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 65 ASN : amide:sc= -2.43! C(o=-1.9!,f=-2.8!) USER MOD Set 1.2: A 66 HIS : no HD1:sc= 0.195 K(o=-1.9,f=-7.6!) USER MOD Set 1.3: A 67 SER OG : rot -114:sc= 0.297 USER MOD Set 2.1: A 51 SER OG : rot 47:sc= -0.349 USER MOD Set 2.2: A 64 SER OG : rot -100:sc= -0.067 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.343 X(o=-0.34,f=-0.34) USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 162:sc= -0.0555 (180deg=-0.463) USER MOD Single : A 39 ASN :FLIP amide:sc= -3.35! C(o=-4.2!,f=-3.4!) 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 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl -148:sc= -0.299 (180deg=-2.09!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 159:sc= -0.392 (180deg=-1.15) USER MOD Single : A 58 LYS NZ :NH3+ -165:sc= -0.0297 (180deg=-0.326) USER MOD Single : A 59 TYR OH : rot -46:sc= -1.51! USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ -164:sc= -0.33 (180deg=-0.714) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ -159:sc= -0.0487 (180deg=-0.55) USER MOD Single : A 90 ASN : amide:sc= -6.52! C(o=-6.5!,f=-11!) USER MOD Single : A 97 ASN : amide:sc= -0.719 X(o=-0.72,f=-0.38!) USER MOD Single : A 98 LYS NZ :NH3+ -129:sc= -3.52! (180deg=-7.2!) USER MOD Single : A 101 LYS NZ :NH3+ 136:sc= -0.0665 (180deg=-0.608) USER MOD Single : A 105 LYS NZ :NH3+ 176:sc= -0.021 (180deg=-0.0533) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ -138:sc= -0.0475 (180deg=-0.386) USER MOD Single : A 114 TYR OH : rot 32:sc= -7.14! USER MOD Single : A 118 ASN : amide:sc= -1.57 K(o=-1.6,f=-7.6!) USER MOD Single : A 120 THR OG1 : rot -120:sc= -4.76! USER MOD Single : A 121 ASN : amide:sc= -0.0846 K(o=-0.085,f=-1.5!) USER MOD Single : A 124 HIS :FLIP no HD1:sc= -0.18 F(o=-1.9!,f=-0.18) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 CYS SG : rot -156:sc= -6.21! 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+ 162:sc= -0.0793 (180deg=-0.538) USER MOD Single : A 134 LYS NZ :NH3+ -152:sc= -10.2! (180deg=-10.4!) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ -160:sc= -0.0601 (180deg=-0.552) USER MOD Single : A 137 LYS NZ :NH3+ -162:sc= -0.0533 (180deg=-0.462) USER MOD ----------------------------------------------------------------- ATOM 409 N ARG A 24 19.138 3.527 0.060 1.00 0.00 N ATOM 410 CA ARG A 24 19.632 2.256 -0.458 1.00 0.00 C ATOM 411 C ARG A 24 21.087 2.037 -0.056 1.00 0.00 C ATOM 412 O ARG A 24 21.468 0.940 0.354 1.00 0.00 O ATOM 413 CB ARG A 24 19.515 2.233 -1.983 1.00 0.00 C ATOM 414 CG ARG A 24 20.024 0.892 -2.515 1.00 0.00 C ATOM 415 CD ARG A 24 19.862 0.850 -4.035 1.00 0.00 C ATOM 416 NE ARG A 24 20.383 -0.405 -4.563 1.00 0.00 N ATOM 417 CZ ARG A 24 20.351 -0.669 -5.865 1.00 0.00 C ATOM 418 NH1 ARG A 24 19.844 0.201 -6.695 1.00 0.00 N ATOM 419 NH2 ARG A 24 20.829 -1.798 -6.314 1.00 0.00 N ATOM 0 HA ARG A 24 19.027 1.455 -0.033 1.00 0.00 H new ATOM 0 HB2 ARG A 24 18.477 2.384 -2.281 1.00 0.00 H new ATOM 0 HB3 ARG A 24 20.093 3.050 -2.415 1.00 0.00 H new ATOM 0 HG2 ARG A 24 21.072 0.757 -2.247 1.00 0.00 H new ATOM 0 HG3 ARG A 24 19.469 0.073 -2.057 1.00 0.00 H new ATOM 0 HD2 ARG A 24 18.810 0.955 -4.299 1.00 0.00 H new ATOM 0 HD3 ARG A 24 20.389 1.690 -4.487 1.00 0.00 H new ATOM 0 HE ARG A 24 20.779 -1.092 -3.922 1.00 0.00 H new ATOM 0 HH11 ARG A 24 19.472 1.084 -6.344 1.00 0.00 H new ATOM 0 HH12 ARG A 24 19.820 -0.002 -7.694 1.00 0.00 H new ATOM 0 HH21 ARG A 24 21.227 -2.477 -5.665 1.00 0.00 H new ATOM 0 HH22 ARG A 24 20.804 -2.001 -7.313 1.00 0.00 H new ATOM 433 N GLU A 25 21.896 3.085 -0.170 1.00 0.00 N ATOM 434 CA GLU A 25 23.306 2.984 0.190 1.00 0.00 C ATOM 435 C GLU A 25 23.454 2.628 1.665 1.00 0.00 C ATOM 436 O GLU A 25 24.285 1.799 2.035 1.00 0.00 O ATOM 437 CB GLU A 25 24.016 4.311 -0.091 1.00 0.00 C ATOM 438 CG GLU A 25 25.500 4.177 0.254 1.00 0.00 C ATOM 439 CD GLU A 25 26.231 5.477 -0.069 1.00 0.00 C ATOM 440 OE1 GLU A 25 25.581 6.399 -0.532 1.00 0.00 O ATOM 441 OE2 GLU A 25 27.429 5.531 0.153 1.00 0.00 O ATOM 0 H GLU A 25 21.605 4.003 -0.505 1.00 0.00 H new ATOM 0 HA GLU A 25 23.761 2.197 -0.412 1.00 0.00 H new ATOM 0 HB2 GLU A 25 23.898 4.584 -1.140 1.00 0.00 H new ATOM 0 HB3 GLU A 25 23.565 5.109 0.499 1.00 0.00 H new ATOM 0 HG2 GLU A 25 25.616 3.938 1.311 1.00 0.00 H new ATOM 0 HG3 GLU A 25 25.940 3.354 -0.309 1.00 0.00 H new ATOM 448 N TYR A 26 22.639 3.260 2.504 1.00 0.00 N ATOM 449 CA TYR A 26 22.684 3.002 3.939 1.00 0.00 C ATOM 450 C TYR A 26 22.274 1.562 4.238 1.00 0.00 C ATOM 451 O TYR A 26 22.837 0.918 5.124 1.00 0.00 O ATOM 452 CB TYR A 26 21.747 3.963 4.674 1.00 0.00 C ATOM 453 CG TYR A 26 22.319 5.359 4.624 1.00 0.00 C ATOM 454 CD1 TYR A 26 21.974 6.220 3.577 1.00 0.00 C ATOM 455 CD2 TYR A 26 23.196 5.792 5.627 1.00 0.00 C ATOM 456 CE1 TYR A 26 22.505 7.515 3.530 1.00 0.00 C ATOM 457 CE2 TYR A 26 23.726 7.087 5.581 1.00 0.00 C ATOM 458 CZ TYR A 26 23.380 7.948 4.533 1.00 0.00 C ATOM 459 OH TYR A 26 23.904 9.224 4.488 1.00 0.00 O ATOM 0 H TYR A 26 21.944 3.950 2.218 1.00 0.00 H new ATOM 0 HA TYR A 26 23.706 3.157 4.284 1.00 0.00 H new ATOM 0 HB2 TYR A 26 20.759 3.947 4.215 1.00 0.00 H new ATOM 0 HB3 TYR A 26 21.623 3.646 5.709 1.00 0.00 H new ATOM 0 HD1 TYR A 26 21.298 5.886 2.804 1.00 0.00 H new ATOM 0 HD2 TYR A 26 23.463 5.127 6.435 1.00 0.00 H new ATOM 0 HE1 TYR A 26 22.240 8.179 2.721 1.00 0.00 H new ATOM 0 HE2 TYR A 26 24.402 7.422 6.354 1.00 0.00 H new ATOM 0 HH TYR A 26 24.492 9.364 5.260 1.00 0.00 H new ATOM 469 N ALA A 27 21.289 1.066 3.496 1.00 0.00 N ATOM 470 CA ALA A 27 20.811 -0.298 3.693 1.00 0.00 C ATOM 471 C ALA A 27 21.933 -1.300 3.445 1.00 0.00 C ATOM 472 O ALA A 27 22.067 -2.288 4.168 1.00 0.00 O ATOM 473 CB ALA A 27 19.647 -0.586 2.743 1.00 0.00 C ATOM 0 H ALA A 27 20.810 1.583 2.759 1.00 0.00 H new ATOM 0 HA ALA A 27 20.471 -0.399 4.724 1.00 0.00 H new ATOM 0 HB1 ALA A 27 19.296 -1.606 2.897 1.00 0.00 H new ATOM 0 HB2 ALA A 27 18.833 0.111 2.942 1.00 0.00 H new ATOM 0 HB3 ALA A 27 19.981 -0.468 1.712 1.00 0.00 H new ATOM 479 N GLN A 28 22.739 -1.040 2.420 1.00 0.00 N ATOM 480 CA GLN A 28 23.849 -1.927 2.092 1.00 0.00 C ATOM 481 C GLN A 28 24.854 -1.967 3.238 1.00 0.00 C ATOM 482 O GLN A 28 25.393 -3.023 3.568 1.00 0.00 O ATOM 483 CB GLN A 28 24.544 -1.447 0.817 1.00 0.00 C ATOM 484 CG GLN A 28 23.620 -1.669 -0.383 1.00 0.00 C ATOM 485 CD GLN A 28 23.284 -3.151 -0.515 1.00 0.00 C ATOM 486 OE1 GLN A 28 22.119 -3.535 -0.413 1.00 0.00 O ATOM 487 NE2 GLN A 28 24.240 -4.010 -0.735 1.00 0.00 N ATOM 0 H GLN A 28 22.646 -0.230 1.807 1.00 0.00 H new ATOM 0 HA GLN A 28 23.454 -2.930 1.932 1.00 0.00 H new ATOM 0 HB2 GLN A 28 24.797 -0.390 0.904 1.00 0.00 H new ATOM 0 HB3 GLN A 28 25.479 -1.988 0.674 1.00 0.00 H new ATOM 0 HG2 GLN A 28 22.705 -1.090 -0.260 1.00 0.00 H new ATOM 0 HG3 GLN A 28 24.102 -1.314 -1.294 1.00 0.00 H new ATOM 0 HE21 GLN A 28 25.205 -3.689 -0.819 1.00 0.00 H new ATOM 0 HE22 GLN A 28 24.023 -5.003 -0.823 1.00 0.00 H new ATOM 496 N GLU A 29 25.098 -0.809 3.842 1.00 0.00 N ATOM 497 CA GLU A 29 26.038 -0.720 4.952 1.00 0.00 C ATOM 498 C GLU A 29 25.563 -1.571 6.125 1.00 0.00 C ATOM 499 O GLU A 29 26.356 -2.263 6.763 1.00 0.00 O ATOM 500 CB GLU A 29 26.181 0.736 5.402 1.00 0.00 C ATOM 501 CG GLU A 29 27.169 0.817 6.567 1.00 0.00 C ATOM 502 CD GLU A 29 28.549 0.358 6.112 1.00 0.00 C ATOM 503 OE1 GLU A 29 28.786 0.355 4.915 1.00 0.00 O ATOM 504 OE2 GLU A 29 29.349 0.015 6.966 1.00 0.00 O ATOM 0 H GLU A 29 24.661 0.076 3.583 1.00 0.00 H new ATOM 0 HA GLU A 29 27.005 -1.092 4.614 1.00 0.00 H new ATOM 0 HB2 GLU A 29 26.530 1.351 4.573 1.00 0.00 H new ATOM 0 HB3 GLU A 29 25.211 1.130 5.706 1.00 0.00 H new ATOM 0 HG2 GLU A 29 27.221 1.840 6.940 1.00 0.00 H new ATOM 0 HG3 GLU A 29 26.823 0.194 7.392 1.00 0.00 H new ATOM 511 N MET A 30 24.265 -1.514 6.404 1.00 0.00 N ATOM 512 CA MET A 30 23.695 -2.283 7.503 1.00 0.00 C ATOM 513 C MET A 30 23.872 -3.779 7.260 1.00 0.00 C ATOM 514 O MET A 30 24.178 -4.534 8.182 1.00 0.00 O ATOM 515 CB MET A 30 22.207 -1.962 7.651 1.00 0.00 C ATOM 516 CG MET A 30 22.042 -0.533 8.169 1.00 0.00 C ATOM 517 SD MET A 30 22.784 -0.399 9.815 1.00 0.00 S ATOM 518 CE MET A 30 22.463 1.364 10.066 1.00 0.00 C ATOM 0 H MET A 30 23.592 -0.947 5.888 1.00 0.00 H new ATOM 0 HA MET A 30 24.218 -2.010 8.420 1.00 0.00 H new ATOM 0 HB2 MET A 30 21.703 -2.072 6.691 1.00 0.00 H new ATOM 0 HB3 MET A 30 21.739 -2.666 8.339 1.00 0.00 H new ATOM 0 HG2 MET A 30 22.518 0.170 7.485 1.00 0.00 H new ATOM 0 HG3 MET A 30 20.985 -0.270 8.212 1.00 0.00 H new ATOM 0 HE1 MET A 30 22.846 1.668 11.040 1.00 0.00 H new ATOM 0 HE2 MET A 30 22.960 1.939 9.285 1.00 0.00 H new ATOM 0 HE3 MET A 30 21.389 1.548 10.025 1.00 0.00 H new ATOM 528 N ASP A 31 23.681 -4.199 6.014 1.00 0.00 N ATOM 529 CA ASP A 31 23.827 -5.607 5.666 1.00 0.00 C ATOM 530 C ASP A 31 25.253 -6.074 5.932 1.00 0.00 C ATOM 531 O ASP A 31 25.474 -7.182 6.422 1.00 0.00 O ATOM 532 CB ASP A 31 23.484 -5.820 4.190 1.00 0.00 C ATOM 533 CG ASP A 31 21.983 -5.661 3.975 1.00 0.00 C ATOM 534 OD1 ASP A 31 21.262 -5.648 4.959 1.00 0.00 O ATOM 535 OD2 ASP A 31 21.576 -5.554 2.830 1.00 0.00 O ATOM 0 H ASP A 31 23.427 -3.591 5.235 1.00 0.00 H new ATOM 0 HA ASP A 31 23.143 -6.189 6.283 1.00 0.00 H new ATOM 0 HB2 ASP A 31 24.026 -5.102 3.575 1.00 0.00 H new ATOM 0 HB3 ASP A 31 23.802 -6.814 3.874 1.00 0.00 H new ATOM 540 N ARG A 32 26.218 -5.219 5.609 1.00 0.00 N ATOM 541 CA ARG A 32 27.622 -5.549 5.821 1.00 0.00 C ATOM 542 C ARG A 32 27.899 -5.781 7.302 1.00 0.00 C ATOM 543 O ARG A 32 28.593 -6.726 7.674 1.00 0.00 O ATOM 544 CB ARG A 32 28.510 -4.415 5.305 1.00 0.00 C ATOM 545 CG ARG A 32 29.981 -4.787 5.501 1.00 0.00 C ATOM 546 CD ARG A 32 30.868 -3.678 4.938 1.00 0.00 C ATOM 547 NE ARG A 32 32.275 -4.005 5.139 1.00 0.00 N ATOM 548 CZ ARG A 32 33.237 -3.188 4.725 1.00 0.00 C ATOM 549 NH1 ARG A 32 32.931 -2.069 4.127 1.00 0.00 N ATOM 550 NH2 ARG A 32 34.489 -3.504 4.916 1.00 0.00 N ATOM 0 H ARG A 32 26.055 -4.298 5.202 1.00 0.00 H new ATOM 0 HA ARG A 32 27.847 -6.464 5.273 1.00 0.00 H new ATOM 0 HB2 ARG A 32 28.308 -4.232 4.250 1.00 0.00 H new ATOM 0 HB3 ARG A 32 28.284 -3.491 5.837 1.00 0.00 H new ATOM 0 HG2 ARG A 32 30.192 -4.933 6.560 1.00 0.00 H new ATOM 0 HG3 ARG A 32 30.198 -5.730 5.000 1.00 0.00 H new ATOM 0 HD2 ARG A 32 30.666 -3.546 3.875 1.00 0.00 H new ATOM 0 HD3 ARG A 32 30.634 -2.732 5.427 1.00 0.00 H new ATOM 0 HE ARG A 32 32.525 -4.877 5.606 1.00 0.00 H new ATOM 0 HH11 ARG A 32 31.953 -1.822 3.977 1.00 0.00 H new ATOM 0 HH12 ARG A 32 33.670 -1.442 3.809 1.00 0.00 H new ATOM 0 HH21 ARG A 32 34.729 -4.378 5.383 1.00 0.00 H new ATOM 0 HH22 ARG A 32 35.228 -2.877 4.598 1.00 0.00 H new ATOM 564 N LEU A 33 27.352 -4.909 8.143 1.00 0.00 N ATOM 565 CA LEU A 33 27.546 -5.025 9.584 1.00 0.00 C ATOM 566 C LEU A 33 26.951 -6.329 10.101 1.00 0.00 C ATOM 567 O LEU A 33 27.532 -6.989 10.963 1.00 0.00 O ATOM 568 CB LEU A 33 26.888 -3.842 10.297 1.00 0.00 C ATOM 569 CG LEU A 33 27.668 -2.563 9.990 1.00 0.00 C ATOM 570 CD1 LEU A 33 26.892 -1.354 10.515 1.00 0.00 C ATOM 571 CD2 LEU A 33 29.036 -2.625 10.673 1.00 0.00 C ATOM 0 H LEU A 33 26.775 -4.119 7.854 1.00 0.00 H new ATOM 0 HA LEU A 33 28.617 -5.022 9.789 1.00 0.00 H new ATOM 0 HB2 LEU A 33 25.853 -3.737 9.971 1.00 0.00 H new ATOM 0 HB3 LEU A 33 26.867 -4.018 11.372 1.00 0.00 H new ATOM 0 HG LEU A 33 27.802 -2.469 8.912 1.00 0.00 H new ATOM 0 HD11 LEU A 33 27.448 -0.442 10.296 1.00 0.00 H new ATOM 0 HD12 LEU A 33 25.917 -1.309 10.031 1.00 0.00 H new ATOM 0 HD13 LEU A 33 26.758 -1.448 11.593 1.00 0.00 H new ATOM 0 HD21 LEU A 33 29.593 -1.714 10.455 1.00 0.00 H new ATOM 0 HD22 LEU A 33 28.901 -2.719 11.751 1.00 0.00 H new ATOM 0 HD23 LEU A 33 29.590 -3.487 10.301 1.00 0.00 H new ATOM 583 N GLU A 34 25.789 -6.698 9.570 1.00 0.00 N ATOM 584 CA GLU A 34 25.130 -7.929 9.990 1.00 0.00 C ATOM 585 C GLU A 34 26.002 -9.136 9.664 1.00 0.00 C ATOM 586 O GLU A 34 26.116 -10.065 10.464 1.00 0.00 O ATOM 587 CB GLU A 34 23.780 -8.065 9.284 1.00 0.00 C ATOM 588 CG GLU A 34 22.808 -7.019 9.832 1.00 0.00 C ATOM 589 CD GLU A 34 21.518 -7.028 9.018 1.00 0.00 C ATOM 590 OE1 GLU A 34 21.509 -7.648 7.968 1.00 0.00 O ATOM 591 OE2 GLU A 34 20.559 -6.414 9.456 1.00 0.00 O ATOM 0 H GLU A 34 25.289 -6.168 8.856 1.00 0.00 H new ATOM 0 HA GLU A 34 24.972 -7.888 11.068 1.00 0.00 H new ATOM 0 HB2 GLU A 34 23.905 -7.933 8.209 1.00 0.00 H new ATOM 0 HB3 GLU A 34 23.377 -9.066 9.437 1.00 0.00 H new ATOM 0 HG2 GLU A 34 22.588 -7.228 10.879 1.00 0.00 H new ATOM 0 HG3 GLU A 34 23.265 -6.030 9.793 1.00 0.00 H new ATOM 598 N LYS A 35 26.629 -9.110 8.492 1.00 0.00 N ATOM 599 CA LYS A 35 27.501 -10.204 8.084 1.00 0.00 C ATOM 600 C LYS A 35 28.656 -10.338 9.067 1.00 0.00 C ATOM 601 O LYS A 35 29.003 -11.440 9.494 1.00 0.00 O ATOM 602 CB LYS A 35 28.047 -9.944 6.679 1.00 0.00 C ATOM 603 CG LYS A 35 28.946 -11.107 6.256 1.00 0.00 C ATOM 604 CD LYS A 35 29.469 -10.860 4.839 1.00 0.00 C ATOM 605 CE LYS A 35 30.416 -11.993 4.439 1.00 0.00 C ATOM 606 NZ LYS A 35 29.667 -13.281 4.418 1.00 0.00 N ATOM 0 H LYS A 35 26.551 -8.351 7.815 1.00 0.00 H new ATOM 0 HA LYS A 35 26.926 -11.130 8.076 1.00 0.00 H new ATOM 0 HB2 LYS A 35 27.224 -9.831 5.973 1.00 0.00 H new ATOM 0 HB3 LYS A 35 28.610 -9.011 6.663 1.00 0.00 H new ATOM 0 HG2 LYS A 35 29.780 -11.207 6.951 1.00 0.00 H new ATOM 0 HG3 LYS A 35 28.388 -12.043 6.291 1.00 0.00 H new ATOM 0 HD2 LYS A 35 28.637 -10.803 4.138 1.00 0.00 H new ATOM 0 HD3 LYS A 35 29.990 -9.904 4.794 1.00 0.00 H new ATOM 0 HE2 LYS A 35 30.845 -11.793 3.457 1.00 0.00 H new ATOM 0 HE3 LYS A 35 31.246 -12.054 5.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 30.201 -13.984 3.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 29.542 -13.626 5.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 28.735 -13.134 3.980 1.00 0.00 H new ATOM 620 N ALA A 36 29.236 -9.200 9.431 1.00 0.00 N ATOM 621 CA ALA A 36 30.344 -9.178 10.377 1.00 0.00 C ATOM 622 C ALA A 36 29.899 -9.734 11.725 1.00 0.00 C ATOM 623 O ALA A 36 30.654 -10.429 12.400 1.00 0.00 O ATOM 624 CB ALA A 36 30.852 -7.746 10.554 1.00 0.00 C ATOM 0 H ALA A 36 28.957 -8.282 9.085 1.00 0.00 H new ATOM 0 HA ALA A 36 31.149 -9.800 9.985 1.00 0.00 H new ATOM 0 HB1 ALA A 36 31.680 -7.739 11.263 1.00 0.00 H new ATOM 0 HB2 ALA A 36 31.193 -7.360 9.594 1.00 0.00 H new ATOM 0 HB3 ALA A 36 30.045 -7.118 10.932 1.00 0.00 H new ATOM 630 N PHE A 37 28.667 -9.408 12.106 1.00 0.00 N ATOM 631 CA PHE A 37 28.111 -9.861 13.379 1.00 0.00 C ATOM 632 C PHE A 37 28.109 -11.384 13.474 1.00 0.00 C ATOM 633 O PHE A 37 28.511 -11.951 14.490 1.00 0.00 O ATOM 634 CB PHE A 37 26.680 -9.343 13.531 1.00 0.00 C ATOM 635 CG PHE A 37 26.091 -9.866 14.819 1.00 0.00 C ATOM 636 CD1 PHE A 37 26.429 -9.265 16.039 1.00 0.00 C ATOM 637 CD2 PHE A 37 25.206 -10.951 14.795 1.00 0.00 C ATOM 638 CE1 PHE A 37 25.882 -9.750 17.233 1.00 0.00 C ATOM 639 CE2 PHE A 37 24.661 -11.436 15.989 1.00 0.00 C ATOM 640 CZ PHE A 37 24.999 -10.836 17.208 1.00 0.00 C ATOM 0 H PHE A 37 28.034 -8.832 11.552 1.00 0.00 H new ATOM 0 HA PHE A 37 28.738 -9.467 14.179 1.00 0.00 H new ATOM 0 HB2 PHE A 37 26.674 -8.253 13.532 1.00 0.00 H new ATOM 0 HB3 PHE A 37 26.073 -9.664 12.684 1.00 0.00 H new ATOM 0 HD1 PHE A 37 27.111 -8.428 16.058 1.00 0.00 H new ATOM 0 HD2 PHE A 37 24.944 -11.413 13.855 1.00 0.00 H new ATOM 0 HE1 PHE A 37 26.141 -9.286 18.173 1.00 0.00 H new ATOM 0 HE2 PHE A 37 23.979 -12.273 15.970 1.00 0.00 H new ATOM 0 HZ PHE A 37 24.578 -11.211 18.129 1.00 0.00 H new ATOM 650 N GLU A 38 27.640 -12.041 12.420 1.00 0.00 N ATOM 651 CA GLU A 38 27.577 -13.499 12.408 1.00 0.00 C ATOM 652 C GLU A 38 28.965 -14.106 12.594 1.00 0.00 C ATOM 653 O GLU A 38 29.127 -15.098 13.307 1.00 0.00 O ATOM 654 CB GLU A 38 26.978 -13.983 11.087 1.00 0.00 C ATOM 655 CG GLU A 38 26.741 -15.492 11.158 1.00 0.00 C ATOM 656 CD GLU A 38 28.034 -16.239 10.851 1.00 0.00 C ATOM 657 OE1 GLU A 38 28.864 -15.681 10.151 1.00 0.00 O ATOM 658 OE2 GLU A 38 28.175 -17.356 11.319 1.00 0.00 O ATOM 0 H GLU A 38 27.300 -11.593 11.569 1.00 0.00 H new ATOM 0 HA GLU A 38 26.945 -13.820 13.236 1.00 0.00 H new ATOM 0 HB2 GLU A 38 26.039 -13.465 10.890 1.00 0.00 H new ATOM 0 HB3 GLU A 38 27.651 -13.748 10.262 1.00 0.00 H new ATOM 0 HG2 GLU A 38 26.380 -15.765 12.150 1.00 0.00 H new ATOM 0 HG3 GLU A 38 25.967 -15.781 10.447 1.00 0.00 H new ATOM 665 N ASN A 39 29.962 -13.509 11.954 1.00 0.00 N ATOM 666 CA ASN A 39 31.332 -14.002 12.061 1.00 0.00 C ATOM 667 C ASN A 39 32.114 -13.176 13.077 1.00 0.00 C ATOM 668 O ASN A 39 33.340 -13.260 13.153 1.00 0.00 O ATOM 669 CB ASN A 39 32.025 -13.928 10.699 1.00 0.00 C ATOM 670 CG ASN A 39 31.288 -14.801 9.690 1.00 0.00 C ATOM 671 OD1 ASN A 39 31.175 -16.082 9.910 1.00 0.00 O flip ATOM 672 ND2 ASN A 39 30.804 -14.304 8.673 1.00 0.00 N flip ATOM 0 H ASN A 39 29.851 -12.688 11.359 1.00 0.00 H new ATOM 0 HA ASN A 39 31.301 -15.040 12.394 1.00 0.00 H new ATOM 0 HB2 ASN A 39 32.049 -12.896 10.350 1.00 0.00 H new ATOM 0 HB3 ASN A 39 33.060 -14.258 10.790 1.00 0.00 H new ATOM 0 HD21 ASN A 39 30.893 -13.302 8.503 1.00 0.00 H new ATOM 0 HD22 ASN A 39 30.314 -14.894 8.001 1.00 0.00 H new ATOM 679 N LEU A 40 31.392 -12.371 13.849 1.00 0.00 N ATOM 680 CA LEU A 40 32.017 -11.519 14.853 1.00 0.00 C ATOM 681 C LEU A 40 32.036 -12.193 16.222 1.00 0.00 C ATOM 682 O LEU A 40 31.239 -11.861 17.100 1.00 0.00 O ATOM 683 CB LEU A 40 31.255 -10.198 14.944 1.00 0.00 C ATOM 684 CG LEU A 40 32.103 -9.077 14.344 1.00 0.00 C ATOM 685 CD1 LEU A 40 31.214 -7.870 14.039 1.00 0.00 C ATOM 686 CD2 LEU A 40 33.186 -8.672 15.344 1.00 0.00 C ATOM 0 H LEU A 40 30.376 -12.291 13.799 1.00 0.00 H new ATOM 0 HA LEU A 40 33.048 -11.337 14.551 1.00 0.00 H new ATOM 0 HB2 LEU A 40 30.307 -10.276 14.412 1.00 0.00 H new ATOM 0 HB3 LEU A 40 31.019 -9.973 15.984 1.00 0.00 H new ATOM 0 HG LEU A 40 32.568 -9.426 13.422 1.00 0.00 H new ATOM 0 HD11 LEU A 40 31.820 -7.071 13.611 1.00 0.00 H new ATOM 0 HD12 LEU A 40 30.440 -8.159 13.328 1.00 0.00 H new ATOM 0 HD13 LEU A 40 30.748 -7.519 14.960 1.00 0.00 H new ATOM 0 HD21 LEU A 40 33.793 -7.872 14.919 1.00 0.00 H new ATOM 0 HD22 LEU A 40 32.719 -8.323 16.265 1.00 0.00 H new ATOM 0 HD23 LEU A 40 33.820 -9.532 15.562 1.00 0.00 H new ATOM 698 N ASP A 41 32.956 -13.134 16.397 1.00 0.00 N ATOM 699 CA ASP A 41 33.084 -13.845 17.664 1.00 0.00 C ATOM 700 C ASP A 41 33.571 -12.910 18.769 1.00 0.00 C ATOM 701 O ASP A 41 34.576 -12.216 18.608 1.00 0.00 O ATOM 702 CB ASP A 41 34.064 -15.009 17.511 1.00 0.00 C ATOM 703 CG ASP A 41 34.122 -15.813 18.805 1.00 0.00 C ATOM 704 OD1 ASP A 41 33.549 -15.366 19.784 1.00 0.00 O ATOM 705 OD2 ASP A 41 34.739 -16.866 18.797 1.00 0.00 O ATOM 0 H ASP A 41 33.622 -13.422 15.681 1.00 0.00 H new ATOM 0 HA ASP A 41 32.101 -14.227 17.940 1.00 0.00 H new ATOM 0 HB2 ASP A 41 33.753 -15.652 16.687 1.00 0.00 H new ATOM 0 HB3 ASP A 41 35.056 -14.631 17.263 1.00 0.00 H new ATOM 710 N GLY A 42 32.862 -12.904 19.895 1.00 0.00 N ATOM 711 CA GLY A 42 33.241 -12.060 21.026 1.00 0.00 C ATOM 712 C GLY A 42 32.721 -10.635 20.864 1.00 0.00 C ATOM 713 O GLY A 42 32.980 -9.775 21.708 1.00 0.00 O ATOM 0 H GLY A 42 32.027 -13.470 20.049 1.00 0.00 H new ATOM 0 HA2 GLY A 42 32.848 -12.488 21.948 1.00 0.00 H new ATOM 0 HA3 GLY A 42 34.327 -12.043 21.120 1.00 0.00 H new ATOM 717 N TRP A 43 31.986 -10.390 19.784 1.00 0.00 N ATOM 718 CA TRP A 43 31.433 -9.063 19.531 1.00 0.00 C ATOM 719 C TRP A 43 29.911 -9.114 19.481 1.00 0.00 C ATOM 720 O TRP A 43 29.331 -10.087 18.999 1.00 0.00 O ATOM 721 CB TRP A 43 31.943 -8.516 18.201 1.00 0.00 C ATOM 722 CG TRP A 43 33.401 -8.203 18.283 1.00 0.00 C ATOM 723 CD1 TRP A 43 34.395 -9.067 17.980 1.00 0.00 C ATOM 724 CD2 TRP A 43 34.045 -6.953 18.665 1.00 0.00 C ATOM 725 NE1 TRP A 43 35.608 -8.430 18.156 1.00 0.00 N ATOM 726 CE2 TRP A 43 35.446 -7.125 18.579 1.00 0.00 C ATOM 727 CE3 TRP A 43 33.554 -5.701 19.077 1.00 0.00 C ATOM 728 CZ2 TRP A 43 36.330 -6.092 18.889 1.00 0.00 C ATOM 729 CZ3 TRP A 43 34.442 -4.657 19.390 1.00 0.00 C ATOM 730 CH2 TRP A 43 35.828 -4.853 19.296 1.00 0.00 C ATOM 0 H TRP A 43 31.760 -11.087 19.074 1.00 0.00 H new ATOM 0 HA TRP A 43 31.751 -8.412 20.345 1.00 0.00 H new ATOM 0 HB2 TRP A 43 31.767 -9.245 17.410 1.00 0.00 H new ATOM 0 HB3 TRP A 43 31.387 -7.617 17.935 1.00 0.00 H new ATOM 0 HD1 TRP A 43 34.263 -10.088 17.654 1.00 0.00 H new ATOM 0 HE1 TRP A 43 36.514 -8.870 17.993 1.00 0.00 H new ATOM 0 HE3 TRP A 43 32.489 -5.541 19.153 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 37.396 -6.249 18.815 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 34.055 -3.699 19.704 1.00 0.00 H new ATOM 0 HH2 TRP A 43 36.506 -4.048 19.538 1.00 0.00 H new ATOM 741 N TYR A 44 29.270 -8.064 19.981 1.00 0.00 N ATOM 742 CA TYR A 44 27.814 -8.010 19.984 1.00 0.00 C ATOM 743 C TYR A 44 27.324 -6.667 19.448 1.00 0.00 C ATOM 744 O TYR A 44 27.937 -5.628 19.693 1.00 0.00 O ATOM 745 CB TYR A 44 27.308 -8.223 21.409 1.00 0.00 C ATOM 746 CG TYR A 44 27.791 -9.569 21.885 1.00 0.00 C ATOM 747 CD1 TYR A 44 29.072 -9.689 22.433 1.00 0.00 C ATOM 748 CD2 TYR A 44 26.973 -10.697 21.760 1.00 0.00 C ATOM 749 CE1 TYR A 44 29.537 -10.936 22.860 1.00 0.00 C ATOM 750 CE2 TYR A 44 27.438 -11.947 22.185 1.00 0.00 C ATOM 751 CZ TYR A 44 28.721 -12.067 22.736 1.00 0.00 C ATOM 752 OH TYR A 44 29.181 -13.299 23.155 1.00 0.00 O ATOM 0 H TYR A 44 29.729 -7.248 20.385 1.00 0.00 H new ATOM 0 HA TYR A 44 27.426 -8.796 19.336 1.00 0.00 H new ATOM 0 HB2 TYR A 44 27.676 -7.434 22.065 1.00 0.00 H new ATOM 0 HB3 TYR A 44 26.219 -8.179 21.436 1.00 0.00 H new ATOM 0 HD1 TYR A 44 29.703 -8.817 22.526 1.00 0.00 H new ATOM 0 HD2 TYR A 44 25.984 -10.603 21.336 1.00 0.00 H new ATOM 0 HE1 TYR A 44 30.525 -11.027 23.285 1.00 0.00 H new ATOM 0 HE2 TYR A 44 26.808 -12.819 22.088 1.00 0.00 H new ATOM 0 HH TYR A 44 28.490 -13.976 22.999 1.00 0.00 H new ATOM 762 N LEU A 45 26.214 -6.698 18.718 1.00 0.00 N ATOM 763 CA LEU A 45 25.647 -5.479 18.152 1.00 0.00 C ATOM 764 C LEU A 45 24.284 -5.185 18.766 1.00 0.00 C ATOM 765 O LEU A 45 23.446 -6.077 18.896 1.00 0.00 O ATOM 766 CB LEU A 45 25.495 -5.628 16.636 1.00 0.00 C ATOM 767 CG LEU A 45 26.866 -5.840 15.996 1.00 0.00 C ATOM 768 CD1 LEU A 45 26.692 -6.142 14.507 1.00 0.00 C ATOM 769 CD2 LEU A 45 27.702 -4.570 16.154 1.00 0.00 C ATOM 0 H LEU A 45 25.692 -7.548 18.505 1.00 0.00 H new ATOM 0 HA LEU A 45 26.323 -4.653 18.374 1.00 0.00 H new ATOM 0 HB2 LEU A 45 24.843 -6.471 16.408 1.00 0.00 H new ATOM 0 HB3 LEU A 45 25.023 -4.738 16.220 1.00 0.00 H new ATOM 0 HG LEU A 45 27.368 -6.675 16.484 1.00 0.00 H new ATOM 0 HD11 LEU A 45 27.670 -6.293 14.050 1.00 0.00 H new ATOM 0 HD12 LEU A 45 26.092 -7.044 14.386 1.00 0.00 H new ATOM 0 HD13 LEU A 45 26.190 -5.305 14.022 1.00 0.00 H new ATOM 0 HD21 LEU A 45 28.681 -4.720 15.698 1.00 0.00 H new ATOM 0 HD22 LEU A 45 27.196 -3.738 15.664 1.00 0.00 H new ATOM 0 HD23 LEU A 45 27.826 -4.345 17.213 1.00 0.00 H new ATOM 781 N SER A 46 24.060 -3.926 19.126 1.00 0.00 N ATOM 782 CA SER A 46 22.785 -3.529 19.707 1.00 0.00 C ATOM 783 C SER A 46 22.127 -2.458 18.846 1.00 0.00 C ATOM 784 O SER A 46 22.750 -1.446 18.517 1.00 0.00 O ATOM 785 CB SER A 46 22.998 -2.992 21.122 1.00 0.00 C ATOM 786 OG SER A 46 21.756 -2.541 21.646 1.00 0.00 O ATOM 0 H SER A 46 24.738 -3.170 19.027 1.00 0.00 H new ATOM 0 HA SER A 46 22.134 -4.402 19.750 1.00 0.00 H new ATOM 0 HB2 SER A 46 23.413 -3.772 21.760 1.00 0.00 H new ATOM 0 HB3 SER A 46 23.718 -2.174 21.108 1.00 0.00 H new ATOM 0 HG SER A 46 21.889 -2.198 22.554 1.00 0.00 H new ATOM 792 N SER A 47 20.867 -2.689 18.486 1.00 0.00 N ATOM 793 CA SER A 47 20.124 -1.742 17.661 1.00 0.00 C ATOM 794 C SER A 47 19.948 -0.413 18.388 1.00 0.00 C ATOM 795 O SER A 47 20.144 0.654 17.807 1.00 0.00 O ATOM 796 CB SER A 47 18.752 -2.319 17.313 1.00 0.00 C ATOM 797 OG SER A 47 18.039 -1.383 16.515 1.00 0.00 O ATOM 0 H SER A 47 20.341 -3.521 18.752 1.00 0.00 H new ATOM 0 HA SER A 47 20.690 -1.568 16.746 1.00 0.00 H new ATOM 0 HB2 SER A 47 18.866 -3.260 16.776 1.00 0.00 H new ATOM 0 HB3 SER A 47 18.195 -2.537 18.224 1.00 0.00 H new ATOM 0 HG SER A 47 17.159 -1.750 16.288 1.00 0.00 H new ATOM 803 N MET A 48 19.576 -0.489 19.662 1.00 0.00 N ATOM 804 CA MET A 48 19.374 0.714 20.462 1.00 0.00 C ATOM 805 C MET A 48 20.669 1.511 20.557 1.00 0.00 C ATOM 806 O MET A 48 20.672 2.733 20.413 1.00 0.00 O ATOM 807 CB MET A 48 18.900 0.335 21.866 1.00 0.00 C ATOM 808 CG MET A 48 18.635 1.604 22.676 1.00 0.00 C ATOM 809 SD MET A 48 17.209 2.476 21.982 1.00 0.00 S ATOM 810 CE MET A 48 18.085 3.975 21.473 1.00 0.00 C ATOM 0 H MET A 48 19.409 -1.364 20.160 1.00 0.00 H new ATOM 0 HA MET A 48 18.615 1.329 19.979 1.00 0.00 H new ATOM 0 HB2 MET A 48 17.993 -0.266 21.805 1.00 0.00 H new ATOM 0 HB3 MET A 48 19.654 -0.275 22.363 1.00 0.00 H new ATOM 0 HG2 MET A 48 18.447 1.350 23.719 1.00 0.00 H new ATOM 0 HG3 MET A 48 19.513 2.249 22.659 1.00 0.00 H new ATOM 0 HE1 MET A 48 17.416 4.832 21.551 1.00 0.00 H new ATOM 0 HE2 MET A 48 18.949 4.129 22.120 1.00 0.00 H new ATOM 0 HE3 MET A 48 18.419 3.869 20.441 1.00 0.00 H new ATOM 820 N LYS A 49 21.766 0.807 20.802 1.00 0.00 N ATOM 821 CA LYS A 49 23.066 1.452 20.917 1.00 0.00 C ATOM 822 C LYS A 49 23.966 1.044 19.755 1.00 0.00 C ATOM 823 O LYS A 49 25.162 0.833 19.942 1.00 0.00 O ATOM 824 CB LYS A 49 23.728 1.054 22.238 1.00 0.00 C ATOM 825 CG LYS A 49 22.788 1.384 23.399 1.00 0.00 C ATOM 826 CD LYS A 49 22.533 2.892 23.438 1.00 0.00 C ATOM 827 CE LYS A 49 21.618 3.225 24.617 1.00 0.00 C ATOM 828 NZ LYS A 49 21.357 4.691 24.644 1.00 0.00 N ATOM 0 H LYS A 49 21.782 -0.206 20.924 1.00 0.00 H new ATOM 0 HA LYS A 49 22.922 2.532 20.892 1.00 0.00 H new ATOM 0 HB2 LYS A 49 23.959 -0.011 22.235 1.00 0.00 H new ATOM 0 HB3 LYS A 49 24.672 1.585 22.358 1.00 0.00 H new ATOM 0 HG2 LYS A 49 21.846 0.848 23.281 1.00 0.00 H new ATOM 0 HG3 LYS A 49 23.227 1.054 24.341 1.00 0.00 H new ATOM 0 HD2 LYS A 49 23.477 3.429 23.534 1.00 0.00 H new ATOM 0 HD3 LYS A 49 22.074 3.218 22.505 1.00 0.00 H new ATOM 0 HE2 LYS A 49 20.679 2.679 24.528 1.00 0.00 H new ATOM 0 HE3 LYS A 49 22.082 2.910 25.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 20.735 4.918 25.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 22.257 5.202 24.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 20.897 4.978 23.757 1.00 0.00 H new ATOM 842 N ASP A 50 23.373 0.933 18.564 1.00 0.00 N ATOM 843 CA ASP A 50 24.115 0.542 17.362 1.00 0.00 C ATOM 844 C ASP A 50 25.619 0.622 17.596 1.00 0.00 C ATOM 845 O ASP A 50 26.269 1.588 17.196 1.00 0.00 O ATOM 846 CB ASP A 50 23.732 1.454 16.196 1.00 0.00 C ATOM 847 CG ASP A 50 22.333 1.109 15.702 1.00 0.00 C ATOM 848 OD1 ASP A 50 21.822 0.075 16.100 1.00 0.00 O ATOM 849 OD2 ASP A 50 21.790 1.883 14.930 1.00 0.00 O ATOM 0 H ASP A 50 22.381 1.108 18.406 1.00 0.00 H new ATOM 0 HA ASP A 50 23.856 -0.490 17.124 1.00 0.00 H new ATOM 0 HB2 ASP A 50 23.768 2.497 16.512 1.00 0.00 H new ATOM 0 HB3 ASP A 50 24.451 1.342 15.385 1.00 0.00 H new ATOM 854 N SER A 51 26.162 -0.396 18.255 1.00 0.00 N ATOM 855 CA SER A 51 27.591 -0.425 18.547 1.00 0.00 C ATOM 856 C SER A 51 28.077 -1.856 18.769 1.00 0.00 C ATOM 857 O SER A 51 27.344 -2.699 19.285 1.00 0.00 O ATOM 858 CB SER A 51 27.880 0.405 19.796 1.00 0.00 C ATOM 859 OG SER A 51 29.275 0.368 20.073 1.00 0.00 O ATOM 0 H SER A 51 25.641 -1.204 18.594 1.00 0.00 H new ATOM 0 HA SER A 51 28.121 -0.006 17.691 1.00 0.00 H new ATOM 0 HB2 SER A 51 27.555 1.434 19.646 1.00 0.00 H new ATOM 0 HB3 SER A 51 27.319 0.014 20.644 1.00 0.00 H new ATOM 0 HG SER A 51 29.777 0.533 19.248 1.00 0.00 H new ATOM 865 N ALA A 52 29.324 -2.115 18.387 1.00 0.00 N ATOM 866 CA ALA A 52 29.911 -3.439 18.559 1.00 0.00 C ATOM 867 C ALA A 52 31.041 -3.372 19.582 1.00 0.00 C ATOM 868 O ALA A 52 31.809 -2.414 19.598 1.00 0.00 O ATOM 869 CB ALA A 52 30.460 -3.948 17.225 1.00 0.00 C ATOM 0 H ALA A 52 29.945 -1.429 17.958 1.00 0.00 H new ATOM 0 HA ALA A 52 29.140 -4.124 18.912 1.00 0.00 H new ATOM 0 HB1 ALA A 52 30.896 -4.937 17.365 1.00 0.00 H new ATOM 0 HB2 ALA A 52 29.651 -4.008 16.497 1.00 0.00 H new ATOM 0 HB3 ALA A 52 31.225 -3.262 16.861 1.00 0.00 H new ATOM 875 N TYR A 53 31.138 -4.383 20.439 1.00 0.00 N ATOM 876 CA TYR A 53 32.186 -4.393 21.455 1.00 0.00 C ATOM 877 C TYR A 53 32.629 -5.816 21.781 1.00 0.00 C ATOM 878 O TYR A 53 31.898 -6.776 21.544 1.00 0.00 O ATOM 879 CB TYR A 53 31.674 -3.717 22.727 1.00 0.00 C ATOM 880 CG TYR A 53 30.533 -4.522 23.301 1.00 0.00 C ATOM 881 CD1 TYR A 53 30.790 -5.531 24.238 1.00 0.00 C ATOM 882 CD2 TYR A 53 29.218 -4.261 22.897 1.00 0.00 C ATOM 883 CE1 TYR A 53 29.732 -6.279 24.770 1.00 0.00 C ATOM 884 CE2 TYR A 53 28.160 -5.009 23.429 1.00 0.00 C ATOM 885 CZ TYR A 53 28.418 -6.017 24.366 1.00 0.00 C ATOM 886 OH TYR A 53 27.376 -6.755 24.890 1.00 0.00 O ATOM 0 H TYR A 53 30.517 -5.192 20.453 1.00 0.00 H new ATOM 0 HA TYR A 53 33.044 -3.849 21.061 1.00 0.00 H new ATOM 0 HB2 TYR A 53 32.479 -3.635 23.457 1.00 0.00 H new ATOM 0 HB3 TYR A 53 31.342 -2.703 22.504 1.00 0.00 H new ATOM 0 HD1 TYR A 53 31.804 -5.732 24.550 1.00 0.00 H new ATOM 0 HD2 TYR A 53 29.019 -3.483 22.175 1.00 0.00 H new ATOM 0 HE1 TYR A 53 29.930 -7.058 25.492 1.00 0.00 H new ATOM 0 HE2 TYR A 53 27.146 -4.808 23.117 1.00 0.00 H new ATOM 0 HH TYR A 53 26.530 -6.445 24.505 1.00 0.00 H new ATOM 896 N LYS A 54 33.830 -5.935 22.340 1.00 0.00 N ATOM 897 CA LYS A 54 34.372 -7.237 22.713 1.00 0.00 C ATOM 898 C LYS A 54 34.578 -7.300 24.221 1.00 0.00 C ATOM 899 O LYS A 54 35.217 -6.425 24.807 1.00 0.00 O ATOM 900 CB LYS A 54 35.702 -7.479 22.000 1.00 0.00 C ATOM 901 CG LYS A 54 36.233 -8.865 22.371 1.00 0.00 C ATOM 902 CD LYS A 54 37.587 -9.091 21.699 1.00 0.00 C ATOM 903 CE LYS A 54 37.391 -9.252 20.192 1.00 0.00 C ATOM 904 NZ LYS A 54 38.696 -9.583 19.553 1.00 0.00 N ATOM 0 H LYS A 54 34.445 -5.147 22.544 1.00 0.00 H new ATOM 0 HA LYS A 54 33.664 -8.010 22.414 1.00 0.00 H new ATOM 0 HB2 LYS A 54 35.567 -7.406 20.921 1.00 0.00 H new ATOM 0 HB3 LYS A 54 36.424 -6.713 22.284 1.00 0.00 H new ATOM 0 HG2 LYS A 54 36.334 -8.949 23.453 1.00 0.00 H new ATOM 0 HG3 LYS A 54 35.526 -9.633 22.056 1.00 0.00 H new ATOM 0 HD2 LYS A 54 38.250 -8.250 21.902 1.00 0.00 H new ATOM 0 HD3 LYS A 54 38.065 -9.980 22.111 1.00 0.00 H new ATOM 0 HE2 LYS A 54 36.665 -10.040 19.991 1.00 0.00 H new ATOM 0 HE3 LYS A 54 36.989 -8.333 19.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 38.527 -10.033 18.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 39.247 -8.711 19.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 39.226 -10.236 20.164 1.00 0.00 H new ATOM 918 N ASP A 55 34.017 -8.327 24.851 1.00 0.00 N ATOM 919 CA ASP A 55 34.135 -8.471 26.299 1.00 0.00 C ATOM 920 C ASP A 55 35.196 -9.500 26.688 1.00 0.00 C ATOM 921 O ASP A 55 34.964 -10.706 26.600 1.00 0.00 O ATOM 922 CB ASP A 55 32.786 -8.886 26.888 1.00 0.00 C ATOM 923 CG ASP A 55 32.890 -8.994 28.405 1.00 0.00 C ATOM 924 OD1 ASP A 55 33.991 -8.869 28.915 1.00 0.00 O ATOM 925 OD2 ASP A 55 31.865 -9.200 29.036 1.00 0.00 O ATOM 0 H ASP A 55 33.483 -9.063 24.390 1.00 0.00 H new ATOM 0 HA ASP A 55 34.442 -7.505 26.701 1.00 0.00 H new ATOM 0 HB2 ASP A 55 32.022 -8.156 26.619 1.00 0.00 H new ATOM 0 HB3 ASP A 55 32.475 -9.842 26.468 1.00 0.00 H new ATOM 930 N PHE A 56 36.348 -9.017 27.151 1.00 0.00 N ATOM 931 CA PHE A 56 37.421 -9.908 27.587 1.00 0.00 C ATOM 932 C PHE A 56 37.223 -10.283 29.050 1.00 0.00 C ATOM 933 O PHE A 56 37.895 -11.171 29.574 1.00 0.00 O ATOM 934 CB PHE A 56 38.786 -9.233 27.429 1.00 0.00 C ATOM 935 CG PHE A 56 39.166 -9.162 25.972 1.00 0.00 C ATOM 936 CD1 PHE A 56 38.962 -7.983 25.247 1.00 0.00 C ATOM 937 CD2 PHE A 56 39.735 -10.278 25.348 1.00 0.00 C ATOM 938 CE1 PHE A 56 39.327 -7.920 23.899 1.00 0.00 C ATOM 939 CE2 PHE A 56 40.099 -10.216 23.998 1.00 0.00 C ATOM 940 CZ PHE A 56 39.896 -9.037 23.274 1.00 0.00 C ATOM 0 H PHE A 56 36.561 -8.023 27.233 1.00 0.00 H new ATOM 0 HA PHE A 56 37.391 -10.803 26.965 1.00 0.00 H new ATOM 0 HB2 PHE A 56 38.755 -8.230 27.854 1.00 0.00 H new ATOM 0 HB3 PHE A 56 39.542 -9.790 27.983 1.00 0.00 H new ATOM 0 HD1 PHE A 56 38.523 -7.122 25.729 1.00 0.00 H new ATOM 0 HD2 PHE A 56 39.893 -11.188 25.908 1.00 0.00 H new ATOM 0 HE1 PHE A 56 39.170 -7.010 23.339 1.00 0.00 H new ATOM 0 HE2 PHE A 56 40.536 -11.078 23.516 1.00 0.00 H new ATOM 0 HZ PHE A 56 40.178 -8.988 22.233 1.00 0.00 H new ATOM 950 N GLY A 57 36.299 -9.588 29.705 1.00 0.00 N ATOM 951 CA GLY A 57 36.017 -9.837 31.112 1.00 0.00 C ATOM 952 C GLY A 57 36.884 -8.947 31.995 1.00 0.00 C ATOM 953 O GLY A 57 36.677 -8.866 33.206 1.00 0.00 O ATOM 0 H GLY A 57 35.734 -8.850 29.284 1.00 0.00 H new ATOM 0 HA2 GLY A 57 34.963 -9.647 31.317 1.00 0.00 H new ATOM 0 HA3 GLY A 57 36.204 -10.885 31.347 1.00 0.00 H new ATOM 957 N LYS A 58 37.850 -8.275 31.377 1.00 0.00 N ATOM 958 CA LYS A 58 38.741 -7.382 32.111 1.00 0.00 C ATOM 959 C LYS A 58 38.496 -5.934 31.698 1.00 0.00 C ATOM 960 O LYS A 58 38.672 -5.011 32.492 1.00 0.00 O ATOM 961 CB LYS A 58 40.198 -7.752 31.831 1.00 0.00 C ATOM 962 CG LYS A 58 40.433 -9.221 32.185 1.00 0.00 C ATOM 963 CD LYS A 58 40.159 -9.439 33.674 1.00 0.00 C ATOM 964 CE LYS A 58 40.525 -10.874 34.055 1.00 0.00 C ATOM 965 NZ LYS A 58 39.648 -11.823 33.312 1.00 0.00 N ATOM 0 H LYS A 58 38.036 -8.331 30.376 1.00 0.00 H new ATOM 0 HA LYS A 58 38.539 -7.488 33.177 1.00 0.00 H new ATOM 0 HB2 LYS A 58 40.432 -7.579 30.781 1.00 0.00 H new ATOM 0 HB3 LYS A 58 40.864 -7.116 32.415 1.00 0.00 H new ATOM 0 HG2 LYS A 58 39.781 -9.858 31.588 1.00 0.00 H new ATOM 0 HG3 LYS A 58 41.459 -9.503 31.948 1.00 0.00 H new ATOM 0 HD2 LYS A 58 40.740 -8.734 34.269 1.00 0.00 H new ATOM 0 HD3 LYS A 58 39.108 -9.250 33.893 1.00 0.00 H new ATOM 0 HE2 LYS A 58 41.571 -11.069 33.820 1.00 0.00 H new ATOM 0 HE3 LYS A 58 40.407 -11.018 35.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 39.712 -12.766 33.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 38.664 -11.490 33.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 39.956 -11.876 32.320 1.00 0.00 H new ATOM 979 N TYR A 59 38.088 -5.747 30.446 1.00 0.00 N ATOM 980 CA TYR A 59 37.819 -4.411 29.926 1.00 0.00 C ATOM 981 C TYR A 59 36.807 -4.478 28.786 1.00 0.00 C ATOM 982 O TYR A 59 36.585 -5.539 28.204 1.00 0.00 O ATOM 983 CB TYR A 59 39.116 -3.770 29.428 1.00 0.00 C ATOM 984 CG TYR A 59 39.673 -4.576 28.278 1.00 0.00 C ATOM 985 CD1 TYR A 59 39.303 -4.269 26.964 1.00 0.00 C ATOM 986 CD2 TYR A 59 40.563 -5.627 28.528 1.00 0.00 C ATOM 987 CE1 TYR A 59 39.823 -5.014 25.898 1.00 0.00 C ATOM 988 CE2 TYR A 59 41.083 -6.372 27.462 1.00 0.00 C ATOM 989 CZ TYR A 59 40.713 -6.065 26.148 1.00 0.00 C ATOM 990 OH TYR A 59 41.227 -6.799 25.098 1.00 0.00 O ATOM 0 H TYR A 59 37.937 -6.501 29.776 1.00 0.00 H new ATOM 0 HA TYR A 59 37.405 -3.803 30.730 1.00 0.00 H new ATOM 0 HB2 TYR A 59 38.927 -2.745 29.109 1.00 0.00 H new ATOM 0 HB3 TYR A 59 39.844 -3.723 30.238 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.617 -3.458 26.772 1.00 0.00 H new ATOM 0 HD2 TYR A 59 40.849 -5.863 29.542 1.00 0.00 H new ATOM 0 HE1 TYR A 59 39.537 -4.778 24.884 1.00 0.00 H new ATOM 0 HE2 TYR A 59 41.769 -7.183 27.654 1.00 0.00 H new ATOM 0 HH TYR A 59 40.506 -7.030 24.476 1.00 0.00 H new ATOM 1000 N GLU A 60 36.192 -3.341 28.475 1.00 0.00 N ATOM 1001 CA GLU A 60 35.202 -3.292 27.407 1.00 0.00 C ATOM 1002 C GLU A 60 35.654 -2.367 26.279 1.00 0.00 C ATOM 1003 O GLU A 60 36.020 -1.216 26.514 1.00 0.00 O ATOM 1004 CB GLU A 60 33.863 -2.801 27.960 1.00 0.00 C ATOM 1005 CG GLU A 60 32.825 -2.778 26.836 1.00 0.00 C ATOM 1006 CD GLU A 60 31.475 -2.325 27.382 1.00 0.00 C ATOM 1007 OE1 GLU A 60 31.399 -2.054 28.569 1.00 0.00 O ATOM 1008 OE2 GLU A 60 30.538 -2.255 26.605 1.00 0.00 O ATOM 0 H GLU A 60 36.360 -2.450 28.943 1.00 0.00 H new ATOM 0 HA GLU A 60 35.089 -4.299 27.006 1.00 0.00 H new ATOM 0 HB2 GLU A 60 33.528 -3.455 28.765 1.00 0.00 H new ATOM 0 HB3 GLU A 60 33.977 -1.804 28.385 1.00 0.00 H new ATOM 0 HG2 GLU A 60 33.150 -2.105 26.043 1.00 0.00 H new ATOM 0 HG3 GLU A 60 32.733 -3.770 26.394 1.00 0.00 H new ATOM 1015 N ILE A 61 35.608 -2.879 25.052 1.00 0.00 N ATOM 1016 CA ILE A 61 35.998 -2.094 23.886 1.00 0.00 C ATOM 1017 C ILE A 61 34.869 -2.105 22.861 1.00 0.00 C ATOM 1018 O ILE A 61 34.264 -3.146 22.610 1.00 0.00 O ATOM 1019 CB ILE A 61 37.268 -2.674 23.260 1.00 0.00 C ATOM 1020 CG1 ILE A 61 37.000 -4.110 22.803 1.00 0.00 C ATOM 1021 CG2 ILE A 61 38.395 -2.673 24.295 1.00 0.00 C ATOM 1022 CD1 ILE A 61 38.188 -4.615 21.983 1.00 0.00 C ATOM 0 H ILE A 61 35.306 -3.830 24.840 1.00 0.00 H new ATOM 0 HA ILE A 61 36.195 -1.069 24.199 1.00 0.00 H new ATOM 0 HB ILE A 61 37.560 -2.066 22.404 1.00 0.00 H new ATOM 0 HG12 ILE A 61 36.841 -4.754 23.668 1.00 0.00 H new ATOM 0 HG13 ILE A 61 36.089 -4.149 22.205 1.00 0.00 H new ATOM 0 HG21 ILE A 61 39.299 -3.086 23.849 1.00 0.00 H new ATOM 0 HG22 ILE A 61 38.587 -1.651 24.623 1.00 0.00 H new ATOM 0 HG23 ILE A 61 38.103 -3.281 25.152 1.00 0.00 H new ATOM 0 HD11 ILE A 61 37.997 -5.638 21.658 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.326 -3.976 21.111 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.089 -4.591 22.596 1.00 0.00 H new ATOM 1034 N ARG A 62 34.576 -0.946 22.279 1.00 0.00 N ATOM 1035 CA ARG A 62 33.500 -0.860 21.298 1.00 0.00 C ATOM 1036 C ARG A 62 33.868 0.066 20.143 1.00 0.00 C ATOM 1037 O ARG A 62 34.698 0.963 20.289 1.00 0.00 O ATOM 1038 CB ARG A 62 32.230 -0.350 21.982 1.00 0.00 C ATOM 1039 CG ARG A 62 32.470 1.068 22.509 1.00 0.00 C ATOM 1040 CD ARG A 62 31.324 1.471 23.441 1.00 0.00 C ATOM 1041 NE ARG A 62 30.061 1.509 22.712 1.00 0.00 N ATOM 1042 CZ ARG A 62 29.675 2.602 22.063 1.00 0.00 C ATOM 1043 NH1 ARG A 62 30.438 3.660 22.054 1.00 0.00 N ATOM 1044 NH2 ARG A 62 28.526 2.623 21.447 1.00 0.00 N ATOM 0 H ARG A 62 35.059 -0.067 22.465 1.00 0.00 H new ATOM 0 HA ARG A 62 33.332 -1.856 20.888 1.00 0.00 H new ATOM 0 HB2 ARG A 62 31.398 -0.352 21.277 1.00 0.00 H new ATOM 0 HB3 ARG A 62 31.954 -1.013 22.802 1.00 0.00 H new ATOM 0 HG2 ARG A 62 33.419 1.112 23.043 1.00 0.00 H new ATOM 0 HG3 ARG A 62 32.539 1.769 21.677 1.00 0.00 H new ATOM 0 HD2 ARG A 62 31.253 0.763 24.267 1.00 0.00 H new ATOM 0 HD3 ARG A 62 31.529 2.449 23.877 1.00 0.00 H new ATOM 0 HE ARG A 62 29.464 0.682 22.700 1.00 0.00 H new ATOM 0 HH11 ARG A 62 31.332 3.648 22.545 1.00 0.00 H new ATOM 0 HH12 ARG A 62 30.141 4.499 21.555 1.00 0.00 H new ATOM 0 HH21 ARG A 62 27.923 1.800 21.463 1.00 0.00 H new ATOM 0 HH22 ARG A 62 28.230 3.462 20.949 1.00 0.00 H new ATOM 1058 N LEU A 63 33.230 -0.160 18.998 1.00 0.00 N ATOM 1059 CA LEU A 63 33.472 0.654 17.813 1.00 0.00 C ATOM 1060 C LEU A 63 32.229 1.468 17.473 1.00 0.00 C ATOM 1061 O LEU A 63 31.131 0.920 17.353 1.00 0.00 O ATOM 1062 CB LEU A 63 33.831 -0.244 16.626 1.00 0.00 C ATOM 1063 CG LEU A 63 35.116 -1.020 16.929 1.00 0.00 C ATOM 1064 CD1 LEU A 63 35.363 -2.045 15.821 1.00 0.00 C ATOM 1065 CD2 LEU A 63 36.297 -0.049 16.984 1.00 0.00 C ATOM 0 H LEU A 63 32.541 -0.901 18.867 1.00 0.00 H new ATOM 0 HA LEU A 63 34.301 1.332 18.019 1.00 0.00 H new ATOM 0 HB2 LEU A 63 33.015 -0.939 16.425 1.00 0.00 H new ATOM 0 HB3 LEU A 63 33.964 0.360 15.729 1.00 0.00 H new ATOM 0 HG LEU A 63 35.014 -1.529 17.887 1.00 0.00 H new ATOM 0 HD11 LEU A 63 36.277 -2.599 16.035 1.00 0.00 H new ATOM 0 HD12 LEU A 63 34.523 -2.737 15.772 1.00 0.00 H new ATOM 0 HD13 LEU A 63 35.465 -1.530 14.866 1.00 0.00 H new ATOM 0 HD21 LEU A 63 37.212 -0.601 17.200 1.00 0.00 H new ATOM 0 HD22 LEU A 63 36.397 0.458 16.024 1.00 0.00 H new ATOM 0 HD23 LEU A 63 36.125 0.689 17.768 1.00 0.00 H new ATOM 1077 N SER A 64 32.406 2.774 17.319 1.00 0.00 N ATOM 1078 CA SER A 64 31.291 3.654 16.992 1.00 0.00 C ATOM 1079 C SER A 64 31.704 4.670 15.932 1.00 0.00 C ATOM 1080 O SER A 64 32.891 4.923 15.730 1.00 0.00 O ATOM 1081 CB SER A 64 30.806 4.376 18.248 1.00 0.00 C ATOM 1082 OG SER A 64 30.323 3.420 19.182 1.00 0.00 O ATOM 0 H SER A 64 33.305 3.245 17.415 1.00 0.00 H new ATOM 0 HA SER A 64 30.477 3.048 16.594 1.00 0.00 H new ATOM 0 HB2 SER A 64 31.620 4.952 18.688 1.00 0.00 H new ATOM 0 HB3 SER A 64 30.017 5.083 17.993 1.00 0.00 H new ATOM 0 HG SER A 64 29.344 3.387 19.140 1.00 0.00 H new ATOM 1088 N ASN A 65 30.717 5.247 15.254 1.00 0.00 N ATOM 1089 CA ASN A 65 30.991 6.230 14.211 1.00 0.00 C ATOM 1090 C ASN A 65 31.833 7.379 14.759 1.00 0.00 C ATOM 1091 O ASN A 65 32.700 7.174 15.609 1.00 0.00 O ATOM 1092 CB ASN A 65 29.678 6.778 13.649 1.00 0.00 C ATOM 1093 CG ASN A 65 29.908 7.359 12.259 1.00 0.00 C ATOM 1094 OD1 ASN A 65 30.718 6.836 11.493 1.00 0.00 O ATOM 1095 ND2 ASN A 65 29.241 8.416 11.884 1.00 0.00 N ATOM 0 H ASN A 65 29.727 5.053 15.406 1.00 0.00 H new ATOM 0 HA ASN A 65 31.548 5.737 13.415 1.00 0.00 H new ATOM 0 HB2 ASN A 65 28.934 5.983 13.601 1.00 0.00 H new ATOM 0 HB3 ASN A 65 29.282 7.547 14.312 1.00 0.00 H new ATOM 0 HD21 ASN A 65 29.390 8.810 10.955 1.00 0.00 H new ATOM 0 HD22 ASN A 65 28.570 8.848 12.520 1.00 0.00 H new ATOM 1102 N HIS A 66 31.582 8.584 14.257 1.00 0.00 N ATOM 1103 CA HIS A 66 32.332 9.754 14.697 1.00 0.00 C ATOM 1104 C HIS A 66 32.160 9.978 16.194 1.00 0.00 C ATOM 1105 O HIS A 66 33.017 10.579 16.843 1.00 0.00 O ATOM 1106 CB HIS A 66 31.856 10.994 13.936 1.00 0.00 C ATOM 1107 CG HIS A 66 30.464 11.349 14.380 1.00 0.00 C ATOM 1108 ND1 HIS A 66 29.345 10.676 13.914 1.00 0.00 N ATOM 1109 CD2 HIS A 66 29.993 12.303 15.248 1.00 0.00 C ATOM 1110 CE1 HIS A 66 28.266 11.229 14.499 1.00 0.00 C ATOM 1111 NE2 HIS A 66 28.605 12.225 15.321 1.00 0.00 N ATOM 0 H HIS A 66 30.871 8.775 13.551 1.00 0.00 H new ATOM 0 HA HIS A 66 33.388 9.580 14.490 1.00 0.00 H new ATOM 0 HB2 HIS A 66 32.532 11.829 14.120 1.00 0.00 H new ATOM 0 HB3 HIS A 66 31.870 10.803 12.863 1.00 0.00 H new ATOM 0 HD2 HIS A 66 30.606 13.007 15.791 1.00 0.00 H new ATOM 0 HE1 HIS A 66 27.250 10.906 14.325 1.00 0.00 H new ATOM 0 HE2 HIS A 66 27.981 12.805 15.882 1.00 0.00 H new ATOM 1119 N SER A 67 31.056 9.485 16.743 1.00 0.00 N ATOM 1120 CA SER A 67 30.800 9.638 18.171 1.00 0.00 C ATOM 1121 C SER A 67 30.333 8.317 18.774 1.00 0.00 C ATOM 1122 O SER A 67 29.695 7.506 18.101 1.00 0.00 O ATOM 1123 CB SER A 67 29.735 10.710 18.400 1.00 0.00 C ATOM 1124 OG SER A 67 28.514 10.295 17.803 1.00 0.00 O ATOM 0 H SER A 67 30.332 8.982 16.230 1.00 0.00 H new ATOM 0 HA SER A 67 31.728 9.940 18.657 1.00 0.00 H new ATOM 0 HB2 SER A 67 29.593 10.875 19.468 1.00 0.00 H new ATOM 0 HB3 SER A 67 30.059 11.658 17.971 1.00 0.00 H new ATOM 0 HG SER A 67 28.289 10.899 17.065 1.00 0.00 H new ATOM 1286 N GLY A 78 32.136 -1.197 35.986 1.00 0.00 N ATOM 1287 CA GLY A 78 33.030 -1.744 37.001 1.00 0.00 C ATOM 1288 C GLY A 78 34.335 -2.203 36.363 1.00 0.00 C ATOM 1289 O GLY A 78 35.218 -2.737 37.035 1.00 0.00 O ATOM 0 HA2 GLY A 78 33.234 -0.989 37.761 1.00 0.00 H new ATOM 0 HA3 GLY A 78 32.549 -2.582 37.506 1.00 0.00 H new ATOM 1293 N ARG A 79 34.445 -1.985 35.057 1.00 0.00 N ATOM 1294 CA ARG A 79 35.639 -2.370 34.315 1.00 0.00 C ATOM 1295 C ARG A 79 36.096 -1.219 33.428 1.00 0.00 C ATOM 1296 O ARG A 79 35.317 -0.319 33.114 1.00 0.00 O ATOM 1297 CB ARG A 79 35.349 -3.600 33.452 1.00 0.00 C ATOM 1298 CG ARG A 79 35.053 -4.801 34.352 1.00 0.00 C ATOM 1299 CD ARG A 79 35.016 -6.075 33.507 1.00 0.00 C ATOM 1300 NE ARG A 79 33.937 -6.002 32.529 1.00 0.00 N ATOM 1301 CZ ARG A 79 32.706 -6.405 32.831 1.00 0.00 C ATOM 1302 NH1 ARG A 79 32.448 -6.874 34.021 1.00 0.00 N ATOM 1303 NH2 ARG A 79 31.758 -6.331 31.938 1.00 0.00 N ATOM 0 H ARG A 79 33.721 -1.543 34.490 1.00 0.00 H new ATOM 0 HA ARG A 79 36.430 -2.611 35.026 1.00 0.00 H new ATOM 0 HB2 ARG A 79 34.499 -3.405 32.798 1.00 0.00 H new ATOM 0 HB3 ARG A 79 36.203 -3.816 32.810 1.00 0.00 H new ATOM 0 HG2 ARG A 79 35.817 -4.887 35.125 1.00 0.00 H new ATOM 0 HG3 ARG A 79 34.099 -4.661 34.861 1.00 0.00 H new ATOM 0 HD2 ARG A 79 35.970 -6.209 32.997 1.00 0.00 H new ATOM 0 HD3 ARG A 79 34.874 -6.943 34.151 1.00 0.00 H new ATOM 0 HE ARG A 79 34.130 -5.635 31.597 1.00 0.00 H new ATOM 0 HH11 ARG A 79 33.190 -6.931 34.719 1.00 0.00 H new ATOM 0 HH12 ARG A 79 31.504 -7.183 34.254 1.00 0.00 H new ATOM 0 HH21 ARG A 79 31.961 -5.964 31.008 1.00 0.00 H new ATOM 0 HH22 ARG A 79 30.814 -6.640 32.170 1.00 0.00 H new ATOM 1317 N LEU A 80 37.363 -1.247 33.028 1.00 0.00 N ATOM 1318 CA LEU A 80 37.901 -0.191 32.180 1.00 0.00 C ATOM 1319 C LEU A 80 37.068 -0.055 30.910 1.00 0.00 C ATOM 1320 O LEU A 80 36.612 -1.050 30.345 1.00 0.00 O ATOM 1321 CB LEU A 80 39.352 -0.504 31.810 1.00 0.00 C ATOM 1322 CG LEU A 80 40.289 0.212 32.782 1.00 0.00 C ATOM 1323 CD1 LEU A 80 40.072 1.722 32.683 1.00 0.00 C ATOM 1324 CD2 LEU A 80 39.993 -0.252 34.210 1.00 0.00 C ATOM 0 H LEU A 80 38.029 -1.980 33.274 1.00 0.00 H new ATOM 0 HA LEU A 80 37.864 0.749 32.731 1.00 0.00 H new ATOM 0 HB2 LEU A 80 39.524 -1.580 31.847 1.00 0.00 H new ATOM 0 HB3 LEU A 80 39.556 -0.183 30.788 1.00 0.00 H new ATOM 0 HG LEU A 80 41.323 -0.023 32.529 1.00 0.00 H new ATOM 0 HD11 LEU A 80 40.741 2.232 33.377 1.00 0.00 H new ATOM 0 HD12 LEU A 80 40.282 2.054 31.666 1.00 0.00 H new ATOM 0 HD13 LEU A 80 39.038 1.958 32.936 1.00 0.00 H new ATOM 0 HD21 LEU A 80 40.661 0.258 34.904 1.00 0.00 H new ATOM 0 HD22 LEU A 80 38.959 -0.017 34.462 1.00 0.00 H new ATOM 0 HD23 LEU A 80 40.148 -1.328 34.282 1.00 0.00 H new ATOM 1336 N ILE A 81 36.866 1.183 30.473 1.00 0.00 N ATOM 1337 CA ILE A 81 36.075 1.440 29.276 1.00 0.00 C ATOM 1338 C ILE A 81 36.930 2.079 28.187 1.00 0.00 C ATOM 1339 O ILE A 81 37.607 3.083 28.421 1.00 0.00 O ATOM 1340 CB ILE A 81 34.904 2.362 29.613 1.00 0.00 C ATOM 1341 CG1 ILE A 81 34.015 1.693 30.666 1.00 0.00 C ATOM 1342 CG2 ILE A 81 34.082 2.631 28.351 1.00 0.00 C ATOM 1343 CD1 ILE A 81 32.991 2.702 31.187 1.00 0.00 C ATOM 0 H ILE A 81 37.236 2.019 30.926 1.00 0.00 H new ATOM 0 HA ILE A 81 35.695 0.487 28.907 1.00 0.00 H new ATOM 0 HB ILE A 81 35.287 3.305 30.004 1.00 0.00 H new ATOM 0 HG12 ILE A 81 33.505 0.833 30.233 1.00 0.00 H new ATOM 0 HG13 ILE A 81 34.625 1.321 31.489 1.00 0.00 H new ATOM 0 HG21 ILE A 81 33.247 3.289 28.594 1.00 0.00 H new ATOM 0 HG22 ILE A 81 34.713 3.107 27.600 1.00 0.00 H new ATOM 0 HG23 ILE A 81 33.699 1.689 27.958 1.00 0.00 H new ATOM 0 HD11 ILE A 81 32.359 2.225 31.936 1.00 0.00 H new ATOM 0 HD12 ILE A 81 33.510 3.549 31.636 1.00 0.00 H new ATOM 0 HD13 ILE A 81 32.373 3.053 30.361 1.00 0.00 H new ATOM 1355 N VAL A 82 36.891 1.491 26.997 1.00 0.00 N ATOM 1356 CA VAL A 82 37.660 2.007 25.874 1.00 0.00 C ATOM 1357 C VAL A 82 36.726 2.446 24.750 1.00 0.00 C ATOM 1358 O VAL A 82 35.907 1.662 24.270 1.00 0.00 O ATOM 1359 CB VAL A 82 38.609 0.927 25.351 1.00 0.00 C ATOM 1360 CG1 VAL A 82 39.405 1.475 24.166 1.00 0.00 C ATOM 1361 CG2 VAL A 82 39.573 0.509 26.465 1.00 0.00 C ATOM 0 H VAL A 82 36.337 0.661 26.787 1.00 0.00 H new ATOM 0 HA VAL A 82 38.238 2.866 26.215 1.00 0.00 H new ATOM 0 HB VAL A 82 38.030 0.062 25.029 1.00 0.00 H new ATOM 0 HG11 VAL A 82 40.081 0.705 23.794 1.00 0.00 H new ATOM 0 HG12 VAL A 82 38.719 1.770 23.372 1.00 0.00 H new ATOM 0 HG13 VAL A 82 39.984 2.342 24.486 1.00 0.00 H new ATOM 0 HG21 VAL A 82 40.249 -0.260 26.092 1.00 0.00 H new ATOM 0 HG22 VAL A 82 40.152 1.374 26.789 1.00 0.00 H new ATOM 0 HG23 VAL A 82 39.006 0.115 27.308 1.00 0.00 H new ATOM 1371 N ASN A 83 36.855 3.701 24.332 1.00 0.00 N ATOM 1372 CA ASN A 83 36.018 4.224 23.259 1.00 0.00 C ATOM 1373 C ASN A 83 36.801 4.259 21.951 1.00 0.00 C ATOM 1374 O ASN A 83 37.863 4.871 21.873 1.00 0.00 O ATOM 1375 CB ASN A 83 35.539 5.635 23.610 1.00 0.00 C ATOM 1376 CG ASN A 83 34.769 5.611 24.925 1.00 0.00 C ATOM 1377 OD1 ASN A 83 35.152 6.283 25.882 1.00 0.00 O ATOM 1378 ND2 ASN A 83 33.698 4.872 25.032 1.00 0.00 N ATOM 0 H ASN A 83 37.524 4.369 24.715 1.00 0.00 H new ATOM 0 HA ASN A 83 35.154 3.570 23.139 1.00 0.00 H new ATOM 0 HB2 ASN A 83 36.392 6.308 23.691 1.00 0.00 H new ATOM 0 HB3 ASN A 83 34.903 6.021 22.813 1.00 0.00 H new ATOM 0 HD21 ASN A 83 33.178 4.851 25.909 1.00 0.00 H new ATOM 0 HD22 ASN A 83 33.381 4.315 24.238 1.00 0.00 H new ATOM 1385 N ILE A 84 36.275 3.592 20.931 1.00 0.00 N ATOM 1386 CA ILE A 84 36.947 3.548 19.638 1.00 0.00 C ATOM 1387 C ILE A 84 36.078 4.167 18.548 1.00 0.00 C ATOM 1388 O ILE A 84 34.918 3.791 18.378 1.00 0.00 O ATOM 1389 CB ILE A 84 37.265 2.099 19.269 1.00 0.00 C ATOM 1390 CG1 ILE A 84 38.181 1.493 20.336 1.00 0.00 C ATOM 1391 CG2 ILE A 84 37.967 2.064 17.912 1.00 0.00 C ATOM 1392 CD1 ILE A 84 38.301 -0.015 20.110 1.00 0.00 C ATOM 0 H ILE A 84 35.394 3.079 20.972 1.00 0.00 H new ATOM 0 HA ILE A 84 37.870 4.122 19.716 1.00 0.00 H new ATOM 0 HB ILE A 84 36.341 1.523 19.214 1.00 0.00 H new ATOM 0 HG12 ILE A 84 39.166 1.958 20.291 1.00 0.00 H new ATOM 0 HG13 ILE A 84 37.780 1.692 21.330 1.00 0.00 H new ATOM 0 HG21 ILE A 84 38.195 1.032 17.647 1.00 0.00 H new ATOM 0 HG22 ILE A 84 37.315 2.498 17.154 1.00 0.00 H new ATOM 0 HG23 ILE A 84 38.892 2.637 17.966 1.00 0.00 H new ATOM 0 HD11 ILE A 84 38.953 -0.446 20.870 1.00 0.00 H new ATOM 0 HD12 ILE A 84 37.314 -0.473 20.177 1.00 0.00 H new ATOM 0 HD13 ILE A 84 38.722 -0.203 19.122 1.00 0.00 H new ATOM 1404 N LYS A 85 36.647 5.115 17.810 1.00 0.00 N ATOM 1405 CA LYS A 85 35.911 5.770 16.735 1.00 0.00 C ATOM 1406 C LYS A 85 36.343 5.219 15.380 1.00 0.00 C ATOM 1407 O LYS A 85 37.535 5.131 15.086 1.00 0.00 O ATOM 1408 CB LYS A 85 36.159 7.279 16.773 1.00 0.00 C ATOM 1409 CG LYS A 85 35.769 7.826 18.146 1.00 0.00 C ATOM 1410 CD LYS A 85 34.286 7.559 18.402 1.00 0.00 C ATOM 1411 CE LYS A 85 33.869 8.218 19.717 1.00 0.00 C ATOM 1412 NZ LYS A 85 34.613 7.590 20.845 1.00 0.00 N ATOM 0 H LYS A 85 37.604 5.444 17.934 1.00 0.00 H new ATOM 0 HA LYS A 85 34.848 5.573 16.876 1.00 0.00 H new ATOM 0 HB2 LYS A 85 37.209 7.491 16.570 1.00 0.00 H new ATOM 0 HB3 LYS A 85 35.578 7.773 15.994 1.00 0.00 H new ATOM 0 HG2 LYS A 85 36.373 7.355 18.921 1.00 0.00 H new ATOM 0 HG3 LYS A 85 35.969 8.896 18.193 1.00 0.00 H new ATOM 0 HD2 LYS A 85 33.688 7.952 17.580 1.00 0.00 H new ATOM 0 HD3 LYS A 85 34.101 6.486 18.446 1.00 0.00 H new ATOM 0 HE2 LYS A 85 34.076 9.288 19.682 1.00 0.00 H new ATOM 0 HE3 LYS A 85 32.795 8.106 19.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 34.150 7.833 21.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 34.617 6.557 20.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 35.592 7.942 20.854 1.00 0.00 H new ATOM 1426 N ALA A 86 35.366 4.849 14.559 1.00 0.00 N ATOM 1427 CA ALA A 86 35.656 4.306 13.237 1.00 0.00 C ATOM 1428 C ALA A 86 34.459 4.487 12.310 1.00 0.00 C ATOM 1429 O ALA A 86 33.317 4.561 12.763 1.00 0.00 O ATOM 1430 CB ALA A 86 36.000 2.820 13.345 1.00 0.00 C ATOM 0 H ALA A 86 34.373 4.914 14.783 1.00 0.00 H new ATOM 0 HA ALA A 86 36.508 4.845 12.823 1.00 0.00 H new ATOM 0 HB1 ALA A 86 36.215 2.423 12.353 1.00 0.00 H new ATOM 0 HB2 ALA A 86 36.875 2.694 13.983 1.00 0.00 H new ATOM 0 HB3 ALA A 86 35.156 2.282 13.776 1.00 0.00 H new ATOM 1436 N SER A 87 34.725 4.549 11.010 1.00 0.00 N ATOM 1437 CA SER A 87 33.659 4.714 10.029 1.00 0.00 C ATOM 1438 C SER A 87 32.813 3.446 9.949 1.00 0.00 C ATOM 1439 O SER A 87 33.306 2.345 10.194 1.00 0.00 O ATOM 1440 CB SER A 87 34.252 5.024 8.655 1.00 0.00 C ATOM 1441 OG SER A 87 34.953 6.259 8.714 1.00 0.00 O ATOM 0 H SER A 87 35.663 4.488 10.613 1.00 0.00 H new ATOM 0 HA SER A 87 33.026 5.545 10.341 1.00 0.00 H new ATOM 0 HB2 SER A 87 34.926 4.224 8.348 1.00 0.00 H new ATOM 0 HB3 SER A 87 33.460 5.077 7.908 1.00 0.00 H new ATOM 0 HG SER A 87 35.336 6.460 7.835 1.00 0.00 H new ATOM 1447 N LYS A 88 31.539 3.608 9.608 1.00 0.00 N ATOM 1448 CA LYS A 88 30.638 2.466 9.505 1.00 0.00 C ATOM 1449 C LYS A 88 31.123 1.497 8.431 1.00 0.00 C ATOM 1450 O LYS A 88 31.059 0.280 8.606 1.00 0.00 O ATOM 1451 CB LYS A 88 29.226 2.943 9.164 1.00 0.00 C ATOM 1452 CG LYS A 88 28.632 3.682 10.366 1.00 0.00 C ATOM 1453 CD LYS A 88 27.220 4.160 10.025 1.00 0.00 C ATOM 1454 CE LYS A 88 26.635 4.915 11.219 1.00 0.00 C ATOM 1455 NZ LYS A 88 26.517 3.991 12.382 1.00 0.00 N ATOM 0 H LYS A 88 31.110 4.510 9.400 1.00 0.00 H new ATOM 0 HA LYS A 88 30.624 1.950 10.465 1.00 0.00 H new ATOM 0 HB2 LYS A 88 29.253 3.602 8.296 1.00 0.00 H new ATOM 0 HB3 LYS A 88 28.597 2.093 8.900 1.00 0.00 H new ATOM 0 HG2 LYS A 88 28.605 3.023 11.234 1.00 0.00 H new ATOM 0 HG3 LYS A 88 29.261 4.532 10.631 1.00 0.00 H new ATOM 0 HD2 LYS A 88 27.246 4.808 9.149 1.00 0.00 H new ATOM 0 HD3 LYS A 88 26.587 3.309 9.774 1.00 0.00 H new ATOM 0 HE2 LYS A 88 27.273 5.761 11.476 1.00 0.00 H new ATOM 0 HE3 LYS A 88 25.656 5.320 10.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 25.820 4.368 13.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 26.208 3.054 12.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 27.441 3.905 12.852 1.00 0.00 H new ATOM 1469 N LEU A 89 31.612 2.044 7.323 1.00 0.00 N ATOM 1470 CA LEU A 89 32.109 1.215 6.231 1.00 0.00 C ATOM 1471 C LEU A 89 33.473 0.631 6.587 1.00 0.00 C ATOM 1472 O LEU A 89 33.906 -0.363 6.004 1.00 0.00 O ATOM 1473 CB LEU A 89 32.223 2.048 4.953 1.00 0.00 C ATOM 1474 CG LEU A 89 33.142 3.245 5.203 1.00 0.00 C ATOM 1475 CD1 LEU A 89 34.555 2.914 4.719 1.00 0.00 C ATOM 1476 CD2 LEU A 89 32.614 4.460 4.437 1.00 0.00 C ATOM 0 H LEU A 89 31.675 3.049 7.158 1.00 0.00 H new ATOM 0 HA LEU A 89 31.407 0.398 6.067 1.00 0.00 H new ATOM 0 HB2 LEU A 89 32.618 1.436 4.142 1.00 0.00 H new ATOM 0 HB3 LEU A 89 31.237 2.392 4.642 1.00 0.00 H new ATOM 0 HG LEU A 89 33.166 3.468 6.270 1.00 0.00 H new ATOM 0 HD11 LEU A 89 35.210 3.767 4.897 1.00 0.00 H new ATOM 0 HD12 LEU A 89 34.932 2.047 5.262 1.00 0.00 H new ATOM 0 HD13 LEU A 89 34.531 2.691 3.652 1.00 0.00 H new ATOM 0 HD21 LEU A 89 33.268 5.314 4.614 1.00 0.00 H new ATOM 0 HD22 LEU A 89 32.591 4.236 3.371 1.00 0.00 H new ATOM 0 HD23 LEU A 89 31.607 4.697 4.780 1.00 0.00 H new ATOM 1488 N ASN A 90 34.143 1.256 7.549 1.00 0.00 N ATOM 1489 CA ASN A 90 35.457 0.795 7.982 1.00 0.00 C ATOM 1490 C ASN A 90 35.342 -0.010 9.272 1.00 0.00 C ATOM 1491 O ASN A 90 36.343 -0.301 9.925 1.00 0.00 O ATOM 1492 CB ASN A 90 36.385 1.989 8.206 1.00 0.00 C ATOM 1493 CG ASN A 90 36.737 2.634 6.870 1.00 0.00 C ATOM 1494 OD1 ASN A 90 36.622 1.996 5.824 1.00 0.00 O ATOM 1495 ND2 ASN A 90 37.161 3.868 6.842 1.00 0.00 N ATOM 0 H ASN A 90 33.800 2.080 8.042 1.00 0.00 H new ATOM 0 HA ASN A 90 35.871 0.156 7.202 1.00 0.00 H new ATOM 0 HB2 ASN A 90 35.902 2.719 8.855 1.00 0.00 H new ATOM 0 HB3 ASN A 90 37.294 1.664 8.713 1.00 0.00 H new ATOM 0 HD21 ASN A 90 37.398 4.306 5.952 1.00 0.00 H new ATOM 0 HD22 ASN A 90 37.255 4.395 7.710 1.00 0.00 H new ATOM 1502 N PHE A 91 34.113 -0.362 9.637 1.00 0.00 N ATOM 1503 CA PHE A 91 33.879 -1.128 10.856 1.00 0.00 C ATOM 1504 C PHE A 91 34.626 -2.457 10.808 1.00 0.00 C ATOM 1505 O PHE A 91 35.317 -2.824 11.756 1.00 0.00 O ATOM 1506 CB PHE A 91 32.381 -1.389 11.028 1.00 0.00 C ATOM 1507 CG PHE A 91 32.156 -2.266 12.235 1.00 0.00 C ATOM 1508 CD1 PHE A 91 32.200 -1.714 13.520 1.00 0.00 C ATOM 1509 CD2 PHE A 91 31.904 -3.633 12.069 1.00 0.00 C ATOM 1510 CE1 PHE A 91 31.991 -2.529 14.640 1.00 0.00 C ATOM 1511 CE2 PHE A 91 31.695 -4.448 13.188 1.00 0.00 C ATOM 1512 CZ PHE A 91 31.739 -3.895 14.474 1.00 0.00 C ATOM 0 H PHE A 91 33.270 -0.131 9.111 1.00 0.00 H new ATOM 0 HA PHE A 91 34.248 -0.549 11.702 1.00 0.00 H new ATOM 0 HB2 PHE A 91 31.848 -0.445 11.147 1.00 0.00 H new ATOM 0 HB3 PHE A 91 31.981 -1.871 10.136 1.00 0.00 H new ATOM 0 HD1 PHE A 91 32.395 -0.660 13.648 1.00 0.00 H new ATOM 0 HD2 PHE A 91 31.871 -4.059 11.077 1.00 0.00 H new ATOM 0 HE1 PHE A 91 32.024 -2.103 15.632 1.00 0.00 H new ATOM 0 HE2 PHE A 91 31.500 -5.502 13.060 1.00 0.00 H new ATOM 0 HZ PHE A 91 31.578 -4.523 15.338 1.00 0.00 H new ATOM 1522 N VAL A 92 34.485 -3.175 9.701 1.00 0.00 N ATOM 1523 CA VAL A 92 35.157 -4.461 9.551 1.00 0.00 C ATOM 1524 C VAL A 92 36.673 -4.285 9.598 1.00 0.00 C ATOM 1525 O VAL A 92 37.376 -5.036 10.271 1.00 0.00 O ATOM 1526 CB VAL A 92 34.757 -5.107 8.225 1.00 0.00 C ATOM 1527 CG1 VAL A 92 35.634 -6.335 7.970 1.00 0.00 C ATOM 1528 CG2 VAL A 92 33.290 -5.535 8.288 1.00 0.00 C ATOM 0 H VAL A 92 33.918 -2.894 8.901 1.00 0.00 H new ATOM 0 HA VAL A 92 34.853 -5.106 10.376 1.00 0.00 H new ATOM 0 HB VAL A 92 34.892 -4.389 7.417 1.00 0.00 H new ATOM 0 HG11 VAL A 92 35.349 -6.796 7.024 1.00 0.00 H new ATOM 0 HG12 VAL A 92 36.680 -6.032 7.925 1.00 0.00 H new ATOM 0 HG13 VAL A 92 35.499 -7.053 8.779 1.00 0.00 H new ATOM 0 HG21 VAL A 92 33.004 -5.996 7.342 1.00 0.00 H new ATOM 0 HG22 VAL A 92 33.155 -6.253 9.097 1.00 0.00 H new ATOM 0 HG23 VAL A 92 32.664 -4.662 8.470 1.00 0.00 H new ATOM 1538 N ASP A 93 37.170 -3.290 8.872 1.00 0.00 N ATOM 1539 CA ASP A 93 38.604 -3.027 8.830 1.00 0.00 C ATOM 1540 C ASP A 93 39.140 -2.662 10.213 1.00 0.00 C ATOM 1541 O ASP A 93 40.199 -3.140 10.623 1.00 0.00 O ATOM 1542 CB ASP A 93 38.895 -1.885 7.855 1.00 0.00 C ATOM 1543 CG ASP A 93 40.401 -1.662 7.749 1.00 0.00 C ATOM 1544 OD1 ASP A 93 41.126 -2.271 8.517 1.00 0.00 O ATOM 1545 OD2 ASP A 93 40.805 -0.884 6.901 1.00 0.00 O ATOM 0 H ASP A 93 36.605 -2.655 8.307 1.00 0.00 H new ATOM 0 HA ASP A 93 39.103 -3.936 8.495 1.00 0.00 H new ATOM 0 HB2 ASP A 93 38.484 -2.120 6.873 1.00 0.00 H new ATOM 0 HB3 ASP A 93 38.407 -0.972 8.195 1.00 0.00 H new ATOM 1550 N ILE A 94 38.415 -1.802 10.921 1.00 0.00 N ATOM 1551 CA ILE A 94 38.842 -1.371 12.248 1.00 0.00 C ATOM 1552 C ILE A 94 38.793 -2.525 13.242 1.00 0.00 C ATOM 1553 O ILE A 94 39.554 -2.553 14.204 1.00 0.00 O ATOM 1554 CB ILE A 94 37.938 -0.245 12.755 1.00 0.00 C ATOM 1555 CG1 ILE A 94 38.721 0.641 13.726 1.00 0.00 C ATOM 1556 CG2 ILE A 94 36.748 -0.855 13.499 1.00 0.00 C ATOM 1557 CD1 ILE A 94 39.920 1.256 13.005 1.00 0.00 C ATOM 0 H ILE A 94 37.537 -1.393 10.602 1.00 0.00 H new ATOM 0 HA ILE A 94 39.869 -1.015 12.165 1.00 0.00 H new ATOM 0 HB ILE A 94 37.590 0.349 11.910 1.00 0.00 H new ATOM 0 HG12 ILE A 94 38.076 1.428 14.117 1.00 0.00 H new ATOM 0 HG13 ILE A 94 39.059 0.053 14.579 1.00 0.00 H new ATOM 0 HG21 ILE A 94 36.099 -0.058 13.863 1.00 0.00 H new ATOM 0 HG22 ILE A 94 36.187 -1.499 12.822 1.00 0.00 H new ATOM 0 HG23 ILE A 94 37.109 -1.443 14.343 1.00 0.00 H new ATOM 0 HD11 ILE A 94 40.477 1.887 13.698 1.00 0.00 H new ATOM 0 HD12 ILE A 94 40.569 0.462 12.636 1.00 0.00 H new ATOM 0 HD13 ILE A 94 39.571 1.858 12.167 1.00 0.00 H new ATOM 1569 N ILE A 95 37.883 -3.465 13.020 1.00 0.00 N ATOM 1570 CA ILE A 95 37.744 -4.596 13.929 1.00 0.00 C ATOM 1571 C ILE A 95 39.021 -5.431 13.974 1.00 0.00 C ATOM 1572 O ILE A 95 39.330 -6.045 14.995 1.00 0.00 O ATOM 1573 CB ILE A 95 36.566 -5.477 13.503 1.00 0.00 C ATOM 1574 CG1 ILE A 95 36.121 -6.333 14.691 1.00 0.00 C ATOM 1575 CG2 ILE A 95 36.986 -6.394 12.354 1.00 0.00 C ATOM 1576 CD1 ILE A 95 35.528 -5.432 15.777 1.00 0.00 C ATOM 0 H ILE A 95 37.238 -3.468 12.230 1.00 0.00 H new ATOM 0 HA ILE A 95 37.558 -4.200 14.927 1.00 0.00 H new ATOM 0 HB ILE A 95 35.745 -4.841 13.173 1.00 0.00 H new ATOM 0 HG12 ILE A 95 35.382 -7.066 14.368 1.00 0.00 H new ATOM 0 HG13 ILE A 95 36.969 -6.890 15.089 1.00 0.00 H new ATOM 0 HG21 ILE A 95 36.142 -7.017 12.058 1.00 0.00 H new ATOM 0 HG22 ILE A 95 37.307 -5.790 11.505 1.00 0.00 H new ATOM 0 HG23 ILE A 95 37.810 -7.030 12.679 1.00 0.00 H new ATOM 0 HD11 ILE A 95 35.211 -6.042 16.623 1.00 0.00 H new ATOM 0 HD12 ILE A 95 36.281 -4.717 16.107 1.00 0.00 H new ATOM 0 HD13 ILE A 95 34.669 -4.895 15.375 1.00 0.00 H new ATOM 1588 N GLU A 96 39.756 -5.467 12.868 1.00 0.00 N ATOM 1589 CA GLU A 96 40.985 -6.252 12.821 1.00 0.00 C ATOM 1590 C GLU A 96 42.193 -5.447 13.294 1.00 0.00 C ATOM 1591 O GLU A 96 42.926 -5.882 14.181 1.00 0.00 O ATOM 1592 CB GLU A 96 41.237 -6.732 11.391 1.00 0.00 C ATOM 1593 CG GLU A 96 40.212 -7.805 11.022 1.00 0.00 C ATOM 1594 CD GLU A 96 40.334 -8.156 9.543 1.00 0.00 C ATOM 1595 OE1 GLU A 96 41.000 -7.421 8.833 1.00 0.00 O ATOM 1596 OE2 GLU A 96 39.758 -9.154 9.142 1.00 0.00 O ATOM 0 H GLU A 96 39.528 -4.972 12.006 1.00 0.00 H new ATOM 0 HA GLU A 96 40.856 -7.102 13.492 1.00 0.00 H new ATOM 0 HB2 GLU A 96 41.167 -5.894 10.698 1.00 0.00 H new ATOM 0 HB3 GLU A 96 42.246 -7.134 11.304 1.00 0.00 H new ATOM 0 HG2 GLU A 96 40.371 -8.696 11.630 1.00 0.00 H new ATOM 0 HG3 GLU A 96 39.205 -7.447 11.238 1.00 0.00 H new ATOM 1603 N ASN A 97 42.407 -4.283 12.690 1.00 0.00 N ATOM 1604 CA ASN A 97 43.541 -3.448 13.055 1.00 0.00 C ATOM 1605 C ASN A 97 43.417 -2.928 14.482 1.00 0.00 C ATOM 1606 O ASN A 97 44.391 -2.915 15.230 1.00 0.00 O ATOM 1607 CB ASN A 97 43.647 -2.270 12.089 1.00 0.00 C ATOM 1608 CG ASN A 97 44.062 -2.764 10.707 1.00 0.00 C ATOM 1609 OD1 ASN A 97 43.323 -2.593 9.738 1.00 0.00 O ATOM 1610 ND2 ASN A 97 45.209 -3.369 10.559 1.00 0.00 N ATOM 0 H ASN A 97 41.815 -3.901 11.952 1.00 0.00 H new ATOM 0 HA ASN A 97 44.441 -4.060 12.995 1.00 0.00 H new ATOM 0 HB2 ASN A 97 42.690 -1.753 12.027 1.00 0.00 H new ATOM 0 HB3 ASN A 97 44.375 -1.549 12.460 1.00 0.00 H new ATOM 0 HD21 ASN A 97 45.495 -3.702 9.638 1.00 0.00 H new ATOM 0 HD22 ASN A 97 45.819 -3.509 11.364 1.00 0.00 H new ATOM 1617 N LYS A 98 42.217 -2.497 14.857 1.00 0.00 N ATOM 1618 CA LYS A 98 41.995 -1.975 16.201 1.00 0.00 C ATOM 1619 C LYS A 98 42.184 -3.066 17.239 1.00 0.00 C ATOM 1620 O LYS A 98 42.808 -2.847 18.276 1.00 0.00 O ATOM 1621 CB LYS A 98 40.586 -1.397 16.325 1.00 0.00 C ATOM 1622 CG LYS A 98 40.394 -0.814 17.726 1.00 0.00 C ATOM 1623 CD LYS A 98 41.423 0.293 17.969 1.00 0.00 C ATOM 1624 CE LYS A 98 41.216 1.417 16.953 1.00 0.00 C ATOM 1625 NZ LYS A 98 42.167 2.527 17.239 1.00 0.00 N ATOM 0 H LYS A 98 41.392 -2.498 14.257 1.00 0.00 H new ATOM 0 HA LYS A 98 42.725 -1.185 16.378 1.00 0.00 H new ATOM 0 HB2 LYS A 98 40.432 -0.623 15.573 1.00 0.00 H new ATOM 0 HB3 LYS A 98 39.845 -2.174 16.139 1.00 0.00 H new ATOM 0 HG2 LYS A 98 39.385 -0.415 17.829 1.00 0.00 H new ATOM 0 HG3 LYS A 98 40.505 -1.598 18.475 1.00 0.00 H new ATOM 0 HD2 LYS A 98 41.322 0.682 18.982 1.00 0.00 H new ATOM 0 HD3 LYS A 98 42.432 -0.109 17.881 1.00 0.00 H new ATOM 0 HE2 LYS A 98 41.373 1.041 15.942 1.00 0.00 H new ATOM 0 HE3 LYS A 98 40.190 1.781 17.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 41.646 3.426 17.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 42.643 2.351 18.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 42.876 2.580 16.480 1.00 0.00 H new ATOM 1639 N LEU A 99 41.644 -4.244 16.952 1.00 0.00 N ATOM 1640 CA LEU A 99 41.763 -5.363 17.872 1.00 0.00 C ATOM 1641 C LEU A 99 43.229 -5.721 18.077 1.00 0.00 C ATOM 1642 O LEU A 99 43.664 -5.989 19.197 1.00 0.00 O ATOM 1643 CB LEU A 99 40.997 -6.571 17.331 1.00 0.00 C ATOM 1644 CG LEU A 99 39.524 -6.474 17.738 1.00 0.00 C ATOM 1645 CD1 LEU A 99 38.965 -5.100 17.361 1.00 0.00 C ATOM 1646 CD2 LEU A 99 38.726 -7.564 17.017 1.00 0.00 C ATOM 0 H LEU A 99 41.125 -4.446 16.098 1.00 0.00 H new ATOM 0 HA LEU A 99 41.335 -5.075 18.832 1.00 0.00 H new ATOM 0 HB2 LEU A 99 41.082 -6.611 16.245 1.00 0.00 H new ATOM 0 HB3 LEU A 99 41.431 -7.492 17.719 1.00 0.00 H new ATOM 0 HG LEU A 99 39.441 -6.608 18.816 1.00 0.00 H new ATOM 0 HD11 LEU A 99 37.917 -5.041 17.654 1.00 0.00 H new ATOM 0 HD12 LEU A 99 39.531 -4.323 17.876 1.00 0.00 H new ATOM 0 HD13 LEU A 99 39.049 -4.956 16.284 1.00 0.00 H new ATOM 0 HD21 LEU A 99 37.677 -7.497 17.305 1.00 0.00 H new ATOM 0 HD22 LEU A 99 38.816 -7.428 15.939 1.00 0.00 H new ATOM 0 HD23 LEU A 99 39.116 -8.544 17.293 1.00 0.00 H new ATOM 1658 N ASP A 100 43.989 -5.706 16.989 1.00 0.00 N ATOM 1659 CA ASP A 100 45.412 -6.013 17.057 1.00 0.00 C ATOM 1660 C ASP A 100 46.133 -4.992 17.929 1.00 0.00 C ATOM 1661 O ASP A 100 47.036 -5.334 18.692 1.00 0.00 O ATOM 1662 CB ASP A 100 46.014 -5.996 15.650 1.00 0.00 C ATOM 1663 CG ASP A 100 45.541 -7.214 14.864 1.00 0.00 C ATOM 1664 OD1 ASP A 100 44.996 -8.117 15.480 1.00 0.00 O ATOM 1665 OD2 ASP A 100 45.728 -7.226 13.659 1.00 0.00 O ATOM 0 H ASP A 100 43.646 -5.486 16.054 1.00 0.00 H new ATOM 0 HA ASP A 100 45.534 -7.004 17.495 1.00 0.00 H new ATOM 0 HB2 ASP A 100 45.722 -5.083 15.132 1.00 0.00 H new ATOM 0 HB3 ASP A 100 47.102 -5.993 15.711 1.00 0.00 H new ATOM 1670 N LYS A 101 45.731 -3.733 17.795 1.00 0.00 N ATOM 1671 CA LYS A 101 46.341 -2.652 18.559 1.00 0.00 C ATOM 1672 C LYS A 101 46.110 -2.838 20.055 1.00 0.00 C ATOM 1673 O LYS A 101 46.994 -2.563 20.867 1.00 0.00 O ATOM 1674 CB LYS A 101 45.746 -1.313 18.123 1.00 0.00 C ATOM 1675 CG LYS A 101 46.141 -1.031 16.675 1.00 0.00 C ATOM 1676 CD LYS A 101 47.651 -0.794 16.591 1.00 0.00 C ATOM 1677 CE LYS A 101 48.039 -0.490 15.143 1.00 0.00 C ATOM 1678 NZ LYS A 101 47.355 0.757 14.696 1.00 0.00 N ATOM 0 H LYS A 101 44.986 -3.436 17.165 1.00 0.00 H new ATOM 0 HA LYS A 101 47.414 -2.666 18.367 1.00 0.00 H new ATOM 0 HB2 LYS A 101 44.660 -1.337 18.218 1.00 0.00 H new ATOM 0 HB3 LYS A 101 46.105 -0.514 18.772 1.00 0.00 H new ATOM 0 HG2 LYS A 101 45.859 -1.871 16.040 1.00 0.00 H new ATOM 0 HG3 LYS A 101 45.604 -0.157 16.305 1.00 0.00 H new ATOM 0 HD2 LYS A 101 47.936 0.036 17.237 1.00 0.00 H new ATOM 0 HD3 LYS A 101 48.188 -1.673 16.946 1.00 0.00 H new ATOM 0 HE2 LYS A 101 49.120 -0.374 15.062 1.00 0.00 H new ATOM 0 HE3 LYS A 101 47.759 -1.323 14.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 48.029 1.356 14.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 46.559 0.512 14.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 46.999 1.274 15.525 1.00 0.00 H new ATOM 1692 N ILE A 102 44.915 -3.293 20.415 1.00 0.00 N ATOM 1693 CA ILE A 102 44.584 -3.492 21.822 1.00 0.00 C ATOM 1694 C ILE A 102 45.220 -4.771 22.349 1.00 0.00 C ATOM 1695 O ILE A 102 45.739 -4.804 23.466 1.00 0.00 O ATOM 1696 CB ILE A 102 43.067 -3.558 22.016 1.00 0.00 C ATOM 1697 CG1 ILE A 102 42.353 -3.187 20.716 1.00 0.00 C ATOM 1698 CG2 ILE A 102 42.660 -2.565 23.103 1.00 0.00 C ATOM 1699 CD1 ILE A 102 40.849 -3.082 20.970 1.00 0.00 C ATOM 0 H ILE A 102 44.168 -3.529 19.762 1.00 0.00 H new ATOM 0 HA ILE A 102 44.978 -2.643 22.381 1.00 0.00 H new ATOM 0 HB ILE A 102 42.788 -4.572 22.303 1.00 0.00 H new ATOM 0 HG12 ILE A 102 42.735 -2.239 20.337 1.00 0.00 H new ATOM 0 HG13 ILE A 102 42.552 -3.939 19.953 1.00 0.00 H new ATOM 0 HG21 ILE A 102 41.580 -2.606 23.247 1.00 0.00 H new ATOM 0 HG22 ILE A 102 43.161 -2.822 24.036 1.00 0.00 H new ATOM 0 HG23 ILE A 102 42.948 -1.558 22.802 1.00 0.00 H new ATOM 0 HD11 ILE A 102 40.341 -2.817 20.043 1.00 0.00 H new ATOM 0 HD12 ILE A 102 40.473 -4.040 21.329 1.00 0.00 H new ATOM 0 HD13 ILE A 102 40.659 -2.314 21.719 1.00 0.00 H new ATOM 1711 N ILE A 103 45.178 -5.824 21.544 1.00 0.00 N ATOM 1712 CA ILE A 103 45.755 -7.099 21.948 1.00 0.00 C ATOM 1713 C ILE A 103 47.255 -6.956 22.187 1.00 0.00 C ATOM 1714 O ILE A 103 47.784 -7.446 23.183 1.00 0.00 O ATOM 1715 CB ILE A 103 45.507 -8.150 20.864 1.00 0.00 C ATOM 1716 CG1 ILE A 103 44.013 -8.474 20.803 1.00 0.00 C ATOM 1717 CG2 ILE A 103 46.289 -9.422 21.197 1.00 0.00 C ATOM 1718 CD1 ILE A 103 43.722 -9.307 19.555 1.00 0.00 C ATOM 0 H ILE A 103 44.755 -5.822 20.616 1.00 0.00 H new ATOM 0 HA ILE A 103 45.279 -7.415 22.876 1.00 0.00 H new ATOM 0 HB ILE A 103 45.837 -7.762 19.900 1.00 0.00 H new ATOM 0 HG12 ILE A 103 43.712 -9.021 21.696 1.00 0.00 H new ATOM 0 HG13 ILE A 103 43.431 -7.553 20.782 1.00 0.00 H new ATOM 0 HG21 ILE A 103 46.112 -10.171 20.425 1.00 0.00 H new ATOM 0 HG22 ILE A 103 47.354 -9.193 21.243 1.00 0.00 H new ATOM 0 HG23 ILE A 103 45.959 -9.810 22.161 1.00 0.00 H new ATOM 0 HD11 ILE A 103 42.658 -9.538 19.512 1.00 0.00 H new ATOM 0 HD12 ILE A 103 44.008 -8.744 18.667 1.00 0.00 H new ATOM 0 HD13 ILE A 103 44.293 -10.235 19.595 1.00 0.00 H new ATOM 1730 N GLU A 104 47.935 -6.286 21.263 1.00 0.00 N ATOM 1731 CA GLU A 104 49.376 -6.092 21.385 1.00 0.00 C ATOM 1732 C GLU A 104 49.725 -5.279 22.630 1.00 0.00 C ATOM 1733 O GLU A 104 50.645 -5.628 23.372 1.00 0.00 O ATOM 1734 CB GLU A 104 49.908 -5.376 20.142 1.00 0.00 C ATOM 1735 CG GLU A 104 51.418 -5.171 20.278 1.00 0.00 C ATOM 1736 CD GLU A 104 52.123 -6.521 20.348 1.00 0.00 C ATOM 1737 OE1 GLU A 104 51.524 -7.502 19.938 1.00 0.00 O ATOM 1738 OE2 GLU A 104 53.252 -6.554 20.810 1.00 0.00 O ATOM 0 H GLU A 104 47.518 -5.872 20.430 1.00 0.00 H new ATOM 0 HA GLU A 104 49.841 -7.073 21.477 1.00 0.00 H new ATOM 0 HB2 GLU A 104 49.689 -5.963 19.250 1.00 0.00 H new ATOM 0 HB3 GLU A 104 49.409 -4.414 20.022 1.00 0.00 H new ATOM 0 HG2 GLU A 104 51.794 -4.599 19.430 1.00 0.00 H new ATOM 0 HG3 GLU A 104 51.635 -4.591 21.175 1.00 0.00 H new ATOM 1745 N LYS A 105 48.994 -4.188 22.854 1.00 0.00 N ATOM 1746 CA LYS A 105 49.256 -3.338 24.013 1.00 0.00 C ATOM 1747 C LYS A 105 48.960 -4.065 25.316 1.00 0.00 C ATOM 1748 O LYS A 105 49.617 -3.827 26.328 1.00 0.00 O ATOM 1749 CB LYS A 105 48.403 -2.070 23.951 1.00 0.00 C ATOM 1750 CG LYS A 105 46.920 -2.441 23.937 1.00 0.00 C ATOM 1751 CD LYS A 105 46.079 -1.164 23.883 1.00 0.00 C ATOM 1752 CE LYS A 105 46.246 -0.387 25.190 1.00 0.00 C ATOM 1753 NZ LYS A 105 45.368 0.817 25.168 1.00 0.00 N ATOM 0 H LYS A 105 48.227 -3.876 22.258 1.00 0.00 H new ATOM 0 HA LYS A 105 50.314 -3.076 23.987 1.00 0.00 H new ATOM 0 HB2 LYS A 105 48.619 -1.433 24.809 1.00 0.00 H new ATOM 0 HB3 LYS A 105 48.652 -1.497 23.058 1.00 0.00 H new ATOM 0 HG2 LYS A 105 46.699 -3.072 23.076 1.00 0.00 H new ATOM 0 HG3 LYS A 105 46.669 -3.018 24.827 1.00 0.00 H new ATOM 0 HD2 LYS A 105 46.389 -0.548 23.039 1.00 0.00 H new ATOM 0 HD3 LYS A 105 45.029 -1.413 23.727 1.00 0.00 H new ATOM 0 HE2 LYS A 105 45.990 -1.022 26.038 1.00 0.00 H new ATOM 0 HE3 LYS A 105 47.287 -0.089 25.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 45.430 1.309 26.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 45.676 1.458 24.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 44.384 0.526 24.997 1.00 0.00 H new ATOM 1767 N ILE A 106 47.963 -4.938 25.293 1.00 0.00 N ATOM 1768 CA ILE A 106 47.594 -5.668 26.496 1.00 0.00 C ATOM 1769 C ILE A 106 48.671 -6.686 26.856 1.00 0.00 C ATOM 1770 O ILE A 106 48.852 -7.029 28.024 1.00 0.00 O ATOM 1771 CB ILE A 106 46.250 -6.369 26.300 1.00 0.00 C ATOM 1772 CG1 ILE A 106 45.611 -6.591 27.668 1.00 0.00 C ATOM 1773 CG2 ILE A 106 46.457 -7.720 25.612 1.00 0.00 C ATOM 1774 CD1 ILE A 106 44.146 -6.994 27.491 1.00 0.00 C ATOM 0 H ILE A 106 47.403 -5.156 24.469 1.00 0.00 H new ATOM 0 HA ILE A 106 47.502 -4.956 27.316 1.00 0.00 H new ATOM 0 HB ILE A 106 45.604 -5.751 25.676 1.00 0.00 H new ATOM 0 HG12 ILE A 106 46.149 -7.368 28.210 1.00 0.00 H new ATOM 0 HG13 ILE A 106 45.679 -5.681 28.264 1.00 0.00 H new ATOM 0 HG21 ILE A 106 45.493 -8.211 25.477 1.00 0.00 H new ATOM 0 HG22 ILE A 106 46.925 -7.565 24.640 1.00 0.00 H new ATOM 0 HG23 ILE A 106 47.101 -8.347 26.228 1.00 0.00 H new ATOM 0 HD11 ILE A 106 43.691 -7.152 28.469 1.00 0.00 H new ATOM 0 HD12 ILE A 106 43.612 -6.202 26.966 1.00 0.00 H new ATOM 0 HD13 ILE A 106 44.090 -7.915 26.911 1.00 0.00 H new ATOM 1786 N ASP A 107 49.383 -7.168 25.845 1.00 0.00 N ATOM 1787 CA ASP A 107 50.440 -8.146 26.063 1.00 0.00 C ATOM 1788 C ASP A 107 51.549 -7.563 26.935 1.00 0.00 C ATOM 1789 O ASP A 107 52.102 -8.252 27.792 1.00 0.00 O ATOM 1790 CB ASP A 107 51.022 -8.590 24.721 1.00 0.00 C ATOM 1791 CG ASP A 107 50.016 -9.462 23.979 1.00 0.00 C ATOM 1792 OD1 ASP A 107 49.058 -9.889 24.603 1.00 0.00 O ATOM 1793 OD2 ASP A 107 50.218 -9.692 22.798 1.00 0.00 O ATOM 0 H ASP A 107 49.248 -6.899 24.870 1.00 0.00 H new ATOM 0 HA ASP A 107 50.010 -9.006 26.577 1.00 0.00 H new ATOM 0 HB2 ASP A 107 51.274 -7.718 24.118 1.00 0.00 H new ATOM 0 HB3 ASP A 107 51.947 -9.144 24.882 1.00 0.00 H new ATOM 1798 N LYS A 108 51.877 -6.296 26.703 1.00 0.00 N ATOM 1799 CA LYS A 108 52.933 -5.641 27.469 1.00 0.00 C ATOM 1800 C LYS A 108 52.376 -4.982 28.728 1.00 0.00 C ATOM 1801 O LYS A 108 53.132 -4.614 29.628 1.00 0.00 O ATOM 1802 CB LYS A 108 53.617 -4.581 26.604 1.00 0.00 C ATOM 1803 CG LYS A 108 54.295 -5.253 25.409 1.00 0.00 C ATOM 1804 CD LYS A 108 55.077 -4.207 24.612 1.00 0.00 C ATOM 1805 CE LYS A 108 54.098 -3.250 23.929 1.00 0.00 C ATOM 1806 NZ LYS A 108 54.856 -2.270 23.101 1.00 0.00 N ATOM 0 H LYS A 108 51.433 -5.707 25.999 1.00 0.00 H new ATOM 0 HA LYS A 108 53.654 -6.402 27.768 1.00 0.00 H new ATOM 0 HB2 LYS A 108 52.884 -3.852 26.257 1.00 0.00 H new ATOM 0 HB3 LYS A 108 54.354 -4.036 27.194 1.00 0.00 H new ATOM 0 HG2 LYS A 108 54.966 -6.040 25.753 1.00 0.00 H new ATOM 0 HG3 LYS A 108 53.548 -5.727 24.772 1.00 0.00 H new ATOM 0 HD2 LYS A 108 55.742 -3.653 25.274 1.00 0.00 H new ATOM 0 HD3 LYS A 108 55.704 -4.696 23.867 1.00 0.00 H new ATOM 0 HE2 LYS A 108 53.403 -3.810 23.303 1.00 0.00 H new ATOM 0 HE3 LYS A 108 53.503 -2.726 24.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 54.190 -1.620 22.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 55.502 -1.728 23.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 55.405 -2.778 22.378 1.00 0.00 H new ATOM 1820 N LEU A 109 51.058 -4.831 28.790 1.00 0.00 N ATOM 1821 CA LEU A 109 50.430 -4.209 29.951 1.00 0.00 C ATOM 1822 C LEU A 109 48.973 -4.636 30.074 1.00 0.00 C ATOM 1823 O LEU A 109 48.388 -5.161 29.129 1.00 0.00 O ATOM 1824 CB LEU A 109 50.508 -2.687 29.829 1.00 0.00 C ATOM 1825 CG LEU A 109 49.472 -2.203 28.814 1.00 0.00 C ATOM 1826 CD1 LEU A 109 48.226 -1.715 29.552 1.00 0.00 C ATOM 1827 CD2 LEU A 109 50.062 -1.055 27.992 1.00 0.00 C ATOM 0 H LEU A 109 50.410 -5.126 28.060 1.00 0.00 H new ATOM 0 HA LEU A 109 50.964 -4.534 30.844 1.00 0.00 H new ATOM 0 HB2 LEU A 109 50.326 -2.224 30.799 1.00 0.00 H new ATOM 0 HB3 LEU A 109 51.508 -2.387 29.515 1.00 0.00 H new ATOM 0 HG LEU A 109 49.202 -3.024 28.150 1.00 0.00 H new ATOM 0 HD11 LEU A 109 47.487 -1.370 28.829 1.00 0.00 H new ATOM 0 HD12 LEU A 109 47.806 -2.533 30.138 1.00 0.00 H new ATOM 0 HD13 LEU A 109 48.495 -0.894 30.216 1.00 0.00 H new ATOM 0 HD21 LEU A 109 49.324 -0.709 27.268 1.00 0.00 H new ATOM 0 HD22 LEU A 109 50.332 -0.234 28.656 1.00 0.00 H new ATOM 0 HD23 LEU A 109 50.951 -1.403 27.466 1.00 0.00 H new ATOM 1839 N ASP A 110 48.389 -4.407 31.246 1.00 0.00 N ATOM 1840 CA ASP A 110 46.997 -4.773 31.477 1.00 0.00 C ATOM 1841 C ASP A 110 46.102 -3.537 31.450 1.00 0.00 C ATOM 1842 O ASP A 110 46.466 -2.482 31.972 1.00 0.00 O ATOM 1843 CB ASP A 110 46.858 -5.475 32.829 1.00 0.00 C ATOM 1844 CG ASP A 110 47.720 -6.733 32.853 1.00 0.00 C ATOM 1845 OD1 ASP A 110 47.680 -7.472 31.883 1.00 0.00 O ATOM 1846 OD2 ASP A 110 48.407 -6.939 33.840 1.00 0.00 O ATOM 0 H ASP A 110 48.854 -3.973 32.044 1.00 0.00 H new ATOM 0 HA ASP A 110 46.685 -5.450 30.682 1.00 0.00 H new ATOM 0 HB2 ASP A 110 47.160 -4.801 33.631 1.00 0.00 H new ATOM 0 HB3 ASP A 110 45.815 -5.735 33.008 1.00 0.00 H new ATOM 1851 N LEU A 111 44.927 -3.676 30.842 1.00 0.00 N ATOM 1852 CA LEU A 111 43.981 -2.569 30.757 1.00 0.00 C ATOM 1853 C LEU A 111 43.498 -2.177 32.148 1.00 0.00 C ATOM 1854 O LEU A 111 43.078 -1.043 32.377 1.00 0.00 O ATOM 1855 CB LEU A 111 42.786 -2.962 29.888 1.00 0.00 C ATOM 1856 CG LEU A 111 43.156 -2.804 28.413 1.00 0.00 C ATOM 1857 CD1 LEU A 111 44.224 -3.835 28.042 1.00 0.00 C ATOM 1858 CD2 LEU A 111 41.913 -3.025 27.548 1.00 0.00 C ATOM 0 H LEU A 111 44.609 -4.540 30.403 1.00 0.00 H new ATOM 0 HA LEU A 111 44.487 -1.716 30.304 1.00 0.00 H new ATOM 0 HB2 LEU A 111 42.497 -3.993 30.093 1.00 0.00 H new ATOM 0 HB3 LEU A 111 41.927 -2.336 30.128 1.00 0.00 H new ATOM 0 HG LEU A 111 43.544 -1.800 28.242 1.00 0.00 H new ATOM 0 HD11 LEU A 111 44.488 -3.723 26.990 1.00 0.00 H new ATOM 0 HD12 LEU A 111 45.110 -3.679 28.657 1.00 0.00 H new ATOM 0 HD13 LEU A 111 43.836 -4.839 28.213 1.00 0.00 H new ATOM 0 HD21 LEU A 111 42.177 -2.912 26.496 1.00 0.00 H new ATOM 0 HD22 LEU A 111 41.524 -4.029 27.719 1.00 0.00 H new ATOM 0 HD23 LEU A 111 41.151 -2.291 27.812 1.00 0.00 H new ATOM 1870 N ASP A 112 43.563 -3.127 33.072 1.00 0.00 N ATOM 1871 CA ASP A 112 43.131 -2.885 34.444 1.00 0.00 C ATOM 1872 C ASP A 112 43.926 -1.738 35.059 1.00 0.00 C ATOM 1873 O ASP A 112 43.384 -0.928 35.809 1.00 0.00 O ATOM 1874 CB ASP A 112 43.321 -4.149 35.282 1.00 0.00 C ATOM 1875 CG ASP A 112 42.774 -3.929 36.688 1.00 0.00 C ATOM 1876 OD1 ASP A 112 42.432 -2.800 36.999 1.00 0.00 O ATOM 1877 OD2 ASP A 112 42.706 -4.892 37.434 1.00 0.00 O ATOM 0 H ASP A 112 43.910 -4.070 32.898 1.00 0.00 H new ATOM 0 HA ASP A 112 42.075 -2.615 34.432 1.00 0.00 H new ATOM 0 HB2 ASP A 112 42.809 -4.988 34.811 1.00 0.00 H new ATOM 0 HB3 ASP A 112 44.379 -4.408 35.331 1.00 0.00 H new ATOM 1882 N LYS A 113 45.213 -1.677 34.735 1.00 0.00 N ATOM 1883 CA LYS A 113 46.071 -0.622 35.260 1.00 0.00 C ATOM 1884 C LYS A 113 45.599 0.733 34.760 1.00 0.00 C ATOM 1885 O LYS A 113 45.608 1.719 35.496 1.00 0.00 O ATOM 1886 CB LYS A 113 47.514 -0.846 34.805 1.00 0.00 C ATOM 1887 CG LYS A 113 48.153 -1.964 35.634 1.00 0.00 C ATOM 1888 CD LYS A 113 47.118 -3.055 35.916 1.00 0.00 C ATOM 1889 CE LYS A 113 47.748 -4.142 36.788 1.00 0.00 C ATOM 1890 NZ LYS A 113 48.878 -4.777 36.051 1.00 0.00 N ATOM 0 H LYS A 113 45.682 -2.339 34.117 1.00 0.00 H new ATOM 0 HA LYS A 113 46.022 -0.646 36.349 1.00 0.00 H new ATOM 0 HB2 LYS A 113 47.535 -1.108 33.747 1.00 0.00 H new ATOM 0 HB3 LYS A 113 48.087 0.075 34.916 1.00 0.00 H new ATOM 0 HG2 LYS A 113 49.003 -2.386 35.098 1.00 0.00 H new ATOM 0 HG3 LYS A 113 48.535 -1.561 36.572 1.00 0.00 H new ATOM 0 HD2 LYS A 113 46.251 -2.627 36.419 1.00 0.00 H new ATOM 0 HD3 LYS A 113 46.763 -3.485 34.980 1.00 0.00 H new ATOM 0 HE2 LYS A 113 48.106 -3.711 37.723 1.00 0.00 H new ATOM 0 HE3 LYS A 113 47.002 -4.893 37.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 48.851 -5.807 36.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 48.793 -4.566 35.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 49.780 -4.401 36.408 1.00 0.00 H new ATOM 1904 N TYR A 114 45.186 0.769 33.503 1.00 0.00 N ATOM 1905 CA TYR A 114 44.709 2.002 32.902 1.00 0.00 C ATOM 1906 C TYR A 114 43.290 2.303 33.371 1.00 0.00 C ATOM 1907 O TYR A 114 42.456 1.403 33.463 1.00 0.00 O ATOM 1908 CB TYR A 114 44.712 1.864 31.384 1.00 0.00 C ATOM 1909 CG TYR A 114 46.126 1.711 30.876 1.00 0.00 C ATOM 1910 CD1 TYR A 114 46.352 1.137 29.621 1.00 0.00 C ATOM 1911 CD2 TYR A 114 47.207 2.143 31.654 1.00 0.00 C ATOM 1912 CE1 TYR A 114 47.657 0.992 29.140 1.00 0.00 C ATOM 1913 CE2 TYR A 114 48.514 1.999 31.174 1.00 0.00 C ATOM 1914 CZ TYR A 114 48.740 1.423 29.917 1.00 0.00 C ATOM 1915 OH TYR A 114 50.027 1.280 29.444 1.00 0.00 O ATOM 0 H TYR A 114 45.172 -0.040 32.881 1.00 0.00 H new ATOM 0 HA TYR A 114 45.368 2.816 33.203 1.00 0.00 H new ATOM 0 HB2 TYR A 114 44.117 1.000 31.089 1.00 0.00 H new ATOM 0 HB3 TYR A 114 44.248 2.740 30.931 1.00 0.00 H new ATOM 0 HD1 TYR A 114 45.517 0.805 29.022 1.00 0.00 H new ATOM 0 HD2 TYR A 114 47.033 2.587 32.623 1.00 0.00 H new ATOM 0 HE1 TYR A 114 47.830 0.548 28.171 1.00 0.00 H new ATOM 0 HE2 TYR A 114 49.349 2.332 31.773 1.00 0.00 H new ATOM 0 HH TYR A 114 50.028 1.362 28.467 1.00 0.00 H new ATOM 1925 N ARG A 115 43.015 3.572 33.658 1.00 0.00 N ATOM 1926 CA ARG A 115 41.683 3.961 34.103 1.00 0.00 C ATOM 1927 C ARG A 115 40.851 4.460 32.927 1.00 0.00 C ATOM 1928 O ARG A 115 39.651 4.197 32.848 1.00 0.00 O ATOM 1929 CB ARG A 115 41.776 5.056 35.167 1.00 0.00 C ATOM 1930 CG ARG A 115 42.567 4.536 36.368 1.00 0.00 C ATOM 1931 CD ARG A 115 42.529 5.575 37.491 1.00 0.00 C ATOM 1932 NE ARG A 115 41.184 5.668 38.046 1.00 0.00 N ATOM 1933 CZ ARG A 115 40.744 4.784 38.936 1.00 0.00 C ATOM 1934 NH1 ARG A 115 41.519 3.810 39.325 1.00 0.00 N ATOM 1935 NH2 ARG A 115 39.537 4.890 39.420 1.00 0.00 N ATOM 0 H ARG A 115 43.686 4.337 33.592 1.00 0.00 H new ATOM 0 HA ARG A 115 41.198 3.085 34.533 1.00 0.00 H new ATOM 0 HB2 ARG A 115 42.262 5.939 34.753 1.00 0.00 H new ATOM 0 HB3 ARG A 115 40.777 5.359 35.480 1.00 0.00 H new ATOM 0 HG2 ARG A 115 42.144 3.593 36.715 1.00 0.00 H new ATOM 0 HG3 ARG A 115 43.598 4.335 36.079 1.00 0.00 H new ATOM 0 HD2 ARG A 115 43.235 5.300 38.274 1.00 0.00 H new ATOM 0 HD3 ARG A 115 42.840 6.547 37.108 1.00 0.00 H new ATOM 0 HE ARG A 115 40.570 6.425 37.746 1.00 0.00 H new ATOM 0 HH11 ARG A 115 42.462 3.727 38.946 1.00 0.00 H new ATOM 0 HH12 ARG A 115 41.182 3.132 40.008 1.00 0.00 H new ATOM 0 HH21 ARG A 115 38.930 5.651 39.115 1.00 0.00 H new ATOM 0 HH22 ARG A 115 39.200 4.211 40.103 1.00 0.00 H new ATOM 1949 N PHE A 116 41.496 5.178 32.012 1.00 0.00 N ATOM 1950 CA PHE A 116 40.799 5.702 30.843 1.00 0.00 C ATOM 1951 C PHE A 116 41.552 5.361 29.560 1.00 0.00 C ATOM 1952 O PHE A 116 42.749 5.624 29.443 1.00 0.00 O ATOM 1953 CB PHE A 116 40.649 7.219 30.962 1.00 0.00 C ATOM 1954 CG PHE A 116 39.822 7.547 32.181 1.00 0.00 C ATOM 1955 CD1 PHE A 116 40.449 7.785 33.410 1.00 0.00 C ATOM 1956 CD2 PHE A 116 38.428 7.618 32.082 1.00 0.00 C ATOM 1957 CE1 PHE A 116 39.682 8.092 34.540 1.00 0.00 C ATOM 1958 CE2 PHE A 116 37.660 7.924 33.212 1.00 0.00 C ATOM 1959 CZ PHE A 116 38.287 8.160 34.441 1.00 0.00 C ATOM 0 H PHE A 116 42.489 5.408 32.056 1.00 0.00 H new ATOM 0 HA PHE A 116 39.813 5.240 30.799 1.00 0.00 H new ATOM 0 HB2 PHE A 116 41.630 7.688 31.038 1.00 0.00 H new ATOM 0 HB3 PHE A 116 40.173 7.620 30.067 1.00 0.00 H new ATOM 0 HD1 PHE A 116 41.525 7.732 33.486 1.00 0.00 H new ATOM 0 HD2 PHE A 116 37.944 7.437 31.134 1.00 0.00 H new ATOM 0 HE1 PHE A 116 40.166 8.276 35.488 1.00 0.00 H new ATOM 0 HE2 PHE A 116 36.584 7.978 33.135 1.00 0.00 H new ATOM 0 HZ PHE A 116 37.695 8.395 35.313 1.00 0.00 H new ATOM 1969 N ILE A 117 40.839 4.783 28.598 1.00 0.00 N ATOM 1970 CA ILE A 117 41.444 4.419 27.320 1.00 0.00 C ATOM 1971 C ILE A 117 40.522 4.831 26.192 1.00 0.00 C ATOM 1972 O ILE A 117 39.314 4.605 26.255 1.00 0.00 O ATOM 1973 CB ILE A 117 41.684 2.916 27.261 1.00 0.00 C ATOM 1974 CG1 ILE A 117 41.882 2.408 28.681 1.00 0.00 C ATOM 1975 CG2 ILE A 117 42.938 2.626 26.433 1.00 0.00 C ATOM 1976 CD1 ILE A 117 40.568 1.824 29.197 1.00 0.00 C ATOM 0 H ILE A 117 39.847 4.557 28.677 1.00 0.00 H new ATOM 0 HA ILE A 117 42.400 4.933 27.219 1.00 0.00 H new ATOM 0 HB ILE A 117 40.833 2.418 26.797 1.00 0.00 H new ATOM 0 HG12 ILE A 117 42.664 1.649 28.702 1.00 0.00 H new ATOM 0 HG13 ILE A 117 42.210 3.221 29.328 1.00 0.00 H new ATOM 0 HG21 ILE A 117 43.107 1.550 26.393 1.00 0.00 H new ATOM 0 HG22 ILE A 117 42.803 3.010 25.422 1.00 0.00 H new ATOM 0 HG23 ILE A 117 43.798 3.111 26.894 1.00 0.00 H new ATOM 0 HD11 ILE A 117 40.707 1.459 30.215 1.00 0.00 H new ATOM 0 HD12 ILE A 117 39.799 2.596 29.190 1.00 0.00 H new ATOM 0 HD13 ILE A 117 40.259 0.999 28.555 1.00 0.00 H new ATOM 1988 N ASN A 118 41.079 5.457 25.172 1.00 0.00 N ATOM 1989 CA ASN A 118 40.261 5.910 24.067 1.00 0.00 C ATOM 1990 C ASN A 118 41.035 5.868 22.754 1.00 0.00 C ATOM 1991 O ASN A 118 41.973 6.637 22.547 1.00 0.00 O ATOM 1992 CB ASN A 118 39.794 7.325 24.373 1.00 0.00 C ATOM 1993 CG ASN A 118 38.734 7.762 23.367 1.00 0.00 C ATOM 1994 OD1 ASN A 118 38.652 7.206 22.271 1.00 0.00 O ATOM 1995 ND2 ASN A 118 37.915 8.729 23.674 1.00 0.00 N ATOM 0 H ASN A 118 42.075 5.660 25.087 1.00 0.00 H new ATOM 0 HA ASN A 118 39.402 5.249 23.951 1.00 0.00 H new ATOM 0 HB2 ASN A 118 39.387 7.370 25.383 1.00 0.00 H new ATOM 0 HB3 ASN A 118 40.641 8.010 24.340 1.00 0.00 H new ATOM 0 HD21 ASN A 118 37.204 9.027 23.006 1.00 0.00 H new ATOM 0 HD22 ASN A 118 37.985 9.188 24.582 1.00 0.00 H new ATOM 2002 N ALA A 119 40.626 4.962 21.870 1.00 0.00 N ATOM 2003 CA ALA A 119 41.277 4.816 20.574 1.00 0.00 C ATOM 2004 C ALA A 119 40.738 5.838 19.580 1.00 0.00 C ATOM 2005 O ALA A 119 39.584 6.260 19.663 1.00 0.00 O ATOM 2006 CB ALA A 119 41.047 3.405 20.030 1.00 0.00 C ATOM 0 H ALA A 119 39.849 4.320 22.028 1.00 0.00 H new ATOM 0 HA ALA A 119 42.345 4.987 20.707 1.00 0.00 H new ATOM 0 HB1 ALA A 119 41.537 3.304 19.061 1.00 0.00 H new ATOM 0 HB2 ALA A 119 41.463 2.675 20.725 1.00 0.00 H new ATOM 0 HB3 ALA A 119 39.977 3.229 19.916 1.00 0.00 H new ATOM 2012 N THR A 120 41.590 6.228 18.641 1.00 0.00 N ATOM 2013 CA THR A 120 41.212 7.203 17.628 1.00 0.00 C ATOM 2014 C THR A 120 41.312 6.576 16.242 1.00 0.00 C ATOM 2015 O THR A 120 41.963 5.545 16.065 1.00 0.00 O ATOM 2016 CB THR A 120 42.135 8.421 17.714 1.00 0.00 C ATOM 2017 OG1 THR A 120 43.456 8.032 17.371 1.00 0.00 O ATOM 2018 CG2 THR A 120 42.121 8.972 19.140 1.00 0.00 C ATOM 0 H THR A 120 42.547 5.884 18.560 1.00 0.00 H new ATOM 0 HA THR A 120 40.183 7.519 17.802 1.00 0.00 H new ATOM 0 HB THR A 120 41.789 9.191 17.025 1.00 0.00 H new ATOM 0 HG1 THR A 120 44.055 8.206 18.127 1.00 0.00 H new ATOM 0 HG21 THR A 120 42.778 9.839 19.201 1.00 0.00 H new ATOM 0 HG22 THR A 120 41.106 9.266 19.406 1.00 0.00 H new ATOM 0 HG23 THR A 120 42.469 8.204 19.830 1.00 0.00 H new ATOM 2026 N ASN A 121 40.661 7.192 15.263 1.00 0.00 N ATOM 2027 CA ASN A 121 40.685 6.666 13.903 1.00 0.00 C ATOM 2028 C ASN A 121 42.068 6.116 13.572 1.00 0.00 C ATOM 2029 O ASN A 121 43.076 6.583 14.104 1.00 0.00 O ATOM 2030 CB ASN A 121 40.319 7.769 12.909 1.00 0.00 C ATOM 2031 CG ASN A 121 39.920 7.155 11.572 1.00 0.00 C ATOM 2032 OD1 ASN A 121 39.313 6.084 11.537 1.00 0.00 O ATOM 2033 ND2 ASN A 121 40.226 7.771 10.464 1.00 0.00 N ATOM 0 H ASN A 121 40.116 8.046 15.382 1.00 0.00 H new ATOM 0 HA ASN A 121 39.956 5.859 13.830 1.00 0.00 H new ATOM 0 HB2 ASN A 121 39.498 8.367 13.303 1.00 0.00 H new ATOM 0 HB3 ASN A 121 41.166 8.441 12.771 1.00 0.00 H new ATOM 0 HD21 ASN A 121 39.963 7.366 9.566 1.00 0.00 H new ATOM 0 HD22 ASN A 121 40.729 8.658 10.496 1.00 0.00 H new ATOM 2040 N LEU A 122 42.109 5.111 12.702 1.00 0.00 N ATOM 2041 CA LEU A 122 43.374 4.492 12.322 1.00 0.00 C ATOM 2042 C LEU A 122 44.419 5.556 12.008 1.00 0.00 C ATOM 2043 O LEU A 122 45.599 5.387 12.314 1.00 0.00 O ATOM 2044 CB LEU A 122 43.170 3.594 11.100 1.00 0.00 C ATOM 2045 CG LEU A 122 42.416 4.368 10.018 1.00 0.00 C ATOM 2046 CD1 LEU A 122 43.379 4.740 8.890 1.00 0.00 C ATOM 2047 CD2 LEU A 122 41.291 3.493 9.459 1.00 0.00 C ATOM 0 H LEU A 122 41.287 4.710 12.250 1.00 0.00 H new ATOM 0 HA LEU A 122 43.728 3.890 13.159 1.00 0.00 H new ATOM 0 HB2 LEU A 122 44.134 3.258 10.717 1.00 0.00 H new ATOM 0 HB3 LEU A 122 42.610 2.702 11.381 1.00 0.00 H new ATOM 0 HG LEU A 122 41.994 5.276 10.448 1.00 0.00 H new ATOM 0 HD11 LEU A 122 42.841 5.292 8.119 1.00 0.00 H new ATOM 0 HD12 LEU A 122 44.182 5.361 9.287 1.00 0.00 H new ATOM 0 HD13 LEU A 122 43.802 3.833 8.459 1.00 0.00 H new ATOM 0 HD21 LEU A 122 40.752 4.043 8.687 1.00 0.00 H new ATOM 0 HD22 LEU A 122 41.715 2.586 9.029 1.00 0.00 H new ATOM 0 HD23 LEU A 122 40.604 3.227 10.262 1.00 0.00 H new ATOM 2059 N GLU A 123 43.980 6.659 11.412 1.00 0.00 N ATOM 2060 CA GLU A 123 44.893 7.745 11.084 1.00 0.00 C ATOM 2061 C GLU A 123 45.426 8.374 12.366 1.00 0.00 C ATOM 2062 O GLU A 123 46.576 8.809 12.431 1.00 0.00 O ATOM 2063 CB GLU A 123 44.170 8.804 10.251 1.00 0.00 C ATOM 2064 CG GLU A 123 43.869 8.244 8.860 1.00 0.00 C ATOM 2065 CD GLU A 123 43.001 9.224 8.079 1.00 0.00 C ATOM 2066 OE1 GLU A 123 42.497 10.154 8.688 1.00 0.00 O ATOM 2067 OE2 GLU A 123 42.853 9.031 6.883 1.00 0.00 O ATOM 0 H GLU A 123 43.008 6.823 11.149 1.00 0.00 H new ATOM 0 HA GLU A 123 45.726 7.346 10.505 1.00 0.00 H new ATOM 0 HB2 GLU A 123 43.244 9.099 10.744 1.00 0.00 H new ATOM 0 HB3 GLU A 123 44.786 9.699 10.168 1.00 0.00 H new ATOM 0 HG2 GLU A 123 44.800 8.062 8.323 1.00 0.00 H new ATOM 0 HG3 GLU A 123 43.359 7.284 8.948 1.00 0.00 H new ATOM 2074 N HIS A 124 44.574 8.411 13.385 1.00 0.00 N ATOM 2075 CA HIS A 124 44.946 8.981 14.673 1.00 0.00 C ATOM 2076 C HIS A 124 45.609 7.928 15.560 1.00 0.00 C ATOM 2077 O HIS A 124 45.514 6.729 15.298 1.00 0.00 O ATOM 2078 CB HIS A 124 43.706 9.538 15.373 1.00 0.00 C ATOM 2079 CG HIS A 124 43.102 10.628 14.532 1.00 0.00 C ATOM 2080 ND1 HIS A 124 41.947 10.684 13.792 1.00 0.00 N flip ATOM 2081 CD2 HIS A 124 43.709 11.865 14.378 1.00 0.00 C flip ATOM 2082 CE1 HIS A 124 41.836 11.933 13.188 1.00 0.00 C flip ATOM 2083 NE2 HIS A 124 42.924 12.605 13.574 1.00 0.00 N flip ATOM 0 H HIS A 124 43.620 8.052 13.343 1.00 0.00 H new ATOM 0 HA HIS A 124 45.658 9.788 14.499 1.00 0.00 H new ATOM 0 HB2 HIS A 124 42.978 8.743 15.534 1.00 0.00 H new ATOM 0 HB3 HIS A 124 43.974 9.928 16.355 1.00 0.00 H new ATOM 0 HD2 HIS A 124 44.642 12.178 14.823 1.00 0.00 H new ATOM 0 HE1 HIS A 124 41.042 12.283 12.546 1.00 0.00 H new ATOM 0 HE2 HIS A 124 43.134 13.563 13.293 1.00 0.00 H new ATOM 2091 N ASP A 125 46.279 8.391 16.611 1.00 0.00 N ATOM 2092 CA ASP A 125 46.960 7.492 17.540 1.00 0.00 C ATOM 2093 C ASP A 125 46.083 7.223 18.759 1.00 0.00 C ATOM 2094 O ASP A 125 45.018 7.821 18.910 1.00 0.00 O ATOM 2095 CB ASP A 125 48.286 8.111 17.988 1.00 0.00 C ATOM 2096 CG ASP A 125 48.022 9.349 18.838 1.00 0.00 C ATOM 2097 OD1 ASP A 125 46.863 9.639 19.084 1.00 0.00 O ATOM 2098 OD2 ASP A 125 48.983 9.989 19.231 1.00 0.00 O ATOM 0 H ASP A 125 46.366 9.381 16.841 1.00 0.00 H new ATOM 0 HA ASP A 125 47.155 6.549 17.030 1.00 0.00 H new ATOM 0 HB2 ASP A 125 48.862 7.383 18.560 1.00 0.00 H new ATOM 0 HB3 ASP A 125 48.885 8.378 17.117 1.00 0.00 H new ATOM 2103 N ILE A 126 46.529 6.322 19.628 1.00 0.00 N ATOM 2104 CA ILE A 126 45.755 5.993 20.821 1.00 0.00 C ATOM 2105 C ILE A 126 46.412 6.582 22.060 1.00 0.00 C ATOM 2106 O ILE A 126 47.634 6.548 22.210 1.00 0.00 O ATOM 2107 CB ILE A 126 45.635 4.474 20.977 1.00 0.00 C ATOM 2108 CG1 ILE A 126 45.098 4.144 22.375 1.00 0.00 C ATOM 2109 CG2 ILE A 126 47.011 3.829 20.800 1.00 0.00 C ATOM 2110 CD1 ILE A 126 43.712 4.761 22.556 1.00 0.00 C ATOM 0 H ILE A 126 47.408 5.813 19.532 1.00 0.00 H new ATOM 0 HA ILE A 126 44.759 6.420 20.709 1.00 0.00 H new ATOM 0 HB ILE A 126 44.952 4.087 20.221 1.00 0.00 H new ATOM 0 HG12 ILE A 126 45.045 3.064 22.509 1.00 0.00 H new ATOM 0 HG13 ILE A 126 45.779 4.527 23.136 1.00 0.00 H new ATOM 0 HG21 ILE A 126 46.923 2.748 20.911 1.00 0.00 H new ATOM 0 HG22 ILE A 126 47.397 4.061 19.807 1.00 0.00 H new ATOM 0 HG23 ILE A 126 47.695 4.217 21.555 1.00 0.00 H new ATOM 0 HD11 ILE A 126 43.335 4.524 23.551 1.00 0.00 H new ATOM 0 HD12 ILE A 126 43.778 5.843 22.442 1.00 0.00 H new ATOM 0 HD13 ILE A 126 43.033 4.357 21.805 1.00 0.00 H new ATOM 2122 N LYS A 127 45.585 7.143 22.934 1.00 0.00 N ATOM 2123 CA LYS A 127 46.076 7.767 24.153 1.00 0.00 C ATOM 2124 C LYS A 127 45.495 7.075 25.382 1.00 0.00 C ATOM 2125 O LYS A 127 44.303 6.770 25.429 1.00 0.00 O ATOM 2126 CB LYS A 127 45.667 9.240 24.148 1.00 0.00 C ATOM 2127 CG LYS A 127 46.338 9.946 22.968 1.00 0.00 C ATOM 2128 CD LYS A 127 45.896 11.410 22.923 1.00 0.00 C ATOM 2129 CE LYS A 127 46.573 12.111 21.745 1.00 0.00 C ATOM 2130 NZ LYS A 127 46.133 13.535 21.695 1.00 0.00 N ATOM 0 H LYS A 127 44.572 7.178 22.820 1.00 0.00 H new ATOM 0 HA LYS A 127 47.162 7.678 24.192 1.00 0.00 H new ATOM 0 HB2 LYS A 127 44.583 9.328 24.071 1.00 0.00 H new ATOM 0 HB3 LYS A 127 45.960 9.714 25.085 1.00 0.00 H new ATOM 0 HG2 LYS A 127 47.422 9.886 23.065 1.00 0.00 H new ATOM 0 HG3 LYS A 127 46.073 9.448 22.035 1.00 0.00 H new ATOM 0 HD2 LYS A 127 44.812 11.471 22.822 1.00 0.00 H new ATOM 0 HD3 LYS A 127 46.158 11.909 23.856 1.00 0.00 H new ATOM 0 HE2 LYS A 127 47.657 12.057 21.850 1.00 0.00 H new ATOM 0 HE3 LYS A 127 46.318 11.607 20.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 46.593 14.013 20.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 45.101 13.575 21.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 46.398 14.012 22.581 1.00 0.00 H new ATOM 2144 N CYS A 128 46.346 6.827 26.371 1.00 0.00 N ATOM 2145 CA CYS A 128 45.910 6.168 27.595 1.00 0.00 C ATOM 2146 C CYS A 128 46.490 6.865 28.821 1.00 0.00 C ATOM 2147 O CYS A 128 47.690 7.131 28.884 1.00 0.00 O ATOM 2148 CB CYS A 128 46.349 4.702 27.583 1.00 0.00 C ATOM 2149 SG CYS A 128 45.767 3.886 29.090 1.00 0.00 S ATOM 0 H CYS A 128 47.336 7.071 26.349 1.00 0.00 H new ATOM 0 HA CYS A 128 44.822 6.223 27.644 1.00 0.00 H new ATOM 0 HB2 CYS A 128 45.946 4.198 26.705 1.00 0.00 H new ATOM 0 HB3 CYS A 128 47.435 4.637 27.518 1.00 0.00 H new ATOM 0 HG CYS A 128 46.521 2.859 29.346 1.00 0.00 H new ATOM 2155 N TYR A 129 45.633 7.154 29.795 1.00 0.00 N ATOM 2156 CA TYR A 129 46.079 7.814 31.016 1.00 0.00 C ATOM 2157 C TYR A 129 46.063 6.830 32.180 1.00 0.00 C ATOM 2158 O TYR A 129 45.080 6.117 32.387 1.00 0.00 O ATOM 2159 CB TYR A 129 45.167 9.001 31.334 1.00 0.00 C ATOM 2160 CG TYR A 129 45.281 10.033 30.238 1.00 0.00 C ATOM 2161 CD1 TYR A 129 44.396 10.003 29.153 1.00 0.00 C ATOM 2162 CD2 TYR A 129 46.271 11.022 30.306 1.00 0.00 C ATOM 2163 CE1 TYR A 129 44.501 10.960 28.137 1.00 0.00 C ATOM 2164 CE2 TYR A 129 46.375 11.979 29.290 1.00 0.00 C ATOM 2165 CZ TYR A 129 45.490 11.948 28.205 1.00 0.00 C ATOM 2166 OH TYR A 129 45.594 12.892 27.205 1.00 0.00 O ATOM 0 H TYR A 129 44.635 6.944 29.764 1.00 0.00 H new ATOM 0 HA TYR A 129 47.097 8.174 30.867 1.00 0.00 H new ATOM 0 HB2 TYR A 129 44.134 8.665 31.425 1.00 0.00 H new ATOM 0 HB3 TYR A 129 45.445 9.440 32.292 1.00 0.00 H new ATOM 0 HD1 TYR A 129 43.632 9.241 29.100 1.00 0.00 H new ATOM 0 HD2 TYR A 129 46.954 11.046 31.142 1.00 0.00 H new ATOM 0 HE1 TYR A 129 43.819 10.936 27.300 1.00 0.00 H new ATOM 0 HE2 TYR A 129 47.138 12.742 29.343 1.00 0.00 H new ATOM 0 HH TYR A 129 46.332 13.504 27.408 1.00 0.00 H new ATOM 2176 N TYR A 130 47.158 6.792 32.934 1.00 0.00 N ATOM 2177 CA TYR A 130 47.255 5.882 34.070 1.00 0.00 C ATOM 2178 C TYR A 130 46.160 6.174 35.094 1.00 0.00 C ATOM 2179 O TYR A 130 45.465 5.265 35.549 1.00 0.00 O ATOM 2180 CB TYR A 130 48.632 6.011 34.727 1.00 0.00 C ATOM 2181 CG TYR A 130 48.695 5.134 35.951 1.00 0.00 C ATOM 2182 CD1 TYR A 130 48.796 3.745 35.814 1.00 0.00 C ATOM 2183 CD2 TYR A 130 48.660 5.710 37.226 1.00 0.00 C ATOM 2184 CE1 TYR A 130 48.859 2.931 36.952 1.00 0.00 C ATOM 2185 CE2 TYR A 130 48.723 4.897 38.364 1.00 0.00 C ATOM 2186 CZ TYR A 130 48.822 3.507 38.227 1.00 0.00 C ATOM 2187 OH TYR A 130 48.885 2.706 39.348 1.00 0.00 O ATOM 0 H TYR A 130 47.982 7.374 32.781 1.00 0.00 H new ATOM 0 HA TYR A 130 47.124 4.863 33.706 1.00 0.00 H new ATOM 0 HB2 TYR A 130 49.411 5.723 34.021 1.00 0.00 H new ATOM 0 HB3 TYR A 130 48.819 7.049 35.002 1.00 0.00 H new ATOM 0 HD1 TYR A 130 48.825 3.300 34.830 1.00 0.00 H new ATOM 0 HD2 TYR A 130 48.584 6.782 37.332 1.00 0.00 H new ATOM 0 HE1 TYR A 130 48.936 1.859 36.846 1.00 0.00 H new ATOM 0 HE2 TYR A 130 48.695 5.342 39.348 1.00 0.00 H new ATOM 0 HH TYR A 130 48.849 3.265 40.152 1.00 0.00 H new ATOM 2197 N LYS A 131 46.009 7.445 35.451 1.00 0.00 N ATOM 2198 CA LYS A 131 44.993 7.845 36.421 1.00 0.00 C ATOM 2199 C LYS A 131 43.830 8.545 35.722 1.00 0.00 C ATOM 2200 O LYS A 131 42.840 8.912 36.356 1.00 0.00 O ATOM 2201 CB LYS A 131 45.606 8.781 37.465 1.00 0.00 C ATOM 2202 CG LYS A 131 44.546 9.154 38.505 1.00 0.00 C ATOM 2203 CD LYS A 131 45.171 10.058 39.569 1.00 0.00 C ATOM 2204 CE LYS A 131 44.102 10.466 40.584 1.00 0.00 C ATOM 2205 NZ LYS A 131 43.590 9.252 41.280 1.00 0.00 N ATOM 0 H LYS A 131 46.573 8.213 35.086 1.00 0.00 H new ATOM 0 HA LYS A 131 44.617 6.949 36.916 1.00 0.00 H new ATOM 0 HB2 LYS A 131 46.452 8.296 37.951 1.00 0.00 H new ATOM 0 HB3 LYS A 131 45.989 9.680 36.982 1.00 0.00 H new ATOM 0 HG2 LYS A 131 43.712 9.664 38.023 1.00 0.00 H new ATOM 0 HG3 LYS A 131 44.143 8.253 38.969 1.00 0.00 H new ATOM 0 HD2 LYS A 131 45.985 9.536 40.072 1.00 0.00 H new ATOM 0 HD3 LYS A 131 45.601 10.944 39.102 1.00 0.00 H new ATOM 0 HE2 LYS A 131 44.521 11.164 41.309 1.00 0.00 H new ATOM 0 HE3 LYS A 131 43.284 10.982 40.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 43.106 9.533 42.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 42.921 8.753 40.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 44.385 8.622 41.509 1.00 0.00 H new ATOM 2219 N GLY A 132 43.964 8.736 34.415 1.00 0.00 N ATOM 2220 CA GLY A 132 42.929 9.409 33.635 1.00 0.00 C ATOM 2221 C GLY A 132 43.321 10.857 33.379 1.00 0.00 C ATOM 2222 O GLY A 132 42.786 11.515 32.486 1.00 0.00 O ATOM 0 H GLY A 132 44.775 8.436 33.874 1.00 0.00 H new ATOM 0 HA2 GLY A 132 42.784 8.891 32.687 1.00 0.00 H new ATOM 0 HA3 GLY A 132 41.979 9.371 34.168 1.00 0.00 H new ATOM 2226 N PHE A 133 44.282 11.337 34.160 1.00 0.00 N ATOM 2227 CA PHE A 133 44.779 12.699 34.013 1.00 0.00 C ATOM 2228 C PHE A 133 46.135 12.817 34.695 1.00 0.00 C ATOM 2229 O PHE A 133 46.247 12.644 35.908 1.00 0.00 O ATOM 2230 CB PHE A 133 43.796 13.693 34.635 1.00 0.00 C ATOM 2231 CG PHE A 133 43.680 13.431 36.118 1.00 0.00 C ATOM 2232 CD1 PHE A 133 44.520 14.101 37.015 1.00 0.00 C ATOM 2233 CD2 PHE A 133 42.731 12.519 36.597 1.00 0.00 C ATOM 2234 CE1 PHE A 133 44.413 13.859 38.390 1.00 0.00 C ATOM 2235 CE2 PHE A 133 42.624 12.277 37.971 1.00 0.00 C ATOM 2236 CZ PHE A 133 43.465 12.947 38.868 1.00 0.00 C ATOM 0 H PHE A 133 44.733 10.802 34.902 1.00 0.00 H new ATOM 0 HA PHE A 133 44.882 12.929 32.953 1.00 0.00 H new ATOM 0 HB2 PHE A 133 44.137 14.714 34.461 1.00 0.00 H new ATOM 0 HB3 PHE A 133 42.819 13.598 34.161 1.00 0.00 H new ATOM 0 HD1 PHE A 133 45.251 14.805 36.646 1.00 0.00 H new ATOM 0 HD2 PHE A 133 42.082 12.002 35.906 1.00 0.00 H new ATOM 0 HE1 PHE A 133 45.062 14.376 39.082 1.00 0.00 H new ATOM 0 HE2 PHE A 133 41.893 11.573 38.340 1.00 0.00 H new ATOM 0 HZ PHE A 133 43.382 12.760 39.928 1.00 0.00 H new ATOM 2246 N LYS A 134 47.167 13.093 33.909 1.00 0.00 N ATOM 2247 CA LYS A 134 48.511 13.210 34.456 1.00 0.00 C ATOM 2248 C LYS A 134 49.544 13.303 33.340 1.00 0.00 C ATOM 2249 O LYS A 134 49.246 13.016 32.180 1.00 0.00 O ATOM 2250 CB LYS A 134 48.819 11.996 35.329 1.00 0.00 C ATOM 2251 CG LYS A 134 48.169 10.759 34.711 1.00 0.00 C ATOM 2252 CD LYS A 134 49.148 9.589 34.767 1.00 0.00 C ATOM 2253 CE LYS A 134 49.492 9.275 36.224 1.00 0.00 C ATOM 2254 NZ LYS A 134 48.269 8.810 36.934 1.00 0.00 N ATOM 0 H LYS A 134 47.101 13.239 32.902 1.00 0.00 H new ATOM 0 HA LYS A 134 48.560 14.119 35.055 1.00 0.00 H new ATOM 0 HB2 LYS A 134 49.897 11.854 35.409 1.00 0.00 H new ATOM 0 HB3 LYS A 134 48.442 12.154 36.339 1.00 0.00 H new ATOM 0 HG2 LYS A 134 47.255 10.508 35.249 1.00 0.00 H new ATOM 0 HG3 LYS A 134 47.886 10.961 33.678 1.00 0.00 H new ATOM 0 HD2 LYS A 134 48.710 8.712 34.289 1.00 0.00 H new ATOM 0 HD3 LYS A 134 50.055 9.834 34.214 1.00 0.00 H new ATOM 0 HE2 LYS A 134 50.265 8.508 36.269 1.00 0.00 H new ATOM 0 HE3 LYS A 134 49.894 10.162 36.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 48.344 9.043 37.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 47.434 9.281 36.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 48.173 7.780 36.823 1.00 0.00 H new ATOM 2268 N THR A 135 50.759 13.694 33.699 1.00 0.00 N ATOM 2269 CA THR A 135 51.832 13.809 32.721 1.00 0.00 C ATOM 2270 C THR A 135 52.244 12.428 32.213 1.00 0.00 C ATOM 2271 O THR A 135 52.849 12.307 31.147 1.00 0.00 O ATOM 2272 CB THR A 135 53.041 14.504 33.350 1.00 0.00 C ATOM 2273 OG1 THR A 135 53.967 14.855 32.332 1.00 0.00 O ATOM 2274 CG2 THR A 135 53.712 13.560 34.349 1.00 0.00 C ATOM 0 H THR A 135 51.025 13.935 34.654 1.00 0.00 H new ATOM 0 HA THR A 135 51.470 14.401 31.880 1.00 0.00 H new ATOM 0 HB THR A 135 52.713 15.405 33.869 1.00 0.00 H new ATOM 0 HG1 THR A 135 54.741 15.302 32.734 1.00 0.00 H new ATOM 0 HG21 THR A 135 54.573 14.056 34.796 1.00 0.00 H new ATOM 0 HG22 THR A 135 53.001 13.292 35.131 1.00 0.00 H new ATOM 0 HG23 THR A 135 54.041 12.658 33.833 1.00 0.00 H new ATOM 2282 N LYS A 136 51.918 11.389 32.981 1.00 0.00 N ATOM 2283 CA LYS A 136 52.270 10.026 32.588 1.00 0.00 C ATOM 2284 C LYS A 136 51.136 9.375 31.798 1.00 0.00 C ATOM 2285 O LYS A 136 50.027 9.195 32.306 1.00 0.00 O ATOM 2286 CB LYS A 136 52.580 9.181 33.827 1.00 0.00 C ATOM 2287 CG LYS A 136 52.988 7.772 33.393 1.00 0.00 C ATOM 2288 CD LYS A 136 53.332 6.937 34.628 1.00 0.00 C ATOM 2289 CE LYS A 136 53.765 5.536 34.194 1.00 0.00 C ATOM 2290 NZ LYS A 136 52.629 4.854 33.512 1.00 0.00 N ATOM 0 H LYS A 136 51.418 11.463 33.867 1.00 0.00 H new ATOM 0 HA LYS A 136 53.154 10.077 31.953 1.00 0.00 H new ATOM 0 HB2 LYS A 136 53.382 9.642 34.404 1.00 0.00 H new ATOM 0 HB3 LYS A 136 51.706 9.134 34.477 1.00 0.00 H new ATOM 0 HG2 LYS A 136 52.177 7.302 32.838 1.00 0.00 H new ATOM 0 HG3 LYS A 136 53.846 7.821 32.723 1.00 0.00 H new ATOM 0 HD2 LYS A 136 54.131 7.417 35.193 1.00 0.00 H new ATOM 0 HD3 LYS A 136 52.468 6.873 35.289 1.00 0.00 H new ATOM 0 HE2 LYS A 136 54.621 5.600 33.522 1.00 0.00 H new ATOM 0 HE3 LYS A 136 54.083 4.957 35.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 52.786 3.826 33.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 51.743 5.072 34.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 52.564 5.187 32.529 1.00 0.00 H new ATOM 2304 N LYS A 137 51.429 9.017 30.552 1.00 0.00 N ATOM 2305 CA LYS A 137 50.439 8.381 29.694 1.00 0.00 C ATOM 2306 C LYS A 137 51.122 7.458 28.690 1.00 0.00 C ATOM 2307 O LYS A 137 52.312 7.604 28.410 1.00 0.00 O ATOM 2308 CB LYS A 137 49.634 9.445 28.945 1.00 0.00 C ATOM 2309 CG LYS A 137 50.556 10.210 27.995 1.00 0.00 C ATOM 2310 CD LYS A 137 49.756 11.292 27.268 1.00 0.00 C ATOM 2311 CE LYS A 137 50.657 11.996 26.252 1.00 0.00 C ATOM 2312 NZ LYS A 137 51.778 12.670 26.965 1.00 0.00 N ATOM 0 H LYS A 137 52.341 9.156 30.116 1.00 0.00 H new ATOM 0 HA LYS A 137 49.767 7.792 30.318 1.00 0.00 H new ATOM 0 HB2 LYS A 137 48.825 8.976 28.384 1.00 0.00 H new ATOM 0 HB3 LYS A 137 49.173 10.133 29.654 1.00 0.00 H new ATOM 0 HG2 LYS A 137 51.376 10.662 28.553 1.00 0.00 H new ATOM 0 HG3 LYS A 137 51.001 9.525 27.273 1.00 0.00 H new ATOM 0 HD2 LYS A 137 48.898 10.848 26.763 1.00 0.00 H new ATOM 0 HD3 LYS A 137 49.365 12.014 27.985 1.00 0.00 H new ATOM 0 HE2 LYS A 137 51.049 11.274 25.536 1.00 0.00 H new ATOM 0 HE3 LYS A 137 50.081 12.727 25.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 52.206 13.384 26.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 51.416 13.132 27.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 52.496 11.965 27.228 1.00 0.00 H new ATOM 2326 N GLU A 138 50.365 6.510 28.151 1.00 0.00 N ATOM 2327 CA GLU A 138 50.913 5.572 27.179 1.00 0.00 C ATOM 2328 C GLU A 138 50.240 5.753 25.824 1.00 0.00 C ATOM 2329 O GLU A 138 49.033 5.987 25.746 1.00 0.00 O ATOM 2330 CB GLU A 138 50.712 4.136 27.668 1.00 0.00 C ATOM 2331 CG GLU A 138 51.411 3.955 29.016 1.00 0.00 C ATOM 2332 CD GLU A 138 52.920 4.096 28.844 1.00 0.00 C ATOM 2333 OE1 GLU A 138 53.386 3.942 27.727 1.00 0.00 O ATOM 2334 OE2 GLU A 138 53.588 4.354 29.832 1.00 0.00 O ATOM 0 H GLU A 138 49.378 6.371 28.368 1.00 0.00 H new ATOM 0 HA GLU A 138 51.979 5.770 27.070 1.00 0.00 H new ATOM 0 HB2 GLU A 138 49.648 3.919 27.766 1.00 0.00 H new ATOM 0 HB3 GLU A 138 51.115 3.432 26.940 1.00 0.00 H new ATOM 0 HG2 GLU A 138 51.047 4.697 29.726 1.00 0.00 H new ATOM 0 HG3 GLU A 138 51.174 2.975 29.429 1.00 0.00 H new ATOM 2341 N VAL A 139 51.026 5.647 24.758 1.00 0.00 N ATOM 2342 CA VAL A 139 50.493 5.804 23.410 1.00 0.00 C ATOM 2343 C VAL A 139 51.100 4.768 22.469 1.00 0.00 C ATOM 2344 O VAL A 139 52.279 4.433 22.575 1.00 0.00 O ATOM 2345 CB VAL A 139 50.797 7.210 22.889 1.00 0.00 C ATOM 2346 CG1 VAL A 139 52.311 7.417 22.828 1.00 0.00 C ATOM 2347 CG2 VAL A 139 50.204 7.371 21.487 1.00 0.00 C ATOM 0 H VAL A 139 52.027 5.455 24.800 1.00 0.00 H new ATOM 0 HA VAL A 139 49.414 5.656 23.447 1.00 0.00 H new ATOM 0 HB VAL A 139 50.357 7.949 23.559 1.00 0.00 H new ATOM 0 HG11 VAL A 139 52.527 8.419 22.457 1.00 0.00 H new ATOM 0 HG12 VAL A 139 52.735 7.301 23.826 1.00 0.00 H new ATOM 0 HG13 VAL A 139 52.752 6.679 22.158 1.00 0.00 H new ATOM 0 HG21 VAL A 139 50.419 8.372 21.114 1.00 0.00 H new ATOM 0 HG22 VAL A 139 50.645 6.632 20.818 1.00 0.00 H new ATOM 0 HG23 VAL A 139 49.125 7.224 21.529 1.00 0.00 H new ATOM 2357 N ILE A 140 50.284 4.265 21.550 1.00 0.00 N ATOM 2358 CA ILE A 140 50.747 3.265 20.594 1.00 0.00 C ATOM 2359 C ILE A 140 50.260 3.602 19.188 1.00 0.00 C ATOM 2360 O ILE A 140 49.174 3.170 18.840 1.00 0.00 O ATOM 2361 CB ILE A 140 50.235 1.882 20.997 1.00 0.00 C ATOM 2362 CG1 ILE A 140 50.939 1.433 22.280 1.00 0.00 C ATOM 2363 CG2 ILE A 140 50.530 0.881 19.878 1.00 0.00 C ATOM 2364 CD1 ILE A 140 50.240 0.191 22.837 1.00 0.00 C ATOM 2365 OXT ILE A 140 50.982 4.285 18.480 1.00 0.00 O ATOM 0 H ILE A 140 49.305 4.531 21.446 1.00 0.00 H new ATOM 0 HA ILE A 140 51.837 3.263 20.597 1.00 0.00 H new ATOM 0 HB ILE A 140 49.159 1.929 21.168 1.00 0.00 H new ATOM 0 HG12 ILE A 140 51.987 1.213 22.075 1.00 0.00 H new ATOM 0 HG13 ILE A 140 50.921 2.235 23.018 1.00 0.00 H new ATOM 0 HG21 ILE A 140 50.165 -0.105 20.166 1.00 0.00 H new ATOM 0 HG22 ILE A 140 50.030 1.200 18.963 1.00 0.00 H new ATOM 0 HG23 ILE A 140 51.605 0.834 19.706 1.00 0.00 H new ATOM 0 HD11 ILE A 140 50.741 -0.129 23.751 1.00 0.00 H new ATOM 0 HD12 ILE A 140 49.199 0.427 23.058 1.00 0.00 H new ATOM 0 HD13 ILE A 140 50.282 -0.611 22.100 1.00 0.00 H new