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 : no HE2:sc= 1.12 K(o=2,f=-7.2!) USER MOD Set 1.2: A 109 SER OG : rot 163:sc= 0.89 USER MOD Set 2.1: A 69 ASN : amide:sc= 1.03 X(o=1.3,f=1.2) USER MOD Set 2.2: A 75 SER OG : rot 170:sc= 0.304 USER MOD Set 3.1: A 53 THR OG1 : rot 75:sc= 1.54 USER MOD Set 3.2: A 91 TYR OH : rot 150:sc= 0.613 USER MOD Single : A 34 THR OG1 : rot -90:sc= -0.269 USER MOD Single : A 35 THR OG1 : rot 110:sc= -0.673 USER MOD Single : A 37 CYS SG : rot 27:sc= 1.03 USER MOD Single : A 38 TYR OH : rot 179:sc= -0.453 USER MOD Single : A 41 THR OG1 : rot -44:sc= 1.07 USER MOD Single : A 51 LYS NZ :NH3+ -169:sc= -0.0107 (180deg=-0.137) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -170:sc=-0.00685 (180deg=-0.135) USER MOD Single : A 55 LYS NZ :NH3+ 141:sc= 1.06 (180deg=-0.112) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 TYR OH : rot 30:sc= 0 USER MOD Single : A 67 THR OG1 : rot 178:sc= -2.41! USER MOD Single : A 68 ASN : amide:sc= -4.57! K(o=-4.6!,f=-1.5) USER MOD Single : A 73 SER OG : rot 81:sc= 0.592 USER MOD Single : A 79 GLN : amide:sc= -1.07 K(o=-1.1,f=-3!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -2.89! C(o=-2.9!,f=-6.7!) USER MOD Single : A 90 LYS NZ :NH3+ -175:sc= 1.03 (180deg=0.987) USER MOD Single : A 93 HIS : no HD1:sc=-0.00127 X(o=-0.0013,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 172:sc=-0.00318 (180deg=-0.0853) USER MOD Single : A 96 SER OG : rot 180:sc= -1.2 USER MOD Single : A 98 LYS NZ :NH3+ -139:sc= -1.2 (180deg=-3.46!) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -170:sc=-0.00944 (180deg=-0.137) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0.0163 USER MOD ----------------------------------------------------------------- ATOM 450 N VAL A 33 26.865 -94.810 -9.383 1.00 64.33 N ATOM 451 CA VAL A 33 26.120 -93.608 -9.758 1.00 3.41 C ATOM 452 C VAL A 33 24.879 -93.457 -8.879 1.00 52.31 C ATOM 453 O VAL A 33 24.182 -94.436 -8.602 1.00 55.05 O ATOM 454 CB VAL A 33 25.683 -93.646 -11.251 1.00 32.24 C ATOM 455 CG1 VAL A 33 24.906 -92.382 -11.629 1.00 21.34 C ATOM 456 CG2 VAL A 33 26.890 -93.833 -12.172 1.00 54.35 C ATOM 0 HA VAL A 33 26.785 -92.757 -9.612 1.00 3.41 H new ATOM 0 HB VAL A 33 25.021 -94.502 -11.381 1.00 32.24 H new ATOM 0 HG11 VAL A 33 24.613 -92.435 -12.678 1.00 21.34 H new ATOM 0 HG12 VAL A 33 24.015 -92.303 -11.007 1.00 21.34 H new ATOM 0 HG13 VAL A 33 25.537 -91.507 -11.472 1.00 21.34 H new ATOM 0 HG21 VAL A 33 26.556 -93.856 -13.209 1.00 54.35 H new ATOM 0 HG22 VAL A 33 27.585 -93.005 -12.033 1.00 54.35 H new ATOM 0 HG23 VAL A 33 27.390 -94.771 -11.931 1.00 54.35 H new ATOM 466 N THR A 34 24.619 -92.232 -8.440 1.00 32.15 N ATOM 467 CA THR A 34 23.435 -91.925 -7.651 1.00 71.11 C ATOM 468 C THR A 34 22.307 -91.470 -8.575 1.00 2.24 C ATOM 469 O THR A 34 22.552 -90.777 -9.563 1.00 60.35 O ATOM 470 CB THR A 34 23.738 -90.809 -6.627 1.00 3.00 C ATOM 471 OG1 THR A 34 24.949 -91.117 -5.921 1.00 50.55 O ATOM 472 CG2 THR A 34 22.592 -90.643 -5.631 1.00 1.10 C ATOM 0 H THR A 34 25.220 -91.428 -8.620 1.00 32.15 H new ATOM 0 HA THR A 34 23.134 -92.824 -7.113 1.00 71.11 H new ATOM 0 HB THR A 34 23.854 -89.872 -7.171 1.00 3.00 H new ATOM 0 HG1 THR A 34 24.737 -91.640 -5.120 1.00 50.55 H new ATOM 0 HG21 THR A 34 22.836 -89.850 -4.924 1.00 1.10 H new ATOM 0 HG22 THR A 34 21.679 -90.383 -6.167 1.00 1.10 H new ATOM 0 HG23 THR A 34 22.442 -91.577 -5.090 1.00 1.10 H new ATOM 480 N THR A 35 21.084 -91.874 -8.278 1.00 71.32 N ATOM 481 CA THR A 35 19.935 -91.477 -9.080 1.00 44.34 C ATOM 482 C THR A 35 18.713 -91.255 -8.200 1.00 64.43 C ATOM 483 O THR A 35 18.463 -92.018 -7.265 1.00 74.11 O ATOM 484 CB THR A 35 19.612 -92.534 -10.161 1.00 51.43 C ATOM 485 OG1 THR A 35 20.768 -92.743 -10.990 1.00 13.30 O ATOM 486 CG2 THR A 35 18.429 -92.103 -11.030 1.00 62.32 C ATOM 0 H THR A 35 20.859 -92.477 -7.487 1.00 71.32 H new ATOM 0 HA THR A 35 20.192 -90.541 -9.576 1.00 44.34 H new ATOM 0 HB THR A 35 19.341 -93.462 -9.657 1.00 51.43 H new ATOM 0 HG1 THR A 35 21.141 -93.632 -10.813 1.00 13.30 H new ATOM 0 HG21 THR A 35 18.230 -92.869 -11.779 1.00 62.32 H new ATOM 0 HG22 THR A 35 17.547 -91.970 -10.404 1.00 62.32 H new ATOM 0 HG23 THR A 35 18.666 -91.163 -11.527 1.00 62.32 H new ATOM 494 N LEU A 36 17.982 -90.186 -8.490 1.00 13.40 N ATOM 495 CA LEU A 36 16.752 -89.857 -7.786 1.00 32.23 C ATOM 496 C LEU A 36 15.756 -89.249 -8.767 1.00 30.20 C ATOM 497 O LEU A 36 16.135 -88.480 -9.652 1.00 35.32 O ATOM 498 CB LEU A 36 17.026 -88.871 -6.635 1.00 70.33 C ATOM 499 CG LEU A 36 17.859 -89.420 -5.459 1.00 3.23 C ATOM 500 CD1 LEU A 36 18.173 -88.312 -4.455 1.00 10.31 C ATOM 501 CD2 LEU A 36 17.134 -90.580 -4.772 1.00 4.14 C ATOM 0 H LEU A 36 18.228 -89.521 -9.223 1.00 13.40 H new ATOM 0 HA LEU A 36 16.337 -90.770 -7.359 1.00 32.23 H new ATOM 0 HB2 LEU A 36 17.540 -88.001 -7.043 1.00 70.33 H new ATOM 0 HB3 LEU A 36 16.069 -88.523 -6.246 1.00 70.33 H new ATOM 0 HG LEU A 36 18.800 -89.797 -5.859 1.00 3.23 H new ATOM 0 HD11 LEU A 36 18.761 -88.721 -3.634 1.00 10.31 H new ATOM 0 HD12 LEU A 36 18.740 -87.523 -4.949 1.00 10.31 H new ATOM 0 HD13 LEU A 36 17.242 -87.900 -4.065 1.00 10.31 H new ATOM 0 HD21 LEU A 36 17.741 -90.950 -3.946 1.00 4.14 H new ATOM 0 HD22 LEU A 36 16.174 -90.234 -4.390 1.00 4.14 H new ATOM 0 HD23 LEU A 36 16.970 -91.383 -5.490 1.00 4.14 H new ATOM 513 N CYS A 37 14.488 -89.601 -8.618 1.00 71.23 N ATOM 514 CA CYS A 37 13.433 -89.043 -9.457 1.00 40.31 C ATOM 515 C CYS A 37 12.858 -87.797 -8.788 1.00 32.44 C ATOM 516 O CYS A 37 12.634 -87.784 -7.577 1.00 34.41 O ATOM 517 CB CYS A 37 12.343 -90.094 -9.707 1.00 1.21 C ATOM 518 SG CYS A 37 10.924 -89.505 -10.661 1.00 21.43 S ATOM 0 H CYS A 37 14.162 -90.272 -7.923 1.00 71.23 H new ATOM 0 HA CYS A 37 13.847 -88.757 -10.424 1.00 40.31 H new ATOM 0 HB2 CYS A 37 12.788 -90.941 -10.230 1.00 1.21 H new ATOM 0 HB3 CYS A 37 11.988 -90.464 -8.745 1.00 1.21 H new ATOM 0 HG CYS A 37 11.295 -88.525 -11.431 1.00 21.43 H new ATOM 524 N TYR A 38 12.637 -86.749 -9.575 1.00 44.52 N ATOM 525 CA TYR A 38 12.201 -85.455 -9.056 1.00 13.14 C ATOM 526 C TYR A 38 10.773 -85.154 -9.488 1.00 33.50 C ATOM 527 O TYR A 38 10.374 -85.461 -10.614 1.00 34.40 O ATOM 528 CB TYR A 38 13.122 -84.331 -9.558 1.00 2.52 C ATOM 529 CG TYR A 38 14.532 -84.341 -8.983 1.00 51.01 C ATOM 530 CD1 TYR A 38 15.269 -85.517 -8.890 1.00 5.21 C ATOM 531 CD2 TYR A 38 15.130 -83.162 -8.548 1.00 74.21 C ATOM 532 CE1 TYR A 38 16.552 -85.518 -8.380 1.00 42.41 C ATOM 533 CE2 TYR A 38 16.416 -83.157 -8.044 1.00 41.03 C ATOM 534 CZ TYR A 38 17.121 -84.337 -7.963 1.00 0.42 C ATOM 535 OH TYR A 38 18.406 -84.334 -7.474 1.00 72.24 O ATOM 0 H TYR A 38 12.754 -86.771 -10.588 1.00 44.52 H new ATOM 0 HA TYR A 38 12.247 -85.503 -7.968 1.00 13.14 H new ATOM 0 HB2 TYR A 38 13.189 -84.396 -10.644 1.00 2.52 H new ATOM 0 HB3 TYR A 38 12.659 -83.372 -9.325 1.00 2.52 H new ATOM 0 HD1 TYR A 38 14.830 -86.446 -9.223 1.00 5.21 H new ATOM 0 HD2 TYR A 38 14.579 -82.235 -8.606 1.00 74.21 H new ATOM 0 HE1 TYR A 38 17.107 -86.442 -8.309 1.00 42.41 H new ATOM 0 HE2 TYR A 38 16.866 -82.232 -7.715 1.00 41.03 H new ATOM 0 HH TYR A 38 18.664 -83.418 -7.239 1.00 72.24 H new ATOM 545 N ARG A 39 10.014 -84.556 -8.584 1.00 41.31 N ATOM 546 CA ARG A 39 8.670 -84.085 -8.874 1.00 13.40 C ATOM 547 C ARG A 39 8.354 -82.879 -7.996 1.00 14.02 C ATOM 548 O ARG A 39 8.197 -83.017 -6.788 1.00 25.40 O ATOM 549 CB ARG A 39 7.640 -85.197 -8.613 1.00 74.33 C ATOM 550 CG ARG A 39 6.205 -84.797 -8.944 1.00 12.21 C ATOM 551 CD ARG A 39 5.200 -85.873 -8.539 1.00 54.31 C ATOM 552 NE ARG A 39 5.016 -85.940 -7.084 1.00 25.32 N ATOM 553 CZ ARG A 39 4.259 -86.851 -6.465 1.00 14.22 C ATOM 554 NH1 ARG A 39 3.720 -87.848 -7.154 1.00 32.13 N ATOM 555 NH2 ARG A 39 4.066 -86.778 -5.154 1.00 64.21 N ATOM 0 H ARG A 39 10.314 -84.383 -7.625 1.00 41.31 H new ATOM 0 HA ARG A 39 8.617 -83.800 -9.925 1.00 13.40 H new ATOM 0 HB2 ARG A 39 7.908 -86.074 -9.203 1.00 74.33 H new ATOM 0 HB3 ARG A 39 7.693 -85.490 -7.564 1.00 74.33 H new ATOM 0 HG2 ARG A 39 5.962 -83.865 -8.434 1.00 12.21 H new ATOM 0 HG3 ARG A 39 6.120 -84.607 -10.014 1.00 12.21 H new ATOM 0 HD2 ARG A 39 4.241 -85.670 -9.016 1.00 54.31 H new ATOM 0 HD3 ARG A 39 5.540 -86.842 -8.906 1.00 54.31 H new ATOM 0 HE ARG A 39 5.496 -85.248 -6.509 1.00 25.32 H new ATOM 0 HH11 ARG A 39 3.883 -87.921 -8.158 1.00 32.13 H new ATOM 0 HH12 ARG A 39 3.143 -88.542 -6.680 1.00 32.13 H new ATOM 0 HH21 ARG A 39 4.496 -86.025 -4.616 1.00 64.21 H new ATOM 0 HH22 ARG A 39 3.488 -87.475 -4.684 1.00 64.21 H new ATOM 569 N VAL A 40 8.259 -81.703 -8.596 1.00 72.34 N ATOM 570 CA VAL A 40 7.930 -80.491 -7.858 1.00 72.44 C ATOM 571 C VAL A 40 6.516 -80.053 -8.185 1.00 70.43 C ATOM 572 O VAL A 40 6.039 -80.242 -9.308 1.00 61.43 O ATOM 573 CB VAL A 40 8.898 -79.323 -8.179 1.00 33.24 C ATOM 574 CG1 VAL A 40 8.793 -78.926 -9.642 1.00 32.30 C ATOM 575 CG2 VAL A 40 8.623 -78.110 -7.287 1.00 22.25 C ATOM 0 H VAL A 40 8.405 -81.561 -9.595 1.00 72.34 H new ATOM 0 HA VAL A 40 8.024 -80.731 -6.799 1.00 72.44 H new ATOM 0 HB VAL A 40 9.911 -79.672 -7.978 1.00 33.24 H new ATOM 0 HG11 VAL A 40 9.480 -78.105 -9.846 1.00 32.30 H new ATOM 0 HG12 VAL A 40 9.050 -79.779 -10.270 1.00 32.30 H new ATOM 0 HG13 VAL A 40 7.773 -78.609 -9.861 1.00 32.30 H new ATOM 0 HG21 VAL A 40 9.319 -77.309 -7.537 1.00 22.25 H new ATOM 0 HG22 VAL A 40 7.601 -77.766 -7.446 1.00 22.25 H new ATOM 0 HG23 VAL A 40 8.753 -78.390 -6.242 1.00 22.25 H new ATOM 585 N THR A 41 5.864 -79.465 -7.204 1.00 2.24 N ATOM 586 CA THR A 41 4.523 -78.932 -7.376 1.00 62.42 C ATOM 587 C THR A 41 4.561 -77.423 -7.160 1.00 74.20 C ATOM 588 O THR A 41 4.915 -76.955 -6.073 1.00 2.33 O ATOM 589 CB THR A 41 3.513 -79.591 -6.404 1.00 55.34 C ATOM 590 OG1 THR A 41 3.930 -79.402 -5.044 1.00 61.12 O ATOM 591 CG2 THR A 41 3.370 -81.083 -6.688 1.00 64.10 C ATOM 0 H THR A 41 6.245 -79.342 -6.266 1.00 2.24 H new ATOM 0 HA THR A 41 4.186 -79.157 -8.388 1.00 62.42 H new ATOM 0 HB THR A 41 2.546 -79.112 -6.557 1.00 55.34 H new ATOM 0 HG1 THR A 41 4.892 -79.574 -4.970 1.00 61.12 H new ATOM 0 HG21 THR A 41 2.655 -81.519 -5.991 1.00 64.10 H new ATOM 0 HG22 THR A 41 3.015 -81.227 -7.709 1.00 64.10 H new ATOM 0 HG23 THR A 41 4.337 -81.571 -6.568 1.00 64.10 H new ATOM 599 N GLY A 42 4.232 -76.662 -8.198 1.00 41.40 N ATOM 600 CA GLY A 42 4.355 -75.221 -8.122 1.00 24.42 C ATOM 601 C GLY A 42 3.461 -74.489 -9.101 1.00 40.24 C ATOM 602 O GLY A 42 2.726 -75.106 -9.877 1.00 32.35 O ATOM 0 H GLY A 42 3.883 -77.018 -9.088 1.00 41.40 H new ATOM 0 HA2 GLY A 42 4.115 -74.896 -7.110 1.00 24.42 H new ATOM 0 HA3 GLY A 42 5.392 -74.942 -8.309 1.00 24.42 H new ATOM 684 N PHE A 48 8.926 -73.490 -16.969 1.00 44.21 N ATOM 685 CA PHE A 48 10.057 -73.724 -16.079 1.00 43.23 C ATOM 686 C PHE A 48 11.346 -73.421 -16.852 1.00 63.04 C ATOM 687 O PHE A 48 11.648 -74.081 -17.850 1.00 45.54 O ATOM 688 CB PHE A 48 10.019 -75.179 -15.579 1.00 61.12 C ATOM 689 CG PHE A 48 10.894 -75.483 -14.384 1.00 53.24 C ATOM 690 CD1 PHE A 48 10.459 -75.193 -13.096 1.00 42.11 C ATOM 691 CD2 PHE A 48 12.138 -76.079 -14.545 1.00 54.45 C ATOM 692 CE1 PHE A 48 11.243 -75.495 -11.997 1.00 23.41 C ATOM 693 CE2 PHE A 48 12.923 -76.383 -13.448 1.00 23.53 C ATOM 694 CZ PHE A 48 12.478 -76.088 -12.175 1.00 52.33 C ATOM 0 HA PHE A 48 10.012 -73.074 -15.205 1.00 43.23 H new ATOM 0 HB2 PHE A 48 8.989 -75.430 -15.326 1.00 61.12 H new ATOM 0 HB3 PHE A 48 10.314 -75.834 -16.399 1.00 61.12 H new ATOM 0 HD1 PHE A 48 9.496 -74.726 -12.951 1.00 42.11 H new ATOM 0 HD2 PHE A 48 12.496 -76.308 -15.538 1.00 54.45 H new ATOM 0 HE1 PHE A 48 10.890 -75.268 -11.002 1.00 23.41 H new ATOM 0 HE2 PHE A 48 13.886 -76.852 -13.587 1.00 23.53 H new ATOM 0 HZ PHE A 48 13.095 -76.320 -11.319 1.00 52.33 H new ATOM 704 N PHE A 49 12.072 -72.400 -16.404 1.00 15.34 N ATOM 705 CA PHE A 49 13.197 -71.835 -17.159 1.00 4.40 C ATOM 706 C PHE A 49 14.245 -72.882 -17.555 1.00 62.32 C ATOM 707 O PHE A 49 15.140 -73.231 -16.769 1.00 1.00 O ATOM 708 CB PHE A 49 13.848 -70.695 -16.363 1.00 33.40 C ATOM 709 CG PHE A 49 12.994 -69.454 -16.276 1.00 61.25 C ATOM 710 CD1 PHE A 49 11.888 -69.410 -15.438 1.00 2.54 C ATOM 711 CD2 PHE A 49 13.298 -68.333 -17.036 1.00 61.52 C ATOM 712 CE1 PHE A 49 11.107 -68.275 -15.357 1.00 70.11 C ATOM 713 CE2 PHE A 49 12.519 -67.195 -16.959 1.00 52.45 C ATOM 714 CZ PHE A 49 11.422 -67.166 -16.119 1.00 63.23 C ATOM 0 H PHE A 49 11.901 -71.939 -15.510 1.00 15.34 H new ATOM 0 HA PHE A 49 12.787 -71.444 -18.090 1.00 4.40 H new ATOM 0 HB2 PHE A 49 14.067 -71.046 -15.355 1.00 33.40 H new ATOM 0 HB3 PHE A 49 14.801 -70.438 -16.825 1.00 33.40 H new ATOM 0 HD1 PHE A 49 11.636 -70.275 -14.842 1.00 2.54 H new ATOM 0 HD2 PHE A 49 14.153 -68.351 -17.695 1.00 61.52 H new ATOM 0 HE1 PHE A 49 10.251 -68.254 -14.699 1.00 70.11 H new ATOM 0 HE2 PHE A 49 12.767 -66.329 -17.555 1.00 52.45 H new ATOM 0 HZ PHE A 49 10.811 -66.277 -16.058 1.00 63.23 H new ATOM 724 N ARG A 50 14.125 -73.363 -18.794 1.00 20.24 N ATOM 725 CA ARG A 50 15.094 -74.285 -19.385 1.00 11.11 C ATOM 726 C ARG A 50 16.501 -73.703 -19.342 1.00 62.02 C ATOM 727 O ARG A 50 17.480 -74.439 -19.289 1.00 13.04 O ATOM 728 CB ARG A 50 14.722 -74.602 -20.842 1.00 4.24 C ATOM 729 CG ARG A 50 13.641 -75.674 -20.998 1.00 63.42 C ATOM 730 CD ARG A 50 14.168 -76.898 -21.748 1.00 31.41 C ATOM 731 NE ARG A 50 14.550 -76.576 -23.128 1.00 52.04 N ATOM 732 CZ ARG A 50 15.053 -77.458 -23.998 1.00 22.45 C ATOM 733 NH1 ARG A 50 15.316 -78.705 -23.627 1.00 12.14 N ATOM 734 NH2 ARG A 50 15.307 -77.082 -25.244 1.00 70.43 N ATOM 0 H ARG A 50 13.352 -73.123 -19.415 1.00 20.24 H new ATOM 0 HA ARG A 50 15.072 -75.203 -18.798 1.00 11.11 H new ATOM 0 HB2 ARG A 50 14.381 -73.686 -21.325 1.00 4.24 H new ATOM 0 HB3 ARG A 50 15.618 -74.927 -21.371 1.00 4.24 H new ATOM 0 HG2 ARG A 50 13.282 -75.976 -20.014 1.00 63.42 H new ATOM 0 HG3 ARG A 50 12.789 -75.257 -21.534 1.00 63.42 H new ATOM 0 HD2 ARG A 50 15.030 -77.304 -21.219 1.00 31.41 H new ATOM 0 HD3 ARG A 50 13.404 -77.675 -21.756 1.00 31.41 H new ATOM 0 HE ARG A 50 14.423 -75.615 -23.445 1.00 52.04 H new ATOM 0 HH11 ARG A 50 15.134 -79.001 -22.668 1.00 12.14 H new ATOM 0 HH12 ARG A 50 15.700 -79.367 -24.301 1.00 12.14 H new ATOM 0 HH21 ARG A 50 15.119 -76.123 -25.536 1.00 70.43 H new ATOM 0 HH22 ARG A 50 15.691 -77.752 -25.911 1.00 70.43 H new ATOM 748 N LYS A 51 16.591 -72.378 -19.384 1.00 31.42 N ATOM 749 CA LYS A 51 17.876 -71.688 -19.361 1.00 51.24 C ATOM 750 C LYS A 51 18.650 -72.025 -18.088 1.00 43.40 C ATOM 751 O LYS A 51 19.813 -72.430 -18.139 1.00 4.25 O ATOM 752 CB LYS A 51 17.661 -70.171 -19.472 1.00 42.54 C ATOM 753 CG LYS A 51 16.969 -69.743 -20.767 1.00 63.21 C ATOM 754 CD LYS A 51 17.808 -70.068 -22.004 1.00 2.41 C ATOM 755 CE LYS A 51 19.109 -69.271 -22.033 1.00 61.10 C ATOM 756 NZ LYS A 51 18.862 -67.810 -22.178 1.00 63.52 N ATOM 0 H LYS A 51 15.784 -71.757 -19.434 1.00 31.42 H new ATOM 0 HA LYS A 51 18.465 -72.024 -20.214 1.00 51.24 H new ATOM 0 HB2 LYS A 51 17.066 -69.834 -18.623 1.00 42.54 H new ATOM 0 HB3 LYS A 51 18.626 -69.670 -19.403 1.00 42.54 H new ATOM 0 HG2 LYS A 51 16.003 -70.243 -20.843 1.00 63.21 H new ATOM 0 HG3 LYS A 51 16.772 -68.671 -20.735 1.00 63.21 H new ATOM 0 HD2 LYS A 51 18.035 -71.134 -22.019 1.00 2.41 H new ATOM 0 HD3 LYS A 51 17.230 -69.852 -22.902 1.00 2.41 H new ATOM 0 HE2 LYS A 51 19.668 -69.455 -21.116 1.00 61.10 H new ATOM 0 HE3 LYS A 51 19.729 -69.618 -22.860 1.00 61.10 H new ATOM 0 HZ1 LYS A 51 19.759 -67.325 -22.380 1.00 63.52 H new ATOM 0 HZ2 LYS A 51 18.196 -67.646 -22.960 1.00 63.52 H new ATOM 0 HZ3 LYS A 51 18.458 -67.437 -21.295 1.00 63.52 H new ATOM 770 N TYR A 52 17.981 -71.882 -16.948 1.00 33.33 N ATOM 771 CA TYR A 52 18.614 -72.125 -15.655 1.00 52.21 C ATOM 772 C TYR A 52 18.706 -73.620 -15.378 1.00 31.13 C ATOM 773 O TYR A 52 19.654 -74.076 -14.735 1.00 33.12 O ATOM 774 CB TYR A 52 17.854 -71.399 -14.539 1.00 51.11 C ATOM 775 CG TYR A 52 17.820 -69.893 -14.728 1.00 65.03 C ATOM 776 CD1 TYR A 52 19.000 -69.156 -14.801 1.00 73.20 C ATOM 777 CD2 TYR A 52 16.615 -69.207 -14.850 1.00 31.11 C ATOM 778 CE1 TYR A 52 18.980 -67.786 -14.986 1.00 34.30 C ATOM 779 CE2 TYR A 52 16.588 -67.838 -15.037 1.00 52.05 C ATOM 780 CZ TYR A 52 17.772 -67.132 -15.103 1.00 23.30 C ATOM 781 OH TYR A 52 17.749 -65.768 -15.296 1.00 53.21 O ATOM 0 H TYR A 52 17.002 -71.600 -16.893 1.00 33.33 H new ATOM 0 HA TYR A 52 19.628 -71.726 -15.683 1.00 52.21 H new ATOM 0 HB2 TYR A 52 16.833 -71.778 -14.496 1.00 51.11 H new ATOM 0 HB3 TYR A 52 18.319 -71.629 -13.581 1.00 51.11 H new ATOM 0 HD1 TYR A 52 19.949 -69.665 -14.711 1.00 73.20 H new ATOM 0 HD2 TYR A 52 15.685 -69.754 -14.798 1.00 31.11 H new ATOM 0 HE1 TYR A 52 19.905 -67.231 -15.039 1.00 34.30 H new ATOM 0 HE2 TYR A 52 15.644 -67.322 -15.131 1.00 52.05 H new ATOM 0 HH TYR A 52 16.820 -65.462 -15.359 1.00 53.21 H new ATOM 791 N THR A 53 17.732 -74.382 -15.875 1.00 44.10 N ATOM 792 CA THR A 53 17.774 -75.836 -15.768 1.00 3.41 C ATOM 793 C THR A 53 19.005 -76.381 -16.503 1.00 73.23 C ATOM 794 O THR A 53 19.768 -77.185 -15.959 1.00 72.33 O ATOM 795 CB THR A 53 16.493 -76.476 -16.353 1.00 45.12 C ATOM 796 OG1 THR A 53 15.340 -75.865 -15.758 1.00 53.20 O ATOM 797 CG2 THR A 53 16.457 -77.983 -16.108 1.00 71.23 C ATOM 0 H THR A 53 16.909 -74.017 -16.353 1.00 44.10 H new ATOM 0 HA THR A 53 17.836 -76.095 -14.711 1.00 3.41 H new ATOM 0 HB THR A 53 16.492 -76.310 -17.430 1.00 45.12 H new ATOM 0 HG1 THR A 53 15.210 -74.971 -16.139 1.00 53.20 H new ATOM 0 HG21 THR A 53 15.543 -78.399 -16.532 1.00 71.23 H new ATOM 0 HG22 THR A 53 17.322 -78.449 -16.581 1.00 71.23 H new ATOM 0 HG23 THR A 53 16.481 -78.178 -15.036 1.00 71.23 H new ATOM 805 N LYS A 54 19.196 -75.901 -17.731 1.00 52.34 N ATOM 806 CA LYS A 54 20.336 -76.293 -18.549 1.00 30.44 C ATOM 807 C LYS A 54 21.631 -75.862 -17.881 1.00 3.54 C ATOM 808 O LYS A 54 22.552 -76.654 -17.745 1.00 44.10 O ATOM 809 CB LYS A 54 20.244 -75.674 -19.953 1.00 40.44 C ATOM 810 CG LYS A 54 21.446 -75.990 -20.843 1.00 35.45 C ATOM 811 CD LYS A 54 21.313 -75.372 -22.233 1.00 30.33 C ATOM 812 CE LYS A 54 22.542 -75.652 -23.094 1.00 3.15 C ATOM 813 NZ LYS A 54 23.765 -74.992 -22.558 1.00 23.31 N ATOM 0 H LYS A 54 18.569 -75.235 -18.182 1.00 52.34 H new ATOM 0 HA LYS A 54 20.325 -77.378 -18.649 1.00 30.44 H new ATOM 0 HB2 LYS A 54 19.338 -76.033 -20.440 1.00 40.44 H new ATOM 0 HB3 LYS A 54 20.148 -74.592 -19.858 1.00 40.44 H new ATOM 0 HG2 LYS A 54 22.355 -75.620 -20.368 1.00 35.45 H new ATOM 0 HG3 LYS A 54 21.553 -77.071 -20.936 1.00 35.45 H new ATOM 0 HD2 LYS A 54 20.425 -75.770 -22.725 1.00 30.33 H new ATOM 0 HD3 LYS A 54 21.171 -74.295 -22.141 1.00 30.33 H new ATOM 0 HE2 LYS A 54 22.707 -76.728 -23.151 1.00 3.15 H new ATOM 0 HE3 LYS A 54 22.359 -75.304 -24.110 1.00 3.15 H new ATOM 0 HZ1 LYS A 54 24.533 -75.065 -23.256 1.00 23.31 H new ATOM 0 HZ2 LYS A 54 23.564 -73.989 -22.368 1.00 23.31 H new ATOM 0 HZ3 LYS A 54 24.054 -75.460 -21.675 1.00 23.31 H new ATOM 827 N LYS A 55 21.681 -74.602 -17.446 1.00 61.15 N ATOM 828 CA LYS A 55 22.861 -74.069 -16.766 1.00 23.30 C ATOM 829 C LYS A 55 23.261 -74.974 -15.600 1.00 15.04 C ATOM 830 O LYS A 55 24.409 -75.423 -15.516 1.00 2.24 O ATOM 831 CB LYS A 55 22.586 -72.622 -16.280 1.00 11.43 C ATOM 832 CG LYS A 55 23.363 -72.199 -15.022 1.00 64.44 C ATOM 833 CD LYS A 55 22.493 -72.290 -13.763 1.00 65.33 C ATOM 834 CE LYS A 55 23.282 -72.015 -12.483 1.00 14.41 C ATOM 835 NZ LYS A 55 24.259 -73.100 -12.175 1.00 63.50 N ATOM 0 H LYS A 55 20.919 -73.933 -17.553 1.00 61.15 H new ATOM 0 HA LYS A 55 23.693 -74.042 -17.469 1.00 23.30 H new ATOM 0 HB2 LYS A 55 22.829 -71.931 -17.088 1.00 11.43 H new ATOM 0 HB3 LYS A 55 21.519 -72.518 -16.082 1.00 11.43 H new ATOM 0 HG2 LYS A 55 24.241 -72.835 -14.905 1.00 64.44 H new ATOM 0 HG3 LYS A 55 23.723 -71.177 -15.143 1.00 64.44 H new ATOM 0 HD2 LYS A 55 21.673 -71.576 -13.840 1.00 65.33 H new ATOM 0 HD3 LYS A 55 22.047 -73.283 -13.705 1.00 65.33 H new ATOM 0 HE2 LYS A 55 23.813 -71.068 -12.583 1.00 14.41 H new ATOM 0 HE3 LYS A 55 22.589 -71.905 -11.649 1.00 14.41 H new ATOM 0 HZ1 LYS A 55 25.137 -72.682 -11.807 1.00 63.50 H new ATOM 0 HZ2 LYS A 55 23.854 -73.739 -11.461 1.00 63.50 H new ATOM 0 HZ3 LYS A 55 24.467 -73.636 -13.042 1.00 63.50 H new ATOM 849 N GLU A 56 22.299 -75.276 -14.742 1.00 61.35 N ATOM 850 CA GLU A 56 22.555 -76.041 -13.534 1.00 4.44 C ATOM 851 C GLU A 56 23.050 -77.445 -13.872 1.00 34.44 C ATOM 852 O GLU A 56 24.158 -77.839 -13.493 1.00 61.15 O ATOM 853 CB GLU A 56 21.281 -76.118 -12.678 1.00 12.34 C ATOM 854 CG GLU A 56 21.528 -76.646 -11.272 1.00 53.51 C ATOM 855 CD GLU A 56 22.309 -75.660 -10.401 1.00 25.14 C ATOM 856 OE1 GLU A 56 23.472 -75.340 -10.739 1.00 63.10 O ATOM 857 OE2 GLU A 56 21.754 -75.176 -9.391 1.00 24.04 O ATOM 0 H GLU A 56 21.325 -74.999 -14.863 1.00 61.35 H new ATOM 0 HA GLU A 56 23.335 -75.534 -12.966 1.00 4.44 H new ATOM 0 HB2 GLU A 56 20.836 -75.125 -12.612 1.00 12.34 H new ATOM 0 HB3 GLU A 56 20.555 -76.760 -13.177 1.00 12.34 H new ATOM 0 HG2 GLU A 56 20.572 -76.866 -10.797 1.00 53.51 H new ATOM 0 HG3 GLU A 56 22.077 -77.586 -11.332 1.00 53.51 H new ATOM 864 N ALA A 57 22.234 -78.180 -14.616 1.00 2.01 N ATOM 865 CA ALA A 57 22.522 -79.569 -14.935 1.00 74.43 C ATOM 866 C ALA A 57 23.794 -79.699 -15.775 1.00 71.13 C ATOM 867 O ALA A 57 24.644 -80.541 -15.500 1.00 12.10 O ATOM 868 CB ALA A 57 21.336 -80.195 -15.651 1.00 4.12 C ATOM 0 H ALA A 57 21.361 -77.832 -15.012 1.00 2.01 H new ATOM 0 HA ALA A 57 22.693 -80.104 -14.001 1.00 74.43 H new ATOM 0 HB1 ALA A 57 21.561 -81.235 -15.886 1.00 4.12 H new ATOM 0 HB2 ALA A 57 20.457 -80.150 -15.008 1.00 4.12 H new ATOM 0 HB3 ALA A 57 21.138 -79.649 -16.574 1.00 4.12 H new ATOM 874 N ASP A 58 23.926 -78.843 -16.780 1.00 44.45 N ATOM 875 CA ASP A 58 25.077 -78.891 -17.687 1.00 61.14 C ATOM 876 C ASP A 58 26.371 -78.530 -16.956 1.00 50.21 C ATOM 877 O ASP A 58 27.427 -79.122 -17.212 1.00 33.21 O ATOM 878 CB ASP A 58 24.853 -77.949 -18.879 1.00 0.41 C ATOM 879 CG ASP A 58 26.025 -77.918 -19.846 1.00 35.12 C ATOM 880 OD1 ASP A 58 26.169 -78.868 -20.645 1.00 32.14 O ATOM 881 OD2 ASP A 58 26.793 -76.931 -19.824 1.00 22.10 O ATOM 0 H ASP A 58 23.254 -78.106 -16.992 1.00 44.45 H new ATOM 0 HA ASP A 58 25.175 -79.911 -18.058 1.00 61.14 H new ATOM 0 HB2 ASP A 58 23.956 -78.259 -19.415 1.00 0.41 H new ATOM 0 HB3 ASP A 58 24.670 -76.941 -18.508 1.00 0.41 H new ATOM 886 N ALA A 59 26.293 -77.569 -16.035 1.00 41.11 N ATOM 887 CA ALA A 59 27.463 -77.150 -15.267 1.00 31.13 C ATOM 888 C ALA A 59 27.905 -78.236 -14.281 1.00 41.12 C ATOM 889 O ALA A 59 29.093 -78.554 -14.185 1.00 73.43 O ATOM 890 CB ALA A 59 27.179 -75.847 -14.525 1.00 33.22 C ATOM 0 H ALA A 59 25.435 -77.068 -15.804 1.00 41.11 H new ATOM 0 HA ALA A 59 28.278 -76.984 -15.972 1.00 31.13 H new ATOM 0 HB1 ALA A 59 28.062 -75.551 -13.959 1.00 33.22 H new ATOM 0 HB2 ALA A 59 26.930 -75.066 -15.243 1.00 33.22 H new ATOM 0 HB3 ALA A 59 26.342 -75.992 -13.842 1.00 33.22 H new ATOM 896 N LEU A 60 26.943 -78.805 -13.556 1.00 54.24 N ATOM 897 CA LEU A 60 27.238 -79.776 -12.495 1.00 74.52 C ATOM 898 C LEU A 60 27.225 -81.222 -13.012 1.00 2.20 C ATOM 899 O LEU A 60 27.533 -82.151 -12.265 1.00 5.04 O ATOM 900 CB LEU A 60 26.235 -79.611 -11.348 1.00 10.34 C ATOM 901 CG LEU A 60 26.323 -78.286 -10.573 1.00 60.33 C ATOM 902 CD1 LEU A 60 25.182 -78.181 -9.565 1.00 41.11 C ATOM 903 CD2 LEU A 60 27.676 -78.162 -9.870 1.00 51.52 C ATOM 0 H LEU A 60 25.949 -78.612 -13.682 1.00 54.24 H new ATOM 0 HA LEU A 60 28.246 -79.575 -12.132 1.00 74.52 H new ATOM 0 HB2 LEU A 60 25.228 -79.708 -11.753 1.00 10.34 H new ATOM 0 HB3 LEU A 60 26.376 -80.432 -10.645 1.00 10.34 H new ATOM 0 HG LEU A 60 26.231 -77.465 -11.284 1.00 60.33 H new ATOM 0 HD11 LEU A 60 25.259 -77.237 -9.025 1.00 41.11 H new ATOM 0 HD12 LEU A 60 24.228 -78.222 -10.090 1.00 41.11 H new ATOM 0 HD13 LEU A 60 25.243 -79.009 -8.859 1.00 41.11 H new ATOM 0 HD21 LEU A 60 27.719 -77.218 -9.327 1.00 51.52 H new ATOM 0 HD22 LEU A 60 27.800 -78.989 -9.170 1.00 51.52 H new ATOM 0 HD23 LEU A 60 28.475 -78.191 -10.611 1.00 51.52 H new ATOM 915 N SER A 61 26.864 -81.399 -14.281 1.00 74.52 N ATOM 916 CA SER A 61 26.871 -82.712 -14.930 1.00 3.53 C ATOM 917 C SER A 61 25.799 -83.647 -14.360 1.00 64.03 C ATOM 918 O SER A 61 26.078 -84.801 -14.023 1.00 34.12 O ATOM 919 CB SER A 61 28.258 -83.363 -14.825 1.00 74.53 C ATOM 920 OG SER A 61 29.235 -82.590 -15.503 1.00 63.03 O ATOM 0 H SER A 61 26.559 -80.639 -14.889 1.00 74.52 H new ATOM 0 HA SER A 61 26.634 -82.548 -15.981 1.00 3.53 H new ATOM 0 HB2 SER A 61 28.536 -83.468 -13.776 1.00 74.53 H new ATOM 0 HB3 SER A 61 28.225 -84.367 -15.248 1.00 74.53 H new ATOM 0 HG SER A 61 30.110 -83.024 -15.421 1.00 63.03 H new ATOM 926 N LEU A 62 24.567 -83.148 -14.260 1.00 73.12 N ATOM 927 CA LEU A 62 23.423 -84.010 -13.966 1.00 32.44 C ATOM 928 C LEU A 62 22.720 -84.354 -15.273 1.00 13.42 C ATOM 929 O LEU A 62 22.476 -83.474 -16.100 1.00 54.02 O ATOM 930 CB LEU A 62 22.412 -83.335 -13.011 1.00 62.02 C ATOM 931 CG LEU A 62 22.897 -83.066 -11.574 1.00 31.13 C ATOM 932 CD1 LEU A 62 23.612 -84.286 -11.002 1.00 22.14 C ATOM 933 CD2 LEU A 62 23.780 -81.827 -11.524 1.00 20.31 C ATOM 0 H LEU A 62 24.337 -82.161 -14.377 1.00 73.12 H new ATOM 0 HA LEU A 62 23.796 -84.907 -13.472 1.00 32.44 H new ATOM 0 HB2 LEU A 62 22.108 -82.385 -13.452 1.00 62.02 H new ATOM 0 HB3 LEU A 62 21.522 -83.962 -12.959 1.00 62.02 H new ATOM 0 HG LEU A 62 22.024 -82.875 -10.950 1.00 31.13 H new ATOM 0 HD11 LEU A 62 23.945 -84.070 -9.987 1.00 22.14 H new ATOM 0 HD12 LEU A 62 22.928 -85.135 -10.987 1.00 22.14 H new ATOM 0 HD13 LEU A 62 24.475 -84.526 -11.623 1.00 22.14 H new ATOM 0 HD21 LEU A 62 24.111 -81.657 -10.499 1.00 20.31 H new ATOM 0 HD22 LEU A 62 24.649 -81.973 -12.166 1.00 20.31 H new ATOM 0 HD23 LEU A 62 23.214 -80.963 -11.871 1.00 20.31 H new ATOM 945 N VAL A 63 22.396 -85.627 -15.457 1.00 63.31 N ATOM 946 CA VAL A 63 21.661 -86.067 -16.639 1.00 53.30 C ATOM 947 C VAL A 63 20.383 -86.784 -16.217 1.00 24.01 C ATOM 948 O VAL A 63 20.169 -87.022 -15.029 1.00 52.40 O ATOM 949 CB VAL A 63 22.519 -86.979 -17.560 1.00 11.42 C ATOM 950 CG1 VAL A 63 23.755 -86.232 -18.062 1.00 23.31 C ATOM 951 CG2 VAL A 63 22.922 -88.270 -16.851 1.00 10.23 C ATOM 0 H VAL A 63 22.630 -86.374 -14.804 1.00 63.31 H new ATOM 0 HA VAL A 63 21.406 -85.180 -17.219 1.00 53.30 H new ATOM 0 HB VAL A 63 21.905 -87.250 -18.419 1.00 11.42 H new ATOM 0 HG11 VAL A 63 24.341 -86.889 -18.705 1.00 23.31 H new ATOM 0 HG12 VAL A 63 23.444 -85.354 -18.628 1.00 23.31 H new ATOM 0 HG13 VAL A 63 24.362 -85.920 -17.212 1.00 23.31 H new ATOM 0 HG21 VAL A 63 23.521 -88.883 -17.524 1.00 10.23 H new ATOM 0 HG22 VAL A 63 23.506 -88.030 -15.963 1.00 10.23 H new ATOM 0 HG23 VAL A 63 22.027 -88.819 -16.559 1.00 10.23 H new ATOM 961 N GLY A 64 19.531 -87.097 -17.185 1.00 15.23 N ATOM 962 CA GLY A 64 18.251 -87.721 -16.893 1.00 55.25 C ATOM 963 C GLY A 64 17.172 -87.219 -17.829 1.00 30.41 C ATOM 964 O GLY A 64 17.294 -87.368 -19.050 1.00 63.55 O ATOM 0 H GLY A 64 19.704 -86.929 -18.176 1.00 15.23 H new ATOM 0 HA2 GLY A 64 18.341 -88.803 -16.985 1.00 55.25 H new ATOM 0 HA3 GLY A 64 17.968 -87.511 -15.861 1.00 55.25 H new ATOM 968 N TYR A 65 16.114 -86.627 -17.274 1.00 73.32 N ATOM 969 CA TYR A 65 15.051 -86.048 -18.098 1.00 13.32 C ATOM 970 C TYR A 65 14.118 -85.166 -17.268 1.00 31.43 C ATOM 971 O TYR A 65 13.954 -85.390 -16.071 1.00 30.44 O ATOM 972 CB TYR A 65 14.279 -87.161 -18.844 1.00 12.34 C ATOM 973 CG TYR A 65 12.799 -87.290 -18.509 1.00 12.32 C ATOM 974 CD1 TYR A 65 12.372 -88.047 -17.421 1.00 2.54 C ATOM 975 CD2 TYR A 65 11.830 -86.667 -19.293 1.00 43.24 C ATOM 976 CE1 TYR A 65 11.028 -88.180 -17.126 1.00 14.21 C ATOM 977 CE2 TYR A 65 10.485 -86.793 -19.000 1.00 74.34 C ATOM 978 CZ TYR A 65 10.090 -87.549 -17.918 1.00 4.14 C ATOM 979 OH TYR A 65 8.751 -87.682 -17.630 1.00 22.34 O ATOM 0 H TYR A 65 15.970 -86.536 -16.268 1.00 73.32 H new ATOM 0 HA TYR A 65 15.511 -85.402 -18.846 1.00 13.32 H new ATOM 0 HB2 TYR A 65 14.374 -86.985 -19.916 1.00 12.34 H new ATOM 0 HB3 TYR A 65 14.763 -88.115 -18.633 1.00 12.34 H new ATOM 0 HD1 TYR A 65 13.103 -88.539 -16.797 1.00 2.54 H new ATOM 0 HD2 TYR A 65 12.135 -86.076 -20.144 1.00 43.24 H new ATOM 0 HE1 TYR A 65 10.714 -88.774 -16.281 1.00 14.21 H new ATOM 0 HE2 TYR A 65 9.747 -86.301 -19.616 1.00 74.34 H new ATOM 0 HH TYR A 65 8.635 -87.807 -16.665 1.00 22.34 H new ATOM 989 N VAL A 66 13.531 -84.152 -17.908 1.00 23.54 N ATOM 990 CA VAL A 66 12.575 -83.249 -17.246 1.00 72.34 C ATOM 991 C VAL A 66 11.398 -82.928 -18.168 1.00 10.41 C ATOM 992 O VAL A 66 11.574 -82.833 -19.383 1.00 63.31 O ATOM 993 CB VAL A 66 13.261 -81.929 -16.777 1.00 1.11 C ATOM 994 CG1 VAL A 66 12.242 -80.810 -16.528 1.00 51.44 C ATOM 995 CG2 VAL A 66 14.084 -82.174 -15.512 1.00 12.42 C ATOM 0 H VAL A 66 13.700 -83.932 -18.890 1.00 23.54 H new ATOM 0 HA VAL A 66 12.200 -83.768 -16.364 1.00 72.34 H new ATOM 0 HB VAL A 66 13.922 -81.606 -17.581 1.00 1.11 H new ATOM 0 HG11 VAL A 66 12.763 -79.909 -16.203 1.00 51.44 H new ATOM 0 HG12 VAL A 66 11.698 -80.602 -17.449 1.00 51.44 H new ATOM 0 HG13 VAL A 66 11.540 -81.122 -15.755 1.00 51.44 H new ATOM 0 HG21 VAL A 66 14.556 -81.243 -15.199 1.00 12.42 H new ATOM 0 HG22 VAL A 66 13.431 -82.535 -14.717 1.00 12.42 H new ATOM 0 HG23 VAL A 66 14.853 -82.919 -15.717 1.00 12.42 H new ATOM 1005 N THR A 67 10.211 -82.761 -17.570 1.00 33.35 N ATOM 1006 CA THR A 67 8.988 -82.393 -18.281 1.00 62.00 C ATOM 1007 C THR A 67 8.027 -81.702 -17.306 1.00 43.22 C ATOM 1008 O THR A 67 8.181 -81.831 -16.090 1.00 43.20 O ATOM 1009 CB THR A 67 8.289 -83.621 -18.912 1.00 20.20 C ATOM 1010 OG1 THR A 67 7.125 -83.203 -19.637 1.00 12.03 O ATOM 1011 CG2 THR A 67 7.878 -84.637 -17.854 1.00 52.41 C ATOM 0 H THR A 67 10.076 -82.880 -16.566 1.00 33.35 H new ATOM 0 HA THR A 67 9.262 -81.718 -19.092 1.00 62.00 H new ATOM 0 HB THR A 67 9.002 -84.094 -19.587 1.00 20.20 H new ATOM 0 HG1 THR A 67 6.707 -83.981 -20.061 1.00 12.03 H new ATOM 0 HG21 THR A 67 7.390 -85.485 -18.334 1.00 52.41 H new ATOM 0 HG22 THR A 67 8.762 -84.982 -17.318 1.00 52.41 H new ATOM 0 HG23 THR A 67 7.187 -84.171 -17.151 1.00 52.41 H new ATOM 1019 N ASN A 68 7.039 -80.974 -17.828 1.00 24.14 N ATOM 1020 CA ASN A 68 6.136 -80.191 -16.978 1.00 73.40 C ATOM 1021 C ASN A 68 4.686 -80.609 -17.207 1.00 73.12 C ATOM 1022 O ASN A 68 4.143 -80.431 -18.296 1.00 10.52 O ATOM 1023 CB ASN A 68 6.296 -78.691 -17.273 1.00 71.15 C ATOM 1024 CG ASN A 68 5.787 -77.766 -16.167 1.00 11.14 C ATOM 1025 OD1 ASN A 68 6.282 -76.650 -16.016 1.00 14.14 O ATOM 1026 ND2 ASN A 68 4.803 -78.199 -15.390 1.00 71.23 N ATOM 0 H ASN A 68 6.843 -80.909 -18.827 1.00 24.14 H new ATOM 0 HA ASN A 68 6.396 -80.381 -15.937 1.00 73.40 H new ATOM 0 HB2 ASN A 68 7.351 -78.479 -17.449 1.00 71.15 H new ATOM 0 HB3 ASN A 68 5.766 -78.457 -18.196 1.00 71.15 H new ATOM 0 HD21 ASN A 68 4.440 -77.602 -14.647 1.00 71.23 H new ATOM 0 HD22 ASN A 68 4.410 -79.129 -15.536 1.00 71.23 H new ATOM 1033 N ASN A 69 4.063 -81.159 -16.175 1.00 74.00 N ATOM 1034 CA ASN A 69 2.655 -81.543 -16.239 1.00 52.24 C ATOM 1035 C ASN A 69 1.783 -80.301 -16.423 1.00 5.25 C ATOM 1036 O ASN A 69 2.135 -79.214 -15.952 1.00 52.52 O ATOM 1037 CB ASN A 69 2.245 -82.308 -14.972 1.00 72.13 C ATOM 1038 CG ASN A 69 3.038 -83.593 -14.788 1.00 72.22 C ATOM 1039 OD1 ASN A 69 2.635 -84.661 -15.252 1.00 2.34 O ATOM 1040 ND2 ASN A 69 4.176 -83.498 -14.115 1.00 31.15 N ATOM 0 H ASN A 69 4.510 -81.351 -15.279 1.00 74.00 H new ATOM 0 HA ASN A 69 2.510 -82.203 -17.095 1.00 52.24 H new ATOM 0 HB2 ASN A 69 2.389 -81.668 -14.102 1.00 72.13 H new ATOM 0 HB3 ASN A 69 1.182 -82.544 -15.022 1.00 72.13 H new ATOM 0 HD21 ASN A 69 4.751 -84.327 -13.966 1.00 31.15 H new ATOM 0 HD22 ASN A 69 4.476 -82.596 -13.746 1.00 31.15 H new ATOM 1047 N GLU A 70 0.651 -80.474 -17.102 1.00 63.52 N ATOM 1048 CA GLU A 70 -0.234 -79.363 -17.472 1.00 54.22 C ATOM 1049 C GLU A 70 -0.575 -78.469 -16.276 1.00 23.41 C ATOM 1050 O GLU A 70 -0.623 -77.242 -16.401 1.00 22.31 O ATOM 1051 CB GLU A 70 -1.528 -79.907 -18.094 1.00 35.24 C ATOM 1052 CG GLU A 70 -2.322 -80.815 -17.159 1.00 73.50 C ATOM 1053 CD GLU A 70 -3.659 -81.246 -17.739 1.00 44.50 C ATOM 1054 OE1 GLU A 70 -4.642 -80.483 -17.615 1.00 32.11 O ATOM 1055 OE2 GLU A 70 -3.740 -82.355 -18.312 1.00 22.30 O ATOM 0 H GLU A 70 0.318 -81.387 -17.413 1.00 63.52 H new ATOM 0 HA GLU A 70 0.301 -78.752 -18.199 1.00 54.22 H new ATOM 0 HB2 GLU A 70 -2.157 -79.069 -18.394 1.00 35.24 H new ATOM 0 HB3 GLU A 70 -1.281 -80.460 -19.000 1.00 35.24 H new ATOM 0 HG2 GLU A 70 -1.729 -81.701 -16.932 1.00 73.50 H new ATOM 0 HG3 GLU A 70 -2.492 -80.296 -16.216 1.00 73.50 H new ATOM 1062 N ASP A 71 -0.784 -79.091 -15.118 1.00 53.44 N ATOM 1063 CA ASP A 71 -1.265 -78.393 -13.922 1.00 52.32 C ATOM 1064 C ASP A 71 -0.193 -77.479 -13.337 1.00 60.33 C ATOM 1065 O ASP A 71 -0.500 -76.562 -12.572 1.00 61.33 O ATOM 1066 CB ASP A 71 -1.690 -79.412 -12.863 1.00 72.43 C ATOM 1067 CG ASP A 71 -0.503 -80.185 -12.317 1.00 73.01 C ATOM 1068 OD1 ASP A 71 -0.021 -81.103 -13.008 1.00 44.11 O ATOM 1069 OD2 ASP A 71 -0.027 -79.856 -11.210 1.00 23.34 O ATOM 0 H ASP A 71 -0.626 -80.089 -14.979 1.00 53.44 H new ATOM 0 HA ASP A 71 -2.116 -77.779 -14.216 1.00 52.32 H new ATOM 0 HB2 ASP A 71 -2.196 -78.898 -12.046 1.00 72.43 H new ATOM 0 HB3 ASP A 71 -2.409 -80.108 -13.296 1.00 72.43 H new ATOM 1074 N GLY A 72 1.063 -77.731 -13.688 1.00 2.22 N ATOM 1075 CA GLY A 72 2.152 -76.914 -13.187 1.00 24.21 C ATOM 1076 C GLY A 72 3.267 -77.733 -12.573 1.00 64.40 C ATOM 1077 O GLY A 72 4.420 -77.306 -12.570 1.00 24.14 O ATOM 0 H GLY A 72 1.347 -78.487 -14.311 1.00 2.22 H new ATOM 0 HA2 GLY A 72 2.555 -76.314 -14.003 1.00 24.21 H new ATOM 0 HA3 GLY A 72 1.765 -76.219 -12.442 1.00 24.21 H new ATOM 1081 N SER A 73 2.929 -78.909 -12.055 1.00 74.30 N ATOM 1082 CA SER A 73 3.921 -79.782 -11.436 1.00 53.52 C ATOM 1083 C SER A 73 4.961 -80.241 -12.465 1.00 5.24 C ATOM 1084 O SER A 73 4.609 -80.693 -13.558 1.00 20.32 O ATOM 1085 CB SER A 73 3.233 -80.997 -10.803 1.00 23.04 C ATOM 1086 OG SER A 73 2.287 -80.592 -9.827 1.00 33.31 O ATOM 0 H SER A 73 1.979 -79.279 -12.051 1.00 74.30 H new ATOM 0 HA SER A 73 4.435 -79.219 -10.657 1.00 53.52 H new ATOM 0 HB2 SER A 73 2.736 -81.582 -11.577 1.00 23.04 H new ATOM 0 HB3 SER A 73 3.980 -81.645 -10.344 1.00 23.04 H new ATOM 0 HG SER A 73 1.455 -80.322 -10.270 1.00 33.31 H new ATOM 1092 N VAL A 74 6.237 -80.123 -12.111 1.00 2.14 N ATOM 1093 CA VAL A 74 7.330 -80.536 -12.992 1.00 23.14 C ATOM 1094 C VAL A 74 7.891 -81.869 -12.507 1.00 45.15 C ATOM 1095 O VAL A 74 8.132 -82.044 -11.314 1.00 50.12 O ATOM 1096 CB VAL A 74 8.466 -79.477 -13.039 1.00 61.55 C ATOM 1097 CG1 VAL A 74 9.532 -79.856 -14.067 1.00 25.24 C ATOM 1098 CG2 VAL A 74 7.898 -78.087 -13.328 1.00 44.21 C ATOM 0 H VAL A 74 6.543 -79.743 -11.215 1.00 2.14 H new ATOM 0 HA VAL A 74 6.931 -80.638 -14.001 1.00 23.14 H new ATOM 0 HB VAL A 74 8.944 -79.453 -12.059 1.00 61.55 H new ATOM 0 HG11 VAL A 74 10.314 -79.097 -14.077 1.00 25.24 H new ATOM 0 HG12 VAL A 74 9.966 -80.820 -13.802 1.00 25.24 H new ATOM 0 HG13 VAL A 74 9.077 -79.922 -15.055 1.00 25.24 H new ATOM 0 HG21 VAL A 74 8.710 -77.361 -13.357 1.00 44.21 H new ATOM 0 HG22 VAL A 74 7.385 -78.096 -14.290 1.00 44.21 H new ATOM 0 HG23 VAL A 74 7.193 -77.812 -12.544 1.00 44.21 H new ATOM 1108 N SER A 75 8.080 -82.810 -13.422 1.00 24.41 N ATOM 1109 CA SER A 75 8.558 -84.141 -13.069 1.00 33.53 C ATOM 1110 C SER A 75 9.725 -84.552 -13.964 1.00 25.55 C ATOM 1111 O SER A 75 9.849 -84.083 -15.098 1.00 44.43 O ATOM 1112 CB SER A 75 7.405 -85.149 -13.171 1.00 45.42 C ATOM 1113 OG SER A 75 6.687 -84.993 -14.387 1.00 50.11 O ATOM 0 H SER A 75 7.909 -82.676 -14.419 1.00 24.41 H new ATOM 0 HA SER A 75 8.920 -84.126 -12.041 1.00 33.53 H new ATOM 0 HB2 SER A 75 7.799 -86.163 -13.107 1.00 45.42 H new ATOM 0 HB3 SER A 75 6.728 -85.016 -12.327 1.00 45.42 H new ATOM 0 HG SER A 75 6.067 -85.744 -14.499 1.00 50.11 H new ATOM 1119 N GLY A 76 10.584 -85.416 -13.438 1.00 32.44 N ATOM 1120 CA GLY A 76 11.730 -85.887 -14.187 1.00 51.54 C ATOM 1121 C GLY A 76 12.622 -86.776 -13.350 1.00 43.42 C ATOM 1122 O GLY A 76 12.229 -87.211 -12.267 1.00 53.55 O ATOM 0 H GLY A 76 10.505 -85.801 -12.497 1.00 32.44 H new ATOM 0 HA2 GLY A 76 11.390 -86.437 -15.064 1.00 51.54 H new ATOM 0 HA3 GLY A 76 12.304 -85.034 -14.548 1.00 51.54 H new ATOM 1126 N VAL A 77 13.823 -87.054 -13.846 1.00 42.05 N ATOM 1127 CA VAL A 77 14.783 -87.901 -13.140 1.00 43.44 C ATOM 1128 C VAL A 77 16.192 -87.333 -13.288 1.00 74.14 C ATOM 1129 O VAL A 77 16.570 -86.874 -14.372 1.00 42.33 O ATOM 1130 CB VAL A 77 14.770 -89.365 -13.669 1.00 53.04 C ATOM 1131 CG1 VAL A 77 15.718 -90.245 -12.856 1.00 73.25 C ATOM 1132 CG2 VAL A 77 13.357 -89.947 -13.662 1.00 44.22 C ATOM 0 H VAL A 77 14.159 -86.702 -14.743 1.00 42.05 H new ATOM 0 HA VAL A 77 14.488 -87.914 -12.091 1.00 43.44 H new ATOM 0 HB VAL A 77 15.118 -89.346 -14.702 1.00 53.04 H new ATOM 0 HG11 VAL A 77 15.692 -91.263 -13.244 1.00 73.25 H new ATOM 0 HG12 VAL A 77 16.733 -89.854 -12.932 1.00 73.25 H new ATOM 0 HG13 VAL A 77 15.407 -90.247 -11.811 1.00 73.25 H new ATOM 0 HG21 VAL A 77 13.383 -90.970 -14.037 1.00 44.22 H new ATOM 0 HG22 VAL A 77 12.967 -89.944 -12.644 1.00 44.22 H new ATOM 0 HG23 VAL A 77 12.712 -89.343 -14.300 1.00 44.22 H new ATOM 1142 N VAL A 78 16.948 -87.353 -12.188 1.00 11.12 N ATOM 1143 CA VAL A 78 18.349 -86.933 -12.174 1.00 13.11 C ATOM 1144 C VAL A 78 19.242 -88.117 -11.816 1.00 3.40 C ATOM 1145 O VAL A 78 18.923 -88.900 -10.918 1.00 63.53 O ATOM 1146 CB VAL A 78 18.611 -85.786 -11.158 1.00 55.53 C ATOM 1147 CG1 VAL A 78 20.108 -85.500 -11.023 1.00 52.34 C ATOM 1148 CG2 VAL A 78 17.865 -84.519 -11.561 1.00 23.42 C ATOM 0 H VAL A 78 16.603 -87.662 -11.279 1.00 11.12 H new ATOM 0 HA VAL A 78 18.581 -86.563 -13.173 1.00 13.11 H new ATOM 0 HB VAL A 78 18.236 -86.113 -10.188 1.00 55.53 H new ATOM 0 HG11 VAL A 78 20.261 -84.693 -10.306 1.00 52.34 H new ATOM 0 HG12 VAL A 78 20.620 -86.397 -10.675 1.00 52.34 H new ATOM 0 HG13 VAL A 78 20.511 -85.205 -11.992 1.00 52.34 H new ATOM 0 HG21 VAL A 78 18.065 -83.732 -10.834 1.00 23.42 H new ATOM 0 HG22 VAL A 78 18.201 -84.197 -12.546 1.00 23.42 H new ATOM 0 HG23 VAL A 78 16.794 -84.721 -11.591 1.00 23.42 H new ATOM 1158 N GLN A 79 20.357 -88.237 -12.520 1.00 61.04 N ATOM 1159 CA GLN A 79 21.321 -89.306 -12.288 1.00 72.34 C ATOM 1160 C GLN A 79 22.745 -88.772 -12.463 1.00 51.25 C ATOM 1161 O GLN A 79 23.063 -88.142 -13.476 1.00 1.41 O ATOM 1162 CB GLN A 79 21.038 -90.478 -13.244 1.00 75.34 C ATOM 1163 CG GLN A 79 20.661 -90.027 -14.649 1.00 65.40 C ATOM 1164 CD GLN A 79 20.441 -91.163 -15.634 1.00 13.34 C ATOM 1165 OE1 GLN A 79 19.652 -91.037 -16.568 1.00 12.03 O ATOM 1166 NE2 GLN A 79 21.139 -92.271 -15.446 1.00 41.24 N ATOM 0 H GLN A 79 20.621 -87.597 -13.269 1.00 61.04 H new ATOM 0 HA GLN A 79 21.224 -89.672 -11.266 1.00 72.34 H new ATOM 0 HB2 GLN A 79 21.920 -91.116 -13.298 1.00 75.34 H new ATOM 0 HB3 GLN A 79 20.231 -91.085 -12.835 1.00 75.34 H new ATOM 0 HG2 GLN A 79 19.752 -89.429 -14.594 1.00 65.40 H new ATOM 0 HG3 GLN A 79 21.447 -89.377 -15.032 1.00 65.40 H new ATOM 0 HE21 GLN A 79 21.785 -92.340 -14.659 1.00 41.24 H new ATOM 0 HE22 GLN A 79 21.031 -93.057 -16.088 1.00 41.24 H new ATOM 1175 N GLY A 80 23.581 -89.000 -11.454 1.00 73.20 N ATOM 1176 CA GLY A 80 24.960 -88.537 -11.472 1.00 70.11 C ATOM 1177 C GLY A 80 25.613 -88.688 -10.106 1.00 45.11 C ATOM 1178 O GLY A 80 25.330 -89.654 -9.393 1.00 30.00 O ATOM 0 H GLY A 80 23.322 -89.507 -10.608 1.00 73.20 H new ATOM 0 HA2 GLY A 80 25.526 -89.103 -12.212 1.00 70.11 H new ATOM 0 HA3 GLY A 80 24.991 -87.491 -11.778 1.00 70.11 H new ATOM 1182 N PRO A 81 26.485 -87.747 -9.700 1.00 21.24 N ATOM 1183 CA PRO A 81 27.120 -87.776 -8.384 1.00 24.25 C ATOM 1184 C PRO A 81 26.174 -87.262 -7.300 1.00 43.11 C ATOM 1185 O PRO A 81 25.604 -86.180 -7.436 1.00 61.12 O ATOM 1186 CB PRO A 81 28.330 -86.837 -8.519 1.00 14.12 C ATOM 1187 CG PRO A 81 28.258 -86.237 -9.899 1.00 1.43 C ATOM 1188 CD PRO A 81 26.909 -86.580 -10.480 1.00 73.32 C ATOM 0 HA PRO A 81 27.399 -88.788 -8.092 1.00 24.25 H new ATOM 0 HB2 PRO A 81 28.303 -86.059 -7.756 1.00 14.12 H new ATOM 0 HB3 PRO A 81 29.262 -87.385 -8.383 1.00 14.12 H new ATOM 0 HG2 PRO A 81 28.391 -85.156 -9.853 1.00 1.43 H new ATOM 0 HG3 PRO A 81 29.056 -86.630 -10.529 1.00 1.43 H new ATOM 0 HD2 PRO A 81 26.206 -85.753 -10.378 1.00 73.32 H new ATOM 0 HD3 PRO A 81 26.977 -86.811 -11.543 1.00 73.32 H new ATOM 1196 N LYS A 82 26.035 -88.030 -6.222 1.00 34.24 N ATOM 1197 CA LYS A 82 25.114 -87.704 -5.126 1.00 65.22 C ATOM 1198 C LYS A 82 25.208 -86.241 -4.678 1.00 10.03 C ATOM 1199 O LYS A 82 24.200 -85.640 -4.302 1.00 13.55 O ATOM 1200 CB LYS A 82 25.329 -88.667 -3.933 1.00 54.13 C ATOM 1201 CG LYS A 82 26.785 -89.079 -3.674 1.00 14.43 C ATOM 1202 CD LYS A 82 27.612 -87.993 -2.984 1.00 71.14 C ATOM 1203 CE LYS A 82 27.093 -87.670 -1.585 1.00 51.01 C ATOM 1204 NZ LYS A 82 28.015 -86.770 -0.840 1.00 4.33 N ATOM 0 H LYS A 82 26.555 -88.896 -6.080 1.00 34.24 H new ATOM 0 HA LYS A 82 24.104 -87.839 -5.512 1.00 65.22 H new ATOM 0 HB2 LYS A 82 24.937 -88.195 -3.032 1.00 54.13 H new ATOM 0 HB3 LYS A 82 24.739 -89.568 -4.104 1.00 54.13 H new ATOM 0 HG2 LYS A 82 26.796 -89.979 -3.059 1.00 14.43 H new ATOM 0 HG3 LYS A 82 27.256 -89.336 -4.623 1.00 14.43 H new ATOM 0 HD2 LYS A 82 28.650 -88.317 -2.918 1.00 71.14 H new ATOM 0 HD3 LYS A 82 27.599 -87.088 -3.592 1.00 71.14 H new ATOM 0 HE2 LYS A 82 26.112 -87.200 -1.662 1.00 51.01 H new ATOM 0 HE3 LYS A 82 26.960 -88.596 -1.025 1.00 51.01 H new ATOM 0 HZ1 LYS A 82 27.624 -86.577 0.104 1.00 4.33 H new ATOM 0 HZ2 LYS A 82 28.944 -87.228 -0.743 1.00 4.33 H new ATOM 0 HZ3 LYS A 82 28.122 -85.876 -1.360 1.00 4.33 H new ATOM 1218 N GLU A 83 26.409 -85.672 -4.712 1.00 45.34 N ATOM 1219 CA GLU A 83 26.611 -84.291 -4.271 1.00 53.14 C ATOM 1220 C GLU A 83 25.986 -83.294 -5.252 1.00 41.52 C ATOM 1221 O GLU A 83 25.327 -82.334 -4.845 1.00 1.31 O ATOM 1222 CB GLU A 83 28.099 -84.004 -4.038 1.00 53.44 C ATOM 1223 CG GLU A 83 29.021 -84.554 -5.115 1.00 34.25 C ATOM 1224 CD GLU A 83 30.479 -84.247 -4.830 1.00 42.22 C ATOM 1225 OE1 GLU A 83 30.959 -83.177 -5.247 1.00 53.32 O ATOM 1226 OE2 GLU A 83 31.147 -85.072 -4.171 1.00 25.22 O ATOM 0 H GLU A 83 27.254 -86.140 -5.038 1.00 45.34 H new ATOM 0 HA GLU A 83 26.098 -84.164 -3.318 1.00 53.14 H new ATOM 0 HB2 GLU A 83 28.242 -82.926 -3.970 1.00 53.44 H new ATOM 0 HB3 GLU A 83 28.392 -84.426 -3.076 1.00 53.44 H new ATOM 0 HG2 GLU A 83 28.886 -85.633 -5.190 1.00 34.25 H new ATOM 0 HG3 GLU A 83 28.744 -84.130 -6.080 1.00 34.25 H new ATOM 1233 N GLN A 84 26.194 -83.524 -6.544 1.00 71.32 N ATOM 1234 CA GLN A 84 25.607 -82.674 -7.580 1.00 73.41 C ATOM 1235 C GLN A 84 24.092 -82.897 -7.659 1.00 4.41 C ATOM 1236 O GLN A 84 23.330 -81.968 -7.930 1.00 35.12 O ATOM 1237 CB GLN A 84 26.273 -82.940 -8.939 1.00 70.43 C ATOM 1238 CG GLN A 84 27.646 -82.282 -9.113 1.00 43.51 C ATOM 1239 CD GLN A 84 28.675 -82.717 -8.081 1.00 53.33 C ATOM 1240 OE1 GLN A 84 29.378 -83.709 -8.267 1.00 64.14 O ATOM 1241 NE2 GLN A 84 28.783 -81.971 -6.992 1.00 5.13 N ATOM 0 H GLN A 84 26.764 -84.291 -6.901 1.00 71.32 H new ATOM 0 HA GLN A 84 25.785 -81.631 -7.316 1.00 73.41 H new ATOM 0 HB2 GLN A 84 26.380 -84.016 -9.072 1.00 70.43 H new ATOM 0 HB3 GLN A 84 25.611 -82.585 -9.729 1.00 70.43 H new ATOM 0 HG2 GLN A 84 28.025 -82.513 -10.109 1.00 43.51 H new ATOM 0 HG3 GLN A 84 27.528 -81.200 -9.060 1.00 43.51 H new ATOM 0 HE21 GLN A 84 28.183 -81.155 -6.871 1.00 5.13 H new ATOM 0 HE22 GLN A 84 29.466 -82.212 -6.274 1.00 5.13 H new ATOM 1250 N VAL A 85 23.665 -84.135 -7.417 1.00 33.13 N ATOM 1251 CA VAL A 85 22.241 -84.461 -7.317 1.00 22.34 C ATOM 1252 C VAL A 85 21.615 -83.640 -6.187 1.00 73.43 C ATOM 1253 O VAL A 85 20.551 -83.037 -6.349 1.00 53.31 O ATOM 1254 CB VAL A 85 22.031 -85.978 -7.053 1.00 44.11 C ATOM 1255 CG1 VAL A 85 20.556 -86.307 -6.823 1.00 71.00 C ATOM 1256 CG2 VAL A 85 22.595 -86.811 -8.206 1.00 25.24 C ATOM 0 H VAL A 85 24.287 -84.933 -7.286 1.00 33.13 H new ATOM 0 HA VAL A 85 21.758 -84.216 -8.263 1.00 22.34 H new ATOM 0 HB VAL A 85 22.574 -86.233 -6.143 1.00 44.11 H new ATOM 0 HG11 VAL A 85 20.446 -87.376 -6.642 1.00 71.00 H new ATOM 0 HG12 VAL A 85 20.190 -85.753 -5.959 1.00 71.00 H new ATOM 0 HG13 VAL A 85 19.979 -86.027 -7.704 1.00 71.00 H new ATOM 0 HG21 VAL A 85 22.438 -87.870 -8.001 1.00 25.24 H new ATOM 0 HG22 VAL A 85 22.087 -86.541 -9.132 1.00 25.24 H new ATOM 0 HG23 VAL A 85 23.663 -86.616 -8.308 1.00 25.24 H new ATOM 1266 N ASP A 86 22.309 -83.607 -5.048 1.00 15.30 N ATOM 1267 CA ASP A 86 21.912 -82.768 -3.915 1.00 63.23 C ATOM 1268 C ASP A 86 21.777 -81.316 -4.364 1.00 64.31 C ATOM 1269 O ASP A 86 20.764 -80.661 -4.107 1.00 72.04 O ATOM 1270 CB ASP A 86 22.951 -82.877 -2.789 1.00 35.40 C ATOM 1271 CG ASP A 86 22.717 -81.880 -1.660 1.00 14.31 C ATOM 1272 OD1 ASP A 86 21.984 -82.211 -0.705 1.00 32.10 O ATOM 1273 OD2 ASP A 86 23.281 -80.763 -1.710 1.00 61.35 O ATOM 0 H ASP A 86 23.154 -84.155 -4.885 1.00 15.30 H new ATOM 0 HA ASP A 86 20.949 -83.113 -3.540 1.00 63.23 H new ATOM 0 HB2 ASP A 86 22.932 -83.888 -2.382 1.00 35.40 H new ATOM 0 HB3 ASP A 86 23.946 -82.719 -3.205 1.00 35.40 H new ATOM 1278 N ALA A 87 22.806 -80.831 -5.051 1.00 21.34 N ATOM 1279 CA ALA A 87 22.816 -79.472 -5.583 1.00 34.53 C ATOM 1280 C ALA A 87 21.583 -79.212 -6.446 1.00 20.20 C ATOM 1281 O ALA A 87 20.994 -78.125 -6.404 1.00 62.15 O ATOM 1282 CB ALA A 87 24.088 -79.232 -6.390 1.00 10.13 C ATOM 0 H ALA A 87 23.651 -81.364 -5.254 1.00 21.34 H new ATOM 0 HA ALA A 87 22.793 -78.777 -4.743 1.00 34.53 H new ATOM 0 HB1 ALA A 87 24.084 -78.215 -6.782 1.00 10.13 H new ATOM 0 HB2 ALA A 87 24.958 -79.370 -5.748 1.00 10.13 H new ATOM 0 HB3 ALA A 87 24.132 -79.939 -7.218 1.00 10.13 H new ATOM 1288 N PHE A 88 21.192 -80.220 -7.221 1.00 23.24 N ATOM 1289 CA PHE A 88 20.037 -80.105 -8.106 1.00 53.22 C ATOM 1290 C PHE A 88 18.747 -80.064 -7.285 1.00 41.43 C ATOM 1291 O PHE A 88 17.789 -79.381 -7.652 1.00 24.23 O ATOM 1292 CB PHE A 88 20.010 -81.268 -9.110 1.00 13.44 C ATOM 1293 CG PHE A 88 19.289 -80.936 -10.396 1.00 60.45 C ATOM 1294 CD1 PHE A 88 17.917 -81.113 -10.518 1.00 41.43 C ATOM 1295 CD2 PHE A 88 19.992 -80.437 -11.484 1.00 2.04 C ATOM 1296 CE1 PHE A 88 17.265 -80.802 -11.698 1.00 43.45 C ATOM 1297 CE2 PHE A 88 19.344 -80.124 -12.663 1.00 65.45 C ATOM 1298 CZ PHE A 88 17.979 -80.307 -12.771 1.00 72.11 C ATOM 0 H PHE A 88 21.659 -81.126 -7.254 1.00 23.24 H new ATOM 0 HA PHE A 88 20.117 -79.175 -8.669 1.00 53.22 H new ATOM 0 HB2 PHE A 88 21.034 -81.562 -9.342 1.00 13.44 H new ATOM 0 HB3 PHE A 88 19.529 -82.129 -8.645 1.00 13.44 H new ATOM 0 HD1 PHE A 88 17.352 -81.498 -9.682 1.00 41.43 H new ATOM 0 HD2 PHE A 88 21.059 -80.292 -11.408 1.00 2.04 H new ATOM 0 HE1 PHE A 88 16.198 -80.946 -11.780 1.00 43.45 H new ATOM 0 HE2 PHE A 88 19.905 -79.736 -13.501 1.00 65.45 H new ATOM 0 HZ PHE A 88 17.472 -80.063 -13.693 1.00 72.11 H new ATOM 1308 N VAL A 89 18.728 -80.792 -6.166 1.00 5.13 N ATOM 1309 CA VAL A 89 17.597 -80.730 -5.232 1.00 63.22 C ATOM 1310 C VAL A 89 17.447 -79.307 -4.696 1.00 22.42 C ATOM 1311 O VAL A 89 16.339 -78.767 -4.613 1.00 63.11 O ATOM 1312 CB VAL A 89 17.758 -81.705 -4.033 1.00 62.24 C ATOM 1313 CG1 VAL A 89 16.573 -81.588 -3.070 1.00 41.30 C ATOM 1314 CG2 VAL A 89 17.915 -83.147 -4.516 1.00 71.34 C ATOM 0 H VAL A 89 19.475 -81.427 -5.884 1.00 5.13 H new ATOM 0 HA VAL A 89 16.709 -81.029 -5.789 1.00 63.22 H new ATOM 0 HB VAL A 89 18.664 -81.425 -3.496 1.00 62.24 H new ATOM 0 HG11 VAL A 89 16.709 -82.281 -2.239 1.00 41.30 H new ATOM 0 HG12 VAL A 89 16.515 -80.569 -2.687 1.00 41.30 H new ATOM 0 HG13 VAL A 89 15.650 -81.831 -3.597 1.00 41.30 H new ATOM 0 HG21 VAL A 89 18.026 -83.808 -3.657 1.00 71.34 H new ATOM 0 HG22 VAL A 89 17.033 -83.438 -5.086 1.00 71.34 H new ATOM 0 HG23 VAL A 89 18.798 -83.224 -5.150 1.00 71.34 H new ATOM 1324 N LYS A 90 18.579 -78.701 -4.343 1.00 72.24 N ATOM 1325 CA LYS A 90 18.598 -77.320 -3.868 1.00 63.21 C ATOM 1326 C LYS A 90 18.112 -76.374 -4.968 1.00 31.12 C ATOM 1327 O LYS A 90 17.377 -75.426 -4.697 1.00 14.12 O ATOM 1328 CB LYS A 90 20.006 -76.923 -3.384 1.00 12.24 C ATOM 1329 CG LYS A 90 20.320 -77.360 -1.950 1.00 73.32 C ATOM 1330 CD LYS A 90 20.118 -78.859 -1.740 1.00 40.24 C ATOM 1331 CE LYS A 90 20.416 -79.283 -0.306 1.00 1.53 C ATOM 1332 NZ LYS A 90 21.840 -79.060 0.058 1.00 60.33 N ATOM 0 H LYS A 90 19.496 -79.146 -4.377 1.00 72.24 H new ATOM 0 HA LYS A 90 17.920 -77.239 -3.019 1.00 63.21 H new ATOM 0 HB2 LYS A 90 20.746 -77.359 -4.056 1.00 12.24 H new ATOM 0 HB3 LYS A 90 20.111 -75.840 -3.454 1.00 12.24 H new ATOM 0 HG2 LYS A 90 21.351 -77.098 -1.711 1.00 73.32 H new ATOM 0 HG3 LYS A 90 19.683 -76.810 -1.258 1.00 73.32 H new ATOM 0 HD2 LYS A 90 19.091 -79.124 -1.990 1.00 40.24 H new ATOM 0 HD3 LYS A 90 20.765 -79.411 -2.422 1.00 40.24 H new ATOM 0 HE2 LYS A 90 19.776 -78.725 0.377 1.00 1.53 H new ATOM 0 HE3 LYS A 90 20.171 -80.338 -0.182 1.00 1.53 H new ATOM 0 HZ1 LYS A 90 22.018 -79.439 1.010 1.00 60.33 H new ATOM 0 HZ2 LYS A 90 22.454 -79.544 -0.628 1.00 60.33 H new ATOM 0 HZ3 LYS A 90 22.046 -78.041 0.047 1.00 60.33 H new ATOM 1346 N TYR A 91 18.505 -76.659 -6.212 1.00 10.11 N ATOM 1347 CA TYR A 91 18.033 -75.891 -7.363 1.00 12.44 C ATOM 1348 C TYR A 91 16.511 -75.981 -7.454 1.00 44.40 C ATOM 1349 O TYR A 91 15.825 -74.980 -7.663 1.00 2.03 O ATOM 1350 CB TYR A 91 18.681 -76.403 -8.661 1.00 54.24 C ATOM 1351 CG TYR A 91 18.000 -75.908 -9.924 1.00 52.31 C ATOM 1352 CD1 TYR A 91 18.236 -74.629 -10.417 1.00 71.31 C ATOM 1353 CD2 TYR A 91 17.109 -76.723 -10.614 1.00 52.30 C ATOM 1354 CE1 TYR A 91 17.603 -74.179 -11.560 1.00 23.41 C ATOM 1355 CE2 TYR A 91 16.475 -76.280 -11.759 1.00 24.51 C ATOM 1356 CZ TYR A 91 16.723 -75.007 -12.228 1.00 4.44 C ATOM 1357 OH TYR A 91 16.084 -74.559 -13.365 1.00 53.33 O ATOM 0 H TYR A 91 19.148 -77.415 -6.446 1.00 10.11 H new ATOM 0 HA TYR A 91 18.320 -74.848 -7.231 1.00 12.44 H new ATOM 0 HB2 TYR A 91 19.727 -76.096 -8.679 1.00 54.24 H new ATOM 0 HB3 TYR A 91 18.669 -77.493 -8.656 1.00 54.24 H new ATOM 0 HD1 TYR A 91 18.924 -73.978 -9.899 1.00 71.31 H new ATOM 0 HD2 TYR A 91 16.909 -77.719 -10.249 1.00 52.30 H new ATOM 0 HE1 TYR A 91 17.796 -73.183 -11.930 1.00 23.41 H new ATOM 0 HE2 TYR A 91 15.789 -76.928 -12.284 1.00 24.51 H new ATOM 0 HH TYR A 91 15.902 -75.318 -13.958 1.00 53.33 H new ATOM 1367 N LEU A 92 15.997 -77.192 -7.274 1.00 51.34 N ATOM 1368 CA LEU A 92 14.560 -77.440 -7.292 1.00 60.14 C ATOM 1369 C LEU A 92 13.867 -76.681 -6.159 1.00 5.34 C ATOM 1370 O LEU A 92 12.746 -76.198 -6.315 1.00 21.55 O ATOM 1371 CB LEU A 92 14.280 -78.952 -7.187 1.00 42.10 C ATOM 1372 CG LEU A 92 13.709 -79.597 -8.458 1.00 14.12 C ATOM 1373 CD1 LEU A 92 12.342 -79.007 -8.780 1.00 1.11 C ATOM 1374 CD2 LEU A 92 14.667 -79.414 -9.634 1.00 4.50 C ATOM 0 H LEU A 92 16.561 -78.026 -7.112 1.00 51.34 H new ATOM 0 HA LEU A 92 14.156 -77.078 -8.237 1.00 60.14 H new ATOM 0 HB2 LEU A 92 15.208 -79.461 -6.925 1.00 42.10 H new ATOM 0 HB3 LEU A 92 13.582 -79.121 -6.367 1.00 42.10 H new ATOM 0 HG LEU A 92 13.592 -80.666 -8.281 1.00 14.12 H new ATOM 0 HD11 LEU A 92 11.948 -79.473 -9.683 1.00 1.11 H new ATOM 0 HD12 LEU A 92 11.661 -79.193 -7.950 1.00 1.11 H new ATOM 0 HD13 LEU A 92 12.437 -77.933 -8.938 1.00 1.11 H new ATOM 0 HD21 LEU A 92 14.243 -79.878 -10.524 1.00 4.50 H new ATOM 0 HD22 LEU A 92 14.819 -78.350 -9.817 1.00 4.50 H new ATOM 0 HD23 LEU A 92 15.623 -79.883 -9.401 1.00 4.50 H new ATOM 1386 N HIS A 93 14.550 -76.581 -5.023 1.00 5.42 N ATOM 1387 CA HIS A 93 14.028 -75.841 -3.872 1.00 23.34 C ATOM 1388 C HIS A 93 14.089 -74.332 -4.123 1.00 11.23 C ATOM 1389 O HIS A 93 13.367 -73.560 -3.488 1.00 14.15 O ATOM 1390 CB HIS A 93 14.799 -76.207 -2.592 1.00 35.40 C ATOM 1391 CG HIS A 93 14.433 -77.548 -2.024 1.00 30.45 C ATOM 1392 ND1 HIS A 93 14.506 -77.841 -0.680 1.00 2.31 N ATOM 1393 CD2 HIS A 93 13.978 -78.676 -2.624 1.00 73.34 C ATOM 1394 CE1 HIS A 93 14.112 -79.083 -0.477 1.00 65.23 C ATOM 1395 NE2 HIS A 93 13.785 -79.615 -1.640 1.00 2.30 N ATOM 0 H HIS A 93 15.467 -77.002 -4.872 1.00 5.42 H new ATOM 0 HA HIS A 93 12.984 -76.123 -3.735 1.00 23.34 H new ATOM 0 HB2 HIS A 93 15.868 -76.194 -2.807 1.00 35.40 H new ATOM 0 HB3 HIS A 93 14.616 -75.442 -1.838 1.00 35.40 H new ATOM 0 HD2 HIS A 93 13.800 -78.811 -3.681 1.00 73.34 H new ATOM 0 HE1 HIS A 93 14.065 -79.581 0.480 1.00 65.23 H new ATOM 0 HE2 HIS A 93 13.445 -80.566 -1.784 1.00 2.30 H new ATOM 1404 N LYS A 94 14.955 -73.917 -5.044 1.00 64.43 N ATOM 1405 CA LYS A 94 15.040 -72.513 -5.445 1.00 13.01 C ATOM 1406 C LYS A 94 13.975 -72.201 -6.495 1.00 4.10 C ATOM 1407 O LYS A 94 13.432 -71.098 -6.533 1.00 53.20 O ATOM 1408 CB LYS A 94 16.440 -72.186 -5.995 1.00 13.44 C ATOM 1409 CG LYS A 94 17.559 -72.343 -4.968 1.00 34.11 C ATOM 1410 CD LYS A 94 17.381 -71.393 -3.785 1.00 31.12 C ATOM 1411 CE LYS A 94 18.440 -71.623 -2.712 1.00 75.41 C ATOM 1412 NZ LYS A 94 19.821 -71.420 -3.227 1.00 1.31 N ATOM 0 H LYS A 94 15.609 -74.533 -5.528 1.00 64.43 H new ATOM 0 HA LYS A 94 14.864 -71.893 -4.566 1.00 13.01 H new ATOM 0 HB2 LYS A 94 16.647 -72.836 -6.845 1.00 13.44 H new ATOM 0 HB3 LYS A 94 16.443 -71.162 -6.368 1.00 13.44 H new ATOM 0 HG2 LYS A 94 17.580 -73.372 -4.608 1.00 34.11 H new ATOM 0 HG3 LYS A 94 18.520 -72.153 -5.446 1.00 34.11 H new ATOM 0 HD2 LYS A 94 17.435 -70.362 -4.135 1.00 31.12 H new ATOM 0 HD3 LYS A 94 16.390 -71.531 -3.353 1.00 31.12 H new ATOM 0 HE2 LYS A 94 18.262 -70.944 -1.878 1.00 75.41 H new ATOM 0 HE3 LYS A 94 18.345 -72.637 -2.323 1.00 75.41 H new ATOM 0 HZ1 LYS A 94 20.495 -71.454 -2.436 1.00 1.31 H new ATOM 0 HZ2 LYS A 94 20.051 -72.170 -3.910 1.00 1.31 H new ATOM 0 HZ3 LYS A 94 19.884 -70.494 -3.696 1.00 1.31 H new ATOM 1426 N GLY A 95 13.680 -73.190 -7.337 1.00 31.54 N ATOM 1427 CA GLY A 95 12.679 -73.026 -8.376 1.00 21.24 C ATOM 1428 C GLY A 95 13.149 -72.103 -9.484 1.00 10.52 C ATOM 1429 O GLY A 95 14.270 -72.243 -9.982 1.00 3.03 O ATOM 0 H GLY A 95 14.122 -74.109 -7.316 1.00 31.54 H new ATOM 0 HA2 GLY A 95 12.432 -74.000 -8.797 1.00 21.24 H new ATOM 0 HA3 GLY A 95 11.764 -72.628 -7.937 1.00 21.24 H new ATOM 1433 N SER A 96 12.300 -71.152 -9.861 1.00 75.45 N ATOM 1434 CA SER A 96 12.614 -70.208 -10.924 1.00 64.44 C ATOM 1435 C SER A 96 11.703 -68.976 -10.818 1.00 73.22 C ATOM 1436 O SER A 96 10.563 -69.094 -10.373 1.00 41.20 O ATOM 1437 CB SER A 96 12.473 -70.888 -12.295 1.00 73.31 C ATOM 1438 OG SER A 96 11.215 -71.523 -12.429 1.00 75.44 O ATOM 0 H SER A 96 11.381 -71.016 -9.440 1.00 75.45 H new ATOM 0 HA SER A 96 13.647 -69.877 -10.817 1.00 64.44 H new ATOM 0 HB2 SER A 96 12.594 -70.147 -13.085 1.00 73.31 H new ATOM 0 HB3 SER A 96 13.268 -71.622 -12.422 1.00 73.31 H new ATOM 0 HG SER A 96 11.154 -71.945 -13.311 1.00 75.44 H new ATOM 1444 N PRO A 97 12.206 -67.788 -11.228 1.00 15.32 N ATOM 1445 CA PRO A 97 11.527 -66.492 -11.061 1.00 63.34 C ATOM 1446 C PRO A 97 10.001 -66.535 -11.240 1.00 3.15 C ATOM 1447 O PRO A 97 9.257 -66.120 -10.347 1.00 13.01 O ATOM 1448 CB PRO A 97 12.173 -65.601 -12.146 1.00 53.52 C ATOM 1449 CG PRO A 97 13.236 -66.435 -12.801 1.00 13.42 C ATOM 1450 CD PRO A 97 13.505 -67.595 -11.881 1.00 51.42 C ATOM 0 HA PRO A 97 11.651 -66.129 -10.041 1.00 63.34 H new ATOM 0 HB2 PRO A 97 11.430 -65.276 -12.875 1.00 53.52 H new ATOM 0 HB3 PRO A 97 12.602 -64.701 -11.705 1.00 53.52 H new ATOM 0 HG2 PRO A 97 12.905 -66.785 -13.779 1.00 13.42 H new ATOM 0 HG3 PRO A 97 14.142 -65.851 -12.962 1.00 13.42 H new ATOM 0 HD2 PRO A 97 13.820 -68.483 -12.429 1.00 51.42 H new ATOM 0 HD3 PRO A 97 14.292 -67.369 -11.161 1.00 51.42 H new ATOM 1458 N LYS A 98 9.539 -67.029 -12.391 1.00 53.54 N ATOM 1459 CA LYS A 98 8.113 -66.974 -12.738 1.00 24.34 C ATOM 1460 C LYS A 98 7.408 -68.303 -12.463 1.00 74.31 C ATOM 1461 O LYS A 98 6.293 -68.528 -12.934 1.00 21.32 O ATOM 1462 CB LYS A 98 7.932 -66.568 -14.211 1.00 51.22 C ATOM 1463 CG LYS A 98 8.544 -65.209 -14.545 1.00 43.41 C ATOM 1464 CD LYS A 98 8.235 -64.751 -15.974 1.00 31.02 C ATOM 1465 CE LYS A 98 6.788 -64.279 -16.147 1.00 2.21 C ATOM 1466 NZ LYS A 98 5.816 -65.404 -16.215 1.00 75.23 N ATOM 0 H LYS A 98 10.127 -67.470 -13.098 1.00 53.54 H new ATOM 0 HA LYS A 98 7.652 -66.219 -12.102 1.00 24.34 H new ATOM 0 HB2 LYS A 98 8.384 -67.328 -14.848 1.00 51.22 H new ATOM 0 HB3 LYS A 98 6.868 -66.547 -14.446 1.00 51.22 H new ATOM 0 HG2 LYS A 98 8.170 -64.465 -13.842 1.00 43.41 H new ATOM 0 HG3 LYS A 98 9.625 -65.260 -14.411 1.00 43.41 H new ATOM 0 HD2 LYS A 98 8.911 -63.940 -16.245 1.00 31.02 H new ATOM 0 HD3 LYS A 98 8.429 -65.572 -16.664 1.00 31.02 H new ATOM 0 HE2 LYS A 98 6.522 -63.626 -15.316 1.00 2.21 H new ATOM 0 HE3 LYS A 98 6.712 -63.684 -17.057 1.00 2.21 H new ATOM 0 HZ1 LYS A 98 5.104 -65.204 -16.946 1.00 75.23 H new ATOM 0 HZ2 LYS A 98 6.319 -66.283 -16.452 1.00 75.23 H new ATOM 0 HZ3 LYS A 98 5.345 -65.512 -15.294 1.00 75.23 H new ATOM 1480 N SER A 99 8.049 -69.171 -11.694 1.00 22.33 N ATOM 1481 CA SER A 99 7.445 -70.435 -11.298 1.00 33.13 C ATOM 1482 C SER A 99 7.461 -70.541 -9.774 1.00 51.15 C ATOM 1483 O SER A 99 8.454 -70.967 -9.177 1.00 65.20 O ATOM 1484 CB SER A 99 8.184 -71.618 -11.941 1.00 24.15 C ATOM 1485 OG SER A 99 7.521 -72.846 -11.684 1.00 42.35 O ATOM 0 H SER A 99 8.990 -69.022 -11.331 1.00 22.33 H new ATOM 0 HA SER A 99 6.413 -70.468 -11.647 1.00 33.13 H new ATOM 0 HB2 SER A 99 8.258 -71.461 -13.017 1.00 24.15 H new ATOM 0 HB3 SER A 99 9.202 -71.665 -11.555 1.00 24.15 H new ATOM 0 HG SER A 99 8.015 -73.579 -12.107 1.00 42.35 H new ATOM 1491 N VAL A 100 6.367 -70.110 -9.145 1.00 74.22 N ATOM 1492 CA VAL A 100 6.283 -70.085 -7.689 1.00 45.42 C ATOM 1493 C VAL A 100 6.042 -71.484 -7.143 1.00 51.00 C ATOM 1494 O VAL A 100 4.906 -71.937 -7.013 1.00 74.34 O ATOM 1495 CB VAL A 100 5.182 -69.131 -7.173 1.00 21.34 C ATOM 1496 CG1 VAL A 100 5.190 -69.101 -5.646 1.00 13.01 C ATOM 1497 CG2 VAL A 100 5.369 -67.731 -7.752 1.00 20.43 C ATOM 0 H VAL A 100 5.530 -69.775 -9.622 1.00 74.22 H new ATOM 0 HA VAL A 100 7.241 -69.709 -7.329 1.00 45.42 H new ATOM 0 HB VAL A 100 4.211 -69.500 -7.504 1.00 21.34 H new ATOM 0 HG11 VAL A 100 4.411 -68.426 -5.291 1.00 13.01 H new ATOM 0 HG12 VAL A 100 5.004 -70.104 -5.261 1.00 13.01 H new ATOM 0 HG13 VAL A 100 6.161 -68.752 -5.294 1.00 13.01 H new ATOM 0 HG21 VAL A 100 4.584 -67.074 -7.377 1.00 20.43 H new ATOM 0 HG22 VAL A 100 6.342 -67.341 -7.454 1.00 20.43 H new ATOM 0 HG23 VAL A 100 5.315 -67.777 -8.840 1.00 20.43 H new ATOM 1507 N VAL A 101 7.132 -72.155 -6.840 1.00 73.33 N ATOM 1508 CA VAL A 101 7.096 -73.531 -6.355 1.00 33.12 C ATOM 1509 C VAL A 101 6.499 -73.601 -4.950 1.00 14.21 C ATOM 1510 O VAL A 101 6.713 -72.707 -4.125 1.00 71.23 O ATOM 1511 CB VAL A 101 8.507 -74.179 -6.360 1.00 1.53 C ATOM 1512 CG1 VAL A 101 9.046 -74.284 -7.788 1.00 0.11 C ATOM 1513 CG2 VAL A 101 9.472 -73.392 -5.472 1.00 23.20 C ATOM 0 H VAL A 101 8.072 -71.768 -6.921 1.00 73.33 H new ATOM 0 HA VAL A 101 6.460 -74.093 -7.039 1.00 33.12 H new ATOM 0 HB VAL A 101 8.420 -75.186 -5.952 1.00 1.53 H new ATOM 0 HG11 VAL A 101 10.036 -74.741 -7.771 1.00 0.11 H new ATOM 0 HG12 VAL A 101 8.373 -74.898 -8.387 1.00 0.11 H new ATOM 0 HG13 VAL A 101 9.114 -73.288 -8.226 1.00 0.11 H new ATOM 0 HG21 VAL A 101 10.453 -73.866 -5.492 1.00 23.20 H new ATOM 0 HG22 VAL A 101 9.555 -72.370 -5.841 1.00 23.20 H new ATOM 0 HG23 VAL A 101 9.096 -73.379 -4.449 1.00 23.20 H new ATOM 1523 N LYS A 102 5.739 -74.660 -4.692 1.00 25.24 N ATOM 1524 CA LYS A 102 5.085 -74.855 -3.402 1.00 22.23 C ATOM 1525 C LYS A 102 5.789 -75.954 -2.605 1.00 52.51 C ATOM 1526 O LYS A 102 6.259 -75.725 -1.489 1.00 64.20 O ATOM 1527 CB LYS A 102 3.605 -75.216 -3.613 1.00 14.41 C ATOM 1528 CG LYS A 102 2.808 -74.152 -4.368 1.00 2.24 C ATOM 1529 CD LYS A 102 2.692 -72.849 -3.580 1.00 35.55 C ATOM 1530 CE LYS A 102 1.903 -73.028 -2.286 1.00 34.44 C ATOM 1531 NZ LYS A 102 0.490 -73.415 -2.543 1.00 11.03 N ATOM 0 H LYS A 102 5.559 -75.404 -5.367 1.00 25.24 H new ATOM 0 HA LYS A 102 5.146 -73.926 -2.835 1.00 22.23 H new ATOM 0 HB2 LYS A 102 3.545 -76.157 -4.160 1.00 14.41 H new ATOM 0 HB3 LYS A 102 3.140 -75.383 -2.641 1.00 14.41 H new ATOM 0 HG2 LYS A 102 3.288 -73.953 -5.326 1.00 2.24 H new ATOM 0 HG3 LYS A 102 1.810 -74.534 -4.584 1.00 2.24 H new ATOM 0 HD2 LYS A 102 3.690 -72.477 -3.347 1.00 35.55 H new ATOM 0 HD3 LYS A 102 2.207 -72.094 -4.198 1.00 35.55 H new ATOM 0 HE2 LYS A 102 2.382 -73.791 -1.672 1.00 34.44 H new ATOM 0 HE3 LYS A 102 1.926 -72.099 -1.716 1.00 34.44 H new ATOM 0 HZ1 LYS A 102 -0.051 -73.361 -1.657 1.00 11.03 H new ATOM 0 HZ2 LYS A 102 0.074 -72.767 -3.242 1.00 11.03 H new ATOM 0 HZ3 LYS A 102 0.458 -74.388 -2.910 1.00 11.03 H new ATOM 1545 N LYS A 103 5.882 -77.145 -3.197 1.00 12.03 N ATOM 1546 CA LYS A 103 6.474 -78.297 -2.518 1.00 72.44 C ATOM 1547 C LYS A 103 7.186 -79.207 -3.515 1.00 14.24 C ATOM 1548 O LYS A 103 6.611 -79.595 -4.532 1.00 53.50 O ATOM 1549 CB LYS A 103 5.387 -79.083 -1.763 1.00 61.22 C ATOM 1550 CG LYS A 103 5.899 -80.338 -1.057 1.00 3.35 C ATOM 1551 CD LYS A 103 4.791 -81.041 -0.272 1.00 22.31 C ATOM 1552 CE LYS A 103 5.280 -82.334 0.369 1.00 15.43 C ATOM 1553 NZ LYS A 103 4.217 -82.993 1.172 1.00 35.52 N ATOM 0 H LYS A 103 5.555 -77.337 -4.144 1.00 12.03 H new ATOM 0 HA LYS A 103 7.210 -77.932 -1.802 1.00 72.44 H new ATOM 0 HB2 LYS A 103 4.926 -78.427 -1.025 1.00 61.22 H new ATOM 0 HB3 LYS A 103 4.606 -79.369 -2.467 1.00 61.22 H new ATOM 0 HG2 LYS A 103 6.314 -81.025 -1.794 1.00 3.35 H new ATOM 0 HG3 LYS A 103 6.709 -80.069 -0.380 1.00 3.35 H new ATOM 0 HD2 LYS A 103 4.414 -80.372 0.502 1.00 22.31 H new ATOM 0 HD3 LYS A 103 3.957 -81.259 -0.938 1.00 22.31 H new ATOM 0 HE2 LYS A 103 5.623 -83.017 -0.408 1.00 15.43 H new ATOM 0 HE3 LYS A 103 6.137 -82.121 1.008 1.00 15.43 H new ATOM 0 HZ1 LYS A 103 4.591 -83.869 1.591 1.00 35.52 H new ATOM 0 HZ2 LYS A 103 3.907 -82.352 1.930 1.00 35.52 H new ATOM 0 HZ3 LYS A 103 3.409 -83.220 0.558 1.00 35.52 H new ATOM 1567 N VAL A 104 8.437 -79.532 -3.220 1.00 20.25 N ATOM 1568 CA VAL A 104 9.232 -80.429 -4.054 1.00 63.52 C ATOM 1569 C VAL A 104 9.202 -81.840 -3.461 1.00 23.40 C ATOM 1570 O VAL A 104 9.131 -82.003 -2.242 1.00 41.12 O ATOM 1571 CB VAL A 104 10.699 -79.947 -4.135 1.00 12.25 C ATOM 1572 CG1 VAL A 104 11.510 -80.792 -5.116 1.00 24.45 C ATOM 1573 CG2 VAL A 104 10.778 -78.463 -4.495 1.00 13.11 C ATOM 0 H VAL A 104 8.930 -79.183 -2.398 1.00 20.25 H new ATOM 0 HA VAL A 104 8.806 -80.434 -5.057 1.00 63.52 H new ATOM 0 HB VAL A 104 11.138 -80.074 -3.145 1.00 12.25 H new ATOM 0 HG11 VAL A 104 12.536 -80.427 -5.149 1.00 24.45 H new ATOM 0 HG12 VAL A 104 11.505 -81.832 -4.790 1.00 24.45 H new ATOM 0 HG13 VAL A 104 11.068 -80.721 -6.110 1.00 24.45 H new ATOM 0 HG21 VAL A 104 11.823 -78.156 -4.544 1.00 13.11 H new ATOM 0 HG22 VAL A 104 10.305 -78.298 -5.463 1.00 13.11 H new ATOM 0 HG23 VAL A 104 10.262 -77.876 -3.735 1.00 13.11 H new ATOM 1583 N SER A 105 9.265 -82.849 -4.321 1.00 70.15 N ATOM 1584 CA SER A 105 9.182 -84.239 -3.902 1.00 14.10 C ATOM 1585 C SER A 105 10.205 -85.072 -4.664 1.00 74.04 C ATOM 1586 O SER A 105 10.252 -85.033 -5.896 1.00 24.02 O ATOM 1587 CB SER A 105 7.762 -84.761 -4.148 1.00 4.52 C ATOM 1588 OG SER A 105 6.812 -83.979 -3.438 1.00 72.03 O ATOM 0 H SER A 105 9.375 -82.725 -5.327 1.00 70.15 H new ATOM 0 HA SER A 105 9.404 -84.316 -2.838 1.00 14.10 H new ATOM 0 HB2 SER A 105 7.539 -84.734 -5.215 1.00 4.52 H new ATOM 0 HB3 SER A 105 7.692 -85.802 -3.833 1.00 4.52 H new ATOM 0 HG SER A 105 5.911 -84.325 -3.608 1.00 72.03 H new ATOM 1594 N ILE A 106 11.035 -85.806 -3.935 1.00 60.24 N ATOM 1595 CA ILE A 106 12.063 -86.644 -4.542 1.00 10.30 C ATOM 1596 C ILE A 106 11.736 -88.121 -4.301 1.00 61.14 C ATOM 1597 O ILE A 106 11.084 -88.458 -3.310 1.00 52.41 O ATOM 1598 CB ILE A 106 13.467 -86.319 -3.970 1.00 72.12 C ATOM 1599 CG1 ILE A 106 13.688 -84.796 -3.880 1.00 61.14 C ATOM 1600 CG2 ILE A 106 14.550 -86.955 -4.837 1.00 61.45 C ATOM 1601 CD1 ILE A 106 13.659 -84.085 -5.220 1.00 61.02 C ATOM 0 H ILE A 106 11.017 -85.838 -2.916 1.00 60.24 H new ATOM 0 HA ILE A 106 12.077 -86.439 -5.613 1.00 10.30 H new ATOM 0 HB ILE A 106 13.527 -86.733 -2.964 1.00 72.12 H new ATOM 0 HG12 ILE A 106 12.921 -84.366 -3.236 1.00 61.14 H new ATOM 0 HG13 ILE A 106 14.649 -84.607 -3.401 1.00 61.14 H new ATOM 0 HG21 ILE A 106 15.531 -86.719 -4.425 1.00 61.45 H new ATOM 0 HG22 ILE A 106 14.414 -88.036 -4.854 1.00 61.45 H new ATOM 0 HG23 ILE A 106 14.480 -86.564 -5.852 1.00 61.45 H new ATOM 0 HD11 ILE A 106 13.822 -83.018 -5.069 1.00 61.02 H new ATOM 0 HD12 ILE A 106 14.444 -84.485 -5.861 1.00 61.02 H new ATOM 0 HD13 ILE A 106 12.690 -84.240 -5.693 1.00 61.02 H new ATOM 1613 N HIS A 107 12.185 -88.995 -5.202 1.00 62.33 N ATOM 1614 CA HIS A 107 11.859 -90.420 -5.130 1.00 42.21 C ATOM 1615 C HIS A 107 13.117 -91.282 -5.331 1.00 3.14 C ATOM 1616 O HIS A 107 14.028 -90.911 -6.073 1.00 44.31 O ATOM 1617 CB HIS A 107 10.781 -90.757 -6.173 1.00 1.15 C ATOM 1618 CG HIS A 107 10.213 -92.141 -6.056 1.00 52.33 C ATOM 1619 ND1 HIS A 107 10.404 -93.118 -7.010 1.00 63.51 N ATOM 1620 CD2 HIS A 107 9.424 -92.697 -5.107 1.00 51.43 C ATOM 1621 CE1 HIS A 107 9.760 -94.212 -6.652 1.00 61.40 C ATOM 1622 NE2 HIS A 107 9.159 -93.985 -5.502 1.00 21.31 N ATOM 0 H HIS A 107 12.777 -88.740 -5.993 1.00 62.33 H new ATOM 0 HA HIS A 107 11.467 -90.644 -4.138 1.00 42.21 H new ATOM 0 HB2 HIS A 107 9.969 -90.036 -6.083 1.00 1.15 H new ATOM 0 HB3 HIS A 107 11.207 -90.636 -7.169 1.00 1.15 H new ATOM 0 HD1 HIS A 107 10.957 -93.011 -7.860 1.00 63.51 H new ATOM 0 HD2 HIS A 107 9.069 -92.217 -4.207 1.00 51.43 H new ATOM 0 HE1 HIS A 107 9.730 -95.138 -7.208 1.00 61.40 H new ATOM 1631 N ALA A 108 13.114 -92.445 -4.690 1.00 62.21 N ATOM 1632 CA ALA A 108 14.283 -93.328 -4.541 1.00 71.54 C ATOM 1633 C ALA A 108 14.739 -94.030 -5.833 1.00 51.20 C ATOM 1634 O ALA A 108 15.637 -94.878 -5.781 1.00 13.21 O ATOM 1635 CB ALA A 108 14.013 -94.355 -3.451 1.00 1.01 C ATOM 0 H ALA A 108 12.276 -92.818 -4.243 1.00 62.21 H new ATOM 0 HA ALA A 108 15.112 -92.676 -4.266 1.00 71.54 H new ATOM 0 HB1 ALA A 108 14.880 -95.007 -3.343 1.00 1.01 H new ATOM 0 HB2 ALA A 108 13.824 -93.843 -2.507 1.00 1.01 H new ATOM 0 HB3 ALA A 108 13.142 -94.951 -3.721 1.00 1.01 H new ATOM 1641 N SER A 109 14.140 -93.698 -6.974 1.00 22.12 N ATOM 1642 CA SER A 109 14.286 -94.507 -8.190 1.00 13.31 C ATOM 1643 C SER A 109 15.751 -94.629 -8.639 1.00 70.35 C ATOM 1644 O SER A 109 16.516 -93.665 -8.588 1.00 20.01 O ATOM 1645 CB SER A 109 13.466 -93.877 -9.319 1.00 75.32 C ATOM 1646 OG SER A 109 12.091 -93.803 -8.975 1.00 74.32 O ATOM 0 H SER A 109 13.548 -92.875 -7.086 1.00 22.12 H new ATOM 0 HA SER A 109 13.925 -95.510 -7.962 1.00 13.31 H new ATOM 0 HB2 SER A 109 13.844 -92.877 -9.533 1.00 75.32 H new ATOM 0 HB3 SER A 109 13.585 -94.464 -10.230 1.00 75.32 H new ATOM 0 HG SER A 109 11.639 -93.168 -9.569 1.00 74.32 H new ATOM 1652 N SER A 110 16.107 -95.841 -9.071 1.00 53.15 N ATOM 1653 CA SER A 110 17.474 -96.203 -9.439 1.00 44.34 C ATOM 1654 C SER A 110 17.877 -95.617 -10.797 1.00 21.33 C ATOM 1655 O SER A 110 17.077 -94.946 -11.455 1.00 40.12 O ATOM 1656 CB SER A 110 17.597 -97.732 -9.456 1.00 20.12 C ATOM 1657 OG SER A 110 16.548 -98.320 -10.215 1.00 61.20 O ATOM 0 H SER A 110 15.443 -96.608 -9.176 1.00 53.15 H new ATOM 0 HA SER A 110 18.154 -95.782 -8.698 1.00 44.34 H new ATOM 0 HB2 SER A 110 18.560 -98.018 -9.878 1.00 20.12 H new ATOM 0 HB3 SER A 110 17.570 -98.114 -8.435 1.00 20.12 H new ATOM 0 HG SER A 110 16.649 -99.295 -10.212 1.00 61.20 H new ATOM 1663 N ARG A 111 19.128 -95.874 -11.202 1.00 10.21 N ATOM 1664 CA ARG A 111 19.687 -95.314 -12.437 1.00 70.34 C ATOM 1665 C ARG A 111 18.829 -95.689 -13.650 1.00 33.55 C ATOM 1666 O ARG A 111 18.306 -96.802 -13.737 1.00 43.23 O ATOM 1667 CB ARG A 111 21.147 -95.780 -12.614 1.00 25.13 C ATOM 1668 CG ARG A 111 21.933 -95.027 -13.695 1.00 15.51 C ATOM 1669 CD ARG A 111 21.739 -95.617 -15.086 1.00 32.52 C ATOM 1670 NE ARG A 111 22.188 -97.009 -15.164 1.00 21.10 N ATOM 1671 CZ ARG A 111 21.727 -97.892 -16.049 1.00 63.31 C ATOM 1672 NH1 ARG A 111 20.815 -97.530 -16.939 1.00 42.52 N ATOM 1673 NH2 ARG A 111 22.184 -99.137 -16.046 1.00 12.12 N ATOM 0 H ARG A 111 19.775 -96.471 -10.687 1.00 10.21 H new ATOM 0 HA ARG A 111 19.681 -94.227 -12.362 1.00 70.34 H new ATOM 0 HB2 ARG A 111 21.667 -95.670 -11.663 1.00 25.13 H new ATOM 0 HB3 ARG A 111 21.148 -96.843 -12.857 1.00 25.13 H new ATOM 0 HG2 ARG A 111 21.622 -93.982 -13.702 1.00 15.51 H new ATOM 0 HG3 ARG A 111 22.994 -95.042 -13.444 1.00 15.51 H new ATOM 0 HD2 ARG A 111 20.685 -95.561 -15.359 1.00 32.52 H new ATOM 0 HD3 ARG A 111 22.289 -95.018 -15.813 1.00 32.52 H new ATOM 0 HE ARG A 111 22.897 -97.321 -14.500 1.00 21.10 H new ATOM 0 HH11 ARG A 111 20.463 -96.573 -16.948 1.00 42.52 H new ATOM 0 HH12 ARG A 111 20.464 -98.209 -17.615 1.00 42.52 H new ATOM 0 HH21 ARG A 111 22.889 -99.420 -15.366 1.00 12.12 H new ATOM 0 HH22 ARG A 111 21.830 -99.812 -16.724 1.00 12.12 H new ATOM 1687 N VAL A 112 18.717 -94.750 -14.589 1.00 42.33 N ATOM 1688 CA VAL A 112 17.795 -94.859 -15.725 1.00 22.53 C ATOM 1689 C VAL A 112 18.480 -94.448 -17.027 1.00 21.24 C ATOM 1690 O VAL A 112 19.650 -94.061 -17.024 1.00 51.15 O ATOM 1691 CB VAL A 112 16.546 -93.961 -15.516 1.00 42.34 C ATOM 1692 CG1 VAL A 112 15.723 -94.424 -14.313 1.00 12.25 C ATOM 1693 CG2 VAL A 112 16.967 -92.496 -15.360 1.00 12.43 C ATOM 0 H VAL A 112 19.264 -93.889 -14.586 1.00 42.33 H new ATOM 0 HA VAL A 112 17.487 -95.903 -15.789 1.00 22.53 H new ATOM 0 HB VAL A 112 15.912 -94.049 -16.399 1.00 42.34 H new ATOM 0 HG11 VAL A 112 14.856 -93.775 -14.194 1.00 12.25 H new ATOM 0 HG12 VAL A 112 15.389 -95.449 -14.473 1.00 12.25 H new ATOM 0 HG13 VAL A 112 16.337 -94.379 -13.413 1.00 12.25 H new ATOM 0 HG21 VAL A 112 16.082 -91.877 -15.214 1.00 12.43 H new ATOM 0 HG22 VAL A 112 17.626 -92.397 -14.497 1.00 12.43 H new ATOM 0 HG23 VAL A 112 17.493 -92.171 -16.258 1.00 12.43 H new ATOM 1703 N ASP A 113 17.757 -94.582 -18.136 1.00 71.41 N ATOM 1704 CA ASP A 113 18.210 -94.071 -19.429 1.00 61.45 C ATOM 1705 C ASP A 113 17.860 -92.588 -19.542 1.00 54.52 C ATOM 1706 O ASP A 113 16.688 -92.215 -19.428 1.00 71.24 O ATOM 1707 CB ASP A 113 17.555 -94.839 -20.590 1.00 13.55 C ATOM 1708 CG ASP A 113 18.046 -96.273 -20.715 1.00 74.32 C ATOM 1709 OD1 ASP A 113 19.134 -96.484 -21.294 1.00 52.52 O ATOM 1710 OD2 ASP A 113 17.339 -97.198 -20.249 1.00 41.05 O ATOM 0 H ASP A 113 16.848 -95.044 -18.166 1.00 71.41 H new ATOM 0 HA ASP A 113 19.290 -94.207 -19.491 1.00 61.45 H new ATOM 0 HB2 ASP A 113 16.474 -94.843 -20.450 1.00 13.55 H new ATOM 0 HB3 ASP A 113 17.753 -94.312 -21.523 1.00 13.55 H new ATOM 1715 N ALA A 114 18.870 -91.751 -19.755 1.00 61.52 N ATOM 1716 CA ALA A 114 18.661 -90.311 -19.888 1.00 14.04 C ATOM 1717 C ALA A 114 17.894 -89.986 -21.170 1.00 42.21 C ATOM 1718 O ALA A 114 18.287 -90.398 -22.264 1.00 32.43 O ATOM 1719 CB ALA A 114 19.994 -89.573 -19.866 1.00 51.25 C ATOM 0 H ALA A 114 19.843 -92.044 -19.840 1.00 61.52 H new ATOM 0 HA ALA A 114 18.064 -89.977 -19.040 1.00 14.04 H new ATOM 0 HB1 ALA A 114 19.819 -88.502 -19.966 1.00 51.25 H new ATOM 0 HB2 ALA A 114 20.504 -89.771 -18.923 1.00 51.25 H new ATOM 0 HB3 ALA A 114 20.615 -89.918 -20.693 1.00 51.25 H new ATOM 1725 N ASP A 115 16.805 -89.236 -21.028 1.00 54.31 N ATOM 1726 CA ASP A 115 15.953 -88.877 -22.164 1.00 31.20 C ATOM 1727 C ASP A 115 16.244 -87.446 -22.603 1.00 74.33 C ATOM 1728 O ASP A 115 16.494 -87.186 -23.782 1.00 33.11 O ATOM 1729 CB ASP A 115 14.470 -89.024 -21.794 1.00 63.02 C ATOM 1730 CG ASP A 115 13.531 -88.679 -22.945 1.00 34.15 C ATOM 1731 OD1 ASP A 115 13.247 -89.570 -23.774 1.00 71.54 O ATOM 1732 OD2 ASP A 115 13.061 -87.526 -23.018 1.00 60.54 O ATOM 0 H ASP A 115 16.488 -88.862 -20.134 1.00 54.31 H new ATOM 0 HA ASP A 115 16.172 -89.554 -22.990 1.00 31.20 H new ATOM 0 HB2 ASP A 115 14.281 -90.048 -21.473 1.00 63.02 H new ATOM 0 HB3 ASP A 115 14.247 -88.378 -20.945 1.00 63.02 H new ATOM 1737 N GLY A 116 16.251 -86.532 -21.637 1.00 25.12 N ATOM 1738 CA GLY A 116 16.473 -85.127 -21.933 1.00 51.02 C ATOM 1739 C GLY A 116 15.661 -84.205 -21.041 1.00 52.42 C ATOM 1740 O GLY A 116 14.533 -84.525 -20.650 1.00 24.24 O ATOM 0 H GLY A 116 16.106 -86.741 -20.649 1.00 25.12 H new ATOM 0 HA2 GLY A 116 17.532 -84.898 -21.816 1.00 51.02 H new ATOM 0 HA3 GLY A 116 16.218 -84.935 -22.975 1.00 51.02 H new ATOM 1744 N PHE A 117 16.245 -83.070 -20.686 1.00 5.24 N ATOM 1745 CA PHE A 117 15.541 -82.057 -19.907 1.00 2.31 C ATOM 1746 C PHE A 117 14.829 -81.099 -20.859 1.00 32.41 C ATOM 1747 O PHE A 117 15.486 -80.332 -21.567 1.00 0.02 O ATOM 1748 CB PHE A 117 16.532 -81.263 -19.036 1.00 64.33 C ATOM 1749 CG PHE A 117 17.369 -82.107 -18.102 1.00 64.31 C ATOM 1750 CD1 PHE A 117 18.380 -82.921 -18.594 1.00 52.42 C ATOM 1751 CD2 PHE A 117 17.147 -82.082 -16.733 1.00 54.12 C ATOM 1752 CE1 PHE A 117 19.147 -83.687 -17.741 1.00 24.34 C ATOM 1753 CE2 PHE A 117 17.912 -82.848 -15.876 1.00 3.23 C ATOM 1754 CZ PHE A 117 18.913 -83.650 -16.381 1.00 43.44 C ATOM 0 H PHE A 117 17.206 -82.825 -20.925 1.00 5.24 H new ATOM 0 HA PHE A 117 14.817 -82.549 -19.258 1.00 2.31 H new ATOM 0 HB2 PHE A 117 17.198 -80.699 -19.689 1.00 64.33 H new ATOM 0 HB3 PHE A 117 15.974 -80.536 -18.445 1.00 64.33 H new ATOM 0 HD1 PHE A 117 18.568 -82.955 -19.657 1.00 52.42 H new ATOM 0 HD2 PHE A 117 16.365 -81.455 -16.332 1.00 54.12 H new ATOM 0 HE1 PHE A 117 19.931 -84.316 -18.137 1.00 24.34 H new ATOM 0 HE2 PHE A 117 17.727 -82.819 -14.812 1.00 3.23 H new ATOM 0 HZ PHE A 117 19.514 -84.249 -15.713 1.00 43.44 H new ATOM 1764 N GLU A 118 13.499 -81.122 -20.871 1.00 33.04 N ATOM 1765 CA GLU A 118 12.737 -80.218 -21.725 1.00 23.02 C ATOM 1766 C GLU A 118 11.289 -80.127 -21.270 1.00 63.02 C ATOM 1767 O GLU A 118 10.643 -81.136 -20.998 1.00 13.12 O ATOM 1768 CB GLU A 118 12.825 -80.644 -23.197 1.00 70.42 C ATOM 1769 CG GLU A 118 12.364 -82.067 -23.477 1.00 51.04 C ATOM 1770 CD GLU A 118 12.414 -82.401 -24.959 1.00 53.34 C ATOM 1771 OE1 GLU A 118 13.522 -82.645 -25.487 1.00 71.34 O ATOM 1772 OE2 GLU A 118 11.347 -82.407 -25.611 1.00 62.15 O ATOM 0 H GLU A 118 12.931 -81.751 -20.304 1.00 33.04 H new ATOM 0 HA GLU A 118 13.179 -79.225 -21.637 1.00 23.02 H new ATOM 0 HB2 GLU A 118 12.226 -79.958 -23.796 1.00 70.42 H new ATOM 0 HB3 GLU A 118 13.858 -80.539 -23.530 1.00 70.42 H new ATOM 0 HG2 GLU A 118 12.993 -82.767 -22.926 1.00 51.04 H new ATOM 0 HG3 GLU A 118 11.346 -82.197 -23.110 1.00 51.04 H new ATOM 1779 N ILE A 119 10.785 -78.906 -21.189 1.00 14.51 N ATOM 1780 CA ILE A 119 9.453 -78.671 -20.664 1.00 51.30 C ATOM 1781 C ILE A 119 8.391 -79.137 -21.652 1.00 62.21 C ATOM 1782 O ILE A 119 7.915 -78.373 -22.497 1.00 44.42 O ATOM 1783 CB ILE A 119 9.251 -77.178 -20.307 1.00 2.53 C ATOM 1784 CG1 ILE A 119 10.356 -76.719 -19.338 1.00 24.02 C ATOM 1785 CG2 ILE A 119 7.870 -76.948 -19.700 1.00 53.12 C ATOM 1786 CD1 ILE A 119 10.455 -77.560 -18.079 1.00 71.13 C ATOM 0 H ILE A 119 11.280 -78.063 -21.481 1.00 14.51 H new ATOM 0 HA ILE A 119 9.347 -79.254 -19.749 1.00 51.30 H new ATOM 0 HB ILE A 119 9.316 -76.587 -21.220 1.00 2.53 H new ATOM 0 HG12 ILE A 119 11.314 -76.744 -19.857 1.00 24.02 H new ATOM 0 HG13 ILE A 119 10.172 -75.682 -19.057 1.00 24.02 H new ATOM 0 HG21 ILE A 119 7.751 -75.892 -19.457 1.00 53.12 H new ATOM 0 HG22 ILE A 119 7.104 -77.244 -20.416 1.00 53.12 H new ATOM 0 HG23 ILE A 119 7.768 -77.543 -18.792 1.00 53.12 H new ATOM 0 HD11 ILE A 119 11.255 -77.175 -17.447 1.00 71.13 H new ATOM 0 HD12 ILE A 119 9.511 -77.516 -17.537 1.00 71.13 H new ATOM 0 HD13 ILE A 119 10.670 -78.594 -18.348 1.00 71.13 H new ATOM 1798 N ARG A 120 8.059 -80.417 -21.558 1.00 2.03 N ATOM 1799 CA ARG A 120 7.021 -81.012 -22.379 1.00 61.44 C ATOM 1800 C ARG A 120 5.663 -80.785 -21.756 1.00 32.31 C ATOM 1801 O ARG A 120 5.512 -80.847 -20.535 1.00 1.25 O ATOM 1802 CB ARG A 120 7.276 -82.506 -22.558 1.00 4.12 C ATOM 1803 CG ARG A 120 8.338 -82.798 -23.595 1.00 2.23 C ATOM 1804 CD ARG A 120 8.693 -84.282 -23.644 1.00 30.01 C ATOM 1805 NE ARG A 120 9.956 -84.518 -24.348 1.00 3.51 N ATOM 1806 CZ ARG A 120 10.860 -85.439 -23.993 1.00 12.41 C ATOM 1807 NH1 ARG A 120 10.633 -86.256 -22.975 1.00 3.32 N ATOM 1808 NH2 ARG A 120 11.999 -85.548 -24.663 1.00 2.32 N ATOM 0 H ARG A 120 8.502 -81.069 -20.911 1.00 2.03 H new ATOM 0 HA ARG A 120 7.039 -80.535 -23.359 1.00 61.44 H new ATOM 0 HB2 ARG A 120 7.579 -82.935 -21.603 1.00 4.12 H new ATOM 0 HB3 ARG A 120 6.347 -82.997 -22.848 1.00 4.12 H new ATOM 0 HG2 ARG A 120 7.986 -82.476 -24.575 1.00 2.23 H new ATOM 0 HG3 ARG A 120 9.233 -82.218 -23.371 1.00 2.23 H new ATOM 0 HD2 ARG A 120 8.765 -84.672 -22.629 1.00 30.01 H new ATOM 0 HD3 ARG A 120 7.893 -84.831 -24.140 1.00 30.01 H new ATOM 0 HE ARG A 120 10.160 -83.941 -25.164 1.00 3.51 H new ATOM 0 HH11 ARG A 120 9.761 -86.188 -22.451 1.00 3.32 H new ATOM 0 HH12 ARG A 120 11.331 -86.953 -22.715 1.00 3.32 H new ATOM 0 HH21 ARG A 120 12.188 -84.929 -25.451 1.00 2.32 H new ATOM 0 HH22 ARG A 120 12.686 -86.251 -24.390 1.00 2.32 H new ATOM 1822 N ARG A 121 4.688 -80.516 -22.603 1.00 14.01 N ATOM 1823 CA ARG A 121 3.317 -80.259 -22.168 1.00 75.33 C ATOM 1824 C ARG A 121 2.335 -80.845 -23.177 1.00 64.21 C ATOM 1825 O ARG A 121 2.129 -80.226 -24.243 1.00 51.44 O ATOM 1826 CB ARG A 121 3.067 -78.751 -21.989 1.00 72.42 C ATOM 1827 CG ARG A 121 3.970 -78.095 -20.951 1.00 14.51 C ATOM 1828 CD ARG A 121 3.572 -76.647 -20.680 1.00 12.45 C ATOM 1829 NE ARG A 121 2.165 -76.539 -20.281 1.00 4.53 N ATOM 1830 CZ ARG A 121 1.739 -76.373 -19.028 1.00 42.14 C ATOM 1831 NH1 ARG A 121 2.605 -76.300 -18.023 1.00 1.44 N ATOM 1832 NH2 ARG A 121 0.437 -76.282 -18.786 1.00 65.01 N ATOM 1833 OXT ARG A 121 1.782 -81.930 -22.909 1.00 0.00 O ATOM 0 H ARG A 121 4.818 -80.468 -23.614 1.00 14.01 H new ATOM 0 HA ARG A 121 3.166 -80.740 -21.202 1.00 75.33 H new ATOM 0 HB2 ARG A 121 3.210 -78.253 -22.948 1.00 72.42 H new ATOM 0 HB3 ARG A 121 2.027 -78.597 -21.701 1.00 72.42 H new ATOM 0 HG2 ARG A 121 3.926 -78.663 -20.022 1.00 14.51 H new ATOM 0 HG3 ARG A 121 5.003 -78.128 -21.297 1.00 14.51 H new ATOM 0 HD2 ARG A 121 4.206 -76.236 -19.894 1.00 12.45 H new ATOM 0 HD3 ARG A 121 3.744 -76.048 -21.575 1.00 12.45 H new ATOM 0 HE ARG A 121 1.460 -76.595 -21.016 1.00 4.53 H new ATOM 0 HH11 ARG A 121 3.606 -76.371 -18.206 1.00 1.44 H new ATOM 0 HH12 ARG A 121 2.269 -76.173 -17.068 1.00 1.44 H new ATOM 0 HH21 ARG A 121 -0.230 -76.339 -19.556 1.00 65.01 H new ATOM 0 HH22 ARG A 121 0.104 -76.155 -17.830 1.00 65.01 H new