USER MOD reduce.3.24.130724 H: found=0, std=0, add=663, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 665 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 107 HIS :FLIP no HD1:sc= 0.381 F(o=-1.7,f=0.66) USER MOD Set 1.2: A 109 SER OG : rot 12:sc= 0.277 USER MOD Set 2.1: A 103 LYS NZ :NH3+ -148:sc= -3.96! (180deg=-5.74!) USER MOD Set 2.2: A 105 SER OG : rot 90:sc= -0.967 USER MOD Set 3.1: A 69 ASN : amide:sc= 0.574 K(o=0.049,f=-0.52) USER MOD Set 3.2: A 75 SER OG : rot 80:sc= -0.525 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 110:sc= -0.753 USER MOD Single : A 37 CYS SG : rot 41:sc= 1.26 USER MOD Single : A 38 TYR OH : rot 110:sc= -1.77! USER MOD Single : A 41 THR OG1 : rot 172:sc= -1.05 USER MOD Single : A 51 LYS NZ :NH3+ 169:sc=-0.00334 (180deg=-0.119) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot -49:sc= 0.534 USER MOD Single : A 54 LYS NZ :NH3+ 167:sc= -0.0152 (180deg=-0.174) USER MOD Single : A 55 LYS NZ :NH3+ 170:sc= 0.878 (180deg=0.826) USER MOD Single : A 61 SER OG : rot -46:sc= 0.637 USER MOD Single : A 65 TYR OH : rot 30:sc= -0.0409 USER MOD Single : A 67 THR OG1 : rot 180:sc= -3.22! USER MOD Single : A 68 ASN : amide:sc= -2.33 K(o=-2.3,f=-4.2!) USER MOD Single : A 73 SER OG : rot -140:sc= -0.0111 USER MOD Single : A 79 GLN : amide:sc= -0.11 K(o=-0.11,f=-3.1!) USER MOD Single : A 82 LYS NZ :NH3+ 134:sc= 0.634 (180deg=0.26) USER MOD Single : A 84 GLN : amide:sc= -1.78 K(o=-1.8,f=-4.5!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot -160:sc= 0.0701 USER MOD Single : A 93 HIS : no HD1:sc= -0.403 X(o=-0.4,f=-0.56) USER MOD Single : A 94 LYS NZ :NH3+ 147:sc= -1.65! (180deg=-3.64!) USER MOD Single : A 96 SER OG : rot -21:sc= 1.21 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0502) USER MOD Single : A 110 SER OG : rot 180:sc= 0.0379 USER MOD ----------------------------------------------------------------- ATOM 450 N VAL A 33 26.469 -93.838 -8.614 1.00 64.33 N ATOM 451 CA VAL A 33 25.743 -92.985 -9.539 1.00 3.41 C ATOM 452 C VAL A 33 24.338 -92.806 -9.005 1.00 52.31 C ATOM 453 O VAL A 33 23.448 -93.622 -9.251 1.00 55.05 O ATOM 454 CB VAL A 33 25.677 -93.555 -10.966 1.00 32.24 C ATOM 455 CG1 VAL A 33 24.979 -92.571 -11.908 1.00 21.34 C ATOM 456 CG2 VAL A 33 27.075 -93.908 -11.473 1.00 54.35 C ATOM 0 HA VAL A 33 26.276 -92.037 -9.609 1.00 3.41 H new ATOM 0 HB VAL A 33 25.089 -94.472 -10.943 1.00 32.24 H new ATOM 0 HG11 VAL A 33 24.942 -92.993 -12.912 1.00 21.34 H new ATOM 0 HG12 VAL A 33 23.964 -92.386 -11.555 1.00 21.34 H new ATOM 0 HG13 VAL A 33 25.532 -91.632 -11.929 1.00 21.34 H new ATOM 0 HG21 VAL A 33 27.005 -94.309 -12.484 1.00 54.35 H new ATOM 0 HG22 VAL A 33 27.696 -93.012 -11.480 1.00 54.35 H new ATOM 0 HG23 VAL A 33 27.522 -94.654 -10.817 1.00 54.35 H new ATOM 466 N THR A 34 24.159 -91.736 -8.272 1.00 32.15 N ATOM 467 CA THR A 34 22.937 -91.500 -7.525 1.00 71.11 C ATOM 468 C THR A 34 21.830 -91.034 -8.464 1.00 2.24 C ATOM 469 O THR A 34 21.998 -90.071 -9.216 1.00 60.35 O ATOM 470 CB THR A 34 23.170 -90.446 -6.415 1.00 3.00 C ATOM 471 OG1 THR A 34 24.270 -90.851 -5.581 1.00 50.55 O ATOM 472 CG2 THR A 34 21.921 -90.260 -5.555 1.00 1.10 C ATOM 0 H THR A 34 24.856 -90.998 -8.172 1.00 32.15 H new ATOM 0 HA THR A 34 22.635 -92.436 -7.055 1.00 71.11 H new ATOM 0 HB THR A 34 23.400 -89.496 -6.896 1.00 3.00 H new ATOM 0 HG1 THR A 34 24.414 -90.180 -4.881 1.00 50.55 H new ATOM 0 HG21 THR A 34 22.117 -89.514 -4.785 1.00 1.10 H new ATOM 0 HG22 THR A 34 21.094 -89.926 -6.182 1.00 1.10 H new ATOM 0 HG23 THR A 34 21.659 -91.207 -5.084 1.00 1.10 H new ATOM 480 N THR A 35 20.716 -91.752 -8.442 1.00 71.32 N ATOM 481 CA THR A 35 19.569 -91.434 -9.274 1.00 44.34 C ATOM 482 C THR A 35 18.347 -91.199 -8.401 1.00 64.43 C ATOM 483 O THR A 35 18.010 -92.030 -7.558 1.00 74.11 O ATOM 484 CB THR A 35 19.285 -92.573 -10.274 1.00 51.43 C ATOM 485 OG1 THR A 35 20.448 -92.807 -11.084 1.00 13.30 O ATOM 486 CG2 THR A 35 18.087 -92.249 -11.168 1.00 62.32 C ATOM 0 H THR A 35 20.584 -92.570 -7.847 1.00 71.32 H new ATOM 0 HA THR A 35 19.793 -90.528 -9.837 1.00 44.34 H new ATOM 0 HB THR A 35 19.045 -93.471 -9.704 1.00 51.43 H new ATOM 0 HG1 THR A 35 20.847 -93.669 -10.842 1.00 13.30 H new ATOM 0 HG21 THR A 35 17.916 -93.074 -11.860 1.00 62.32 H new ATOM 0 HG22 THR A 35 17.201 -92.104 -10.550 1.00 62.32 H new ATOM 0 HG23 THR A 35 18.289 -91.338 -11.732 1.00 62.32 H new ATOM 494 N LEU A 36 17.713 -90.052 -8.590 1.00 13.40 N ATOM 495 CA LEU A 36 16.514 -89.689 -7.853 1.00 32.23 C ATOM 496 C LEU A 36 15.541 -88.987 -8.791 1.00 30.20 C ATOM 497 O LEU A 36 15.933 -88.103 -9.557 1.00 35.32 O ATOM 498 CB LEU A 36 16.857 -88.774 -6.664 1.00 70.33 C ATOM 499 CG LEU A 36 17.639 -89.438 -5.515 1.00 3.23 C ATOM 500 CD1 LEU A 36 18.018 -88.409 -4.450 1.00 10.31 C ATOM 501 CD2 LEU A 36 16.830 -90.580 -4.896 1.00 4.14 C ATOM 0 H LEU A 36 18.017 -89.346 -9.260 1.00 13.40 H new ATOM 0 HA LEU A 36 16.054 -90.595 -7.459 1.00 32.23 H new ATOM 0 HB2 LEU A 36 17.439 -87.930 -7.035 1.00 70.33 H new ATOM 0 HB3 LEU A 36 15.929 -88.369 -6.261 1.00 70.33 H new ATOM 0 HG LEU A 36 18.557 -89.855 -5.929 1.00 3.23 H new ATOM 0 HD11 LEU A 36 18.569 -88.901 -3.649 1.00 10.31 H new ATOM 0 HD12 LEU A 36 18.641 -87.635 -4.897 1.00 10.31 H new ATOM 0 HD13 LEU A 36 17.114 -87.956 -4.043 1.00 10.31 H new ATOM 0 HD21 LEU A 36 17.402 -91.034 -4.087 1.00 4.14 H new ATOM 0 HD22 LEU A 36 15.892 -90.189 -4.502 1.00 4.14 H new ATOM 0 HD23 LEU A 36 16.619 -91.331 -5.657 1.00 4.14 H new ATOM 513 N CYS A 37 14.285 -89.393 -8.746 1.00 71.23 N ATOM 514 CA CYS A 37 13.255 -88.789 -9.581 1.00 40.31 C ATOM 515 C CYS A 37 12.697 -87.545 -8.896 1.00 32.44 C ATOM 516 O CYS A 37 12.472 -87.546 -7.687 1.00 34.41 O ATOM 517 CB CYS A 37 12.150 -89.814 -9.870 1.00 1.21 C ATOM 518 SG CYS A 37 10.698 -89.156 -10.725 1.00 21.43 S ATOM 0 H CYS A 37 13.950 -90.141 -8.139 1.00 71.23 H new ATOM 0 HA CYS A 37 13.688 -88.484 -10.534 1.00 40.31 H new ATOM 0 HB2 CYS A 37 12.572 -90.620 -10.470 1.00 1.21 H new ATOM 0 HB3 CYS A 37 11.828 -90.254 -8.926 1.00 1.21 H new ATOM 0 HG CYS A 37 11.079 -88.328 -11.652 1.00 21.43 H new ATOM 524 N TYR A 38 12.487 -86.486 -9.667 1.00 44.52 N ATOM 525 CA TYR A 38 12.021 -85.209 -9.130 1.00 13.14 C ATOM 526 C TYR A 38 10.602 -84.920 -9.591 1.00 33.50 C ATOM 527 O TYR A 38 10.213 -85.280 -10.706 1.00 34.40 O ATOM 528 CB TYR A 38 12.946 -84.062 -9.579 1.00 2.52 C ATOM 529 CG TYR A 38 14.246 -83.958 -8.800 1.00 51.01 C ATOM 530 CD1 TYR A 38 15.082 -85.054 -8.643 1.00 5.21 C ATOM 531 CD2 TYR A 38 14.632 -82.753 -8.218 1.00 74.21 C ATOM 532 CE1 TYR A 38 16.260 -84.956 -7.933 1.00 42.41 C ATOM 533 CE2 TYR A 38 15.811 -82.650 -7.508 1.00 41.03 C ATOM 534 CZ TYR A 38 16.621 -83.754 -7.369 1.00 0.42 C ATOM 535 OH TYR A 38 17.798 -83.657 -6.667 1.00 72.24 O ATOM 0 H TYR A 38 12.633 -86.485 -10.676 1.00 44.52 H new ATOM 0 HA TYR A 38 12.037 -85.278 -8.042 1.00 13.14 H new ATOM 0 HB2 TYR A 38 13.180 -84.194 -10.635 1.00 2.52 H new ATOM 0 HB3 TYR A 38 12.406 -83.120 -9.487 1.00 2.52 H new ATOM 0 HD1 TYR A 38 14.805 -86.000 -9.084 1.00 5.21 H new ATOM 0 HD2 TYR A 38 13.998 -81.885 -8.324 1.00 74.21 H new ATOM 0 HE1 TYR A 38 16.898 -85.820 -7.820 1.00 42.41 H new ATOM 0 HE2 TYR A 38 16.097 -81.708 -7.064 1.00 41.03 H new ATOM 0 HH TYR A 38 18.437 -83.113 -7.173 1.00 72.24 H new ATOM 545 N ARG A 39 9.838 -84.278 -8.720 1.00 41.31 N ATOM 546 CA ARG A 39 8.479 -83.869 -9.025 1.00 13.40 C ATOM 547 C ARG A 39 8.093 -82.679 -8.153 1.00 14.02 C ATOM 548 O ARG A 39 7.949 -82.809 -6.939 1.00 25.40 O ATOM 549 CB ARG A 39 7.514 -85.041 -8.805 1.00 74.33 C ATOM 550 CG ARG A 39 6.059 -84.703 -9.110 1.00 12.21 C ATOM 551 CD ARG A 39 5.196 -85.957 -9.168 1.00 54.31 C ATOM 552 NE ARG A 39 3.786 -85.651 -9.416 1.00 25.32 N ATOM 553 CZ ARG A 39 3.250 -85.501 -10.630 1.00 14.22 C ATOM 554 NH1 ARG A 39 4.016 -85.505 -11.716 1.00 32.13 N ATOM 555 NH2 ARG A 39 1.946 -85.314 -10.757 1.00 64.21 N ATOM 0 H ARG A 39 10.145 -84.026 -7.781 1.00 41.31 H new ATOM 0 HA ARG A 39 8.418 -83.569 -10.071 1.00 13.40 H new ATOM 0 HB2 ARG A 39 7.823 -85.877 -9.433 1.00 74.33 H new ATOM 0 HB3 ARG A 39 7.591 -85.374 -7.770 1.00 74.33 H new ATOM 0 HG2 ARG A 39 5.673 -84.029 -8.345 1.00 12.21 H new ATOM 0 HG3 ARG A 39 5.999 -84.174 -10.061 1.00 12.21 H new ATOM 0 HD2 ARG A 39 5.567 -86.614 -9.955 1.00 54.31 H new ATOM 0 HD3 ARG A 39 5.287 -86.502 -8.228 1.00 54.31 H new ATOM 0 HE ARG A 39 3.172 -85.545 -8.608 1.00 25.32 H new ATOM 0 HH11 ARG A 39 5.025 -85.624 -11.628 1.00 32.13 H new ATOM 0 HH12 ARG A 39 3.595 -85.390 -12.638 1.00 32.13 H new ATOM 0 HH21 ARG A 39 1.352 -85.285 -9.928 1.00 64.21 H new ATOM 0 HH22 ARG A 39 1.535 -85.199 -11.683 1.00 64.21 H new ATOM 569 N VAL A 40 7.947 -81.519 -8.778 1.00 72.34 N ATOM 570 CA VAL A 40 7.590 -80.292 -8.075 1.00 72.44 C ATOM 571 C VAL A 40 6.265 -79.759 -8.610 1.00 70.43 C ATOM 572 O VAL A 40 5.961 -79.907 -9.794 1.00 61.43 O ATOM 573 CB VAL A 40 8.698 -79.211 -8.228 1.00 33.24 C ATOM 574 CG1 VAL A 40 8.794 -78.725 -9.671 1.00 32.30 C ATOM 575 CG2 VAL A 40 8.458 -78.037 -7.276 1.00 22.25 C ATOM 0 H VAL A 40 8.072 -81.401 -9.783 1.00 72.34 H new ATOM 0 HA VAL A 40 7.489 -80.523 -7.015 1.00 72.44 H new ATOM 0 HB VAL A 40 9.649 -79.672 -7.962 1.00 33.24 H new ATOM 0 HG11 VAL A 40 9.576 -77.970 -9.749 1.00 32.30 H new ATOM 0 HG12 VAL A 40 9.034 -79.565 -10.323 1.00 32.30 H new ATOM 0 HG13 VAL A 40 7.840 -78.292 -9.973 1.00 32.30 H new ATOM 0 HG21 VAL A 40 9.248 -77.297 -7.405 1.00 22.25 H new ATOM 0 HG22 VAL A 40 7.493 -77.581 -7.497 1.00 22.25 H new ATOM 0 HG23 VAL A 40 8.462 -78.396 -6.247 1.00 22.25 H new ATOM 585 N THR A 41 5.472 -79.158 -7.736 1.00 2.24 N ATOM 586 CA THR A 41 4.175 -78.615 -8.115 1.00 62.42 C ATOM 587 C THR A 41 4.222 -77.089 -8.134 1.00 74.20 C ATOM 588 O THR A 41 4.509 -76.451 -7.116 1.00 2.33 O ATOM 589 CB THR A 41 3.060 -79.099 -7.155 1.00 55.34 C ATOM 590 OG1 THR A 41 3.421 -78.822 -5.793 1.00 61.12 O ATOM 591 CG2 THR A 41 2.806 -80.596 -7.322 1.00 64.10 C ATOM 0 H THR A 41 5.706 -79.033 -6.751 1.00 2.24 H new ATOM 0 HA THR A 41 3.942 -78.977 -9.116 1.00 62.42 H new ATOM 0 HB THR A 41 2.146 -78.560 -7.404 1.00 55.34 H new ATOM 0 HG1 THR A 41 2.659 -79.012 -5.207 1.00 61.12 H new ATOM 0 HG21 THR A 41 2.019 -80.910 -6.637 1.00 64.10 H new ATOM 0 HG22 THR A 41 2.497 -80.801 -8.347 1.00 64.10 H new ATOM 0 HG23 THR A 41 3.720 -81.147 -7.102 1.00 64.10 H new ATOM 599 N GLY A 42 3.971 -76.511 -9.300 1.00 41.40 N ATOM 600 CA GLY A 42 3.949 -75.070 -9.427 1.00 24.42 C ATOM 601 C GLY A 42 2.594 -74.500 -9.073 1.00 40.24 C ATOM 602 O GLY A 42 1.570 -74.970 -9.569 1.00 32.35 O ATOM 0 H GLY A 42 3.781 -77.019 -10.164 1.00 41.40 H new ATOM 0 HA2 GLY A 42 4.708 -74.635 -8.777 1.00 24.42 H new ATOM 0 HA3 GLY A 42 4.206 -74.790 -10.449 1.00 24.42 H new ATOM 684 N PHE A 48 8.522 -72.297 -15.151 1.00 44.21 N ATOM 685 CA PHE A 48 9.694 -72.822 -14.453 1.00 43.23 C ATOM 686 C PHE A 48 10.948 -72.227 -15.106 1.00 63.04 C ATOM 687 O PHE A 48 10.846 -71.618 -16.175 1.00 45.54 O ATOM 688 CB PHE A 48 9.691 -74.362 -14.549 1.00 61.12 C ATOM 689 CG PHE A 48 10.434 -75.081 -13.442 1.00 53.24 C ATOM 690 CD1 PHE A 48 9.999 -74.988 -12.126 1.00 42.11 C ATOM 691 CD2 PHE A 48 11.542 -75.873 -13.719 1.00 54.45 C ATOM 692 CE1 PHE A 48 10.657 -75.661 -11.114 1.00 23.41 C ATOM 693 CE2 PHE A 48 12.198 -76.553 -12.710 1.00 23.53 C ATOM 694 CZ PHE A 48 11.754 -76.445 -11.405 1.00 52.33 C ATOM 0 HA PHE A 48 9.679 -72.548 -13.398 1.00 43.23 H new ATOM 0 HB2 PHE A 48 8.657 -74.707 -14.554 1.00 61.12 H new ATOM 0 HB3 PHE A 48 10.128 -74.651 -15.505 1.00 61.12 H new ATOM 0 HD1 PHE A 48 9.136 -74.382 -11.891 1.00 42.11 H new ATOM 0 HD2 PHE A 48 11.895 -75.958 -14.736 1.00 54.45 H new ATOM 0 HE1 PHE A 48 10.312 -75.573 -10.094 1.00 23.41 H new ATOM 0 HE2 PHE A 48 13.056 -77.167 -12.941 1.00 23.53 H new ATOM 0 HZ PHE A 48 12.266 -76.974 -10.614 1.00 52.33 H new ATOM 704 N PHE A 49 12.118 -72.385 -14.486 1.00 15.34 N ATOM 705 CA PHE A 49 13.345 -71.793 -15.035 1.00 4.40 C ATOM 706 C PHE A 49 13.824 -72.512 -16.309 1.00 62.32 C ATOM 707 O PHE A 49 14.792 -73.286 -16.297 1.00 1.00 O ATOM 708 CB PHE A 49 14.469 -71.696 -13.973 1.00 33.40 C ATOM 709 CG PHE A 49 14.625 -72.901 -13.065 1.00 61.25 C ATOM 710 CD1 PHE A 49 15.176 -74.086 -13.530 1.00 2.54 C ATOM 711 CD2 PHE A 49 14.231 -72.835 -11.734 1.00 61.52 C ATOM 712 CE1 PHE A 49 15.328 -75.176 -12.693 1.00 70.11 C ATOM 713 CE2 PHE A 49 14.380 -73.922 -10.894 1.00 52.45 C ATOM 714 CZ PHE A 49 14.928 -75.093 -11.373 1.00 63.23 C ATOM 0 H PHE A 49 12.245 -72.907 -13.619 1.00 15.34 H new ATOM 0 HA PHE A 49 13.091 -70.774 -15.327 1.00 4.40 H new ATOM 0 HB2 PHE A 49 15.415 -71.527 -14.487 1.00 33.40 H new ATOM 0 HB3 PHE A 49 14.282 -70.819 -13.353 1.00 33.40 H new ATOM 0 HD1 PHE A 49 15.491 -74.158 -14.561 1.00 2.54 H new ATOM 0 HD2 PHE A 49 13.802 -71.921 -11.351 1.00 61.52 H new ATOM 0 HE1 PHE A 49 15.759 -76.091 -13.071 1.00 70.11 H new ATOM 0 HE2 PHE A 49 14.067 -73.854 -9.862 1.00 52.45 H new ATOM 0 HZ PHE A 49 15.044 -75.944 -10.718 1.00 63.23 H new ATOM 724 N ARG A 50 13.119 -72.239 -17.412 1.00 20.24 N ATOM 725 CA ARG A 50 13.486 -72.746 -18.733 1.00 11.11 C ATOM 726 C ARG A 50 14.890 -72.255 -19.077 1.00 62.02 C ATOM 727 O ARG A 50 15.306 -71.196 -18.601 1.00 13.04 O ATOM 728 CB ARG A 50 12.460 -72.268 -19.780 1.00 4.24 C ATOM 729 CG ARG A 50 12.537 -72.973 -21.140 1.00 63.42 C ATOM 730 CD ARG A 50 12.340 -74.484 -21.013 1.00 31.41 C ATOM 731 NE ARG A 50 11.819 -75.097 -22.249 1.00 52.04 N ATOM 732 CZ ARG A 50 12.416 -76.092 -22.916 1.00 22.45 C ATOM 733 NH1 ARG A 50 13.654 -76.454 -22.617 1.00 12.14 N ATOM 734 NH2 ARG A 50 11.790 -76.688 -23.923 1.00 70.43 N ATOM 0 H ARG A 50 12.279 -71.660 -17.411 1.00 20.24 H new ATOM 0 HA ARG A 50 13.482 -73.836 -18.732 1.00 11.11 H new ATOM 0 HB2 ARG A 50 11.458 -72.407 -19.373 1.00 4.24 H new ATOM 0 HB3 ARG A 50 12.595 -71.198 -19.936 1.00 4.24 H new ATOM 0 HG2 ARG A 50 11.777 -72.563 -21.805 1.00 63.42 H new ATOM 0 HG3 ARG A 50 13.505 -72.771 -21.599 1.00 63.42 H new ATOM 0 HD2 ARG A 50 13.291 -74.950 -20.755 1.00 31.41 H new ATOM 0 HD3 ARG A 50 11.652 -74.689 -20.193 1.00 31.41 H new ATOM 0 HE ARG A 50 10.941 -74.737 -22.622 1.00 52.04 H new ATOM 0 HH11 ARG A 50 14.160 -75.974 -21.873 1.00 12.14 H new ATOM 0 HH12 ARG A 50 14.101 -77.213 -23.130 1.00 12.14 H new ATOM 0 HH21 ARG A 50 10.852 -76.388 -24.190 1.00 70.43 H new ATOM 0 HH22 ARG A 50 12.247 -77.446 -24.430 1.00 70.43 H new ATOM 748 N LYS A 51 15.609 -73.023 -19.897 1.00 31.42 N ATOM 749 CA LYS A 51 17.033 -72.787 -20.165 1.00 51.24 C ATOM 750 C LYS A 51 17.866 -73.145 -18.936 1.00 43.40 C ATOM 751 O LYS A 51 18.681 -74.065 -18.979 1.00 4.25 O ATOM 752 CB LYS A 51 17.324 -71.333 -20.587 1.00 42.54 C ATOM 753 CG LYS A 51 16.605 -70.887 -21.853 1.00 63.21 C ATOM 754 CD LYS A 51 16.989 -69.459 -22.236 1.00 2.41 C ATOM 755 CE LYS A 51 16.241 -68.977 -23.473 1.00 61.10 C ATOM 756 NZ LYS A 51 14.778 -68.866 -23.230 1.00 63.52 N ATOM 0 H LYS A 51 15.224 -73.826 -20.395 1.00 31.42 H new ATOM 0 HA LYS A 51 17.309 -73.429 -21.001 1.00 51.24 H new ATOM 0 HB2 LYS A 51 17.042 -70.668 -19.771 1.00 42.54 H new ATOM 0 HB3 LYS A 51 18.398 -71.219 -20.735 1.00 42.54 H new ATOM 0 HG2 LYS A 51 16.851 -71.564 -22.671 1.00 63.21 H new ATOM 0 HG3 LYS A 51 15.527 -70.948 -21.702 1.00 63.21 H new ATOM 0 HD2 LYS A 51 16.777 -68.791 -21.401 1.00 2.41 H new ATOM 0 HD3 LYS A 51 18.062 -69.409 -22.420 1.00 2.41 H new ATOM 0 HE2 LYS A 51 16.633 -68.007 -23.779 1.00 61.10 H new ATOM 0 HE3 LYS A 51 16.420 -69.667 -24.297 1.00 61.10 H new ATOM 0 HZ1 LYS A 51 14.331 -68.364 -24.024 1.00 63.52 H new ATOM 0 HZ2 LYS A 51 14.367 -69.818 -23.147 1.00 63.52 H new ATOM 0 HZ3 LYS A 51 14.611 -68.339 -22.349 1.00 63.52 H new ATOM 770 N TYR A 52 17.627 -72.431 -17.835 1.00 33.33 N ATOM 771 CA TYR A 52 18.391 -72.604 -16.600 1.00 52.21 C ATOM 772 C TYR A 52 18.375 -74.053 -16.115 1.00 31.13 C ATOM 773 O TYR A 52 19.354 -74.520 -15.538 1.00 33.12 O ATOM 774 CB TYR A 52 17.854 -71.680 -15.501 1.00 51.11 C ATOM 775 CG TYR A 52 17.946 -70.205 -15.844 1.00 65.03 C ATOM 776 CD1 TYR A 52 19.179 -69.598 -16.057 1.00 73.20 C ATOM 777 CD2 TYR A 52 16.803 -69.421 -15.960 1.00 31.11 C ATOM 778 CE1 TYR A 52 19.269 -68.256 -16.374 1.00 34.30 C ATOM 779 CE2 TYR A 52 16.886 -68.079 -16.277 1.00 52.05 C ATOM 780 CZ TYR A 52 18.121 -67.502 -16.483 1.00 23.30 C ATOM 781 OH TYR A 52 18.208 -66.164 -16.799 1.00 53.21 O ATOM 0 H TYR A 52 16.900 -71.718 -17.775 1.00 33.33 H new ATOM 0 HA TYR A 52 19.424 -72.338 -16.822 1.00 52.21 H new ATOM 0 HB2 TYR A 52 16.813 -71.933 -15.303 1.00 51.11 H new ATOM 0 HB3 TYR A 52 18.408 -71.865 -14.581 1.00 51.11 H new ATOM 0 HD1 TYR A 52 20.081 -70.185 -15.973 1.00 73.20 H new ATOM 0 HD2 TYR A 52 15.834 -69.869 -15.799 1.00 31.11 H new ATOM 0 HE1 TYR A 52 20.235 -67.800 -16.536 1.00 34.30 H new ATOM 0 HE2 TYR A 52 15.988 -67.485 -16.363 1.00 52.05 H new ATOM 0 HH TYR A 52 17.308 -65.778 -16.838 1.00 53.21 H new ATOM 791 N THR A 53 17.262 -74.756 -16.339 1.00 44.10 N ATOM 792 CA THR A 53 17.184 -76.177 -15.987 1.00 3.41 C ATOM 793 C THR A 53 18.324 -76.961 -16.653 1.00 73.23 C ATOM 794 O THR A 53 19.126 -77.634 -15.983 1.00 72.33 O ATOM 795 CB THR A 53 15.836 -76.793 -16.446 1.00 45.12 C ATOM 796 OG1 THR A 53 14.745 -75.941 -16.072 1.00 53.20 O ATOM 797 CG2 THR A 53 15.629 -78.179 -15.841 1.00 71.23 C ATOM 0 H THR A 53 16.414 -74.372 -16.756 1.00 44.10 H new ATOM 0 HA THR A 53 17.266 -76.246 -14.902 1.00 3.41 H new ATOM 0 HB THR A 53 15.867 -76.888 -17.531 1.00 45.12 H new ATOM 0 HG1 THR A 53 14.830 -75.697 -15.127 1.00 53.20 H new ATOM 0 HG21 THR A 53 14.676 -78.586 -16.180 1.00 71.23 H new ATOM 0 HG22 THR A 53 16.438 -78.838 -16.156 1.00 71.23 H new ATOM 0 HG23 THR A 53 15.625 -78.104 -14.754 1.00 71.23 H new ATOM 805 N LYS A 54 18.426 -76.810 -17.973 1.00 52.34 N ATOM 806 CA LYS A 54 19.409 -77.538 -18.766 1.00 30.44 C ATOM 807 C LYS A 54 20.797 -76.985 -18.467 1.00 3.54 C ATOM 808 O LYS A 54 21.759 -77.734 -18.330 1.00 44.10 O ATOM 809 CB LYS A 54 19.074 -77.411 -20.268 1.00 40.44 C ATOM 810 CG LYS A 54 19.499 -78.608 -21.124 1.00 35.45 C ATOM 811 CD LYS A 54 21.013 -78.807 -21.167 1.00 30.33 C ATOM 812 CE LYS A 54 21.401 -79.977 -22.067 1.00 3.15 C ATOM 813 NZ LYS A 54 21.049 -79.727 -23.491 1.00 23.31 N ATOM 0 H LYS A 54 17.833 -76.184 -18.517 1.00 52.34 H new ATOM 0 HA LYS A 54 19.387 -78.596 -18.506 1.00 30.44 H new ATOM 0 HB2 LYS A 54 17.999 -77.269 -20.375 1.00 40.44 H new ATOM 0 HB3 LYS A 54 19.555 -76.514 -20.659 1.00 40.44 H new ATOM 0 HG2 LYS A 54 19.031 -79.511 -20.733 1.00 35.45 H new ATOM 0 HG3 LYS A 54 19.128 -78.471 -22.140 1.00 35.45 H new ATOM 0 HD2 LYS A 54 21.490 -77.896 -21.528 1.00 30.33 H new ATOM 0 HD3 LYS A 54 21.386 -78.984 -20.158 1.00 30.33 H new ATOM 0 HE2 LYS A 54 22.473 -80.157 -21.985 1.00 3.15 H new ATOM 0 HE3 LYS A 54 20.899 -80.881 -21.723 1.00 3.15 H new ATOM 0 HZ1 LYS A 54 21.519 -80.433 -24.094 1.00 23.31 H new ATOM 0 HZ2 LYS A 54 20.019 -79.799 -23.612 1.00 23.31 H new ATOM 0 HZ3 LYS A 54 21.364 -78.774 -23.764 1.00 23.31 H new ATOM 827 N LYS A 55 20.876 -75.663 -18.351 1.00 61.15 N ATOM 828 CA LYS A 55 22.119 -74.977 -18.007 1.00 23.30 C ATOM 829 C LYS A 55 22.713 -75.556 -16.727 1.00 15.04 C ATOM 830 O LYS A 55 23.883 -75.942 -16.694 1.00 2.24 O ATOM 831 CB LYS A 55 21.863 -73.456 -17.865 1.00 11.43 C ATOM 832 CG LYS A 55 22.981 -72.663 -17.172 1.00 64.44 C ATOM 833 CD LYS A 55 22.781 -72.595 -15.652 1.00 65.33 C ATOM 834 CE LYS A 55 23.999 -72.025 -14.935 1.00 14.41 C ATOM 835 NZ LYS A 55 23.822 -72.024 -13.456 1.00 63.50 N ATOM 0 H LYS A 55 20.083 -75.037 -18.492 1.00 61.15 H new ATOM 0 HA LYS A 55 22.842 -75.130 -18.809 1.00 23.30 H new ATOM 0 HB2 LYS A 55 21.705 -73.037 -18.859 1.00 11.43 H new ATOM 0 HB3 LYS A 55 20.938 -73.311 -17.307 1.00 11.43 H new ATOM 0 HG2 LYS A 55 23.943 -73.126 -17.391 1.00 64.44 H new ATOM 0 HG3 LYS A 55 23.014 -71.652 -17.579 1.00 64.44 H new ATOM 0 HD2 LYS A 55 21.910 -71.979 -15.429 1.00 65.33 H new ATOM 0 HD3 LYS A 55 22.571 -73.594 -15.270 1.00 65.33 H new ATOM 0 HE2 LYS A 55 24.881 -72.611 -15.195 1.00 14.41 H new ATOM 0 HE3 LYS A 55 24.180 -71.007 -15.280 1.00 14.41 H new ATOM 0 HZ1 LYS A 55 24.726 -71.791 -12.998 1.00 63.50 H new ATOM 0 HZ2 LYS A 55 23.108 -71.316 -13.192 1.00 63.50 H new ATOM 0 HZ3 LYS A 55 23.508 -72.965 -13.143 1.00 63.50 H new ATOM 849 N GLU A 56 21.893 -75.625 -15.683 1.00 61.35 N ATOM 850 CA GLU A 56 22.350 -76.081 -14.379 1.00 4.44 C ATOM 851 C GLU A 56 22.746 -77.543 -14.438 1.00 34.44 C ATOM 852 O GLU A 56 23.849 -77.910 -14.033 1.00 61.15 O ATOM 853 CB GLU A 56 21.268 -75.889 -13.312 1.00 12.34 C ATOM 854 CG GLU A 56 21.734 -76.299 -11.915 1.00 53.51 C ATOM 855 CD GLU A 56 22.815 -75.376 -11.345 1.00 25.14 C ATOM 856 OE1 GLU A 56 22.995 -74.245 -11.867 1.00 24.04 O ATOM 857 OE2 GLU A 56 23.481 -75.772 -10.365 1.00 63.10 O ATOM 0 H GLU A 56 20.906 -75.370 -15.717 1.00 61.35 H new ATOM 0 HA GLU A 56 23.218 -75.480 -14.106 1.00 4.44 H new ATOM 0 HB2 GLU A 56 20.962 -74.843 -13.295 1.00 12.34 H new ATOM 0 HB3 GLU A 56 20.389 -76.474 -13.583 1.00 12.34 H new ATOM 0 HG2 GLU A 56 20.878 -76.305 -11.241 1.00 53.51 H new ATOM 0 HG3 GLU A 56 22.118 -77.318 -11.952 1.00 53.51 H new ATOM 864 N ALA A 57 21.842 -78.375 -14.948 1.00 2.01 N ATOM 865 CA ALA A 57 22.099 -79.804 -15.035 1.00 74.43 C ATOM 866 C ALA A 57 23.373 -80.074 -15.835 1.00 71.13 C ATOM 867 O ALA A 57 24.255 -80.807 -15.396 1.00 12.10 O ATOM 868 CB ALA A 57 20.904 -80.518 -15.648 1.00 4.12 C ATOM 0 H ALA A 57 20.932 -78.084 -15.304 1.00 2.01 H new ATOM 0 HA ALA A 57 22.249 -80.195 -14.028 1.00 74.43 H new ATOM 0 HB1 ALA A 57 21.110 -81.587 -15.707 1.00 4.12 H new ATOM 0 HB2 ALA A 57 20.023 -80.352 -15.028 1.00 4.12 H new ATOM 0 HB3 ALA A 57 20.721 -80.128 -16.649 1.00 4.12 H new ATOM 874 N ASP A 58 23.485 -79.438 -16.993 1.00 44.45 N ATOM 875 CA ASP A 58 24.635 -79.637 -17.874 1.00 61.14 C ATOM 876 C ASP A 58 25.922 -79.133 -17.219 1.00 50.21 C ATOM 877 O ASP A 58 26.988 -79.735 -17.380 1.00 33.21 O ATOM 878 CB ASP A 58 24.409 -78.928 -19.216 1.00 0.41 C ATOM 879 CG ASP A 58 25.530 -79.184 -20.213 1.00 35.12 C ATOM 880 OD1 ASP A 58 25.567 -80.288 -20.803 1.00 32.14 O ATOM 881 OD2 ASP A 58 26.365 -78.279 -20.429 1.00 22.10 O ATOM 0 H ASP A 58 22.793 -78.778 -17.348 1.00 44.45 H new ATOM 0 HA ASP A 58 24.741 -80.707 -18.054 1.00 61.14 H new ATOM 0 HB2 ASP A 58 23.464 -79.263 -19.644 1.00 0.41 H new ATOM 0 HB3 ASP A 58 24.319 -77.855 -19.045 1.00 0.41 H new ATOM 886 N ALA A 59 25.814 -78.035 -16.468 1.00 41.11 N ATOM 887 CA ALA A 59 26.969 -77.434 -15.800 1.00 31.13 C ATOM 888 C ALA A 59 27.456 -78.306 -14.642 1.00 41.12 C ATOM 889 O ALA A 59 28.653 -78.560 -14.510 1.00 73.43 O ATOM 890 CB ALA A 59 26.628 -76.033 -15.305 1.00 33.22 C ATOM 0 H ALA A 59 24.935 -77.543 -16.307 1.00 41.11 H new ATOM 0 HA ALA A 59 27.777 -77.362 -16.528 1.00 31.13 H new ATOM 0 HB1 ALA A 59 27.498 -75.600 -14.811 1.00 33.22 H new ATOM 0 HB2 ALA A 59 26.343 -75.408 -16.151 1.00 33.22 H new ATOM 0 HB3 ALA A 59 25.799 -76.088 -14.599 1.00 33.22 H new ATOM 896 N LEU A 60 26.522 -78.747 -13.802 1.00 54.24 N ATOM 897 CA LEU A 60 26.842 -79.608 -12.658 1.00 74.52 C ATOM 898 C LEU A 60 26.945 -81.074 -13.095 1.00 2.20 C ATOM 899 O LEU A 60 27.264 -81.947 -12.292 1.00 5.04 O ATOM 900 CB LEU A 60 25.787 -79.436 -11.546 1.00 10.34 C ATOM 901 CG LEU A 60 26.093 -78.375 -10.472 1.00 60.33 C ATOM 902 CD1 LEU A 60 27.157 -78.884 -9.496 1.00 41.11 C ATOM 903 CD2 LEU A 60 26.526 -77.059 -11.116 1.00 51.52 C ATOM 0 H LEU A 60 25.531 -78.522 -13.890 1.00 54.24 H new ATOM 0 HA LEU A 60 27.811 -79.309 -12.259 1.00 74.52 H new ATOM 0 HB2 LEU A 60 24.835 -79.184 -12.014 1.00 10.34 H new ATOM 0 HB3 LEU A 60 25.654 -80.397 -11.049 1.00 10.34 H new ATOM 0 HG LEU A 60 25.179 -78.188 -9.908 1.00 60.33 H new ATOM 0 HD11 LEU A 60 27.358 -78.119 -8.746 1.00 41.11 H new ATOM 0 HD12 LEU A 60 26.798 -79.788 -9.005 1.00 41.11 H new ATOM 0 HD13 LEU A 60 28.074 -79.107 -10.041 1.00 41.11 H new ATOM 0 HD21 LEU A 60 26.737 -76.325 -10.338 1.00 51.52 H new ATOM 0 HD22 LEU A 60 27.424 -77.224 -11.712 1.00 51.52 H new ATOM 0 HD23 LEU A 60 25.727 -76.688 -11.758 1.00 51.52 H new ATOM 915 N SER A 61 26.666 -81.320 -14.378 1.00 74.52 N ATOM 916 CA SER A 61 26.875 -82.626 -15.005 1.00 3.53 C ATOM 917 C SER A 61 25.897 -83.673 -14.463 1.00 64.03 C ATOM 918 O SER A 61 26.245 -84.847 -14.303 1.00 34.12 O ATOM 919 CB SER A 61 28.336 -83.081 -14.812 1.00 74.53 C ATOM 920 OG SER A 61 28.603 -84.292 -15.503 1.00 63.03 O ATOM 0 H SER A 61 26.288 -80.616 -15.012 1.00 74.52 H new ATOM 0 HA SER A 61 26.680 -82.525 -16.073 1.00 3.53 H new ATOM 0 HB2 SER A 61 29.010 -82.302 -15.168 1.00 74.53 H new ATOM 0 HB3 SER A 61 28.538 -83.216 -13.749 1.00 74.53 H new ATOM 0 HG SER A 61 27.878 -84.930 -15.336 1.00 63.03 H new ATOM 926 N LEU A 62 24.656 -83.247 -14.217 1.00 73.12 N ATOM 927 CA LEU A 62 23.576 -84.182 -13.925 1.00 32.44 C ATOM 928 C LEU A 62 22.947 -84.637 -15.237 1.00 13.42 C ATOM 929 O LEU A 62 22.661 -83.815 -16.114 1.00 54.02 O ATOM 930 CB LEU A 62 22.487 -83.553 -13.027 1.00 62.02 C ATOM 931 CG LEU A 62 22.937 -83.093 -11.627 1.00 31.13 C ATOM 932 CD1 LEU A 62 23.895 -84.102 -11.003 1.00 22.14 C ATOM 933 CD2 LEU A 62 23.543 -81.699 -11.684 1.00 20.31 C ATOM 0 H LEU A 62 24.379 -82.265 -14.215 1.00 73.12 H new ATOM 0 HA LEU A 62 24.001 -85.028 -13.384 1.00 32.44 H new ATOM 0 HB2 LEU A 62 22.066 -82.694 -13.550 1.00 62.02 H new ATOM 0 HB3 LEU A 62 21.682 -84.278 -12.906 1.00 62.02 H new ATOM 0 HG LEU A 62 22.058 -83.041 -10.985 1.00 31.13 H new ATOM 0 HD11 LEU A 62 24.198 -83.754 -10.015 1.00 22.14 H new ATOM 0 HD12 LEU A 62 23.397 -85.067 -10.911 1.00 22.14 H new ATOM 0 HD13 LEU A 62 24.776 -84.207 -11.636 1.00 22.14 H new ATOM 0 HD21 LEU A 62 23.853 -81.396 -10.684 1.00 20.31 H new ATOM 0 HD22 LEU A 62 24.409 -81.705 -12.346 1.00 20.31 H new ATOM 0 HD23 LEU A 62 22.802 -80.995 -12.063 1.00 20.31 H new ATOM 945 N VAL A 63 22.735 -85.938 -15.372 1.00 63.31 N ATOM 946 CA VAL A 63 22.066 -86.493 -16.540 1.00 53.30 C ATOM 947 C VAL A 63 20.683 -86.997 -16.142 1.00 24.01 C ATOM 948 O VAL A 63 20.398 -87.152 -14.957 1.00 52.40 O ATOM 949 CB VAL A 63 22.890 -87.635 -17.193 1.00 11.42 C ATOM 950 CG1 VAL A 63 24.246 -87.116 -17.672 1.00 23.31 C ATOM 951 CG2 VAL A 63 23.067 -88.807 -16.227 1.00 10.23 C ATOM 0 H VAL A 63 23.019 -86.633 -14.682 1.00 63.31 H new ATOM 0 HA VAL A 63 21.970 -85.701 -17.283 1.00 53.30 H new ATOM 0 HB VAL A 63 22.337 -87.997 -18.060 1.00 11.42 H new ATOM 0 HG11 VAL A 63 24.808 -87.932 -18.127 1.00 23.31 H new ATOM 0 HG12 VAL A 63 24.094 -86.326 -18.408 1.00 23.31 H new ATOM 0 HG13 VAL A 63 24.804 -86.719 -16.824 1.00 23.31 H new ATOM 0 HG21 VAL A 63 23.648 -89.593 -16.711 1.00 10.23 H new ATOM 0 HG22 VAL A 63 23.590 -88.466 -15.334 1.00 10.23 H new ATOM 0 HG23 VAL A 63 22.089 -89.199 -15.947 1.00 10.23 H new ATOM 961 N GLY A 64 19.824 -87.219 -17.125 1.00 15.23 N ATOM 962 CA GLY A 64 18.461 -87.643 -16.853 1.00 55.25 C ATOM 963 C GLY A 64 17.483 -86.975 -17.794 1.00 30.41 C ATOM 964 O GLY A 64 17.741 -86.893 -18.999 1.00 63.55 O ATOM 0 H GLY A 64 20.046 -87.113 -18.115 1.00 15.23 H new ATOM 0 HA2 GLY A 64 18.387 -88.726 -16.955 1.00 55.25 H new ATOM 0 HA3 GLY A 64 18.201 -87.402 -15.822 1.00 55.25 H new ATOM 968 N TYR A 65 16.369 -86.484 -17.259 1.00 73.32 N ATOM 969 CA TYR A 65 15.357 -85.821 -18.080 1.00 13.32 C ATOM 970 C TYR A 65 14.343 -85.074 -17.215 1.00 31.43 C ATOM 971 O TYR A 65 14.070 -85.473 -16.088 1.00 30.44 O ATOM 972 CB TYR A 65 14.676 -86.846 -19.022 1.00 12.34 C ATOM 973 CG TYR A 65 13.166 -86.990 -18.894 1.00 12.32 C ATOM 974 CD1 TYR A 65 12.608 -87.871 -17.971 1.00 2.54 C ATOM 975 CD2 TYR A 65 12.304 -86.270 -19.718 1.00 43.24 C ATOM 976 CE1 TYR A 65 11.239 -88.028 -17.873 1.00 14.21 C ATOM 977 CE2 TYR A 65 10.933 -86.419 -19.622 1.00 74.34 C ATOM 978 CZ TYR A 65 10.406 -87.301 -18.699 1.00 4.14 C ATOM 979 OH TYR A 65 9.039 -87.460 -18.603 1.00 22.34 O ATOM 0 H TYR A 65 16.143 -86.531 -16.265 1.00 73.32 H new ATOM 0 HA TYR A 65 15.848 -85.073 -18.702 1.00 13.32 H new ATOM 0 HB2 TYR A 65 14.906 -86.569 -20.051 1.00 12.34 H new ATOM 0 HB3 TYR A 65 15.128 -87.822 -18.847 1.00 12.34 H new ATOM 0 HD1 TYR A 65 13.256 -88.441 -17.321 1.00 2.54 H new ATOM 0 HD2 TYR A 65 12.714 -85.584 -20.444 1.00 43.24 H new ATOM 0 HE1 TYR A 65 10.822 -88.717 -17.153 1.00 14.21 H new ATOM 0 HE2 TYR A 65 10.278 -85.849 -20.265 1.00 74.34 H new ATOM 0 HH TYR A 65 8.801 -87.699 -17.683 1.00 22.34 H new ATOM 989 N VAL A 66 13.809 -83.979 -17.749 1.00 23.54 N ATOM 990 CA VAL A 66 12.788 -83.179 -17.062 1.00 72.34 C ATOM 991 C VAL A 66 11.718 -82.746 -18.057 1.00 10.41 C ATOM 992 O VAL A 66 12.037 -82.433 -19.207 1.00 63.31 O ATOM 993 CB VAL A 66 13.392 -81.920 -16.362 1.00 1.11 C ATOM 994 CG1 VAL A 66 12.321 -80.864 -16.084 1.00 51.44 C ATOM 995 CG2 VAL A 66 14.087 -82.302 -15.054 1.00 12.42 C ATOM 0 H VAL A 66 14.068 -83.618 -18.667 1.00 23.54 H new ATOM 0 HA VAL A 66 12.350 -83.807 -16.287 1.00 72.34 H new ATOM 0 HB VAL A 66 14.127 -81.496 -17.046 1.00 1.11 H new ATOM 0 HG11 VAL A 66 12.777 -80.002 -15.597 1.00 51.44 H new ATOM 0 HG12 VAL A 66 11.866 -80.551 -17.024 1.00 51.44 H new ATOM 0 HG13 VAL A 66 11.555 -81.285 -15.433 1.00 51.44 H new ATOM 0 HG21 VAL A 66 14.499 -81.408 -14.586 1.00 12.42 H new ATOM 0 HG22 VAL A 66 13.366 -82.764 -14.380 1.00 12.42 H new ATOM 0 HG23 VAL A 66 14.892 -83.006 -15.262 1.00 12.42 H new ATOM 1005 N THR A 67 10.461 -82.743 -17.601 1.00 33.35 N ATOM 1006 CA THR A 67 9.321 -82.294 -18.392 1.00 62.00 C ATOM 1007 C THR A 67 8.265 -81.686 -17.472 1.00 43.22 C ATOM 1008 O THR A 67 8.280 -81.915 -16.261 1.00 43.20 O ATOM 1009 CB THR A 67 8.674 -83.454 -19.193 1.00 20.20 C ATOM 1010 OG1 THR A 67 7.581 -82.965 -19.985 1.00 12.03 O ATOM 1011 CG2 THR A 67 8.152 -84.545 -18.270 1.00 52.41 C ATOM 0 H THR A 67 10.209 -83.056 -16.663 1.00 33.35 H new ATOM 0 HA THR A 67 9.690 -81.553 -19.101 1.00 62.00 H new ATOM 0 HB THR A 67 9.448 -83.872 -19.836 1.00 20.20 H new ATOM 0 HG1 THR A 67 7.183 -83.707 -20.486 1.00 12.03 H new ATOM 0 HG21 THR A 67 7.705 -85.342 -18.865 1.00 52.41 H new ATOM 0 HG22 THR A 67 8.976 -84.949 -17.682 1.00 52.41 H new ATOM 0 HG23 THR A 67 7.400 -84.127 -17.601 1.00 52.41 H new ATOM 1019 N ASN A 68 7.355 -80.907 -18.042 1.00 24.14 N ATOM 1020 CA ASN A 68 6.230 -80.363 -17.289 1.00 73.40 C ATOM 1021 C ASN A 68 4.979 -81.189 -17.571 1.00 73.12 C ATOM 1022 O ASN A 68 4.886 -81.847 -18.611 1.00 10.52 O ATOM 1023 CB ASN A 68 5.991 -78.893 -17.663 1.00 71.15 C ATOM 1024 CG ASN A 68 4.817 -78.264 -16.918 1.00 11.14 C ATOM 1025 OD1 ASN A 68 4.077 -77.459 -17.477 1.00 14.14 O ATOM 1026 ND2 ASN A 68 4.657 -78.596 -15.643 1.00 71.23 N ATOM 0 H ASN A 68 7.373 -80.637 -19.025 1.00 24.14 H new ATOM 0 HA ASN A 68 6.461 -80.411 -16.225 1.00 73.40 H new ATOM 0 HB2 ASN A 68 6.894 -78.320 -17.453 1.00 71.15 H new ATOM 0 HB3 ASN A 68 5.811 -78.823 -18.736 1.00 71.15 H new ATOM 0 HD21 ASN A 68 3.902 -78.179 -15.098 1.00 71.23 H new ATOM 0 HD22 ASN A 68 5.289 -79.268 -15.208 1.00 71.23 H new ATOM 1033 N ASN A 69 4.033 -81.165 -16.642 1.00 74.00 N ATOM 1034 CA ASN A 69 2.753 -81.848 -16.807 1.00 52.24 C ATOM 1035 C ASN A 69 1.637 -80.819 -16.736 1.00 5.25 C ATOM 1036 O ASN A 69 1.771 -79.806 -16.045 1.00 52.52 O ATOM 1037 CB ASN A 69 2.550 -82.911 -15.713 1.00 72.13 C ATOM 1038 CG ASN A 69 3.635 -83.976 -15.705 1.00 72.22 C ATOM 1039 OD1 ASN A 69 3.528 -84.998 -16.379 1.00 2.34 O ATOM 1040 ND2 ASN A 69 4.687 -83.745 -14.934 1.00 31.15 N ATOM 0 H ASN A 69 4.129 -80.673 -15.754 1.00 74.00 H new ATOM 0 HA ASN A 69 2.742 -82.352 -17.773 1.00 52.24 H new ATOM 0 HB2 ASN A 69 2.523 -82.421 -14.740 1.00 72.13 H new ATOM 0 HB3 ASN A 69 1.581 -83.389 -15.856 1.00 72.13 H new ATOM 0 HD21 ASN A 69 5.444 -84.427 -14.886 1.00 31.15 H new ATOM 0 HD22 ASN A 69 4.741 -82.885 -14.389 1.00 31.15 H new ATOM 1047 N GLU A 70 0.532 -81.081 -17.423 1.00 63.52 N ATOM 1048 CA GLU A 70 -0.588 -80.142 -17.456 1.00 54.22 C ATOM 1049 C GLU A 70 -1.292 -80.105 -16.092 1.00 23.41 C ATOM 1050 O GLU A 70 -2.220 -79.325 -15.871 1.00 22.31 O ATOM 1051 CB GLU A 70 -1.567 -80.521 -18.578 1.00 35.24 C ATOM 1052 CG GLU A 70 -2.633 -79.463 -18.851 1.00 73.50 C ATOM 1053 CD GLU A 70 -3.512 -79.806 -20.041 1.00 44.50 C ATOM 1054 OE1 GLU A 70 -4.547 -80.477 -19.852 1.00 32.11 O ATOM 1055 OE2 GLU A 70 -3.176 -79.400 -21.174 1.00 22.30 O ATOM 0 H GLU A 70 0.385 -81.933 -17.964 1.00 63.52 H new ATOM 0 HA GLU A 70 -0.207 -79.142 -17.665 1.00 54.22 H new ATOM 0 HB2 GLU A 70 -1.003 -80.700 -19.494 1.00 35.24 H new ATOM 0 HB3 GLU A 70 -2.058 -81.459 -18.317 1.00 35.24 H new ATOM 0 HG2 GLU A 70 -3.258 -79.346 -17.965 1.00 73.50 H new ATOM 0 HG3 GLU A 70 -2.148 -78.503 -19.028 1.00 73.50 H new ATOM 1062 N ASP A 71 -0.834 -80.963 -15.182 1.00 53.44 N ATOM 1063 CA ASP A 71 -1.286 -80.951 -13.791 1.00 52.32 C ATOM 1064 C ASP A 71 -0.679 -79.764 -13.050 1.00 60.33 C ATOM 1065 O ASP A 71 -1.030 -79.488 -11.901 1.00 61.33 O ATOM 1066 CB ASP A 71 -0.875 -82.250 -13.084 1.00 72.43 C ATOM 1067 CG ASP A 71 -1.400 -83.491 -13.780 1.00 73.01 C ATOM 1068 OD1 ASP A 71 -0.801 -83.907 -14.795 1.00 23.34 O ATOM 1069 OD2 ASP A 71 -2.405 -84.068 -13.315 1.00 44.11 O ATOM 0 H ASP A 71 -0.142 -81.684 -15.387 1.00 53.44 H new ATOM 0 HA ASP A 71 -2.373 -80.866 -13.786 1.00 52.32 H new ATOM 0 HB2 ASP A 71 0.213 -82.301 -13.032 1.00 72.43 H new ATOM 0 HB3 ASP A 71 -1.243 -82.232 -12.058 1.00 72.43 H new ATOM 1074 N GLY A 72 0.247 -79.073 -13.716 1.00 2.22 N ATOM 1075 CA GLY A 72 0.942 -77.954 -13.106 1.00 24.21 C ATOM 1076 C GLY A 72 2.208 -78.397 -12.400 1.00 64.40 C ATOM 1077 O GLY A 72 2.890 -77.595 -11.757 1.00 24.14 O ATOM 0 H GLY A 72 0.528 -79.273 -14.676 1.00 2.22 H new ATOM 0 HA2 GLY A 72 1.191 -77.219 -13.872 1.00 24.21 H new ATOM 0 HA3 GLY A 72 0.282 -77.461 -12.393 1.00 24.21 H new ATOM 1081 N SER A 73 2.529 -79.679 -12.526 1.00 74.30 N ATOM 1082 CA SER A 73 3.690 -80.255 -11.865 1.00 53.52 C ATOM 1083 C SER A 73 4.807 -80.537 -12.870 1.00 5.24 C ATOM 1084 O SER A 73 4.558 -81.036 -13.966 1.00 20.32 O ATOM 1085 CB SER A 73 3.277 -81.543 -11.142 1.00 23.04 C ATOM 1086 OG SER A 73 2.527 -82.392 -11.999 1.00 33.31 O ATOM 0 H SER A 73 1.995 -80.344 -13.086 1.00 74.30 H new ATOM 0 HA SER A 73 4.073 -79.540 -11.137 1.00 53.52 H new ATOM 0 HB2 SER A 73 4.166 -82.068 -10.792 1.00 23.04 H new ATOM 0 HB3 SER A 73 2.685 -81.295 -10.261 1.00 23.04 H new ATOM 0 HG SER A 73 1.793 -82.801 -11.494 1.00 33.31 H new ATOM 1092 N VAL A 74 6.031 -80.184 -12.505 1.00 2.14 N ATOM 1093 CA VAL A 74 7.209 -80.513 -13.302 1.00 23.14 C ATOM 1094 C VAL A 74 7.842 -81.785 -12.743 1.00 45.15 C ATOM 1095 O VAL A 74 8.063 -81.888 -11.538 1.00 50.12 O ATOM 1096 CB VAL A 74 8.243 -79.358 -13.285 1.00 61.55 C ATOM 1097 CG1 VAL A 74 9.478 -79.711 -14.114 1.00 25.24 C ATOM 1098 CG2 VAL A 74 7.608 -78.057 -13.776 1.00 44.21 C ATOM 0 H VAL A 74 6.238 -79.664 -11.652 1.00 2.14 H new ATOM 0 HA VAL A 74 6.901 -80.667 -14.336 1.00 23.14 H new ATOM 0 HB VAL A 74 8.566 -79.211 -12.255 1.00 61.55 H new ATOM 0 HG11 VAL A 74 10.186 -78.882 -14.084 1.00 25.24 H new ATOM 0 HG12 VAL A 74 9.948 -80.605 -13.704 1.00 25.24 H new ATOM 0 HG13 VAL A 74 9.182 -79.898 -15.146 1.00 25.24 H new ATOM 0 HG21 VAL A 74 8.351 -77.259 -13.756 1.00 44.21 H new ATOM 0 HG22 VAL A 74 7.246 -78.191 -14.796 1.00 44.21 H new ATOM 0 HG23 VAL A 74 6.773 -77.792 -13.127 1.00 44.21 H new ATOM 1108 N SER A 75 8.110 -82.760 -13.601 1.00 24.41 N ATOM 1109 CA SER A 75 8.631 -84.048 -13.155 1.00 33.53 C ATOM 1110 C SER A 75 9.739 -84.548 -14.082 1.00 25.55 C ATOM 1111 O SER A 75 9.767 -84.225 -15.271 1.00 44.43 O ATOM 1112 CB SER A 75 7.489 -85.070 -13.081 1.00 45.42 C ATOM 1113 OG SER A 75 6.464 -84.622 -12.202 1.00 50.11 O ATOM 0 H SER A 75 7.976 -82.685 -14.609 1.00 24.41 H new ATOM 0 HA SER A 75 9.064 -83.921 -12.163 1.00 33.53 H new ATOM 0 HB2 SER A 75 7.075 -85.232 -14.076 1.00 45.42 H new ATOM 0 HB3 SER A 75 7.876 -86.029 -12.737 1.00 45.42 H new ATOM 0 HG SER A 75 5.897 -83.970 -12.665 1.00 50.11 H new ATOM 1119 N GLY A 76 10.652 -85.328 -13.517 1.00 32.44 N ATOM 1120 CA GLY A 76 11.755 -85.884 -14.274 1.00 51.54 C ATOM 1121 C GLY A 76 12.636 -86.758 -13.405 1.00 43.42 C ATOM 1122 O GLY A 76 12.231 -87.147 -12.311 1.00 53.55 O ATOM 0 H GLY A 76 10.646 -85.588 -12.531 1.00 32.44 H new ATOM 0 HA2 GLY A 76 11.368 -86.470 -15.108 1.00 51.54 H new ATOM 0 HA3 GLY A 76 12.349 -85.076 -14.701 1.00 51.54 H new ATOM 1126 N VAL A 77 13.835 -87.068 -13.887 1.00 42.05 N ATOM 1127 CA VAL A 77 14.787 -87.899 -13.151 1.00 43.44 C ATOM 1128 C VAL A 77 16.190 -87.303 -13.257 1.00 74.14 C ATOM 1129 O VAL A 77 16.578 -86.806 -14.322 1.00 42.33 O ATOM 1130 CB VAL A 77 14.816 -89.356 -13.689 1.00 53.04 C ATOM 1131 CG1 VAL A 77 15.781 -90.218 -12.876 1.00 73.25 C ATOM 1132 CG2 VAL A 77 13.414 -89.970 -13.695 1.00 44.22 C ATOM 0 H VAL A 77 14.175 -86.753 -14.795 1.00 42.05 H new ATOM 0 HA VAL A 77 14.463 -87.922 -12.110 1.00 43.44 H new ATOM 0 HB VAL A 77 15.173 -89.324 -14.718 1.00 53.04 H new ATOM 0 HG11 VAL A 77 15.784 -91.234 -13.272 1.00 73.25 H new ATOM 0 HG12 VAL A 77 16.786 -89.800 -12.942 1.00 73.25 H new ATOM 0 HG13 VAL A 77 15.463 -90.236 -11.834 1.00 73.25 H new ATOM 0 HG21 VAL A 77 13.465 -90.990 -14.076 1.00 44.22 H new ATOM 0 HG22 VAL A 77 13.018 -89.982 -12.680 1.00 44.22 H new ATOM 0 HG23 VAL A 77 12.760 -89.376 -14.333 1.00 44.22 H new ATOM 1142 N VAL A 78 16.936 -87.344 -12.155 1.00 11.12 N ATOM 1143 CA VAL A 78 18.311 -86.849 -12.121 1.00 13.11 C ATOM 1144 C VAL A 78 19.263 -87.998 -11.784 1.00 3.40 C ATOM 1145 O VAL A 78 18.922 -88.882 -10.992 1.00 63.53 O ATOM 1146 CB VAL A 78 18.489 -85.712 -11.078 1.00 55.53 C ATOM 1147 CG1 VAL A 78 18.580 -86.272 -9.660 1.00 52.34 C ATOM 1148 CG2 VAL A 78 19.708 -84.859 -11.402 1.00 23.42 C ATOM 0 H VAL A 78 16.607 -87.719 -11.265 1.00 11.12 H new ATOM 0 HA VAL A 78 18.542 -86.443 -13.106 1.00 13.11 H new ATOM 0 HB VAL A 78 17.606 -85.074 -11.130 1.00 55.53 H new ATOM 0 HG11 VAL A 78 18.704 -85.452 -8.952 1.00 52.34 H new ATOM 0 HG12 VAL A 78 17.667 -86.819 -9.425 1.00 52.34 H new ATOM 0 HG13 VAL A 78 19.434 -86.945 -9.589 1.00 52.34 H new ATOM 0 HG21 VAL A 78 19.809 -84.071 -10.656 1.00 23.42 H new ATOM 0 HG22 VAL A 78 20.602 -85.483 -11.394 1.00 23.42 H new ATOM 0 HG23 VAL A 78 19.587 -84.412 -12.389 1.00 23.42 H new ATOM 1158 N GLN A 79 20.445 -87.988 -12.396 1.00 61.04 N ATOM 1159 CA GLN A 79 21.438 -89.041 -12.203 1.00 72.34 C ATOM 1160 C GLN A 79 22.841 -88.425 -12.194 1.00 51.25 C ATOM 1161 O GLN A 79 23.154 -87.578 -13.037 1.00 1.41 O ATOM 1162 CB GLN A 79 21.342 -90.079 -13.338 1.00 75.34 C ATOM 1163 CG GLN A 79 19.928 -90.298 -13.870 1.00 65.40 C ATOM 1164 CD GLN A 79 19.890 -91.174 -15.107 1.00 13.34 C ATOM 1165 OE1 GLN A 79 19.071 -90.968 -16.000 1.00 12.03 O ATOM 1166 NE2 GLN A 79 20.745 -92.182 -15.153 1.00 41.24 N ATOM 0 H GLN A 79 20.740 -87.252 -13.038 1.00 61.04 H new ATOM 0 HA GLN A 79 21.247 -89.537 -11.251 1.00 72.34 H new ATOM 0 HB2 GLN A 79 21.982 -89.761 -14.161 1.00 75.34 H new ATOM 0 HB3 GLN A 79 21.734 -91.030 -12.979 1.00 75.34 H new ATOM 0 HG2 GLN A 79 19.319 -90.754 -13.090 1.00 65.40 H new ATOM 0 HG3 GLN A 79 19.479 -89.332 -14.101 1.00 65.40 H new ATOM 0 HE21 GLN A 79 21.411 -92.321 -14.393 1.00 41.24 H new ATOM 0 HE22 GLN A 79 20.739 -92.820 -15.949 1.00 41.24 H new ATOM 1175 N GLY A 80 23.676 -88.838 -11.245 1.00 73.20 N ATOM 1176 CA GLY A 80 25.050 -88.358 -11.191 1.00 70.11 C ATOM 1177 C GLY A 80 25.689 -88.617 -9.841 1.00 45.11 C ATOM 1178 O GLY A 80 25.117 -89.332 -9.022 1.00 30.00 O ATOM 0 H GLY A 80 23.427 -89.499 -10.509 1.00 73.20 H new ATOM 0 HA2 GLY A 80 25.636 -88.847 -11.969 1.00 70.11 H new ATOM 0 HA3 GLY A 80 25.069 -87.289 -11.402 1.00 70.11 H new ATOM 1182 N PRO A 81 26.889 -88.064 -9.580 1.00 21.24 N ATOM 1183 CA PRO A 81 27.549 -88.199 -8.273 1.00 24.25 C ATOM 1184 C PRO A 81 26.703 -87.595 -7.148 1.00 43.11 C ATOM 1185 O PRO A 81 26.008 -86.597 -7.356 1.00 61.12 O ATOM 1186 CB PRO A 81 28.868 -87.425 -8.433 1.00 14.12 C ATOM 1187 CG PRO A 81 28.675 -86.561 -9.640 1.00 1.43 C ATOM 1188 CD PRO A 81 27.700 -87.284 -10.531 1.00 73.32 C ATOM 0 HA PRO A 81 27.700 -89.243 -8.000 1.00 24.25 H new ATOM 0 HB2 PRO A 81 29.081 -86.824 -7.549 1.00 14.12 H new ATOM 0 HB3 PRO A 81 29.709 -88.105 -8.566 1.00 14.12 H new ATOM 0 HG2 PRO A 81 28.290 -85.581 -9.358 1.00 1.43 H new ATOM 0 HG3 PRO A 81 29.622 -86.396 -10.154 1.00 1.43 H new ATOM 0 HD2 PRO A 81 27.088 -86.589 -11.106 1.00 73.32 H new ATOM 0 HD3 PRO A 81 28.210 -87.928 -11.248 1.00 73.32 H new ATOM 1196 N LYS A 82 26.791 -88.195 -5.961 1.00 34.24 N ATOM 1197 CA LYS A 82 25.984 -87.791 -4.807 1.00 65.22 C ATOM 1198 C LYS A 82 26.002 -86.278 -4.615 1.00 10.03 C ATOM 1199 O LYS A 82 24.959 -85.651 -4.443 1.00 13.55 O ATOM 1200 CB LYS A 82 26.501 -88.505 -3.538 1.00 54.13 C ATOM 1201 CG LYS A 82 25.797 -88.113 -2.227 1.00 14.43 C ATOM 1202 CD LYS A 82 26.365 -86.826 -1.614 1.00 71.14 C ATOM 1203 CE LYS A 82 25.724 -86.499 -0.267 1.00 51.01 C ATOM 1204 NZ LYS A 82 24.274 -86.197 -0.393 1.00 4.33 N ATOM 0 H LYS A 82 27.422 -88.973 -5.771 1.00 34.24 H new ATOM 0 HA LYS A 82 24.950 -88.084 -4.991 1.00 65.22 H new ATOM 0 HB2 LYS A 82 26.397 -89.581 -3.679 1.00 54.13 H new ATOM 0 HB3 LYS A 82 27.566 -88.299 -3.434 1.00 54.13 H new ATOM 0 HG2 LYS A 82 24.732 -87.981 -2.416 1.00 14.43 H new ATOM 0 HG3 LYS A 82 25.895 -88.927 -1.509 1.00 14.43 H new ATOM 0 HD2 LYS A 82 27.442 -86.931 -1.486 1.00 71.14 H new ATOM 0 HD3 LYS A 82 26.205 -85.996 -2.302 1.00 71.14 H new ATOM 0 HE2 LYS A 82 25.860 -87.341 0.412 1.00 51.01 H new ATOM 0 HE3 LYS A 82 26.234 -85.645 0.178 1.00 51.01 H new ATOM 0 HZ1 LYS A 82 23.748 -86.708 0.344 1.00 4.33 H new ATOM 0 HZ2 LYS A 82 24.121 -85.174 -0.282 1.00 4.33 H new ATOM 0 HZ3 LYS A 82 23.937 -86.497 -1.330 1.00 4.33 H new ATOM 1218 N GLU A 83 27.193 -85.694 -4.657 1.00 45.34 N ATOM 1219 CA GLU A 83 27.361 -84.280 -4.333 1.00 53.14 C ATOM 1220 C GLU A 83 26.719 -83.373 -5.389 1.00 41.52 C ATOM 1221 O GLU A 83 26.158 -82.327 -5.062 1.00 1.31 O ATOM 1222 CB GLU A 83 28.847 -83.949 -4.149 1.00 53.44 C ATOM 1223 CG GLU A 83 29.747 -84.545 -5.220 1.00 34.25 C ATOM 1224 CD GLU A 83 31.199 -84.140 -5.046 1.00 42.22 C ATOM 1225 OE1 GLU A 83 31.887 -84.737 -4.188 1.00 25.22 O ATOM 1226 OE2 GLU A 83 31.656 -83.212 -5.746 1.00 53.32 O ATOM 0 H GLU A 83 28.056 -86.175 -4.911 1.00 45.34 H new ATOM 0 HA GLU A 83 26.844 -84.089 -3.393 1.00 53.14 H new ATOM 0 HB2 GLU A 83 28.970 -82.866 -4.146 1.00 53.44 H new ATOM 0 HB3 GLU A 83 29.172 -84.310 -3.173 1.00 53.44 H new ATOM 0 HG2 GLU A 83 29.670 -85.632 -5.192 1.00 34.25 H new ATOM 0 HG3 GLU A 83 29.399 -84.226 -6.202 1.00 34.25 H new ATOM 1233 N GLN A 84 26.778 -83.784 -6.652 1.00 71.32 N ATOM 1234 CA GLN A 84 26.172 -83.006 -7.731 1.00 73.41 C ATOM 1235 C GLN A 84 24.651 -83.158 -7.717 1.00 4.41 C ATOM 1236 O GLN A 84 23.919 -82.194 -7.960 1.00 35.12 O ATOM 1237 CB GLN A 84 26.752 -83.419 -9.092 1.00 70.43 C ATOM 1238 CG GLN A 84 28.082 -82.748 -9.436 1.00 43.51 C ATOM 1239 CD GLN A 84 29.181 -83.009 -8.418 1.00 53.33 C ATOM 1240 OE1 GLN A 84 29.928 -83.979 -8.532 1.00 64.14 O ATOM 1241 NE2 GLN A 84 29.302 -82.143 -7.424 1.00 5.13 N ATOM 0 H GLN A 84 27.235 -84.644 -6.954 1.00 71.32 H new ATOM 0 HA GLN A 84 26.409 -81.954 -7.569 1.00 73.41 H new ATOM 0 HB2 GLN A 84 26.890 -84.500 -9.103 1.00 70.43 H new ATOM 0 HB3 GLN A 84 26.027 -83.183 -9.870 1.00 70.43 H new ATOM 0 HG2 GLN A 84 28.414 -83.099 -10.413 1.00 43.51 H new ATOM 0 HG3 GLN A 84 27.925 -81.673 -9.520 1.00 43.51 H new ATOM 0 HE21 GLN A 84 28.665 -81.349 -7.359 1.00 5.13 H new ATOM 0 HE22 GLN A 84 30.032 -82.270 -6.723 1.00 5.13 H new ATOM 1250 N VAL A 85 24.176 -84.366 -7.428 1.00 33.13 N ATOM 1251 CA VAL A 85 22.743 -84.602 -7.267 1.00 22.34 C ATOM 1252 C VAL A 85 22.228 -83.788 -6.084 1.00 73.43 C ATOM 1253 O VAL A 85 21.132 -83.221 -6.123 1.00 53.31 O ATOM 1254 CB VAL A 85 22.428 -86.107 -7.050 1.00 44.11 C ATOM 1255 CG1 VAL A 85 20.935 -86.326 -6.800 1.00 71.00 C ATOM 1256 CG2 VAL A 85 22.901 -86.928 -8.249 1.00 25.24 C ATOM 0 H VAL A 85 24.758 -85.194 -7.301 1.00 33.13 H new ATOM 0 HA VAL A 85 22.242 -84.290 -8.183 1.00 22.34 H new ATOM 0 HB VAL A 85 22.968 -86.443 -6.165 1.00 44.11 H new ATOM 0 HG11 VAL A 85 20.743 -87.389 -6.651 1.00 71.00 H new ATOM 0 HG12 VAL A 85 20.630 -85.774 -5.911 1.00 71.00 H new ATOM 0 HG13 VAL A 85 20.366 -85.971 -7.660 1.00 71.00 H new ATOM 0 HG21 VAL A 85 22.673 -87.981 -8.082 1.00 25.24 H new ATOM 0 HG22 VAL A 85 22.391 -86.585 -9.149 1.00 25.24 H new ATOM 0 HG23 VAL A 85 23.977 -86.805 -8.373 1.00 25.24 H new ATOM 1266 N ASP A 86 23.055 -83.716 -5.047 1.00 15.30 N ATOM 1267 CA ASP A 86 22.749 -82.932 -3.857 1.00 63.23 C ATOM 1268 C ASP A 86 22.717 -81.447 -4.226 1.00 64.31 C ATOM 1269 O ASP A 86 21.886 -80.680 -3.731 1.00 72.04 O ATOM 1270 CB ASP A 86 23.801 -83.205 -2.769 1.00 35.40 C ATOM 1271 CG ASP A 86 23.294 -82.932 -1.359 1.00 14.31 C ATOM 1272 OD1 ASP A 86 23.390 -81.781 -0.892 1.00 61.35 O ATOM 1273 OD2 ASP A 86 22.819 -83.890 -0.705 1.00 32.10 O ATOM 0 H ASP A 86 23.953 -84.198 -5.008 1.00 15.30 H new ATOM 0 HA ASP A 86 21.772 -83.217 -3.465 1.00 63.23 H new ATOM 0 HB2 ASP A 86 24.123 -84.244 -2.837 1.00 35.40 H new ATOM 0 HB3 ASP A 86 24.678 -82.587 -2.958 1.00 35.40 H new ATOM 1278 N ALA A 87 23.618 -81.058 -5.132 1.00 21.34 N ATOM 1279 CA ALA A 87 23.635 -79.706 -5.677 1.00 34.53 C ATOM 1280 C ALA A 87 22.321 -79.403 -6.391 1.00 20.20 C ATOM 1281 O ALA A 87 21.753 -78.320 -6.245 1.00 62.15 O ATOM 1282 CB ALA A 87 24.801 -79.542 -6.644 1.00 10.13 C ATOM 0 H ALA A 87 24.347 -81.667 -5.503 1.00 21.34 H new ATOM 0 HA ALA A 87 23.757 -79.003 -4.853 1.00 34.53 H new ATOM 0 HB1 ALA A 87 24.802 -78.528 -7.044 1.00 10.13 H new ATOM 0 HB2 ALA A 87 25.738 -79.726 -6.119 1.00 10.13 H new ATOM 0 HB3 ALA A 87 24.698 -80.255 -7.462 1.00 10.13 H new ATOM 1288 N PHE A 88 21.844 -80.380 -7.159 1.00 23.24 N ATOM 1289 CA PHE A 88 20.628 -80.225 -7.947 1.00 53.22 C ATOM 1290 C PHE A 88 19.405 -80.067 -7.040 1.00 41.43 C ATOM 1291 O PHE A 88 18.573 -79.190 -7.264 1.00 24.23 O ATOM 1292 CB PHE A 88 20.450 -81.427 -8.888 1.00 13.44 C ATOM 1293 CG PHE A 88 19.492 -81.170 -10.022 1.00 60.45 C ATOM 1294 CD1 PHE A 88 19.912 -80.481 -11.152 1.00 2.04 C ATOM 1295 CD2 PHE A 88 18.177 -81.609 -9.963 1.00 41.43 C ATOM 1296 CE1 PHE A 88 19.044 -80.239 -12.197 1.00 65.45 C ATOM 1297 CE2 PHE A 88 17.304 -81.368 -11.007 1.00 43.45 C ATOM 1298 CZ PHE A 88 17.737 -80.681 -12.123 1.00 72.11 C ATOM 0 H PHE A 88 22.287 -81.294 -7.251 1.00 23.24 H new ATOM 0 HA PHE A 88 20.721 -79.320 -8.547 1.00 53.22 H new ATOM 0 HB2 PHE A 88 21.421 -81.702 -9.299 1.00 13.44 H new ATOM 0 HB3 PHE A 88 20.095 -82.280 -8.310 1.00 13.44 H new ATOM 0 HD1 PHE A 88 20.931 -80.130 -11.214 1.00 2.04 H new ATOM 0 HD2 PHE A 88 17.832 -82.145 -9.091 1.00 41.43 H new ATOM 0 HE1 PHE A 88 19.386 -79.705 -13.071 1.00 65.45 H new ATOM 0 HE2 PHE A 88 16.284 -81.717 -10.950 1.00 43.45 H new ATOM 0 HZ PHE A 88 17.055 -80.489 -12.938 1.00 72.11 H new ATOM 1308 N VAL A 89 19.302 -80.909 -6.010 1.00 5.13 N ATOM 1309 CA VAL A 89 18.163 -80.845 -5.090 1.00 63.22 C ATOM 1310 C VAL A 89 18.197 -79.539 -4.292 1.00 22.42 C ATOM 1311 O VAL A 89 17.157 -78.905 -4.061 1.00 63.11 O ATOM 1312 CB VAL A 89 18.118 -82.064 -4.120 1.00 62.24 C ATOM 1313 CG1 VAL A 89 19.270 -82.038 -3.117 1.00 41.30 C ATOM 1314 CG2 VAL A 89 16.768 -82.140 -3.405 1.00 71.34 C ATOM 0 H VAL A 89 19.984 -81.635 -5.793 1.00 5.13 H new ATOM 0 HA VAL A 89 17.258 -80.877 -5.696 1.00 63.22 H new ATOM 0 HB VAL A 89 18.238 -82.964 -4.723 1.00 62.24 H new ATOM 0 HG11 VAL A 89 19.200 -82.905 -2.460 1.00 41.30 H new ATOM 0 HG12 VAL A 89 20.219 -82.063 -3.652 1.00 41.30 H new ATOM 0 HG13 VAL A 89 19.214 -81.127 -2.522 1.00 41.30 H new ATOM 0 HG21 VAL A 89 16.760 -82.998 -2.733 1.00 71.34 H new ATOM 0 HG22 VAL A 89 16.609 -81.228 -2.830 1.00 71.34 H new ATOM 0 HG23 VAL A 89 15.972 -82.248 -4.142 1.00 71.34 H new ATOM 1324 N LYS A 90 19.402 -79.131 -3.902 1.00 72.24 N ATOM 1325 CA LYS A 90 19.606 -77.881 -3.176 1.00 63.21 C ATOM 1326 C LYS A 90 19.189 -76.698 -4.046 1.00 31.12 C ATOM 1327 O LYS A 90 18.518 -75.772 -3.585 1.00 14.12 O ATOM 1328 CB LYS A 90 21.078 -77.763 -2.747 1.00 12.24 C ATOM 1329 CG LYS A 90 21.453 -76.426 -2.113 1.00 73.32 C ATOM 1330 CD LYS A 90 22.807 -76.490 -1.410 1.00 40.24 C ATOM 1331 CE LYS A 90 23.918 -76.993 -2.329 1.00 1.53 C ATOM 1332 NZ LYS A 90 24.178 -76.070 -3.471 1.00 60.33 N ATOM 0 H LYS A 90 20.260 -79.654 -4.079 1.00 72.24 H new ATOM 0 HA LYS A 90 18.987 -77.876 -2.279 1.00 63.21 H new ATOM 0 HB2 LYS A 90 21.301 -78.561 -2.038 1.00 12.24 H new ATOM 0 HB3 LYS A 90 21.711 -77.926 -3.620 1.00 12.24 H new ATOM 0 HG2 LYS A 90 21.479 -75.654 -2.882 1.00 73.32 H new ATOM 0 HG3 LYS A 90 20.685 -76.136 -1.396 1.00 73.32 H new ATOM 0 HD2 LYS A 90 23.068 -75.499 -1.039 1.00 40.24 H new ATOM 0 HD3 LYS A 90 22.732 -77.146 -0.543 1.00 40.24 H new ATOM 0 HE2 LYS A 90 24.834 -77.118 -1.751 1.00 1.53 H new ATOM 0 HE3 LYS A 90 23.648 -77.976 -2.715 1.00 1.53 H new ATOM 0 HZ1 LYS A 90 24.940 -76.457 -4.064 1.00 60.33 H new ATOM 0 HZ2 LYS A 90 23.313 -75.970 -4.040 1.00 60.33 H new ATOM 0 HZ3 LYS A 90 24.462 -75.138 -3.107 1.00 60.33 H new ATOM 1346 N TYR A 91 19.561 -76.765 -5.317 1.00 10.11 N ATOM 1347 CA TYR A 91 19.199 -75.748 -6.294 1.00 12.44 C ATOM 1348 C TYR A 91 17.689 -75.757 -6.538 1.00 44.40 C ATOM 1349 O TYR A 91 17.056 -74.704 -6.640 1.00 2.03 O ATOM 1350 CB TYR A 91 19.957 -76.002 -7.604 1.00 54.24 C ATOM 1351 CG TYR A 91 19.483 -75.158 -8.770 1.00 52.31 C ATOM 1352 CD1 TYR A 91 19.913 -73.845 -8.932 1.00 71.31 C ATOM 1353 CD2 TYR A 91 18.604 -75.680 -9.712 1.00 52.30 C ATOM 1354 CE1 TYR A 91 19.476 -73.080 -9.995 1.00 23.41 C ATOM 1355 CE2 TYR A 91 18.166 -74.922 -10.776 1.00 24.51 C ATOM 1356 CZ TYR A 91 18.605 -73.624 -10.916 1.00 4.44 C ATOM 1357 OH TYR A 91 18.171 -72.863 -11.979 1.00 53.33 O ATOM 0 H TYR A 91 20.122 -77.526 -5.700 1.00 10.11 H new ATOM 0 HA TYR A 91 19.475 -74.767 -5.908 1.00 12.44 H new ATOM 0 HB2 TYR A 91 21.018 -75.812 -7.440 1.00 54.24 H new ATOM 0 HB3 TYR A 91 19.859 -77.055 -7.869 1.00 54.24 H new ATOM 0 HD1 TYR A 91 20.599 -73.418 -8.216 1.00 71.31 H new ATOM 0 HD2 TYR A 91 18.258 -76.698 -9.608 1.00 52.30 H new ATOM 0 HE1 TYR A 91 19.815 -72.060 -10.105 1.00 23.41 H new ATOM 0 HE2 TYR A 91 17.481 -75.344 -11.497 1.00 24.51 H new ATOM 0 HH TYR A 91 17.345 -73.247 -12.340 1.00 53.33 H new ATOM 1367 N LEU A 92 17.120 -76.956 -6.616 1.00 51.34 N ATOM 1368 CA LEU A 92 15.693 -77.128 -6.886 1.00 60.14 C ATOM 1369 C LEU A 92 14.866 -76.518 -5.750 1.00 5.34 C ATOM 1370 O LEU A 92 13.825 -75.902 -5.984 1.00 21.55 O ATOM 1371 CB LEU A 92 15.358 -78.625 -7.050 1.00 42.10 C ATOM 1372 CG LEU A 92 14.302 -78.971 -8.120 1.00 14.12 C ATOM 1373 CD1 LEU A 92 12.947 -78.334 -7.807 1.00 1.11 C ATOM 1374 CD2 LEU A 92 14.791 -78.553 -9.506 1.00 4.50 C ATOM 0 H LEU A 92 17.629 -77.831 -6.495 1.00 51.34 H new ATOM 0 HA LEU A 92 15.445 -76.613 -7.814 1.00 60.14 H new ATOM 0 HB2 LEU A 92 16.278 -79.158 -7.291 1.00 42.10 H new ATOM 0 HB3 LEU A 92 15.011 -79.006 -6.090 1.00 42.10 H new ATOM 0 HG LEU A 92 14.162 -80.052 -8.110 1.00 14.12 H new ATOM 0 HD11 LEU A 92 12.231 -78.602 -8.584 1.00 1.11 H new ATOM 0 HD12 LEU A 92 12.589 -78.696 -6.843 1.00 1.11 H new ATOM 0 HD13 LEU A 92 13.054 -77.250 -7.770 1.00 1.11 H new ATOM 0 HD21 LEU A 92 14.035 -78.804 -10.250 1.00 4.50 H new ATOM 0 HD22 LEU A 92 14.971 -77.478 -9.520 1.00 4.50 H new ATOM 0 HD23 LEU A 92 15.717 -79.078 -9.739 1.00 4.50 H new ATOM 1386 N HIS A 93 15.349 -76.686 -4.518 1.00 5.42 N ATOM 1387 CA HIS A 93 14.656 -76.170 -3.330 1.00 23.34 C ATOM 1388 C HIS A 93 14.597 -74.639 -3.327 1.00 11.23 C ATOM 1389 O HIS A 93 13.883 -74.043 -2.515 1.00 14.15 O ATOM 1390 CB HIS A 93 15.330 -76.679 -2.044 1.00 35.40 C ATOM 1391 CG HIS A 93 15.025 -78.115 -1.728 1.00 30.45 C ATOM 1392 ND1 HIS A 93 15.181 -78.654 -0.471 1.00 2.31 N ATOM 1393 CD2 HIS A 93 14.561 -79.122 -2.508 1.00 73.34 C ATOM 1394 CE1 HIS A 93 14.825 -79.925 -0.491 1.00 65.23 C ATOM 1395 NE2 HIS A 93 14.443 -80.237 -1.714 1.00 2.30 N ATOM 0 H HIS A 93 16.220 -77.176 -4.314 1.00 5.42 H new ATOM 0 HA HIS A 93 13.632 -76.543 -3.364 1.00 23.34 H new ATOM 0 HB2 HIS A 93 16.409 -76.559 -2.138 1.00 35.40 H new ATOM 0 HB3 HIS A 93 15.012 -76.057 -1.207 1.00 35.40 H new ATOM 0 HD2 HIS A 93 14.327 -79.059 -3.560 1.00 73.34 H new ATOM 0 HE1 HIS A 93 14.844 -80.598 0.354 1.00 65.23 H new ATOM 0 HE2 HIS A 93 14.115 -81.153 -2.019 1.00 2.30 H new ATOM 1404 N LYS A 94 15.349 -74.009 -4.231 1.00 64.43 N ATOM 1405 CA LYS A 94 15.339 -72.550 -4.366 1.00 13.01 C ATOM 1406 C LYS A 94 14.165 -72.101 -5.236 1.00 4.10 C ATOM 1407 O LYS A 94 13.755 -70.939 -5.194 1.00 53.20 O ATOM 1408 CB LYS A 94 16.666 -72.053 -4.966 1.00 13.44 C ATOM 1409 CG LYS A 94 17.900 -72.436 -4.148 1.00 34.11 C ATOM 1410 CD LYS A 94 17.908 -71.796 -2.756 1.00 31.12 C ATOM 1411 CE LYS A 94 18.279 -70.311 -2.784 1.00 75.41 C ATOM 1412 NZ LYS A 94 17.243 -69.460 -3.434 1.00 1.31 N ATOM 0 H LYS A 94 15.973 -74.486 -4.881 1.00 64.43 H new ATOM 0 HA LYS A 94 15.223 -72.116 -3.373 1.00 13.01 H new ATOM 0 HB2 LYS A 94 16.771 -72.456 -5.973 1.00 13.44 H new ATOM 0 HB3 LYS A 94 16.627 -70.968 -5.059 1.00 13.44 H new ATOM 0 HG2 LYS A 94 17.941 -73.520 -4.045 1.00 34.11 H new ATOM 0 HG3 LYS A 94 18.797 -72.133 -4.688 1.00 34.11 H new ATOM 0 HD2 LYS A 94 16.923 -71.911 -2.304 1.00 31.12 H new ATOM 0 HD3 LYS A 94 18.615 -72.330 -2.121 1.00 31.12 H new ATOM 0 HE2 LYS A 94 18.438 -69.963 -1.763 1.00 75.41 H new ATOM 0 HE3 LYS A 94 19.224 -70.189 -3.313 1.00 75.41 H new ATOM 0 HZ1 LYS A 94 17.223 -68.526 -2.976 1.00 1.31 H new ATOM 0 HZ2 LYS A 94 17.470 -69.346 -4.443 1.00 1.31 H new ATOM 0 HZ3 LYS A 94 16.312 -69.912 -3.338 1.00 1.31 H new ATOM 1426 N GLY A 95 13.629 -73.032 -6.023 1.00 31.54 N ATOM 1427 CA GLY A 95 12.500 -72.734 -6.887 1.00 21.24 C ATOM 1428 C GLY A 95 12.880 -71.851 -8.063 1.00 10.52 C ATOM 1429 O GLY A 95 14.066 -71.644 -8.341 1.00 3.03 O ATOM 0 H GLY A 95 13.961 -73.995 -6.077 1.00 31.54 H new ATOM 0 HA2 GLY A 95 12.077 -73.667 -7.260 1.00 21.24 H new ATOM 0 HA3 GLY A 95 11.722 -72.241 -6.304 1.00 21.24 H new ATOM 1433 N SER A 96 11.874 -71.335 -8.763 1.00 75.45 N ATOM 1434 CA SER A 96 12.098 -70.452 -9.905 1.00 64.44 C ATOM 1435 C SER A 96 11.828 -68.998 -9.503 1.00 73.22 C ATOM 1436 O SER A 96 10.926 -68.737 -8.708 1.00 41.20 O ATOM 1437 CB SER A 96 11.194 -70.862 -11.073 1.00 73.31 C ATOM 1438 OG SER A 96 11.345 -72.239 -11.374 1.00 75.44 O ATOM 0 H SER A 96 10.891 -71.514 -8.559 1.00 75.45 H new ATOM 0 HA SER A 96 13.137 -70.539 -10.224 1.00 64.44 H new ATOM 0 HB2 SER A 96 10.154 -70.653 -10.823 1.00 73.31 H new ATOM 0 HB3 SER A 96 11.437 -70.265 -11.952 1.00 73.31 H new ATOM 0 HG SER A 96 12.205 -72.557 -11.027 1.00 75.44 H new ATOM 1444 N PRO A 97 12.596 -68.038 -10.069 1.00 15.32 N ATOM 1445 CA PRO A 97 12.530 -66.614 -9.689 1.00 63.34 C ATOM 1446 C PRO A 97 11.104 -66.072 -9.519 1.00 3.15 C ATOM 1447 O PRO A 97 10.802 -65.402 -8.530 1.00 13.01 O ATOM 1448 CB PRO A 97 13.232 -65.916 -10.860 1.00 53.52 C ATOM 1449 CG PRO A 97 14.236 -66.912 -11.336 1.00 13.42 C ATOM 1450 CD PRO A 97 13.608 -68.270 -11.125 1.00 51.42 C ATOM 0 HA PRO A 97 12.987 -66.446 -8.714 1.00 63.34 H new ATOM 0 HB2 PRO A 97 12.526 -65.655 -11.648 1.00 53.52 H new ATOM 0 HB3 PRO A 97 13.711 -64.990 -10.542 1.00 53.52 H new ATOM 0 HG2 PRO A 97 14.476 -66.752 -12.387 1.00 13.42 H new ATOM 0 HG3 PRO A 97 15.169 -66.823 -10.779 1.00 13.42 H new ATOM 0 HD2 PRO A 97 13.150 -68.644 -12.041 1.00 51.42 H new ATOM 0 HD3 PRO A 97 14.348 -69.008 -10.814 1.00 51.42 H new ATOM 1458 N LYS A 98 10.232 -66.366 -10.482 1.00 53.54 N ATOM 1459 CA LYS A 98 8.872 -65.810 -10.492 1.00 24.34 C ATOM 1460 C LYS A 98 7.821 -66.869 -10.162 1.00 74.31 C ATOM 1461 O LYS A 98 6.617 -66.619 -10.294 1.00 21.32 O ATOM 1462 CB LYS A 98 8.563 -65.200 -11.869 1.00 51.22 C ATOM 1463 CG LYS A 98 8.670 -66.193 -13.026 1.00 43.41 C ATOM 1464 CD LYS A 98 8.105 -65.623 -14.329 1.00 31.02 C ATOM 1465 CE LYS A 98 8.813 -64.342 -14.757 1.00 2.21 C ATOM 1466 NZ LYS A 98 8.265 -63.809 -16.030 1.00 75.23 N ATOM 0 H LYS A 98 10.439 -66.985 -11.266 1.00 53.54 H new ATOM 0 HA LYS A 98 8.830 -65.039 -9.723 1.00 24.34 H new ATOM 0 HB2 LYS A 98 7.556 -64.784 -11.853 1.00 51.22 H new ATOM 0 HB3 LYS A 98 9.248 -64.371 -12.050 1.00 51.22 H new ATOM 0 HG2 LYS A 98 9.715 -66.466 -13.173 1.00 43.41 H new ATOM 0 HG3 LYS A 98 8.135 -67.107 -12.769 1.00 43.41 H new ATOM 0 HD2 LYS A 98 8.198 -66.368 -15.119 1.00 31.02 H new ATOM 0 HD3 LYS A 98 7.041 -65.423 -14.204 1.00 31.02 H new ATOM 0 HE2 LYS A 98 8.710 -63.591 -13.974 1.00 2.21 H new ATOM 0 HE3 LYS A 98 9.879 -64.537 -14.873 1.00 2.21 H new ATOM 0 HZ1 LYS A 98 8.771 -62.938 -16.288 1.00 75.23 H new ATOM 0 HZ2 LYS A 98 8.386 -64.516 -16.783 1.00 75.23 H new ATOM 0 HZ3 LYS A 98 7.253 -63.599 -15.911 1.00 75.23 H new ATOM 1480 N SER A 99 8.264 -68.037 -9.716 1.00 22.33 N ATOM 1481 CA SER A 99 7.362 -69.166 -9.508 1.00 33.13 C ATOM 1482 C SER A 99 7.300 -69.551 -8.031 1.00 51.15 C ATOM 1483 O SER A 99 8.274 -69.390 -7.290 1.00 65.20 O ATOM 1484 CB SER A 99 7.816 -70.363 -10.354 1.00 24.15 C ATOM 1485 OG SER A 99 6.884 -71.426 -10.302 1.00 42.35 O ATOM 0 H SER A 99 9.240 -68.229 -9.491 1.00 22.33 H new ATOM 0 HA SER A 99 6.361 -68.869 -9.821 1.00 33.13 H new ATOM 0 HB2 SER A 99 7.950 -70.047 -11.389 1.00 24.15 H new ATOM 0 HB3 SER A 99 8.786 -70.712 -9.999 1.00 24.15 H new ATOM 0 HG SER A 99 7.205 -72.170 -10.853 1.00 42.35 H new ATOM 1491 N VAL A 100 6.142 -70.049 -7.612 1.00 74.22 N ATOM 1492 CA VAL A 100 5.940 -70.508 -6.242 1.00 45.42 C ATOM 1493 C VAL A 100 5.856 -72.031 -6.217 1.00 51.00 C ATOM 1494 O VAL A 100 4.887 -72.616 -6.712 1.00 74.34 O ATOM 1495 CB VAL A 100 4.647 -69.916 -5.626 1.00 21.34 C ATOM 1496 CG1 VAL A 100 4.479 -70.361 -4.171 1.00 13.01 C ATOM 1497 CG2 VAL A 100 4.643 -68.392 -5.739 1.00 20.43 C ATOM 0 H VAL A 100 5.320 -70.146 -8.209 1.00 74.22 H new ATOM 0 HA VAL A 100 6.788 -70.167 -5.649 1.00 45.42 H new ATOM 0 HB VAL A 100 3.796 -70.298 -6.190 1.00 21.34 H new ATOM 0 HG11 VAL A 100 3.564 -69.932 -3.763 1.00 13.01 H new ATOM 0 HG12 VAL A 100 4.420 -71.449 -4.128 1.00 13.01 H new ATOM 0 HG13 VAL A 100 5.333 -70.020 -3.585 1.00 13.01 H new ATOM 0 HG21 VAL A 100 3.727 -67.997 -5.301 1.00 20.43 H new ATOM 0 HG22 VAL A 100 5.504 -67.986 -5.208 1.00 20.43 H new ATOM 0 HG23 VAL A 100 4.696 -68.105 -6.789 1.00 20.43 H new ATOM 1507 N VAL A 101 6.882 -72.667 -5.664 1.00 73.33 N ATOM 1508 CA VAL A 101 6.914 -74.119 -5.554 1.00 33.12 C ATOM 1509 C VAL A 101 6.098 -74.581 -4.343 1.00 14.21 C ATOM 1510 O VAL A 101 6.459 -74.323 -3.190 1.00 71.23 O ATOM 1511 CB VAL A 101 8.368 -74.664 -5.470 1.00 1.53 C ATOM 1512 CG1 VAL A 101 9.101 -74.425 -6.789 1.00 0.11 C ATOM 1513 CG2 VAL A 101 9.139 -74.036 -4.305 1.00 23.20 C ATOM 0 H VAL A 101 7.704 -72.198 -5.284 1.00 73.33 H new ATOM 0 HA VAL A 101 6.466 -74.525 -6.461 1.00 33.12 H new ATOM 0 HB VAL A 101 8.312 -75.737 -5.287 1.00 1.53 H new ATOM 0 HG11 VAL A 101 10.118 -74.812 -6.716 1.00 0.11 H new ATOM 0 HG12 VAL A 101 8.575 -74.937 -7.595 1.00 0.11 H new ATOM 0 HG13 VAL A 101 9.134 -73.356 -6.999 1.00 0.11 H new ATOM 0 HG21 VAL A 101 10.151 -74.441 -4.278 1.00 23.20 H new ATOM 0 HG22 VAL A 101 9.184 -72.955 -4.439 1.00 23.20 H new ATOM 0 HG23 VAL A 101 8.632 -74.264 -3.368 1.00 23.20 H new ATOM 1523 N LYS A 102 4.979 -75.240 -4.618 1.00 25.24 N ATOM 1524 CA LYS A 102 4.085 -75.710 -3.568 1.00 22.23 C ATOM 1525 C LYS A 102 4.707 -76.915 -2.865 1.00 52.51 C ATOM 1526 O LYS A 102 4.875 -76.924 -1.642 1.00 64.20 O ATOM 1527 CB LYS A 102 2.718 -76.087 -4.161 1.00 14.41 C ATOM 1528 CG LYS A 102 1.624 -76.306 -3.119 1.00 2.24 C ATOM 1529 CD LYS A 102 1.232 -74.996 -2.437 1.00 35.55 C ATOM 1530 CE LYS A 102 0.145 -75.204 -1.388 1.00 34.44 C ATOM 1531 NZ LYS A 102 0.629 -75.993 -0.228 1.00 11.03 N ATOM 0 H LYS A 102 4.668 -75.462 -5.564 1.00 25.24 H new ATOM 0 HA LYS A 102 3.937 -74.911 -2.842 1.00 22.23 H new ATOM 0 HB2 LYS A 102 2.401 -75.299 -4.844 1.00 14.41 H new ATOM 0 HB3 LYS A 102 2.829 -76.996 -4.752 1.00 14.41 H new ATOM 0 HG2 LYS A 102 0.748 -76.746 -3.596 1.00 2.24 H new ATOM 0 HG3 LYS A 102 1.970 -77.018 -2.370 1.00 2.24 H new ATOM 0 HD2 LYS A 102 2.111 -74.555 -1.967 1.00 35.55 H new ATOM 0 HD3 LYS A 102 0.882 -74.287 -3.187 1.00 35.55 H new ATOM 0 HE2 LYS A 102 -0.214 -74.235 -1.042 1.00 34.44 H new ATOM 0 HE3 LYS A 102 -0.704 -75.714 -1.843 1.00 34.44 H new ATOM 0 HZ1 LYS A 102 -0.096 -75.995 0.517 1.00 11.03 H new ATOM 0 HZ2 LYS A 102 0.820 -76.970 -0.528 1.00 11.03 H new ATOM 0 HZ3 LYS A 102 1.503 -75.567 0.141 1.00 11.03 H new ATOM 1545 N LYS A 103 5.057 -77.925 -3.655 1.00 12.03 N ATOM 1546 CA LYS A 103 5.698 -79.133 -3.145 1.00 72.44 C ATOM 1547 C LYS A 103 6.881 -79.521 -4.025 1.00 14.24 C ATOM 1548 O LYS A 103 6.729 -79.670 -5.234 1.00 53.50 O ATOM 1549 CB LYS A 103 4.708 -80.309 -3.111 1.00 61.22 C ATOM 1550 CG LYS A 103 3.566 -80.156 -2.114 1.00 3.35 C ATOM 1551 CD LYS A 103 2.637 -81.374 -2.114 1.00 22.31 C ATOM 1552 CE LYS A 103 3.307 -82.636 -1.553 1.00 15.43 C ATOM 1553 NZ LYS A 103 4.412 -83.146 -2.415 1.00 35.52 N ATOM 0 H LYS A 103 4.905 -77.930 -4.664 1.00 12.03 H new ATOM 0 HA LYS A 103 6.042 -78.919 -2.133 1.00 72.44 H new ATOM 0 HB2 LYS A 103 4.286 -80.439 -4.108 1.00 61.22 H new ATOM 0 HB3 LYS A 103 5.257 -81.221 -2.876 1.00 61.22 H new ATOM 0 HG2 LYS A 103 3.975 -80.012 -1.114 1.00 3.35 H new ATOM 0 HG3 LYS A 103 2.991 -79.262 -2.355 1.00 3.35 H new ATOM 0 HD2 LYS A 103 1.749 -81.147 -1.524 1.00 22.31 H new ATOM 0 HD3 LYS A 103 2.302 -81.569 -3.133 1.00 22.31 H new ATOM 0 HE2 LYS A 103 3.700 -82.420 -0.559 1.00 15.43 H new ATOM 0 HE3 LYS A 103 2.556 -83.417 -1.436 1.00 15.43 H new ATOM 0 HZ1 LYS A 103 4.461 -84.182 -2.340 1.00 35.52 H new ATOM 0 HZ2 LYS A 103 4.232 -82.879 -3.404 1.00 35.52 H new ATOM 0 HZ3 LYS A 103 5.314 -82.733 -2.103 1.00 35.52 H new ATOM 1567 N VAL A 104 8.053 -79.664 -3.417 1.00 20.25 N ATOM 1568 CA VAL A 104 9.211 -80.235 -4.096 1.00 63.52 C ATOM 1569 C VAL A 104 9.434 -81.652 -3.567 1.00 23.40 C ATOM 1570 O VAL A 104 9.833 -81.847 -2.416 1.00 41.12 O ATOM 1571 CB VAL A 104 10.489 -79.362 -3.919 1.00 12.25 C ATOM 1572 CG1 VAL A 104 10.770 -79.072 -2.446 1.00 24.45 C ATOM 1573 CG2 VAL A 104 11.698 -80.024 -4.586 1.00 13.11 C ATOM 0 H VAL A 104 8.227 -79.391 -2.450 1.00 20.25 H new ATOM 0 HA VAL A 104 9.011 -80.264 -5.167 1.00 63.52 H new ATOM 0 HB VAL A 104 10.307 -78.407 -4.413 1.00 12.25 H new ATOM 0 HG11 VAL A 104 11.669 -78.461 -2.360 1.00 24.45 H new ATOM 0 HG12 VAL A 104 9.925 -78.537 -2.013 1.00 24.45 H new ATOM 0 HG13 VAL A 104 10.918 -80.011 -1.912 1.00 24.45 H new ATOM 0 HG21 VAL A 104 12.578 -79.396 -4.449 1.00 13.11 H new ATOM 0 HG22 VAL A 104 11.874 -81.000 -4.133 1.00 13.11 H new ATOM 0 HG23 VAL A 104 11.503 -80.148 -5.651 1.00 13.11 H new ATOM 1583 N SER A 105 9.153 -82.639 -4.405 1.00 70.15 N ATOM 1584 CA SER A 105 9.101 -84.024 -3.974 1.00 14.10 C ATOM 1585 C SER A 105 10.086 -84.859 -4.776 1.00 74.04 C ATOM 1586 O SER A 105 10.136 -84.769 -6.007 1.00 24.02 O ATOM 1587 CB SER A 105 7.675 -84.561 -4.137 1.00 4.52 C ATOM 1588 OG SER A 105 6.749 -83.749 -3.428 1.00 72.03 O ATOM 0 H SER A 105 8.956 -82.502 -5.396 1.00 70.15 H new ATOM 0 HA SER A 105 9.380 -84.086 -2.922 1.00 14.10 H new ATOM 0 HB2 SER A 105 7.409 -84.587 -5.194 1.00 4.52 H new ATOM 0 HB3 SER A 105 7.623 -85.586 -3.770 1.00 4.52 H new ATOM 0 HG SER A 105 6.425 -83.034 -4.015 1.00 72.03 H new ATOM 1594 N ILE A 106 10.884 -85.646 -4.074 1.00 60.24 N ATOM 1595 CA ILE A 106 11.887 -86.485 -4.707 1.00 10.30 C ATOM 1596 C ILE A 106 11.522 -87.953 -4.495 1.00 61.14 C ATOM 1597 O ILE A 106 10.866 -88.290 -3.505 1.00 52.41 O ATOM 1598 CB ILE A 106 13.304 -86.207 -4.137 1.00 72.12 C ATOM 1599 CG1 ILE A 106 13.476 -84.717 -3.781 1.00 61.14 C ATOM 1600 CG2 ILE A 106 14.360 -86.622 -5.154 1.00 61.45 C ATOM 1601 CD1 ILE A 106 13.400 -83.776 -4.967 1.00 61.02 C ATOM 0 H ILE A 106 10.856 -85.721 -3.057 1.00 60.24 H new ATOM 0 HA ILE A 106 11.906 -86.254 -5.772 1.00 10.30 H new ATOM 0 HB ILE A 106 13.427 -86.791 -3.225 1.00 72.12 H new ATOM 0 HG12 ILE A 106 12.707 -84.437 -3.061 1.00 61.14 H new ATOM 0 HG13 ILE A 106 14.439 -84.583 -3.288 1.00 61.14 H new ATOM 0 HG21 ILE A 106 15.353 -86.425 -4.749 1.00 61.45 H new ATOM 0 HG22 ILE A 106 14.260 -87.686 -5.368 1.00 61.45 H new ATOM 0 HG23 ILE A 106 14.224 -86.052 -6.073 1.00 61.45 H new ATOM 0 HD11 ILE A 106 13.531 -82.749 -4.626 1.00 61.02 H new ATOM 0 HD12 ILE A 106 14.186 -84.025 -5.680 1.00 61.02 H new ATOM 0 HD13 ILE A 106 12.428 -83.877 -5.450 1.00 61.02 H new ATOM 1613 N HIS A 107 11.939 -88.823 -5.409 1.00 62.33 N ATOM 1614 CA HIS A 107 11.551 -90.230 -5.360 1.00 42.21 C ATOM 1615 C HIS A 107 12.772 -91.138 -5.539 1.00 3.14 C ATOM 1616 O HIS A 107 13.706 -90.811 -6.273 1.00 44.31 O ATOM 1617 CB HIS A 107 10.483 -90.521 -6.428 1.00 1.15 C ATOM 1618 CG HIS A 107 9.764 -91.824 -6.241 1.00 52.33 C ATOM 1619 ND1 HIS A 107 10.079 -93.081 -6.634 1.00 63.51 N flip ATOM 1620 CD2 HIS A 107 8.556 -91.925 -5.588 1.00 51.43 C flip ATOM 1621 CE1 HIS A 107 9.066 -93.902 -6.214 1.00 61.40 C flip ATOM 1622 NE2 HIS A 107 8.161 -93.181 -5.587 1.00 21.31 N flip ATOM 0 H HIS A 107 12.545 -88.580 -6.192 1.00 62.33 H new ATOM 0 HA HIS A 107 11.124 -90.441 -4.380 1.00 42.21 H new ATOM 0 HB2 HIS A 107 9.752 -89.712 -6.425 1.00 1.15 H new ATOM 0 HB3 HIS A 107 10.957 -90.518 -7.410 1.00 1.15 H new ATOM 0 HD2 HIS A 107 8.016 -91.101 -5.145 1.00 51.43 H new ATOM 0 HE1 HIS A 107 9.018 -94.969 -6.372 1.00 61.40 H new ATOM 0 HE2 HIS A 107 7.300 -93.535 -5.171 1.00 21.31 H new ATOM 1631 N ALA A 108 12.714 -92.290 -4.878 1.00 62.21 N ATOM 1632 CA ALA A 108 13.829 -93.235 -4.746 1.00 71.54 C ATOM 1633 C ALA A 108 14.222 -93.954 -6.046 1.00 51.20 C ATOM 1634 O ALA A 108 15.040 -94.877 -6.007 1.00 13.21 O ATOM 1635 CB ALA A 108 13.525 -94.250 -3.654 1.00 1.01 C ATOM 0 H ALA A 108 11.868 -92.605 -4.404 1.00 62.21 H new ATOM 0 HA ALA A 108 14.695 -92.631 -4.477 1.00 71.54 H new ATOM 0 HB1 ALA A 108 14.358 -94.947 -3.563 1.00 1.01 H new ATOM 0 HB2 ALA A 108 13.380 -93.732 -2.706 1.00 1.01 H new ATOM 0 HB3 ALA A 108 12.619 -94.799 -3.910 1.00 1.01 H new ATOM 1641 N SER A 109 13.633 -93.577 -7.177 1.00 22.12 N ATOM 1642 CA SER A 109 13.776 -94.356 -8.407 1.00 13.31 C ATOM 1643 C SER A 109 15.249 -94.472 -8.825 1.00 70.35 C ATOM 1644 O SER A 109 15.970 -93.477 -8.903 1.00 20.01 O ATOM 1645 CB SER A 109 12.986 -93.675 -9.524 1.00 75.32 C ATOM 1646 OG SER A 109 11.630 -93.492 -9.149 1.00 74.32 O ATOM 0 H SER A 109 13.055 -92.742 -7.269 1.00 22.12 H new ATOM 0 HA SER A 109 13.393 -95.360 -8.226 1.00 13.31 H new ATOM 0 HB2 SER A 109 13.436 -92.710 -9.756 1.00 75.32 H new ATOM 0 HB3 SER A 109 13.038 -94.278 -10.431 1.00 75.32 H new ATOM 0 HG SER A 109 11.530 -93.663 -8.189 1.00 74.32 H new ATOM 1652 N SER A 110 15.665 -95.710 -9.100 1.00 53.15 N ATOM 1653 CA SER A 110 17.057 -96.050 -9.375 1.00 44.34 C ATOM 1654 C SER A 110 17.467 -95.676 -10.805 1.00 21.33 C ATOM 1655 O SER A 110 16.645 -95.192 -11.589 1.00 40.12 O ATOM 1656 CB SER A 110 17.267 -97.548 -9.120 1.00 20.12 C ATOM 1657 OG SER A 110 16.231 -98.318 -9.716 1.00 61.20 O ATOM 0 H SER A 110 15.035 -96.512 -9.138 1.00 53.15 H new ATOM 0 HA SER A 110 17.694 -95.471 -8.706 1.00 44.34 H new ATOM 0 HB2 SER A 110 18.232 -97.857 -9.522 1.00 20.12 H new ATOM 0 HB3 SER A 110 17.294 -97.737 -8.047 1.00 20.12 H new ATOM 0 HG SER A 110 16.388 -99.269 -9.541 1.00 61.20 H new ATOM 1663 N ARG A 111 18.742 -95.925 -11.129 1.00 10.21 N ATOM 1664 CA ARG A 111 19.351 -95.491 -12.391 1.00 70.34 C ATOM 1665 C ARG A 111 18.492 -95.825 -13.618 1.00 33.55 C ATOM 1666 O ARG A 111 17.908 -96.910 -13.717 1.00 43.23 O ATOM 1667 CB ARG A 111 20.750 -96.106 -12.547 1.00 25.13 C ATOM 1668 CG ARG A 111 21.478 -95.642 -13.806 1.00 15.51 C ATOM 1669 CD ARG A 111 22.886 -96.220 -13.912 1.00 32.52 C ATOM 1670 NE ARG A 111 23.558 -95.771 -15.135 1.00 21.10 N ATOM 1671 CZ ARG A 111 24.880 -95.678 -15.278 1.00 63.31 C ATOM 1672 NH1 ARG A 111 25.689 -95.995 -14.277 1.00 42.52 N ATOM 1673 NH2 ARG A 111 25.393 -95.258 -16.423 1.00 12.12 N ATOM 0 H ARG A 111 19.382 -96.435 -10.520 1.00 10.21 H new ATOM 0 HA ARG A 111 19.427 -94.405 -12.342 1.00 70.34 H new ATOM 0 HB2 ARG A 111 21.351 -95.851 -11.674 1.00 25.13 H new ATOM 0 HB3 ARG A 111 20.661 -97.192 -12.567 1.00 25.13 H new ATOM 0 HG2 ARG A 111 20.902 -95.934 -14.684 1.00 15.51 H new ATOM 0 HG3 ARG A 111 21.534 -94.553 -13.809 1.00 15.51 H new ATOM 0 HD2 ARG A 111 23.471 -95.919 -13.043 1.00 32.52 H new ATOM 0 HD3 ARG A 111 22.836 -97.309 -13.901 1.00 32.52 H new ATOM 0 HE ARG A 111 22.974 -95.512 -15.931 1.00 21.10 H new ATOM 0 HH11 ARG A 111 25.301 -96.313 -13.389 1.00 42.52 H new ATOM 0 HH12 ARG A 111 26.699 -95.921 -14.395 1.00 42.52 H new ATOM 0 HH21 ARG A 111 24.777 -95.006 -17.196 1.00 12.12 H new ATOM 0 HH22 ARG A 111 26.405 -95.187 -16.533 1.00 12.12 H new ATOM 1687 N VAL A 112 18.442 -94.871 -14.548 1.00 42.33 N ATOM 1688 CA VAL A 112 17.670 -94.982 -15.785 1.00 22.53 C ATOM 1689 C VAL A 112 18.494 -94.450 -16.956 1.00 21.24 C ATOM 1690 O VAL A 112 19.626 -93.994 -16.769 1.00 51.15 O ATOM 1691 CB VAL A 112 16.344 -94.184 -15.709 1.00 42.34 C ATOM 1692 CG1 VAL A 112 15.417 -94.747 -14.633 1.00 12.25 C ATOM 1693 CG2 VAL A 112 16.633 -92.703 -15.467 1.00 12.43 C ATOM 0 H VAL A 112 18.944 -93.987 -14.462 1.00 42.33 H new ATOM 0 HA VAL A 112 17.433 -96.036 -15.929 1.00 22.53 H new ATOM 0 HB VAL A 112 15.829 -94.285 -16.665 1.00 42.34 H new ATOM 0 HG11 VAL A 112 14.496 -94.165 -14.605 1.00 12.25 H new ATOM 0 HG12 VAL A 112 15.183 -95.787 -14.862 1.00 12.25 H new ATOM 0 HG13 VAL A 112 15.910 -94.692 -13.663 1.00 12.25 H new ATOM 0 HG21 VAL A 112 15.694 -92.153 -15.416 1.00 12.43 H new ATOM 0 HG22 VAL A 112 17.174 -92.587 -14.528 1.00 12.43 H new ATOM 0 HG23 VAL A 112 17.238 -92.312 -16.285 1.00 12.43 H new ATOM 1703 N ASP A 113 17.952 -94.552 -18.163 1.00 71.41 N ATOM 1704 CA ASP A 113 18.563 -93.927 -19.337 1.00 61.45 C ATOM 1705 C ASP A 113 18.107 -92.469 -19.446 1.00 54.52 C ATOM 1706 O ASP A 113 16.941 -92.152 -19.197 1.00 71.24 O ATOM 1707 CB ASP A 113 18.209 -94.697 -20.620 1.00 13.55 C ATOM 1708 CG ASP A 113 16.712 -94.789 -20.868 1.00 74.32 C ATOM 1709 OD1 ASP A 113 16.052 -95.632 -20.224 1.00 52.52 O ATOM 1710 OD2 ASP A 113 16.182 -94.022 -21.703 1.00 41.05 O ATOM 0 H ASP A 113 17.090 -95.061 -18.358 1.00 71.41 H new ATOM 0 HA ASP A 113 19.646 -93.955 -19.218 1.00 61.45 H new ATOM 0 HB2 ASP A 113 18.683 -94.209 -21.472 1.00 13.55 H new ATOM 0 HB3 ASP A 113 18.623 -95.703 -20.558 1.00 13.55 H new ATOM 1715 N ALA A 114 19.037 -91.587 -19.800 1.00 61.52 N ATOM 1716 CA ALA A 114 18.763 -90.153 -19.906 1.00 14.04 C ATOM 1717 C ALA A 114 18.032 -89.814 -21.207 1.00 42.21 C ATOM 1718 O ALA A 114 18.076 -90.578 -22.175 1.00 32.43 O ATOM 1719 CB ALA A 114 20.063 -89.361 -19.802 1.00 51.25 C ATOM 0 H ALA A 114 19.999 -91.842 -20.021 1.00 61.52 H new ATOM 0 HA ALA A 114 18.109 -89.875 -19.080 1.00 14.04 H new ATOM 0 HB1 ALA A 114 19.847 -88.296 -19.882 1.00 51.25 H new ATOM 0 HB2 ALA A 114 20.537 -89.564 -18.842 1.00 51.25 H new ATOM 0 HB3 ALA A 114 20.735 -89.657 -20.608 1.00 51.25 H new ATOM 1725 N ASP A 115 17.370 -88.657 -21.226 1.00 54.31 N ATOM 1726 CA ASP A 115 16.614 -88.206 -22.397 1.00 31.20 C ATOM 1727 C ASP A 115 16.824 -86.712 -22.646 1.00 74.33 C ATOM 1728 O ASP A 115 17.065 -86.293 -23.781 1.00 33.11 O ATOM 1729 CB ASP A 115 15.119 -88.507 -22.225 1.00 63.02 C ATOM 1730 CG ASP A 115 14.281 -88.014 -23.398 1.00 34.15 C ATOM 1731 OD1 ASP A 115 14.441 -88.548 -24.516 1.00 60.54 O ATOM 1732 OD2 ASP A 115 13.456 -87.096 -23.209 1.00 71.54 O ATOM 0 H ASP A 115 17.342 -88.010 -20.438 1.00 54.31 H new ATOM 0 HA ASP A 115 16.985 -88.753 -23.263 1.00 31.20 H new ATOM 0 HB2 ASP A 115 14.980 -89.582 -22.111 1.00 63.02 H new ATOM 0 HB3 ASP A 115 14.762 -88.040 -21.307 1.00 63.02 H new ATOM 1737 N GLY A 116 16.742 -85.909 -21.586 1.00 25.12 N ATOM 1738 CA GLY A 116 16.955 -84.473 -21.718 1.00 51.02 C ATOM 1739 C GLY A 116 16.154 -83.661 -20.713 1.00 52.42 C ATOM 1740 O GLY A 116 14.996 -83.976 -20.428 1.00 24.24 O ATOM 0 H GLY A 116 16.532 -86.225 -20.639 1.00 25.12 H new ATOM 0 HA2 GLY A 116 18.015 -84.255 -21.591 1.00 51.02 H new ATOM 0 HA3 GLY A 116 16.684 -84.162 -22.727 1.00 51.02 H new ATOM 1744 N PHE A 117 16.773 -82.622 -20.164 1.00 5.24 N ATOM 1745 CA PHE A 117 16.096 -81.725 -19.233 1.00 2.31 C ATOM 1746 C PHE A 117 15.471 -80.562 -19.994 1.00 32.41 C ATOM 1747 O PHE A 117 16.197 -79.722 -20.535 1.00 0.02 O ATOM 1748 CB PHE A 117 17.092 -81.161 -18.203 1.00 64.33 C ATOM 1749 CG PHE A 117 17.755 -82.195 -17.328 1.00 64.31 C ATOM 1750 CD1 PHE A 117 18.819 -82.950 -17.801 1.00 52.42 C ATOM 1751 CD2 PHE A 117 17.322 -82.404 -16.027 1.00 54.12 C ATOM 1752 CE1 PHE A 117 19.431 -83.889 -16.996 1.00 24.34 C ATOM 1753 CE2 PHE A 117 17.934 -83.341 -15.218 1.00 3.23 C ATOM 1754 CZ PHE A 117 18.989 -84.084 -15.703 1.00 43.44 C ATOM 0 H PHE A 117 17.746 -82.379 -20.348 1.00 5.24 H new ATOM 0 HA PHE A 117 15.323 -82.293 -18.716 1.00 2.31 H new ATOM 0 HB2 PHE A 117 17.865 -80.606 -18.734 1.00 64.33 H new ATOM 0 HB3 PHE A 117 16.568 -80.449 -17.565 1.00 64.33 H new ATOM 0 HD1 PHE A 117 19.172 -82.801 -18.811 1.00 52.42 H new ATOM 0 HD2 PHE A 117 16.495 -81.826 -15.641 1.00 54.12 H new ATOM 0 HE1 PHE A 117 20.256 -84.472 -17.378 1.00 24.34 H new ATOM 0 HE2 PHE A 117 17.587 -83.492 -14.207 1.00 3.23 H new ATOM 0 HZ PHE A 117 19.469 -84.818 -15.072 1.00 43.44 H new ATOM 1764 N GLU A 118 14.140 -80.495 -20.039 1.00 33.04 N ATOM 1765 CA GLU A 118 13.475 -79.350 -20.653 1.00 23.02 C ATOM 1766 C GLU A 118 12.013 -79.268 -20.228 1.00 63.02 C ATOM 1767 O GLU A 118 11.306 -80.273 -20.196 1.00 13.12 O ATOM 1768 CB GLU A 118 13.590 -79.405 -22.185 1.00 70.42 C ATOM 1769 CG GLU A 118 12.899 -80.596 -22.837 1.00 51.04 C ATOM 1770 CD GLU A 118 12.769 -80.438 -24.344 1.00 53.34 C ATOM 1771 OE1 GLU A 118 12.618 -79.284 -24.811 1.00 62.15 O ATOM 1772 OE2 GLU A 118 12.802 -81.462 -25.068 1.00 71.34 O ATOM 0 H GLU A 118 13.513 -81.207 -19.665 1.00 33.04 H new ATOM 0 HA GLU A 118 13.979 -78.449 -20.304 1.00 23.02 H new ATOM 0 HB2 GLU A 118 13.171 -78.488 -22.600 1.00 70.42 H new ATOM 0 HB3 GLU A 118 14.646 -79.423 -22.455 1.00 70.42 H new ATOM 0 HG2 GLU A 118 13.461 -81.504 -22.617 1.00 51.04 H new ATOM 0 HG3 GLU A 118 11.908 -80.721 -22.401 1.00 51.04 H new ATOM 1779 N ILE A 119 11.556 -78.067 -19.901 1.00 14.51 N ATOM 1780 CA ILE A 119 10.175 -77.883 -19.481 1.00 51.30 C ATOM 1781 C ILE A 119 9.246 -78.077 -20.674 1.00 62.21 C ATOM 1782 O ILE A 119 8.902 -77.131 -21.386 1.00 44.42 O ATOM 1783 CB ILE A 119 9.952 -76.491 -18.841 1.00 2.53 C ATOM 1784 CG1 ILE A 119 11.005 -76.244 -17.748 1.00 24.02 C ATOM 1785 CG2 ILE A 119 8.537 -76.384 -18.269 1.00 53.12 C ATOM 1786 CD1 ILE A 119 11.082 -77.343 -16.703 1.00 71.13 C ATOM 0 H ILE A 119 12.115 -77.214 -19.918 1.00 14.51 H new ATOM 0 HA ILE A 119 9.949 -78.630 -18.720 1.00 51.30 H new ATOM 0 HB ILE A 119 10.062 -75.726 -19.609 1.00 2.53 H new ATOM 0 HG12 ILE A 119 11.982 -76.135 -18.218 1.00 24.02 H new ATOM 0 HG13 ILE A 119 10.783 -75.300 -17.251 1.00 24.02 H new ATOM 0 HG21 ILE A 119 8.398 -75.399 -17.823 1.00 53.12 H new ATOM 0 HG22 ILE A 119 7.810 -76.526 -19.068 1.00 53.12 H new ATOM 0 HG23 ILE A 119 8.394 -77.150 -17.507 1.00 53.12 H new ATOM 0 HD11 ILE A 119 11.848 -77.094 -15.968 1.00 71.13 H new ATOM 0 HD12 ILE A 119 10.118 -77.439 -16.204 1.00 71.13 H new ATOM 0 HD13 ILE A 119 11.336 -78.287 -17.186 1.00 71.13 H new ATOM 1798 N ARG A 120 8.885 -79.332 -20.902 1.00 2.03 N ATOM 1799 CA ARG A 120 8.029 -79.709 -22.015 1.00 61.44 C ATOM 1800 C ARG A 120 6.591 -79.304 -21.770 1.00 32.31 C ATOM 1801 O ARG A 120 5.975 -79.691 -20.772 1.00 1.25 O ATOM 1802 CB ARG A 120 8.144 -81.212 -22.273 1.00 4.12 C ATOM 1803 CG ARG A 120 9.307 -81.548 -23.184 1.00 2.23 C ATOM 1804 CD ARG A 120 9.489 -83.050 -23.358 1.00 30.01 C ATOM 1805 NE ARG A 120 10.798 -83.368 -23.928 1.00 3.51 N ATOM 1806 CZ ARG A 120 11.467 -84.495 -23.687 1.00 12.41 C ATOM 1807 NH1 ARG A 120 10.941 -85.434 -22.913 1.00 3.32 N ATOM 1808 NH2 ARG A 120 12.662 -84.684 -24.225 1.00 2.32 N ATOM 0 H ARG A 120 9.178 -80.117 -20.320 1.00 2.03 H new ATOM 0 HA ARG A 120 8.364 -79.175 -22.904 1.00 61.44 H new ATOM 0 HB2 ARG A 120 8.266 -81.734 -21.324 1.00 4.12 H new ATOM 0 HB3 ARG A 120 7.218 -81.574 -22.720 1.00 4.12 H new ATOM 0 HG2 ARG A 120 9.147 -81.088 -24.159 1.00 2.23 H new ATOM 0 HG3 ARG A 120 10.222 -81.118 -22.776 1.00 2.23 H new ATOM 0 HD2 ARG A 120 9.381 -83.545 -22.393 1.00 30.01 H new ATOM 0 HD3 ARG A 120 8.704 -83.440 -24.006 1.00 30.01 H new ATOM 0 HE ARG A 120 11.226 -82.683 -24.550 1.00 3.51 H new ATOM 0 HH11 ARG A 120 10.019 -85.296 -22.498 1.00 3.32 H new ATOM 0 HH12 ARG A 120 11.458 -86.295 -22.732 1.00 3.32 H new ATOM 0 HH21 ARG A 120 13.071 -83.967 -24.824 1.00 2.32 H new ATOM 0 HH22 ARG A 120 13.174 -85.547 -24.040 1.00 2.32 H new ATOM 1822 N ARG A 121 6.074 -78.528 -22.708 1.00 14.01 N ATOM 1823 CA ARG A 121 4.722 -77.978 -22.633 1.00 75.33 C ATOM 1824 C ARG A 121 4.161 -77.856 -24.044 1.00 64.21 C ATOM 1825 O ARG A 121 4.827 -77.211 -24.885 1.00 51.44 O ATOM 1826 CB ARG A 121 4.701 -76.597 -21.947 1.00 72.42 C ATOM 1827 CG ARG A 121 5.384 -76.560 -20.583 1.00 14.51 C ATOM 1828 CD ARG A 121 4.960 -75.342 -19.770 1.00 12.45 C ATOM 1829 NE ARG A 121 3.566 -75.458 -19.339 1.00 4.53 N ATOM 1830 CZ ARG A 121 2.771 -74.436 -19.027 1.00 42.14 C ATOM 1831 NH1 ARG A 121 3.215 -73.187 -19.092 1.00 1.44 N ATOM 1832 NH2 ARG A 121 1.522 -74.675 -18.643 1.00 65.01 N ATOM 1833 OXT ARG A 121 3.073 -78.400 -24.307 1.00 0.00 O ATOM 0 H ARG A 121 6.581 -78.257 -23.551 1.00 14.01 H new ATOM 0 HA ARG A 121 4.111 -78.652 -22.033 1.00 75.33 H new ATOM 0 HB2 ARG A 121 5.185 -75.872 -22.602 1.00 72.42 H new ATOM 0 HB3 ARG A 121 3.665 -76.279 -21.830 1.00 72.42 H new ATOM 0 HG2 ARG A 121 5.142 -77.468 -20.031 1.00 14.51 H new ATOM 0 HG3 ARG A 121 6.466 -76.548 -20.718 1.00 14.51 H new ATOM 0 HD2 ARG A 121 5.606 -75.239 -18.898 1.00 12.45 H new ATOM 0 HD3 ARG A 121 5.085 -74.439 -20.368 1.00 12.45 H new ATOM 0 HE ARG A 121 3.172 -76.396 -19.272 1.00 4.53 H new ATOM 0 HH11 ARG A 121 4.175 -73.001 -19.383 1.00 1.44 H new ATOM 0 HH12 ARG A 121 2.597 -72.413 -18.851 1.00 1.44 H new ATOM 0 HH21 ARG A 121 1.180 -75.634 -18.589 1.00 65.01 H new ATOM 0 HH22 ARG A 121 0.905 -73.899 -18.402 1.00 65.01 H new