USER MOD reduce.3.24.130724 H: found=0, std=0, add=663, rem=0, adj=24 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 37 CYS SG : rot 10:sc= -6.68! USER MOD Set 1.2: A 107 HIS : no HD1:sc= -0.286 K(o=-7,f=-6.2) USER MOD Set 1.3: A 109 SER OG : rot 141:sc= -0.0505 USER MOD Set 2.1: A 69 ASN : amide:sc= 1.01 K(o=1.2,f=0.43) USER MOD Set 2.2: A 75 SER OG : rot 180:sc= 0.239 USER MOD Set 3.1: A 53 THR OG1 : rot -24:sc= 0.685 USER MOD Set 3.2: A 91 TYR OH : rot -64:sc= 1.41 USER MOD Single : A 34 THR OG1 : rot -105:sc= -1.08 USER MOD Single : A 35 THR OG1 : rot 130:sc= 0 USER MOD Single : A 38 TYR OH : rot 120:sc= -1.73! USER MOD Single : A 41 THR OG1 : rot -160:sc= -2.6! USER MOD Single : A 51 LYS NZ :NH3+ -162:sc= -0.0337 (180deg=-0.27) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -167:sc= -0.0233 (180deg=-0.166) USER MOD Single : A 61 SER OG : rot -44:sc= 0.769 USER MOD Single : A 65 TYR OH : rot 30:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= -2.7! USER MOD Single : A 68 ASN : amide:sc= -4.1! K(o=-4.1!,f=-0.48) USER MOD Single : A 73 SER OG : rot -108:sc= 0.0305 USER MOD Single : A 79 GLN : amide:sc= -0.0155 K(o=-0.016,f=-2.7) USER MOD Single : A 82 LYS NZ :NH3+ -167:sc= -0.0517 (180deg=-0.263) USER MOD Single : A 84 GLN : amide:sc= -2.09 K(o=-2.1,f=-4.2) USER MOD Single : A 90 LYS NZ :NH3+ -145:sc= 0.219 (180deg=-0.628) USER MOD Single : A 93 HIS : no HD1:sc= -0.51 X(o=-0.51,f=-0.85) USER MOD Single : A 94 LYS NZ :NH3+ -176:sc= -0.0565 (180deg=-0.0718) USER MOD Single : A 96 SER OG : rot 180:sc= 0 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+ -124:sc= 0.56 (180deg=-0.116) 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= 0.0149 USER MOD ----------------------------------------------------------------- ATOM 450 N VAL A 33 27.639 -93.063 -8.265 1.00 64.33 N ATOM 451 CA VAL A 33 26.473 -92.646 -9.033 1.00 3.41 C ATOM 452 C VAL A 33 25.199 -92.813 -8.208 1.00 52.31 C ATOM 453 O VAL A 33 24.996 -93.836 -7.549 1.00 55.05 O ATOM 454 CB VAL A 33 26.348 -93.440 -10.363 1.00 32.24 C ATOM 455 CG1 VAL A 33 26.241 -94.941 -10.101 1.00 21.34 C ATOM 456 CG2 VAL A 33 25.157 -92.941 -11.188 1.00 54.35 C ATOM 0 HA VAL A 33 26.606 -91.592 -9.279 1.00 3.41 H new ATOM 0 HB VAL A 33 27.255 -93.267 -10.942 1.00 32.24 H new ATOM 0 HG11 VAL A 33 26.155 -95.471 -11.050 1.00 21.34 H new ATOM 0 HG12 VAL A 33 27.132 -95.283 -9.574 1.00 21.34 H new ATOM 0 HG13 VAL A 33 25.360 -95.142 -9.492 1.00 21.34 H new ATOM 0 HG21 VAL A 33 25.091 -93.512 -12.114 1.00 54.35 H new ATOM 0 HG22 VAL A 33 24.238 -93.070 -10.616 1.00 54.35 H new ATOM 0 HG23 VAL A 33 25.293 -91.885 -11.422 1.00 54.35 H new ATOM 466 N THR A 34 24.358 -91.792 -8.241 1.00 32.15 N ATOM 467 CA THR A 34 23.099 -91.776 -7.512 1.00 71.11 C ATOM 468 C THR A 34 21.950 -91.473 -8.478 1.00 2.24 C ATOM 469 O THR A 34 22.172 -90.881 -9.536 1.00 60.35 O ATOM 470 CB THR A 34 23.152 -90.706 -6.398 1.00 3.00 C ATOM 471 OG1 THR A 34 24.328 -90.901 -5.600 1.00 50.55 O ATOM 472 CG2 THR A 34 21.920 -90.753 -5.500 1.00 1.10 C ATOM 0 H THR A 34 24.531 -90.943 -8.779 1.00 32.15 H new ATOM 0 HA THR A 34 22.933 -92.752 -7.056 1.00 71.11 H new ATOM 0 HB THR A 34 23.177 -89.729 -6.881 1.00 3.00 H new ATOM 0 HG1 THR A 34 24.077 -91.298 -4.740 1.00 50.55 H new ATOM 0 HG21 THR A 34 22.000 -89.984 -4.732 1.00 1.10 H new ATOM 0 HG22 THR A 34 21.026 -90.576 -6.099 1.00 1.10 H new ATOM 0 HG23 THR A 34 21.852 -91.733 -5.027 1.00 1.10 H new ATOM 480 N THR A 35 20.736 -91.897 -8.134 1.00 71.32 N ATOM 481 CA THR A 35 19.563 -91.641 -8.967 1.00 44.34 C ATOM 482 C THR A 35 18.310 -91.472 -8.112 1.00 64.43 C ATOM 483 O THR A 35 18.031 -92.295 -7.239 1.00 74.11 O ATOM 484 CB THR A 35 19.334 -92.779 -9.991 1.00 51.43 C ATOM 485 OG1 THR A 35 20.463 -92.872 -10.874 1.00 13.30 O ATOM 486 CG2 THR A 35 18.061 -92.548 -10.808 1.00 62.32 C ATOM 0 H THR A 35 20.538 -92.421 -7.281 1.00 71.32 H new ATOM 0 HA THR A 35 19.755 -90.715 -9.510 1.00 44.34 H new ATOM 0 HB THR A 35 19.218 -93.711 -9.438 1.00 51.43 H new ATOM 0 HG1 THR A 35 20.768 -93.802 -10.918 1.00 13.30 H new ATOM 0 HG21 THR A 35 17.930 -93.365 -11.517 1.00 62.32 H new ATOM 0 HG22 THR A 35 17.202 -92.507 -10.139 1.00 62.32 H new ATOM 0 HG23 THR A 35 18.143 -91.606 -11.351 1.00 62.32 H new ATOM 494 N LEU A 36 17.581 -90.384 -8.358 1.00 13.40 N ATOM 495 CA LEU A 36 16.288 -90.137 -7.718 1.00 32.23 C ATOM 496 C LEU A 36 15.387 -89.373 -8.683 1.00 30.20 C ATOM 497 O LEU A 36 15.874 -88.625 -9.529 1.00 35.32 O ATOM 498 CB LEU A 36 16.428 -89.337 -6.403 1.00 70.33 C ATOM 499 CG LEU A 36 17.165 -90.046 -5.245 1.00 3.23 C ATOM 500 CD1 LEU A 36 18.632 -89.627 -5.191 1.00 10.31 C ATOM 501 CD2 LEU A 36 16.472 -89.781 -3.908 1.00 4.14 C ATOM 0 H LEU A 36 17.869 -89.650 -9.005 1.00 13.40 H new ATOM 0 HA LEU A 36 15.852 -91.104 -7.469 1.00 32.23 H new ATOM 0 HB2 LEU A 36 16.952 -88.407 -6.623 1.00 70.33 H new ATOM 0 HB3 LEU A 36 15.430 -89.067 -6.059 1.00 70.33 H new ATOM 0 HG LEU A 36 17.129 -91.119 -5.435 1.00 3.23 H new ATOM 0 HD11 LEU A 36 19.127 -90.141 -4.367 1.00 10.31 H new ATOM 0 HD12 LEU A 36 19.121 -89.891 -6.129 1.00 10.31 H new ATOM 0 HD13 LEU A 36 18.697 -88.550 -5.038 1.00 10.31 H new ATOM 0 HD21 LEU A 36 17.012 -90.292 -3.111 1.00 4.14 H new ATOM 0 HD22 LEU A 36 16.461 -88.709 -3.710 1.00 4.14 H new ATOM 0 HD23 LEU A 36 15.448 -90.153 -3.949 1.00 4.14 H new ATOM 513 N CYS A 37 14.083 -89.569 -8.570 1.00 71.23 N ATOM 514 CA CYS A 37 13.133 -88.866 -9.429 1.00 40.31 C ATOM 515 C CYS A 37 12.663 -87.576 -8.763 1.00 32.44 C ATOM 516 O CYS A 37 12.462 -87.532 -7.550 1.00 34.41 O ATOM 517 CB CYS A 37 11.936 -89.762 -9.751 1.00 1.21 C ATOM 518 SG CYS A 37 12.383 -91.312 -10.570 1.00 21.43 S ATOM 0 H CYS A 37 13.656 -90.205 -7.897 1.00 71.23 H new ATOM 0 HA CYS A 37 13.637 -88.612 -10.361 1.00 40.31 H new ATOM 0 HB2 CYS A 37 11.406 -89.990 -8.826 1.00 1.21 H new ATOM 0 HB3 CYS A 37 11.243 -89.212 -10.388 1.00 1.21 H new ATOM 0 HG CYS A 37 13.674 -91.461 -10.542 1.00 21.43 H new ATOM 524 N TYR A 38 12.501 -86.533 -9.565 1.00 44.52 N ATOM 525 CA TYR A 38 12.064 -85.227 -9.080 1.00 13.14 C ATOM 526 C TYR A 38 10.676 -84.890 -9.616 1.00 33.50 C ATOM 527 O TYR A 38 10.361 -85.171 -10.771 1.00 34.40 O ATOM 528 CB TYR A 38 13.060 -84.135 -9.507 1.00 2.52 C ATOM 529 CG TYR A 38 14.292 -84.021 -8.625 1.00 51.01 C ATOM 530 CD1 TYR A 38 15.042 -85.138 -8.284 1.00 5.21 C ATOM 531 CD2 TYR A 38 14.700 -82.789 -8.131 1.00 74.21 C ATOM 532 CE1 TYR A 38 16.160 -85.028 -7.480 1.00 42.41 C ATOM 533 CE2 TYR A 38 15.817 -82.672 -7.327 1.00 41.03 C ATOM 534 CZ TYR A 38 16.543 -83.796 -7.005 1.00 0.42 C ATOM 535 OH TYR A 38 17.655 -83.688 -6.204 1.00 72.24 O ATOM 0 H TYR A 38 12.668 -86.566 -10.571 1.00 44.52 H new ATOM 0 HA TYR A 38 12.022 -85.268 -7.992 1.00 13.14 H new ATOM 0 HB2 TYR A 38 13.379 -84.333 -10.530 1.00 2.52 H new ATOM 0 HB3 TYR A 38 12.545 -83.175 -9.514 1.00 2.52 H new ATOM 0 HD1 TYR A 38 14.747 -86.109 -8.653 1.00 5.21 H new ATOM 0 HD2 TYR A 38 14.133 -81.905 -8.380 1.00 74.21 H new ATOM 0 HE1 TYR A 38 16.732 -85.908 -7.225 1.00 42.41 H new ATOM 0 HE2 TYR A 38 16.119 -81.705 -6.953 1.00 41.03 H new ATOM 0 HH TYR A 38 18.311 -83.099 -6.632 1.00 72.24 H new ATOM 545 N ARG A 39 9.855 -84.299 -8.758 1.00 41.31 N ATOM 546 CA ARG A 39 8.554 -83.777 -9.155 1.00 13.40 C ATOM 547 C ARG A 39 8.188 -82.587 -8.276 1.00 14.02 C ATOM 548 O ARG A 39 7.985 -82.729 -7.070 1.00 25.40 O ATOM 549 CB ARG A 39 7.465 -84.858 -9.070 1.00 74.33 C ATOM 550 CG ARG A 39 6.068 -84.333 -9.407 1.00 12.21 C ATOM 551 CD ARG A 39 5.025 -85.447 -9.481 1.00 54.31 C ATOM 552 NE ARG A 39 4.945 -86.226 -8.241 1.00 25.32 N ATOM 553 CZ ARG A 39 4.070 -85.997 -7.256 1.00 14.22 C ATOM 554 NH1 ARG A 39 3.218 -84.985 -7.338 1.00 32.13 N ATOM 555 NH2 ARG A 39 4.046 -86.791 -6.194 1.00 64.21 N ATOM 0 H ARG A 39 10.071 -84.168 -7.770 1.00 41.31 H new ATOM 0 HA ARG A 39 8.618 -83.454 -10.194 1.00 13.40 H new ATOM 0 HB2 ARG A 39 7.715 -85.671 -9.752 1.00 74.33 H new ATOM 0 HB3 ARG A 39 7.456 -85.277 -8.064 1.00 74.33 H new ATOM 0 HG2 ARG A 39 5.765 -83.606 -8.653 1.00 12.21 H new ATOM 0 HG3 ARG A 39 6.102 -83.807 -10.361 1.00 12.21 H new ATOM 0 HD2 ARG A 39 4.049 -85.012 -9.697 1.00 54.31 H new ATOM 0 HD3 ARG A 39 5.268 -86.113 -10.309 1.00 54.31 H new ATOM 0 HE ARG A 39 5.603 -86.996 -8.122 1.00 25.32 H new ATOM 0 HH11 ARG A 39 3.227 -84.376 -8.156 1.00 32.13 H new ATOM 0 HH12 ARG A 39 2.553 -84.816 -6.583 1.00 32.13 H new ATOM 0 HH21 ARG A 39 4.695 -87.576 -6.129 1.00 64.21 H new ATOM 0 HH22 ARG A 39 3.379 -86.617 -5.442 1.00 64.21 H new ATOM 569 N VAL A 40 8.131 -81.409 -8.880 1.00 72.34 N ATOM 570 CA VAL A 40 7.720 -80.201 -8.174 1.00 72.44 C ATOM 571 C VAL A 40 6.395 -79.713 -8.741 1.00 70.43 C ATOM 572 O VAL A 40 6.146 -79.830 -9.941 1.00 61.43 O ATOM 573 CB VAL A 40 8.779 -79.067 -8.274 1.00 33.24 C ATOM 574 CG1 VAL A 40 8.872 -78.515 -9.693 1.00 32.30 C ATOM 575 CG2 VAL A 40 8.474 -77.947 -7.278 1.00 22.25 C ATOM 0 H VAL A 40 8.365 -81.262 -9.862 1.00 72.34 H new ATOM 0 HA VAL A 40 7.614 -80.455 -7.119 1.00 72.44 H new ATOM 0 HB VAL A 40 9.747 -79.498 -8.020 1.00 33.24 H new ATOM 0 HG11 VAL A 40 9.621 -77.724 -9.727 1.00 32.30 H new ATOM 0 HG12 VAL A 40 9.157 -79.315 -10.377 1.00 32.30 H new ATOM 0 HG13 VAL A 40 7.904 -78.111 -9.990 1.00 32.30 H new ATOM 0 HG21 VAL A 40 9.229 -77.165 -7.367 1.00 22.25 H new ATOM 0 HG22 VAL A 40 7.491 -77.528 -7.492 1.00 22.25 H new ATOM 0 HG23 VAL A 40 8.485 -78.348 -6.265 1.00 22.25 H new ATOM 585 N THR A 41 5.548 -79.192 -7.880 1.00 2.24 N ATOM 586 CA THR A 41 4.250 -78.683 -8.283 1.00 62.42 C ATOM 587 C THR A 41 4.250 -77.158 -8.237 1.00 74.20 C ATOM 588 O THR A 41 5.044 -76.557 -7.512 1.00 2.33 O ATOM 589 CB THR A 41 3.142 -79.250 -7.365 1.00 55.34 C ATOM 590 OG1 THR A 41 3.502 -79.050 -5.990 1.00 61.12 O ATOM 591 CG2 THR A 41 2.926 -80.741 -7.617 1.00 64.10 C ATOM 0 H THR A 41 5.737 -79.108 -6.881 1.00 2.24 H new ATOM 0 HA THR A 41 4.048 -79.003 -9.305 1.00 62.42 H new ATOM 0 HB THR A 41 2.215 -78.722 -7.589 1.00 55.34 H new ATOM 0 HG1 THR A 41 2.990 -79.665 -5.425 1.00 61.12 H new ATOM 0 HG21 THR A 41 2.141 -81.112 -6.957 1.00 64.10 H new ATOM 0 HG22 THR A 41 2.631 -80.896 -8.655 1.00 64.10 H new ATOM 0 HG23 THR A 41 3.852 -81.281 -7.419 1.00 64.10 H new ATOM 599 N GLY A 42 3.378 -76.536 -9.023 1.00 41.40 N ATOM 600 CA GLY A 42 3.287 -75.085 -9.052 1.00 24.42 C ATOM 601 C GLY A 42 2.023 -74.576 -8.387 1.00 40.24 C ATOM 602 O GLY A 42 1.069 -75.334 -8.198 1.00 32.35 O ATOM 0 H GLY A 42 2.727 -77.014 -9.646 1.00 41.40 H new ATOM 0 HA2 GLY A 42 4.156 -74.658 -8.551 1.00 24.42 H new ATOM 0 HA3 GLY A 42 3.315 -74.742 -10.086 1.00 24.42 H new ATOM 684 N PHE A 48 8.415 -73.535 -15.142 1.00 44.21 N ATOM 685 CA PHE A 48 9.767 -73.733 -14.643 1.00 43.23 C ATOM 686 C PHE A 48 10.785 -73.289 -15.696 1.00 63.04 C ATOM 687 O PHE A 48 10.720 -73.708 -16.855 1.00 45.54 O ATOM 688 CB PHE A 48 9.945 -75.213 -14.281 1.00 61.12 C ATOM 689 CG PHE A 48 11.040 -75.514 -13.285 1.00 53.24 C ATOM 690 CD1 PHE A 48 10.939 -75.070 -11.971 1.00 42.11 C ATOM 691 CD2 PHE A 48 12.146 -76.272 -13.645 1.00 54.45 C ATOM 692 CE1 PHE A 48 11.922 -75.367 -11.047 1.00 23.41 C ATOM 693 CE2 PHE A 48 13.129 -76.575 -12.723 1.00 23.53 C ATOM 694 CZ PHE A 48 13.017 -76.124 -11.422 1.00 52.33 C ATOM 0 HA PHE A 48 9.933 -73.129 -13.751 1.00 43.23 H new ATOM 0 HB2 PHE A 48 9.002 -75.587 -13.881 1.00 61.12 H new ATOM 0 HB3 PHE A 48 10.147 -75.771 -15.196 1.00 61.12 H new ATOM 0 HD1 PHE A 48 10.082 -74.486 -11.669 1.00 42.11 H new ATOM 0 HD2 PHE A 48 12.239 -76.630 -14.660 1.00 54.45 H new ATOM 0 HE1 PHE A 48 11.835 -75.008 -10.032 1.00 23.41 H new ATOM 0 HE2 PHE A 48 13.984 -77.164 -13.019 1.00 23.53 H new ATOM 0 HZ PHE A 48 13.783 -76.362 -10.699 1.00 52.33 H new ATOM 704 N PHE A 49 11.704 -72.423 -15.287 1.00 15.34 N ATOM 705 CA PHE A 49 12.715 -71.855 -16.183 1.00 4.40 C ATOM 706 C PHE A 49 13.631 -72.926 -16.798 1.00 62.32 C ATOM 707 O PHE A 49 14.724 -73.199 -16.292 1.00 1.00 O ATOM 708 CB PHE A 49 13.541 -70.770 -15.451 1.00 33.40 C ATOM 709 CG PHE A 49 14.060 -71.132 -14.061 1.00 61.25 C ATOM 710 CD1 PHE A 49 13.841 -72.385 -13.490 1.00 2.54 C ATOM 711 CD2 PHE A 49 14.769 -70.194 -13.322 1.00 61.52 C ATOM 712 CE1 PHE A 49 14.313 -72.682 -12.228 1.00 70.11 C ATOM 713 CE2 PHE A 49 15.244 -70.492 -12.058 1.00 52.45 C ATOM 714 CZ PHE A 49 15.017 -71.737 -11.512 1.00 63.23 C ATOM 0 H PHE A 49 11.773 -72.092 -14.325 1.00 15.34 H new ATOM 0 HA PHE A 49 12.182 -71.391 -17.013 1.00 4.40 H new ATOM 0 HB2 PHE A 49 14.395 -70.511 -16.077 1.00 33.40 H new ATOM 0 HB3 PHE A 49 12.926 -69.874 -15.363 1.00 33.40 H new ATOM 0 HD1 PHE A 49 13.294 -73.134 -14.044 1.00 2.54 H new ATOM 0 HD2 PHE A 49 14.952 -69.216 -13.741 1.00 61.52 H new ATOM 0 HE1 PHE A 49 14.131 -73.657 -11.800 1.00 70.11 H new ATOM 0 HE2 PHE A 49 15.793 -69.749 -11.499 1.00 52.45 H new ATOM 0 HZ PHE A 49 15.390 -71.972 -10.526 1.00 63.23 H new ATOM 724 N ARG A 50 13.169 -73.509 -17.909 1.00 20.24 N ATOM 725 CA ARG A 50 13.909 -74.566 -18.612 1.00 11.11 C ATOM 726 C ARG A 50 15.348 -74.157 -18.924 1.00 62.02 C ATOM 727 O ARG A 50 16.257 -74.983 -18.851 1.00 13.04 O ATOM 728 CB ARG A 50 13.196 -74.976 -19.916 1.00 4.24 C ATOM 729 CG ARG A 50 12.809 -73.805 -20.822 1.00 63.42 C ATOM 730 CD ARG A 50 12.672 -74.229 -22.283 1.00 31.41 C ATOM 731 NE ARG A 50 11.765 -75.370 -22.478 1.00 52.04 N ATOM 732 CZ ARG A 50 12.091 -76.474 -23.167 1.00 22.45 C ATOM 733 NH1 ARG A 50 13.318 -76.621 -23.649 1.00 12.14 N ATOM 734 NH2 ARG A 50 11.197 -77.431 -23.372 1.00 70.43 N ATOM 0 H ARG A 50 12.279 -73.265 -18.345 1.00 20.24 H new ATOM 0 HA ARG A 50 13.938 -75.420 -17.935 1.00 11.11 H new ATOM 0 HB2 ARG A 50 13.845 -75.651 -20.473 1.00 4.24 H new ATOM 0 HB3 ARG A 50 12.296 -75.536 -19.663 1.00 4.24 H new ATOM 0 HG2 ARG A 50 11.867 -73.378 -20.479 1.00 63.42 H new ATOM 0 HG3 ARG A 50 13.562 -73.021 -20.742 1.00 63.42 H new ATOM 0 HD2 ARG A 50 12.310 -73.383 -22.867 1.00 31.41 H new ATOM 0 HD3 ARG A 50 13.657 -74.487 -22.673 1.00 31.41 H new ATOM 0 HE ARG A 50 10.834 -75.319 -22.065 1.00 52.04 H new ATOM 0 HH11 ARG A 50 14.017 -75.894 -23.496 1.00 12.14 H new ATOM 0 HH12 ARG A 50 13.563 -77.461 -24.172 1.00 12.14 H new ATOM 0 HH21 ARG A 50 10.251 -77.332 -23.005 1.00 70.43 H new ATOM 0 HH22 ARG A 50 11.455 -78.266 -23.897 1.00 70.43 H new ATOM 748 N LYS A 51 15.551 -72.889 -19.282 1.00 31.42 N ATOM 749 CA LYS A 51 16.887 -72.389 -19.605 1.00 51.24 C ATOM 750 C LYS A 51 17.841 -72.574 -18.425 1.00 43.40 C ATOM 751 O LYS A 51 18.936 -73.119 -18.580 1.00 4.25 O ATOM 752 CB LYS A 51 16.830 -70.912 -20.033 1.00 42.54 C ATOM 753 CG LYS A 51 16.450 -70.714 -21.498 1.00 63.21 C ATOM 754 CD LYS A 51 16.328 -69.234 -21.858 1.00 2.41 C ATOM 755 CE LYS A 51 16.357 -69.016 -23.368 1.00 61.10 C ATOM 756 NZ LYS A 51 17.697 -69.315 -23.944 1.00 63.52 N ATOM 0 H LYS A 51 14.810 -72.192 -19.355 1.00 31.42 H new ATOM 0 HA LYS A 51 17.270 -72.972 -20.443 1.00 51.24 H new ATOM 0 HB2 LYS A 51 16.109 -70.388 -19.405 1.00 42.54 H new ATOM 0 HB3 LYS A 51 17.802 -70.453 -19.853 1.00 42.54 H new ATOM 0 HG2 LYS A 51 17.201 -71.182 -22.135 1.00 63.21 H new ATOM 0 HG3 LYS A 51 15.504 -71.216 -21.699 1.00 63.21 H new ATOM 0 HD2 LYS A 51 15.399 -68.836 -21.451 1.00 2.41 H new ATOM 0 HD3 LYS A 51 17.143 -68.678 -21.394 1.00 2.41 H new ATOM 0 HE2 LYS A 51 15.608 -69.651 -23.841 1.00 61.10 H new ATOM 0 HE3 LYS A 51 16.087 -67.984 -23.592 1.00 61.10 H new ATOM 0 HZ1 LYS A 51 17.776 -68.878 -24.884 1.00 63.52 H new ATOM 0 HZ2 LYS A 51 18.436 -68.931 -23.321 1.00 63.52 H new ATOM 0 HZ3 LYS A 51 17.816 -70.345 -24.029 1.00 63.52 H new ATOM 770 N TYR A 52 17.410 -72.143 -17.243 1.00 33.33 N ATOM 771 CA TYR A 52 18.224 -72.285 -16.039 1.00 52.21 C ATOM 772 C TYR A 52 18.343 -73.752 -15.644 1.00 31.13 C ATOM 773 O TYR A 52 19.354 -74.165 -15.079 1.00 33.12 O ATOM 774 CB TYR A 52 17.635 -71.479 -14.880 1.00 51.11 C ATOM 775 CG TYR A 52 17.800 -69.972 -15.012 1.00 65.03 C ATOM 776 CD1 TYR A 52 16.846 -69.195 -15.661 1.00 31.11 C ATOM 777 CD2 TYR A 52 18.903 -69.329 -14.462 1.00 73.20 C ATOM 778 CE1 TYR A 52 16.984 -67.823 -15.756 1.00 52.05 C ATOM 779 CE2 TYR A 52 19.049 -67.958 -14.558 1.00 34.30 C ATOM 780 CZ TYR A 52 18.088 -67.209 -15.202 1.00 23.30 C ATOM 781 OH TYR A 52 18.227 -65.843 -15.287 1.00 53.21 O ATOM 0 H TYR A 52 16.506 -71.695 -17.093 1.00 33.33 H new ATOM 0 HA TYR A 52 19.218 -71.896 -16.260 1.00 52.21 H new ATOM 0 HB2 TYR A 52 16.573 -71.710 -14.796 1.00 51.11 H new ATOM 0 HB3 TYR A 52 18.106 -71.804 -13.952 1.00 51.11 H new ATOM 0 HD1 TYR A 52 15.982 -69.672 -16.099 1.00 31.11 H new ATOM 0 HD2 TYR A 52 19.657 -69.910 -13.952 1.00 73.20 H new ATOM 0 HE1 TYR A 52 16.232 -67.235 -16.261 1.00 52.05 H new ATOM 0 HE2 TYR A 52 19.914 -67.475 -14.129 1.00 34.30 H new ATOM 0 HH TYR A 52 19.058 -65.571 -14.846 1.00 53.21 H new ATOM 791 N THR A 53 17.302 -74.533 -15.931 1.00 44.10 N ATOM 792 CA THR A 53 17.319 -75.966 -15.651 1.00 3.41 C ATOM 793 C THR A 53 18.457 -76.647 -16.411 1.00 73.23 C ATOM 794 O THR A 53 19.292 -77.338 -15.818 1.00 72.33 O ATOM 795 CB THR A 53 15.973 -76.628 -16.031 1.00 45.12 C ATOM 796 OG1 THR A 53 14.891 -75.910 -15.423 1.00 53.20 O ATOM 797 CG2 THR A 53 15.926 -78.089 -15.591 1.00 71.23 C ATOM 0 H THR A 53 16.438 -74.197 -16.357 1.00 44.10 H new ATOM 0 HA THR A 53 17.476 -76.090 -14.580 1.00 3.41 H new ATOM 0 HB THR A 53 15.877 -76.596 -17.116 1.00 45.12 H new ATOM 0 HG1 THR A 53 15.217 -75.438 -14.629 1.00 53.20 H new ATOM 0 HG21 THR A 53 14.967 -78.523 -15.873 1.00 71.23 H new ATOM 0 HG22 THR A 53 16.731 -78.641 -16.076 1.00 71.23 H new ATOM 0 HG23 THR A 53 16.046 -78.147 -14.509 1.00 71.23 H new ATOM 805 N LYS A 54 18.498 -76.420 -17.724 1.00 52.34 N ATOM 806 CA LYS A 54 19.533 -77.001 -18.572 1.00 30.44 C ATOM 807 C LYS A 54 20.899 -76.447 -18.189 1.00 3.54 C ATOM 808 O LYS A 54 21.884 -77.179 -18.159 1.00 44.10 O ATOM 809 CB LYS A 54 19.250 -76.716 -20.052 1.00 40.44 C ATOM 810 CG LYS A 54 17.914 -77.264 -20.544 1.00 35.45 C ATOM 811 CD LYS A 54 17.753 -77.109 -22.056 1.00 30.33 C ATOM 812 CE LYS A 54 18.792 -77.925 -22.825 1.00 3.15 C ATOM 813 NZ LYS A 54 18.663 -77.751 -24.297 1.00 23.31 N ATOM 0 H LYS A 54 17.825 -75.837 -18.222 1.00 52.34 H new ATOM 0 HA LYS A 54 19.530 -78.081 -18.421 1.00 30.44 H new ATOM 0 HB2 LYS A 54 19.271 -75.638 -20.215 1.00 40.44 H new ATOM 0 HB3 LYS A 54 20.051 -77.145 -20.654 1.00 40.44 H new ATOM 0 HG2 LYS A 54 17.834 -78.318 -20.277 1.00 35.45 H new ATOM 0 HG3 LYS A 54 17.101 -76.744 -20.038 1.00 35.45 H new ATOM 0 HD2 LYS A 54 16.752 -77.426 -22.349 1.00 30.33 H new ATOM 0 HD3 LYS A 54 17.845 -76.057 -22.325 1.00 30.33 H new ATOM 0 HE2 LYS A 54 19.792 -77.626 -22.511 1.00 3.15 H new ATOM 0 HE3 LYS A 54 18.682 -78.980 -22.574 1.00 3.15 H new ATOM 0 HZ1 LYS A 54 19.387 -78.322 -24.779 1.00 23.31 H new ATOM 0 HZ2 LYS A 54 17.718 -78.061 -24.602 1.00 23.31 H new ATOM 0 HZ3 LYS A 54 18.794 -76.749 -24.541 1.00 23.31 H new ATOM 827 N LYS A 55 20.940 -75.148 -17.898 1.00 61.15 N ATOM 828 CA LYS A 55 22.178 -74.483 -17.501 1.00 23.30 C ATOM 829 C LYS A 55 22.770 -75.128 -16.247 1.00 15.04 C ATOM 830 O LYS A 55 23.937 -75.537 -16.239 1.00 2.24 O ATOM 831 CB LYS A 55 21.897 -72.994 -17.241 1.00 11.43 C ATOM 832 CG LYS A 55 23.084 -72.216 -16.678 1.00 64.44 C ATOM 833 CD LYS A 55 22.728 -70.753 -16.435 1.00 65.33 C ATOM 834 CE LYS A 55 23.886 -69.984 -15.810 1.00 14.41 C ATOM 835 NZ LYS A 55 24.231 -70.489 -14.455 1.00 63.50 N ATOM 0 H LYS A 55 20.126 -74.534 -17.930 1.00 61.15 H new ATOM 0 HA LYS A 55 22.903 -74.586 -18.309 1.00 23.30 H new ATOM 0 HB2 LYS A 55 21.583 -72.528 -18.175 1.00 11.43 H new ATOM 0 HB3 LYS A 55 21.061 -72.911 -16.546 1.00 11.43 H new ATOM 0 HG2 LYS A 55 23.409 -72.673 -15.743 1.00 64.44 H new ATOM 0 HG3 LYS A 55 23.923 -72.277 -17.372 1.00 64.44 H new ATOM 0 HD2 LYS A 55 22.449 -70.285 -17.379 1.00 65.33 H new ATOM 0 HD3 LYS A 55 21.858 -70.695 -15.781 1.00 65.33 H new ATOM 0 HE2 LYS A 55 24.760 -70.059 -16.457 1.00 14.41 H new ATOM 0 HE3 LYS A 55 23.626 -68.927 -15.746 1.00 14.41 H new ATOM 0 HZ1 LYS A 55 24.862 -69.811 -13.982 1.00 63.50 H new ATOM 0 HZ2 LYS A 55 23.362 -70.602 -13.895 1.00 63.50 H new ATOM 0 HZ3 LYS A 55 24.711 -71.408 -14.539 1.00 63.50 H new ATOM 849 N GLU A 56 21.941 -75.254 -15.214 1.00 61.35 N ATOM 850 CA GLU A 56 22.374 -75.794 -13.930 1.00 4.44 C ATOM 851 C GLU A 56 22.817 -77.240 -14.085 1.00 34.44 C ATOM 852 O GLU A 56 23.932 -77.605 -13.712 1.00 61.15 O ATOM 853 CB GLU A 56 21.236 -75.717 -12.899 1.00 12.34 C ATOM 854 CG GLU A 56 21.632 -76.210 -11.507 1.00 53.51 C ATOM 855 CD GLU A 56 22.485 -75.205 -10.736 1.00 25.14 C ATOM 856 OE1 GLU A 56 23.547 -74.789 -11.245 1.00 63.10 O ATOM 857 OE2 GLU A 56 22.084 -74.807 -9.621 1.00 24.04 O ATOM 0 H GLU A 56 20.957 -74.987 -15.243 1.00 61.35 H new ATOM 0 HA GLU A 56 23.215 -75.196 -13.579 1.00 4.44 H new ATOM 0 HB2 GLU A 56 20.894 -74.685 -12.825 1.00 12.34 H new ATOM 0 HB3 GLU A 56 20.393 -76.307 -13.257 1.00 12.34 H new ATOM 0 HG2 GLU A 56 20.730 -76.427 -10.935 1.00 53.51 H new ATOM 0 HG3 GLU A 56 22.182 -77.146 -11.602 1.00 53.51 H new ATOM 864 N ALA A 57 21.935 -78.054 -14.657 1.00 2.01 N ATOM 865 CA ALA A 57 22.194 -79.476 -14.819 1.00 74.43 C ATOM 866 C ALA A 57 23.454 -79.707 -15.645 1.00 71.13 C ATOM 867 O ALA A 57 24.263 -80.572 -15.328 1.00 12.10 O ATOM 868 CB ALA A 57 20.995 -80.161 -15.456 1.00 4.12 C ATOM 0 H ALA A 57 21.031 -77.749 -15.017 1.00 2.01 H new ATOM 0 HA ALA A 57 22.356 -79.912 -13.833 1.00 74.43 H new ATOM 0 HB1 ALA A 57 21.203 -81.225 -15.571 1.00 4.12 H new ATOM 0 HB2 ALA A 57 20.120 -80.029 -14.820 1.00 4.12 H new ATOM 0 HB3 ALA A 57 20.802 -79.721 -16.434 1.00 4.12 H new ATOM 874 N ASP A 58 23.629 -78.906 -16.688 1.00 44.45 N ATOM 875 CA ASP A 58 24.798 -79.022 -17.557 1.00 61.14 C ATOM 876 C ASP A 58 26.065 -78.593 -16.819 1.00 50.21 C ATOM 877 O ASP A 58 27.131 -79.184 -17.003 1.00 33.21 O ATOM 878 CB ASP A 58 24.610 -78.176 -18.820 1.00 0.41 C ATOM 879 CG ASP A 58 25.820 -78.217 -19.737 1.00 35.12 C ATOM 880 OD1 ASP A 58 26.084 -79.281 -20.334 1.00 22.10 O ATOM 881 OD2 ASP A 58 26.504 -77.182 -19.874 1.00 32.14 O ATOM 0 H ASP A 58 22.977 -78.168 -16.955 1.00 44.45 H new ATOM 0 HA ASP A 58 24.905 -80.067 -17.847 1.00 61.14 H new ATOM 0 HB2 ASP A 58 23.735 -78.531 -19.364 1.00 0.41 H new ATOM 0 HB3 ASP A 58 24.410 -77.143 -18.534 1.00 0.41 H new ATOM 886 N ALA A 59 25.933 -77.576 -15.970 1.00 41.11 N ATOM 887 CA ALA A 59 27.065 -77.058 -15.204 1.00 31.13 C ATOM 888 C ALA A 59 27.495 -78.044 -14.118 1.00 41.12 C ATOM 889 O ALA A 59 28.686 -78.275 -13.907 1.00 73.43 O ATOM 890 CB ALA A 59 26.712 -75.704 -14.592 1.00 33.22 C ATOM 0 H ALA A 59 25.052 -77.093 -15.795 1.00 41.11 H new ATOM 0 HA ALA A 59 27.906 -76.927 -15.885 1.00 31.13 H new ATOM 0 HB1 ALA A 59 27.563 -75.328 -14.024 1.00 33.22 H new ATOM 0 HB2 ALA A 59 26.466 -74.999 -15.386 1.00 33.22 H new ATOM 0 HB3 ALA A 59 25.854 -75.817 -13.929 1.00 33.22 H new ATOM 896 N LEU A 60 26.515 -78.628 -13.437 1.00 54.24 N ATOM 897 CA LEU A 60 26.778 -79.581 -12.356 1.00 74.52 C ATOM 898 C LEU A 60 26.861 -81.015 -12.889 1.00 2.20 C ATOM 899 O LEU A 60 27.137 -81.945 -12.137 1.00 5.04 O ATOM 900 CB LEU A 60 25.702 -79.465 -11.260 1.00 10.34 C ATOM 901 CG LEU A 60 25.907 -78.349 -10.216 1.00 60.33 C ATOM 902 CD1 LEU A 60 27.126 -78.640 -9.347 1.00 41.11 C ATOM 903 CD2 LEU A 60 26.034 -76.983 -10.881 1.00 51.52 C ATOM 0 H LEU A 60 25.525 -78.459 -13.613 1.00 54.24 H new ATOM 0 HA LEU A 60 27.745 -79.334 -11.917 1.00 74.52 H new ATOM 0 HB2 LEU A 60 24.737 -79.309 -11.743 1.00 10.34 H new ATOM 0 HB3 LEU A 60 25.645 -80.418 -10.735 1.00 10.34 H new ATOM 0 HG LEU A 60 25.025 -78.327 -9.576 1.00 60.33 H new ATOM 0 HD11 LEU A 60 27.252 -77.840 -8.617 1.00 41.11 H new ATOM 0 HD12 LEU A 60 26.984 -79.587 -8.826 1.00 41.11 H new ATOM 0 HD13 LEU A 60 28.015 -78.701 -9.975 1.00 41.11 H new ATOM 0 HD21 LEU A 60 26.177 -76.219 -10.117 1.00 51.52 H new ATOM 0 HD22 LEU A 60 26.889 -76.986 -11.557 1.00 51.52 H new ATOM 0 HD23 LEU A 60 25.126 -76.767 -11.445 1.00 51.52 H new ATOM 915 N SER A 61 26.594 -81.184 -14.184 1.00 74.52 N ATOM 916 CA SER A 61 26.814 -82.456 -14.872 1.00 3.53 C ATOM 917 C SER A 61 25.837 -83.541 -14.390 1.00 64.03 C ATOM 918 O SER A 61 26.210 -84.711 -14.246 1.00 34.12 O ATOM 919 CB SER A 61 28.274 -82.908 -14.686 1.00 74.53 C ATOM 920 OG SER A 61 28.545 -84.115 -15.380 1.00 63.03 O ATOM 0 H SER A 61 26.221 -80.447 -14.783 1.00 74.52 H new ATOM 0 HA SER A 61 26.623 -82.304 -15.934 1.00 3.53 H new ATOM 0 HB2 SER A 61 28.945 -82.126 -15.042 1.00 74.53 H new ATOM 0 HB3 SER A 61 28.479 -83.045 -13.624 1.00 74.53 H new ATOM 0 HG SER A 61 27.810 -84.747 -15.237 1.00 63.03 H new ATOM 926 N LEU A 62 24.576 -83.158 -14.171 1.00 73.12 N ATOM 927 CA LEU A 62 23.527 -84.133 -13.871 1.00 32.44 C ATOM 928 C LEU A 62 22.966 -84.697 -15.174 1.00 13.42 C ATOM 929 O LEU A 62 22.685 -83.946 -16.114 1.00 54.02 O ATOM 930 CB LEU A 62 22.372 -83.520 -13.047 1.00 62.02 C ATOM 931 CG LEU A 62 22.720 -83.079 -11.610 1.00 31.13 C ATOM 932 CD1 LEU A 62 23.553 -84.142 -10.903 1.00 22.14 C ATOM 933 CD2 LEU A 62 23.427 -81.732 -11.617 1.00 20.31 C ATOM 0 H LEU A 62 24.260 -82.189 -14.196 1.00 73.12 H new ATOM 0 HA LEU A 62 23.980 -84.923 -13.272 1.00 32.44 H new ATOM 0 HB2 LEU A 62 21.987 -82.655 -13.587 1.00 62.02 H new ATOM 0 HB3 LEU A 62 21.563 -84.249 -12.995 1.00 62.02 H new ATOM 0 HG LEU A 62 21.791 -82.963 -11.052 1.00 31.13 H new ATOM 0 HD11 LEU A 62 23.786 -83.809 -9.892 1.00 22.14 H new ATOM 0 HD12 LEU A 62 22.990 -85.074 -10.857 1.00 22.14 H new ATOM 0 HD13 LEU A 62 24.479 -84.304 -11.454 1.00 22.14 H new ATOM 0 HD21 LEU A 62 23.663 -81.440 -10.594 1.00 20.31 H new ATOM 0 HD22 LEU A 62 24.348 -81.808 -12.195 1.00 20.31 H new ATOM 0 HD23 LEU A 62 22.777 -80.982 -12.067 1.00 20.31 H new ATOM 945 N VAL A 63 22.816 -86.013 -15.230 1.00 63.31 N ATOM 946 CA VAL A 63 22.193 -86.674 -16.370 1.00 53.30 C ATOM 947 C VAL A 63 20.833 -87.213 -15.952 1.00 24.01 C ATOM 948 O VAL A 63 20.620 -87.524 -14.784 1.00 52.40 O ATOM 949 CB VAL A 63 23.072 -87.821 -16.940 1.00 11.42 C ATOM 950 CG1 VAL A 63 24.409 -87.276 -17.439 1.00 23.31 C ATOM 951 CG2 VAL A 63 23.281 -88.926 -15.905 1.00 10.23 C ATOM 0 H VAL A 63 23.120 -86.649 -14.493 1.00 63.31 H new ATOM 0 HA VAL A 63 22.078 -85.937 -17.165 1.00 53.30 H new ATOM 0 HB VAL A 63 22.545 -88.260 -17.787 1.00 11.42 H new ATOM 0 HG11 VAL A 63 25.011 -88.094 -17.834 1.00 23.31 H new ATOM 0 HG12 VAL A 63 24.232 -86.543 -18.226 1.00 23.31 H new ATOM 0 HG13 VAL A 63 24.940 -86.802 -16.613 1.00 23.31 H new ATOM 0 HG21 VAL A 63 23.900 -89.714 -16.334 1.00 10.23 H new ATOM 0 HG22 VAL A 63 23.777 -88.513 -15.027 1.00 10.23 H new ATOM 0 HG23 VAL A 63 22.315 -89.340 -15.615 1.00 10.23 H new ATOM 961 N GLY A 64 19.912 -87.286 -16.893 1.00 15.23 N ATOM 962 CA GLY A 64 18.563 -87.724 -16.593 1.00 55.25 C ATOM 963 C GLY A 64 17.573 -87.099 -17.546 1.00 30.41 C ATOM 964 O GLY A 64 17.831 -87.045 -18.750 1.00 63.55 O ATOM 0 H GLY A 64 20.073 -87.048 -17.872 1.00 15.23 H new ATOM 0 HA2 GLY A 64 18.505 -88.810 -16.661 1.00 55.25 H new ATOM 0 HA3 GLY A 64 18.308 -87.455 -15.568 1.00 55.25 H new ATOM 968 N TYR A 65 16.447 -86.615 -17.031 1.00 73.32 N ATOM 969 CA TYR A 65 15.448 -85.976 -17.881 1.00 13.32 C ATOM 970 C TYR A 65 14.411 -85.230 -17.049 1.00 31.43 C ATOM 971 O TYR A 65 14.073 -85.649 -15.946 1.00 30.44 O ATOM 972 CB TYR A 65 14.805 -87.022 -18.820 1.00 12.34 C ATOM 973 CG TYR A 65 13.292 -87.150 -18.739 1.00 12.32 C ATOM 974 CD1 TYR A 65 12.695 -88.048 -17.857 1.00 2.54 C ATOM 975 CD2 TYR A 65 12.463 -86.390 -19.559 1.00 43.24 C ATOM 976 CE1 TYR A 65 11.322 -88.182 -17.795 1.00 14.21 C ATOM 977 CE2 TYR A 65 11.090 -86.519 -19.499 1.00 74.34 C ATOM 978 CZ TYR A 65 10.525 -87.416 -18.617 1.00 4.14 C ATOM 979 OH TYR A 65 9.156 -87.551 -18.563 1.00 22.34 O ATOM 0 H TYR A 65 16.205 -86.652 -16.041 1.00 73.32 H new ATOM 0 HA TYR A 65 15.940 -85.229 -18.504 1.00 13.32 H new ATOM 0 HB2 TYR A 65 15.074 -86.774 -19.847 1.00 12.34 H new ATOM 0 HB3 TYR A 65 15.244 -87.995 -18.602 1.00 12.34 H new ATOM 0 HD1 TYR A 65 13.317 -88.650 -17.211 1.00 2.54 H new ATOM 0 HD2 TYR A 65 12.901 -85.688 -20.253 1.00 43.24 H new ATOM 0 HE1 TYR A 65 10.875 -88.883 -17.106 1.00 14.21 H new ATOM 0 HE2 TYR A 65 10.461 -85.920 -20.140 1.00 74.34 H new ATOM 0 HH TYR A 65 8.889 -87.814 -17.658 1.00 22.34 H new ATOM 989 N VAL A 66 13.933 -84.107 -17.583 1.00 23.54 N ATOM 990 CA VAL A 66 12.895 -83.301 -16.926 1.00 72.34 C ATOM 991 C VAL A 66 11.886 -82.804 -17.959 1.00 10.41 C ATOM 992 O VAL A 66 12.258 -82.535 -19.102 1.00 63.31 O ATOM 993 CB VAL A 66 13.498 -82.092 -16.141 1.00 1.11 C ATOM 994 CG1 VAL A 66 12.464 -80.987 -15.915 1.00 51.44 C ATOM 995 CG2 VAL A 66 14.066 -82.551 -14.800 1.00 12.42 C ATOM 0 H VAL A 66 14.249 -83.729 -18.476 1.00 23.54 H new ATOM 0 HA VAL A 66 12.392 -83.942 -16.202 1.00 72.34 H new ATOM 0 HB VAL A 66 14.302 -81.681 -16.751 1.00 1.11 H new ATOM 0 HG11 VAL A 66 12.924 -80.165 -15.366 1.00 51.44 H new ATOM 0 HG12 VAL A 66 12.104 -80.624 -16.877 1.00 51.44 H new ATOM 0 HG13 VAL A 66 11.627 -81.384 -15.340 1.00 51.44 H new ATOM 0 HG21 VAL A 66 14.481 -81.695 -14.268 1.00 12.42 H new ATOM 0 HG22 VAL A 66 13.272 -82.999 -14.203 1.00 12.42 H new ATOM 0 HG23 VAL A 66 14.851 -83.288 -14.970 1.00 12.42 H new ATOM 1005 N THR A 67 10.623 -82.691 -17.537 1.00 33.35 N ATOM 1006 CA THR A 67 9.529 -82.224 -18.381 1.00 62.00 C ATOM 1007 C THR A 67 8.423 -81.647 -17.504 1.00 43.22 C ATOM 1008 O THR A 67 8.380 -81.907 -16.300 1.00 43.20 O ATOM 1009 CB THR A 67 8.945 -83.357 -19.258 1.00 20.20 C ATOM 1010 OG1 THR A 67 7.955 -82.831 -20.155 1.00 12.03 O ATOM 1011 CG2 THR A 67 8.313 -84.456 -18.411 1.00 52.41 C ATOM 0 H THR A 67 10.332 -82.925 -16.588 1.00 33.35 H new ATOM 0 HA THR A 67 9.929 -81.459 -19.047 1.00 62.00 H new ATOM 0 HB THR A 67 9.771 -83.787 -19.824 1.00 20.20 H new ATOM 0 HG1 THR A 67 7.594 -83.557 -20.706 1.00 12.03 H new ATOM 0 HG21 THR A 67 7.914 -85.234 -19.063 1.00 52.41 H new ATOM 0 HG22 THR A 67 9.067 -84.886 -17.752 1.00 52.41 H new ATOM 0 HG23 THR A 67 7.505 -84.035 -17.812 1.00 52.41 H new ATOM 1019 N ASN A 68 7.541 -80.859 -18.100 1.00 24.14 N ATOM 1020 CA ASN A 68 6.423 -80.262 -17.373 1.00 73.40 C ATOM 1021 C ASN A 68 5.114 -80.927 -17.788 1.00 73.12 C ATOM 1022 O ASN A 68 5.050 -81.610 -18.812 1.00 10.52 O ATOM 1023 CB ASN A 68 6.357 -78.753 -17.643 1.00 71.15 C ATOM 1024 CG ASN A 68 5.280 -78.030 -16.839 1.00 11.14 C ATOM 1025 OD1 ASN A 68 4.675 -77.072 -17.314 1.00 14.14 O ATOM 1026 ND2 ASN A 68 5.057 -78.460 -15.603 1.00 71.23 N ATOM 0 H ASN A 68 7.576 -80.615 -19.090 1.00 24.14 H new ATOM 0 HA ASN A 68 6.576 -80.419 -16.305 1.00 73.40 H new ATOM 0 HB2 ASN A 68 7.326 -78.310 -17.415 1.00 71.15 H new ATOM 0 HB3 ASN A 68 6.174 -78.591 -18.705 1.00 71.15 H new ATOM 0 HD21 ASN A 68 4.366 -77.992 -15.017 1.00 71.23 H new ATOM 0 HD22 ASN A 68 5.577 -79.259 -15.239 1.00 71.23 H new ATOM 1033 N ASN A 69 4.083 -80.734 -16.982 1.00 74.00 N ATOM 1034 CA ASN A 69 2.752 -81.250 -17.269 1.00 52.24 C ATOM 1035 C ASN A 69 1.738 -80.127 -17.099 1.00 5.25 C ATOM 1036 O ASN A 69 1.868 -79.307 -16.187 1.00 52.52 O ATOM 1037 CB ASN A 69 2.404 -82.415 -16.326 1.00 72.13 C ATOM 1038 CG ASN A 69 3.383 -83.579 -16.420 1.00 72.22 C ATOM 1039 OD1 ASN A 69 3.205 -84.492 -17.225 1.00 2.34 O ATOM 1040 ND2 ASN A 69 4.420 -83.559 -15.591 1.00 31.15 N ATOM 0 H ASN A 69 4.144 -80.213 -16.107 1.00 74.00 H new ATOM 0 HA ASN A 69 2.728 -81.622 -18.293 1.00 52.24 H new ATOM 0 HB2 ASN A 69 2.383 -82.049 -15.300 1.00 72.13 H new ATOM 0 HB3 ASN A 69 1.401 -82.773 -16.557 1.00 72.13 H new ATOM 0 HD21 ASN A 69 5.102 -84.318 -15.608 1.00 31.15 H new ATOM 0 HD22 ASN A 69 4.535 -82.785 -14.937 1.00 31.15 H new ATOM 1047 N GLU A 70 0.732 -80.095 -17.971 1.00 63.52 N ATOM 1048 CA GLU A 70 -0.348 -79.106 -17.894 1.00 54.22 C ATOM 1049 C GLU A 70 -1.072 -79.210 -16.546 1.00 23.41 C ATOM 1050 O GLU A 70 -1.785 -78.294 -16.128 1.00 22.31 O ATOM 1051 CB GLU A 70 -1.330 -79.330 -19.049 1.00 35.24 C ATOM 1052 CG GLU A 70 -2.516 -78.371 -19.072 1.00 73.50 C ATOM 1053 CD GLU A 70 -3.452 -78.619 -20.245 1.00 44.50 C ATOM 1054 OE1 GLU A 70 -3.563 -79.787 -20.692 1.00 22.30 O ATOM 1055 OE2 GLU A 70 -4.094 -77.658 -20.717 1.00 32.11 O ATOM 0 H GLU A 70 0.640 -80.749 -18.748 1.00 63.52 H new ATOM 0 HA GLU A 70 0.076 -78.105 -17.976 1.00 54.22 H new ATOM 0 HB2 GLU A 70 -0.789 -79.240 -19.991 1.00 35.24 H new ATOM 0 HB3 GLU A 70 -1.707 -80.351 -18.995 1.00 35.24 H new ATOM 0 HG2 GLU A 70 -3.074 -78.468 -18.141 1.00 73.50 H new ATOM 0 HG3 GLU A 70 -2.148 -77.346 -19.117 1.00 73.50 H new ATOM 1062 N ASP A 71 -0.843 -80.328 -15.867 1.00 53.44 N ATOM 1063 CA ASP A 71 -1.394 -80.582 -14.538 1.00 52.32 C ATOM 1064 C ASP A 71 -0.824 -79.593 -13.518 1.00 60.33 C ATOM 1065 O ASP A 71 -1.361 -79.436 -12.418 1.00 61.33 O ATOM 1066 CB ASP A 71 -1.045 -82.022 -14.122 1.00 72.43 C ATOM 1067 CG ASP A 71 -1.540 -82.393 -12.731 1.00 73.01 C ATOM 1068 OD1 ASP A 71 -2.706 -82.822 -12.601 1.00 23.34 O ATOM 1069 OD2 ASP A 71 -0.758 -82.283 -11.761 1.00 44.11 O ATOM 0 H ASP A 71 -0.266 -81.090 -16.224 1.00 53.44 H new ATOM 0 HA ASP A 71 -2.476 -80.454 -14.568 1.00 52.32 H new ATOM 0 HB2 ASP A 71 -1.473 -82.714 -14.847 1.00 72.43 H new ATOM 0 HB3 ASP A 71 0.037 -82.150 -14.159 1.00 72.43 H new ATOM 1074 N GLY A 72 0.254 -78.916 -13.903 1.00 2.22 N ATOM 1075 CA GLY A 72 0.910 -77.967 -13.023 1.00 24.21 C ATOM 1076 C GLY A 72 2.032 -78.612 -12.241 1.00 64.40 C ATOM 1077 O GLY A 72 2.358 -78.183 -11.132 1.00 24.14 O ATOM 0 H GLY A 72 0.689 -79.011 -14.821 1.00 2.22 H new ATOM 0 HA2 GLY A 72 1.306 -77.139 -13.611 1.00 24.21 H new ATOM 0 HA3 GLY A 72 0.179 -77.547 -12.332 1.00 24.21 H new ATOM 1081 N SER A 73 2.629 -79.647 -12.824 1.00 74.30 N ATOM 1082 CA SER A 73 3.698 -80.394 -12.175 1.00 53.52 C ATOM 1083 C SER A 73 4.879 -80.600 -13.130 1.00 5.24 C ATOM 1084 O SER A 73 4.699 -80.990 -14.286 1.00 20.32 O ATOM 1085 CB SER A 73 3.156 -81.743 -11.679 1.00 23.04 C ATOM 1086 OG SER A 73 2.392 -82.397 -12.685 1.00 33.31 O ATOM 0 H SER A 73 2.386 -79.989 -13.754 1.00 74.30 H new ATOM 0 HA SER A 73 4.060 -79.822 -11.321 1.00 53.52 H new ATOM 0 HB2 SER A 73 3.986 -82.382 -11.378 1.00 23.04 H new ATOM 0 HB3 SER A 73 2.538 -81.586 -10.795 1.00 23.04 H new ATOM 0 HG SER A 73 1.442 -82.367 -12.445 1.00 33.31 H new ATOM 1092 N VAL A 74 6.080 -80.293 -12.653 1.00 2.14 N ATOM 1093 CA VAL A 74 7.310 -80.549 -13.399 1.00 23.14 C ATOM 1094 C VAL A 74 7.976 -81.805 -12.847 1.00 45.15 C ATOM 1095 O VAL A 74 8.354 -81.845 -11.676 1.00 50.12 O ATOM 1096 CB VAL A 74 8.294 -79.355 -13.296 1.00 61.55 C ATOM 1097 CG1 VAL A 74 9.502 -79.550 -14.213 1.00 25.24 C ATOM 1098 CG2 VAL A 74 7.577 -78.045 -13.609 1.00 44.21 C ATOM 0 H VAL A 74 6.230 -79.861 -11.741 1.00 2.14 H new ATOM 0 HA VAL A 74 7.053 -80.685 -14.450 1.00 23.14 H new ATOM 0 HB VAL A 74 8.664 -79.309 -12.272 1.00 61.55 H new ATOM 0 HG11 VAL A 74 10.173 -78.696 -14.118 1.00 25.24 H new ATOM 0 HG12 VAL A 74 10.031 -80.460 -13.930 1.00 25.24 H new ATOM 0 HG13 VAL A 74 9.165 -79.633 -15.246 1.00 25.24 H new ATOM 0 HG21 VAL A 74 8.282 -77.217 -13.532 1.00 44.21 H new ATOM 0 HG22 VAL A 74 7.172 -78.084 -14.620 1.00 44.21 H new ATOM 0 HG23 VAL A 74 6.764 -77.896 -12.898 1.00 44.21 H new ATOM 1108 N SER A 75 8.107 -82.828 -13.681 1.00 24.41 N ATOM 1109 CA SER A 75 8.584 -84.130 -13.229 1.00 33.53 C ATOM 1110 C SER A 75 9.749 -84.632 -14.085 1.00 25.55 C ATOM 1111 O SER A 75 9.906 -84.230 -15.240 1.00 44.43 O ATOM 1112 CB SER A 75 7.419 -85.125 -13.251 1.00 45.42 C ATOM 1113 OG SER A 75 6.745 -85.105 -14.505 1.00 50.11 O ATOM 0 H SER A 75 7.889 -82.782 -14.676 1.00 24.41 H new ATOM 0 HA SER A 75 8.960 -84.032 -12.211 1.00 33.53 H new ATOM 0 HB2 SER A 75 7.792 -86.130 -13.052 1.00 45.42 H new ATOM 0 HB3 SER A 75 6.716 -84.883 -12.454 1.00 45.42 H new ATOM 0 HG SER A 75 6.008 -85.751 -14.490 1.00 50.11 H new ATOM 1119 N GLY A 76 10.568 -85.504 -13.501 1.00 32.44 N ATOM 1120 CA GLY A 76 11.697 -86.077 -14.210 1.00 51.54 C ATOM 1121 C GLY A 76 12.564 -86.933 -13.305 1.00 43.42 C ATOM 1122 O GLY A 76 12.156 -87.284 -12.197 1.00 53.55 O ATOM 0 H GLY A 76 10.466 -85.826 -12.538 1.00 32.44 H new ATOM 0 HA2 GLY A 76 11.334 -86.681 -15.041 1.00 51.54 H new ATOM 0 HA3 GLY A 76 12.300 -85.276 -14.638 1.00 51.54 H new ATOM 1126 N VAL A 77 13.762 -87.272 -13.774 1.00 42.05 N ATOM 1127 CA VAL A 77 14.702 -88.093 -13.014 1.00 43.44 C ATOM 1128 C VAL A 77 16.099 -87.469 -13.050 1.00 74.14 C ATOM 1129 O VAL A 77 16.529 -86.960 -14.092 1.00 42.33 O ATOM 1130 CB VAL A 77 14.777 -89.541 -13.575 1.00 53.04 C ATOM 1131 CG1 VAL A 77 15.713 -90.410 -12.736 1.00 73.25 C ATOM 1132 CG2 VAL A 77 13.384 -90.168 -13.658 1.00 44.22 C ATOM 0 H VAL A 77 14.109 -86.986 -14.690 1.00 42.05 H new ATOM 0 HA VAL A 77 14.341 -88.136 -11.986 1.00 43.44 H new ATOM 0 HB VAL A 77 15.185 -89.485 -14.584 1.00 53.04 H new ATOM 0 HG11 VAL A 77 15.745 -91.417 -13.152 1.00 73.25 H new ATOM 0 HG12 VAL A 77 16.715 -89.981 -12.746 1.00 73.25 H new ATOM 0 HG13 VAL A 77 15.347 -90.453 -11.710 1.00 73.25 H new ATOM 0 HG21 VAL A 77 13.464 -91.181 -14.053 1.00 44.22 H new ATOM 0 HG22 VAL A 77 12.940 -90.201 -12.663 1.00 44.22 H new ATOM 0 HG23 VAL A 77 12.754 -89.570 -14.317 1.00 44.22 H new ATOM 1142 N VAL A 78 16.797 -87.505 -11.913 1.00 11.12 N ATOM 1143 CA VAL A 78 18.165 -87.006 -11.817 1.00 13.11 C ATOM 1144 C VAL A 78 19.115 -88.164 -11.508 1.00 3.40 C ATOM 1145 O VAL A 78 18.813 -89.028 -10.672 1.00 63.53 O ATOM 1146 CB VAL A 78 18.311 -85.916 -10.723 1.00 55.53 C ATOM 1147 CG1 VAL A 78 18.220 -86.521 -9.327 1.00 52.34 C ATOM 1148 CG2 VAL A 78 19.614 -85.140 -10.889 1.00 23.42 C ATOM 0 H VAL A 78 16.430 -87.880 -11.038 1.00 11.12 H new ATOM 0 HA VAL A 78 18.418 -86.554 -12.776 1.00 13.11 H new ATOM 0 HB VAL A 78 17.483 -85.217 -10.843 1.00 55.53 H new ATOM 0 HG11 VAL A 78 18.326 -85.733 -8.581 1.00 52.34 H new ATOM 0 HG12 VAL A 78 17.253 -87.009 -9.204 1.00 52.34 H new ATOM 0 HG13 VAL A 78 19.016 -87.254 -9.196 1.00 52.34 H new ATOM 0 HG21 VAL A 78 19.689 -84.383 -10.108 1.00 23.42 H new ATOM 0 HG22 VAL A 78 20.458 -85.825 -10.812 1.00 23.42 H new ATOM 0 HG23 VAL A 78 19.628 -84.656 -11.866 1.00 23.42 H new ATOM 1158 N GLN A 79 20.249 -88.185 -12.200 1.00 61.04 N ATOM 1159 CA GLN A 79 21.252 -89.233 -12.041 1.00 72.34 C ATOM 1160 C GLN A 79 22.649 -88.609 -12.076 1.00 51.25 C ATOM 1161 O GLN A 79 22.905 -87.685 -12.853 1.00 1.41 O ATOM 1162 CB GLN A 79 21.120 -90.276 -13.170 1.00 75.34 C ATOM 1163 CG GLN A 79 19.695 -90.454 -13.696 1.00 65.40 C ATOM 1164 CD GLN A 79 19.605 -91.407 -14.872 1.00 13.34 C ATOM 1165 OE1 GLN A 79 18.799 -91.217 -15.778 1.00 12.03 O ATOM 1166 NE2 GLN A 79 20.396 -92.466 -14.844 1.00 41.24 N ATOM 0 H GLN A 79 20.499 -87.475 -12.888 1.00 61.04 H new ATOM 0 HA GLN A 79 21.097 -89.731 -11.084 1.00 72.34 H new ATOM 0 HB2 GLN A 79 21.767 -89.983 -13.997 1.00 75.34 H new ATOM 0 HB3 GLN A 79 21.484 -91.237 -12.806 1.00 75.34 H new ATOM 0 HG2 GLN A 79 19.061 -90.822 -12.890 1.00 65.40 H new ATOM 0 HG3 GLN A 79 19.301 -89.482 -13.994 1.00 65.40 H new ATOM 0 HE21 GLN A 79 21.054 -92.591 -14.075 1.00 41.24 H new ATOM 0 HE22 GLN A 79 20.348 -93.158 -15.592 1.00 41.24 H new ATOM 1175 N GLY A 80 23.545 -89.104 -11.234 1.00 73.20 N ATOM 1176 CA GLY A 80 24.906 -88.597 -11.196 1.00 70.11 C ATOM 1177 C GLY A 80 25.480 -88.640 -9.794 1.00 45.11 C ATOM 1178 O GLY A 80 24.857 -89.205 -8.898 1.00 30.00 O ATOM 0 H GLY A 80 23.353 -89.854 -10.570 1.00 73.20 H new ATOM 0 HA2 GLY A 80 25.533 -89.187 -11.864 1.00 70.11 H new ATOM 0 HA3 GLY A 80 24.923 -87.572 -11.565 1.00 70.11 H new ATOM 1182 N PRO A 81 26.669 -88.055 -9.572 1.00 21.24 N ATOM 1183 CA PRO A 81 27.301 -88.027 -8.247 1.00 24.25 C ATOM 1184 C PRO A 81 26.389 -87.395 -7.190 1.00 43.11 C ATOM 1185 O PRO A 81 25.903 -86.278 -7.374 1.00 61.12 O ATOM 1186 CB PRO A 81 28.567 -87.178 -8.457 1.00 14.12 C ATOM 1187 CG PRO A 81 28.370 -86.480 -9.763 1.00 1.43 C ATOM 1188 CD PRO A 81 27.491 -87.375 -10.587 1.00 73.32 C ATOM 0 HA PRO A 81 27.516 -89.029 -7.877 1.00 24.25 H new ATOM 0 HB2 PRO A 81 28.698 -86.462 -7.646 1.00 14.12 H new ATOM 0 HB3 PRO A 81 29.460 -87.803 -8.477 1.00 14.12 H new ATOM 0 HG2 PRO A 81 27.905 -85.505 -9.617 1.00 1.43 H new ATOM 0 HG3 PRO A 81 29.325 -86.307 -10.260 1.00 1.43 H new ATOM 0 HD2 PRO A 81 26.879 -86.807 -11.287 1.00 73.32 H new ATOM 0 HD3 PRO A 81 28.074 -88.083 -11.175 1.00 73.32 H new ATOM 1196 N LYS A 82 26.174 -88.119 -6.087 1.00 34.24 N ATOM 1197 CA LYS A 82 25.267 -87.695 -5.008 1.00 65.22 C ATOM 1198 C LYS A 82 25.466 -86.228 -4.603 1.00 10.03 C ATOM 1199 O LYS A 82 24.510 -85.550 -4.227 1.00 13.55 O ATOM 1200 CB LYS A 82 25.412 -88.635 -3.788 1.00 54.13 C ATOM 1201 CG LYS A 82 26.839 -89.133 -3.511 1.00 14.43 C ATOM 1202 CD LYS A 82 27.736 -88.064 -2.890 1.00 71.14 C ATOM 1203 CE LYS A 82 29.153 -88.583 -2.658 1.00 51.01 C ATOM 1204 NZ LYS A 82 29.177 -89.784 -1.779 1.00 4.33 N ATOM 0 H LYS A 82 26.624 -89.018 -5.914 1.00 34.24 H new ATOM 0 HA LYS A 82 24.251 -87.768 -5.395 1.00 65.22 H new ATOM 0 HB2 LYS A 82 25.048 -88.114 -2.903 1.00 54.13 H new ATOM 0 HB3 LYS A 82 24.765 -89.500 -3.937 1.00 54.13 H new ATOM 0 HG2 LYS A 82 26.794 -89.994 -2.844 1.00 14.43 H new ATOM 0 HG3 LYS A 82 27.285 -89.476 -4.444 1.00 14.43 H new ATOM 0 HD2 LYS A 82 27.770 -87.192 -3.544 1.00 71.14 H new ATOM 0 HD3 LYS A 82 27.309 -87.736 -1.943 1.00 71.14 H new ATOM 0 HE2 LYS A 82 29.610 -88.828 -3.617 1.00 51.01 H new ATOM 0 HE3 LYS A 82 29.758 -87.795 -2.209 1.00 51.01 H new ATOM 0 HZ1 LYS A 82 30.153 -89.969 -1.471 1.00 4.33 H new ATOM 0 HZ2 LYS A 82 28.577 -89.617 -0.946 1.00 4.33 H new ATOM 0 HZ3 LYS A 82 28.818 -90.606 -2.305 1.00 4.33 H new ATOM 1218 N GLU A 83 26.695 -85.739 -4.706 1.00 45.34 N ATOM 1219 CA GLU A 83 27.006 -84.363 -4.329 1.00 53.14 C ATOM 1220 C GLU A 83 26.397 -83.369 -5.326 1.00 41.52 C ATOM 1221 O GLU A 83 25.827 -82.343 -4.938 1.00 1.31 O ATOM 1222 CB GLU A 83 28.527 -84.174 -4.209 1.00 53.44 C ATOM 1223 CG GLU A 83 29.317 -84.784 -5.361 1.00 34.25 C ATOM 1224 CD GLU A 83 30.817 -84.591 -5.212 1.00 42.22 C ATOM 1225 OE1 GLU A 83 31.333 -83.530 -5.622 1.00 25.22 O ATOM 1226 OE2 GLU A 83 31.485 -85.499 -4.671 1.00 53.32 O ATOM 0 H GLU A 83 27.494 -86.273 -5.047 1.00 45.34 H new ATOM 0 HA GLU A 83 26.561 -84.162 -3.355 1.00 53.14 H new ATOM 0 HB2 GLU A 83 28.748 -83.108 -4.154 1.00 53.44 H new ATOM 0 HB3 GLU A 83 28.866 -84.618 -3.273 1.00 53.44 H new ATOM 0 HG2 GLU A 83 29.097 -85.850 -5.423 1.00 34.25 H new ATOM 0 HG3 GLU A 83 28.989 -84.336 -6.299 1.00 34.25 H new ATOM 1233 N GLN A 84 26.505 -83.680 -6.614 1.00 71.32 N ATOM 1234 CA GLN A 84 25.911 -82.841 -7.651 1.00 73.41 C ATOM 1235 C GLN A 84 24.394 -83.026 -7.664 1.00 4.41 C ATOM 1236 O GLN A 84 23.649 -82.106 -8.008 1.00 35.12 O ATOM 1237 CB GLN A 84 26.514 -83.158 -9.028 1.00 70.43 C ATOM 1238 CG GLN A 84 27.869 -82.501 -9.289 1.00 43.51 C ATOM 1239 CD GLN A 84 28.961 -82.938 -8.328 1.00 53.33 C ATOM 1240 OE1 GLN A 84 29.652 -83.926 -8.563 1.00 64.14 O ATOM 1241 NE2 GLN A 84 29.135 -82.201 -7.244 1.00 5.13 N ATOM 0 H GLN A 84 26.996 -84.503 -6.964 1.00 71.32 H new ATOM 0 HA GLN A 84 26.134 -81.798 -7.426 1.00 73.41 H new ATOM 0 HB2 GLN A 84 26.623 -84.238 -9.124 1.00 70.43 H new ATOM 0 HB3 GLN A 84 25.814 -82.839 -9.800 1.00 70.43 H new ATOM 0 HG2 GLN A 84 28.182 -82.730 -10.308 1.00 43.51 H new ATOM 0 HG3 GLN A 84 27.755 -81.419 -9.226 1.00 43.51 H new ATOM 0 HE21 GLN A 84 28.543 -81.387 -7.080 1.00 5.13 H new ATOM 0 HE22 GLN A 84 29.861 -82.447 -6.571 1.00 5.13 H new ATOM 1250 N VAL A 85 23.943 -84.218 -7.280 1.00 33.13 N ATOM 1251 CA VAL A 85 22.516 -84.478 -7.105 1.00 22.34 C ATOM 1252 C VAL A 85 21.973 -83.578 -6.000 1.00 73.43 C ATOM 1253 O VAL A 85 20.870 -83.031 -6.104 1.00 53.31 O ATOM 1254 CB VAL A 85 22.242 -85.966 -6.760 1.00 44.11 C ATOM 1255 CG1 VAL A 85 20.757 -86.201 -6.488 1.00 71.00 C ATOM 1256 CG2 VAL A 85 22.735 -86.875 -7.886 1.00 25.24 C ATOM 0 H VAL A 85 24.544 -85.018 -7.084 1.00 33.13 H new ATOM 0 HA VAL A 85 22.011 -84.261 -8.046 1.00 22.34 H new ATOM 0 HB VAL A 85 22.792 -86.211 -5.851 1.00 44.11 H new ATOM 0 HG11 VAL A 85 20.593 -87.252 -6.249 1.00 71.00 H new ATOM 0 HG12 VAL A 85 20.439 -85.584 -5.648 1.00 71.00 H new ATOM 0 HG13 VAL A 85 20.179 -85.936 -7.373 1.00 71.00 H new ATOM 0 HG21 VAL A 85 22.535 -87.915 -7.628 1.00 25.24 H new ATOM 0 HG22 VAL A 85 22.215 -86.624 -8.810 1.00 25.24 H new ATOM 0 HG23 VAL A 85 23.807 -86.735 -8.024 1.00 25.24 H new ATOM 1266 N ASP A 86 22.777 -83.411 -4.952 1.00 15.30 N ATOM 1267 CA ASP A 86 22.454 -82.490 -3.871 1.00 63.23 C ATOM 1268 C ASP A 86 22.424 -81.061 -4.401 1.00 64.31 C ATOM 1269 O ASP A 86 21.536 -80.279 -4.062 1.00 72.04 O ATOM 1270 CB ASP A 86 23.467 -82.604 -2.727 1.00 35.40 C ATOM 1271 CG ASP A 86 23.168 -81.633 -1.593 1.00 14.31 C ATOM 1272 OD1 ASP A 86 22.323 -81.953 -0.734 1.00 61.35 O ATOM 1273 OD2 ASP A 86 23.775 -80.540 -1.550 1.00 32.10 O ATOM 0 H ASP A 86 23.661 -83.906 -4.831 1.00 15.30 H new ATOM 0 HA ASP A 86 21.471 -82.753 -3.480 1.00 63.23 H new ATOM 0 HB2 ASP A 86 23.462 -83.623 -2.341 1.00 35.40 H new ATOM 0 HB3 ASP A 86 24.469 -82.413 -3.111 1.00 35.40 H new ATOM 1278 N ALA A 87 23.403 -80.723 -5.240 1.00 21.34 N ATOM 1279 CA ALA A 87 23.420 -79.425 -5.907 1.00 34.53 C ATOM 1280 C ALA A 87 22.107 -79.191 -6.655 1.00 20.20 C ATOM 1281 O ALA A 87 21.550 -78.087 -6.645 1.00 62.15 O ATOM 1282 CB ALA A 87 24.596 -79.336 -6.873 1.00 10.13 C ATOM 0 H ALA A 87 24.191 -81.328 -5.472 1.00 21.34 H new ATOM 0 HA ALA A 87 23.533 -78.651 -5.147 1.00 34.53 H new ATOM 0 HB1 ALA A 87 24.593 -78.361 -7.361 1.00 10.13 H new ATOM 0 HB2 ALA A 87 25.529 -79.463 -6.324 1.00 10.13 H new ATOM 0 HB3 ALA A 87 24.509 -80.119 -7.626 1.00 10.13 H new ATOM 1288 N PHE A 88 21.613 -80.250 -7.290 1.00 23.24 N ATOM 1289 CA PHE A 88 20.388 -80.176 -8.077 1.00 53.22 C ATOM 1290 C PHE A 88 19.165 -79.974 -7.177 1.00 41.43 C ATOM 1291 O PHE A 88 18.284 -79.177 -7.497 1.00 24.23 O ATOM 1292 CB PHE A 88 20.223 -81.439 -8.931 1.00 13.44 C ATOM 1293 CG PHE A 88 19.276 -81.259 -10.093 1.00 60.45 C ATOM 1294 CD1 PHE A 88 19.707 -80.635 -11.255 1.00 2.04 C ATOM 1295 CD2 PHE A 88 17.965 -81.712 -10.029 1.00 41.43 C ATOM 1296 CE1 PHE A 88 18.851 -80.464 -12.327 1.00 65.45 C ATOM 1297 CE2 PHE A 88 17.105 -81.543 -11.099 1.00 43.45 C ATOM 1298 CZ PHE A 88 17.550 -80.919 -12.249 1.00 72.11 C ATOM 0 H PHE A 88 22.046 -81.174 -7.274 1.00 23.24 H new ATOM 0 HA PHE A 88 20.464 -79.314 -8.739 1.00 53.22 H new ATOM 0 HB2 PHE A 88 21.199 -81.741 -9.311 1.00 13.44 H new ATOM 0 HB3 PHE A 88 19.861 -82.251 -8.300 1.00 13.44 H new ATOM 0 HD1 PHE A 88 20.724 -80.278 -11.323 1.00 2.04 H new ATOM 0 HD2 PHE A 88 17.613 -82.202 -9.133 1.00 41.43 H new ATOM 0 HE1 PHE A 88 19.200 -79.975 -13.225 1.00 65.45 H new ATOM 0 HE2 PHE A 88 16.087 -81.898 -11.036 1.00 43.45 H new ATOM 0 HZ PHE A 88 16.880 -80.787 -13.086 1.00 72.11 H new ATOM 1308 N VAL A 89 19.102 -80.690 -6.051 1.00 5.13 N ATOM 1309 CA VAL A 89 17.985 -80.518 -5.115 1.00 63.22 C ATOM 1310 C VAL A 89 18.027 -79.119 -4.496 1.00 22.42 C ATOM 1311 O VAL A 89 16.982 -78.511 -4.244 1.00 63.11 O ATOM 1312 CB VAL A 89 17.949 -81.604 -3.998 1.00 62.24 C ATOM 1313 CG1 VAL A 89 19.049 -81.396 -2.959 1.00 41.30 C ATOM 1314 CG2 VAL A 89 16.574 -81.648 -3.333 1.00 71.34 C ATOM 0 H VAL A 89 19.796 -81.382 -5.768 1.00 5.13 H new ATOM 0 HA VAL A 89 17.069 -80.638 -5.693 1.00 63.22 H new ATOM 0 HB VAL A 89 18.136 -82.566 -4.475 1.00 62.24 H new ATOM 0 HG11 VAL A 89 18.985 -82.176 -2.200 1.00 41.30 H new ATOM 0 HG12 VAL A 89 20.023 -81.442 -3.446 1.00 41.30 H new ATOM 0 HG13 VAL A 89 18.925 -80.421 -2.488 1.00 41.30 H new ATOM 0 HG21 VAL A 89 16.570 -82.413 -2.556 1.00 71.34 H new ATOM 0 HG22 VAL A 89 16.354 -80.678 -2.888 1.00 71.34 H new ATOM 0 HG23 VAL A 89 15.816 -81.885 -4.080 1.00 71.34 H new ATOM 1324 N LYS A 90 19.238 -78.602 -4.266 1.00 72.24 N ATOM 1325 CA LYS A 90 19.415 -77.220 -3.822 1.00 63.21 C ATOM 1326 C LYS A 90 18.821 -76.275 -4.864 1.00 31.12 C ATOM 1327 O LYS A 90 18.117 -75.321 -4.532 1.00 14.12 O ATOM 1328 CB LYS A 90 20.904 -76.891 -3.612 1.00 12.24 C ATOM 1329 CG LYS A 90 21.569 -77.633 -2.454 1.00 73.32 C ATOM 1330 CD LYS A 90 20.969 -77.245 -1.105 1.00 40.24 C ATOM 1331 CE LYS A 90 21.752 -77.841 0.063 1.00 1.53 C ATOM 1332 NZ LYS A 90 21.803 -79.329 0.015 1.00 60.33 N ATOM 0 H LYS A 90 20.108 -79.121 -4.380 1.00 72.24 H new ATOM 0 HA LYS A 90 18.902 -77.094 -2.869 1.00 63.21 H new ATOM 0 HB2 LYS A 90 21.445 -77.121 -4.530 1.00 12.24 H new ATOM 0 HB3 LYS A 90 21.004 -75.819 -3.443 1.00 12.24 H new ATOM 0 HG2 LYS A 90 21.462 -78.707 -2.603 1.00 73.32 H new ATOM 0 HG3 LYS A 90 22.637 -77.417 -2.451 1.00 73.32 H new ATOM 0 HD2 LYS A 90 20.953 -76.159 -1.014 1.00 40.24 H new ATOM 0 HD3 LYS A 90 19.934 -77.584 -1.058 1.00 40.24 H new ATOM 0 HE2 LYS A 90 22.768 -77.445 0.055 1.00 1.53 H new ATOM 0 HE3 LYS A 90 21.295 -77.526 1.001 1.00 1.53 H new ATOM 0 HZ1 LYS A 90 21.776 -79.709 0.983 1.00 60.33 H new ATOM 0 HZ2 LYS A 90 20.986 -79.687 -0.520 1.00 60.33 H new ATOM 0 HZ3 LYS A 90 22.682 -79.631 -0.451 1.00 60.33 H new ATOM 1346 N TYR A 91 19.115 -76.559 -6.128 1.00 10.11 N ATOM 1347 CA TYR A 91 18.560 -75.802 -7.246 1.00 12.44 C ATOM 1348 C TYR A 91 17.035 -75.884 -7.250 1.00 44.40 C ATOM 1349 O TYR A 91 16.348 -74.878 -7.424 1.00 2.03 O ATOM 1350 CB TYR A 91 19.127 -76.336 -8.570 1.00 54.24 C ATOM 1351 CG TYR A 91 18.362 -75.887 -9.800 1.00 52.31 C ATOM 1352 CD1 TYR A 91 18.459 -74.583 -10.272 1.00 71.31 C ATOM 1353 CD2 TYR A 91 17.541 -76.776 -10.487 1.00 52.30 C ATOM 1354 CE1 TYR A 91 17.758 -74.178 -11.391 1.00 23.41 C ATOM 1355 CE2 TYR A 91 16.839 -76.379 -11.606 1.00 24.51 C ATOM 1356 CZ TYR A 91 16.950 -75.080 -12.054 1.00 4.44 C ATOM 1357 OH TYR A 91 16.251 -74.683 -13.170 1.00 53.33 O ATOM 0 H TYR A 91 19.740 -77.315 -6.406 1.00 10.11 H new ATOM 0 HA TYR A 91 18.844 -74.756 -7.134 1.00 12.44 H new ATOM 0 HB2 TYR A 91 20.164 -76.015 -8.664 1.00 54.24 H new ATOM 0 HB3 TYR A 91 19.132 -77.425 -8.537 1.00 54.24 H new ATOM 0 HD1 TYR A 91 19.092 -73.876 -9.756 1.00 71.31 H new ATOM 0 HD2 TYR A 91 17.452 -77.794 -10.138 1.00 52.30 H new ATOM 0 HE1 TYR A 91 17.841 -73.161 -11.745 1.00 23.41 H new ATOM 0 HE2 TYR A 91 16.206 -77.082 -12.128 1.00 24.51 H new ATOM 0 HH TYR A 91 15.599 -73.996 -12.920 1.00 53.33 H new ATOM 1367 N LEU A 92 16.518 -77.085 -7.042 1.00 51.34 N ATOM 1368 CA LEU A 92 15.079 -77.319 -7.063 1.00 60.14 C ATOM 1369 C LEU A 92 14.396 -76.530 -5.945 1.00 5.34 C ATOM 1370 O LEU A 92 13.311 -75.976 -6.128 1.00 21.55 O ATOM 1371 CB LEU A 92 14.787 -78.823 -6.918 1.00 42.10 C ATOM 1372 CG LEU A 92 13.675 -79.374 -7.826 1.00 14.12 C ATOM 1373 CD1 LEU A 92 12.354 -78.644 -7.598 1.00 1.11 C ATOM 1374 CD2 LEU A 92 14.097 -79.291 -9.293 1.00 4.50 C ATOM 0 H LEU A 92 17.076 -77.918 -6.856 1.00 51.34 H new ATOM 0 HA LEU A 92 14.680 -76.977 -8.018 1.00 60.14 H new ATOM 0 HB2 LEU A 92 15.705 -79.374 -7.122 1.00 42.10 H new ATOM 0 HB3 LEU A 92 14.518 -79.024 -5.881 1.00 42.10 H new ATOM 0 HG LEU A 92 13.518 -80.421 -7.568 1.00 14.12 H new ATOM 0 HD11 LEU A 92 11.591 -79.059 -8.256 1.00 1.11 H new ATOM 0 HD12 LEU A 92 12.045 -78.767 -6.560 1.00 1.11 H new ATOM 0 HD13 LEU A 92 12.482 -77.583 -7.815 1.00 1.11 H new ATOM 0 HD21 LEU A 92 13.300 -79.685 -9.924 1.00 4.50 H new ATOM 0 HD22 LEU A 92 14.290 -78.251 -9.558 1.00 4.50 H new ATOM 0 HD23 LEU A 92 15.003 -79.878 -9.445 1.00 4.50 H new ATOM 1386 N HIS A 93 15.048 -76.484 -4.783 1.00 5.42 N ATOM 1387 CA HIS A 93 14.531 -75.738 -3.633 1.00 23.34 C ATOM 1388 C HIS A 93 14.417 -74.245 -3.947 1.00 11.23 C ATOM 1389 O HIS A 93 13.611 -73.540 -3.339 1.00 14.15 O ATOM 1390 CB HIS A 93 15.420 -75.944 -2.396 1.00 35.40 C ATOM 1391 CG HIS A 93 15.380 -77.333 -1.840 1.00 30.45 C ATOM 1392 ND1 HIS A 93 16.404 -77.866 -1.092 1.00 2.31 N ATOM 1393 CD2 HIS A 93 14.429 -78.299 -1.909 1.00 73.34 C ATOM 1394 CE1 HIS A 93 16.093 -79.093 -0.727 1.00 65.23 C ATOM 1395 NE2 HIS A 93 14.899 -79.380 -1.208 1.00 2.30 N ATOM 0 H HIS A 93 15.936 -76.955 -4.612 1.00 5.42 H new ATOM 0 HA HIS A 93 13.535 -76.125 -3.417 1.00 23.34 H new ATOM 0 HB2 HIS A 93 16.449 -75.698 -2.656 1.00 35.40 H new ATOM 0 HB3 HIS A 93 15.112 -75.244 -1.619 1.00 35.40 H new ATOM 0 HD2 HIS A 93 13.480 -78.229 -2.420 1.00 73.34 H new ATOM 0 HE1 HIS A 93 16.711 -79.752 -0.135 1.00 65.23 H new ATOM 0 HE2 HIS A 93 14.405 -80.263 -1.079 1.00 2.30 H new ATOM 1404 N LYS A 94 15.228 -73.768 -4.896 1.00 64.43 N ATOM 1405 CA LYS A 94 15.177 -72.366 -5.320 1.00 13.01 C ATOM 1406 C LYS A 94 13.842 -72.069 -6.006 1.00 4.10 C ATOM 1407 O LYS A 94 13.333 -70.946 -5.952 1.00 53.20 O ATOM 1408 CB LYS A 94 16.342 -72.039 -6.272 1.00 13.44 C ATOM 1409 CG LYS A 94 17.730 -72.208 -5.651 1.00 34.11 C ATOM 1410 CD LYS A 94 18.838 -71.869 -6.650 1.00 31.12 C ATOM 1411 CE LYS A 94 20.226 -71.917 -6.015 1.00 75.41 C ATOM 1412 NZ LYS A 94 20.595 -73.283 -5.559 1.00 1.31 N ATOM 0 H LYS A 94 15.925 -74.330 -5.384 1.00 64.43 H new ATOM 0 HA LYS A 94 15.269 -71.739 -4.433 1.00 13.01 H new ATOM 0 HB2 LYS A 94 16.269 -72.681 -7.150 1.00 13.44 H new ATOM 0 HB3 LYS A 94 16.235 -71.011 -6.619 1.00 13.44 H new ATOM 0 HG2 LYS A 94 17.819 -71.564 -4.776 1.00 34.11 H new ATOM 0 HG3 LYS A 94 17.852 -73.234 -5.305 1.00 34.11 H new ATOM 0 HD2 LYS A 94 18.798 -72.569 -7.484 1.00 31.12 H new ATOM 0 HD3 LYS A 94 18.663 -70.874 -7.060 1.00 31.12 H new ATOM 0 HE2 LYS A 94 20.964 -71.566 -6.736 1.00 75.41 H new ATOM 0 HE3 LYS A 94 20.258 -71.233 -5.167 1.00 75.41 H new ATOM 0 HZ1 LYS A 94 21.515 -73.251 -5.075 1.00 1.31 H new ATOM 0 HZ2 LYS A 94 19.871 -73.637 -4.902 1.00 1.31 H new ATOM 0 HZ3 LYS A 94 20.658 -73.918 -6.380 1.00 1.31 H new ATOM 1426 N GLY A 95 13.287 -73.092 -6.651 1.00 31.54 N ATOM 1427 CA GLY A 95 11.991 -72.973 -7.296 1.00 21.24 C ATOM 1428 C GLY A 95 12.021 -72.092 -8.531 1.00 10.52 C ATOM 1429 O GLY A 95 13.091 -71.734 -9.027 1.00 3.03 O ATOM 0 H GLY A 95 13.719 -74.012 -6.739 1.00 31.54 H new ATOM 0 HA2 GLY A 95 11.637 -73.966 -7.573 1.00 21.24 H new ATOM 0 HA3 GLY A 95 11.273 -72.566 -6.584 1.00 21.24 H new ATOM 1433 N SER A 96 10.839 -71.751 -9.032 1.00 75.45 N ATOM 1434 CA SER A 96 10.711 -70.876 -10.189 1.00 64.44 C ATOM 1435 C SER A 96 11.051 -69.435 -9.795 1.00 73.22 C ATOM 1436 O SER A 96 10.806 -69.031 -8.658 1.00 41.20 O ATOM 1437 CB SER A 96 9.286 -70.967 -10.743 1.00 73.31 C ATOM 1438 OG SER A 96 8.927 -72.317 -10.984 1.00 75.44 O ATOM 0 H SER A 96 9.949 -72.071 -8.650 1.00 75.45 H new ATOM 0 HA SER A 96 11.409 -71.191 -10.965 1.00 64.44 H new ATOM 0 HB2 SER A 96 8.587 -70.520 -10.036 1.00 73.31 H new ATOM 0 HB3 SER A 96 9.213 -70.395 -11.668 1.00 73.31 H new ATOM 0 HG SER A 96 8.013 -72.355 -11.336 1.00 75.44 H new ATOM 1444 N PRO A 97 11.615 -68.638 -10.725 1.00 15.32 N ATOM 1445 CA PRO A 97 12.099 -67.288 -10.411 1.00 63.34 C ATOM 1446 C PRO A 97 10.971 -66.333 -10.011 1.00 3.15 C ATOM 1447 O PRO A 97 11.035 -65.690 -8.961 1.00 13.01 O ATOM 1448 CB PRO A 97 12.777 -66.825 -11.714 1.00 53.52 C ATOM 1449 CG PRO A 97 12.172 -67.663 -12.789 1.00 13.42 C ATOM 1450 CD PRO A 97 11.820 -68.982 -12.147 1.00 51.42 C ATOM 0 HA PRO A 97 12.771 -67.293 -9.553 1.00 63.34 H new ATOM 0 HB2 PRO A 97 12.600 -65.765 -11.895 1.00 53.52 H new ATOM 0 HB3 PRO A 97 13.857 -66.964 -11.667 1.00 53.52 H new ATOM 0 HG2 PRO A 97 11.286 -67.183 -13.204 1.00 13.42 H new ATOM 0 HG3 PRO A 97 12.872 -67.805 -13.612 1.00 13.42 H new ATOM 0 HD2 PRO A 97 10.922 -69.414 -12.588 1.00 51.42 H new ATOM 0 HD3 PRO A 97 12.619 -69.713 -12.271 1.00 51.42 H new ATOM 1458 N LYS A 98 9.932 -66.249 -10.845 1.00 53.54 N ATOM 1459 CA LYS A 98 8.833 -65.307 -10.614 1.00 24.34 C ATOM 1460 C LYS A 98 7.497 -66.032 -10.490 1.00 74.31 C ATOM 1461 O LYS A 98 6.433 -65.413 -10.560 1.00 21.32 O ATOM 1462 CB LYS A 98 8.779 -64.268 -11.745 1.00 51.22 C ATOM 1463 CG LYS A 98 10.038 -63.410 -11.838 1.00 43.41 C ATOM 1464 CD LYS A 98 9.903 -62.281 -12.857 1.00 31.02 C ATOM 1465 CE LYS A 98 8.766 -61.328 -12.502 1.00 2.21 C ATOM 1466 NZ LYS A 98 8.703 -60.170 -13.426 1.00 75.23 N ATOM 0 H LYS A 98 9.828 -66.820 -11.684 1.00 53.54 H new ATOM 0 HA LYS A 98 9.020 -64.794 -9.671 1.00 24.34 H new ATOM 0 HB2 LYS A 98 8.627 -64.782 -12.694 1.00 51.22 H new ATOM 0 HB3 LYS A 98 7.916 -63.619 -11.592 1.00 51.22 H new ATOM 0 HG2 LYS A 98 10.258 -62.986 -10.858 1.00 43.41 H new ATOM 0 HG3 LYS A 98 10.884 -64.041 -12.110 1.00 43.41 H new ATOM 0 HD2 LYS A 98 10.839 -61.725 -12.910 1.00 31.02 H new ATOM 0 HD3 LYS A 98 9.727 -62.704 -13.846 1.00 31.02 H new ATOM 0 HE2 LYS A 98 7.819 -61.867 -12.531 1.00 2.21 H new ATOM 0 HE3 LYS A 98 8.898 -60.970 -11.481 1.00 2.21 H new ATOM 0 HZ1 LYS A 98 7.917 -59.548 -13.150 1.00 75.23 H new ATOM 0 HZ2 LYS A 98 9.597 -59.640 -13.380 1.00 75.23 H new ATOM 0 HZ3 LYS A 98 8.551 -60.509 -14.397 1.00 75.23 H new ATOM 1480 N SER A 99 7.552 -67.346 -10.305 1.00 22.33 N ATOM 1481 CA SER A 99 6.351 -68.147 -10.091 1.00 33.13 C ATOM 1482 C SER A 99 6.468 -68.906 -8.769 1.00 51.15 C ATOM 1483 O SER A 99 7.565 -69.313 -8.377 1.00 65.20 O ATOM 1484 CB SER A 99 6.152 -69.120 -11.258 1.00 24.15 C ATOM 1485 OG SER A 99 6.153 -68.427 -12.501 1.00 42.35 O ATOM 0 H SER A 99 8.420 -67.882 -10.299 1.00 22.33 H new ATOM 0 HA SER A 99 5.483 -67.490 -10.042 1.00 33.13 H new ATOM 0 HB2 SER A 99 6.945 -69.868 -11.253 1.00 24.15 H new ATOM 0 HB3 SER A 99 5.210 -69.654 -11.135 1.00 24.15 H new ATOM 0 HG SER A 99 6.026 -69.067 -13.232 1.00 42.35 H new ATOM 1491 N VAL A 100 5.343 -69.087 -8.088 1.00 74.22 N ATOM 1492 CA VAL A 100 5.327 -69.713 -6.771 1.00 45.42 C ATOM 1493 C VAL A 100 5.188 -71.232 -6.888 1.00 51.00 C ATOM 1494 O VAL A 100 4.309 -71.732 -7.596 1.00 74.34 O ATOM 1495 CB VAL A 100 4.167 -69.159 -5.902 1.00 21.34 C ATOM 1496 CG1 VAL A 100 4.183 -69.774 -4.504 1.00 13.01 C ATOM 1497 CG2 VAL A 100 4.230 -67.633 -5.825 1.00 20.43 C ATOM 0 H VAL A 100 4.423 -68.807 -8.429 1.00 74.22 H new ATOM 0 HA VAL A 100 6.276 -69.476 -6.290 1.00 45.42 H new ATOM 0 HB VAL A 100 3.228 -69.439 -6.379 1.00 21.34 H new ATOM 0 HG11 VAL A 100 3.359 -69.367 -3.918 1.00 13.01 H new ATOM 0 HG12 VAL A 100 4.074 -70.856 -4.581 1.00 13.01 H new ATOM 0 HG13 VAL A 100 5.128 -69.539 -4.014 1.00 13.01 H new ATOM 0 HG21 VAL A 100 3.408 -67.265 -5.211 1.00 20.43 H new ATOM 0 HG22 VAL A 100 5.178 -67.330 -5.381 1.00 20.43 H new ATOM 0 HG23 VAL A 100 4.149 -67.214 -6.828 1.00 20.43 H new ATOM 1507 N VAL A 101 6.069 -71.956 -6.207 1.00 73.33 N ATOM 1508 CA VAL A 101 6.001 -73.413 -6.153 1.00 33.12 C ATOM 1509 C VAL A 101 4.976 -73.858 -5.110 1.00 14.21 C ATOM 1510 O VAL A 101 4.746 -73.167 -4.115 1.00 71.23 O ATOM 1511 CB VAL A 101 7.380 -74.044 -5.824 1.00 1.53 C ATOM 1512 CG1 VAL A 101 8.408 -73.673 -6.892 1.00 0.11 C ATOM 1513 CG2 VAL A 101 7.864 -73.623 -4.432 1.00 23.20 C ATOM 0 H VAL A 101 6.845 -71.554 -5.680 1.00 73.33 H new ATOM 0 HA VAL A 101 5.696 -73.759 -7.141 1.00 33.12 H new ATOM 0 HB VAL A 101 7.263 -75.128 -5.821 1.00 1.53 H new ATOM 0 HG11 VAL A 101 9.369 -74.124 -6.645 1.00 0.11 H new ATOM 0 HG12 VAL A 101 8.074 -74.041 -7.862 1.00 0.11 H new ATOM 0 HG13 VAL A 101 8.516 -72.589 -6.932 1.00 0.11 H new ATOM 0 HG21 VAL A 101 8.832 -74.081 -4.230 1.00 23.20 H new ATOM 0 HG22 VAL A 101 7.960 -72.538 -4.393 1.00 23.20 H new ATOM 0 HG23 VAL A 101 7.144 -73.951 -3.682 1.00 23.20 H new ATOM 1523 N LYS A 102 4.348 -74.997 -5.354 1.00 25.24 N ATOM 1524 CA LYS A 102 3.371 -75.553 -4.430 1.00 22.23 C ATOM 1525 C LYS A 102 4.079 -76.452 -3.418 1.00 52.51 C ATOM 1526 O LYS A 102 3.957 -76.254 -2.205 1.00 64.20 O ATOM 1527 CB LYS A 102 2.315 -76.354 -5.204 1.00 14.41 C ATOM 1528 CG LYS A 102 1.146 -76.856 -4.354 1.00 2.24 C ATOM 1529 CD LYS A 102 0.350 -77.953 -5.061 1.00 35.55 C ATOM 1530 CE LYS A 102 -0.083 -77.550 -6.470 1.00 34.44 C ATOM 1531 NZ LYS A 102 -0.956 -76.346 -6.477 1.00 11.03 N ATOM 0 H LYS A 102 4.499 -75.559 -6.192 1.00 25.24 H new ATOM 0 HA LYS A 102 2.873 -74.742 -3.899 1.00 22.23 H new ATOM 0 HB2 LYS A 102 1.922 -75.730 -6.007 1.00 14.41 H new ATOM 0 HB3 LYS A 102 2.800 -77.210 -5.673 1.00 14.41 H new ATOM 0 HG2 LYS A 102 1.525 -77.238 -3.406 1.00 2.24 H new ATOM 0 HG3 LYS A 102 0.484 -76.022 -4.120 1.00 2.24 H new ATOM 0 HD2 LYS A 102 0.955 -78.858 -5.116 1.00 35.55 H new ATOM 0 HD3 LYS A 102 -0.533 -78.195 -4.469 1.00 35.55 H new ATOM 0 HE2 LYS A 102 0.802 -77.356 -7.077 1.00 34.44 H new ATOM 0 HE3 LYS A 102 -0.613 -78.381 -6.935 1.00 34.44 H new ATOM 0 HZ1 LYS A 102 -1.850 -76.568 -6.959 1.00 11.03 H new ATOM 0 HZ2 LYS A 102 -1.154 -76.055 -5.498 1.00 11.03 H new ATOM 0 HZ3 LYS A 102 -0.476 -75.572 -6.978 1.00 11.03 H new ATOM 1545 N LYS A 103 4.825 -77.430 -3.931 1.00 12.03 N ATOM 1546 CA LYS A 103 5.576 -78.366 -3.095 1.00 72.44 C ATOM 1547 C LYS A 103 6.562 -79.163 -3.953 1.00 14.24 C ATOM 1548 O LYS A 103 6.264 -79.495 -5.099 1.00 53.50 O ATOM 1549 CB LYS A 103 4.613 -79.325 -2.375 1.00 61.22 C ATOM 1550 CG LYS A 103 5.296 -80.266 -1.385 1.00 3.35 C ATOM 1551 CD LYS A 103 5.949 -79.504 -0.236 1.00 22.31 C ATOM 1552 CE LYS A 103 6.687 -80.433 0.723 1.00 15.43 C ATOM 1553 NZ LYS A 103 7.321 -79.686 1.843 1.00 35.52 N ATOM 0 H LYS A 103 4.926 -77.595 -4.932 1.00 12.03 H new ATOM 0 HA LYS A 103 6.133 -77.799 -2.349 1.00 72.44 H new ATOM 0 HB2 LYS A 103 3.863 -78.739 -1.844 1.00 61.22 H new ATOM 0 HB3 LYS A 103 4.085 -79.920 -3.120 1.00 61.22 H new ATOM 0 HG2 LYS A 103 4.563 -80.967 -0.986 1.00 3.35 H new ATOM 0 HG3 LYS A 103 6.051 -80.855 -1.906 1.00 3.35 H new ATOM 0 HD2 LYS A 103 6.647 -78.770 -0.639 1.00 22.31 H new ATOM 0 HD3 LYS A 103 5.186 -78.951 0.311 1.00 22.31 H new ATOM 0 HE2 LYS A 103 5.989 -81.167 1.126 1.00 15.43 H new ATOM 0 HE3 LYS A 103 7.451 -80.986 0.177 1.00 15.43 H new ATOM 0 HZ1 LYS A 103 7.812 -80.353 2.472 1.00 35.52 H new ATOM 0 HZ2 LYS A 103 8.006 -79.003 1.461 1.00 35.52 H new ATOM 0 HZ3 LYS A 103 6.589 -79.179 2.380 1.00 35.52 H new ATOM 1567 N VAL A 104 7.739 -79.460 -3.400 1.00 20.25 N ATOM 1568 CA VAL A 104 8.736 -80.279 -4.094 1.00 63.52 C ATOM 1569 C VAL A 104 8.689 -81.716 -3.565 1.00 23.40 C ATOM 1570 O VAL A 104 8.479 -81.938 -2.371 1.00 41.12 O ATOM 1571 CB VAL A 104 10.171 -79.694 -3.945 1.00 12.25 C ATOM 1572 CG1 VAL A 104 10.586 -79.581 -2.479 1.00 24.45 C ATOM 1573 CG2 VAL A 104 11.189 -80.524 -4.728 1.00 13.11 C ATOM 0 H VAL A 104 8.026 -79.146 -2.473 1.00 20.25 H new ATOM 0 HA VAL A 104 8.491 -80.275 -5.156 1.00 63.52 H new ATOM 0 HB VAL A 104 10.152 -78.688 -4.364 1.00 12.25 H new ATOM 0 HG11 VAL A 104 11.593 -79.169 -2.417 1.00 24.45 H new ATOM 0 HG12 VAL A 104 9.892 -78.925 -1.954 1.00 24.45 H new ATOM 0 HG13 VAL A 104 10.569 -80.569 -2.019 1.00 24.45 H new ATOM 0 HG21 VAL A 104 12.182 -80.092 -4.605 1.00 13.11 H new ATOM 0 HG22 VAL A 104 11.190 -81.547 -4.353 1.00 13.11 H new ATOM 0 HG23 VAL A 104 10.922 -80.525 -5.785 1.00 13.11 H new ATOM 1583 N SER A 105 8.855 -82.686 -4.462 1.00 70.15 N ATOM 1584 CA SER A 105 8.782 -84.098 -4.107 1.00 14.10 C ATOM 1585 C SER A 105 9.896 -84.872 -4.814 1.00 74.04 C ATOM 1586 O SER A 105 10.173 -84.631 -5.992 1.00 24.02 O ATOM 1587 CB SER A 105 7.410 -84.663 -4.497 1.00 4.52 C ATOM 1588 OG SER A 105 6.359 -83.859 -3.976 1.00 72.03 O ATOM 0 H SER A 105 9.043 -82.515 -5.450 1.00 70.15 H new ATOM 0 HA SER A 105 8.912 -84.204 -3.030 1.00 14.10 H new ATOM 0 HB2 SER A 105 7.329 -84.714 -5.583 1.00 4.52 H new ATOM 0 HB3 SER A 105 7.313 -85.682 -4.122 1.00 4.52 H new ATOM 0 HG SER A 105 5.495 -84.239 -4.240 1.00 72.03 H new ATOM 1594 N ILE A 106 10.539 -85.785 -4.093 1.00 60.24 N ATOM 1595 CA ILE A 106 11.626 -86.591 -4.643 1.00 10.30 C ATOM 1596 C ILE A 106 11.286 -88.076 -4.482 1.00 61.14 C ATOM 1597 O ILE A 106 10.494 -88.432 -3.606 1.00 52.41 O ATOM 1598 CB ILE A 106 12.975 -86.287 -3.928 1.00 72.12 C ATOM 1599 CG1 ILE A 106 13.155 -84.774 -3.685 1.00 61.14 C ATOM 1600 CG2 ILE A 106 14.140 -86.822 -4.754 1.00 61.45 C ATOM 1601 CD1 ILE A 106 13.252 -83.944 -4.952 1.00 61.02 C ATOM 0 H ILE A 106 10.324 -85.987 -3.117 1.00 60.24 H new ATOM 0 HA ILE A 106 11.738 -86.342 -5.698 1.00 10.30 H new ATOM 0 HB ILE A 106 12.959 -86.786 -2.959 1.00 72.12 H new ATOM 0 HG12 ILE A 106 12.316 -84.411 -3.091 1.00 61.14 H new ATOM 0 HG13 ILE A 106 14.057 -84.618 -3.093 1.00 61.14 H new ATOM 0 HG21 ILE A 106 15.078 -86.604 -4.244 1.00 61.45 H new ATOM 0 HG22 ILE A 106 14.035 -87.900 -4.875 1.00 61.45 H new ATOM 0 HG23 ILE A 106 14.140 -86.345 -5.734 1.00 61.45 H new ATOM 0 HD11 ILE A 106 13.377 -82.893 -4.690 1.00 61.02 H new ATOM 0 HD12 ILE A 106 14.108 -84.276 -5.540 1.00 61.02 H new ATOM 0 HD13 ILE A 106 12.341 -84.066 -5.537 1.00 61.02 H new ATOM 1613 N HIS A 107 11.872 -88.944 -5.309 1.00 62.33 N ATOM 1614 CA HIS A 107 11.559 -90.372 -5.257 1.00 42.21 C ATOM 1615 C HIS A 107 12.833 -91.216 -5.336 1.00 3.14 C ATOM 1616 O HIS A 107 13.774 -90.875 -6.045 1.00 44.31 O ATOM 1617 CB HIS A 107 10.593 -90.758 -6.390 1.00 1.15 C ATOM 1618 CG HIS A 107 9.774 -91.983 -6.098 1.00 52.33 C ATOM 1619 ND1 HIS A 107 8.504 -91.924 -5.570 1.00 63.51 N ATOM 1620 CD2 HIS A 107 10.052 -93.300 -6.251 1.00 51.43 C ATOM 1621 CE1 HIS A 107 8.037 -93.148 -5.411 1.00 61.40 C ATOM 1622 NE2 HIS A 107 8.955 -94.001 -5.815 1.00 21.31 N ATOM 0 H HIS A 107 12.560 -88.686 -6.017 1.00 62.33 H new ATOM 0 HA HIS A 107 11.074 -90.573 -4.302 1.00 42.21 H new ATOM 0 HB2 HIS A 107 9.922 -89.921 -6.583 1.00 1.15 H new ATOM 0 HB3 HIS A 107 11.166 -90.924 -7.302 1.00 1.15 H new ATOM 0 HD2 HIS A 107 10.966 -93.720 -6.643 1.00 51.43 H new ATOM 0 HE1 HIS A 107 7.066 -93.406 -5.016 1.00 61.40 H new ATOM 0 HE2 HIS A 107 8.866 -95.017 -5.806 1.00 21.31 H new ATOM 1631 N ALA A 108 12.814 -92.334 -4.629 1.00 62.21 N ATOM 1632 CA ALA A 108 13.968 -93.222 -4.450 1.00 71.54 C ATOM 1633 C ALA A 108 14.361 -94.015 -5.711 1.00 51.20 C ATOM 1634 O ALA A 108 15.236 -94.881 -5.637 1.00 13.21 O ATOM 1635 CB ALA A 108 13.717 -94.165 -3.283 1.00 1.01 C ATOM 0 H ALA A 108 11.977 -92.664 -4.148 1.00 62.21 H new ATOM 0 HA ALA A 108 14.819 -92.575 -4.238 1.00 71.54 H new ATOM 0 HB1 ALA A 108 14.577 -94.822 -3.155 1.00 1.01 H new ATOM 0 HB2 ALA A 108 13.564 -93.585 -2.373 1.00 1.01 H new ATOM 0 HB3 ALA A 108 12.829 -94.765 -3.484 1.00 1.01 H new ATOM 1641 N SER A 109 13.724 -93.740 -6.848 1.00 22.12 N ATOM 1642 CA SER A 109 13.808 -94.617 -8.021 1.00 13.31 C ATOM 1643 C SER A 109 15.248 -94.794 -8.516 1.00 70.35 C ATOM 1644 O SER A 109 16.076 -93.884 -8.424 1.00 20.01 O ATOM 1645 CB SER A 109 12.962 -94.029 -9.151 1.00 75.32 C ATOM 1646 OG SER A 109 11.600 -93.922 -8.772 1.00 74.32 O ATOM 0 H SER A 109 13.141 -92.914 -6.985 1.00 22.12 H new ATOM 0 HA SER A 109 13.436 -95.598 -7.724 1.00 13.31 H new ATOM 0 HB2 SER A 109 13.345 -93.045 -9.421 1.00 75.32 H new ATOM 0 HB3 SER A 109 13.047 -94.658 -10.037 1.00 75.32 H new ATOM 0 HG SER A 109 11.227 -93.087 -9.124 1.00 74.32 H new ATOM 1652 N SER A 110 15.517 -95.992 -9.030 1.00 53.15 N ATOM 1653 CA SER A 110 16.861 -96.423 -9.397 1.00 44.34 C ATOM 1654 C SER A 110 17.278 -95.917 -10.783 1.00 21.33 C ATOM 1655 O SER A 110 16.505 -95.253 -11.479 1.00 40.12 O ATOM 1656 CB SER A 110 16.935 -97.954 -9.333 1.00 20.12 C ATOM 1657 OG SER A 110 15.880 -98.553 -10.074 1.00 61.20 O ATOM 0 H SER A 110 14.800 -96.696 -9.205 1.00 53.15 H new ATOM 0 HA SER A 110 17.563 -95.989 -8.685 1.00 44.34 H new ATOM 0 HB2 SER A 110 17.895 -98.291 -9.725 1.00 20.12 H new ATOM 0 HB3 SER A 110 16.883 -98.280 -8.294 1.00 20.12 H new ATOM 0 HG SER A 110 15.953 -99.529 -10.017 1.00 61.20 H new ATOM 1663 N ARG A 111 18.515 -96.251 -11.165 1.00 10.21 N ATOM 1664 CA ARG A 111 19.127 -95.784 -12.413 1.00 70.34 C ATOM 1665 C ARG A 111 18.259 -96.090 -13.639 1.00 33.55 C ATOM 1666 O ARG A 111 17.663 -97.164 -13.746 1.00 43.23 O ATOM 1667 CB ARG A 111 20.517 -96.419 -12.589 1.00 25.13 C ATOM 1668 CG ARG A 111 21.153 -96.126 -13.945 1.00 15.51 C ATOM 1669 CD ARG A 111 22.525 -96.776 -14.101 1.00 32.52 C ATOM 1670 NE ARG A 111 23.021 -96.649 -15.473 1.00 21.10 N ATOM 1671 CZ ARG A 111 24.309 -96.561 -15.810 1.00 63.31 C ATOM 1672 NH1 ARG A 111 25.259 -96.619 -14.884 1.00 42.52 N ATOM 1673 NH2 ARG A 111 24.644 -96.432 -17.086 1.00 12.12 N ATOM 0 H ARG A 111 19.123 -96.856 -10.614 1.00 10.21 H new ATOM 0 HA ARG A 111 19.220 -94.700 -12.340 1.00 70.34 H new ATOM 0 HB2 ARG A 111 21.176 -96.055 -11.801 1.00 25.13 H new ATOM 0 HB3 ARG A 111 20.433 -97.498 -12.461 1.00 25.13 H new ATOM 0 HG2 ARG A 111 20.494 -96.483 -14.736 1.00 15.51 H new ATOM 0 HG3 ARG A 111 21.249 -95.048 -14.072 1.00 15.51 H new ATOM 0 HD2 ARG A 111 23.231 -96.311 -13.412 1.00 32.52 H new ATOM 0 HD3 ARG A 111 22.463 -97.830 -13.830 1.00 32.52 H new ATOM 0 HE ARG A 111 22.332 -96.626 -16.225 1.00 21.10 H new ATOM 0 HH11 ARG A 111 25.008 -96.732 -13.902 1.00 42.52 H new ATOM 0 HH12 ARG A 111 26.240 -96.551 -15.155 1.00 42.52 H new ATOM 0 HH21 ARG A 111 23.919 -96.401 -17.803 1.00 12.12 H new ATOM 0 HH22 ARG A 111 25.627 -96.364 -17.351 1.00 12.12 H new ATOM 1687 N VAL A 112 18.216 -95.130 -14.560 1.00 42.33 N ATOM 1688 CA VAL A 112 17.479 -95.250 -15.816 1.00 22.53 C ATOM 1689 C VAL A 112 18.327 -94.687 -16.958 1.00 21.24 C ATOM 1690 O VAL A 112 19.440 -94.205 -16.723 1.00 51.15 O ATOM 1691 CB VAL A 112 16.126 -94.490 -15.757 1.00 42.34 C ATOM 1692 CG1 VAL A 112 15.181 -95.124 -14.735 1.00 12.25 C ATOM 1693 CG2 VAL A 112 16.360 -93.013 -15.440 1.00 12.43 C ATOM 0 H VAL A 112 18.697 -94.237 -14.454 1.00 42.33 H new ATOM 0 HA VAL A 112 17.268 -96.306 -15.986 1.00 22.53 H new ATOM 0 HB VAL A 112 15.651 -94.563 -16.735 1.00 42.34 H new ATOM 0 HG11 VAL A 112 14.242 -94.571 -14.716 1.00 12.25 H new ATOM 0 HG12 VAL A 112 14.986 -96.160 -15.013 1.00 12.25 H new ATOM 0 HG13 VAL A 112 15.640 -95.094 -13.747 1.00 12.25 H new ATOM 0 HG21 VAL A 112 15.403 -92.493 -15.402 1.00 12.43 H new ATOM 0 HG22 VAL A 112 16.861 -92.923 -14.476 1.00 12.43 H new ATOM 0 HG23 VAL A 112 16.984 -92.569 -16.216 1.00 12.43 H new ATOM 1703 N ASP A 113 17.839 -94.787 -18.190 1.00 71.41 N ATOM 1704 CA ASP A 113 18.525 -94.177 -19.330 1.00 61.45 C ATOM 1705 C ASP A 113 18.120 -92.708 -19.459 1.00 54.52 C ATOM 1706 O ASP A 113 16.930 -92.377 -19.443 1.00 71.24 O ATOM 1707 CB ASP A 113 18.233 -94.946 -20.631 1.00 13.55 C ATOM 1708 CG ASP A 113 16.758 -94.957 -21.015 1.00 74.32 C ATOM 1709 OD1 ASP A 113 15.954 -95.581 -20.289 1.00 52.52 O ATOM 1710 OD2 ASP A 113 16.396 -94.360 -22.054 1.00 41.05 O ATOM 0 H ASP A 113 16.978 -95.280 -18.427 1.00 71.41 H new ATOM 0 HA ASP A 113 19.600 -94.228 -19.155 1.00 61.45 H new ATOM 0 HB2 ASP A 113 18.808 -94.501 -21.443 1.00 13.55 H new ATOM 0 HB3 ASP A 113 18.579 -95.974 -20.521 1.00 13.55 H new ATOM 1715 N ALA A 114 19.120 -91.836 -19.576 1.00 61.52 N ATOM 1716 CA ALA A 114 18.901 -90.389 -19.619 1.00 14.04 C ATOM 1717 C ALA A 114 18.291 -89.967 -20.953 1.00 42.21 C ATOM 1718 O ALA A 114 18.305 -90.733 -21.920 1.00 32.43 O ATOM 1719 CB ALA A 114 20.210 -89.642 -19.373 1.00 51.25 C ATOM 0 H ALA A 114 20.100 -92.109 -19.643 1.00 61.52 H new ATOM 0 HA ALA A 114 18.198 -90.131 -18.827 1.00 14.04 H new ATOM 0 HB1 ALA A 114 20.028 -88.568 -19.409 1.00 51.25 H new ATOM 0 HB2 ALA A 114 20.604 -89.911 -18.393 1.00 51.25 H new ATOM 0 HB3 ALA A 114 20.934 -89.913 -20.142 1.00 51.25 H new ATOM 1725 N ASP A 115 17.774 -88.742 -21.002 1.00 54.31 N ATOM 1726 CA ASP A 115 17.060 -88.239 -22.178 1.00 31.20 C ATOM 1727 C ASP A 115 17.274 -86.733 -22.344 1.00 74.33 C ATOM 1728 O ASP A 115 17.541 -86.252 -23.451 1.00 33.11 O ATOM 1729 CB ASP A 115 15.563 -88.552 -22.050 1.00 63.02 C ATOM 1730 CG ASP A 115 14.731 -87.982 -23.190 1.00 34.15 C ATOM 1731 OD1 ASP A 115 14.816 -88.506 -24.320 1.00 71.54 O ATOM 1732 OD2 ASP A 115 13.962 -87.031 -22.954 1.00 60.54 O ATOM 0 H ASP A 115 17.836 -88.072 -20.235 1.00 54.31 H new ATOM 0 HA ASP A 115 17.456 -88.736 -23.063 1.00 31.20 H new ATOM 0 HB2 ASP A 115 15.426 -89.633 -22.014 1.00 63.02 H new ATOM 0 HB3 ASP A 115 15.195 -88.153 -21.105 1.00 63.02 H new ATOM 1737 N GLY A 116 17.149 -85.991 -21.245 1.00 25.12 N ATOM 1738 CA GLY A 116 17.384 -84.556 -21.281 1.00 51.02 C ATOM 1739 C GLY A 116 16.487 -83.782 -20.331 1.00 52.42 C ATOM 1740 O GLY A 116 15.295 -84.079 -20.190 1.00 24.24 O ATOM 0 H GLY A 116 16.889 -86.358 -20.330 1.00 25.12 H new ATOM 0 HA2 GLY A 116 18.426 -84.358 -21.030 1.00 51.02 H new ATOM 0 HA3 GLY A 116 17.226 -84.193 -22.297 1.00 51.02 H new ATOM 1744 N PHE A 117 17.061 -82.803 -19.648 1.00 5.24 N ATOM 1745 CA PHE A 117 16.287 -81.909 -18.799 1.00 2.31 C ATOM 1746 C PHE A 117 15.767 -80.746 -19.637 1.00 32.41 C ATOM 1747 O PHE A 117 16.560 -79.940 -20.122 1.00 0.02 O ATOM 1748 CB PHE A 117 17.160 -81.353 -17.657 1.00 64.33 C ATOM 1749 CG PHE A 117 17.781 -82.400 -16.761 1.00 64.31 C ATOM 1750 CD1 PHE A 117 18.852 -83.163 -17.197 1.00 52.42 C ATOM 1751 CD2 PHE A 117 17.299 -82.612 -15.478 1.00 54.12 C ATOM 1752 CE1 PHE A 117 19.425 -84.113 -16.374 1.00 24.34 C ATOM 1753 CE2 PHE A 117 17.869 -83.560 -14.651 1.00 3.23 C ATOM 1754 CZ PHE A 117 18.934 -84.312 -15.100 1.00 43.44 C ATOM 0 H PHE A 117 18.062 -82.607 -19.665 1.00 5.24 H new ATOM 0 HA PHE A 117 15.456 -82.468 -18.369 1.00 2.31 H new ATOM 0 HB2 PHE A 117 17.957 -80.748 -18.090 1.00 64.33 H new ATOM 0 HB3 PHE A 117 16.551 -80.687 -17.045 1.00 64.33 H new ATOM 0 HD1 PHE A 117 19.244 -83.013 -18.192 1.00 52.42 H new ATOM 0 HD2 PHE A 117 16.465 -82.027 -15.120 1.00 54.12 H new ATOM 0 HE1 PHE A 117 20.259 -84.701 -16.728 1.00 24.34 H new ATOM 0 HE2 PHE A 117 17.481 -83.712 -13.655 1.00 3.23 H new ATOM 0 HZ PHE A 117 19.382 -85.054 -14.456 1.00 43.44 H new ATOM 1764 N GLU A 118 14.454 -80.675 -19.847 1.00 33.04 N ATOM 1765 CA GLU A 118 13.849 -79.500 -20.461 1.00 23.02 C ATOM 1766 C GLU A 118 12.350 -79.489 -20.209 1.00 63.02 C ATOM 1767 O GLU A 118 11.669 -80.492 -20.405 1.00 13.12 O ATOM 1768 CB GLU A 118 14.144 -79.418 -21.966 1.00 70.42 C ATOM 1769 CG GLU A 118 13.507 -80.521 -22.803 1.00 51.04 C ATOM 1770 CD GLU A 118 13.574 -80.221 -24.289 1.00 53.34 C ATOM 1771 OE1 GLU A 118 12.914 -79.256 -24.736 1.00 62.15 O ATOM 1772 OE2 GLU A 118 14.277 -80.941 -25.025 1.00 71.34 O ATOM 0 H GLU A 118 13.794 -81.413 -19.602 1.00 33.04 H new ATOM 0 HA GLU A 118 14.296 -78.620 -19.998 1.00 23.02 H new ATOM 0 HB2 GLU A 118 13.798 -78.453 -22.338 1.00 70.42 H new ATOM 0 HB3 GLU A 118 15.224 -79.448 -22.113 1.00 70.42 H new ATOM 0 HG2 GLU A 118 14.012 -81.466 -22.601 1.00 51.04 H new ATOM 0 HG3 GLU A 118 12.466 -80.646 -22.505 1.00 51.04 H new ATOM 1779 N ILE A 119 11.837 -78.352 -19.777 1.00 14.51 N ATOM 1780 CA ILE A 119 10.422 -78.223 -19.482 1.00 51.30 C ATOM 1781 C ILE A 119 9.596 -78.389 -20.763 1.00 62.21 C ATOM 1782 O ILE A 119 9.332 -77.429 -21.491 1.00 44.42 O ATOM 1783 CB ILE A 119 10.108 -76.878 -18.763 1.00 2.53 C ATOM 1784 CG1 ILE A 119 10.586 -76.929 -17.297 1.00 24.02 C ATOM 1785 CG2 ILE A 119 8.617 -76.561 -18.811 1.00 53.12 C ATOM 1786 CD1 ILE A 119 12.063 -77.227 -17.116 1.00 71.13 C ATOM 0 H ILE A 119 12.380 -77.503 -19.622 1.00 14.51 H new ATOM 0 HA ILE A 119 10.142 -79.019 -18.793 1.00 51.30 H new ATOM 0 HB ILE A 119 10.643 -76.087 -19.288 1.00 2.53 H new ATOM 0 HG12 ILE A 119 10.363 -75.973 -16.824 1.00 24.02 H new ATOM 0 HG13 ILE A 119 10.010 -77.688 -16.769 1.00 24.02 H new ATOM 0 HG21 ILE A 119 8.429 -75.616 -18.301 1.00 53.12 H new ATOM 0 HG22 ILE A 119 8.295 -76.483 -19.849 1.00 53.12 H new ATOM 0 HG23 ILE A 119 8.060 -77.357 -18.317 1.00 53.12 H new ATOM 0 HD11 ILE A 119 12.304 -77.242 -16.053 1.00 71.13 H new ATOM 0 HD12 ILE A 119 12.295 -78.198 -17.554 1.00 71.13 H new ATOM 0 HD13 ILE A 119 12.653 -76.455 -17.611 1.00 71.13 H new ATOM 1798 N ARG A 120 9.273 -79.643 -21.052 1.00 2.03 N ATOM 1799 CA ARG A 120 8.422 -80.016 -22.175 1.00 61.44 C ATOM 1800 C ARG A 120 6.961 -79.915 -21.787 1.00 32.31 C ATOM 1801 O ARG A 120 6.597 -80.175 -20.638 1.00 1.25 O ATOM 1802 CB ARG A 120 8.735 -81.444 -22.636 1.00 4.12 C ATOM 1803 CG ARG A 120 9.963 -81.551 -23.520 1.00 2.23 C ATOM 1804 CD ARG A 120 10.266 -83.004 -23.863 1.00 30.01 C ATOM 1805 NE ARG A 120 11.566 -83.171 -24.520 1.00 3.51 N ATOM 1806 CZ ARG A 120 12.358 -84.231 -24.342 1.00 12.41 C ATOM 1807 NH1 ARG A 120 12.000 -85.194 -23.500 1.00 3.32 N ATOM 1808 NH2 ARG A 120 13.507 -84.324 -24.999 1.00 2.32 N ATOM 0 H ARG A 120 9.599 -80.440 -20.506 1.00 2.03 H new ATOM 0 HA ARG A 120 8.621 -79.327 -22.996 1.00 61.44 H new ATOM 0 HB2 ARG A 120 8.875 -82.076 -21.759 1.00 4.12 H new ATOM 0 HB3 ARG A 120 7.875 -81.837 -23.178 1.00 4.12 H new ATOM 0 HG2 ARG A 120 9.806 -80.983 -24.437 1.00 2.23 H new ATOM 0 HG3 ARG A 120 10.820 -81.107 -23.013 1.00 2.23 H new ATOM 0 HD2 ARG A 120 10.245 -83.600 -22.951 1.00 30.01 H new ATOM 0 HD3 ARG A 120 9.482 -83.390 -24.514 1.00 30.01 H new ATOM 0 HE ARG A 120 11.884 -82.434 -25.150 1.00 3.51 H new ATOM 0 HH11 ARG A 120 11.120 -85.124 -22.989 1.00 3.32 H new ATOM 0 HH12 ARG A 120 12.605 -86.004 -23.364 1.00 3.32 H new ATOM 0 HH21 ARG A 120 13.788 -83.584 -25.643 1.00 2.32 H new ATOM 0 HH22 ARG A 120 14.109 -85.135 -24.860 1.00 2.32 H new ATOM 1822 N ARG A 121 6.138 -79.514 -22.739 1.00 14.01 N ATOM 1823 CA ARG A 121 4.698 -79.404 -22.518 1.00 75.33 C ATOM 1824 C ARG A 121 3.940 -80.290 -23.511 1.00 64.21 C ATOM 1825 O ARG A 121 3.543 -79.793 -24.580 1.00 51.44 O ATOM 1826 CB ARG A 121 4.242 -77.939 -22.626 1.00 72.42 C ATOM 1827 CG ARG A 121 4.794 -77.036 -21.522 1.00 14.51 C ATOM 1828 CD ARG A 121 4.113 -75.672 -21.513 1.00 12.45 C ATOM 1829 NE ARG A 121 2.658 -75.799 -21.377 1.00 4.53 N ATOM 1830 CZ ARG A 121 1.875 -74.929 -20.740 1.00 42.14 C ATOM 1831 NH1 ARG A 121 2.389 -73.847 -20.166 1.00 1.44 N ATOM 1832 NH2 ARG A 121 0.566 -75.139 -20.687 1.00 65.01 N ATOM 1833 OXT ARG A 121 3.777 -81.495 -23.225 1.00 0.00 O ATOM 0 H ARG A 121 6.439 -79.257 -23.679 1.00 14.01 H new ATOM 0 HA ARG A 121 4.473 -79.750 -21.509 1.00 75.33 H new ATOM 0 HB2 ARG A 121 4.550 -77.543 -23.594 1.00 72.42 H new ATOM 0 HB3 ARG A 121 3.153 -77.905 -22.600 1.00 72.42 H new ATOM 0 HG2 ARG A 121 4.655 -77.518 -20.554 1.00 14.51 H new ATOM 0 HG3 ARG A 121 5.867 -76.906 -21.662 1.00 14.51 H new ATOM 0 HD2 ARG A 121 4.506 -75.074 -20.691 1.00 12.45 H new ATOM 0 HD3 ARG A 121 4.348 -75.140 -22.435 1.00 12.45 H new ATOM 0 HE ARG A 121 2.213 -76.613 -21.801 1.00 4.53 H new ATOM 0 HH11 ARG A 121 3.393 -73.675 -20.210 1.00 1.44 H new ATOM 0 HH12 ARG A 121 1.779 -73.188 -19.681 1.00 1.44 H new ATOM 0 HH21 ARG A 121 0.163 -75.963 -21.133 1.00 65.01 H new ATOM 0 HH22 ARG A 121 -0.038 -74.476 -20.201 1.00 65.01 H new