A 96 44.154 -1.737 7.686 1.00 0.00 O ATOM 0 H GLU A 96 39.301 -1.245 11.273 1.00 0.00 H new ATOM 0 HA GLU A 96 41.667 -2.624 11.925 1.00 0.00 H new ATOM 0 HB2 GLU A 96 40.823 -2.219 9.611 1.00 0.00 H new ATOM 0 HB3 GLU A 96 41.119 -0.501 9.795 1.00 0.00 H new ATOM 0 HG2 GLU A 96 43.550 -0.945 10.168 1.00 0.00 H new ATOM 0 HG3 GLU A 96 43.267 -2.669 10.035 1.00 0.00 H new ATOM 1603 N ASN A 97 41.776 0.665 12.299 1.00 0.00 N ATOM 1604 CA ASN A 97 42.541 1.739 12.921 1.00 0.00 C ATOM 1605 C ASN A 97 42.154 1.912 14.386 1.00 0.00 C ATOM 1606 O ASN A 97 43.003 2.198 15.228 1.00 0.00 O ATOM 1607 CB ASN A 97 42.302 3.051 12.173 1.00 0.00 C ATOM 1608 CG ASN A 97 42.966 2.997 10.802 1.00 0.00 C ATOM 1609 OD1 ASN A 97 43.871 2.192 10.580 1.00 0.00 O ATOM 1610 ND2 ASN A 97 42.570 3.813 9.864 1.00 0.00 N ATOM 0 H ASN A 97 40.898 0.959 11.870 1.00 0.00 H new ATOM 0 HA ASN A 97 43.597 1.474 12.870 1.00 0.00 H new ATOM 0 HB2 ASN A 97 41.232 3.226 12.061 1.00 0.00 H new ATOM 0 HB3 ASN A 97 42.703 3.886 12.748 1.00 0.00 H new ATOM 0 HD21 ASN A 97 43.010 3.785 8.944 1.00 0.00 H new ATOM 0 HD22 ASN A 97 41.820 4.479 10.050 1.00 0.00 H new ATOM 1617 N LYS A 98 40.872 1.735 14.687 1.00 0.00 N ATOM 1618 CA LYS A 98 40.400 1.877 16.058 1.00 0.00 C ATOM 1619 C LYS A 98 41.003 0.792 16.932 1.00 0.00 C ATOM 1620 O LYS A 98 41.397 1.044 18.070 1.00 0.00 O ATOM 1621 CB LYS A 98 38.875 1.789 16.107 1.00 0.00 C ATOM 1622 CG LYS A 98 38.269 3.007 15.408 1.00 0.00 C ATOM 1623 CD LYS A 98 38.620 4.275 16.189 1.00 0.00 C ATOM 1624 CE LYS A 98 37.969 5.485 15.515 1.00 0.00 C ATOM 1625 NZ LYS A 98 38.315 6.721 16.272 1.00 0.00 N ATOM 0 H LYS A 98 40.149 1.496 14.008 1.00 0.00 H new ATOM 0 HA LYS A 98 40.710 2.853 16.432 1.00 0.00 H new ATOM 0 HB2 LYS A 98 38.538 0.873 15.622 1.00 0.00 H new ATOM 0 HB3 LYS A 98 38.536 1.745 17.142 1.00 0.00 H new ATOM 0 HG2 LYS A 98 38.648 3.079 14.388 1.00 0.00 H new ATOM 0 HG3 LYS A 98 37.187 2.898 15.339 1.00 0.00 H new ATOM 0 HD2 LYS A 98 38.273 4.189 17.219 1.00 0.00 H new ATOM 0 HD3 LYS A 98 39.702 4.404 16.227 1.00 0.00 H new ATOM 0 HE2 LYS A 98 38.313 5.569 14.484 1.00 0.00 H new ATOM 0 HE3 LYS A 98 36.887 5.357 15.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 37.478 7.335 16.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 38.630 6.465 17.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 39.079 7.227 15.780 1.00 0.00 H new ATOM 1639 N LEU A 99 41.085 -0.414 16.385 1.00 0.00 N ATOM 1640 CA LEU A 99 41.656 -1.531 17.118 1.00 0.00 C ATOM 1641 C LEU A 99 43.124 -1.254 17.422 1.00 0.00 C ATOM 1642 O LEU A 99 43.609 -1.539 18.516 1.00 0.00 O ATOM 1643 CB LEU A 99 41.529 -2.818 16.301 1.00 0.00 C ATOM 1644 CG LEU A 99 40.062 -3.248 16.250 1.00 0.00 C ATOM 1645 CD1 LEU A 99 39.895 -4.389 15.245 1.00 0.00 C ATOM 1646 CD2 LEU A 99 39.629 -3.725 17.637 1.00 0.00 C ATOM 0 H LEU A 99 40.765 -0.641 15.443 1.00 0.00 H new ATOM 0 HA LEU A 99 41.112 -1.653 18.055 1.00 0.00 H new ATOM 0 HB2 LEU A 99 41.908 -2.659 15.291 1.00 0.00 H new ATOM 0 HB3 LEU A 99 42.135 -3.606 16.748 1.00 0.00 H new ATOM 0 HG LEU A 99 39.446 -2.403 15.942 1.00 0.00 H new ATOM 0 HD11 LEU A 99 38.849 -4.693 15.211 1.00 0.00 H new ATOM 0 HD12 LEU A 99 40.207 -4.052 14.257 1.00 0.00 H new ATOM 0 HD13 LEU A 99 40.509 -5.236 15.551 1.00 0.00 H new ATOM 0 HD21 LEU A 99 38.584 -4.033 17.606 1.00 0.00 H new ATOM 0 HD22 LEU A 99 40.247 -4.570 17.941 1.00 0.00 H new ATOM 0 HD23 LEU A 99 39.747 -2.913 18.354 1.00 0.00 H new ATOM 1658 N ASP A 100 43.821 -0.684 16.443 1.00 0.00 N ATOM 1659 CA ASP A 100 45.232 -0.354 16.608 1.00 0.00 C ATOM 1660 C ASP A 100 45.412 0.664 17.727 1.00 0.00 C ATOM 1661 O ASP A 100 46.361 0.588 18.507 1.00 0.00 O ATOM 1662 CB ASP A 100 45.784 0.223 15.305 1.00 0.00 C ATOM 1663 CG ASP A 100 45.919 -0.879 14.260 1.00 0.00 C ATOM 1664 OD1 ASP A 100 45.818 -2.036 14.632 1.00 0.00 O ATOM 1665 OD2 ASP A 100 46.119 -0.550 13.102 1.00 0.00 O ATOM 0 H ASP A 100 43.433 -0.442 15.531 1.00 0.00 H new ATOM 0 HA ASP A 100 45.774 -1.264 16.865 1.00 0.00 H new ATOM 0 HB2 ASP A 100 45.122 1.006 14.936 1.00 0.00 H new ATOM 0 HB3 ASP A 100 46.755 0.685 15.485 1.00 0.00 H new ATOM 1670 N LYS A 101 44.496 1.621 17.788 1.00 0.00 N ATOM 1671 CA LYS A 101 44.552 2.665 18.802 1.00 0.00 C ATOM 1672 C LYS A 101 44.420 2.072 20.196 1.00 0.00 C ATOM 1673 O LYS A 101 45.074 2.519 21.137 1.00 0.00 O ATOM 1674 CB LYS A 101 43.415 3.661 18.577 1.00 0.00 C ATOM 1675 CG LYS A 101 43.629 4.377 17.247 1.00 0.00 C ATOM 1676 CD LYS A 101 44.897 5.228 17.321 1.00 0.00 C ATOM 1677 CE LYS A 101 45.078 5.987 16.005 1.00 0.00 C ATOM 1678 NZ LYS A 101 46.318 6.811 16.075 1.00 0.00 N ATOM 0 H LYS A 101 43.706 1.696 17.148 1.00 0.00 H new ATOM 0 HA LYS A 101 45.515 3.169 18.721 1.00 0.00 H new ATOM 0 HB2 LYS A 101 42.457 3.142 18.574 1.00 0.00 H new ATOM 0 HB3 LYS A 101 43.383 4.384 19.392 1.00 0.00 H new ATOM 0 HG2 LYS A 101 43.714 3.649 16.440 1.00 0.00 H new ATOM 0 HG3 LYS A 101 42.769 5.007 17.019 1.00 0.00 H new ATOM 0 HD2 LYS A 101 44.829 5.930 18.152 1.00 0.00 H new ATOM 0 HD3 LYS A 101 45.763 4.594 17.510 1.00 0.00 H new ATOM 0 HE2 LYS A 101 45.141 5.285 15.173 1.00 0.00 H new ATOM 0 HE3 LYS A 101 44.214 6.625 15.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 46.078 7.813 15.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 46.762 6.691 17.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 46.981 6.505 15.334 1.00 0.00 H new ATOM 1692 N ILE A 102 43.559 1.072 20.326 1.00 0.00 N ATOM 1693 CA ILE A 102 43.340 0.439 21.618 1.00 0.00 C ATOM 1694 C ILE A 102 44.488 -0.506 21.956 1.00 0.00 C ATOM 1695 O ILE A 102 44.967 -0.535 23.090 1.00 0.00 O ATOM 1696 CB ILE A 102 42.021 -0.337 21.614 1.00 0.00 C ATOM 1697 CG1 ILE A 102 41.210 0.018 20.366 1.00 0.00 C ATOM 1698 CG2 ILE A 102 41.216 0.048 22.852 1.00 0.00 C ATOM 1699 CD1 ILE A 102 39.809 -0.586 20.479 1.00 0.00 C ATOM 0 H ILE A 102 43.006 0.685 19.561 1.00 0.00 H new ATOM 0 HA ILE A 102 43.293 1.222 22.375 1.00 0.00 H new ATOM 0 HB ILE A 102 42.232 -1.406 21.616 1.00 0.00 H new ATOM 0 HG12 ILE A 102 41.143 1.101 20.259 1.00 0.00 H new ATOM 0 HG13 ILE A 102 41.710 -0.361 19.475 1.00 0.00 H new ATOM 0 HG21 ILE A 102 40.274 -0.500 22.858 1.00 0.00 H new ATOM 0 HG22 ILE A 102 41.786 -0.199 23.748 1.00 0.00 H new ATOM 0 HG23 ILE A 102 41.013 1.119 22.835 1.00 0.00 H new ATOM 0 HD11 ILE A 102 39.231 -0.333 19.590 1.00 0.00 H new ATOM 0 HD12 ILE A 102 39.886 -1.670 20.566 1.00 0.00 H new ATOM 0 HD13 ILE A 102 39.310 -0.186 21.362 1.00 0.00 H new ATOM 1711 N ILE A 103 44.925 -1.278 20.967 1.00 0.00 N ATOM 1712 CA ILE A 103 46.018 -2.220 21.176 1.00 0.00 C ATOM 1713 C ILE A 103 47.297 -1.489 21.571 1.00 0.00 C ATOM 1714 O ILE A 103 47.986 -1.888 22.509 1.00 0.00 O ATOM 1715 CB ILE A 103 46.260 -3.028 19.900 1.00 0.00 C ATOM 1716 CG1 ILE A 103 45.050 -3.923 19.628 1.00 0.00 C ATOM 1717 CG2 ILE A 103 47.507 -3.897 20.075 1.00 0.00 C ATOM 1718 CD1 ILE A 103 44.857 -4.891 20.796 1.00 0.00 C ATOM 0 H ILE A 103 44.543 -1.271 20.021 1.00 0.00 H new ATOM 0 HA ILE A 103 45.739 -2.893 21.986 1.00 0.00 H new ATOM 0 HB ILE A 103 46.406 -2.348 19.061 1.00 0.00 H new ATOM 0 HG12 ILE A 103 44.156 -3.313 19.496 1.00 0.00 H new ATOM 0 HG13 ILE A 103 45.197 -4.479 18.702 1.00 0.00 H new ATOM 0 HG21 ILE A 103 47.680 -4.473 19.166 1.00 0.00 H new ATOM 0 HG22 ILE A 103 48.370 -3.260 20.270 1.00 0.00 H new ATOM 0 HG23 ILE A 103 47.361 -4.578 20.914 1.00 0.00 H new ATOM 0 HD11 ILE A 103 43.995 -5.528 20.602 1.00 0.00 H new ATOM 0 HD12 ILE A 103 45.748 -5.509 20.907 1.00 0.00 H new ATOM 0 HD13 ILE A 103 44.691 -4.326 21.713 1.00 0.00 H new ATOM 1730 N GLU A 104 47.609 -0.415 20.853 1.00 0.00 N ATOM 1731 CA GLU A 104 48.809 0.363 21.143 1.00 0.00 C ATOM 1732 C GLU A 104 48.709 0.999 22.524 1.00 0.00 C ATOM 1733 O GLU A 104 49.670 1.001 23.293 1.00 0.00 O ATOM 1734 CB GLU A 104 48.992 1.455 20.088 1.00 0.00 C ATOM 1735 CG GLU A 104 50.274 2.239 20.380 1.00 0.00 C ATOM 1736 CD GLU A 104 50.489 3.303 19.310 1.00 0.00 C ATOM 1737 OE1 GLU A 104 49.663 3.391 18.414 1.00 0.00 O ATOM 1738 OE2 GLU A 104 51.475 4.015 19.400 1.00 0.00 O ATOM 0 H GLU A 104 47.053 -0.065 20.072 1.00 0.00 H new ATOM 0 HA GLU A 104 49.669 -0.307 21.123 1.00 0.00 H new ATOM 0 HB2 GLU A 104 49.044 1.010 19.094 1.00 0.00 H new ATOM 0 HB3 GLU A 104 48.134 2.127 20.092 1.00 0.00 H new ATOM 0 HG2 GLU A 104 50.208 2.707 21.362 1.00 0.00 H new ATOM 0 HG3 GLU A 104 51.127 1.561 20.407 1.00 0.00 H new ATOM 1745 N LYS A 105 47.535 1.539 22.826 1.00 0.00 N ATOM 1746 CA LYS A 105 47.301 2.182 24.111 1.00 0.00 C ATOM 1747 C LYS A 105 47.438 1.184 25.255 1.00 0.00 C ATOM 1748 O LYS A 105 47.974 1.509 26.313 1.00 0.00 O ATOM 1749 CB LYS A 105 45.900 2.790 24.135 1.00 0.00 C ATOM 1750 CG LYS A 105 45.860 4.019 23.222 1.00 0.00 C ATOM 1751 CD LYS A 105 44.417 4.509 23.088 1.00 0.00 C ATOM 1752 CE LYS A 105 43.925 5.024 24.441 1.00 0.00 C ATOM 1753 NZ LYS A 105 42.539 5.553 24.298 1.00 0.00 N ATOM 0 H LYS A 105 46.731 1.544 22.198 1.00 0.00 H new ATOM 0 HA LYS A 105 48.048 2.965 24.242 1.00 0.00 H new ATOM 0 HB2 LYS A 105 45.167 2.054 23.804 1.00 0.00 H new ATOM 0 HB3 LYS A 105 45.632 3.071 25.153 1.00 0.00 H new ATOM 0 HG2 LYS A 105 46.487 4.810 23.632 1.00 0.00 H new ATOM 0 HG3 LYS A 105 46.263 3.769 22.241 1.00 0.00 H new ATOM 0 HD2 LYS A 105 44.359 5.302 22.342 1.00 0.00 H new ATOM 0 HD3 LYS A 105 43.777 3.698 22.741 1.00 0.00 H new ATOM 0 HE2 LYS A 105 43.945 4.220 25.177 1.00 0.00 H new ATOM 0 HE3 LYS A 105 44.589 5.807 24.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 42.204 5.903 25.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 42.534 6.332 23.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 41.910 4.794 23.967 1.00 0.00 H new ATOM 1767 N ILE A 106 46.940 -0.028 25.040 1.00 0.00 N ATOM 1768 CA ILE A 106 47.003 -1.061 26.067 1.00 0.00 C ATOM 1769 C ILE A 106 48.453 -1.409 26.402 1.00 0.00 C ATOM 1770 O ILE A 106 48.754 -1.845 27.513 1.00 0.00 O ATOM 1771 CB ILE A 106 46.257 -2.313 25.597 1.00 0.00 C ATOM 1772 CG1 ILE A 106 45.980 -3.214 26.801 1.00 0.00 C ATOM 1773 CG2 ILE A 106 47.101 -3.078 24.575 1.00 0.00 C ATOM 1774 CD1 ILE A 106 44.984 -4.306 26.406 1.00 0.00 C ATOM 0 H ILE A 106 46.492 -0.318 24.171 1.00 0.00 H new ATOM 0 HA ILE A 106 46.527 -0.677 26.969 1.00 0.00 H new ATOM 0 HB ILE A 106 45.318 -2.016 25.130 1.00 0.00 H new ATOM 0 HG12 ILE A 106 46.908 -3.664 27.152 1.00 0.00 H new ATOM 0 HG13 ILE A 106 45.580 -2.624 27.625 1.00 0.00 H new ATOM 0 HG21 ILE A 106 46.560 -3.966 24.248 1.00 0.00 H new ATOM 0 HG22 ILE A 106 47.300 -2.438 23.716 1.00 0.00 H new ATOM 0 HG23 ILE A 106 48.045 -3.376 25.032 1.00 0.00 H new ATOM 0 HD11 ILE A 106 44.788 -4.947 27.265 1.00 0.00 H new ATOM 0 HD12 ILE A 106 44.052 -3.847 26.076 1.00 0.00 H new ATOM 0 HD13 ILE A 106 45.401 -4.903 25.595 1.00 0.00 H new ATOM 1786 N ASP A 107 49.345 -1.214 25.436 1.00 0.00 N ATOM 1787 CA ASP A 107 50.758 -1.512 25.639 1.00 0.00 C ATOM 1788 C ASP A 107 51.368 -0.575 26.673 1.00 0.00 C ATOM 1789 O ASP A 107 52.141 -0.998 27.533 1.00 0.00 O ATOM 1790 CB ASP A 107 51.512 -1.376 24.316 1.00 0.00 C ATOM 1791 CG ASP A 107 52.964 -1.807 24.497 1.00 0.00 C ATOM 1792 OD1 ASP A 107 53.360 -2.018 25.632 1.00 0.00 O ATOM 1793 OD2 ASP A 107 53.657 -1.918 23.501 1.00 0.00 O ATOM 0 H ASP A 107 49.116 -0.853 24.510 1.00 0.00 H new ATOM 0 HA ASP A 107 50.843 -2.535 26.006 1.00 0.00 H new ATOM 0 HB2 ASP A 107 51.035 -1.989 23.551 1.00 0.00 H new ATOM 0 HB3 ASP A 107 51.471 -0.344 23.969 1.00 0.00 H new ATOM 1798 N LYS A 108 51.022 0.703 26.574 1.00 0.00 N ATOM 1799 CA LYS A 108 51.547 1.701 27.493 1.00 0.00 C ATOM 1800 C LYS A 108 50.650 1.834 28.717 1.00 0.00 C ATOM 1801 O LYS A 108 51.125 2.073 29.826 1.00 0.00 O ATOM 1802 CB LYS A 108 51.649 3.052 26.785 1.00 0.00 C ATOM 1803 CG LYS A 108 50.337 3.357 26.057 1.00 0.00 C ATOM 1804 CD LYS A 108 50.416 4.747 25.425 1.00 0.00 C ATOM 1805 CE LYS A 108 51.502 4.756 24.347 1.00 0.00 C ATOM 1806 NZ LYS A 108 51.101 3.852 23.231 1.00 0.00 N ATOM 0 H LYS A 108 50.383 1.070 25.869 1.00 0.00 H new ATOM 0 HA LYS A 108 52.537 1.382 27.820 1.00 0.00 H new ATOM 0 HB2 LYS A 108 51.864 3.837 27.510 1.00 0.00 H new ATOM 0 HB3 LYS A 108 52.475 3.039 26.074 1.00 0.00 H new ATOM 0 HG2 LYS A 108 50.152 2.606 25.289 1.00 0.00 H new ATOM 0 HG3 LYS A 108 49.502 3.310 26.756 1.00 0.00 H new ATOM 0 HD2 LYS A 108 49.454 5.015 24.989 1.00 0.00 H new ATOM 0 HD3 LYS A 108 50.639 5.493 26.188 1.00 0.00 H new ATOM 0 HE2 LYS A 108 51.650 5.769 23.973 1.00 0.00 H new ATOM 0 HE3 LYS A 108 52.452 4.430 24.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 51.623 4.112 22.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 51.321 2.868 23.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 50.080 3.945 23.059 1.00 0.00 H new ATOM 1820 N LEU A 109 49.351 1.680 28.502 1.00 0.00 N ATOM 1821 CA LEU A 109 48.389 1.787 29.588 1.00 0.00 C ATOM 1822 C LEU A 109 47.112 1.031 29.244 1.00 0.00 C ATOM 1823 O LEU A 109 46.718 0.966 28.081 1.00 0.00 O ATOM 1824 CB LEU A 109 48.061 3.258 29.843 1.00 0.00 C ATOM 1825 CG LEU A 109 47.514 3.889 28.563 1.00 0.00 C ATOM 1826 CD1 LEU A 109 45.988 3.800 28.562 1.00 0.00 C ATOM 1827 CD2 LEU A 109 47.939 5.358 28.497 1.00 0.00 C ATOM 0 H LEU A 109 48.941 1.481 27.589 1.00 0.00 H new ATOM 0 HA LEU A 109 48.825 1.349 30.486 1.00 0.00 H new ATOM 0 HB2 LEU A 109 47.328 3.344 30.645 1.00 0.00 H new ATOM 0 HB3 LEU A 109 48.955 3.789 30.170 1.00 0.00 H new ATOM 0 HG LEU A 109 47.909 3.357 27.698 1.00 0.00 H new ATOM 0 HD11 LEU A 109 45.598 4.250 27.649 1.00 0.00 H new ATOM 0 HD12 LEU A 109 45.685 2.754 28.609 1.00 0.00 H new ATOM 0 HD13 LEU A 109 45.592 4.332 29.427 1.00 0.00 H new ATOM 0 HD21 LEU A 109 47.549 5.809 27.584 1.00 0.00 H new ATOM 0 HD22 LEU A 109 47.544 5.890 29.362 1.00 0.00 H new ATOM 0 HD23 LEU A 109 49.027 5.422 28.497 1.00 0.00 H new ATOM 1839 N ASP A 110 46.467 0.467 30.258 1.00 0.00 N ATOM 1840 CA ASP A 110 45.235 -0.279 30.041 1.00 0.00 C ATOM 1841 C ASP A 110 44.041 0.665 30.000 1.00 0.00 C ATOM 1842 O ASP A 110 43.656 1.242 31.017 1.00 0.00 O ATOM 1843 CB ASP A 110 45.040 -1.310 31.153 1.00 0.00 C ATOM 1844 CG ASP A 110 43.789 -2.138 30.879 1.00 0.00 C ATOM 1845 OD1 ASP A 110 43.041 -1.767 29.989 1.00 0.00 O ATOM 1846 OD2 ASP A 110 43.599 -3.131 31.560 1.00 0.00 O ATOM 0 H ASP A 110 46.773 0.511 31.230 1.00 0.00 H new ATOM 0 HA ASP A 110 45.309 -0.795 29.084 1.00 0.00 H new ATOM 0 HB2 ASP A 110 45.912 -1.961 31.214 1.00 0.00 H new ATOM 0 HB3 ASP A 110 44.950 -0.807 32.116 1.00 0.00 H new ATOM 1851 N LEU A 111 43.462 0.822 28.814 1.00 0.00 N ATOM 1852 CA LEU A 111 42.315 1.703 28.640 1.00 0.00 C ATOM 1853 C LEU A 111 41.291 1.497 29.754 1.00 0.00 C ATOM 1854 O LEU A 111 40.397 2.319 29.938 1.00 0.00 O ATOM 1855 CB LEU A 111 41.655 1.436 27.285 1.00 0.00 C ATOM 1856 CG LEU A 111 41.068 0.024 27.271 1.00 0.00 C ATOM 1857 CD1 LEU A 111 39.541 0.106 27.215 1.00 0.00 C ATOM 1858 CD2 LEU A 111 41.583 -0.730 26.044 1.00 0.00 C ATOM 0 H LEU A 111 43.768 0.352 27.962 1.00 0.00 H new ATOM 0 HA LEU A 111 42.669 2.733 28.681 1.00 0.00 H new ATOM 0 HB2 LEU A 111 40.870 2.169 27.101 1.00 0.00 H new ATOM 0 HB3 LEU A 111 42.387 1.545 26.485 1.00 0.00 H new ATOM 0 HG LEU A 111 41.370 -0.504 28.176 1.00 0.00 H new ATOM 0 HD11 LEU A 111 39.123 -0.900 27.205 1.00 0.00 H new ATOM 0 HD12 LEU A 111 39.173 0.643 28.089 1.00 0.00 H new ATOM 0 HD13 LEU A 111 39.238 0.634 26.311 1.00 0.00 H new ATOM 0 HD21 LEU A 111 41.165 -1.737 26.034 1.00 0.00 H new ATOM 0 HD22 LEU A 111 41.281 -0.202 25.139 1.00 0.00 H new ATOM 0 HD23 LEU A 111 42.671 -0.789 26.083 1.00 0.00 H new ATOM 1870 N ASP A 112 41.428 0.399 30.494 1.00 0.00 N ATOM 1871 CA ASP A 112 40.500 0.106 31.584 1.00 0.00 C ATOM 1872 C ASP A 112 40.627 1.154 32.684 1.00 0.00 C ATOM 1873 O ASP A 112 39.769 1.257 33.562 1.00 0.00 O ATOM 1874 CB ASP A 112 40.794 -1.276 32.170 1.00 0.00 C ATOM 1875 CG ASP A 112 42.185 -1.291 32.794 1.00 0.00 C ATOM 1876 OD1 ASP A 112 42.862 -0.279 32.708 1.00 0.00 O ATOM 1877 OD2 ASP A 112 42.553 -2.314 33.349 1.00 0.00 O ATOM 0 H ASP A 112 42.163 -0.295 30.362 1.00 0.00 H new ATOM 0 HA ASP A 112 39.486 0.123 31.185 1.00 0.00 H new ATOM 0 HB2 ASP A 112 40.046 -1.528 32.922 1.00 0.00 H new ATOM 0 HB3 ASP A 112 40.728 -2.033 31.389 1.00 0.00 H new ATOM 1882 N LYS A 113 41.700 1.931 32.624 1.00 0.00 N ATOM 1883 CA LYS A 113 41.937 2.977 33.609 1.00 0.00 C ATOM 1884 C LYS A 113 40.861 4.044 33.512 1.00 0.00 C ATOM 1885 O LYS A 113 40.412 4.587 34.521 1.00 0.00 O ATOM 1886 CB LYS A 113 43.306 3.616 33.375 1.00 0.00 C ATOM 1887 CG LYS A 113 44.405 2.621 33.748 1.00 0.00 C ATOM 1888 CD LYS A 113 45.776 3.257 33.513 1.00 0.00 C ATOM 1889 CE LYS A 113 46.872 2.261 33.894 1.00 0.00 C ATOM 1890 NZ LYS A 113 48.209 2.876 33.657 1.00 0.00 N ATOM 0 H LYS A 113 42.419 1.857 31.905 1.00 0.00 H new ATOM 0 HA LYS A 113 41.910 2.530 34.603 1.00 0.00 H new ATOM 0 HB2 LYS A 113 43.407 3.911 32.331 1.00 0.00 H new ATOM 0 HB3 LYS A 113 43.403 4.522 33.973 1.00 0.00 H new ATOM 0 HG2 LYS A 113 44.304 2.327 34.793 1.00 0.00 H new ATOM 0 HG3 LYS A 113 44.306 1.714 33.151 1.00 0.00 H new ATOM 0 HD2 LYS A 113 45.880 3.546 32.467 1.00 0.00 H new ATOM 0 HD3 LYS A 113 45.874 4.166 34.106 1.00 0.00 H new ATOM 0 HE2 LYS A 113 46.771 1.977 34.942 1.00 0.00 H new ATOM 0 HE3 LYS A 113 46.770 1.349 33.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 48.954 2.198 33.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 48.303 3.126 32.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 48.304 3.734 34.237 1.00 0.00 H new ATOM 1904 N TYR A 114 40.464 4.344 32.285 1.00 0.00 N ATOM 1905 CA TYR A 114 39.450 5.356 32.050 1.00 0.00 C ATOM 1906 C TYR A 114 38.072 4.809 32.397 1.00 0.00 C ATOM 1907 O TYR A 114 37.650 3.787 31.858 1.00 0.00 O ATOM 1908 CB TYR A 114 39.464 5.756 30.579 1.00 0.00 C ATOM 1909 CG TYR A 114 40.884 5.984 30.126 1.00 0.00 C ATOM 1910 CD1 TYR A 114 41.473 5.089 29.226 1.00 0.00 C ATOM 1911 CD2 TYR A 114 41.610 7.083 30.598 1.00 0.00 C ATOM 1912 CE1 TYR A 114 42.786 5.289 28.798 1.00 0.00 C ATOM 1913 CE2 TYR A 114 42.927 7.284 30.170 1.00 0.00 C ATOM 1914 CZ TYR A 114 43.517 6.387 29.269 1.00 0.00 C ATOM 1915 OH TYR A 114 44.814 6.586 28.846 1.00 0.00 O ATOM 0 H TYR A 114 40.828 3.902 31.441 1.00 0.00 H new ATOM 0 HA TYR A 114 39.665 6.221 32.677 1.00 0.00 H new ATOM 0 HB2 TYR A 114 39.001 4.975 29.976 1.00 0.00 H new ATOM 0 HB3 TYR A 114 38.876 6.662 30.433 1.00 0.00 H new ATOM 0 HD1 TYR A 114 40.910 4.242 28.862 1.00 0.00 H new ATOM 0 HD2 TYR A 114 41.155 7.775 31.291 1.00 0.00 H new ATOM 0 HE1 TYR A 114 43.239 4.597 28.103 1.00 0.00 H new ATOM 0 HE2 TYR A 114 43.489 8.131 30.534 1.00 0.00 H new ATOM 0 HH TYR A 114 45.361 6.889 29.600 1.00 0.00 H new ATOM 1925 N ARG A 115 37.366 5.490 33.289 1.00 0.00 N ATOM 1926 CA ARG A 115 36.036 5.046 33.673 1.00 0.00 C ATOM 1927 C ARG A 115 35.098 5.095 32.472 1.00 0.00 C ATOM 1928 O ARG A 115 34.267 4.206 32.286 1.00 0.00 O ATOM 1929 CB ARG A 115 35.485 5.922 34.799 1.00 0.00 C ATOM 1930 CG ARG A 115 36.264 5.644 36.086 1.00 0.00 C ATOM 1931 CD ARG A 115 35.708 6.508 37.219 1.00 0.00 C ATOM 1932 NE ARG A 115 36.434 6.245 38.455 1.00 0.00 N ATOM 1933 CZ ARG A 115 36.111 6.864 39.586 1.00 0.00 C ATOM 1934 NH1 ARG A 115 35.128 7.722 39.602 1.00 0.00 N ATOM 1935 NH2 ARG A 115 36.776 6.614 40.680 1.00 0.00 N ATOM 0 H ARG A 115 37.687 6.339 33.754 1.00 0.00 H new ATOM 0 HA ARG A 115 36.104 4.018 34.029 1.00 0.00 H new ATOM 0 HB2 ARG A 115 35.569 6.975 34.530 1.00 0.00 H new ATOM 0 HB3 ARG A 115 34.425 5.715 34.950 1.00 0.00 H new ATOM 0 HG2 ARG A 115 36.188 4.589 36.349 1.00 0.00 H new ATOM 0 HG3 ARG A 115 37.322 5.859 35.936 1.00 0.00 H new ATOM 0 HD2 ARG A 115 35.792 7.563 36.957 1.00 0.00 H new ATOM 0 HD3 ARG A 115 34.648 6.298 37.360 1.00 0.00 H new ATOM 0 HE ARG A 115 37.203 5.575 38.452 1.00 0.00 H new ATOM 0 HH11 ARG A 115 34.608 7.917 38.747 1.00 0.00 H new ATOM 0 HH12 ARG A 115 34.880 8.197 40.470 1.00 0.00 H new ATOM 0 HH21 ARG A 115 37.544 5.943 40.668 1.00 0.00 H new ATOM 0 HH22 ARG A 115 36.528 7.089 41.548 1.00 0.00 H new ATOM 1949 N PHE A 116 35.237 6.138 31.657 1.00 0.00 N ATOM 1950 CA PHE A 116 34.392 6.282 30.477 1.00 0.00 C ATOM 1951 C PHE A 116 35.144 6.948 29.333 1.00 0.00 C ATOM 1952 O PHE A 116 35.586 8.093 29.445 1.00 0.00 O ATOM 1953 CB PHE A 116 33.158 7.115 30.825 1.00 0.00 C ATOM 1954 CG PHE A 116 32.331 7.329 29.581 1.00 0.00 C ATOM 1955 CD1 PHE A 116 31.522 6.297 29.091 1.00 0.00 C ATOM 1956 CD2 PHE A 116 32.378 8.559 28.914 1.00 0.00 C ATOM 1957 CE1 PHE A 116 30.759 6.496 27.933 1.00 0.00 C ATOM 1958 CE2 PHE A 116 31.615 8.758 27.757 1.00 0.00 C ATOM 1959 CZ PHE A 116 30.805 7.726 27.267 1.00 0.00 C ATOM 0 H PHE A 116 35.918 6.886 31.790 1.00 0.00 H new ATOM 0 HA PHE A 116 34.092 5.285 30.155 1.00 0.00 H new ATOM 0 HB2 PHE A 116 32.566 6.607 31.586 1.00 0.00 H new ATOM 0 HB3 PHE A 116 33.460 8.075 31.244 1.00 0.00 H new ATOM 0 HD1 PHE A 116 31.486 5.348 29.605 1.00 0.00 H new ATOM 0 HD2 PHE A 116 33.003 9.355 29.292 1.00 0.00 H new ATOM 0 HE1 PHE A 116 30.135 5.700 27.554 1.00 0.00 H new ATOM 0 HE2 PHE A 116 31.651 9.707 27.243 1.00 0.00 H new ATOM 0 HZ PHE A 116 30.216 7.879 26.375 1.00 0.00 H new ATOM 1969 N ILE A 117 35.253 6.235 28.218 1.00 0.00 N ATOM 1970 CA ILE A 117 35.914 6.776 27.036 1.00 0.00 C ATOM 1971 C ILE A 117 35.025 6.558 25.822 1.00 0.00 C ATOM 1972 O ILE A 117 34.229 5.619 25.789 1.00 0.00 O ATOM 1973 CB ILE A 117 37.285 6.132 26.817 1.00 0.00 C ATOM 1974 CG1 ILE A 117 37.145 4.620 26.672 1.00 0.00 C ATOM 1975 CG2 ILE A 117 38.190 6.440 28.011 1.00 0.00 C ATOM 1976 CD1 ILE A 117 38.462 4.042 26.152 1.00 0.00 C ATOM 0 H ILE A 117 34.895 5.286 28.107 1.00 0.00 H new ATOM 0 HA ILE A 117 36.076 7.843 27.186 1.00 0.00 H new ATOM 0 HB ILE A 117 37.721 6.538 25.904 1.00 0.00 H new ATOM 0 HG12 ILE A 117 36.891 4.172 27.633 1.00 0.00 H new ATOM 0 HG13 ILE A 117 36.333 4.382 25.985 1.00 0.00 H new ATOM 0 HG21 ILE A 117 39.166 5.981 27.855 1.00 0.00 H new ATOM 0 HG22 ILE A 117 38.307 7.519 28.110 1.00 0.00 H new ATOM 0 HG23 ILE A 117 37.742 6.039 28.920 1.00 0.00 H new ATOM 0 HD11 ILE A 117 38.368 2.961 26.046 1.00 0.00 H new ATOM 0 HD12 ILE A 117 38.695 4.483 25.183 1.00 0.00 H new ATOM 0 HD13 ILE A 117 39.262 4.270 26.856 1.00 0.00 H new ATOM 1988 N ASN A 118 35.132 7.441 24.841 1.00 0.00 N ATOM 1989 CA ASN A 118 34.295 7.331 23.656 1.00 0.00 C ATOM 1990 C ASN A 118 35.040 7.745 22.391 1.00 0.00 C ATOM 1991 O ASN A 118 35.356 8.919 22.198 1.00 0.00 O ATOM 1992 CB ASN A 118 33.062 8.211 23.846 1.00 0.00 C ATOM 1993 CG ASN A 118 32.114 8.056 22.663 1.00 0.00 C ATOM 1994 OD1 ASN A 118 32.550 7.759 21.551 1.00 0.00 O ATOM 1995 ND2 ASN A 118 30.835 8.248 22.835 1.00 0.00 N ATOM 0 H ASN A 118 35.779 8.230 24.840 1.00 0.00 H new ATOM 0 HA ASN A 118 34.006 6.287 23.532 1.00 0.00 H new ATOM 0 HB2 ASN A 118 32.550 7.938 24.769 1.00 0.00 H new ATOM 0 HB3 ASN A 118 33.363 9.254 23.945 1.00 0.00 H new ATOM 0 HD21 ASN A 118 30.194 8.152 22.047 1.00 0.00 H new ATOM 0 HD22 ASN A 118 30.476 8.494 23.757 1.00 0.00 H new ATOM 2002 N ALA A 119 35.302 6.769 21.525 1.00 0.00 N ATOM 2003 CA ALA A 119 35.993 7.033 20.268 1.00 0.00 C ATOM 2004 C ALA A 119 35.003 7.509 19.209 1.00 0.00 C ATOM 2005 O ALA A 119 33.807 7.228 19.294 1.00 0.00 O ATOM 2006 CB ALA A 119 36.704 5.769 19.778 1.00 0.00 C ATOM 0 H ALA A 119 35.047 5.792 21.671 1.00 0.00 H new ATOM 0 HA ALA A 119 36.733 7.814 20.439 1.00 0.00 H new ATOM 0 HB1 ALA A 119 37.216 5.980 18.839 1.00 0.00 H new ATOM 0 HB2 ALA A 119 37.432 5.449 20.524 1.00 0.00 H new ATOM 0 HB3 ALA A 119 35.972 4.977 19.622 1.00 0.00 H new ATOM 2012 N THR A 120 35.505 8.234 18.217 1.00 0.00 N ATOM 2013 CA THR A 120 34.652 8.748 17.152 1.00 0.00 C ATOM 2014 C THR A 120 35.143 8.261 15.791 1.00 0.00 C ATOM 2015 O THR A 120 36.286 7.827 15.652 1.00 0.00 O ATOM 2016 CB THR A 120 34.638 10.278 17.176 1.00 0.00 C ATOM 2017 OG1 THR A 120 34.517 10.725 18.520 1.00 0.00 O ATOM 2018 CG2 THR A 120 33.446 10.786 16.366 1.00 0.00 C ATOM 0 H THR A 120 36.491 8.478 18.127 1.00 0.00 H new ATOM 0 HA THR A 120 33.640 8.378 17.316 1.00 0.00 H new ATOM 0 HB THR A 120 35.563 10.659 16.744 1.00 0.00 H new ATOM 0 HG1 THR A 120 35.363 11.126 18.809 1.00 0.00 H new ATOM 0 HG21 THR A 120 33.434 11.876 16.381 1.00 0.00 H new ATOM 0 HG22 THR A 120 33.531 10.439 15.336 1.00 0.00 H new ATOM 0 HG23 THR A 120 32.522 10.406 16.802 1.00 0.00 H new ATOM 2026 N ASN A 121 34.264 8.325 14.795 1.00 0.00 N ATOM 2027 CA ASN A 121 34.608 7.876 13.449 1.00 0.00 C ATOM 2028 C ASN A 121 36.049 8.243 13.103 1.00 0.00 C ATOM 2029 O ASN A 121 36.692 9.020 13.808 1.00 0.00 O ATOM 2030 CB ASN A 121 33.661 8.518 12.433 1.00 0.00 C ATOM 2031 CG ASN A 121 32.225 8.090 12.716 1.00 0.00 C ATOM 2032 OD1 ASN A 121 31.262 8.966 12.619 1.00 0.00 O flip ATOM 2033 ND2 ASN A 121 31.973 6.927 13.031 1.00 0.00 N flip ATOM 0 H ASN A 121 33.313 8.681 14.893 1.00 0.00 H new ATOM 0 HA ASN A 121 34.508 6.791 13.414 1.00 0.00 H new ATOM 0 HB2 ASN A 121 33.742 9.604 12.483 1.00 0.00 H new ATOM 0 HB3 ASN A 121 33.945 8.224 11.423 1.00 0.00 H new ATOM 0 HD21 ASN A 121 32.727 6.244 13.106 1.00 0.00 H new ATOM 0 HD22 ASN A 121 31.010 6.646 13.217 1.00 0.00 H new ATOM 2040 N LEU A 122 36.555 7.660 12.018 1.00 0.00 N ATOM 2041 CA LEU A 122 37.929 7.910 11.592 1.00 0.00 C ATOM 2042 C LEU A 122 38.143 9.387 11.276 1.00 0.00 C ATOM 2043 O LEU A 122 39.177 9.958 11.618 1.00 0.00 O ATOM 2044 CB LEU A 122 38.249 7.071 10.354 1.00 0.00 C ATOM 2045 CG LEU A 122 38.302 5.592 10.739 1.00 0.00 C ATOM 2046 CD1 LEU A 122 38.412 4.738 9.474 1.00 0.00 C ATOM 2047 CD2 LEU A 122 39.520 5.339 11.630 1.00 0.00 C ATOM 0 H LEU A 122 36.037 7.015 11.421 1.00 0.00 H new ATOM 0 HA LEU A 122 38.595 7.630 12.408 1.00 0.00 H new ATOM 0 HB2 LEU A 122 37.491 7.231 9.587 1.00 0.00 H new ATOM 0 HB3 LEU A 122 39.203 7.381 9.928 1.00 0.00 H new ATOM 0 HG LEU A 122 37.394 5.326 11.280 1.00 0.00 H new ATOM 0 HD11 LEU A 122 38.450 3.684 9.749 1.00 0.00 H new ATOM 0 HD12 LEU A 122 37.545 4.916 8.838 1.00 0.00 H new ATOM 0 HD13 LEU A 122 39.320 5.005 8.933 1.00 0.00 H new ATOM 0 HD21 LEU A 122 39.557 4.285 11.904 1.00 0.00 H new ATOM 0 HD22 LEU A 122 40.428 5.606 11.089 1.00 0.00 H new ATOM 0 HD23 LEU A 122 39.443 5.946 12.532 1.00 0.00 H new ATOM 2059 N GLU A 123 37.158 10.007 10.633 1.00 0.00 N ATOM 2060 CA GLU A 123 37.263 11.422 10.298 1.00 0.00 C ATOM 2061 C GLU A 123 37.271 12.248 11.579 1.00 0.00 C ATOM 2062 O GLU A 123 37.939 13.277 11.671 1.00 0.00 O ATOM 2063 CB GLU A 123 36.085 11.843 9.418 1.00 0.00 C ATOM 2064 CG GLU A 123 36.225 11.203 8.037 1.00 0.00 C ATOM 2065 CD GLU A 123 34.978 11.480 7.204 1.00 0.00 C ATOM 2066 OE1 GLU A 123 34.000 11.936 7.773 1.00 0.00 O ATOM 2067 OE2 GLU A 123 35.019 11.230 6.011 1.00 0.00 O ATOM 0 H GLU A 123 36.290 9.559 10.337 1.00 0.00 H new ATOM 0 HA GLU A 123 38.190 11.592 9.750 1.00 0.00 H new ATOM 0 HB2 GLU A 123 35.146 11.537 9.879 1.00 0.00 H new ATOM 0 HB3 GLU A 123 36.056 12.929 9.326 1.00 0.00 H new ATOM 0 HG2 GLU A 123 37.105 11.599 7.531 1.00 0.00 H new ATOM 0 HG3 GLU A 123 36.373 10.128 8.139 1.00 0.00 H new ATOM 2074 N HIS A 124 36.524 11.769 12.565 1.00 0.00 N ATOM 2075 CA HIS A 124 36.435 12.435 13.857 1.00 0.00 C ATOM 2076 C HIS A 124 37.618 12.046 14.738 1.00 0.00 C ATOM 2077 O HIS A 124 38.338 11.093 14.440 1.00 0.00 O ATOM 2078 CB HIS A 124 35.129 12.052 14.551 1.00 0.00 C ATOM 2079 CG HIS A 124 33.968 12.615 13.780 1.00 0.00 C ATOM 2080 ND1 HIS A 124 33.443 11.977 12.666 1.00 0.00 N ATOM 2081 CD2 HIS A 124 33.218 13.753 13.947 1.00 0.00 C ATOM 2082 CE1 HIS A 124 32.423 12.729 12.211 1.00 0.00 C ATOM 2083 NE2 HIS A 124 32.245 13.823 12.956 1.00 0.00 N ATOM 0 H HIS A 124 35.968 10.917 12.493 1.00 0.00 H new ATOM 0 HA HIS A 124 36.455 13.513 13.695 1.00 0.00 H new ATOM 0 HB2 HIS A 124 35.044 10.967 14.616 1.00 0.00 H new ATOM 0 HB3 HIS A 124 35.121 12.435 15.572 1.00 0.00 H new ATOM 0 HD2 HIS A 124 33.362 14.483 14.730 1.00 0.00 H new ATOM 0 HE1 HIS A 124 31.822 12.478 11.349 1.00 0.00 H new ATOM 0 HE2 HIS A 124 31.545 14.554 12.826 1.00 0.00 H new ATOM 2091 N ASP A 125 37.819 12.791 15.818 1.00 0.00 N ATOM 2092 CA ASP A 125 38.925 12.517 16.730 1.00 0.00 C ATOM 2093 C ASP A 125 38.443 11.672 17.906 1.00 0.00 C ATOM 2094 O ASP A 125 37.242 11.469 18.085 1.00 0.00 O ATOM 2095 CB ASP A 125 39.514 13.829 17.247 1.00 0.00 C ATOM 2096 CG ASP A 125 40.273 14.536 16.129 1.00 0.00 C ATOM 2097 OD1 ASP A 125 40.529 13.901 15.120 1.00 0.00 O ATOM 2098 OD2 ASP A 125 40.586 15.704 16.299 1.00 0.00 O ATOM 0 H ASP A 125 37.236 13.584 16.084 1.00 0.00 H new ATOM 0 HA ASP A 125 39.694 11.966 16.189 1.00 0.00 H new ATOM 0 HB2 ASP A 125 38.718 14.473 17.621 1.00 0.00 H new ATOM 0 HB3 ASP A 125 40.184 13.632 18.084 1.00 0.00 H new ATOM 2103 N ILE A 126 39.386 11.163 18.693 1.00 0.00 N ATOM 2104 CA ILE A 126 39.041 10.322 19.834 1.00 0.00 C ATOM 2105 C ILE A 126 39.293 11.050 21.149 1.00 0.00 C ATOM 2106 O ILE A 126 40.311 11.723 21.317 1.00 0.00 O ATOM 2107 CB ILE A 126 39.869 9.036 19.797 1.00 0.00 C ATOM 2108 CG1 ILE A 126 39.503 8.158 20.998 1.00 0.00 C ATOM 2109 CG2 ILE A 126 41.357 9.384 19.858 1.00 0.00 C ATOM 2110 CD1 ILE A 126 40.060 6.750 20.787 1.00 0.00 C ATOM 0 H ILE A 126 40.386 11.316 18.564 1.00 0.00 H new ATOM 0 HA ILE A 126 37.980 10.082 19.770 1.00 0.00 H new ATOM 0 HB ILE A 126 39.659 8.497 18.873 1.00 0.00 H new ATOM 0 HG12 ILE A 126 39.909 8.588 21.914 1.00 0.00 H new ATOM 0 HG13 ILE A 126 38.420 8.119 21.117 1.00 0.00 H new ATOM 0 HG21 ILE A 126 41.946 8.467 19.832 1.00 0.00 H new ATOM 0 HG22 ILE A 126 41.620 10.009 19.005 1.00 0.00 H new ATOM 0 HG23 ILE A 126 41.567 9.924 20.781 1.00 0.00 H new ATOM 0 HD11 ILE A 126 39.800 6.124 21.641 1.00 0.00 H new ATOM 0 HD12 ILE A 126 39.633 6.322 19.880 1.00 0.00 H new ATOM 0 HD13 ILE A 126 41.145 6.799 20.689 1.00 0.00 H new ATOM 2122 N LYS A 127 38.350 10.906 22.076 1.00 0.00 N ATOM 2123 CA LYS A 127 38.457 11.547 23.379 1.00 0.00 C ATOM 2124 C LYS A 127 38.418 10.506 24.493 1.00 0.00 C ATOM 2125 O LYS A 127 37.760 9.473 24.368 1.00 0.00 O ATOM 2126 CB LYS A 127 37.305 12.537 23.566 1.00 0.00 C ATOM 2127 CG LYS A 127 37.418 13.651 22.524 1.00 0.00 C ATOM 2128 CD LYS A 127 36.266 14.642 22.707 1.00 0.00 C ATOM 2129 CE LYS A 127 36.358 15.733 21.640 1.00 0.00 C ATOM 2130 NZ LYS A 127 37.627 16.495 21.820 1.00 0.00 N ATOM 0 H LYS A 127 37.504 10.351 21.947 1.00 0.00 H new ATOM 0 HA LYS A 127 39.408 12.078 23.426 1.00 0.00 H new ATOM 0 HB2 LYS A 127 36.349 12.023 23.463 1.00 0.00 H new ATOM 0 HB3 LYS A 127 37.333 12.959 24.570 1.00 0.00 H new ATOM 0 HG2 LYS A 127 38.374 14.165 22.628 1.00 0.00 H new ATOM 0 HG3 LYS A 127 37.391 13.228 21.520 1.00 0.00 H new ATOM 0 HD2 LYS A 127 35.310 14.123 22.631 1.00 0.00 H new ATOM 0 HD3 LYS A 127 36.309 15.086 23.701 1.00 0.00 H new ATOM 0 HE2 LYS A 127 36.326 15.288 20.645 1.00 0.00 H new ATOM 0 HE3 LYS A 127 35.503 16.405 21.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 37.554 17.411 21.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 37.795 16.655 22.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 38.418 15.951 21.420 1.00 0.00 H new ATOM 2144 N CYS A 128 39.131 10.783 25.579 1.00 0.00 N ATOM 2145 CA CYS A 128 39.176 9.864 26.709 1.00 0.00 C ATOM 2146 C CYS A 128 38.999 10.617 28.022 1.00 0.00 C ATOM 2147 O CYS A 128 39.714 11.581 28.297 1.00 0.00 O ATOM 2148 CB CYS A 128 40.516 9.126 26.720 1.00 0.00 C ATOM 2149 SG CYS A 128 40.565 7.979 28.119 1.00 0.00 S ATOM 0 H CYS A 128 39.683 11.632 25.700 1.00 0.00 H new ATOM 0 HA CYS A 128 38.362 9.147 26.605 1.00 0.00 H new ATOM 0 HB2 CYS A 128 40.651 8.582 25.785 1.00 0.00 H new ATOM 0 HB3 CYS A 128 41.336 9.841 26.794 1.00 0.00 H new ATOM 0 HG CYS A 128 41.694 8.112 28.750 1.00 0.00 H new ATOM 2155 N TYR A 129 38.045 10.173 28.833 1.00 0.00 N ATOM 2156 CA TYR A 129 37.790 10.816 30.116 1.00 0.00 C ATOM 2157 C TYR A 129 38.200 9.897 31.261 1.00 0.00 C ATOM 2158 O TYR A 129 37.853 8.715 31.277 1.00 0.00 O ATOM 2159 CB TYR A 129 36.306 11.165 30.241 1.00 0.00 C ATOM 2160 CG TYR A 129 35.939 12.180 29.185 1.00 0.00 C ATOM 2161 CD1 TYR A 129 35.446 11.754 27.946 1.00 0.00 C ATOM 2162 CD2 TYR A 129 36.093 13.547 29.444 1.00 0.00 C ATOM 2163 CE1 TYR A 129 35.107 12.696 26.967 1.00 0.00 C ATOM 2164 CE2 TYR A 129 35.754 14.488 28.466 1.00 0.00 C ATOM 2165 CZ TYR A 129 35.260 14.062 27.227 1.00 0.00 C ATOM 2166 OH TYR A 129 34.925 14.991 26.262 1.00 0.00 O ATOM 0 H TYR A 129 37.441 9.378 28.627 1.00 0.00 H new ATOM 0 HA TYR A 129 38.380 11.731 30.169 1.00 0.00 H new ATOM 0 HB2 TYR A 129 35.699 10.267 30.125 1.00 0.00 H new ATOM 0 HB3 TYR A 129 36.097 11.565 31.233 1.00 0.00 H new ATOM 0 HD1 TYR A 129 35.327 10.699 27.745 1.00 0.00 H new ATOM 0 HD2 TYR A 129 36.474 13.875 30.400 1.00 0.00 H new ATOM 0 HE1 TYR A 129 34.727 12.368 26.011 1.00 0.00 H new ATOM 0 HE2 TYR A 129 35.873 15.543 28.666 1.00 0.00 H new ATOM 0 HH TYR A 129 35.091 15.894 26.605 1.00 0.00 H new ATOM 2176 N TYR A 130 38.943 10.449 32.215 1.00 0.00 N ATOM 2177 CA TYR A 130 39.402 9.669 33.358 1.00 0.00 C ATOM 2178 C TYR A 130 38.214 9.107 34.137 1.00 0.00 C ATOM 2179 O TYR A 130 38.166 7.914 34.437 1.00 0.00 O ATOM 2180 CB TYR A 130 40.249 10.553 34.275 1.00 0.00 C ATOM 2181 CG TYR A 130 40.673 9.763 35.487 1.00 0.00 C ATOM 2182 CD1 TYR A 130 41.734 8.857 35.393 1.00 0.00 C ATOM 2183 CD2 TYR A 130 40.007 9.939 36.705 1.00 0.00 C ATOM 2184 CE1 TYR A 130 42.130 8.123 36.518 1.00 0.00 C ATOM 2185 CE2 TYR A 130 40.402 9.206 37.831 1.00 0.00 C ATOM 2186 CZ TYR A 130 41.464 8.298 37.737 1.00 0.00 C ATOM 2187 OH TYR A 130 41.853 7.576 38.847 1.00 0.00 O ATOM 0 H TYR A 130 39.238 11.425 32.220 1.00 0.00 H new ATOM 0 HA TYR A 130 40.004 8.836 32.994 1.00 0.00 H new ATOM 0 HB2 TYR A 130 41.126 10.915 33.739 1.00 0.00 H new ATOM 0 HB3 TYR A 130 39.678 11.430 34.581 1.00 0.00 H new ATOM 0 HD1 TYR A 130 42.248 8.723 34.453 1.00 0.00 H new ATOM 0 HD2 TYR A 130 39.189 10.640 36.777 1.00 0.00 H new ATOM 0 HE1 TYR A 130 42.949 7.422 36.445 1.00 0.00 H new ATOM 0 HE2 TYR A 130 39.888 9.341 38.771 1.00 0.00 H new ATOM 0 HH TYR A 130 41.288 7.819 39.610 1.00 0.00 H new ATOM 2197 N LYS A 131 37.255 9.971 34.449 1.00 0.00 N ATOM 2198 CA LYS A 131 36.065 9.551 35.181 1.00 0.00 C ATOM 2199 C LYS A 131 34.818 9.777 34.333 1.00 0.00 C ATOM 2200 O LYS A 131 33.692 9.653 34.814 1.00 0.00 O ATOM 2201 CB LYS A 131 35.950 10.333 36.491 1.00 0.00 C ATOM 2202 CG LYS A 131 35.219 11.652 36.237 1.00 0.00 C ATOM 2203 CD LYS A 131 34.987 12.371 37.567 1.00 0.00 C ATOM 2204 CE LYS A 131 33.607 12.000 38.114 1.00 0.00 C ATOM 2205 NZ LYS A 131 32.552 12.594 37.246 1.00 0.00 N ATOM 0 H LYS A 131 37.277 10.962 34.208 1.00 0.00 H new ATOM 0 HA LYS A 131 36.152 8.488 35.407 1.00 0.00 H new ATOM 0 HB2 LYS A 131 35.411 9.743 37.232 1.00 0.00 H new ATOM 0 HB3 LYS A 131 36.942 10.528 36.899 1.00 0.00 H new ATOM 0 HG2 LYS A 131 35.805 12.282 35.568 1.00 0.00 H new ATOM 0 HG3 LYS A 131 34.266 11.463 35.743 1.00 0.00 H new ATOM 0 HD2 LYS A 131 35.760 12.093 38.283 1.00 0.00 H new ATOM 0 HD3 LYS A 131 35.056 13.450 37.426 1.00 0.00 H new ATOM 0 HE2 LYS A 131 33.497 10.916 38.148 1.00 0.00 H new ATOM 0 HE3 LYS A 131 33.499 12.364 39.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 31.696 12.768 37.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 32.894 13.493 36.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 32.329 11.937 36.472 1.00 0.00 H new ATOM 2219 N GLY A 132 35.037 10.127 33.072 1.00 0.00 N ATOM 2220 CA GLY A 132 33.941 10.395 32.148 1.00 0.00 C ATOM 2221 C GLY A 132 33.690 11.894 32.073 1.00 0.00 C ATOM 2222 O GLY A 132 33.140 12.401 31.095 1.00 0.00 O ATOM 0 H GLY A 132 35.966 10.232 32.664 1.00 0.00 H new ATOM 0 HA2 GLY A 132 34.183 10.007 31.159 1.00 0.00 H new ATOM 0 HA3 GLY A 132 33.039 9.881 32.480 1.00 0.00 H new ATOM 2226 N PHE A 133 34.131 12.597 33.110 1.00 0.00 N ATOM 2227 CA PHE A 133 33.993 14.045 33.171 1.00 0.00 C ATOM 2228 C PHE A 133 35.150 14.630 33.973 1.00 0.00 C ATOM 2229 O PHE A 133 35.283 14.355 35.166 1.00 0.00 O ATOM 2230 CB PHE A 133 32.663 14.420 33.827 1.00 0.00 C ATOM 2231 CG PHE A 133 31.525 13.847 33.016 1.00 0.00 C ATOM 2232 CD1 PHE A 133 30.972 12.608 33.365 1.00 0.00 C ATOM 2233 CD2 PHE A 133 31.026 14.552 31.915 1.00 0.00 C ATOM 2234 CE1 PHE A 133 29.918 12.076 32.611 1.00 0.00 C ATOM 2235 CE2 PHE A 133 29.971 14.020 31.162 1.00 0.00 C ATOM 2236 CZ PHE A 133 29.418 12.782 31.510 1.00 0.00 C ATOM 0 H PHE A 133 34.589 12.184 33.923 1.00 0.00 H new ATOM 0 HA PHE A 133 34.010 14.450 32.159 1.00 0.00 H new ATOM 0 HB2 PHE A 133 32.627 14.036 34.847 1.00 0.00 H new ATOM 0 HB3 PHE A 133 32.569 15.504 33.891 1.00 0.00 H new ATOM 0 HD1 PHE A 133 31.358 12.064 34.214 1.00 0.00 H new ATOM 0 HD2 PHE A 133 31.454 15.506 31.646 1.00 0.00 H new ATOM 0 HE1 PHE A 133 29.491 11.121 32.879 1.00 0.00 H new ATOM 0 HE2 PHE A 133 29.585 14.565 30.313 1.00 0.00 H new ATOM 0 HZ PHE A 133 28.605 12.371 30.929 1.00 0.00 H new ATOM 2246 N LYS A 134 35.987 15.426 33.320 1.00 0.00 N ATOM 2247 CA LYS A 134 37.129 16.026 34.001 1.00 0.00 C ATOM 2248 C LYS A 134 38.004 16.788 33.014 1.00 0.00 C ATOM 2249 O LYS A 134 37.960 16.542 31.809 1.00 0.00 O ATOM 2250 CB LYS A 134 37.964 14.937 34.679 1.00 0.00 C ATOM 2251 CG LYS A 134 38.955 15.583 35.649 1.00 0.00 C ATOM 2252 CD LYS A 134 39.823 14.498 36.291 1.00 0.00 C ATOM 2253 CE LYS A 134 38.966 13.645 37.228 1.00 0.00 C ATOM 2254 NZ LYS A 134 39.828 12.641 37.912 1.00 0.00 N ATOM 0 H LYS A 134 35.900 15.669 32.333 1.00 0.00 H new ATOM 0 HA LYS A 134 36.753 16.721 34.751 1.00 0.00 H new ATOM 0 HB2 LYS A 134 37.313 14.245 35.214 1.00 0.00 H new ATOM 0 HB3 LYS A 134 38.500 14.355 33.929 1.00 0.00 H new ATOM 0 HG2 LYS A 134 39.583 16.300 35.120 1.00 0.00 H new ATOM 0 HG3 LYS A 134 38.418 16.137 36.419 1.00 0.00 H new ATOM 0 HD2 LYS A 134 40.270 13.872 35.519 1.00 0.00 H new ATOM 0 HD3 LYS A 134 40.643 14.954 36.846 1.00 0.00 H new ATOM 0 HE2 LYS A 134 38.472 14.279 37.965 1.00 0.00 H new ATOM 0 HE3 LYS A 134 38.181 13.142 36.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 39.281 12.164 38.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 40.157 11.937 37.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 40.648 13.119 38.336 1.00 0.00 H new ATOM 2268 N THR A 135 38.809 17.707 33.536 1.00 0.00 N ATOM 2269 CA THR A 135 39.702 18.489 32.693 1.00 0.00 C ATOM 2270 C THR A 135 40.806 17.597 32.134 1.00 0.00 C ATOM 2271 O THR A 135 41.436 17.926 31.128 1.00 0.00 O ATOM 2272 CB THR A 135 40.321 19.631 33.500 1.00 0.00 C ATOM 2273 OG1 THR A 135 41.062 19.094 34.587 1.00 0.00 O ATOM 2274 CG2 THR A 135 39.213 20.540 34.035 1.00 0.00 C ATOM 0 H THR A 135 38.861 17.927 34.531 1.00 0.00 H new ATOM 0 HA THR A 135 39.127 18.908 31.867 1.00 0.00 H new ATOM 0 HB THR A 135 40.985 20.211 32.859 1.00 0.00 H new ATOM 0 HG1 THR A 135 41.461 19.825 35.104 1.00 0.00 H new ATOM 0 HG21 THR A 135 39.656 21.353 34.610 1.00 0.00 H new ATOM 0 HG22 THR A 135 38.646 20.952 33.200 1.00 0.00 H new ATOM 0 HG23 THR A 135 38.547 19.963 34.676 1.00 0.00 H new ATOM 2282 N LYS A 136 41.034 16.463 32.793 1.00 0.00 N ATOM 2283 CA LYS A 136 42.064 15.529 32.352 1.00 0.00 C ATOM 2284 C LYS A 136 41.479 14.509 31.380 1.00 0.00 C ATOM 2285 O LYS A 136 40.581 13.741 31.732 1.00 0.00 O ATOM 2286 CB LYS A 136 42.658 14.797 33.558 1.00 0.00 C ATOM 2287 CG LYS A 136 43.762 13.850 33.085 1.00 0.00 C ATOM 2288 CD LYS A 136 44.384 13.146 34.293 1.00 0.00 C ATOM 2289 CE LYS A 136 45.450 12.160 33.815 1.00 0.00 C ATOM 2290 NZ LYS A 136 46.540 12.905 33.122 1.00 0.00 N ATOM 0 H LYS A 136 40.524 16.171 33.627 1.00 0.00 H new ATOM 0 HA LYS A 136 42.847 16.094 31.846 1.00 0.00 H new ATOM 0 HB2 LYS A 136 43.061 15.516 34.271 1.00 0.00 H new ATOM 0 HB3 LYS A 136 41.880 14.236 34.076 1.00 0.00 H new ATOM 0 HG2 LYS A 136 43.353 13.114 32.393 1.00 0.00 H new ATOM 0 HG3 LYS A 136 44.526 14.407 32.543 1.00 0.00 H new ATOM 0 HD2 LYS A 136 44.828 13.880 34.966 1.00 0.00 H new ATOM 0 HD3 LYS A 136 43.614 12.620 34.857 1.00 0.00 H new ATOM 0 HE2 LYS A 136 45.855 11.606 34.662 1.00 0.00 H new ATOM 0 HE3 LYS A 136 45.007 11.429 33.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 47.389 12.307 33.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 46.232 13.157 32.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 46.760 13.772 33.653 1.00 0.00 H new ATOM 2304 N LYS A 137 41.996 14.506 30.156 1.00 0.00 N ATOM 2305 CA LYS A 137 41.522 13.578 29.137 1.00 0.00 C ATOM 2306 C LYS A 137 42.636 13.255 28.146 1.00 0.00 C ATOM 2307 O LYS A 137 43.599 14.011 28.013 1.00 0.00 O ATOM 2308 CB LYS A 137 40.333 14.188 28.390 1.00 0.00 C ATOM 2309 CG LYS A 137 40.765 15.496 27.725 1.00 0.00 C ATOM 2310 CD LYS A 137 39.576 16.110 26.982 1.00 0.00 C ATOM 2311 CE LYS A 137 39.086 15.136 25.910 1.00 0.00 C ATOM 2312 NZ LYS A 137 40.175 14.898 24.920 1.00 0.00 N ATOM 0 H LYS A 137 42.739 15.132 29.847 1.00 0.00 H new ATOM 0 HA LYS A 137 41.210 12.656 29.628 1.00 0.00 H new ATOM 0 HB2 LYS A 137 39.965 13.490 27.638 1.00 0.00 H new ATOM 0 HB3 LYS A 137 39.511 14.373 29.082 1.00 0.00 H new ATOM 0 HG2 LYS A 137 41.136 16.193 28.477 1.00 0.00 H new ATOM 0 HG3 LYS A 137 41.584 15.310 27.030 1.00 0.00 H new ATOM 0 HD2 LYS A 137 38.771 16.331 27.683 1.00 0.00 H new ATOM 0 HD3 LYS A 137 39.869 17.055 26.524 1.00 0.00 H new ATOM 0 HE2 LYS A 137 38.785 14.194 26.369 1.00 0.00 H new ATOM 0 HE3 LYS A 137 38.207 15.542 25.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 39.796 14.997 23.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 40.935 15.593 25.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 40.555 13.938 25.046 1.00 0.00 H new ATOM 2326 N GLU A 138 42.495 12.134 27.448 1.00 0.00 N ATOM 2327 CA GLU A 138 43.495 11.728 26.466 1.00 0.00 C ATOM 2328 C GLU A 138 42.894 11.755 25.064 1.00 0.00 C ATOM 2329 O GLU A 138 41.740 11.380 24.868 1.00 0.00 O ATOM 2330 CB GLU A 138 43.998 10.319 26.782 1.00 0.00 C ATOM 2331 CG GLU A 138 44.615 10.299 28.182 1.00 0.00 C ATOM 2332 CD GLU A 138 45.870 11.164 28.211 1.00 0.00 C ATOM 2333 OE1 GLU A 138 46.417 11.416 27.149 1.00 0.00 O ATOM 2334 OE2 GLU A 138 46.267 11.561 29.294 1.00 0.00 O ATOM 0 H GLU A 138 41.706 11.495 27.542 1.00 0.00 H new ATOM 0 HA GLU A 138 44.332 12.425 26.510 1.00 0.00 H new ATOM 0 HB2 GLU A 138 43.175 9.606 26.726 1.00 0.00 H new ATOM 0 HB3 GLU A 138 44.737 10.011 26.043 1.00 0.00 H new ATOM 0 HG2 GLU A 138 43.893 10.666 28.912 1.00 0.00 H new ATOM 0 HG3 GLU A 138 44.862 9.276 28.465 1.00 0.00 H new ATOM 2341 N VAL A 139 43.680 12.205 24.093 1.00 0.00 N ATOM 2342 CA VAL A 139 43.201 12.279 22.718 1.00 0.00 C ATOM 2343 C VAL A 139 44.256 11.760 21.749 1.00 0.00 C ATOM 2344 O VAL A 139 45.452 11.985 21.937 1.00 0.00 O ATOM 2345 CB VAL A 139 42.851 13.725 22.365 1.00 0.00 C ATOM 2346 CG1 VAL A 139 44.103 14.596 22.479 1.00 0.00 C ATOM 2347 CG2 VAL A 139 42.316 13.785 20.934 1.00 0.00 C ATOM 0 H VAL A 139 44.640 12.521 24.229 1.00 0.00 H new ATOM 0 HA VAL A 139 42.311 11.656 22.632 1.00 0.00 H new ATOM 0 HB VAL A 139 42.090 14.093 23.053 1.00 0.00 H new ATOM 0 HG11 VAL A 139 43.853 15.627 22.227 1.00 0.00 H new ATOM 0 HG12 VAL A 139 44.484 14.554 23.499 1.00 0.00 H new ATOM 0 HG13 VAL A 139 44.865 14.229 21.792 1.00 0.00 H new ATOM 0 HG21 VAL A 139 42.066 14.816 20.682 1.00 0.00 H new ATOM 0 HG22 VAL A 139 43.077 13.417 20.245 1.00 0.00 H new ATOM 0 HG23 VAL A 139 41.423 13.165 20.853 1.00 0.00 H new ATOM 2357 N ILE A 140 43.804 11.063 20.712 1.00 0.00 N ATOM 2358 CA ILE A 140 44.717 10.513 19.717 1.00 0.00 C ATOM 2359 C ILE A 140 44.165 10.722 18.310 1.00 0.00 C ATOM 2360 O ILE A 140 43.760 9.744 17.702 1.00 0.00 O ATOM 2361 CB ILE A 140 44.925 9.019 19.968 1.00 0.00 C ATOM 2362 CG1 ILE A 140 45.717 8.827 21.264 1.00 0.00 C ATOM 2363 CG2 ILE A 140 45.702 8.407 18.802 1.00 0.00 C ATOM 2364 CD1 ILE A 140 45.690 7.352 21.665 1.00 0.00 C ATOM 2365 OXT ILE A 140 44.154 11.856 17.861 1.00 0.00 O ATOM 0 H ILE A 140 42.818 10.867 20.539 1.00 0.00 H new ATOM 0 HA ILE A 140 45.672 11.032 19.802 1.00 0.00 H new ATOM 0 HB ILE A 140 43.956 8.527 20.055 1.00 0.00 H new ATOM 0 HG12 ILE A 140 46.746 9.158 21.126 1.00 0.00 H new ATOM 0 HG13 ILE A 140 45.289 9.439 22.058 1.00 0.00 H new ATOM 0 HG21 ILE A 140 45.850 7.342 18.982 1.00 0.00 H new ATOM 0 HG22 ILE A 140 45.140 8.544 17.878 1.00 0.00 H new ATOM 0 HG23 ILE A 140 46.671 8.898 18.713 1.00 0.00 H new ATOM 0 HD11 ILE A 140 46.254 7.215 22.588 1.00 0.00 H new ATOM 0 HD12 ILE A 140 44.658 7.036 21.820 1.00 0.00 H new ATOM 0 HD13 ILE A 140 46.138 6.752 20.874 1.00 0.00 H new