USER MOD reduce.3.24.130724 H: found=0, std=0, add=663, rem=0, adj=23 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 HD1:sc= -0.802 K(o=-1.6,f=0.44) USER MOD Set 1.2: A 109 SER OG : rot 180:sc= -0.761 USER MOD Set 2.1: A 35 THR OG1 : rot 130:sc= -0.662 USER MOD Set 2.2: A 79 GLN : amide:sc= -3.73 K(o=-4.4,f=-0.68) USER MOD Set 3.1: A 69 ASN : amide:sc= -2.81! C(o=-1.8!,f=-2.5!) USER MOD Set 3.2: A 75 SER OG : rot 166:sc= 0.985 USER MOD Set 4.1: A 53 THR OG1 : rot -30:sc= -1.29! USER MOD Set 4.2: A 91 TYR OH : rot 30:sc= 0.26 USER MOD Single : A 34 THR OG1 : rot -110:sc= -1.55! USER MOD Single : A 37 CYS SG : rot 24:sc= 0.911 USER MOD Single : A 38 TYR OH : rot 134:sc= -0.0618 USER MOD Single : A 41 THR OG1 : rot 98:sc= -0.0781 USER MOD Single : A 51 LYS NZ :NH3+ -169:sc= -0.0252 (180deg=-0.153) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0391) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 180:sc= -2.84! USER MOD Single : A 68 ASN : amide:sc= -1.19 K(o=-1.2,f=-3.9!) USER MOD Single : A 73 SER OG : rot 28:sc= 0.359 USER MOD Single : A 82 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0277) USER MOD Single : A 84 GLN : amide:sc= -0.844 K(o=-0.84,f=-3.3!) USER MOD Single : A 90 LYS NZ :NH3+ -158:sc= 0.987 (180deg=0.336) USER MOD Single : A 93 HIS : no HD1:sc= -0.0372 X(o=-0.037,f=-0.0073) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot -60:sc= -0.0722 USER MOD Single : A 98 LYS NZ :NH3+ -169:sc= -0.0267 (180deg=-0.235) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 USER MOD ----------------------------------------------------------------- ATOM 450 N VAL A 33 26.984 -93.561 -8.211 1.00 64.33 N ATOM 451 CA VAL A 33 25.986 -92.948 -9.080 1.00 3.41 C ATOM 452 C VAL A 33 24.627 -92.956 -8.404 1.00 52.31 C ATOM 453 O VAL A 33 23.903 -93.957 -8.425 1.00 55.05 O ATOM 454 CB VAL A 33 25.862 -93.658 -10.442 1.00 32.24 C ATOM 455 CG1 VAL A 33 24.896 -92.903 -11.355 1.00 21.34 C ATOM 456 CG2 VAL A 33 27.229 -93.824 -11.103 1.00 54.35 C ATOM 0 HA VAL A 33 26.322 -91.927 -9.261 1.00 3.41 H new ATOM 0 HB VAL A 33 25.457 -94.655 -10.270 1.00 32.24 H new ATOM 0 HG11 VAL A 33 24.821 -93.419 -12.312 1.00 21.34 H new ATOM 0 HG12 VAL A 33 23.912 -92.860 -10.888 1.00 21.34 H new ATOM 0 HG13 VAL A 33 25.265 -91.890 -11.517 1.00 21.34 H new ATOM 0 HG21 VAL A 33 27.111 -94.328 -12.062 1.00 54.35 H new ATOM 0 HG22 VAL A 33 27.678 -92.844 -11.261 1.00 54.35 H new ATOM 0 HG23 VAL A 33 27.875 -94.419 -10.458 1.00 54.35 H new ATOM 466 N THR A 34 24.306 -91.837 -7.806 1.00 32.15 N ATOM 467 CA THR A 34 23.043 -91.645 -7.124 1.00 71.11 C ATOM 468 C THR A 34 21.977 -91.228 -8.130 1.00 2.24 C ATOM 469 O THR A 34 22.177 -90.290 -8.905 1.00 60.35 O ATOM 470 CB THR A 34 23.173 -90.564 -6.028 1.00 3.00 C ATOM 471 OG1 THR A 34 24.260 -90.895 -5.153 1.00 50.55 O ATOM 472 CG2 THR A 34 21.885 -90.434 -5.218 1.00 1.10 C ATOM 0 H THR A 34 24.918 -91.022 -7.776 1.00 32.15 H new ATOM 0 HA THR A 34 22.756 -92.585 -6.653 1.00 71.11 H new ATOM 0 HB THR A 34 23.365 -89.608 -6.515 1.00 3.00 H new ATOM 0 HG1 THR A 34 23.907 -91.156 -4.277 1.00 50.55 H new ATOM 0 HG21 THR A 34 22.011 -89.665 -4.456 1.00 1.10 H new ATOM 0 HG22 THR A 34 21.065 -90.157 -5.881 1.00 1.10 H new ATOM 0 HG23 THR A 34 21.659 -91.387 -4.739 1.00 1.10 H new ATOM 480 N THR A 35 20.864 -91.944 -8.143 1.00 71.32 N ATOM 481 CA THR A 35 19.758 -91.621 -9.029 1.00 44.34 C ATOM 482 C THR A 35 18.496 -91.362 -8.219 1.00 64.43 C ATOM 483 O THR A 35 18.136 -92.153 -7.348 1.00 74.11 O ATOM 484 CB THR A 35 19.496 -92.756 -10.043 1.00 51.43 C ATOM 485 OG1 THR A 35 20.703 -93.043 -10.773 1.00 13.30 O ATOM 486 CG2 THR A 35 18.380 -92.379 -11.021 1.00 62.32 C ATOM 0 H THR A 35 20.703 -92.756 -7.547 1.00 71.32 H new ATOM 0 HA THR A 35 20.030 -90.723 -9.583 1.00 44.34 H new ATOM 0 HB THR A 35 19.180 -93.640 -9.490 1.00 51.43 H new ATOM 0 HG1 THR A 35 20.875 -94.008 -10.755 1.00 13.30 H new ATOM 0 HG21 THR A 35 18.219 -93.198 -11.722 1.00 62.32 H new ATOM 0 HG22 THR A 35 17.460 -92.189 -10.468 1.00 62.32 H new ATOM 0 HG23 THR A 35 18.665 -91.482 -11.570 1.00 62.32 H new ATOM 494 N LEU A 36 17.847 -90.239 -8.496 1.00 13.40 N ATOM 495 CA LEU A 36 16.613 -89.868 -7.823 1.00 32.23 C ATOM 496 C LEU A 36 15.639 -89.273 -8.830 1.00 30.20 C ATOM 497 O LEU A 36 16.035 -88.516 -9.721 1.00 35.32 O ATOM 498 CB LEU A 36 16.892 -88.860 -6.695 1.00 70.33 C ATOM 499 CG LEU A 36 17.703 -89.402 -5.501 1.00 3.23 C ATOM 500 CD1 LEU A 36 18.035 -88.284 -4.518 1.00 10.31 C ATOM 501 CD2 LEU A 36 16.942 -90.532 -4.800 1.00 4.14 C ATOM 0 H LEU A 36 18.161 -89.562 -9.192 1.00 13.40 H new ATOM 0 HA LEU A 36 16.172 -90.762 -7.381 1.00 32.23 H new ATOM 0 HB2 LEU A 36 17.426 -88.009 -7.117 1.00 70.33 H new ATOM 0 HB3 LEU A 36 15.938 -88.485 -6.323 1.00 70.33 H new ATOM 0 HG LEU A 36 18.641 -89.806 -5.883 1.00 3.23 H new ATOM 0 HD11 LEU A 36 18.607 -88.691 -3.684 1.00 10.31 H new ATOM 0 HD12 LEU A 36 18.624 -87.518 -5.023 1.00 10.31 H new ATOM 0 HD13 LEU A 36 17.111 -87.843 -4.143 1.00 10.31 H new ATOM 0 HD21 LEU A 36 17.531 -90.901 -3.960 1.00 4.14 H new ATOM 0 HD22 LEU A 36 15.986 -90.155 -4.435 1.00 4.14 H new ATOM 0 HD23 LEU A 36 16.767 -91.345 -5.505 1.00 4.14 H new ATOM 513 N CYS A 37 14.373 -89.638 -8.700 1.00 71.23 N ATOM 514 CA CYS A 37 13.322 -89.088 -9.545 1.00 40.31 C ATOM 515 C CYS A 37 12.738 -87.849 -8.871 1.00 32.44 C ATOM 516 O CYS A 37 12.488 -87.856 -7.666 1.00 34.41 O ATOM 517 CB CYS A 37 12.237 -90.142 -9.790 1.00 1.21 C ATOM 518 SG CYS A 37 10.890 -89.606 -10.872 1.00 21.43 S ATOM 0 H CYS A 37 14.046 -90.317 -8.013 1.00 71.23 H new ATOM 0 HA CYS A 37 13.736 -88.803 -10.512 1.00 40.31 H new ATOM 0 HB2 CYS A 37 12.702 -91.028 -10.223 1.00 1.21 H new ATOM 0 HB3 CYS A 37 11.816 -90.440 -8.830 1.00 1.21 H new ATOM 0 HG CYS A 37 11.309 -88.648 -11.644 1.00 21.43 H new ATOM 524 N TYR A 38 12.539 -86.790 -9.645 1.00 44.52 N ATOM 525 CA TYR A 38 12.094 -85.505 -9.113 1.00 13.14 C ATOM 526 C TYR A 38 10.679 -85.182 -9.578 1.00 33.50 C ATOM 527 O TYR A 38 10.282 -85.547 -10.684 1.00 34.40 O ATOM 528 CB TYR A 38 13.042 -84.383 -9.571 1.00 2.52 C ATOM 529 CG TYR A 38 14.421 -84.419 -8.938 1.00 51.01 C ATOM 530 CD1 TYR A 38 15.266 -85.511 -9.104 1.00 5.21 C ATOM 531 CD2 TYR A 38 14.880 -83.352 -8.177 1.00 74.21 C ATOM 532 CE1 TYR A 38 16.522 -85.537 -8.529 1.00 42.41 C ATOM 533 CE2 TYR A 38 16.134 -83.369 -7.601 1.00 41.03 C ATOM 534 CZ TYR A 38 16.950 -84.463 -7.780 1.00 0.42 C ATOM 535 OH TYR A 38 18.199 -84.479 -7.213 1.00 72.24 O ATOM 0 H TYR A 38 12.680 -86.795 -10.655 1.00 44.52 H new ATOM 0 HA TYR A 38 12.102 -85.574 -8.025 1.00 13.14 H new ATOM 0 HB2 TYR A 38 13.153 -84.439 -10.654 1.00 2.52 H new ATOM 0 HB3 TYR A 38 12.580 -83.422 -9.347 1.00 2.52 H new ATOM 0 HD1 TYR A 38 14.935 -86.354 -9.693 1.00 5.21 H new ATOM 0 HD2 TYR A 38 14.243 -82.492 -8.033 1.00 74.21 H new ATOM 0 HE1 TYR A 38 17.164 -86.394 -8.666 1.00 42.41 H new ATOM 0 HE2 TYR A 38 16.473 -82.529 -7.013 1.00 41.03 H new ATOM 0 HH TYR A 38 18.641 -83.619 -7.371 1.00 72.24 H new ATOM 545 N ARG A 39 9.928 -84.507 -8.716 1.00 41.31 N ATOM 546 CA ARG A 39 8.623 -83.956 -9.066 1.00 13.40 C ATOM 547 C ARG A 39 8.286 -82.794 -8.135 1.00 14.02 C ATOM 548 O ARG A 39 8.173 -82.972 -6.923 1.00 25.40 O ATOM 549 CB ARG A 39 7.519 -85.032 -9.009 1.00 74.33 C ATOM 550 CG ARG A 39 6.100 -84.459 -9.053 1.00 12.21 C ATOM 551 CD ARG A 39 5.043 -85.527 -9.321 1.00 54.31 C ATOM 552 NE ARG A 39 4.994 -85.910 -10.736 1.00 25.32 N ATOM 553 CZ ARG A 39 4.200 -86.863 -11.228 1.00 14.22 C ATOM 554 NH1 ARG A 39 3.420 -87.574 -10.420 1.00 32.13 N ATOM 555 NH2 ARG A 39 4.178 -87.097 -12.532 1.00 64.21 N ATOM 0 H ARG A 39 10.207 -84.325 -7.752 1.00 41.31 H new ATOM 0 HA ARG A 39 8.672 -83.593 -10.092 1.00 13.40 H new ATOM 0 HB2 ARG A 39 7.650 -85.719 -9.845 1.00 74.33 H new ATOM 0 HB3 ARG A 39 7.638 -85.615 -8.095 1.00 74.33 H new ATOM 0 HG2 ARG A 39 5.882 -83.967 -8.105 1.00 12.21 H new ATOM 0 HG3 ARG A 39 6.044 -83.696 -9.829 1.00 12.21 H new ATOM 0 HD2 ARG A 39 5.256 -86.407 -8.714 1.00 54.31 H new ATOM 0 HD3 ARG A 39 4.066 -85.155 -9.012 1.00 54.31 H new ATOM 0 HE ARG A 39 5.606 -85.416 -11.386 1.00 25.32 H new ATOM 0 HH11 ARG A 39 3.426 -87.393 -9.416 1.00 32.13 H new ATOM 0 HH12 ARG A 39 2.816 -88.301 -10.804 1.00 32.13 H new ATOM 0 HH21 ARG A 39 4.768 -86.549 -13.158 1.00 64.21 H new ATOM 0 HH22 ARG A 39 3.572 -87.825 -12.909 1.00 64.21 H new ATOM 569 N VAL A 40 8.152 -81.602 -8.701 1.00 72.34 N ATOM 570 CA VAL A 40 7.812 -80.410 -7.927 1.00 72.44 C ATOM 571 C VAL A 40 6.557 -79.753 -8.488 1.00 70.43 C ATOM 572 O VAL A 40 6.326 -79.771 -9.697 1.00 61.43 O ATOM 573 CB VAL A 40 8.971 -79.380 -7.925 1.00 33.24 C ATOM 574 CG1 VAL A 40 9.205 -78.830 -9.329 1.00 32.30 C ATOM 575 CG2 VAL A 40 8.705 -78.242 -6.933 1.00 22.25 C ATOM 0 H VAL A 40 8.274 -81.432 -9.699 1.00 72.34 H new ATOM 0 HA VAL A 40 7.633 -80.730 -6.901 1.00 72.44 H new ATOM 0 HB VAL A 40 9.875 -79.896 -7.602 1.00 33.24 H new ATOM 0 HG11 VAL A 40 10.022 -78.109 -9.306 1.00 32.30 H new ATOM 0 HG12 VAL A 40 9.462 -79.648 -10.002 1.00 32.30 H new ATOM 0 HG13 VAL A 40 8.298 -78.340 -9.683 1.00 32.30 H new ATOM 0 HG21 VAL A 40 9.536 -77.537 -6.956 1.00 22.25 H new ATOM 0 HG22 VAL A 40 7.785 -77.727 -7.209 1.00 22.25 H new ATOM 0 HG23 VAL A 40 8.604 -78.652 -5.928 1.00 22.25 H new ATOM 585 N THR A 41 5.757 -79.178 -7.606 1.00 2.24 N ATOM 586 CA THR A 41 4.517 -78.509 -7.985 1.00 62.42 C ATOM 587 C THR A 41 4.611 -77.025 -7.634 1.00 74.20 C ATOM 588 O THR A 41 5.494 -76.621 -6.869 1.00 2.33 O ATOM 589 CB THR A 41 3.298 -79.161 -7.281 1.00 55.34 C ATOM 590 OG1 THR A 41 2.077 -78.494 -7.638 1.00 61.12 O ATOM 591 CG2 THR A 41 3.474 -79.153 -5.766 1.00 64.10 C ATOM 0 H THR A 41 5.947 -79.160 -6.604 1.00 2.24 H new ATOM 0 HA THR A 41 4.374 -78.614 -9.060 1.00 62.42 H new ATOM 0 HB THR A 41 3.239 -80.195 -7.619 1.00 55.34 H new ATOM 0 HG1 THR A 41 1.627 -78.995 -8.350 1.00 61.12 H new ATOM 0 HG21 THR A 41 2.606 -79.616 -5.296 1.00 64.10 H new ATOM 0 HG22 THR A 41 4.371 -79.712 -5.501 1.00 64.10 H new ATOM 0 HG23 THR A 41 3.571 -78.125 -5.416 1.00 64.10 H new ATOM 599 N GLY A 42 3.706 -76.220 -8.177 1.00 41.40 N ATOM 600 CA GLY A 42 3.817 -74.777 -8.035 1.00 24.42 C ATOM 601 C GLY A 42 2.581 -74.126 -7.451 1.00 40.24 C ATOM 602 O GLY A 42 1.521 -74.747 -7.349 1.00 32.35 O ATOM 0 H GLY A 42 2.898 -76.538 -8.712 1.00 41.40 H new ATOM 0 HA2 GLY A 42 4.672 -74.548 -7.399 1.00 24.42 H new ATOM 0 HA3 GLY A 42 4.020 -74.339 -9.012 1.00 24.42 H new ATOM 684 N PHE A 48 9.446 -74.523 -14.752 1.00 44.21 N ATOM 685 CA PHE A 48 10.845 -74.121 -14.666 1.00 43.23 C ATOM 686 C PHE A 48 11.241 -73.305 -15.892 1.00 63.04 C ATOM 687 O PHE A 48 10.582 -73.373 -16.933 1.00 45.54 O ATOM 688 CB PHE A 48 11.745 -75.358 -14.543 1.00 61.12 C ATOM 689 CG PHE A 48 11.904 -75.903 -13.140 1.00 53.24 C ATOM 690 CD1 PHE A 48 11.182 -75.380 -12.072 1.00 42.11 C ATOM 691 CD2 PHE A 48 12.789 -76.943 -12.896 1.00 54.45 C ATOM 692 CE1 PHE A 48 11.344 -75.888 -10.795 1.00 23.41 C ATOM 693 CE2 PHE A 48 12.952 -77.452 -11.623 1.00 23.53 C ATOM 694 CZ PHE A 48 12.229 -76.925 -10.571 1.00 52.33 C ATOM 0 HA PHE A 48 10.973 -73.501 -13.779 1.00 43.23 H new ATOM 0 HB2 PHE A 48 11.341 -76.146 -15.178 1.00 61.12 H new ATOM 0 HB3 PHE A 48 12.732 -75.110 -14.933 1.00 61.12 H new ATOM 0 HD1 PHE A 48 10.488 -74.570 -12.241 1.00 42.11 H new ATOM 0 HD2 PHE A 48 13.358 -77.360 -13.713 1.00 54.45 H new ATOM 0 HE1 PHE A 48 10.779 -75.474 -9.973 1.00 23.41 H new ATOM 0 HE2 PHE A 48 13.645 -78.262 -11.450 1.00 23.53 H new ATOM 0 HZ PHE A 48 12.355 -77.323 -9.575 1.00 52.33 H new ATOM 704 N PHE A 49 12.321 -72.541 -15.769 1.00 15.34 N ATOM 705 CA PHE A 49 12.784 -71.705 -16.868 1.00 4.40 C ATOM 706 C PHE A 49 13.431 -72.565 -17.959 1.00 62.32 C ATOM 707 O PHE A 49 14.479 -73.216 -17.735 1.00 1.00 O ATOM 708 CB PHE A 49 13.765 -70.639 -16.364 1.00 33.40 C ATOM 709 CG PHE A 49 13.995 -69.513 -17.349 1.00 61.25 C ATOM 710 CD1 PHE A 49 14.895 -69.651 -18.397 1.00 2.54 C ATOM 711 CD2 PHE A 49 13.305 -68.312 -17.223 1.00 61.52 C ATOM 712 CE1 PHE A 49 15.104 -68.619 -19.294 1.00 70.11 C ATOM 713 CE2 PHE A 49 13.510 -67.279 -18.118 1.00 52.45 C ATOM 714 CZ PHE A 49 14.411 -67.433 -19.154 1.00 63.23 C ATOM 0 H PHE A 49 12.889 -72.484 -14.924 1.00 15.34 H new ATOM 0 HA PHE A 49 11.922 -71.195 -17.298 1.00 4.40 H new ATOM 0 HB2 PHE A 49 13.387 -70.222 -15.430 1.00 33.40 H new ATOM 0 HB3 PHE A 49 14.720 -71.114 -16.138 1.00 33.40 H new ATOM 0 HD1 PHE A 49 15.439 -70.577 -18.513 1.00 2.54 H new ATOM 0 HD2 PHE A 49 12.600 -68.185 -16.415 1.00 61.52 H new ATOM 0 HE1 PHE A 49 15.809 -68.741 -20.103 1.00 70.11 H new ATOM 0 HE2 PHE A 49 12.966 -66.352 -18.008 1.00 52.45 H new ATOM 0 HZ PHE A 49 14.573 -66.626 -19.854 1.00 63.23 H new ATOM 724 N ARG A 50 12.786 -72.550 -19.134 1.00 20.24 N ATOM 725 CA ARG A 50 13.226 -73.300 -20.308 1.00 11.11 C ATOM 726 C ARG A 50 14.561 -72.769 -20.828 1.00 62.02 C ATOM 727 O ARG A 50 14.614 -72.047 -21.824 1.00 13.04 O ATOM 728 CB ARG A 50 12.154 -73.227 -21.410 1.00 4.24 C ATOM 729 CG ARG A 50 12.485 -74.040 -22.662 1.00 63.42 C ATOM 730 CD ARG A 50 12.470 -75.539 -22.390 1.00 31.41 C ATOM 731 NE ARG A 50 12.874 -76.314 -23.565 1.00 52.04 N ATOM 732 CZ ARG A 50 12.065 -77.122 -24.250 1.00 22.45 C ATOM 733 NH1 ARG A 50 10.776 -77.207 -23.946 1.00 12.14 N ATOM 734 NH2 ARG A 50 12.545 -77.823 -25.264 1.00 70.43 N ATOM 0 H ARG A 50 11.936 -72.010 -19.293 1.00 20.24 H new ATOM 0 HA ARG A 50 13.368 -74.341 -20.018 1.00 11.11 H new ATOM 0 HB2 ARG A 50 11.206 -73.578 -21.003 1.00 4.24 H new ATOM 0 HB3 ARG A 50 12.012 -72.184 -21.695 1.00 4.24 H new ATOM 0 HG2 ARG A 50 11.765 -73.807 -23.446 1.00 63.42 H new ATOM 0 HG3 ARG A 50 13.467 -73.749 -23.034 1.00 63.42 H new ATOM 0 HD2 ARG A 50 13.140 -75.763 -21.560 1.00 31.41 H new ATOM 0 HD3 ARG A 50 11.469 -75.842 -22.083 1.00 31.41 H new ATOM 0 HE ARG A 50 13.840 -76.230 -23.881 1.00 52.04 H new ATOM 0 HH11 ARG A 50 10.395 -76.650 -23.181 1.00 12.14 H new ATOM 0 HH12 ARG A 50 10.167 -77.829 -24.477 1.00 12.14 H new ATOM 0 HH21 ARG A 50 13.530 -77.744 -25.518 1.00 70.43 H new ATOM 0 HH22 ARG A 50 11.930 -78.443 -25.792 1.00 70.43 H new ATOM 748 N LYS A 51 15.612 -73.115 -20.103 1.00 31.42 N ATOM 749 CA LYS A 51 16.994 -72.760 -20.417 1.00 51.24 C ATOM 750 C LYS A 51 17.811 -72.895 -19.149 1.00 43.40 C ATOM 751 O LYS A 51 18.849 -73.545 -19.133 1.00 4.25 O ATOM 752 CB LYS A 51 17.154 -71.329 -20.963 1.00 42.54 C ATOM 753 CG LYS A 51 18.602 -70.978 -21.303 1.00 63.21 C ATOM 754 CD LYS A 51 18.735 -69.573 -21.874 1.00 2.41 C ATOM 755 CE LYS A 51 20.182 -69.251 -22.238 1.00 61.10 C ATOM 756 NZ LYS A 51 21.084 -69.305 -21.055 1.00 63.52 N ATOM 0 H LYS A 51 15.528 -73.669 -19.251 1.00 31.42 H new ATOM 0 HA LYS A 51 17.335 -73.433 -21.204 1.00 51.24 H new ATOM 0 HB2 LYS A 51 16.539 -71.216 -21.856 1.00 42.54 H new ATOM 0 HB3 LYS A 51 16.778 -70.620 -20.225 1.00 42.54 H new ATOM 0 HG2 LYS A 51 19.215 -71.063 -20.406 1.00 63.21 H new ATOM 0 HG3 LYS A 51 18.989 -71.699 -22.023 1.00 63.21 H new ATOM 0 HD2 LYS A 51 18.106 -69.478 -22.759 1.00 2.41 H new ATOM 0 HD3 LYS A 51 18.372 -68.848 -21.146 1.00 2.41 H new ATOM 0 HE2 LYS A 51 20.531 -69.957 -22.992 1.00 61.10 H new ATOM 0 HE3 LYS A 51 20.230 -68.258 -22.685 1.00 61.10 H new ATOM 0 HZ1 LYS A 51 22.010 -68.903 -21.306 1.00 63.52 H new ATOM 0 HZ2 LYS A 51 20.668 -68.756 -20.276 1.00 63.52 H new ATOM 0 HZ3 LYS A 51 21.206 -70.294 -20.756 1.00 63.52 H new ATOM 770 N TYR A 52 17.309 -72.283 -18.075 1.00 33.33 N ATOM 771 CA TYR A 52 17.956 -72.364 -16.770 1.00 52.21 C ATOM 772 C TYR A 52 17.992 -73.809 -16.296 1.00 31.13 C ATOM 773 O TYR A 52 18.970 -74.241 -15.693 1.00 33.12 O ATOM 774 CB TYR A 52 17.233 -71.493 -15.731 1.00 51.11 C ATOM 775 CG TYR A 52 17.385 -69.995 -15.938 1.00 65.03 C ATOM 776 CD1 TYR A 52 18.076 -69.478 -17.029 1.00 73.20 C ATOM 777 CD2 TYR A 52 16.833 -69.095 -15.029 1.00 31.11 C ATOM 778 CE1 TYR A 52 18.212 -68.116 -17.208 1.00 34.30 C ATOM 779 CE2 TYR A 52 16.968 -67.731 -15.204 1.00 52.05 C ATOM 780 CZ TYR A 52 17.658 -67.247 -16.294 1.00 23.30 C ATOM 781 OH TYR A 52 17.795 -65.889 -16.473 1.00 53.21 O ATOM 0 H TYR A 52 16.455 -71.726 -18.086 1.00 33.33 H new ATOM 0 HA TYR A 52 18.974 -71.989 -16.877 1.00 52.21 H new ATOM 0 HB2 TYR A 52 16.172 -71.742 -15.745 1.00 51.11 H new ATOM 0 HB3 TYR A 52 17.608 -71.748 -14.740 1.00 51.11 H new ATOM 0 HD1 TYR A 52 18.514 -70.154 -17.749 1.00 73.20 H new ATOM 0 HD2 TYR A 52 16.291 -69.470 -14.173 1.00 31.11 H new ATOM 0 HE1 TYR A 52 18.751 -67.733 -18.062 1.00 34.30 H new ATOM 0 HE2 TYR A 52 16.534 -67.047 -14.489 1.00 52.05 H new ATOM 0 HH TYR A 52 17.346 -65.416 -15.742 1.00 53.21 H new ATOM 791 N THR A 53 16.919 -74.554 -16.569 1.00 44.10 N ATOM 792 CA THR A 53 16.887 -75.973 -16.213 1.00 3.41 C ATOM 793 C THR A 53 18.021 -76.744 -16.912 1.00 73.23 C ATOM 794 O THR A 53 18.830 -77.425 -16.258 1.00 72.33 O ATOM 795 CB THR A 53 15.522 -76.599 -16.568 1.00 45.12 C ATOM 796 OG1 THR A 53 14.478 -75.827 -15.961 1.00 53.20 O ATOM 797 CG2 THR A 53 15.433 -78.047 -16.090 1.00 71.23 C ATOM 0 H THR A 53 16.076 -74.207 -17.027 1.00 44.10 H new ATOM 0 HA THR A 53 17.033 -76.046 -15.135 1.00 3.41 H new ATOM 0 HB THR A 53 15.412 -76.595 -17.652 1.00 45.12 H new ATOM 0 HG1 THR A 53 14.809 -75.424 -15.131 1.00 53.20 H new ATOM 0 HG21 THR A 53 14.459 -78.459 -16.356 1.00 71.23 H new ATOM 0 HG22 THR A 53 16.218 -78.636 -16.565 1.00 71.23 H new ATOM 0 HG23 THR A 53 15.558 -78.081 -15.008 1.00 71.23 H new ATOM 805 N LYS A 54 18.089 -76.608 -18.237 1.00 52.34 N ATOM 806 CA LYS A 54 19.107 -77.288 -19.035 1.00 30.44 C ATOM 807 C LYS A 54 20.499 -76.834 -18.593 1.00 3.54 C ATOM 808 O LYS A 54 21.374 -77.658 -18.333 1.00 44.10 O ATOM 809 CB LYS A 54 18.887 -76.994 -20.537 1.00 40.44 C ATOM 810 CG LYS A 54 19.595 -77.958 -21.503 1.00 35.45 C ATOM 811 CD LYS A 54 21.121 -77.807 -21.499 1.00 30.33 C ATOM 812 CE LYS A 54 21.567 -76.414 -21.934 1.00 3.15 C ATOM 813 NZ LYS A 54 21.213 -76.129 -23.347 1.00 23.31 N ATOM 0 H LYS A 54 17.448 -76.030 -18.781 1.00 52.34 H new ATOM 0 HA LYS A 54 19.026 -78.364 -18.881 1.00 30.44 H new ATOM 0 HB2 LYS A 54 17.817 -77.019 -20.743 1.00 40.44 H new ATOM 0 HB3 LYS A 54 19.228 -75.980 -20.746 1.00 40.44 H new ATOM 0 HG2 LYS A 54 19.337 -78.983 -21.236 1.00 35.45 H new ATOM 0 HG3 LYS A 54 19.222 -77.788 -22.513 1.00 35.45 H new ATOM 0 HD2 LYS A 54 21.501 -78.012 -20.498 1.00 30.33 H new ATOM 0 HD3 LYS A 54 21.559 -78.551 -22.165 1.00 30.33 H new ATOM 0 HE2 LYS A 54 21.105 -75.668 -21.288 1.00 3.15 H new ATOM 0 HE3 LYS A 54 22.646 -76.323 -21.806 1.00 3.15 H new ATOM 0 HZ1 LYS A 54 21.637 -75.224 -23.635 1.00 23.31 H new ATOM 0 HZ2 LYS A 54 21.575 -76.890 -23.956 1.00 23.31 H new ATOM 0 HZ3 LYS A 54 20.179 -76.072 -23.441 1.00 23.31 H new ATOM 827 N LYS A 55 20.684 -75.519 -18.504 1.00 61.15 N ATOM 828 CA LYS A 55 21.974 -74.930 -18.146 1.00 23.30 C ATOM 829 C LYS A 55 22.438 -75.450 -16.788 1.00 15.04 C ATOM 830 O LYS A 55 23.605 -75.794 -16.616 1.00 2.24 O ATOM 831 CB LYS A 55 21.870 -73.389 -18.147 1.00 11.43 C ATOM 832 CG LYS A 55 23.191 -72.644 -17.913 1.00 64.44 C ATOM 833 CD LYS A 55 23.546 -72.518 -16.429 1.00 65.33 C ATOM 834 CE LYS A 55 24.865 -71.785 -16.219 1.00 14.41 C ATOM 835 NZ LYS A 55 25.176 -71.610 -14.775 1.00 63.50 N ATOM 0 H LYS A 55 19.948 -74.834 -18.677 1.00 61.15 H new ATOM 0 HA LYS A 55 22.717 -75.223 -18.888 1.00 23.30 H new ATOM 0 HB2 LYS A 55 21.456 -73.070 -19.103 1.00 11.43 H new ATOM 0 HB3 LYS A 55 21.161 -73.088 -17.376 1.00 11.43 H new ATOM 0 HG2 LYS A 55 23.995 -73.167 -18.431 1.00 64.44 H new ATOM 0 HG3 LYS A 55 23.124 -71.648 -18.352 1.00 64.44 H new ATOM 0 HD2 LYS A 55 22.749 -71.986 -15.909 1.00 65.33 H new ATOM 0 HD3 LYS A 55 23.609 -73.512 -15.985 1.00 65.33 H new ATOM 0 HE2 LYS A 55 25.670 -72.341 -16.699 1.00 14.41 H new ATOM 0 HE3 LYS A 55 24.819 -70.809 -16.702 1.00 14.41 H new ATOM 0 HZ1 LYS A 55 26.081 -71.107 -14.673 1.00 63.50 H new ATOM 0 HZ2 LYS A 55 24.420 -71.058 -14.322 1.00 63.50 H new ATOM 0 HZ3 LYS A 55 25.245 -72.542 -14.319 1.00 63.50 H new ATOM 849 N GLU A 56 21.512 -75.509 -15.834 1.00 61.35 N ATOM 850 CA GLU A 56 21.811 -76.004 -14.496 1.00 4.44 C ATOM 851 C GLU A 56 22.311 -77.443 -14.570 1.00 34.44 C ATOM 852 O GLU A 56 23.411 -77.765 -14.095 1.00 61.15 O ATOM 853 CB GLU A 56 20.561 -75.934 -13.607 1.00 12.34 C ATOM 854 CG GLU A 56 20.811 -76.352 -12.163 1.00 53.51 C ATOM 855 CD GLU A 56 21.741 -75.396 -11.428 1.00 25.14 C ATOM 856 OE1 GLU A 56 21.478 -74.173 -11.445 1.00 63.10 O ATOM 857 OE2 GLU A 56 22.742 -75.851 -10.842 1.00 24.04 O ATOM 0 H GLU A 56 20.543 -75.218 -15.966 1.00 61.35 H new ATOM 0 HA GLU A 56 22.588 -75.376 -14.060 1.00 4.44 H new ATOM 0 HB2 GLU A 56 20.174 -74.915 -13.619 1.00 12.34 H new ATOM 0 HB3 GLU A 56 19.788 -76.574 -14.032 1.00 12.34 H new ATOM 0 HG2 GLU A 56 19.859 -76.405 -11.634 1.00 53.51 H new ATOM 0 HG3 GLU A 56 21.240 -77.354 -12.148 1.00 53.51 H new ATOM 864 N ALA A 57 21.498 -78.297 -15.195 1.00 2.01 N ATOM 865 CA ALA A 57 21.826 -79.710 -15.342 1.00 74.43 C ATOM 866 C ALA A 57 23.181 -79.881 -16.026 1.00 71.13 C ATOM 867 O ALA A 57 24.036 -80.624 -15.554 1.00 12.10 O ATOM 868 CB ALA A 57 20.729 -80.424 -16.122 1.00 4.12 C ATOM 0 H ALA A 57 20.605 -78.030 -15.608 1.00 2.01 H new ATOM 0 HA ALA A 57 21.893 -80.158 -14.351 1.00 74.43 H new ATOM 0 HB1 ALA A 57 20.984 -81.479 -16.226 1.00 4.12 H new ATOM 0 HB2 ALA A 57 19.783 -80.330 -15.588 1.00 4.12 H new ATOM 0 HB3 ALA A 57 20.634 -79.975 -17.110 1.00 4.12 H new ATOM 874 N ASP A 58 23.374 -79.158 -17.122 1.00 44.45 N ATOM 875 CA ASP A 58 24.620 -79.212 -17.885 1.00 61.14 C ATOM 876 C ASP A 58 25.802 -78.755 -17.030 1.00 50.21 C ATOM 877 O ASP A 58 26.866 -79.379 -17.032 1.00 33.21 O ATOM 878 CB ASP A 58 24.501 -78.333 -19.140 1.00 0.41 C ATOM 879 CG ASP A 58 25.793 -78.257 -19.945 1.00 35.12 C ATOM 880 OD1 ASP A 58 26.027 -79.138 -20.797 1.00 22.10 O ATOM 881 OD2 ASP A 58 26.575 -77.305 -19.731 1.00 32.14 O ATOM 0 H ASP A 58 22.677 -78.520 -17.507 1.00 44.45 H new ATOM 0 HA ASP A 58 24.798 -80.244 -18.186 1.00 61.14 H new ATOM 0 HB2 ASP A 58 23.707 -78.724 -19.776 1.00 0.41 H new ATOM 0 HB3 ASP A 58 24.205 -77.327 -18.844 1.00 0.41 H new ATOM 886 N ALA A 59 25.591 -77.676 -16.278 1.00 41.11 N ATOM 887 CA ALA A 59 26.647 -77.070 -15.470 1.00 31.13 C ATOM 888 C ALA A 59 27.163 -78.037 -14.407 1.00 41.12 C ATOM 889 O ALA A 59 28.372 -78.240 -14.277 1.00 73.43 O ATOM 890 CB ALA A 59 26.140 -75.786 -14.821 1.00 33.22 C ATOM 0 H ALA A 59 24.691 -77.201 -16.212 1.00 41.11 H new ATOM 0 HA ALA A 59 27.480 -76.830 -16.131 1.00 31.13 H new ATOM 0 HB1 ALA A 59 26.935 -75.343 -14.221 1.00 33.22 H new ATOM 0 HB2 ALA A 59 25.835 -75.083 -15.596 1.00 33.22 H new ATOM 0 HB3 ALA A 59 25.287 -76.014 -14.182 1.00 33.22 H new ATOM 896 N LEU A 60 26.244 -78.641 -13.657 1.00 54.24 N ATOM 897 CA LEU A 60 26.623 -79.602 -12.615 1.00 74.52 C ATOM 898 C LEU A 60 26.787 -81.006 -13.206 1.00 2.20 C ATOM 899 O LEU A 60 27.237 -81.926 -12.520 1.00 5.04 O ATOM 900 CB LEU A 60 25.591 -79.606 -11.472 1.00 10.34 C ATOM 901 CG LEU A 60 25.773 -78.528 -10.383 1.00 60.33 C ATOM 902 CD1 LEU A 60 27.021 -78.806 -9.544 1.00 41.11 C ATOM 903 CD2 LEU A 60 25.839 -77.131 -10.996 1.00 51.52 C ATOM 0 H LEU A 60 25.240 -78.487 -13.747 1.00 54.24 H new ATOM 0 HA LEU A 60 27.583 -79.293 -12.202 1.00 74.52 H new ATOM 0 HB2 LEU A 60 24.598 -79.489 -11.907 1.00 10.34 H new ATOM 0 HB3 LEU A 60 25.615 -80.584 -10.992 1.00 10.34 H new ATOM 0 HG LEU A 60 24.903 -78.568 -9.728 1.00 60.33 H new ATOM 0 HD11 LEU A 60 27.128 -78.033 -8.783 1.00 41.11 H new ATOM 0 HD12 LEU A 60 26.926 -79.779 -9.062 1.00 41.11 H new ATOM 0 HD13 LEU A 60 27.900 -78.805 -10.188 1.00 41.11 H new ATOM 0 HD21 LEU A 60 25.967 -76.392 -10.205 1.00 51.52 H new ATOM 0 HD22 LEU A 60 26.682 -77.075 -11.685 1.00 51.52 H new ATOM 0 HD23 LEU A 60 24.915 -76.927 -11.536 1.00 51.52 H new ATOM 915 N SER A 61 26.424 -81.151 -14.481 1.00 74.52 N ATOM 916 CA SER A 61 26.616 -82.392 -15.232 1.00 3.53 C ATOM 917 C SER A 61 25.719 -83.516 -14.707 1.00 64.03 C ATOM 918 O SER A 61 26.160 -84.652 -14.513 1.00 34.12 O ATOM 919 CB SER A 61 28.098 -82.807 -15.192 1.00 74.53 C ATOM 920 OG SER A 61 28.936 -81.753 -15.648 1.00 63.03 O ATOM 0 H SER A 61 25.986 -80.407 -15.024 1.00 74.52 H new ATOM 0 HA SER A 61 26.328 -82.209 -16.267 1.00 3.53 H new ATOM 0 HB2 SER A 61 28.375 -83.082 -14.174 1.00 74.53 H new ATOM 0 HB3 SER A 61 28.249 -83.690 -15.813 1.00 74.53 H new ATOM 0 HG SER A 61 29.872 -82.040 -15.612 1.00 63.03 H new ATOM 926 N LEU A 62 24.442 -83.192 -14.506 1.00 73.12 N ATOM 927 CA LEU A 62 23.445 -84.196 -14.151 1.00 32.44 C ATOM 928 C LEU A 62 22.921 -84.860 -15.418 1.00 13.42 C ATOM 929 O LEU A 62 22.597 -84.177 -16.390 1.00 54.02 O ATOM 930 CB LEU A 62 22.259 -83.577 -13.381 1.00 62.02 C ATOM 931 CG LEU A 62 22.591 -82.887 -12.042 1.00 31.13 C ATOM 932 CD1 LEU A 62 23.646 -83.672 -11.277 1.00 22.14 C ATOM 933 CD2 LEU A 62 23.023 -81.443 -12.259 1.00 20.31 C ATOM 0 H LEU A 62 24.076 -82.243 -14.583 1.00 73.12 H new ATOM 0 HA LEU A 62 23.926 -84.929 -13.504 1.00 32.44 H new ATOM 0 HB2 LEU A 62 21.775 -82.847 -14.030 1.00 62.02 H new ATOM 0 HB3 LEU A 62 21.530 -84.364 -13.187 1.00 62.02 H new ATOM 0 HG LEU A 62 21.684 -82.869 -11.438 1.00 31.13 H new ATOM 0 HD11 LEU A 62 23.864 -83.167 -10.336 1.00 22.14 H new ATOM 0 HD12 LEU A 62 23.275 -84.676 -11.072 1.00 22.14 H new ATOM 0 HD13 LEU A 62 24.556 -83.736 -11.874 1.00 22.14 H new ATOM 0 HD21 LEU A 62 23.250 -80.983 -11.297 1.00 20.31 H new ATOM 0 HD22 LEU A 62 23.911 -81.420 -12.891 1.00 20.31 H new ATOM 0 HD23 LEU A 62 22.218 -80.891 -12.744 1.00 20.31 H new ATOM 945 N VAL A 63 22.837 -86.183 -15.409 1.00 63.31 N ATOM 946 CA VAL A 63 22.248 -86.920 -16.521 1.00 53.30 C ATOM 947 C VAL A 63 20.854 -87.390 -16.127 1.00 24.01 C ATOM 948 O VAL A 63 20.565 -87.556 -14.940 1.00 52.40 O ATOM 949 CB VAL A 63 23.115 -88.131 -16.956 1.00 11.42 C ATOM 950 CG1 VAL A 63 24.536 -87.684 -17.299 1.00 23.31 C ATOM 951 CG2 VAL A 63 23.133 -89.219 -15.885 1.00 10.23 C ATOM 0 H VAL A 63 23.169 -86.770 -14.644 1.00 63.31 H new ATOM 0 HA VAL A 63 22.193 -86.246 -17.376 1.00 53.30 H new ATOM 0 HB VAL A 63 22.663 -88.557 -17.852 1.00 11.42 H new ATOM 0 HG11 VAL A 63 25.126 -88.549 -17.601 1.00 23.31 H new ATOM 0 HG12 VAL A 63 24.503 -86.963 -18.116 1.00 23.31 H new ATOM 0 HG13 VAL A 63 24.993 -87.221 -16.424 1.00 23.31 H new ATOM 0 HG21 VAL A 63 23.749 -90.052 -16.223 1.00 10.23 H new ATOM 0 HG22 VAL A 63 23.546 -88.813 -14.961 1.00 10.23 H new ATOM 0 HG23 VAL A 63 22.117 -89.569 -15.705 1.00 10.23 H new ATOM 961 N GLY A 64 19.992 -87.577 -17.114 1.00 15.23 N ATOM 962 CA GLY A 64 18.623 -87.988 -16.850 1.00 55.25 C ATOM 963 C GLY A 64 17.654 -87.310 -17.791 1.00 30.41 C ATOM 964 O GLY A 64 17.885 -87.280 -19.003 1.00 63.55 O ATOM 0 H GLY A 64 20.215 -87.451 -18.101 1.00 15.23 H new ATOM 0 HA2 GLY A 64 18.539 -89.070 -16.956 1.00 55.25 H new ATOM 0 HA3 GLY A 64 18.361 -87.747 -15.820 1.00 55.25 H new ATOM 968 N TYR A 65 16.572 -86.757 -17.252 1.00 73.32 N ATOM 969 CA TYR A 65 15.590 -86.065 -18.083 1.00 13.32 C ATOM 970 C TYR A 65 14.622 -85.254 -17.229 1.00 31.43 C ATOM 971 O TYR A 65 14.363 -85.607 -16.083 1.00 30.44 O ATOM 972 CB TYR A 65 14.849 -87.075 -18.992 1.00 12.34 C ATOM 973 CG TYR A 65 13.357 -87.226 -18.730 1.00 12.32 C ATOM 974 CD1 TYR A 65 12.881 -88.097 -17.753 1.00 2.54 C ATOM 975 CD2 TYR A 65 12.426 -86.501 -19.471 1.00 43.24 C ATOM 976 CE1 TYR A 65 11.526 -88.238 -17.526 1.00 14.21 C ATOM 977 CE2 TYR A 65 11.071 -86.639 -19.247 1.00 74.34 C ATOM 978 CZ TYR A 65 10.628 -87.508 -18.272 1.00 4.14 C ATOM 979 OH TYR A 65 9.279 -87.651 -18.044 1.00 22.34 O ATOM 0 H TYR A 65 16.353 -86.773 -16.256 1.00 73.32 H new ATOM 0 HA TYR A 65 16.115 -85.359 -18.727 1.00 13.32 H new ATOM 0 HB2 TYR A 65 14.988 -86.772 -20.030 1.00 12.34 H new ATOM 0 HB3 TYR A 65 15.320 -88.051 -18.879 1.00 12.34 H new ATOM 0 HD1 TYR A 65 13.582 -88.671 -17.164 1.00 2.54 H new ATOM 0 HD2 TYR A 65 12.771 -85.819 -20.234 1.00 43.24 H new ATOM 0 HE1 TYR A 65 11.172 -88.919 -16.766 1.00 14.21 H new ATOM 0 HE2 TYR A 65 10.363 -86.070 -19.831 1.00 74.34 H new ATOM 0 HH TYR A 65 9.129 -87.882 -17.103 1.00 22.34 H new ATOM 989 N VAL A 66 14.108 -84.158 -17.788 1.00 23.54 N ATOM 990 CA VAL A 66 13.122 -83.314 -17.092 1.00 72.34 C ATOM 991 C VAL A 66 12.024 -82.856 -18.051 1.00 10.41 C ATOM 992 O VAL A 66 12.309 -82.551 -19.209 1.00 63.31 O ATOM 993 CB VAL A 66 13.790 -82.077 -16.414 1.00 1.11 C ATOM 994 CG1 VAL A 66 12.769 -80.974 -16.125 1.00 51.44 C ATOM 995 CG2 VAL A 66 14.494 -82.489 -15.121 1.00 12.42 C ATOM 0 H VAL A 66 14.355 -83.829 -18.721 1.00 23.54 H new ATOM 0 HA VAL A 66 12.676 -83.926 -16.308 1.00 72.34 H new ATOM 0 HB VAL A 66 14.528 -81.680 -17.112 1.00 1.11 H new ATOM 0 HG11 VAL A 66 13.270 -80.129 -15.653 1.00 51.44 H new ATOM 0 HG12 VAL A 66 12.311 -80.649 -17.059 1.00 51.44 H new ATOM 0 HG13 VAL A 66 11.998 -81.358 -15.457 1.00 51.44 H new ATOM 0 HG21 VAL A 66 14.954 -81.614 -14.662 1.00 12.42 H new ATOM 0 HG22 VAL A 66 13.767 -82.920 -14.432 1.00 12.42 H new ATOM 0 HG23 VAL A 66 15.264 -83.228 -15.345 1.00 12.42 H new ATOM 1005 N THR A 67 10.782 -82.811 -17.545 1.00 33.35 N ATOM 1006 CA THR A 67 9.608 -82.375 -18.307 1.00 62.00 C ATOM 1007 C THR A 67 8.545 -81.789 -17.363 1.00 43.22 C ATOM 1008 O THR A 67 8.585 -82.025 -16.153 1.00 43.20 O ATOM 1009 CB THR A 67 8.973 -83.539 -19.110 1.00 20.20 C ATOM 1010 OG1 THR A 67 7.895 -83.046 -19.918 1.00 12.03 O ATOM 1011 CG2 THR A 67 8.439 -84.630 -18.188 1.00 52.41 C ATOM 0 H THR A 67 10.565 -83.080 -16.585 1.00 33.35 H new ATOM 0 HA THR A 67 9.950 -81.614 -19.009 1.00 62.00 H new ATOM 0 HB THR A 67 9.753 -83.966 -19.740 1.00 20.20 H new ATOM 0 HG1 THR A 67 7.500 -83.787 -20.423 1.00 12.03 H new ATOM 0 HG21 THR A 67 8.001 -85.429 -18.786 1.00 52.41 H new ATOM 0 HG22 THR A 67 9.256 -85.031 -17.588 1.00 52.41 H new ATOM 0 HG23 THR A 67 7.678 -84.210 -17.530 1.00 52.41 H new ATOM 1019 N ASN A 68 7.602 -81.025 -17.916 1.00 24.14 N ATOM 1020 CA ASN A 68 6.520 -80.430 -17.124 1.00 73.40 C ATOM 1021 C ASN A 68 5.268 -81.305 -17.204 1.00 73.12 C ATOM 1022 O ASN A 68 5.098 -82.077 -18.150 1.00 10.52 O ATOM 1023 CB ASN A 68 6.206 -79.013 -17.624 1.00 71.15 C ATOM 1024 CG ASN A 68 5.244 -78.246 -16.719 1.00 11.14 C ATOM 1025 OD1 ASN A 68 4.414 -77.471 -17.195 1.00 14.14 O ATOM 1026 ND2 ASN A 68 5.370 -78.426 -15.410 1.00 71.23 N ATOM 0 H ASN A 68 7.564 -80.802 -18.911 1.00 24.14 H new ATOM 0 HA ASN A 68 6.843 -80.368 -16.085 1.00 73.40 H new ATOM 0 HB2 ASN A 68 7.137 -78.452 -17.710 1.00 71.15 H new ATOM 0 HB3 ASN A 68 5.779 -79.076 -18.625 1.00 71.15 H new ATOM 0 HD21 ASN A 68 4.768 -77.914 -14.765 1.00 71.23 H new ATOM 0 HD22 ASN A 68 6.068 -79.076 -15.049 1.00 71.23 H new ATOM 1033 N ASN A 69 4.408 -81.197 -16.191 1.00 74.00 N ATOM 1034 CA ASN A 69 3.178 -81.994 -16.105 1.00 52.24 C ATOM 1035 C ASN A 69 1.949 -81.094 -16.196 1.00 5.25 C ATOM 1036 O ASN A 69 2.043 -79.883 -15.980 1.00 52.52 O ATOM 1037 CB ASN A 69 3.127 -82.805 -14.794 1.00 72.13 C ATOM 1038 CG ASN A 69 4.141 -83.944 -14.725 1.00 72.22 C ATOM 1039 OD1 ASN A 69 3.860 -85.006 -14.164 1.00 2.34 O ATOM 1040 ND2 ASN A 69 5.334 -83.728 -15.249 1.00 31.15 N ATOM 0 H ASN A 69 4.541 -80.557 -15.408 1.00 74.00 H new ATOM 0 HA ASN A 69 3.179 -82.690 -16.944 1.00 52.24 H new ATOM 0 HB2 ASN A 69 3.297 -82.130 -13.955 1.00 72.13 H new ATOM 0 HB3 ASN A 69 2.125 -83.217 -14.673 1.00 72.13 H new ATOM 0 HD21 ASN A 69 6.053 -84.450 -15.196 1.00 31.15 H new ATOM 0 HD22 ASN A 69 5.537 -82.839 -15.707 1.00 31.15 H new ATOM 1047 N GLU A 70 0.801 -81.712 -16.478 1.00 63.52 N ATOM 1048 CA GLU A 70 -0.462 -81.000 -16.698 1.00 54.22 C ATOM 1049 C GLU A 70 -0.777 -80.020 -15.563 1.00 23.41 C ATOM 1050 O GLU A 70 -1.116 -78.859 -15.807 1.00 22.31 O ATOM 1051 CB GLU A 70 -1.607 -82.015 -16.833 1.00 35.24 C ATOM 1052 CG GLU A 70 -2.981 -81.382 -16.993 1.00 73.50 C ATOM 1053 CD GLU A 70 -4.087 -82.416 -17.085 1.00 44.50 C ATOM 1054 OE1 GLU A 70 -4.375 -82.888 -18.205 1.00 32.11 O ATOM 1055 OE2 GLU A 70 -4.676 -82.762 -16.041 1.00 22.30 O ATOM 0 H GLU A 70 0.719 -82.725 -16.561 1.00 63.52 H new ATOM 0 HA GLU A 70 -0.359 -80.421 -17.616 1.00 54.22 H new ATOM 0 HB2 GLU A 70 -1.411 -82.655 -17.693 1.00 35.24 H new ATOM 0 HB3 GLU A 70 -1.615 -82.657 -15.952 1.00 35.24 H new ATOM 0 HG2 GLU A 70 -3.174 -80.721 -16.148 1.00 73.50 H new ATOM 0 HG3 GLU A 70 -2.991 -80.763 -17.890 1.00 73.50 H new ATOM 1062 N ASP A 71 -0.641 -80.491 -14.329 1.00 53.44 N ATOM 1063 CA ASP A 71 -0.998 -79.699 -13.142 1.00 52.32 C ATOM 1064 C ASP A 71 -0.101 -78.473 -12.997 1.00 60.33 C ATOM 1065 O ASP A 71 -0.450 -77.507 -12.314 1.00 61.33 O ATOM 1066 CB ASP A 71 -0.888 -80.565 -11.878 1.00 72.43 C ATOM 1067 CG ASP A 71 -1.078 -79.768 -10.591 1.00 73.01 C ATOM 1068 OD1 ASP A 71 -2.233 -79.421 -10.264 1.00 23.34 O ATOM 1069 OD2 ASP A 71 -0.075 -79.497 -9.888 1.00 44.11 O ATOM 0 H ASP A 71 -0.284 -81.423 -14.116 1.00 53.44 H new ATOM 0 HA ASP A 71 -2.026 -79.359 -13.268 1.00 52.32 H new ATOM 0 HB2 ASP A 71 -1.635 -81.358 -11.921 1.00 72.43 H new ATOM 0 HB3 ASP A 71 0.089 -81.048 -11.859 1.00 72.43 H new ATOM 1074 N GLY A 72 1.026 -78.496 -13.684 1.00 2.22 N ATOM 1075 CA GLY A 72 2.056 -77.507 -13.460 1.00 24.21 C ATOM 1076 C GLY A 72 3.100 -78.057 -12.520 1.00 64.40 C ATOM 1077 O GLY A 72 3.479 -77.421 -11.539 1.00 24.14 O ATOM 0 H GLY A 72 1.248 -79.188 -14.399 1.00 2.22 H new ATOM 0 HA2 GLY A 72 2.518 -77.229 -14.407 1.00 24.21 H new ATOM 0 HA3 GLY A 72 1.618 -76.601 -13.041 1.00 24.21 H new ATOM 1081 N SER A 73 3.536 -79.270 -12.815 1.00 74.30 N ATOM 1082 CA SER A 73 4.511 -79.969 -11.997 1.00 53.52 C ATOM 1083 C SER A 73 5.714 -80.357 -12.850 1.00 5.24 C ATOM 1084 O SER A 73 5.560 -80.966 -13.905 1.00 20.32 O ATOM 1085 CB SER A 73 3.864 -81.217 -11.373 1.00 23.04 C ATOM 1086 OG SER A 73 4.780 -81.925 -10.557 1.00 33.31 O ATOM 0 H SER A 73 3.223 -79.798 -13.630 1.00 74.30 H new ATOM 0 HA SER A 73 4.851 -79.315 -11.194 1.00 53.52 H new ATOM 0 HB2 SER A 73 3.000 -80.921 -10.779 1.00 23.04 H new ATOM 0 HB3 SER A 73 3.498 -81.872 -12.164 1.00 23.04 H new ATOM 0 HG SER A 73 5.449 -81.304 -10.201 1.00 33.31 H new ATOM 1092 N VAL A 74 6.905 -79.978 -12.412 1.00 2.14 N ATOM 1093 CA VAL A 74 8.125 -80.330 -13.127 1.00 23.14 C ATOM 1094 C VAL A 74 8.689 -81.626 -12.561 1.00 45.15 C ATOM 1095 O VAL A 74 9.083 -81.682 -11.396 1.00 50.12 O ATOM 1096 CB VAL A 74 9.191 -79.208 -13.035 1.00 61.55 C ATOM 1097 CG1 VAL A 74 10.456 -79.594 -13.798 1.00 25.24 C ATOM 1098 CG2 VAL A 74 8.628 -77.887 -13.551 1.00 44.21 C ATOM 0 H VAL A 74 7.054 -79.427 -11.566 1.00 2.14 H new ATOM 0 HA VAL A 74 7.873 -80.460 -14.179 1.00 23.14 H new ATOM 0 HB VAL A 74 9.458 -79.079 -11.986 1.00 61.55 H new ATOM 0 HG11 VAL A 74 11.188 -78.791 -13.718 1.00 25.24 H new ATOM 0 HG12 VAL A 74 10.872 -80.508 -13.374 1.00 25.24 H new ATOM 0 HG13 VAL A 74 10.212 -79.760 -14.847 1.00 25.24 H new ATOM 0 HG21 VAL A 74 9.392 -77.113 -13.478 1.00 44.21 H new ATOM 0 HG22 VAL A 74 8.326 -78.002 -14.592 1.00 44.21 H new ATOM 0 HG23 VAL A 74 7.763 -77.601 -12.952 1.00 44.21 H new ATOM 1108 N SER A 75 8.705 -82.668 -13.382 1.00 24.41 N ATOM 1109 CA SER A 75 9.185 -83.975 -12.961 1.00 33.53 C ATOM 1110 C SER A 75 10.336 -84.433 -13.850 1.00 25.55 C ATOM 1111 O SER A 75 10.582 -83.855 -14.910 1.00 44.43 O ATOM 1112 CB SER A 75 8.040 -84.995 -13.006 1.00 45.42 C ATOM 1113 OG SER A 75 7.476 -85.081 -14.306 1.00 50.11 O ATOM 0 H SER A 75 8.388 -82.631 -14.351 1.00 24.41 H new ATOM 0 HA SER A 75 9.550 -83.899 -11.937 1.00 33.53 H new ATOM 0 HB2 SER A 75 8.410 -85.974 -12.703 1.00 45.42 H new ATOM 0 HB3 SER A 75 7.268 -84.710 -12.291 1.00 45.42 H new ATOM 0 HG SER A 75 6.914 -85.881 -14.366 1.00 50.11 H new ATOM 1119 N GLY A 76 11.034 -85.469 -13.415 1.00 32.44 N ATOM 1120 CA GLY A 76 12.119 -86.024 -14.199 1.00 51.54 C ATOM 1121 C GLY A 76 12.983 -86.960 -13.386 1.00 43.42 C ATOM 1122 O GLY A 76 12.561 -87.435 -12.332 1.00 53.55 O ATOM 0 H GLY A 76 10.868 -85.940 -12.526 1.00 32.44 H new ATOM 0 HA2 GLY A 76 11.710 -86.560 -15.056 1.00 51.54 H new ATOM 0 HA3 GLY A 76 12.733 -85.214 -14.593 1.00 51.54 H new ATOM 1126 N VAL A 77 14.186 -87.236 -13.876 1.00 42.05 N ATOM 1127 CA VAL A 77 15.136 -88.094 -13.176 1.00 43.44 C ATOM 1128 C VAL A 77 16.536 -87.497 -13.271 1.00 74.14 C ATOM 1129 O VAL A 77 16.940 -87.021 -14.338 1.00 42.33 O ATOM 1130 CB VAL A 77 15.163 -89.533 -13.761 1.00 53.04 C ATOM 1131 CG1 VAL A 77 16.154 -90.407 -12.996 1.00 73.25 C ATOM 1132 CG2 VAL A 77 13.770 -90.165 -13.754 1.00 44.22 C ATOM 0 H VAL A 77 14.530 -86.874 -14.765 1.00 42.05 H new ATOM 0 HA VAL A 77 14.814 -88.154 -12.136 1.00 43.44 H new ATOM 0 HB VAL A 77 15.491 -89.463 -14.798 1.00 53.04 H new ATOM 0 HG11 VAL A 77 16.158 -91.411 -13.421 1.00 73.25 H new ATOM 0 HG12 VAL A 77 17.153 -89.977 -13.072 1.00 73.25 H new ATOM 0 HG13 VAL A 77 15.860 -90.458 -11.948 1.00 73.25 H new ATOM 0 HG21 VAL A 77 13.825 -91.171 -14.170 1.00 44.22 H new ATOM 0 HG22 VAL A 77 13.398 -90.215 -12.731 1.00 44.22 H new ATOM 0 HG23 VAL A 77 13.093 -89.560 -14.357 1.00 44.22 H new ATOM 1142 N VAL A 78 17.257 -87.515 -12.152 1.00 11.12 N ATOM 1143 CA VAL A 78 18.641 -87.055 -12.090 1.00 13.11 C ATOM 1144 C VAL A 78 19.537 -88.199 -11.618 1.00 3.40 C ATOM 1145 O VAL A 78 19.207 -88.892 -10.653 1.00 63.53 O ATOM 1146 CB VAL A 78 18.803 -85.850 -11.125 1.00 55.53 C ATOM 1147 CG1 VAL A 78 20.278 -85.523 -10.896 1.00 52.34 C ATOM 1148 CG2 VAL A 78 18.052 -84.625 -11.648 1.00 23.42 C ATOM 0 H VAL A 78 16.895 -87.851 -11.259 1.00 11.12 H new ATOM 0 HA VAL A 78 18.931 -86.731 -13.090 1.00 13.11 H new ATOM 0 HB VAL A 78 18.367 -86.131 -10.166 1.00 55.53 H new ATOM 0 HG11 VAL A 78 20.361 -84.675 -10.216 1.00 52.34 H new ATOM 0 HG12 VAL A 78 20.779 -86.388 -10.461 1.00 52.34 H new ATOM 0 HG13 VAL A 78 20.747 -85.273 -11.847 1.00 52.34 H new ATOM 0 HG21 VAL A 78 18.182 -83.795 -10.954 1.00 23.42 H new ATOM 0 HG22 VAL A 78 18.447 -84.346 -12.625 1.00 23.42 H new ATOM 0 HG23 VAL A 78 16.991 -84.860 -11.739 1.00 23.42 H new ATOM 1158 N GLN A 79 20.655 -88.397 -12.309 1.00 61.04 N ATOM 1159 CA GLN A 79 21.601 -89.456 -11.974 1.00 72.34 C ATOM 1160 C GLN A 79 23.026 -88.897 -11.996 1.00 51.25 C ATOM 1161 O GLN A 79 23.376 -88.114 -12.884 1.00 1.41 O ATOM 1162 CB GLN A 79 21.463 -90.638 -12.963 1.00 75.34 C ATOM 1163 CG GLN A 79 20.267 -90.519 -13.913 1.00 65.40 C ATOM 1164 CD GLN A 79 20.146 -91.679 -14.888 1.00 13.34 C ATOM 1165 OE1 GLN A 79 19.735 -91.497 -16.031 1.00 12.03 O ATOM 1166 NE2 GLN A 79 20.461 -92.885 -14.440 1.00 41.24 N ATOM 0 H GLN A 79 20.930 -87.832 -13.112 1.00 61.04 H new ATOM 0 HA GLN A 79 21.382 -89.827 -10.973 1.00 72.34 H new ATOM 0 HB2 GLN A 79 22.376 -90.713 -13.553 1.00 75.34 H new ATOM 0 HB3 GLN A 79 21.373 -91.564 -12.396 1.00 75.34 H new ATOM 0 HG2 GLN A 79 19.352 -90.453 -13.325 1.00 65.40 H new ATOM 0 HG3 GLN A 79 20.352 -89.590 -14.476 1.00 65.40 H new ATOM 0 HE21 GLN A 79 20.800 -93.002 -13.485 1.00 41.24 H new ATOM 0 HE22 GLN A 79 20.365 -93.697 -15.050 1.00 41.24 H new ATOM 1175 N GLY A 80 23.829 -89.282 -11.007 1.00 73.20 N ATOM 1176 CA GLY A 80 25.214 -88.837 -10.932 1.00 70.11 C ATOM 1177 C GLY A 80 25.711 -88.797 -9.498 1.00 45.11 C ATOM 1178 O GLY A 80 25.086 -89.387 -8.620 1.00 30.00 O ATOM 0 H GLY A 80 23.543 -89.901 -10.248 1.00 73.20 H new ATOM 0 HA2 GLY A 80 25.844 -89.506 -11.518 1.00 70.11 H new ATOM 0 HA3 GLY A 80 25.303 -87.846 -11.376 1.00 70.11 H new ATOM 1182 N PRO A 81 26.831 -88.107 -9.223 1.00 21.24 N ATOM 1183 CA PRO A 81 27.347 -87.967 -7.854 1.00 24.25 C ATOM 1184 C PRO A 81 26.348 -87.224 -6.969 1.00 43.11 C ATOM 1185 O PRO A 81 25.860 -86.153 -7.346 1.00 61.12 O ATOM 1186 CB PRO A 81 28.640 -87.152 -8.034 1.00 14.12 C ATOM 1187 CG PRO A 81 28.483 -86.468 -9.353 1.00 1.43 C ATOM 1188 CD PRO A 81 27.669 -87.400 -10.208 1.00 73.32 C ATOM 0 HA PRO A 81 27.519 -88.926 -7.365 1.00 24.25 H new ATOM 0 HB2 PRO A 81 28.767 -86.430 -7.227 1.00 14.12 H new ATOM 0 HB3 PRO A 81 29.518 -87.798 -8.026 1.00 14.12 H new ATOM 0 HG2 PRO A 81 27.982 -85.507 -9.237 1.00 1.43 H new ATOM 0 HG3 PRO A 81 29.454 -86.269 -9.807 1.00 1.43 H new ATOM 0 HD2 PRO A 81 27.066 -86.857 -10.935 1.00 73.32 H new ATOM 0 HD3 PRO A 81 28.301 -88.089 -10.769 1.00 73.32 H new ATOM 1196 N LYS A 82 26.053 -87.777 -5.791 1.00 34.24 N ATOM 1197 CA LYS A 82 25.000 -87.236 -4.931 1.00 65.22 C ATOM 1198 C LYS A 82 25.281 -85.781 -4.564 1.00 10.03 C ATOM 1199 O LYS A 82 24.377 -85.062 -4.160 1.00 13.55 O ATOM 1200 CB LYS A 82 24.790 -88.110 -3.673 1.00 54.13 C ATOM 1201 CG LYS A 82 25.883 -88.020 -2.599 1.00 14.43 C ATOM 1202 CD LYS A 82 25.653 -86.875 -1.606 1.00 71.14 C ATOM 1203 CE LYS A 82 24.266 -86.936 -0.966 1.00 51.01 C ATOM 1204 NZ LYS A 82 24.015 -88.222 -0.260 1.00 4.33 N ATOM 0 H LYS A 82 26.527 -88.597 -5.412 1.00 34.24 H new ATOM 0 HA LYS A 82 24.069 -87.258 -5.497 1.00 65.22 H new ATOM 0 HB2 LYS A 82 23.839 -87.834 -3.218 1.00 54.13 H new ATOM 0 HB3 LYS A 82 24.703 -89.150 -3.988 1.00 54.13 H new ATOM 0 HG2 LYS A 82 25.928 -88.963 -2.054 1.00 14.43 H new ATOM 0 HG3 LYS A 82 26.850 -87.885 -3.083 1.00 14.43 H new ATOM 0 HD2 LYS A 82 26.413 -86.915 -0.826 1.00 71.14 H new ATOM 0 HD3 LYS A 82 25.773 -85.921 -2.120 1.00 71.14 H new ATOM 0 HE2 LYS A 82 24.159 -86.112 -0.260 1.00 51.01 H new ATOM 0 HE3 LYS A 82 23.508 -86.796 -1.737 1.00 51.01 H new ATOM 0 HZ1 LYS A 82 23.104 -88.172 0.240 1.00 4.33 H new ATOM 0 HZ2 LYS A 82 23.988 -88.998 -0.952 1.00 4.33 H new ATOM 0 HZ3 LYS A 82 24.777 -88.396 0.426 1.00 4.33 H new ATOM 1218 N GLU A 83 26.537 -85.362 -4.694 1.00 45.34 N ATOM 1219 CA GLU A 83 26.903 -83.958 -4.487 1.00 53.14 C ATOM 1220 C GLU A 83 26.198 -83.073 -5.513 1.00 41.52 C ATOM 1221 O GLU A 83 25.534 -82.097 -5.167 1.00 1.31 O ATOM 1222 CB GLU A 83 28.419 -83.773 -4.617 1.00 53.44 C ATOM 1223 CG GLU A 83 29.236 -84.663 -3.695 1.00 34.25 C ATOM 1224 CD GLU A 83 30.728 -84.422 -3.843 1.00 42.22 C ATOM 1225 OE1 GLU A 83 31.251 -83.488 -3.199 1.00 25.22 O ATOM 1226 OE2 GLU A 83 31.381 -85.149 -4.621 1.00 53.32 O ATOM 0 H GLU A 83 27.318 -85.970 -4.941 1.00 45.34 H new ATOM 0 HA GLU A 83 26.592 -83.670 -3.483 1.00 53.14 H new ATOM 0 HB2 GLU A 83 28.711 -83.972 -5.648 1.00 53.44 H new ATOM 0 HB3 GLU A 83 28.666 -82.731 -4.411 1.00 53.44 H new ATOM 0 HG2 GLU A 83 28.941 -84.482 -2.662 1.00 34.25 H new ATOM 0 HG3 GLU A 83 29.015 -85.708 -3.911 1.00 34.25 H new ATOM 1233 N GLN A 84 26.347 -83.438 -6.780 1.00 71.32 N ATOM 1234 CA GLN A 84 25.773 -82.680 -7.883 1.00 73.41 C ATOM 1235 C GLN A 84 24.265 -82.911 -7.964 1.00 4.41 C ATOM 1236 O GLN A 84 23.507 -82.022 -8.357 1.00 35.12 O ATOM 1237 CB GLN A 84 26.473 -83.060 -9.197 1.00 70.43 C ATOM 1238 CG GLN A 84 27.781 -82.299 -9.451 1.00 43.51 C ATOM 1239 CD GLN A 84 28.593 -82.035 -8.189 1.00 53.33 C ATOM 1240 OE1 GLN A 84 28.440 -80.999 -7.543 1.00 64.14 O ATOM 1241 NE2 GLN A 84 29.461 -82.963 -7.831 1.00 5.13 N ATOM 0 H GLN A 84 26.868 -84.265 -7.071 1.00 71.32 H new ATOM 0 HA GLN A 84 25.932 -81.616 -7.708 1.00 73.41 H new ATOM 0 HB2 GLN A 84 26.683 -84.130 -9.189 1.00 70.43 H new ATOM 0 HB3 GLN A 84 25.791 -82.876 -10.027 1.00 70.43 H new ATOM 0 HG2 GLN A 84 28.391 -82.868 -10.152 1.00 43.51 H new ATOM 0 HG3 GLN A 84 27.550 -81.347 -9.929 1.00 43.51 H new ATOM 0 HE21 GLN A 84 29.562 -83.810 -8.390 1.00 5.13 H new ATOM 0 HE22 GLN A 84 30.031 -82.833 -6.995 1.00 5.13 H new ATOM 1250 N VAL A 85 23.837 -84.111 -7.587 1.00 33.13 N ATOM 1251 CA VAL A 85 22.414 -84.411 -7.465 1.00 22.34 C ATOM 1252 C VAL A 85 21.799 -83.502 -6.402 1.00 73.43 C ATOM 1253 O VAL A 85 20.745 -82.906 -6.616 1.00 53.31 O ATOM 1254 CB VAL A 85 22.176 -85.900 -7.097 1.00 44.11 C ATOM 1255 CG1 VAL A 85 20.689 -86.191 -6.894 1.00 71.00 C ATOM 1256 CG2 VAL A 85 22.769 -86.821 -8.167 1.00 25.24 C ATOM 0 H VAL A 85 24.454 -84.891 -7.361 1.00 33.13 H new ATOM 0 HA VAL A 85 21.938 -84.231 -8.429 1.00 22.34 H new ATOM 0 HB VAL A 85 22.684 -86.097 -6.153 1.00 44.11 H new ATOM 0 HG11 VAL A 85 20.556 -87.242 -6.637 1.00 71.00 H new ATOM 0 HG12 VAL A 85 20.303 -85.569 -6.087 1.00 71.00 H new ATOM 0 HG13 VAL A 85 20.146 -85.970 -7.813 1.00 71.00 H new ATOM 0 HG21 VAL A 85 22.592 -87.861 -7.891 1.00 25.24 H new ATOM 0 HG22 VAL A 85 22.296 -86.615 -9.127 1.00 25.24 H new ATOM 0 HG23 VAL A 85 23.842 -86.644 -8.245 1.00 25.24 H new ATOM 1266 N ASP A 86 22.503 -83.372 -5.275 1.00 15.30 N ATOM 1267 CA ASP A 86 22.078 -82.496 -4.181 1.00 63.23 C ATOM 1268 C ASP A 86 22.144 -81.035 -4.628 1.00 64.31 C ATOM 1269 O ASP A 86 21.353 -80.205 -4.182 1.00 72.04 O ATOM 1270 CB ASP A 86 22.952 -82.729 -2.936 1.00 35.40 C ATOM 1271 CG ASP A 86 22.497 -81.938 -1.712 1.00 14.31 C ATOM 1272 OD1 ASP A 86 21.274 -81.775 -1.508 1.00 61.35 O ATOM 1273 OD2 ASP A 86 23.364 -81.503 -0.919 1.00 32.10 O ATOM 0 H ASP A 86 23.377 -83.867 -5.096 1.00 15.30 H new ATOM 0 HA ASP A 86 21.047 -82.731 -3.918 1.00 63.23 H new ATOM 0 HB2 ASP A 86 22.948 -83.792 -2.693 1.00 35.40 H new ATOM 0 HB3 ASP A 86 23.982 -82.459 -3.170 1.00 35.40 H new ATOM 1278 N ALA A 87 23.084 -80.727 -5.524 1.00 21.34 N ATOM 1279 CA ALA A 87 23.157 -79.405 -6.146 1.00 34.53 C ATOM 1280 C ALA A 87 21.865 -79.112 -6.906 1.00 20.20 C ATOM 1281 O ALA A 87 21.286 -78.018 -6.803 1.00 62.15 O ATOM 1282 CB ALA A 87 24.356 -79.323 -7.086 1.00 10.13 C ATOM 0 H ALA A 87 23.806 -81.377 -5.835 1.00 21.34 H new ATOM 0 HA ALA A 87 23.282 -78.657 -5.363 1.00 34.53 H new ATOM 0 HB1 ALA A 87 24.395 -78.333 -7.540 1.00 10.13 H new ATOM 0 HB2 ALA A 87 25.272 -79.501 -6.523 1.00 10.13 H new ATOM 0 HB3 ALA A 87 24.258 -80.077 -7.867 1.00 10.13 H new ATOM 1288 N PHE A 88 21.415 -80.103 -7.671 1.00 23.24 N ATOM 1289 CA PHE A 88 20.163 -79.997 -8.406 1.00 53.22 C ATOM 1290 C PHE A 88 19.001 -79.895 -7.419 1.00 41.43 C ATOM 1291 O PHE A 88 18.018 -79.209 -7.677 1.00 24.23 O ATOM 1292 CB PHE A 88 19.979 -81.207 -9.337 1.00 13.44 C ATOM 1293 CG PHE A 88 18.975 -80.971 -10.437 1.00 60.45 C ATOM 1294 CD1 PHE A 88 19.366 -80.377 -11.628 1.00 2.04 C ATOM 1295 CD2 PHE A 88 17.646 -81.340 -10.283 1.00 41.43 C ATOM 1296 CE1 PHE A 88 18.454 -80.153 -12.641 1.00 65.45 C ATOM 1297 CE2 PHE A 88 16.730 -81.119 -11.293 1.00 43.45 C ATOM 1298 CZ PHE A 88 17.134 -80.525 -12.475 1.00 72.11 C ATOM 0 H PHE A 88 21.902 -80.990 -7.797 1.00 23.24 H new ATOM 0 HA PHE A 88 20.186 -79.099 -9.024 1.00 53.22 H new ATOM 0 HB2 PHE A 88 20.941 -81.463 -9.782 1.00 13.44 H new ATOM 0 HB3 PHE A 88 19.663 -82.066 -8.745 1.00 13.44 H new ATOM 0 HD1 PHE A 88 20.397 -80.086 -11.765 1.00 2.04 H new ATOM 0 HD2 PHE A 88 17.324 -81.805 -9.363 1.00 41.43 H new ATOM 0 HE1 PHE A 88 18.773 -79.687 -13.562 1.00 65.45 H new ATOM 0 HE2 PHE A 88 15.699 -81.410 -11.160 1.00 43.45 H new ATOM 0 HZ PHE A 88 16.419 -80.352 -13.266 1.00 72.11 H new ATOM 1308 N VAL A 89 19.132 -80.585 -6.284 1.00 5.13 N ATOM 1309 CA VAL A 89 18.156 -80.491 -5.195 1.00 63.22 C ATOM 1310 C VAL A 89 18.087 -79.062 -4.657 1.00 22.42 C ATOM 1311 O VAL A 89 17.001 -78.552 -4.368 1.00 63.11 O ATOM 1312 CB VAL A 89 18.481 -81.467 -4.027 1.00 62.24 C ATOM 1313 CG1 VAL A 89 17.552 -81.234 -2.836 1.00 41.30 C ATOM 1314 CG2 VAL A 89 18.394 -82.920 -4.491 1.00 71.34 C ATOM 0 H VAL A 89 19.909 -81.218 -6.094 1.00 5.13 H new ATOM 0 HA VAL A 89 17.190 -80.775 -5.613 1.00 63.22 H new ATOM 0 HB VAL A 89 19.503 -81.266 -3.705 1.00 62.24 H new ATOM 0 HG11 VAL A 89 17.804 -81.931 -2.036 1.00 41.30 H new ATOM 0 HG12 VAL A 89 17.670 -80.212 -2.477 1.00 41.30 H new ATOM 0 HG13 VAL A 89 16.519 -81.393 -3.144 1.00 41.30 H new ATOM 0 HG21 VAL A 89 18.625 -83.583 -3.657 1.00 71.34 H new ATOM 0 HG22 VAL A 89 17.386 -83.127 -4.851 1.00 71.34 H new ATOM 0 HG23 VAL A 89 19.108 -83.088 -5.297 1.00 71.34 H new ATOM 1324 N LYS A 90 19.245 -78.410 -4.527 1.00 72.24 N ATOM 1325 CA LYS A 90 19.282 -77.013 -4.095 1.00 63.21 C ATOM 1326 C LYS A 90 18.514 -76.164 -5.099 1.00 31.12 C ATOM 1327 O LYS A 90 17.635 -75.380 -4.730 1.00 14.12 O ATOM 1328 CB LYS A 90 20.722 -76.481 -3.976 1.00 12.24 C ATOM 1329 CG LYS A 90 21.671 -77.360 -3.165 1.00 73.32 C ATOM 1330 CD LYS A 90 21.044 -77.848 -1.862 1.00 40.24 C ATOM 1331 CE LYS A 90 22.054 -78.616 -1.018 1.00 1.53 C ATOM 1332 NZ LYS A 90 21.404 -79.437 0.038 1.00 60.33 N ATOM 0 H LYS A 90 20.159 -78.822 -4.713 1.00 72.24 H new ATOM 0 HA LYS A 90 18.825 -76.954 -3.107 1.00 63.21 H new ATOM 0 HB2 LYS A 90 21.132 -76.359 -4.979 1.00 12.24 H new ATOM 0 HB3 LYS A 90 20.691 -75.491 -3.522 1.00 12.24 H new ATOM 0 HG2 LYS A 90 21.968 -78.219 -3.766 1.00 73.32 H new ATOM 0 HG3 LYS A 90 22.578 -76.799 -2.940 1.00 73.32 H new ATOM 0 HD2 LYS A 90 20.666 -76.997 -1.296 1.00 40.24 H new ATOM 0 HD3 LYS A 90 20.190 -78.488 -2.084 1.00 40.24 H new ATOM 0 HE2 LYS A 90 22.646 -79.264 -1.665 1.00 1.53 H new ATOM 0 HE3 LYS A 90 22.745 -77.912 -0.553 1.00 1.53 H new ATOM 0 HZ1 LYS A 90 22.089 -79.634 0.796 1.00 60.33 H new ATOM 0 HZ2 LYS A 90 20.593 -78.918 0.431 1.00 60.33 H new ATOM 0 HZ3 LYS A 90 21.075 -80.334 -0.373 1.00 60.33 H new ATOM 1346 N TYR A 91 18.841 -76.359 -6.373 1.00 10.11 N ATOM 1347 CA TYR A 91 18.162 -75.676 -7.467 1.00 12.44 C ATOM 1348 C TYR A 91 16.666 -75.985 -7.448 1.00 44.40 C ATOM 1349 O TYR A 91 15.845 -75.138 -7.781 1.00 2.03 O ATOM 1350 CB TYR A 91 18.781 -76.105 -8.805 1.00 54.24 C ATOM 1351 CG TYR A 91 17.967 -75.712 -10.027 1.00 52.31 C ATOM 1352 CD1 TYR A 91 18.070 -74.443 -10.588 1.00 71.31 C ATOM 1353 CD2 TYR A 91 17.097 -76.621 -10.622 1.00 52.30 C ATOM 1354 CE1 TYR A 91 17.333 -74.094 -11.705 1.00 23.41 C ATOM 1355 CE2 TYR A 91 16.355 -76.277 -11.736 1.00 24.51 C ATOM 1356 CZ TYR A 91 16.476 -75.012 -12.275 1.00 4.44 C ATOM 1357 OH TYR A 91 15.749 -74.668 -13.396 1.00 53.33 O ATOM 0 H TYR A 91 19.581 -76.993 -6.674 1.00 10.11 H new ATOM 0 HA TYR A 91 18.287 -74.600 -7.344 1.00 12.44 H new ATOM 0 HB2 TYR A 91 19.775 -75.666 -8.889 1.00 54.24 H new ATOM 0 HB3 TYR A 91 18.910 -77.187 -8.802 1.00 54.24 H new ATOM 0 HD1 TYR A 91 18.737 -73.718 -10.144 1.00 71.31 H new ATOM 0 HD2 TYR A 91 17.000 -77.613 -10.206 1.00 52.30 H new ATOM 0 HE1 TYR A 91 17.428 -73.106 -12.130 1.00 23.41 H new ATOM 0 HE2 TYR A 91 15.683 -76.995 -12.183 1.00 24.51 H new ATOM 0 HH TYR A 91 16.250 -74.010 -13.922 1.00 53.33 H new ATOM 1367 N LEU A 92 16.323 -77.204 -7.055 1.00 51.34 N ATOM 1368 CA LEU A 92 14.936 -77.646 -7.031 1.00 60.14 C ATOM 1369 C LEU A 92 14.178 -76.944 -5.899 1.00 5.34 C ATOM 1370 O LEU A 92 13.031 -76.532 -6.066 1.00 21.55 O ATOM 1371 CB LEU A 92 14.870 -79.175 -6.855 1.00 42.10 C ATOM 1372 CG LEU A 92 13.782 -79.894 -7.670 1.00 14.12 C ATOM 1373 CD1 LEU A 92 12.412 -79.278 -7.430 1.00 1.11 C ATOM 1374 CD2 LEU A 92 14.128 -79.886 -9.158 1.00 4.50 C ATOM 0 H LEU A 92 16.992 -77.909 -6.746 1.00 51.34 H new ATOM 0 HA LEU A 92 14.465 -77.384 -7.979 1.00 60.14 H new ATOM 0 HB2 LEU A 92 15.838 -79.596 -7.126 1.00 42.10 H new ATOM 0 HB3 LEU A 92 14.711 -79.394 -5.799 1.00 42.10 H new ATOM 0 HG LEU A 92 13.743 -80.930 -7.332 1.00 14.12 H new ATOM 0 HD11 LEU A 92 11.666 -79.809 -8.021 1.00 1.11 H new ATOM 0 HD12 LEU A 92 12.159 -79.354 -6.372 1.00 1.11 H new ATOM 0 HD13 LEU A 92 12.428 -78.229 -7.725 1.00 1.11 H new ATOM 0 HD21 LEU A 92 13.345 -80.400 -9.716 1.00 4.50 H new ATOM 0 HD22 LEU A 92 14.207 -78.857 -9.508 1.00 4.50 H new ATOM 0 HD23 LEU A 92 15.079 -80.396 -9.313 1.00 4.50 H new ATOM 1386 N HIS A 93 14.834 -76.812 -4.748 1.00 5.42 N ATOM 1387 CA HIS A 93 14.232 -76.151 -3.587 1.00 23.34 C ATOM 1388 C HIS A 93 14.039 -74.659 -3.852 1.00 11.23 C ATOM 1389 O HIS A 93 13.125 -74.037 -3.313 1.00 14.15 O ATOM 1390 CB HIS A 93 15.091 -76.360 -2.328 1.00 35.40 C ATOM 1391 CG HIS A 93 14.958 -77.727 -1.720 1.00 30.45 C ATOM 1392 ND1 HIS A 93 14.971 -77.951 -0.359 1.00 2.31 N ATOM 1393 CD2 HIS A 93 14.802 -78.944 -2.295 1.00 73.34 C ATOM 1394 CE1 HIS A 93 14.833 -79.243 -0.125 1.00 65.23 C ATOM 1395 NE2 HIS A 93 14.726 -79.865 -1.282 1.00 2.30 N ATOM 0 H HIS A 93 15.783 -77.153 -4.592 1.00 5.42 H new ATOM 0 HA HIS A 93 13.255 -76.603 -3.416 1.00 23.34 H new ATOM 0 HB2 HIS A 93 16.137 -76.186 -2.581 1.00 35.40 H new ATOM 0 HB3 HIS A 93 14.814 -75.614 -1.583 1.00 35.40 H new ATOM 0 HD2 HIS A 93 14.748 -79.150 -3.354 1.00 73.34 H new ATOM 0 HE1 HIS A 93 14.811 -79.710 0.848 1.00 65.23 H new ATOM 0 HE2 HIS A 93 14.606 -80.870 -1.404 1.00 2.30 H new ATOM 1404 N LYS A 94 14.918 -74.094 -4.674 1.00 64.43 N ATOM 1405 CA LYS A 94 14.808 -72.697 -5.081 1.00 13.01 C ATOM 1406 C LYS A 94 13.877 -72.572 -6.290 1.00 4.10 C ATOM 1407 O LYS A 94 13.210 -71.551 -6.473 1.00 53.20 O ATOM 1408 CB LYS A 94 16.198 -72.135 -5.422 1.00 13.44 C ATOM 1409 CG LYS A 94 17.203 -72.221 -4.272 1.00 34.11 C ATOM 1410 CD LYS A 94 16.776 -71.388 -3.062 1.00 31.12 C ATOM 1411 CE LYS A 94 16.717 -69.900 -3.389 1.00 75.41 C ATOM 1412 NZ LYS A 94 16.295 -69.089 -2.217 1.00 1.31 N ATOM 0 H LYS A 94 15.718 -74.585 -5.073 1.00 64.43 H new ATOM 0 HA LYS A 94 14.389 -72.122 -4.255 1.00 13.01 H new ATOM 0 HB2 LYS A 94 16.597 -72.676 -6.280 1.00 13.44 H new ATOM 0 HB3 LYS A 94 16.093 -71.092 -5.722 1.00 13.44 H new ATOM 0 HG2 LYS A 94 17.318 -73.262 -3.971 1.00 34.11 H new ATOM 0 HG3 LYS A 94 18.178 -71.880 -4.619 1.00 34.11 H new ATOM 0 HD2 LYS A 94 15.798 -71.723 -2.717 1.00 31.12 H new ATOM 0 HD3 LYS A 94 17.476 -71.552 -2.243 1.00 31.12 H new ATOM 0 HE2 LYS A 94 17.697 -69.564 -3.728 1.00 75.41 H new ATOM 0 HE3 LYS A 94 16.021 -69.737 -4.212 1.00 75.41 H new ATOM 0 HZ1 LYS A 94 16.268 -68.084 -2.482 1.00 1.31 H new ATOM 0 HZ2 LYS A 94 15.349 -69.391 -1.908 1.00 1.31 H new ATOM 0 HZ3 LYS A 94 16.972 -69.224 -1.440 1.00 1.31 H new ATOM 1426 N GLY A 95 13.833 -73.634 -7.094 1.00 31.54 N ATOM 1427 CA GLY A 95 13.065 -73.628 -8.324 1.00 21.24 C ATOM 1428 C GLY A 95 13.511 -72.528 -9.264 1.00 10.52 C ATOM 1429 O GLY A 95 14.675 -72.120 -9.250 1.00 3.03 O ATOM 0 H GLY A 95 14.324 -74.509 -6.909 1.00 31.54 H new ATOM 0 HA2 GLY A 95 13.167 -74.593 -8.820 1.00 21.24 H new ATOM 0 HA3 GLY A 95 12.008 -73.500 -8.091 1.00 21.24 H new ATOM 1433 N SER A 96 12.601 -72.056 -10.100 1.00 75.45 N ATOM 1434 CA SER A 96 12.854 -70.884 -10.918 1.00 64.44 C ATOM 1435 C SER A 96 12.340 -69.645 -10.178 1.00 73.22 C ATOM 1436 O SER A 96 11.154 -69.562 -9.866 1.00 41.20 O ATOM 1437 CB SER A 96 12.179 -71.037 -12.286 1.00 73.31 C ATOM 1438 OG SER A 96 12.689 -72.175 -12.968 1.00 75.44 O ATOM 0 H SER A 96 11.677 -72.469 -10.229 1.00 75.45 H new ATOM 0 HA SER A 96 13.924 -70.773 -11.092 1.00 64.44 H new ATOM 0 HB2 SER A 96 11.101 -71.136 -12.157 1.00 73.31 H new ATOM 0 HB3 SER A 96 12.348 -70.141 -12.884 1.00 73.31 H new ATOM 0 HG SER A 96 13.654 -72.071 -13.101 1.00 75.44 H new ATOM 1444 N PRO A 97 13.226 -68.668 -9.889 1.00 15.32 N ATOM 1445 CA PRO A 97 12.900 -67.517 -9.023 1.00 63.34 C ATOM 1446 C PRO A 97 11.715 -66.691 -9.531 1.00 3.15 C ATOM 1447 O PRO A 97 11.155 -65.868 -8.797 1.00 13.01 O ATOM 1448 CB PRO A 97 14.191 -66.680 -9.029 1.00 53.52 C ATOM 1449 CG PRO A 97 14.947 -67.141 -10.230 1.00 13.42 C ATOM 1450 CD PRO A 97 14.614 -68.598 -10.384 1.00 51.42 C ATOM 0 HA PRO A 97 12.592 -67.844 -8.030 1.00 63.34 H new ATOM 0 HB2 PRO A 97 13.970 -65.614 -9.087 1.00 53.52 H new ATOM 0 HB3 PRO A 97 14.767 -66.836 -8.117 1.00 53.52 H new ATOM 0 HG2 PRO A 97 14.656 -66.577 -11.116 1.00 13.42 H new ATOM 0 HG3 PRO A 97 16.019 -66.996 -10.097 1.00 13.42 H new ATOM 0 HD2 PRO A 97 14.691 -68.923 -11.421 1.00 51.42 H new ATOM 0 HD3 PRO A 97 15.284 -69.230 -9.801 1.00 51.42 H new ATOM 1458 N LYS A 98 11.340 -66.912 -10.784 1.00 53.54 N ATOM 1459 CA LYS A 98 10.215 -66.207 -11.389 1.00 24.34 C ATOM 1460 C LYS A 98 8.884 -66.756 -10.870 1.00 74.31 C ATOM 1461 O LYS A 98 7.876 -66.045 -10.830 1.00 21.32 O ATOM 1462 CB LYS A 98 10.289 -66.332 -12.917 1.00 51.22 C ATOM 1463 CG LYS A 98 9.173 -65.594 -13.653 1.00 43.41 C ATOM 1464 CD LYS A 98 9.394 -65.584 -15.165 1.00 31.02 C ATOM 1465 CE LYS A 98 10.668 -64.833 -15.550 1.00 2.21 C ATOM 1466 NZ LYS A 98 10.657 -63.426 -15.062 1.00 75.23 N ATOM 0 H LYS A 98 11.801 -67.577 -11.405 1.00 53.54 H new ATOM 0 HA LYS A 98 10.272 -65.154 -11.113 1.00 24.34 H new ATOM 0 HB2 LYS A 98 11.251 -65.948 -13.257 1.00 51.22 H new ATOM 0 HB3 LYS A 98 10.253 -67.387 -13.188 1.00 51.22 H new ATOM 0 HG2 LYS A 98 8.217 -66.067 -13.429 1.00 43.41 H new ATOM 0 HG3 LYS A 98 9.114 -64.568 -13.288 1.00 43.41 H new ATOM 0 HD2 LYS A 98 9.453 -66.609 -15.530 1.00 31.02 H new ATOM 0 HD3 LYS A 98 8.537 -65.120 -15.654 1.00 31.02 H new ATOM 0 HE2 LYS A 98 11.533 -65.353 -15.138 1.00 2.21 H new ATOM 0 HE3 LYS A 98 10.779 -64.839 -16.634 1.00 2.21 H new ATOM 0 HZ1 LYS A 98 11.442 -62.901 -15.497 1.00 75.23 H new ATOM 0 HZ2 LYS A 98 9.755 -62.976 -15.320 1.00 75.23 H new ATOM 0 HZ3 LYS A 98 10.766 -63.416 -14.028 1.00 75.23 H new ATOM 1480 N SER A 99 8.893 -68.016 -10.454 1.00 22.33 N ATOM 1481 CA SER A 99 7.691 -68.684 -9.964 1.00 33.13 C ATOM 1482 C SER A 99 7.796 -68.960 -8.463 1.00 51.15 C ATOM 1483 O SER A 99 8.845 -68.744 -7.849 1.00 65.20 O ATOM 1484 CB SER A 99 7.484 -69.997 -10.731 1.00 24.15 C ATOM 1485 OG SER A 99 7.481 -69.772 -12.131 1.00 42.35 O ATOM 0 H SER A 99 9.728 -68.602 -10.446 1.00 22.33 H new ATOM 0 HA SER A 99 6.835 -68.030 -10.129 1.00 33.13 H new ATOM 0 HB2 SER A 99 8.275 -70.701 -10.474 1.00 24.15 H new ATOM 0 HB3 SER A 99 6.541 -70.453 -10.430 1.00 24.15 H new ATOM 0 HG SER A 99 7.349 -70.623 -12.599 1.00 42.35 H new ATOM 1491 N VAL A 100 6.695 -69.422 -7.874 1.00 74.22 N ATOM 1492 CA VAL A 100 6.667 -69.809 -6.467 1.00 45.42 C ATOM 1493 C VAL A 100 6.378 -71.305 -6.357 1.00 51.00 C ATOM 1494 O VAL A 100 5.289 -71.757 -6.715 1.00 74.34 O ATOM 1495 CB VAL A 100 5.592 -69.019 -5.676 1.00 21.34 C ATOM 1496 CG1 VAL A 100 5.593 -69.419 -4.199 1.00 13.01 C ATOM 1497 CG2 VAL A 100 5.800 -67.513 -5.835 1.00 20.43 C ATOM 0 H VAL A 100 5.803 -69.538 -8.356 1.00 74.22 H new ATOM 0 HA VAL A 100 7.641 -69.578 -6.036 1.00 45.42 H new ATOM 0 HB VAL A 100 4.615 -69.271 -6.089 1.00 21.34 H new ATOM 0 HG11 VAL A 100 4.830 -68.850 -3.667 1.00 13.01 H new ATOM 0 HG12 VAL A 100 5.379 -70.484 -4.110 1.00 13.01 H new ATOM 0 HG13 VAL A 100 6.571 -69.208 -3.766 1.00 13.01 H new ATOM 0 HG21 VAL A 100 5.035 -66.979 -5.272 1.00 20.43 H new ATOM 0 HG22 VAL A 100 6.785 -67.240 -5.458 1.00 20.43 H new ATOM 0 HG23 VAL A 100 5.728 -67.245 -6.889 1.00 20.43 H new ATOM 1507 N VAL A 101 7.362 -72.067 -5.892 1.00 73.33 N ATOM 1508 CA VAL A 101 7.214 -73.513 -5.739 1.00 33.12 C ATOM 1509 C VAL A 101 6.336 -73.843 -4.531 1.00 14.21 C ATOM 1510 O VAL A 101 6.442 -73.206 -3.481 1.00 71.23 O ATOM 1511 CB VAL A 101 8.589 -74.225 -5.600 1.00 1.53 C ATOM 1512 CG1 VAL A 101 9.406 -74.070 -6.880 1.00 0.11 C ATOM 1513 CG2 VAL A 101 9.369 -73.693 -4.397 1.00 23.20 C ATOM 0 H VAL A 101 8.275 -71.707 -5.613 1.00 73.33 H new ATOM 0 HA VAL A 101 6.733 -73.882 -6.645 1.00 33.12 H new ATOM 0 HB VAL A 101 8.401 -75.286 -5.435 1.00 1.53 H new ATOM 0 HG11 VAL A 101 10.365 -74.575 -6.763 1.00 0.11 H new ATOM 0 HG12 VAL A 101 8.862 -74.513 -7.715 1.00 0.11 H new ATOM 0 HG13 VAL A 101 9.575 -73.012 -7.078 1.00 0.11 H new ATOM 0 HG21 VAL A 101 10.326 -74.210 -4.326 1.00 23.20 H new ATOM 0 HG22 VAL A 101 9.542 -72.624 -4.520 1.00 23.20 H new ATOM 0 HG23 VAL A 101 8.795 -73.865 -3.486 1.00 23.20 H new ATOM 1523 N LYS A 102 5.461 -74.826 -4.697 1.00 25.24 N ATOM 1524 CA LYS A 102 4.554 -75.254 -3.637 1.00 22.23 C ATOM 1525 C LYS A 102 5.205 -76.345 -2.789 1.00 52.51 C ATOM 1526 O LYS A 102 5.370 -76.189 -1.577 1.00 64.20 O ATOM 1527 CB LYS A 102 3.237 -75.757 -4.250 1.00 14.41 C ATOM 1528 CG LYS A 102 2.292 -76.444 -3.262 1.00 2.24 C ATOM 1529 CD LYS A 102 1.835 -75.507 -2.142 1.00 35.55 C ATOM 1530 CE LYS A 102 0.889 -76.212 -1.173 1.00 34.44 C ATOM 1531 NZ LYS A 102 0.445 -75.319 -0.070 1.00 11.03 N ATOM 0 H LYS A 102 5.359 -75.349 -5.567 1.00 25.24 H new ATOM 0 HA LYS A 102 4.337 -74.404 -2.990 1.00 22.23 H new ATOM 0 HB2 LYS A 102 2.717 -74.912 -4.702 1.00 14.41 H new ATOM 0 HB3 LYS A 102 3.470 -76.455 -5.054 1.00 14.41 H new ATOM 0 HG2 LYS A 102 1.419 -76.817 -3.798 1.00 2.24 H new ATOM 0 HG3 LYS A 102 2.793 -77.309 -2.827 1.00 2.24 H new ATOM 0 HD2 LYS A 102 2.704 -75.137 -1.599 1.00 35.55 H new ATOM 0 HD3 LYS A 102 1.335 -74.639 -2.573 1.00 35.55 H new ATOM 0 HE2 LYS A 102 0.017 -76.574 -1.718 1.00 34.44 H new ATOM 0 HE3 LYS A 102 1.387 -77.085 -0.752 1.00 34.44 H new ATOM 0 HZ1 LYS A 102 -0.195 -75.840 0.562 1.00 11.03 H new ATOM 0 HZ2 LYS A 102 1.273 -74.993 0.468 1.00 11.03 H new ATOM 0 HZ3 LYS A 102 -0.054 -74.498 -0.468 1.00 11.03 H new ATOM 1545 N LYS A 103 5.596 -77.439 -3.439 1.00 12.03 N ATOM 1546 CA LYS A 103 6.176 -78.583 -2.740 1.00 72.44 C ATOM 1547 C LYS A 103 7.058 -79.395 -3.681 1.00 14.24 C ATOM 1548 O LYS A 103 6.727 -79.569 -4.856 1.00 53.50 O ATOM 1549 CB LYS A 103 5.068 -79.485 -2.170 1.00 61.22 C ATOM 1550 CG LYS A 103 5.594 -80.737 -1.469 1.00 3.35 C ATOM 1551 CD LYS A 103 4.469 -81.673 -1.037 1.00 22.31 C ATOM 1552 CE LYS A 103 3.520 -81.013 -0.043 1.00 15.43 C ATOM 1553 NZ LYS A 103 2.476 -81.954 0.436 1.00 35.52 N ATOM 0 H LYS A 103 5.522 -77.557 -4.449 1.00 12.03 H new ATOM 0 HA LYS A 103 6.785 -78.203 -1.920 1.00 72.44 H new ATOM 0 HB2 LYS A 103 4.470 -78.909 -1.464 1.00 61.22 H new ATOM 0 HB3 LYS A 103 4.404 -79.785 -2.980 1.00 61.22 H new ATOM 0 HG2 LYS A 103 6.270 -81.269 -2.139 1.00 3.35 H new ATOM 0 HG3 LYS A 103 6.176 -80.444 -0.595 1.00 3.35 H new ATOM 0 HD2 LYS A 103 3.908 -81.993 -1.915 1.00 22.31 H new ATOM 0 HD3 LYS A 103 4.897 -82.569 -0.588 1.00 22.31 H new ATOM 0 HE2 LYS A 103 4.089 -80.639 0.808 1.00 15.43 H new ATOM 0 HE3 LYS A 103 3.044 -80.152 -0.512 1.00 15.43 H new ATOM 0 HZ1 LYS A 103 1.852 -81.466 1.110 1.00 35.52 H new ATOM 0 HZ2 LYS A 103 1.916 -82.292 -0.373 1.00 35.52 H new ATOM 0 HZ3 LYS A 103 2.928 -82.764 0.907 1.00 35.52 H new ATOM 1567 N VAL A 104 8.177 -79.883 -3.154 1.00 20.25 N ATOM 1568 CA VAL A 104 9.081 -80.753 -3.896 1.00 63.52 C ATOM 1569 C VAL A 104 8.927 -82.198 -3.414 1.00 23.40 C ATOM 1570 O VAL A 104 8.718 -82.445 -2.223 1.00 41.12 O ATOM 1571 CB VAL A 104 10.559 -80.295 -3.747 1.00 12.25 C ATOM 1572 CG1 VAL A 104 10.986 -80.255 -2.279 1.00 24.45 C ATOM 1573 CG2 VAL A 104 11.493 -81.189 -4.566 1.00 13.11 C ATOM 0 H VAL A 104 8.482 -79.686 -2.201 1.00 20.25 H new ATOM 0 HA VAL A 104 8.817 -80.693 -4.952 1.00 63.52 H new ATOM 0 HB VAL A 104 10.632 -79.280 -4.138 1.00 12.25 H new ATOM 0 HG11 VAL A 104 12.024 -79.931 -2.211 1.00 24.45 H new ATOM 0 HG12 VAL A 104 10.351 -79.556 -1.734 1.00 24.45 H new ATOM 0 HG13 VAL A 104 10.887 -81.250 -1.844 1.00 24.45 H new ATOM 0 HG21 VAL A 104 12.521 -80.848 -4.445 1.00 13.11 H new ATOM 0 HG22 VAL A 104 11.409 -82.219 -4.218 1.00 13.11 H new ATOM 0 HG23 VAL A 104 11.215 -81.138 -5.619 1.00 13.11 H new ATOM 1583 N SER A 105 9.005 -83.143 -4.342 1.00 70.15 N ATOM 1584 CA SER A 105 8.860 -84.558 -4.027 1.00 14.10 C ATOM 1585 C SER A 105 9.902 -85.366 -4.795 1.00 74.04 C ATOM 1586 O SER A 105 10.019 -85.242 -6.015 1.00 24.02 O ATOM 1587 CB SER A 105 7.441 -85.029 -4.375 1.00 4.52 C ATOM 1588 OG SER A 105 6.470 -84.270 -3.667 1.00 72.03 O ATOM 0 H SER A 105 9.170 -82.951 -5.330 1.00 70.15 H new ATOM 0 HA SER A 105 9.020 -84.710 -2.960 1.00 14.10 H new ATOM 0 HB2 SER A 105 7.274 -84.932 -5.448 1.00 4.52 H new ATOM 0 HB3 SER A 105 7.333 -86.086 -4.130 1.00 4.52 H new ATOM 0 HG SER A 105 5.573 -84.585 -3.904 1.00 72.03 H new ATOM 1594 N ILE A 106 10.675 -86.168 -4.071 1.00 60.24 N ATOM 1595 CA ILE A 106 11.742 -86.966 -4.669 1.00 10.30 C ATOM 1596 C ILE A 106 11.435 -88.454 -4.488 1.00 61.14 C ATOM 1597 O ILE A 106 10.722 -88.831 -3.552 1.00 52.41 O ATOM 1598 CB ILE A 106 13.116 -86.635 -4.024 1.00 72.12 C ATOM 1599 CG1 ILE A 106 13.310 -85.110 -3.897 1.00 61.14 C ATOM 1600 CG2 ILE A 106 14.252 -87.243 -4.844 1.00 61.45 C ATOM 1601 CD1 ILE A 106 13.324 -84.374 -5.222 1.00 61.02 C ATOM 0 H ILE A 106 10.582 -86.284 -3.062 1.00 60.24 H new ATOM 0 HA ILE A 106 11.795 -86.726 -5.731 1.00 10.30 H new ATOM 0 HB ILE A 106 13.133 -87.069 -3.024 1.00 72.12 H new ATOM 0 HG12 ILE A 106 12.511 -84.704 -3.277 1.00 61.14 H new ATOM 0 HG13 ILE A 106 14.248 -84.916 -3.376 1.00 61.14 H new ATOM 0 HG21 ILE A 106 15.207 -87.001 -4.378 1.00 61.45 H new ATOM 0 HG22 ILE A 106 14.132 -88.326 -4.885 1.00 61.45 H new ATOM 0 HG23 ILE A 106 14.229 -86.837 -5.855 1.00 61.45 H new ATOM 0 HD11 ILE A 106 13.465 -83.308 -5.044 1.00 61.02 H new ATOM 0 HD12 ILE A 106 14.140 -84.750 -5.839 1.00 61.02 H new ATOM 0 HD13 ILE A 106 12.377 -84.534 -5.737 1.00 61.02 H new ATOM 1613 N HIS A 107 11.960 -89.296 -5.374 1.00 62.33 N ATOM 1614 CA HIS A 107 11.706 -90.735 -5.312 1.00 42.21 C ATOM 1615 C HIS A 107 13.008 -91.522 -5.486 1.00 3.14 C ATOM 1616 O HIS A 107 13.899 -91.118 -6.230 1.00 44.31 O ATOM 1617 CB HIS A 107 10.675 -91.142 -6.379 1.00 1.15 C ATOM 1618 CG HIS A 107 10.011 -92.468 -6.128 1.00 52.33 C ATOM 1619 ND1 HIS A 107 8.866 -92.599 -5.376 1.00 63.51 N ATOM 1620 CD2 HIS A 107 10.328 -93.717 -6.543 1.00 51.43 C ATOM 1621 CE1 HIS A 107 8.507 -93.868 -5.338 1.00 61.40 C ATOM 1622 NE2 HIS A 107 9.376 -94.571 -6.041 1.00 21.31 N ATOM 0 H HIS A 107 12.564 -89.008 -6.144 1.00 62.33 H new ATOM 0 HA HIS A 107 11.297 -90.972 -4.330 1.00 42.21 H new ATOM 0 HB2 HIS A 107 9.907 -90.370 -6.438 1.00 1.15 H new ATOM 0 HB3 HIS A 107 11.169 -91.175 -7.350 1.00 1.15 H new ATOM 0 HD2 HIS A 107 11.174 -93.992 -7.156 1.00 51.43 H new ATOM 0 HE1 HIS A 107 7.647 -94.265 -4.819 1.00 61.40 H new ATOM 0 HE2 HIS A 107 9.346 -95.580 -6.187 1.00 21.31 H new ATOM 1631 N ALA A 108 13.069 -92.669 -4.816 1.00 62.21 N ATOM 1632 CA ALA A 108 14.275 -93.500 -4.695 1.00 71.54 C ATOM 1633 C ALA A 108 14.714 -94.184 -6.002 1.00 51.20 C ATOM 1634 O ALA A 108 15.633 -95.005 -5.979 1.00 13.21 O ATOM 1635 CB ALA A 108 14.070 -94.544 -3.599 1.00 1.01 C ATOM 0 H ALA A 108 12.264 -93.061 -4.328 1.00 62.21 H new ATOM 0 HA ALA A 108 15.086 -92.819 -4.436 1.00 71.54 H new ATOM 0 HB1 ALA A 108 14.965 -95.159 -3.511 1.00 1.01 H new ATOM 0 HB2 ALA A 108 13.879 -94.043 -2.650 1.00 1.01 H new ATOM 0 HB3 ALA A 108 13.219 -95.176 -3.853 1.00 1.01 H new ATOM 1641 N SER A 109 14.070 -93.872 -7.124 1.00 22.12 N ATOM 1642 CA SER A 109 14.242 -94.665 -8.346 1.00 13.31 C ATOM 1643 C SER A 109 15.704 -94.676 -8.814 1.00 70.35 C ATOM 1644 O SER A 109 16.344 -93.633 -8.939 1.00 20.01 O ATOM 1645 CB SER A 109 13.357 -94.088 -9.457 1.00 75.32 C ATOM 1646 OG SER A 109 11.988 -94.090 -9.076 1.00 74.32 O ATOM 0 H SER A 109 13.429 -93.084 -7.216 1.00 22.12 H new ATOM 0 HA SER A 109 13.951 -95.692 -8.124 1.00 13.31 H new ATOM 0 HB2 SER A 109 13.672 -93.070 -9.685 1.00 75.32 H new ATOM 0 HB3 SER A 109 13.485 -94.673 -10.368 1.00 75.32 H new ATOM 0 HG SER A 109 11.446 -93.715 -9.802 1.00 74.32 H new ATOM 1652 N SER A 110 16.207 -95.887 -9.076 1.00 53.15 N ATOM 1653 CA SER A 110 17.604 -96.115 -9.438 1.00 44.34 C ATOM 1654 C SER A 110 17.879 -95.758 -10.904 1.00 21.33 C ATOM 1655 O SER A 110 16.964 -95.369 -11.636 1.00 40.12 O ATOM 1656 CB SER A 110 17.958 -97.582 -9.178 1.00 20.12 C ATOM 1657 OG SER A 110 17.575 -97.971 -7.867 1.00 61.20 O ATOM 0 H SER A 110 15.650 -96.741 -9.042 1.00 53.15 H new ATOM 0 HA SER A 110 18.227 -95.465 -8.823 1.00 44.34 H new ATOM 0 HB2 SER A 110 17.458 -98.216 -9.910 1.00 20.12 H new ATOM 0 HB3 SER A 110 19.030 -97.730 -9.307 1.00 20.12 H new ATOM 0 HG SER A 110 17.809 -98.912 -7.723 1.00 61.20 H new ATOM 1663 N ARG A 111 19.148 -95.908 -11.306 1.00 10.21 N ATOM 1664 CA ARG A 111 19.623 -95.546 -12.647 1.00 70.34 C ATOM 1665 C ARG A 111 18.651 -95.974 -13.746 1.00 33.55 C ATOM 1666 O ARG A 111 18.208 -97.125 -13.797 1.00 43.23 O ATOM 1667 CB ARG A 111 21.017 -96.154 -12.901 1.00 25.13 C ATOM 1668 CG ARG A 111 21.445 -96.147 -14.371 1.00 15.51 C ATOM 1669 CD ARG A 111 22.883 -96.634 -14.566 1.00 32.52 C ATOM 1670 NE ARG A 111 23.862 -95.555 -14.396 1.00 21.10 N ATOM 1671 CZ ARG A 111 25.130 -95.736 -14.012 1.00 63.31 C ATOM 1672 NH1 ARG A 111 25.554 -96.938 -13.637 1.00 42.52 N ATOM 1673 NH2 ARG A 111 25.965 -94.705 -13.999 1.00 12.12 N ATOM 0 H ARG A 111 19.879 -96.287 -10.704 1.00 10.21 H new ATOM 0 HA ARG A 111 19.689 -94.459 -12.682 1.00 70.34 H new ATOM 0 HB2 ARG A 111 21.754 -95.603 -12.317 1.00 25.13 H new ATOM 0 HB3 ARG A 111 21.025 -97.181 -12.536 1.00 25.13 H new ATOM 0 HG2 ARG A 111 20.769 -96.781 -14.946 1.00 15.51 H new ATOM 0 HG3 ARG A 111 21.350 -95.137 -14.769 1.00 15.51 H new ATOM 0 HD2 ARG A 111 23.095 -97.430 -13.852 1.00 32.52 H new ATOM 0 HD3 ARG A 111 22.987 -97.063 -15.563 1.00 32.52 H new ATOM 0 HE ARG A 111 23.554 -94.601 -14.584 1.00 21.10 H new ATOM 0 HH11 ARG A 111 24.911 -97.730 -13.641 1.00 42.52 H new ATOM 0 HH12 ARG A 111 26.523 -97.069 -13.345 1.00 42.52 H new ATOM 0 HH21 ARG A 111 25.638 -93.781 -14.281 1.00 12.12 H new ATOM 0 HH22 ARG A 111 26.933 -94.837 -13.707 1.00 12.12 H new ATOM 1687 N VAL A 112 18.319 -95.020 -14.611 1.00 42.33 N ATOM 1688 CA VAL A 112 17.458 -95.250 -15.766 1.00 22.53 C ATOM 1689 C VAL A 112 18.138 -94.728 -17.030 1.00 21.24 C ATOM 1690 O VAL A 112 19.235 -94.163 -16.963 1.00 51.15 O ATOM 1691 CB VAL A 112 16.085 -94.547 -15.603 1.00 42.34 C ATOM 1692 CG1 VAL A 112 15.309 -95.127 -14.422 1.00 12.25 C ATOM 1693 CG2 VAL A 112 16.276 -93.041 -15.442 1.00 12.43 C ATOM 0 H VAL A 112 18.643 -94.056 -14.529 1.00 42.33 H new ATOM 0 HA VAL A 112 17.289 -96.324 -15.844 1.00 22.53 H new ATOM 0 HB VAL A 112 15.499 -94.726 -16.505 1.00 42.34 H new ATOM 0 HG11 VAL A 112 14.350 -94.616 -14.330 1.00 12.25 H new ATOM 0 HG12 VAL A 112 15.139 -96.191 -14.586 1.00 12.25 H new ATOM 0 HG13 VAL A 112 15.883 -94.988 -13.506 1.00 12.25 H new ATOM 0 HG21 VAL A 112 15.304 -92.561 -15.329 1.00 12.43 H new ATOM 0 HG22 VAL A 112 16.883 -92.844 -14.559 1.00 12.43 H new ATOM 0 HG23 VAL A 112 16.777 -92.642 -16.324 1.00 12.43 H new ATOM 1703 N ASP A 113 17.502 -94.945 -18.177 1.00 71.41 N ATOM 1704 CA ASP A 113 18.000 -94.423 -19.448 1.00 61.45 C ATOM 1705 C ASP A 113 17.707 -92.926 -19.563 1.00 54.52 C ATOM 1706 O ASP A 113 16.551 -92.506 -19.486 1.00 71.24 O ATOM 1707 CB ASP A 113 17.359 -95.183 -20.617 1.00 13.55 C ATOM 1708 CG ASP A 113 17.763 -94.623 -21.975 1.00 74.32 C ATOM 1709 OD1 ASP A 113 18.942 -94.766 -22.355 1.00 52.52 O ATOM 1710 OD2 ASP A 113 16.901 -94.040 -22.666 1.00 41.05 O ATOM 0 H ASP A 113 16.637 -95.481 -18.254 1.00 71.41 H new ATOM 0 HA ASP A 113 19.080 -94.566 -19.485 1.00 61.45 H new ATOM 0 HB2 ASP A 113 17.645 -96.233 -20.562 1.00 13.55 H new ATOM 0 HB3 ASP A 113 16.274 -95.142 -20.520 1.00 13.55 H new ATOM 1715 N ALA A 114 18.764 -92.132 -19.722 1.00 61.52 N ATOM 1716 CA ALA A 114 18.645 -90.678 -19.815 1.00 14.04 C ATOM 1717 C ALA A 114 18.038 -90.250 -21.153 1.00 42.21 C ATOM 1718 O ALA A 114 18.158 -90.959 -22.155 1.00 32.43 O ATOM 1719 CB ALA A 114 20.013 -90.034 -19.619 1.00 51.25 C ATOM 0 H ALA A 114 19.722 -92.476 -19.790 1.00 61.52 H new ATOM 0 HA ALA A 114 17.972 -90.340 -19.027 1.00 14.04 H new ATOM 0 HB1 ALA A 114 19.918 -88.950 -19.689 1.00 51.25 H new ATOM 0 HB2 ALA A 114 20.404 -90.301 -18.637 1.00 51.25 H new ATOM 0 HB3 ALA A 114 20.696 -90.389 -20.390 1.00 51.25 H new ATOM 1725 N ASP A 115 17.406 -89.077 -21.170 1.00 54.31 N ATOM 1726 CA ASP A 115 16.740 -88.563 -22.374 1.00 31.20 C ATOM 1727 C ASP A 115 17.094 -87.096 -22.612 1.00 74.33 C ATOM 1728 O ASP A 115 17.458 -86.707 -23.724 1.00 33.11 O ATOM 1729 CB ASP A 115 15.216 -88.721 -22.254 1.00 63.02 C ATOM 1730 CG ASP A 115 14.471 -88.174 -23.465 1.00 34.15 C ATOM 1731 OD1 ASP A 115 14.505 -88.823 -24.532 1.00 71.54 O ATOM 1732 OD2 ASP A 115 13.827 -87.105 -23.354 1.00 60.54 O ATOM 0 H ASP A 115 17.339 -88.459 -20.361 1.00 54.31 H new ATOM 0 HA ASP A 115 17.092 -89.145 -23.226 1.00 31.20 H new ATOM 0 HB2 ASP A 115 14.973 -89.776 -22.129 1.00 63.02 H new ATOM 0 HB3 ASP A 115 14.871 -88.206 -21.357 1.00 63.02 H new ATOM 1737 N GLY A 116 16.991 -86.283 -21.563 1.00 25.12 N ATOM 1738 CA GLY A 116 17.293 -84.865 -21.684 1.00 51.02 C ATOM 1739 C GLY A 116 16.452 -83.999 -20.758 1.00 52.42 C ATOM 1740 O GLY A 116 15.293 -84.314 -20.467 1.00 24.24 O ATOM 0 H GLY A 116 16.704 -86.581 -20.631 1.00 25.12 H new ATOM 0 HA2 GLY A 116 18.348 -84.704 -21.465 1.00 51.02 H new ATOM 0 HA3 GLY A 116 17.130 -84.551 -22.715 1.00 51.02 H new ATOM 1744 N PHE A 117 17.041 -82.910 -20.281 1.00 5.24 N ATOM 1745 CA PHE A 117 16.343 -81.975 -19.407 1.00 2.31 C ATOM 1746 C PHE A 117 15.751 -80.836 -20.234 1.00 32.41 C ATOM 1747 O PHE A 117 16.493 -80.019 -20.785 1.00 0.02 O ATOM 1748 CB PHE A 117 17.317 -81.396 -18.364 1.00 64.33 C ATOM 1749 CG PHE A 117 17.968 -82.428 -17.470 1.00 64.31 C ATOM 1750 CD1 PHE A 117 18.904 -83.320 -17.978 1.00 52.42 C ATOM 1751 CD2 PHE A 117 17.646 -82.504 -16.122 1.00 54.12 C ATOM 1752 CE1 PHE A 117 19.500 -84.260 -17.160 1.00 24.34 C ATOM 1753 CE2 PHE A 117 18.241 -83.441 -15.302 1.00 3.23 C ATOM 1754 CZ PHE A 117 19.168 -84.321 -15.820 1.00 43.44 C ATOM 0 H PHE A 117 18.006 -82.651 -20.486 1.00 5.24 H new ATOM 0 HA PHE A 117 15.542 -82.507 -18.894 1.00 2.31 H new ATOM 0 HB2 PHE A 117 18.098 -80.841 -18.884 1.00 64.33 H new ATOM 0 HB3 PHE A 117 16.779 -80.682 -17.741 1.00 64.33 H new ATOM 0 HD1 PHE A 117 19.169 -83.278 -19.024 1.00 52.42 H new ATOM 0 HD2 PHE A 117 16.919 -81.820 -15.709 1.00 54.12 H new ATOM 0 HE1 PHE A 117 20.226 -84.948 -17.568 1.00 24.34 H new ATOM 0 HE2 PHE A 117 17.981 -83.485 -14.255 1.00 3.23 H new ATOM 0 HZ PHE A 117 19.633 -85.056 -15.180 1.00 43.44 H new ATOM 1764 N GLU A 118 14.422 -80.772 -20.315 1.00 33.04 N ATOM 1765 CA GLU A 118 13.759 -79.676 -21.011 1.00 23.02 C ATOM 1766 C GLU A 118 12.299 -79.602 -20.602 1.00 63.02 C ATOM 1767 O GLU A 118 11.592 -80.608 -20.590 1.00 13.12 O ATOM 1768 CB GLU A 118 13.886 -79.815 -22.536 1.00 70.42 C ATOM 1769 CG GLU A 118 13.213 -81.050 -23.128 1.00 51.04 C ATOM 1770 CD GLU A 118 13.178 -81.019 -24.649 1.00 53.34 C ATOM 1771 OE1 GLU A 118 14.221 -81.290 -25.276 1.00 62.15 O ATOM 1772 OE2 GLU A 118 12.109 -80.715 -25.224 1.00 71.34 O ATOM 0 H GLU A 118 13.790 -81.462 -19.910 1.00 33.04 H new ATOM 0 HA GLU A 118 14.255 -78.749 -20.724 1.00 23.02 H new ATOM 0 HB2 GLU A 118 13.459 -78.928 -23.004 1.00 70.42 H new ATOM 0 HB3 GLU A 118 14.944 -79.836 -22.797 1.00 70.42 H new ATOM 0 HG2 GLU A 118 13.744 -81.943 -22.798 1.00 51.04 H new ATOM 0 HG3 GLU A 118 12.195 -81.124 -22.745 1.00 51.04 H new ATOM 1779 N ILE A 119 11.847 -78.408 -20.260 1.00 14.51 N ATOM 1780 CA ILE A 119 10.485 -78.225 -19.794 1.00 51.30 C ATOM 1781 C ILE A 119 9.505 -78.478 -20.936 1.00 62.21 C ATOM 1782 O ILE A 119 9.125 -77.563 -21.671 1.00 44.42 O ATOM 1783 CB ILE A 119 10.274 -76.812 -19.195 1.00 2.53 C ATOM 1784 CG1 ILE A 119 11.421 -76.475 -18.227 1.00 24.02 C ATOM 1785 CG2 ILE A 119 8.928 -76.725 -18.476 1.00 53.12 C ATOM 1786 CD1 ILE A 119 11.626 -77.514 -17.142 1.00 71.13 C ATOM 0 H ILE A 119 12.402 -77.553 -20.296 1.00 14.51 H new ATOM 0 HA ILE A 119 10.299 -78.947 -18.999 1.00 51.30 H new ATOM 0 HB ILE A 119 10.273 -76.086 -20.008 1.00 2.53 H new ATOM 0 HG12 ILE A 119 12.345 -76.368 -18.795 1.00 24.02 H new ATOM 0 HG13 ILE A 119 11.220 -75.510 -17.761 1.00 24.02 H new ATOM 0 HG21 ILE A 119 8.800 -75.724 -18.063 1.00 53.12 H new ATOM 0 HG22 ILE A 119 8.124 -76.931 -19.183 1.00 53.12 H new ATOM 0 HG23 ILE A 119 8.899 -77.457 -17.669 1.00 53.12 H new ATOM 0 HD11 ILE A 119 12.451 -77.209 -16.498 1.00 71.13 H new ATOM 0 HD12 ILE A 119 10.716 -77.605 -16.549 1.00 71.13 H new ATOM 0 HD13 ILE A 119 11.859 -78.476 -17.599 1.00 71.13 H new ATOM 1798 N ARG A 120 9.152 -79.747 -21.101 1.00 2.03 N ATOM 1799 CA ARG A 120 8.200 -80.172 -22.114 1.00 61.44 C ATOM 1800 C ARG A 120 6.780 -79.955 -21.630 1.00 32.31 C ATOM 1801 O ARG A 120 6.462 -80.225 -20.471 1.00 1.25 O ATOM 1802 CB ARG A 120 8.422 -81.647 -22.466 1.00 4.12 C ATOM 1803 CG ARG A 120 9.551 -81.866 -23.453 1.00 2.23 C ATOM 1804 CD ARG A 120 9.828 -83.353 -23.676 1.00 30.01 C ATOM 1805 NE ARG A 120 11.069 -83.585 -24.425 1.00 3.51 N ATOM 1806 CZ ARG A 120 11.959 -84.536 -24.118 1.00 12.41 C ATOM 1807 NH1 ARG A 120 11.767 -85.312 -23.058 1.00 3.32 N ATOM 1808 NH2 ARG A 120 13.047 -84.708 -24.858 1.00 2.32 N ATOM 0 H ARG A 120 9.520 -80.510 -20.534 1.00 2.03 H new ATOM 0 HA ARG A 120 8.356 -79.572 -23.010 1.00 61.44 H new ATOM 0 HB2 ARG A 120 8.634 -82.203 -21.553 1.00 4.12 H new ATOM 0 HB3 ARG A 120 7.501 -82.056 -22.882 1.00 4.12 H new ATOM 0 HG2 ARG A 120 9.299 -81.396 -24.404 1.00 2.23 H new ATOM 0 HG3 ARG A 120 10.454 -81.379 -23.086 1.00 2.23 H new ATOM 0 HD2 ARG A 120 9.889 -83.857 -22.711 1.00 30.01 H new ATOM 0 HD3 ARG A 120 8.992 -83.798 -24.216 1.00 30.01 H new ATOM 0 HE ARG A 120 11.265 -82.986 -25.227 1.00 3.51 H new ATOM 0 HH11 ARG A 120 10.940 -85.184 -22.475 1.00 3.32 H new ATOM 0 HH12 ARG A 120 12.447 -86.036 -22.826 1.00 3.32 H new ATOM 0 HH21 ARG A 120 13.211 -84.112 -25.670 1.00 2.32 H new ATOM 0 HH22 ARG A 120 13.719 -85.436 -24.615 1.00 2.32 H new ATOM 1822 N ARG A 121 5.937 -79.467 -22.525 1.00 14.01 N ATOM 1823 CA ARG A 121 4.545 -79.160 -22.200 1.00 75.33 C ATOM 1824 C ARG A 121 3.654 -79.522 -23.385 1.00 64.21 C ATOM 1825 O ARG A 121 3.658 -78.771 -24.384 1.00 51.44 O ATOM 1826 CB ARG A 121 4.365 -77.673 -21.840 1.00 72.42 C ATOM 1827 CG ARG A 121 5.240 -77.190 -20.684 1.00 14.51 C ATOM 1828 CD ARG A 121 4.806 -75.820 -20.177 1.00 12.45 C ATOM 1829 NE ARG A 121 3.506 -75.881 -19.498 1.00 4.53 N ATOM 1830 CZ ARG A 121 2.400 -75.253 -19.916 1.00 42.14 C ATOM 1831 NH1 ARG A 121 2.420 -74.521 -21.024 1.00 1.44 N ATOM 1832 NH2 ARG A 121 1.273 -75.362 -19.225 1.00 65.01 N ATOM 1833 OXT ARG A 121 2.979 -80.570 -23.335 1.00 0.00 O ATOM 0 H ARG A 121 6.192 -79.272 -23.493 1.00 14.01 H new ATOM 0 HA ARG A 121 4.259 -79.750 -21.329 1.00 75.33 H new ATOM 0 HB2 ARG A 121 4.584 -77.070 -22.721 1.00 72.42 H new ATOM 0 HB3 ARG A 121 3.320 -77.498 -21.586 1.00 72.42 H new ATOM 0 HG2 ARG A 121 5.193 -77.911 -19.868 1.00 14.51 H new ATOM 0 HG3 ARG A 121 6.279 -77.144 -21.010 1.00 14.51 H new ATOM 0 HD2 ARG A 121 5.558 -75.431 -19.490 1.00 12.45 H new ATOM 0 HD3 ARG A 121 4.748 -75.124 -21.014 1.00 12.45 H new ATOM 0 HE ARG A 121 3.441 -76.441 -18.648 1.00 4.53 H new ATOM 0 HH11 ARG A 121 3.282 -74.434 -21.563 1.00 1.44 H new ATOM 0 HH12 ARG A 121 1.573 -74.045 -21.336 1.00 1.44 H new ATOM 0 HH21 ARG A 121 1.249 -75.925 -18.375 1.00 65.01 H new ATOM 0 HH22 ARG A 121 0.431 -74.883 -19.544 1.00 65.01 H new