USER MOD reduce.3.24.130724 H: found=0, std=0, add=663, rem=0, adj=21 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 180:sc= -7.24! USER MOD Set 1.2: A 109 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 96 SER OG : rot 180:sc= 0.134 USER MOD Set 2.2: A 99 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 69 ASN : amide:sc= 1.06 K(o=2.5,f=0.41!) USER MOD Set 3.2: A 73 SER OG : rot 77:sc= 0.798 USER MOD Set 3.3: A 75 SER OG : rot 158:sc= 0.673 USER MOD Set 4.1: A 53 THR OG1 : rot -9:sc= 0.736 USER MOD Set 4.2: A 91 TYR OH : rot -99:sc= 2.31 USER MOD Set 5.1: A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 90:sc= -0.703 USER MOD Single : A 35 THR OG1 : rot 120:sc= -0.0784 USER MOD Single : A 38 TYR OH : rot 180:sc= -0.349 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.0462 USER MOD Single : A 54 LYS NZ :NH3+ -179:sc= 0.0887 (180deg=0.0807) 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 160:sc= -2.15! USER MOD Single : A 68 ASN : amide:sc= -0.156 K(o=-0.16,f=-2.5!) USER MOD Single : A 79 GLN : amide:sc= -0.103 K(o=-0.1,f=-3.3!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -1.47 K(o=-1.5,f=-2.8) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 HIS :FLIP no HE2:sc= 0.13 F(o=-0.53,f=0.13) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 168:sc= -0.0212 (180deg=-0.219) 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 107 HIS : no HD1:sc=-0.00451 X(o=-0.0045,f=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0.0361 USER MOD ----------------------------------------------------------------- ATOM 450 N VAL A 33 26.029 -94.907 -8.822 1.00 64.33 N ATOM 451 CA VAL A 33 25.452 -93.690 -9.374 1.00 3.41 C ATOM 452 C VAL A 33 24.189 -93.324 -8.604 1.00 52.31 C ATOM 453 O VAL A 33 23.316 -94.164 -8.387 1.00 55.05 O ATOM 454 CB VAL A 33 25.132 -93.837 -10.888 1.00 32.24 C ATOM 455 CG1 VAL A 33 24.203 -95.023 -11.144 1.00 21.34 C ATOM 456 CG2 VAL A 33 24.538 -92.542 -11.449 1.00 54.35 C ATOM 0 HA VAL A 33 26.189 -92.893 -9.271 1.00 3.41 H new ATOM 0 HB VAL A 33 26.069 -94.032 -11.410 1.00 32.24 H new ATOM 0 HG11 VAL A 33 23.997 -95.100 -12.212 1.00 21.34 H new ATOM 0 HG12 VAL A 33 24.680 -95.940 -10.799 1.00 21.34 H new ATOM 0 HG13 VAL A 33 23.268 -94.876 -10.604 1.00 21.34 H new ATOM 0 HG21 VAL A 33 24.323 -92.670 -12.510 1.00 54.35 H new ATOM 0 HG22 VAL A 33 23.616 -92.304 -10.918 1.00 54.35 H new ATOM 0 HG23 VAL A 33 25.252 -91.728 -11.319 1.00 54.35 H new ATOM 466 N THR A 34 24.111 -92.075 -8.171 1.00 32.15 N ATOM 467 CA THR A 34 22.970 -91.596 -7.414 1.00 71.11 C ATOM 468 C THR A 34 21.868 -91.129 -8.368 1.00 2.24 C ATOM 469 O THR A 34 22.030 -90.139 -9.083 1.00 60.35 O ATOM 470 CB THR A 34 23.395 -90.443 -6.475 1.00 3.00 C ATOM 471 OG1 THR A 34 24.542 -90.841 -5.706 1.00 50.55 O ATOM 472 CG2 THR A 34 22.269 -90.047 -5.528 1.00 1.10 C ATOM 0 H THR A 34 24.832 -91.372 -8.334 1.00 32.15 H new ATOM 0 HA THR A 34 22.583 -92.413 -6.804 1.00 71.11 H new ATOM 0 HB THR A 34 23.639 -89.581 -7.096 1.00 3.00 H new ATOM 0 HG1 THR A 34 25.360 -90.602 -6.190 1.00 50.55 H new ATOM 0 HG21 THR A 34 22.604 -89.234 -4.884 1.00 1.10 H new ATOM 0 HG22 THR A 34 21.406 -89.719 -6.107 1.00 1.10 H new ATOM 0 HG23 THR A 34 21.990 -90.904 -4.915 1.00 1.10 H new ATOM 480 N THR A 35 20.770 -91.876 -8.404 1.00 71.32 N ATOM 481 CA THR A 35 19.640 -91.550 -9.264 1.00 44.34 C ATOM 482 C THR A 35 18.383 -91.303 -8.435 1.00 64.43 C ATOM 483 O THR A 35 17.995 -92.142 -7.619 1.00 74.11 O ATOM 484 CB THR A 35 19.375 -92.679 -10.286 1.00 51.43 C ATOM 485 OG1 THR A 35 20.549 -92.889 -11.088 1.00 13.30 O ATOM 486 CG2 THR A 35 18.182 -92.352 -11.187 1.00 62.32 C ATOM 0 H THR A 35 20.639 -92.718 -7.843 1.00 71.32 H new ATOM 0 HA THR A 35 19.892 -90.639 -9.807 1.00 44.34 H new ATOM 0 HB THR A 35 19.137 -93.588 -9.733 1.00 51.43 H new ATOM 0 HG1 THR A 35 20.863 -93.810 -10.974 1.00 13.30 H new ATOM 0 HG21 THR A 35 18.025 -93.168 -11.893 1.00 62.32 H new ATOM 0 HG22 THR A 35 17.289 -92.224 -10.576 1.00 62.32 H new ATOM 0 HG23 THR A 35 18.382 -91.431 -11.735 1.00 62.32 H new ATOM 494 N LEU A 36 17.782 -90.133 -8.621 1.00 13.40 N ATOM 495 CA LEU A 36 16.527 -89.773 -7.963 1.00 32.23 C ATOM 496 C LEU A 36 15.592 -89.155 -8.992 1.00 30.20 C ATOM 497 O LEU A 36 16.022 -88.334 -9.800 1.00 35.32 O ATOM 498 CB LEU A 36 16.749 -88.763 -6.815 1.00 70.33 C ATOM 499 CG LEU A 36 17.384 -89.301 -5.513 1.00 3.23 C ATOM 500 CD1 LEU A 36 16.686 -90.572 -5.043 1.00 10.31 C ATOM 501 CD2 LEU A 36 18.884 -89.519 -5.673 1.00 4.14 C ATOM 0 H LEU A 36 18.150 -89.405 -9.233 1.00 13.40 H new ATOM 0 HA LEU A 36 16.096 -90.679 -7.536 1.00 32.23 H new ATOM 0 HB2 LEU A 36 17.380 -87.958 -7.191 1.00 70.33 H new ATOM 0 HB3 LEU A 36 15.785 -88.321 -6.563 1.00 70.33 H new ATOM 0 HG LEU A 36 17.245 -88.543 -4.742 1.00 3.23 H new ATOM 0 HD11 LEU A 36 17.155 -90.927 -4.125 1.00 10.31 H new ATOM 0 HD12 LEU A 36 15.633 -90.361 -4.854 1.00 10.31 H new ATOM 0 HD13 LEU A 36 16.770 -91.339 -5.813 1.00 10.31 H new ATOM 0 HD21 LEU A 36 19.298 -89.898 -4.739 1.00 4.14 H new ATOM 0 HD22 LEU A 36 19.064 -90.242 -6.469 1.00 4.14 H new ATOM 0 HD23 LEU A 36 19.364 -88.574 -5.926 1.00 4.14 H new ATOM 513 N CYS A 37 14.324 -89.542 -8.981 1.00 71.23 N ATOM 514 CA CYS A 37 13.354 -88.939 -9.895 1.00 40.31 C ATOM 515 C CYS A 37 12.653 -87.774 -9.203 1.00 32.44 C ATOM 516 O CYS A 37 12.364 -87.836 -8.010 1.00 34.41 O ATOM 517 CB CYS A 37 12.339 -89.972 -10.385 1.00 1.21 C ATOM 518 SG CYS A 37 13.090 -91.467 -11.065 1.00 21.43 S ATOM 0 H CYS A 37 13.944 -90.258 -8.362 1.00 71.23 H new ATOM 0 HA CYS A 37 13.885 -88.565 -10.770 1.00 40.31 H new ATOM 0 HB2 CYS A 37 11.687 -90.249 -9.556 1.00 1.21 H new ATOM 0 HB3 CYS A 37 11.708 -89.515 -11.147 1.00 1.21 H new ATOM 0 HG CYS A 37 12.156 -92.284 -11.452 1.00 21.43 H new ATOM 524 N TYR A 38 12.382 -86.719 -9.958 1.00 44.52 N ATOM 525 CA TYR A 38 11.857 -85.475 -9.403 1.00 13.14 C ATOM 526 C TYR A 38 10.423 -85.240 -9.849 1.00 33.50 C ATOM 527 O TYR A 38 10.030 -85.635 -10.949 1.00 34.40 O ATOM 528 CB TYR A 38 12.703 -84.277 -9.870 1.00 2.52 C ATOM 529 CG TYR A 38 14.059 -84.129 -9.201 1.00 51.01 C ATOM 530 CD1 TYR A 38 14.835 -85.230 -8.866 1.00 5.21 C ATOM 531 CD2 TYR A 38 14.566 -82.865 -8.915 1.00 74.21 C ATOM 532 CE1 TYR A 38 16.068 -85.075 -8.269 1.00 42.41 C ATOM 533 CE2 TYR A 38 15.800 -82.706 -8.324 1.00 41.03 C ATOM 534 CZ TYR A 38 16.546 -83.812 -8.003 1.00 0.42 C ATOM 535 OH TYR A 38 17.779 -83.652 -7.419 1.00 72.24 O ATOM 0 H TYR A 38 12.518 -86.699 -10.969 1.00 44.52 H new ATOM 0 HA TYR A 38 11.895 -85.565 -8.317 1.00 13.14 H new ATOM 0 HB2 TYR A 38 12.856 -84.361 -10.946 1.00 2.52 H new ATOM 0 HB3 TYR A 38 12.132 -83.364 -9.700 1.00 2.52 H new ATOM 0 HD1 TYR A 38 14.467 -86.223 -9.076 1.00 5.21 H new ATOM 0 HD2 TYR A 38 13.980 -81.992 -9.161 1.00 74.21 H new ATOM 0 HE1 TYR A 38 16.657 -85.942 -8.011 1.00 42.41 H new ATOM 0 HE2 TYR A 38 16.178 -81.716 -8.114 1.00 41.03 H new ATOM 0 HH TYR A 38 17.964 -82.697 -7.302 1.00 72.24 H new ATOM 545 N ARG A 39 9.653 -84.608 -8.977 1.00 41.31 N ATOM 546 CA ARG A 39 8.340 -84.090 -9.324 1.00 13.40 C ATOM 547 C ARG A 39 7.961 -82.983 -8.350 1.00 14.02 C ATOM 548 O ARG A 39 7.734 -83.237 -7.168 1.00 25.40 O ATOM 549 CB ARG A 39 7.279 -85.198 -9.313 1.00 74.33 C ATOM 550 CG ARG A 39 5.895 -84.711 -9.739 1.00 12.21 C ATOM 551 CD ARG A 39 4.902 -85.855 -9.888 1.00 54.31 C ATOM 552 NE ARG A 39 3.624 -85.399 -10.442 1.00 25.32 N ATOM 553 CZ ARG A 39 2.569 -86.189 -10.645 1.00 14.22 C ATOM 554 NH1 ARG A 39 2.620 -87.473 -10.304 1.00 32.13 N ATOM 555 NH2 ARG A 39 1.463 -85.689 -11.185 1.00 64.21 N ATOM 0 H ARG A 39 9.922 -84.440 -8.008 1.00 41.31 H new ATOM 0 HA ARG A 39 8.383 -83.688 -10.336 1.00 13.40 H new ATOM 0 HB2 ARG A 39 7.595 -86.001 -9.979 1.00 74.33 H new ATOM 0 HB3 ARG A 39 7.215 -85.621 -8.311 1.00 74.33 H new ATOM 0 HG2 ARG A 39 5.520 -84.000 -9.003 1.00 12.21 H new ATOM 0 HG3 ARG A 39 5.975 -84.177 -10.686 1.00 12.21 H new ATOM 0 HD2 ARG A 39 5.326 -86.622 -10.536 1.00 54.31 H new ATOM 0 HD3 ARG A 39 4.732 -86.318 -8.916 1.00 54.31 H new ATOM 0 HE ARG A 39 3.536 -84.413 -10.688 1.00 25.32 H new ATOM 0 HH11 ARG A 39 3.468 -87.856 -9.886 1.00 32.13 H new ATOM 0 HH12 ARG A 39 1.811 -88.075 -10.460 1.00 32.13 H new ATOM 0 HH21 ARG A 39 1.422 -84.703 -11.443 1.00 64.21 H new ATOM 0 HH22 ARG A 39 0.655 -86.291 -11.341 1.00 64.21 H new ATOM 569 N VAL A 40 7.921 -81.755 -8.844 1.00 72.34 N ATOM 570 CA VAL A 40 7.601 -80.594 -8.013 1.00 72.44 C ATOM 571 C VAL A 40 6.321 -79.937 -8.510 1.00 70.43 C ATOM 572 O VAL A 40 6.049 -79.941 -9.708 1.00 61.43 O ATOM 573 CB VAL A 40 8.758 -79.557 -8.026 1.00 33.24 C ATOM 574 CG1 VAL A 40 8.915 -78.929 -9.409 1.00 32.30 C ATOM 575 CG2 VAL A 40 8.546 -78.481 -6.962 1.00 22.25 C ATOM 0 H VAL A 40 8.107 -81.531 -9.822 1.00 72.34 H new ATOM 0 HA VAL A 40 7.462 -80.941 -6.989 1.00 72.44 H new ATOM 0 HB VAL A 40 9.681 -80.087 -7.788 1.00 33.24 H new ATOM 0 HG11 VAL A 40 9.731 -78.207 -9.390 1.00 32.30 H new ATOM 0 HG12 VAL A 40 9.136 -79.708 -10.139 1.00 32.30 H new ATOM 0 HG13 VAL A 40 7.990 -78.423 -9.686 1.00 32.30 H new ATOM 0 HG21 VAL A 40 9.371 -77.769 -6.995 1.00 22.25 H new ATOM 0 HG22 VAL A 40 7.609 -77.959 -7.154 1.00 22.25 H new ATOM 0 HG23 VAL A 40 8.507 -78.946 -5.977 1.00 22.25 H new ATOM 585 N THR A 41 5.535 -79.378 -7.600 1.00 2.24 N ATOM 586 CA THR A 41 4.287 -78.713 -7.973 1.00 62.42 C ATOM 587 C THR A 41 4.360 -77.223 -7.691 1.00 74.20 C ATOM 588 O THR A 41 5.077 -76.774 -6.788 1.00 2.33 O ATOM 589 CB THR A 41 3.056 -79.315 -7.252 1.00 55.34 C ATOM 590 OG1 THR A 41 1.861 -78.594 -7.605 1.00 61.12 O ATOM 591 CG2 THR A 41 3.236 -79.312 -5.735 1.00 64.10 C ATOM 0 H THR A 41 5.736 -79.370 -6.600 1.00 2.24 H new ATOM 0 HA THR A 41 4.161 -78.876 -9.043 1.00 62.42 H new ATOM 0 HB THR A 41 2.960 -80.350 -7.580 1.00 55.34 H new ATOM 0 HG1 THR A 41 1.092 -78.988 -7.142 1.00 61.12 H new ATOM 0 HG21 THR A 41 2.352 -79.742 -5.263 1.00 64.10 H new ATOM 0 HG22 THR A 41 4.112 -79.904 -5.471 1.00 64.10 H new ATOM 0 HG23 THR A 41 3.372 -78.288 -5.387 1.00 64.10 H new ATOM 599 N GLY A 42 3.594 -76.468 -8.462 1.00 41.40 N ATOM 600 CA GLY A 42 3.612 -75.022 -8.365 1.00 24.42 C ATOM 601 C GLY A 42 2.493 -74.487 -7.493 1.00 40.24 C ATOM 602 O GLY A 42 1.457 -75.137 -7.324 1.00 32.35 O ATOM 0 H GLY A 42 2.951 -76.836 -9.163 1.00 41.40 H new ATOM 0 HA2 GLY A 42 4.571 -74.700 -7.959 1.00 24.42 H new ATOM 0 HA3 GLY A 42 3.528 -74.593 -9.363 1.00 24.42 H new ATOM 684 N PHE A 48 8.563 -73.414 -15.794 1.00 44.21 N ATOM 685 CA PHE A 48 9.775 -73.804 -15.084 1.00 43.23 C ATOM 686 C PHE A 48 10.992 -73.391 -15.909 1.00 63.04 C ATOM 687 O PHE A 48 11.088 -73.728 -17.090 1.00 45.54 O ATOM 688 CB PHE A 48 9.765 -75.319 -14.838 1.00 61.12 C ATOM 689 CG PHE A 48 10.777 -75.803 -13.825 1.00 53.24 C ATOM 690 CD1 PHE A 48 10.538 -75.653 -12.465 1.00 42.11 C ATOM 691 CD2 PHE A 48 11.955 -76.417 -14.229 1.00 54.45 C ATOM 692 CE1 PHE A 48 11.450 -76.108 -11.532 1.00 23.41 C ATOM 693 CE2 PHE A 48 12.869 -76.874 -13.298 1.00 23.53 C ATOM 694 CZ PHE A 48 12.617 -76.718 -11.949 1.00 52.33 C ATOM 0 HA PHE A 48 9.821 -73.303 -14.117 1.00 43.23 H new ATOM 0 HB2 PHE A 48 8.769 -75.612 -14.505 1.00 61.12 H new ATOM 0 HB3 PHE A 48 9.947 -75.828 -15.785 1.00 61.12 H new ATOM 0 HD1 PHE A 48 9.628 -75.175 -12.133 1.00 42.11 H new ATOM 0 HD2 PHE A 48 12.160 -76.539 -15.282 1.00 54.45 H new ATOM 0 HE1 PHE A 48 11.251 -75.987 -10.478 1.00 23.41 H new ATOM 0 HE2 PHE A 48 13.780 -77.353 -13.625 1.00 23.53 H new ATOM 0 HZ PHE A 48 13.332 -77.073 -11.221 1.00 52.33 H new ATOM 704 N PHE A 49 11.899 -72.647 -15.285 1.00 15.34 N ATOM 705 CA PHE A 49 13.080 -72.107 -15.965 1.00 4.40 C ATOM 706 C PHE A 49 13.986 -73.205 -16.545 1.00 62.32 C ATOM 707 O PHE A 49 15.008 -73.578 -15.954 1.00 1.00 O ATOM 708 CB PHE A 49 13.871 -71.167 -15.031 1.00 33.40 C ATOM 709 CG PHE A 49 14.141 -71.681 -13.624 1.00 61.25 C ATOM 710 CD1 PHE A 49 13.783 -72.964 -13.223 1.00 2.54 C ATOM 711 CD2 PHE A 49 14.756 -70.853 -12.695 1.00 61.52 C ATOM 712 CE1 PHE A 49 14.030 -73.402 -11.937 1.00 70.11 C ATOM 713 CE2 PHE A 49 15.007 -71.289 -11.408 1.00 52.45 C ATOM 714 CZ PHE A 49 14.644 -72.563 -11.029 1.00 63.23 C ATOM 0 H PHE A 49 11.840 -72.400 -14.297 1.00 15.34 H new ATOM 0 HA PHE A 49 12.717 -71.526 -16.813 1.00 4.40 H new ATOM 0 HB2 PHE A 49 14.828 -70.943 -15.502 1.00 33.40 H new ATOM 0 HB3 PHE A 49 13.326 -70.226 -14.952 1.00 33.40 H new ATOM 0 HD1 PHE A 49 13.305 -73.628 -13.928 1.00 2.54 H new ATOM 0 HD2 PHE A 49 15.043 -69.852 -12.983 1.00 61.52 H new ATOM 0 HE1 PHE A 49 13.743 -74.400 -11.642 1.00 70.11 H new ATOM 0 HE2 PHE A 49 15.488 -70.631 -10.699 1.00 52.45 H new ATOM 0 HZ PHE A 49 14.840 -72.905 -10.023 1.00 63.23 H new ATOM 724 N ARG A 50 13.598 -73.707 -17.717 1.00 20.24 N ATOM 725 CA ARG A 50 14.341 -74.747 -18.429 1.00 11.11 C ATOM 726 C ARG A 50 15.783 -74.317 -18.677 1.00 62.02 C ATOM 727 O ARG A 50 16.712 -75.103 -18.499 1.00 13.04 O ATOM 728 CB ARG A 50 13.651 -75.059 -19.767 1.00 4.24 C ATOM 729 CG ARG A 50 14.429 -76.016 -20.664 1.00 63.42 C ATOM 730 CD ARG A 50 13.737 -76.226 -22.009 1.00 31.41 C ATOM 731 NE ARG A 50 13.546 -74.969 -22.742 1.00 52.04 N ATOM 732 CZ ARG A 50 13.336 -74.893 -24.059 1.00 22.45 C ATOM 733 NH1 ARG A 50 13.318 -75.993 -24.803 1.00 12.14 N ATOM 734 NH2 ARG A 50 13.158 -73.710 -24.631 1.00 70.43 N ATOM 0 H ARG A 50 12.754 -73.402 -18.202 1.00 20.24 H new ATOM 0 HA ARG A 50 14.354 -75.643 -17.809 1.00 11.11 H new ATOM 0 HB2 ARG A 50 12.669 -75.486 -19.565 1.00 4.24 H new ATOM 0 HB3 ARG A 50 13.489 -74.125 -20.305 1.00 4.24 H new ATOM 0 HG2 ARG A 50 15.432 -75.624 -20.829 1.00 63.42 H new ATOM 0 HG3 ARG A 50 14.541 -76.976 -20.160 1.00 63.42 H new ATOM 0 HD2 ARG A 50 14.329 -76.911 -22.616 1.00 31.41 H new ATOM 0 HD3 ARG A 50 12.769 -76.699 -21.846 1.00 31.41 H new ATOM 0 HE ARG A 50 13.575 -74.098 -22.212 1.00 52.04 H new ATOM 0 HH11 ARG A 50 13.465 -76.904 -24.369 1.00 12.14 H new ATOM 0 HH12 ARG A 50 13.157 -75.926 -25.808 1.00 12.14 H new ATOM 0 HH21 ARG A 50 13.182 -72.861 -24.066 1.00 70.43 H new ATOM 0 HH22 ARG A 50 12.997 -73.649 -25.636 1.00 70.43 H new ATOM 748 N LYS A 51 15.954 -73.061 -19.075 1.00 31.42 N ATOM 749 CA LYS A 51 17.267 -72.515 -19.410 1.00 51.24 C ATOM 750 C LYS A 51 18.244 -72.669 -18.241 1.00 43.40 C ATOM 751 O LYS A 51 19.345 -73.210 -18.399 1.00 4.25 O ATOM 752 CB LYS A 51 17.132 -71.035 -19.807 1.00 42.54 C ATOM 753 CG LYS A 51 18.454 -70.362 -20.175 1.00 63.21 C ATOM 754 CD LYS A 51 18.258 -68.917 -20.640 1.00 2.41 C ATOM 755 CE LYS A 51 17.591 -68.052 -19.574 1.00 61.10 C ATOM 756 NZ LYS A 51 17.514 -66.625 -19.982 1.00 63.52 N ATOM 0 H LYS A 51 15.189 -72.393 -19.175 1.00 31.42 H new ATOM 0 HA LYS A 51 17.668 -73.076 -20.254 1.00 51.24 H new ATOM 0 HB2 LYS A 51 16.450 -70.958 -20.654 1.00 42.54 H new ATOM 0 HB3 LYS A 51 16.677 -70.489 -18.981 1.00 42.54 H new ATOM 0 HG2 LYS A 51 19.120 -70.377 -19.312 1.00 63.21 H new ATOM 0 HG3 LYS A 51 18.943 -70.933 -20.965 1.00 63.21 H new ATOM 0 HD2 LYS A 51 19.225 -68.487 -20.901 1.00 2.41 H new ATOM 0 HD3 LYS A 51 17.650 -68.908 -21.545 1.00 2.41 H new ATOM 0 HE2 LYS A 51 16.587 -68.428 -19.379 1.00 61.10 H new ATOM 0 HE3 LYS A 51 18.149 -68.133 -18.641 1.00 61.10 H new ATOM 0 HZ1 LYS A 51 17.054 -66.073 -19.230 1.00 63.52 H new ATOM 0 HZ2 LYS A 51 18.474 -66.258 -20.144 1.00 63.52 H new ATOM 0 HZ3 LYS A 51 16.960 -66.544 -20.858 1.00 63.52 H new ATOM 770 N TYR A 52 17.828 -72.210 -17.064 1.00 33.33 N ATOM 771 CA TYR A 52 18.685 -72.237 -15.881 1.00 52.21 C ATOM 772 C TYR A 52 18.827 -73.660 -15.344 1.00 31.13 C ATOM 773 O TYR A 52 19.879 -74.026 -14.813 1.00 33.12 O ATOM 774 CB TYR A 52 18.134 -71.302 -14.796 1.00 51.11 C ATOM 775 CG TYR A 52 17.999 -69.859 -15.259 1.00 65.03 C ATOM 776 CD1 TYR A 52 19.093 -69.171 -15.778 1.00 73.20 C ATOM 777 CD2 TYR A 52 16.781 -69.189 -15.190 1.00 31.11 C ATOM 778 CE1 TYR A 52 18.976 -67.865 -16.212 1.00 34.30 C ATOM 779 CE2 TYR A 52 16.656 -67.882 -15.626 1.00 52.05 C ATOM 780 CZ TYR A 52 17.757 -67.226 -16.132 1.00 23.30 C ATOM 781 OH TYR A 52 17.639 -65.930 -16.575 1.00 53.21 O ATOM 0 H TYR A 52 16.902 -71.814 -16.903 1.00 33.33 H new ATOM 0 HA TYR A 52 19.675 -71.884 -16.170 1.00 52.21 H new ATOM 0 HB2 TYR A 52 17.158 -71.666 -14.473 1.00 51.11 H new ATOM 0 HB3 TYR A 52 18.791 -71.338 -13.927 1.00 51.11 H new ATOM 0 HD1 TYR A 52 20.050 -69.668 -15.842 1.00 73.20 H new ATOM 0 HD2 TYR A 52 15.918 -69.699 -14.789 1.00 31.11 H new ATOM 0 HE1 TYR A 52 19.835 -67.347 -16.612 1.00 34.30 H new ATOM 0 HE2 TYR A 52 15.702 -67.379 -15.570 1.00 52.05 H new ATOM 0 HH TYR A 52 16.716 -65.625 -16.451 1.00 53.21 H new ATOM 791 N THR A 53 17.772 -74.458 -15.491 1.00 44.10 N ATOM 792 CA THR A 53 17.801 -75.856 -15.074 1.00 3.41 C ATOM 793 C THR A 53 18.818 -76.648 -15.899 1.00 73.23 C ATOM 794 O THR A 53 19.632 -77.402 -15.354 1.00 72.33 O ATOM 795 CB THR A 53 16.401 -76.500 -15.195 1.00 45.12 C ATOM 796 OG1 THR A 53 15.461 -75.758 -14.405 1.00 53.20 O ATOM 797 CG2 THR A 53 16.409 -77.959 -14.743 1.00 71.23 C ATOM 0 H THR A 53 16.885 -74.159 -15.897 1.00 44.10 H new ATOM 0 HA THR A 53 18.104 -75.884 -14.027 1.00 3.41 H new ATOM 0 HB THR A 53 16.111 -76.476 -16.245 1.00 45.12 H new ATOM 0 HG1 THR A 53 15.941 -75.105 -13.854 1.00 53.20 H new ATOM 0 HG21 THR A 53 15.407 -78.376 -14.843 1.00 71.23 H new ATOM 0 HG22 THR A 53 17.103 -78.528 -15.362 1.00 71.23 H new ATOM 0 HG23 THR A 53 16.723 -78.015 -13.701 1.00 71.23 H new ATOM 805 N LYS A 54 18.791 -76.442 -17.214 1.00 52.34 N ATOM 806 CA LYS A 54 19.697 -77.142 -18.112 1.00 30.44 C ATOM 807 C LYS A 54 21.125 -76.645 -17.904 1.00 3.54 C ATOM 808 O LYS A 54 22.064 -77.434 -17.901 1.00 44.10 O ATOM 809 CB LYS A 54 19.271 -76.963 -19.573 1.00 40.44 C ATOM 810 CG LYS A 54 20.051 -77.847 -20.546 1.00 35.45 C ATOM 811 CD LYS A 54 19.514 -77.745 -21.970 1.00 30.33 C ATOM 812 CE LYS A 54 20.220 -78.719 -22.907 1.00 3.15 C ATOM 813 NZ LYS A 54 21.679 -78.444 -23.011 1.00 23.31 N ATOM 0 H LYS A 54 18.152 -75.797 -17.678 1.00 52.34 H new ATOM 0 HA LYS A 54 19.657 -78.207 -17.881 1.00 30.44 H new ATOM 0 HB2 LYS A 54 18.208 -77.186 -19.664 1.00 40.44 H new ATOM 0 HB3 LYS A 54 19.403 -75.919 -19.857 1.00 40.44 H new ATOM 0 HG2 LYS A 54 21.102 -77.559 -20.534 1.00 35.45 H new ATOM 0 HG3 LYS A 54 20.001 -78.884 -20.213 1.00 35.45 H new ATOM 0 HD2 LYS A 54 18.443 -77.949 -21.971 1.00 30.33 H new ATOM 0 HD3 LYS A 54 19.645 -76.727 -22.337 1.00 30.33 H new ATOM 0 HE2 LYS A 54 20.069 -79.738 -22.550 1.00 3.15 H new ATOM 0 HE3 LYS A 54 19.769 -78.658 -23.898 1.00 3.15 H new ATOM 0 HZ1 LYS A 54 22.113 -79.120 -23.671 1.00 23.31 H new ATOM 0 HZ2 LYS A 54 21.826 -77.476 -23.361 1.00 23.31 H new ATOM 0 HZ3 LYS A 54 22.119 -78.544 -22.074 1.00 23.31 H new ATOM 827 N LYS A 55 21.278 -75.331 -17.716 1.00 61.15 N ATOM 828 CA LYS A 55 22.567 -74.740 -17.410 1.00 23.30 C ATOM 829 C LYS A 55 23.148 -75.369 -16.145 1.00 15.04 C ATOM 830 O LYS A 55 24.331 -75.722 -16.086 1.00 2.24 O ATOM 831 CB LYS A 55 22.374 -73.242 -17.202 1.00 11.43 C ATOM 832 CG LYS A 55 23.652 -72.486 -16.904 1.00 64.44 C ATOM 833 CD LYS A 55 23.357 -71.066 -16.458 1.00 65.33 C ATOM 834 CE LYS A 55 22.582 -71.027 -15.145 1.00 14.41 C ATOM 835 NZ LYS A 55 22.480 -69.648 -14.602 1.00 63.50 N ATOM 0 H LYS A 55 20.513 -74.659 -17.773 1.00 61.15 H new ATOM 0 HA LYS A 55 23.260 -74.918 -18.232 1.00 23.30 H new ATOM 0 HB2 LYS A 55 21.915 -72.819 -18.095 1.00 11.43 H new ATOM 0 HB3 LYS A 55 21.674 -73.088 -16.381 1.00 11.43 H new ATOM 0 HG2 LYS A 55 24.212 -73.005 -16.127 1.00 64.44 H new ATOM 0 HG3 LYS A 55 24.283 -72.467 -17.793 1.00 64.44 H new ATOM 0 HD2 LYS A 55 24.294 -70.521 -16.342 1.00 65.33 H new ATOM 0 HD3 LYS A 55 22.784 -70.555 -17.232 1.00 65.33 H new ATOM 0 HE2 LYS A 55 21.582 -71.430 -15.302 1.00 14.41 H new ATOM 0 HE3 LYS A 55 23.073 -71.669 -14.414 1.00 14.41 H new ATOM 0 HZ1 LYS A 55 21.946 -69.665 -13.710 1.00 63.50 H new ATOM 0 HZ2 LYS A 55 23.434 -69.272 -14.428 1.00 63.50 H new ATOM 0 HZ3 LYS A 55 21.988 -69.040 -15.288 1.00 63.50 H new ATOM 849 N GLU A 56 22.290 -75.507 -15.139 1.00 61.35 N ATOM 850 CA GLU A 56 22.661 -76.104 -13.863 1.00 4.44 C ATOM 851 C GLU A 56 23.183 -77.522 -14.082 1.00 34.44 C ATOM 852 O GLU A 56 24.279 -77.875 -13.639 1.00 61.15 O ATOM 853 CB GLU A 56 21.438 -76.128 -12.932 1.00 12.34 C ATOM 854 CG GLU A 56 21.734 -76.614 -11.519 1.00 53.51 C ATOM 855 CD GLU A 56 22.615 -75.648 -10.737 1.00 25.14 C ATOM 856 OE1 GLU A 56 22.268 -74.446 -10.661 1.00 63.10 O ATOM 857 OE2 GLU A 56 23.652 -76.076 -10.194 1.00 24.04 O ATOM 0 H GLU A 56 21.316 -75.207 -15.187 1.00 61.35 H new ATOM 0 HA GLU A 56 23.450 -75.509 -13.402 1.00 4.44 H new ATOM 0 HB2 GLU A 56 21.018 -75.124 -12.877 1.00 12.34 H new ATOM 0 HB3 GLU A 56 20.674 -76.769 -13.372 1.00 12.34 H new ATOM 0 HG2 GLU A 56 20.795 -76.757 -10.984 1.00 53.51 H new ATOM 0 HG3 GLU A 56 22.224 -77.587 -11.569 1.00 53.51 H new ATOM 864 N ALA A 57 22.393 -78.314 -14.800 1.00 2.01 N ATOM 865 CA ALA A 57 22.730 -79.706 -15.069 1.00 74.43 C ATOM 866 C ALA A 57 24.002 -79.820 -15.907 1.00 71.13 C ATOM 867 O ALA A 57 24.855 -80.662 -15.633 1.00 12.10 O ATOM 868 CB ALA A 57 21.560 -80.401 -15.757 1.00 4.12 C ATOM 0 H ALA A 57 21.509 -78.012 -15.208 1.00 2.01 H new ATOM 0 HA ALA A 57 22.923 -80.202 -14.118 1.00 74.43 H new ATOM 0 HB1 ALA A 57 21.820 -81.441 -15.955 1.00 4.12 H new ATOM 0 HB2 ALA A 57 20.683 -80.363 -15.111 1.00 4.12 H new ATOM 0 HB3 ALA A 57 21.340 -79.897 -16.698 1.00 4.12 H new ATOM 874 N ASP A 58 24.132 -78.962 -16.916 1.00 44.45 N ATOM 875 CA ASP A 58 25.318 -78.955 -17.779 1.00 61.14 C ATOM 876 C ASP A 58 26.578 -78.688 -16.962 1.00 50.21 C ATOM 877 O ASP A 58 27.597 -79.364 -17.121 1.00 33.21 O ATOM 878 CB ASP A 58 25.199 -77.893 -18.895 1.00 0.41 C ATOM 879 CG ASP A 58 24.464 -78.387 -20.134 1.00 35.12 C ATOM 880 OD1 ASP A 58 24.847 -79.449 -20.666 1.00 22.10 O ATOM 881 OD2 ASP A 58 23.519 -77.707 -20.597 1.00 32.14 O ATOM 0 H ASP A 58 23.432 -78.261 -17.159 1.00 44.45 H new ATOM 0 HA ASP A 58 25.386 -79.940 -18.240 1.00 61.14 H new ATOM 0 HB2 ASP A 58 24.680 -77.020 -18.500 1.00 0.41 H new ATOM 0 HB3 ASP A 58 26.199 -77.567 -19.182 1.00 0.41 H new ATOM 886 N ALA A 59 26.499 -77.699 -16.081 1.00 41.11 N ATOM 887 CA ALA A 59 27.644 -77.288 -15.283 1.00 31.13 C ATOM 888 C ALA A 59 28.007 -78.346 -14.235 1.00 41.12 C ATOM 889 O ALA A 59 29.163 -78.761 -14.130 1.00 73.43 O ATOM 890 CB ALA A 59 27.364 -75.943 -14.622 1.00 33.22 C ATOM 0 H ALA A 59 25.649 -77.165 -15.901 1.00 41.11 H new ATOM 0 HA ALA A 59 28.501 -77.182 -15.948 1.00 31.13 H new ATOM 0 HB1 ALA A 59 28.227 -75.644 -14.027 1.00 33.22 H new ATOM 0 HB2 ALA A 59 27.175 -75.193 -15.390 1.00 33.22 H new ATOM 0 HB3 ALA A 59 26.490 -76.030 -13.976 1.00 33.22 H new ATOM 896 N LEU A 60 27.008 -78.789 -13.479 1.00 54.24 N ATOM 897 CA LEU A 60 27.225 -79.743 -12.386 1.00 74.52 C ATOM 898 C LEU A 60 27.255 -81.187 -12.903 1.00 2.20 C ATOM 899 O LEU A 60 27.489 -82.118 -12.133 1.00 5.04 O ATOM 900 CB LEU A 60 26.138 -79.572 -11.307 1.00 10.34 C ATOM 901 CG LEU A 60 26.351 -78.430 -10.294 1.00 60.33 C ATOM 902 CD1 LEU A 60 27.448 -78.792 -9.294 1.00 41.11 C ATOM 903 CD2 LEU A 60 26.677 -77.115 -11.002 1.00 51.52 C ATOM 0 H LEU A 60 26.036 -78.504 -13.600 1.00 54.24 H new ATOM 0 HA LEU A 60 28.197 -79.533 -11.940 1.00 74.52 H new ATOM 0 HB2 LEU A 60 25.183 -79.411 -11.807 1.00 10.34 H new ATOM 0 HB3 LEU A 60 26.055 -80.508 -10.754 1.00 10.34 H new ATOM 0 HG LEU A 60 25.419 -78.292 -9.746 1.00 60.33 H new ATOM 0 HD11 LEU A 60 27.582 -77.972 -8.588 1.00 41.11 H new ATOM 0 HD12 LEU A 60 27.163 -79.694 -8.752 1.00 41.11 H new ATOM 0 HD13 LEU A 60 28.382 -78.968 -9.827 1.00 41.11 H new ATOM 0 HD21 LEU A 60 26.822 -76.329 -10.261 1.00 51.52 H new ATOM 0 HD22 LEU A 60 27.588 -77.233 -11.588 1.00 51.52 H new ATOM 0 HD23 LEU A 60 25.854 -76.844 -11.663 1.00 51.52 H new ATOM 915 N SER A 61 27.004 -81.360 -14.203 1.00 74.52 N ATOM 916 CA SER A 61 27.135 -82.655 -14.875 1.00 3.53 C ATOM 917 C SER A 61 26.081 -83.664 -14.401 1.00 64.03 C ATOM 918 O SER A 61 26.384 -84.835 -14.173 1.00 34.12 O ATOM 919 CB SER A 61 28.550 -83.219 -14.661 1.00 74.53 C ATOM 920 OG SER A 61 29.536 -82.333 -15.174 1.00 63.03 O ATOM 0 H SER A 61 26.704 -80.605 -14.820 1.00 74.52 H new ATOM 0 HA SER A 61 26.967 -82.490 -15.939 1.00 3.53 H new ATOM 0 HB2 SER A 61 28.722 -83.384 -13.597 1.00 74.53 H new ATOM 0 HB3 SER A 61 28.637 -84.188 -15.152 1.00 74.53 H new ATOM 0 HG SER A 61 30.427 -82.713 -15.024 1.00 63.03 H new ATOM 926 N LEU A 62 24.832 -83.209 -14.293 1.00 73.12 N ATOM 927 CA LEU A 62 23.720 -84.114 -13.999 1.00 32.44 C ATOM 928 C LEU A 62 23.094 -84.591 -15.302 1.00 13.42 C ATOM 929 O LEU A 62 22.843 -83.793 -16.212 1.00 54.02 O ATOM 930 CB LEU A 62 22.636 -83.445 -13.128 1.00 62.02 C ATOM 931 CG LEU A 62 23.054 -83.071 -11.694 1.00 31.13 C ATOM 932 CD1 LEU A 62 23.802 -84.222 -11.028 1.00 22.14 C ATOM 933 CD2 LEU A 62 23.884 -81.803 -11.692 1.00 20.31 C ATOM 0 H LEU A 62 24.566 -82.230 -14.403 1.00 73.12 H new ATOM 0 HA LEU A 62 24.124 -84.956 -13.437 1.00 32.44 H new ATOM 0 HB2 LEU A 62 22.299 -82.540 -13.634 1.00 62.02 H new ATOM 0 HB3 LEU A 62 21.779 -84.116 -13.071 1.00 62.02 H new ATOM 0 HG LEU A 62 22.151 -82.882 -11.113 1.00 31.13 H new ATOM 0 HD11 LEU A 62 24.087 -83.934 -10.016 1.00 22.14 H new ATOM 0 HD12 LEU A 62 23.157 -85.100 -10.987 1.00 22.14 H new ATOM 0 HD13 LEU A 62 24.697 -84.456 -11.604 1.00 22.14 H new ATOM 0 HD21 LEU A 62 24.169 -81.556 -10.669 1.00 20.31 H new ATOM 0 HD22 LEU A 62 24.781 -81.954 -12.292 1.00 20.31 H new ATOM 0 HD23 LEU A 62 23.300 -80.985 -12.113 1.00 20.31 H new ATOM 945 N VAL A 63 22.849 -85.892 -15.388 1.00 63.31 N ATOM 946 CA VAL A 63 22.176 -86.475 -16.539 1.00 53.30 C ATOM 947 C VAL A 63 20.802 -86.981 -16.116 1.00 24.01 C ATOM 948 O VAL A 63 20.547 -87.170 -14.928 1.00 52.40 O ATOM 949 CB VAL A 63 22.998 -87.628 -17.172 1.00 11.42 C ATOM 950 CG1 VAL A 63 24.350 -87.115 -17.669 1.00 23.31 C ATOM 951 CG2 VAL A 63 23.184 -88.781 -16.186 1.00 10.23 C ATOM 0 H VAL A 63 23.109 -86.567 -14.669 1.00 63.31 H new ATOM 0 HA VAL A 63 22.072 -85.700 -17.298 1.00 53.30 H new ATOM 0 HB VAL A 63 22.439 -88.009 -18.027 1.00 11.42 H new ATOM 0 HG11 VAL A 63 24.912 -87.938 -18.110 1.00 23.31 H new ATOM 0 HG12 VAL A 63 24.192 -86.341 -18.420 1.00 23.31 H new ATOM 0 HG13 VAL A 63 24.911 -86.699 -16.832 1.00 23.31 H new ATOM 0 HG21 VAL A 63 23.764 -89.574 -16.659 1.00 10.23 H new ATOM 0 HG22 VAL A 63 23.712 -88.423 -15.302 1.00 10.23 H new ATOM 0 HG23 VAL A 63 22.209 -89.170 -15.893 1.00 10.23 H new ATOM 961 N GLY A 64 19.921 -87.173 -17.083 1.00 15.23 N ATOM 962 CA GLY A 64 18.559 -87.584 -16.797 1.00 55.25 C ATOM 963 C GLY A 64 17.598 -86.929 -17.756 1.00 30.41 C ATOM 964 O GLY A 64 17.866 -86.881 -18.959 1.00 63.55 O ATOM 0 H GLY A 64 20.126 -87.050 -18.075 1.00 15.23 H new ATOM 0 HA2 GLY A 64 18.476 -88.668 -16.874 1.00 55.25 H new ATOM 0 HA3 GLY A 64 18.299 -87.316 -15.773 1.00 55.25 H new ATOM 968 N TYR A 65 16.487 -86.414 -17.245 1.00 73.32 N ATOM 969 CA TYR A 65 15.535 -85.701 -18.090 1.00 13.32 C ATOM 970 C TYR A 65 14.512 -84.938 -17.253 1.00 31.43 C ATOM 971 O TYR A 65 14.299 -85.257 -16.087 1.00 30.44 O ATOM 972 CB TYR A 65 14.847 -86.672 -19.078 1.00 12.34 C ATOM 973 CG TYR A 65 13.411 -87.042 -18.742 1.00 12.32 C ATOM 974 CD1 TYR A 65 13.114 -88.040 -17.818 1.00 2.54 C ATOM 975 CD2 TYR A 65 12.348 -86.392 -19.363 1.00 43.24 C ATOM 976 CE1 TYR A 65 11.803 -88.375 -17.525 1.00 14.21 C ATOM 977 CE2 TYR A 65 11.040 -86.719 -19.073 1.00 74.34 C ATOM 978 CZ TYR A 65 10.771 -87.710 -18.155 1.00 4.14 C ATOM 979 OH TYR A 65 9.463 -88.037 -17.864 1.00 22.34 O ATOM 0 H TYR A 65 16.224 -86.475 -16.261 1.00 73.32 H new ATOM 0 HA TYR A 65 16.087 -84.965 -18.674 1.00 13.32 H new ATOM 0 HB2 TYR A 65 14.865 -86.224 -20.072 1.00 12.34 H new ATOM 0 HB3 TYR A 65 15.437 -87.587 -19.130 1.00 12.34 H new ATOM 0 HD1 TYR A 65 13.919 -88.561 -17.322 1.00 2.54 H new ATOM 0 HD2 TYR A 65 12.552 -85.616 -20.086 1.00 43.24 H new ATOM 0 HE1 TYR A 65 11.589 -89.153 -16.807 1.00 14.21 H new ATOM 0 HE2 TYR A 65 10.230 -86.200 -19.564 1.00 74.34 H new ATOM 0 HH TYR A 65 9.403 -88.355 -16.939 1.00 22.34 H new ATOM 989 N VAL A 66 13.892 -83.926 -17.857 1.00 23.54 N ATOM 990 CA VAL A 66 12.819 -83.160 -17.212 1.00 72.34 C ATOM 991 C VAL A 66 11.707 -82.880 -18.219 1.00 10.41 C ATOM 992 O VAL A 66 11.983 -82.750 -19.420 1.00 63.31 O ATOM 993 CB VAL A 66 13.343 -81.823 -16.600 1.00 1.11 C ATOM 994 CG1 VAL A 66 12.223 -80.798 -16.402 1.00 51.44 C ATOM 995 CG2 VAL A 66 14.043 -82.090 -15.267 1.00 12.42 C ATOM 0 H VAL A 66 14.115 -83.613 -18.802 1.00 23.54 H new ATOM 0 HA VAL A 66 12.427 -83.761 -16.392 1.00 72.34 H new ATOM 0 HB VAL A 66 14.054 -81.401 -17.310 1.00 1.11 H new ATOM 0 HG11 VAL A 66 12.637 -79.885 -15.974 1.00 51.44 H new ATOM 0 HG12 VAL A 66 11.763 -80.572 -17.364 1.00 51.44 H new ATOM 0 HG13 VAL A 66 11.471 -81.207 -15.727 1.00 51.44 H new ATOM 0 HG21 VAL A 66 14.404 -81.149 -14.851 1.00 12.42 H new ATOM 0 HG22 VAL A 66 13.339 -82.548 -14.572 1.00 12.42 H new ATOM 0 HG23 VAL A 66 14.885 -82.763 -15.427 1.00 12.42 H new ATOM 1005 N THR A 67 10.467 -82.798 -17.712 1.00 33.35 N ATOM 1006 CA THR A 67 9.271 -82.531 -18.511 1.00 62.00 C ATOM 1007 C THR A 67 8.187 -81.900 -17.628 1.00 43.22 C ATOM 1008 O THR A 67 8.251 -81.989 -16.402 1.00 43.20 O ATOM 1009 CB THR A 67 8.701 -83.822 -19.153 1.00 20.20 C ATOM 1010 OG1 THR A 67 7.546 -83.511 -19.951 1.00 12.03 O ATOM 1011 CG2 THR A 67 8.311 -84.841 -18.088 1.00 52.41 C ATOM 0 H THR A 67 10.269 -82.918 -16.719 1.00 33.35 H new ATOM 0 HA THR A 67 9.561 -81.849 -19.310 1.00 62.00 H new ATOM 0 HB THR A 67 9.481 -84.251 -19.782 1.00 20.20 H new ATOM 0 HG1 THR A 67 7.386 -84.235 -20.591 1.00 12.03 H new ATOM 0 HG21 THR A 67 7.915 -85.736 -18.568 1.00 52.41 H new ATOM 0 HG22 THR A 67 9.189 -85.105 -17.498 1.00 52.41 H new ATOM 0 HG23 THR A 67 7.550 -84.412 -17.435 1.00 52.41 H new ATOM 1019 N ASN A 68 7.200 -81.261 -18.253 1.00 24.14 N ATOM 1020 CA ASN A 68 6.073 -80.674 -17.523 1.00 73.40 C ATOM 1021 C ASN A 68 4.886 -81.637 -17.492 1.00 73.12 C ATOM 1022 O ASN A 68 4.770 -82.523 -18.341 1.00 10.52 O ATOM 1023 CB ASN A 68 5.661 -79.334 -18.162 1.00 71.15 C ATOM 1024 CG ASN A 68 4.316 -78.817 -17.663 1.00 11.14 C ATOM 1025 OD1 ASN A 68 3.282 -79.011 -18.304 1.00 14.14 O ATOM 1026 ND2 ASN A 68 4.319 -78.168 -16.508 1.00 71.23 N ATOM 0 H ASN A 68 7.156 -81.135 -19.264 1.00 24.14 H new ATOM 0 HA ASN A 68 6.389 -80.489 -16.496 1.00 73.40 H new ATOM 0 HB2 ASN A 68 6.429 -78.589 -17.954 1.00 71.15 H new ATOM 0 HB3 ASN A 68 5.618 -79.454 -19.245 1.00 71.15 H new ATOM 0 HD21 ASN A 68 3.445 -77.810 -16.122 1.00 71.23 H new ATOM 0 HD22 ASN A 68 5.195 -78.026 -16.005 1.00 71.23 H new ATOM 1033 N ASN A 69 4.028 -81.473 -16.487 1.00 74.00 N ATOM 1034 CA ASN A 69 2.786 -82.233 -16.379 1.00 52.24 C ATOM 1035 C ASN A 69 1.615 -81.257 -16.355 1.00 5.25 C ATOM 1036 O ASN A 69 1.734 -80.160 -15.797 1.00 52.52 O ATOM 1037 CB ASN A 69 2.750 -83.074 -15.086 1.00 72.13 C ATOM 1038 CG ASN A 69 4.004 -83.902 -14.837 1.00 72.22 C ATOM 1039 OD1 ASN A 69 4.363 -84.154 -13.683 1.00 2.34 O ATOM 1040 ND2 ASN A 69 4.671 -84.337 -15.892 1.00 31.15 N ATOM 0 H ASN A 69 4.175 -80.810 -15.726 1.00 74.00 H new ATOM 0 HA ASN A 69 2.721 -82.907 -17.233 1.00 52.24 H new ATOM 0 HB2 ASN A 69 2.596 -82.407 -14.238 1.00 72.13 H new ATOM 0 HB3 ASN A 69 1.890 -83.743 -15.126 1.00 72.13 H new ATOM 0 HD21 ASN A 69 5.512 -84.901 -15.767 1.00 31.15 H new ATOM 0 HD22 ASN A 69 4.345 -84.109 -16.831 1.00 31.15 H new ATOM 1047 N GLU A 70 0.484 -81.657 -16.928 1.00 63.52 N ATOM 1048 CA GLU A 70 -0.716 -80.816 -16.929 1.00 54.22 C ATOM 1049 C GLU A 70 -1.262 -80.686 -15.504 1.00 23.41 C ATOM 1050 O GLU A 70 -2.098 -79.829 -15.215 1.00 22.31 O ATOM 1051 CB GLU A 70 -1.783 -81.400 -17.871 1.00 35.24 C ATOM 1052 CG GLU A 70 -2.995 -80.492 -18.073 1.00 73.50 C ATOM 1053 CD GLU A 70 -4.006 -81.070 -19.048 1.00 44.50 C ATOM 1054 OE1 GLU A 70 -3.886 -80.809 -20.264 1.00 22.30 O ATOM 1055 OE2 GLU A 70 -4.924 -81.792 -18.605 1.00 32.11 O ATOM 0 H GLU A 70 0.370 -82.555 -17.397 1.00 63.52 H new ATOM 0 HA GLU A 70 -0.452 -79.823 -17.293 1.00 54.22 H new ATOM 0 HB2 GLU A 70 -1.327 -81.601 -18.840 1.00 35.24 H new ATOM 0 HB3 GLU A 70 -2.121 -82.357 -17.473 1.00 35.24 H new ATOM 0 HG2 GLU A 70 -3.480 -80.322 -17.112 1.00 73.50 H new ATOM 0 HG3 GLU A 70 -2.659 -79.521 -18.437 1.00 73.50 H new ATOM 1062 N ASP A 71 -0.758 -81.541 -14.616 1.00 53.44 N ATOM 1063 CA ASP A 71 -1.111 -81.503 -13.195 1.00 52.32 C ATOM 1064 C ASP A 71 -0.610 -80.217 -12.538 1.00 60.33 C ATOM 1065 O ASP A 71 -0.965 -79.915 -11.393 1.00 61.33 O ATOM 1066 CB ASP A 71 -0.499 -82.703 -12.454 1.00 72.43 C ATOM 1067 CG ASP A 71 -0.959 -84.046 -13.000 1.00 73.01 C ATOM 1068 OD1 ASP A 71 -0.384 -84.508 -14.007 1.00 44.11 O ATOM 1069 OD2 ASP A 71 -1.878 -84.655 -12.411 1.00 23.34 O ATOM 0 H ASP A 71 -0.096 -82.278 -14.858 1.00 53.44 H new ATOM 0 HA ASP A 71 -2.198 -81.542 -13.129 1.00 52.32 H new ATOM 0 HB2 ASP A 71 0.588 -82.645 -12.519 1.00 72.43 H new ATOM 0 HB3 ASP A 71 -0.759 -82.640 -11.397 1.00 72.43 H new ATOM 1074 N GLY A 72 0.223 -79.465 -13.260 1.00 2.22 N ATOM 1075 CA GLY A 72 0.853 -78.288 -12.690 1.00 24.21 C ATOM 1076 C GLY A 72 2.108 -78.663 -11.934 1.00 64.40 C ATOM 1077 O GLY A 72 2.523 -77.973 -11.001 1.00 24.14 O ATOM 0 H GLY A 72 0.471 -79.653 -14.231 1.00 2.22 H new ATOM 0 HA2 GLY A 72 1.098 -77.581 -13.483 1.00 24.21 H new ATOM 0 HA3 GLY A 72 0.156 -77.786 -12.020 1.00 24.21 H new ATOM 1081 N SER A 73 2.705 -79.778 -12.344 1.00 74.30 N ATOM 1082 CA SER A 73 3.921 -80.283 -11.727 1.00 53.52 C ATOM 1083 C SER A 73 4.993 -80.532 -12.785 1.00 5.24 C ATOM 1084 O SER A 73 4.680 -80.874 -13.926 1.00 20.32 O ATOM 1085 CB SER A 73 3.621 -81.574 -10.948 1.00 23.04 C ATOM 1086 OG SER A 73 2.992 -82.550 -11.768 1.00 33.31 O ATOM 0 H SER A 73 2.358 -80.354 -13.111 1.00 74.30 H new ATOM 0 HA SER A 73 4.297 -79.534 -11.030 1.00 53.52 H new ATOM 0 HB2 SER A 73 4.549 -81.980 -10.546 1.00 23.04 H new ATOM 0 HB3 SER A 73 2.979 -81.345 -10.098 1.00 23.04 H new ATOM 0 HG SER A 73 3.661 -82.972 -12.347 1.00 33.31 H new ATOM 1092 N VAL A 74 6.248 -80.330 -12.410 1.00 2.14 N ATOM 1093 CA VAL A 74 7.379 -80.616 -13.284 1.00 23.14 C ATOM 1094 C VAL A 74 8.068 -81.894 -12.817 1.00 45.15 C ATOM 1095 O VAL A 74 8.508 -81.979 -11.670 1.00 50.12 O ATOM 1096 CB VAL A 74 8.396 -79.448 -13.290 1.00 61.55 C ATOM 1097 CG1 VAL A 74 9.556 -79.738 -14.243 1.00 25.24 C ATOM 1098 CG2 VAL A 74 7.703 -78.140 -13.658 1.00 44.21 C ATOM 0 H VAL A 74 6.511 -79.965 -11.495 1.00 2.14 H new ATOM 0 HA VAL A 74 7.004 -80.743 -14.300 1.00 23.14 H new ATOM 0 HB VAL A 74 8.807 -79.347 -12.286 1.00 61.55 H new ATOM 0 HG11 VAL A 74 10.256 -78.903 -14.229 1.00 25.24 H new ATOM 0 HG12 VAL A 74 10.069 -80.646 -13.926 1.00 25.24 H new ATOM 0 HG13 VAL A 74 9.171 -79.872 -15.254 1.00 25.24 H new ATOM 0 HG21 VAL A 74 8.432 -77.329 -13.658 1.00 44.21 H new ATOM 0 HG22 VAL A 74 7.260 -78.229 -14.650 1.00 44.21 H new ATOM 0 HG23 VAL A 74 6.921 -77.925 -12.930 1.00 44.21 H new ATOM 1108 N SER A 75 8.142 -82.886 -13.694 1.00 24.41 N ATOM 1109 CA SER A 75 8.686 -84.191 -13.336 1.00 33.53 C ATOM 1110 C SER A 75 9.929 -84.508 -14.166 1.00 25.55 C ATOM 1111 O SER A 75 10.157 -83.904 -15.213 1.00 44.43 O ATOM 1112 CB SER A 75 7.617 -85.272 -13.542 1.00 45.42 C ATOM 1113 OG SER A 75 7.174 -85.301 -14.891 1.00 50.11 O ATOM 0 H SER A 75 7.831 -82.812 -14.663 1.00 24.41 H new ATOM 0 HA SER A 75 8.978 -84.171 -12.286 1.00 33.53 H new ATOM 0 HB2 SER A 75 8.022 -86.246 -13.268 1.00 45.42 H new ATOM 0 HB3 SER A 75 6.771 -85.082 -12.882 1.00 45.42 H new ATOM 0 HG SER A 75 6.784 -86.178 -15.088 1.00 50.11 H new ATOM 1119 N GLY A 76 10.728 -85.457 -13.691 1.00 32.44 N ATOM 1120 CA GLY A 76 11.925 -85.858 -14.404 1.00 51.54 C ATOM 1121 C GLY A 76 12.775 -86.813 -13.591 1.00 43.42 C ATOM 1122 O GLY A 76 12.305 -87.372 -12.603 1.00 53.55 O ATOM 0 H GLY A 76 10.565 -85.959 -12.818 1.00 32.44 H new ATOM 0 HA2 GLY A 76 11.645 -86.332 -15.345 1.00 51.54 H new ATOM 0 HA3 GLY A 76 12.511 -84.974 -14.655 1.00 51.54 H new ATOM 1126 N VAL A 77 14.021 -87.008 -14.011 1.00 42.05 N ATOM 1127 CA VAL A 77 14.964 -87.869 -13.301 1.00 43.44 C ATOM 1128 C VAL A 77 16.354 -87.237 -13.315 1.00 74.14 C ATOM 1129 O VAL A 77 16.761 -86.659 -14.329 1.00 42.33 O ATOM 1130 CB VAL A 77 15.052 -89.287 -13.934 1.00 53.04 C ATOM 1131 CG1 VAL A 77 15.971 -90.188 -13.112 1.00 73.25 C ATOM 1132 CG2 VAL A 77 13.667 -89.920 -14.084 1.00 44.22 C ATOM 0 H VAL A 77 14.406 -86.575 -14.851 1.00 42.05 H new ATOM 0 HA VAL A 77 14.600 -87.973 -12.279 1.00 43.44 H new ATOM 0 HB VAL A 77 15.476 -89.179 -14.932 1.00 53.04 H new ATOM 0 HG11 VAL A 77 16.019 -91.175 -13.572 1.00 73.25 H new ATOM 0 HG12 VAL A 77 16.971 -89.755 -13.078 1.00 73.25 H new ATOM 0 HG13 VAL A 77 15.580 -90.278 -12.098 1.00 73.25 H new ATOM 0 HG21 VAL A 77 13.766 -90.910 -14.529 1.00 44.22 H new ATOM 0 HG22 VAL A 77 13.199 -90.008 -13.103 1.00 44.22 H new ATOM 0 HG23 VAL A 77 13.048 -89.293 -14.726 1.00 44.22 H new ATOM 1142 N VAL A 78 17.064 -87.338 -12.192 1.00 11.12 N ATOM 1143 CA VAL A 78 18.443 -86.868 -12.087 1.00 13.11 C ATOM 1144 C VAL A 78 19.359 -88.054 -11.777 1.00 3.40 C ATOM 1145 O VAL A 78 18.990 -88.946 -11.003 1.00 63.53 O ATOM 1146 CB VAL A 78 18.611 -85.790 -10.982 1.00 55.53 C ATOM 1147 CG1 VAL A 78 18.604 -86.418 -9.588 1.00 52.34 C ATOM 1148 CG2 VAL A 78 19.883 -84.976 -11.200 1.00 23.42 C ATOM 0 H VAL A 78 16.700 -87.747 -11.332 1.00 11.12 H new ATOM 0 HA VAL A 78 18.712 -86.412 -13.040 1.00 13.11 H new ATOM 0 HB VAL A 78 17.758 -85.114 -11.050 1.00 55.53 H new ATOM 0 HG11 VAL A 78 18.724 -85.637 -8.837 1.00 52.34 H new ATOM 0 HG12 VAL A 78 17.658 -86.935 -9.427 1.00 52.34 H new ATOM 0 HG13 VAL A 78 19.425 -87.130 -9.505 1.00 52.34 H new ATOM 0 HG21 VAL A 78 19.976 -84.228 -10.412 1.00 23.42 H new ATOM 0 HG22 VAL A 78 20.748 -85.639 -11.175 1.00 23.42 H new ATOM 0 HG23 VAL A 78 19.835 -84.478 -12.169 1.00 23.42 H new ATOM 1158 N GLN A 79 20.535 -88.075 -12.392 1.00 61.04 N ATOM 1159 CA GLN A 79 21.481 -89.173 -12.219 1.00 72.34 C ATOM 1160 C GLN A 79 22.906 -88.617 -12.175 1.00 51.25 C ATOM 1161 O GLN A 79 23.278 -87.788 -13.012 1.00 1.41 O ATOM 1162 CB GLN A 79 21.346 -90.174 -13.385 1.00 75.34 C ATOM 1163 CG GLN A 79 19.920 -90.314 -13.921 1.00 65.40 C ATOM 1164 CD GLN A 79 19.826 -91.133 -15.195 1.00 13.34 C ATOM 1165 OE1 GLN A 79 18.995 -90.856 -16.058 1.00 12.03 O ATOM 1166 NE2 GLN A 79 20.637 -92.171 -15.307 1.00 41.24 N ATOM 0 H GLN A 79 20.859 -87.339 -13.020 1.00 61.04 H new ATOM 0 HA GLN A 79 21.265 -89.689 -11.284 1.00 72.34 H new ATOM 0 HB2 GLN A 79 22.000 -89.859 -14.198 1.00 75.34 H new ATOM 0 HB3 GLN A 79 21.697 -91.152 -13.054 1.00 75.34 H new ATOM 0 HG2 GLN A 79 19.297 -90.776 -13.155 1.00 65.40 H new ATOM 0 HG3 GLN A 79 19.512 -89.321 -14.107 1.00 65.40 H new ATOM 0 HE21 GLN A 79 21.314 -92.371 -14.571 1.00 41.24 H new ATOM 0 HE22 GLN A 79 20.585 -92.772 -16.129 1.00 41.24 H new ATOM 1175 N GLY A 80 23.688 -89.053 -11.191 1.00 73.20 N ATOM 1176 CA GLY A 80 25.078 -88.631 -11.085 1.00 70.11 C ATOM 1177 C GLY A 80 25.630 -88.843 -9.686 1.00 45.11 C ATOM 1178 O GLY A 80 25.049 -89.598 -8.907 1.00 30.00 O ATOM 0 H GLY A 80 23.383 -89.695 -10.460 1.00 73.20 H new ATOM 0 HA2 GLY A 80 25.682 -89.188 -11.802 1.00 70.11 H new ATOM 0 HA3 GLY A 80 25.159 -87.577 -11.351 1.00 70.11 H new ATOM 1182 N PRO A 81 26.763 -88.202 -9.339 1.00 21.24 N ATOM 1183 CA PRO A 81 27.323 -88.258 -7.981 1.00 24.25 C ATOM 1184 C PRO A 81 26.432 -87.509 -6.991 1.00 43.11 C ATOM 1185 O PRO A 81 25.980 -86.400 -7.278 1.00 61.12 O ATOM 1186 CB PRO A 81 28.688 -87.571 -8.122 1.00 14.12 C ATOM 1187 CG PRO A 81 28.549 -86.689 -9.317 1.00 1.43 C ATOM 1188 CD PRO A 81 27.588 -87.382 -10.245 1.00 73.32 C ATOM 0 HA PRO A 81 27.401 -89.275 -7.598 1.00 24.25 H new ATOM 0 HB2 PRO A 81 28.934 -86.994 -7.231 1.00 14.12 H new ATOM 0 HB3 PRO A 81 29.486 -88.301 -8.260 1.00 14.12 H new ATOM 0 HG2 PRO A 81 28.174 -85.706 -9.033 1.00 1.43 H new ATOM 0 HG3 PRO A 81 29.514 -86.535 -9.801 1.00 1.43 H new ATOM 0 HD2 PRO A 81 26.982 -86.667 -10.802 1.00 73.32 H new ATOM 0 HD3 PRO A 81 28.111 -87.997 -10.978 1.00 73.32 H new ATOM 1196 N LYS A 82 26.205 -88.105 -5.821 1.00 34.24 N ATOM 1197 CA LYS A 82 25.239 -87.576 -4.856 1.00 65.22 C ATOM 1198 C LYS A 82 25.520 -86.117 -4.491 1.00 10.03 C ATOM 1199 O LYS A 82 24.619 -85.405 -4.055 1.00 13.55 O ATOM 1200 CB LYS A 82 25.183 -88.469 -3.596 1.00 54.13 C ATOM 1201 CG LYS A 82 26.451 -88.485 -2.727 1.00 14.43 C ATOM 1202 CD LYS A 82 26.517 -87.301 -1.752 1.00 71.14 C ATOM 1203 CE LYS A 82 25.259 -87.192 -0.890 1.00 51.01 C ATOM 1204 NZ LYS A 82 25.332 -86.052 0.063 1.00 4.33 N ATOM 0 H LYS A 82 26.678 -88.956 -5.517 1.00 34.24 H new ATOM 0 HA LYS A 82 24.260 -87.594 -5.335 1.00 65.22 H new ATOM 0 HB2 LYS A 82 24.347 -88.141 -2.979 1.00 54.13 H new ATOM 0 HB3 LYS A 82 24.967 -89.491 -3.908 1.00 54.13 H new ATOM 0 HG2 LYS A 82 26.488 -89.417 -2.163 1.00 14.43 H new ATOM 0 HG3 LYS A 82 27.329 -88.468 -3.373 1.00 14.43 H new ATOM 0 HD2 LYS A 82 27.389 -87.412 -1.107 1.00 71.14 H new ATOM 0 HD3 LYS A 82 26.652 -86.377 -2.314 1.00 71.14 H new ATOM 0 HE2 LYS A 82 24.388 -87.071 -1.534 1.00 51.01 H new ATOM 0 HE3 LYS A 82 25.118 -88.120 -0.335 1.00 51.01 H new ATOM 0 HZ1 LYS A 82 24.459 -86.015 0.627 1.00 4.33 H new ATOM 0 HZ2 LYS A 82 26.148 -86.180 0.695 1.00 4.33 H new ATOM 0 HZ3 LYS A 82 25.440 -85.163 -0.466 1.00 4.33 H new ATOM 1218 N GLU A 83 26.761 -85.672 -4.674 1.00 45.34 N ATOM 1219 CA GLU A 83 27.128 -84.292 -4.360 1.00 53.14 C ATOM 1220 C GLU A 83 26.487 -83.337 -5.360 1.00 41.52 C ATOM 1221 O GLU A 83 25.833 -82.366 -4.983 1.00 1.31 O ATOM 1222 CB GLU A 83 28.648 -84.111 -4.377 1.00 53.44 C ATOM 1223 CG GLU A 83 29.397 -85.106 -3.502 1.00 34.25 C ATOM 1224 CD GLU A 83 30.827 -84.679 -3.220 1.00 42.22 C ATOM 1225 OE1 GLU A 83 31.658 -84.703 -4.152 1.00 25.22 O ATOM 1226 OE2 GLU A 83 31.123 -84.297 -2.066 1.00 53.32 O ATOM 0 H GLU A 83 27.526 -86.242 -5.036 1.00 45.34 H new ATOM 0 HA GLU A 83 26.763 -84.066 -3.358 1.00 53.14 H new ATOM 0 HB2 GLU A 83 29.004 -84.205 -5.403 1.00 53.44 H new ATOM 0 HB3 GLU A 83 28.887 -83.100 -4.047 1.00 53.44 H new ATOM 0 HG2 GLU A 83 28.865 -85.226 -2.558 1.00 34.25 H new ATOM 0 HG3 GLU A 83 29.403 -86.080 -3.990 1.00 34.25 H new ATOM 1233 N GLN A 84 26.675 -83.626 -6.641 1.00 71.32 N ATOM 1234 CA GLN A 84 26.119 -82.794 -7.702 1.00 73.41 C ATOM 1235 C GLN A 84 24.605 -82.975 -7.768 1.00 4.41 C ATOM 1236 O GLN A 84 23.866 -82.035 -8.077 1.00 35.12 O ATOM 1237 CB GLN A 84 26.779 -83.120 -9.050 1.00 70.43 C ATOM 1238 CG GLN A 84 28.205 -82.577 -9.197 1.00 43.51 C ATOM 1239 CD GLN A 84 29.158 -83.053 -8.110 1.00 53.33 C ATOM 1240 OE1 GLN A 84 29.799 -84.093 -8.240 1.00 64.14 O ATOM 1241 NE2 GLN A 84 29.267 -82.294 -7.029 1.00 5.13 N ATOM 0 H GLN A 84 27.208 -84.430 -6.971 1.00 71.32 H new ATOM 0 HA GLN A 84 26.329 -81.748 -7.478 1.00 73.41 H new ATOM 0 HB2 GLN A 84 26.799 -84.202 -9.180 1.00 70.43 H new ATOM 0 HB3 GLN A 84 26.163 -82.713 -9.852 1.00 70.43 H new ATOM 0 HG2 GLN A 84 28.599 -82.875 -10.169 1.00 43.51 H new ATOM 0 HG3 GLN A 84 28.172 -81.488 -9.187 1.00 43.51 H new ATOM 0 HE21 GLN A 84 28.721 -81.436 -6.951 1.00 5.13 H new ATOM 0 HE22 GLN A 84 29.897 -82.568 -6.275 1.00 5.13 H new ATOM 1250 N VAL A 85 24.145 -84.184 -7.457 1.00 33.13 N ATOM 1251 CA VAL A 85 22.720 -84.445 -7.319 1.00 22.34 C ATOM 1252 C VAL A 85 22.152 -83.565 -6.208 1.00 73.43 C ATOM 1253 O VAL A 85 21.093 -82.958 -6.363 1.00 53.31 O ATOM 1254 CB VAL A 85 22.436 -85.937 -7.006 1.00 44.11 C ATOM 1255 CG1 VAL A 85 20.953 -86.167 -6.708 1.00 71.00 C ATOM 1256 CG2 VAL A 85 22.900 -86.827 -8.160 1.00 25.24 C ATOM 0 H VAL A 85 24.740 -84.997 -7.296 1.00 33.13 H new ATOM 0 HA VAL A 85 22.238 -84.210 -8.268 1.00 22.34 H new ATOM 0 HB VAL A 85 23.001 -86.206 -6.114 1.00 44.11 H new ATOM 0 HG11 VAL A 85 20.785 -87.222 -6.492 1.00 71.00 H new ATOM 0 HG12 VAL A 85 20.658 -85.569 -5.846 1.00 71.00 H new ATOM 0 HG13 VAL A 85 20.358 -85.874 -7.573 1.00 71.00 H new ATOM 0 HG21 VAL A 85 22.692 -87.870 -7.921 1.00 25.24 H new ATOM 0 HG22 VAL A 85 22.368 -86.550 -9.070 1.00 25.24 H new ATOM 0 HG23 VAL A 85 23.971 -86.696 -8.312 1.00 25.24 H new ATOM 1266 N ASP A 86 22.886 -83.478 -5.096 1.00 15.30 N ATOM 1267 CA ASP A 86 22.501 -82.619 -3.973 1.00 63.23 C ATOM 1268 C ASP A 86 22.482 -81.156 -4.411 1.00 64.31 C ATOM 1269 O ASP A 86 21.615 -80.389 -3.998 1.00 72.04 O ATOM 1270 CB ASP A 86 23.460 -82.807 -2.789 1.00 35.40 C ATOM 1271 CG ASP A 86 23.075 -81.973 -1.574 1.00 14.31 C ATOM 1272 OD1 ASP A 86 22.146 -82.382 -0.839 1.00 61.35 O ATOM 1273 OD2 ASP A 86 23.709 -80.922 -1.335 1.00 32.10 O ATOM 0 H ASP A 86 23.753 -83.994 -4.949 1.00 15.30 H new ATOM 0 HA ASP A 86 21.500 -82.904 -3.650 1.00 63.23 H new ATOM 0 HB2 ASP A 86 23.480 -83.860 -2.508 1.00 35.40 H new ATOM 0 HB3 ASP A 86 24.470 -82.541 -3.101 1.00 35.40 H new ATOM 1278 N ALA A 87 23.441 -80.783 -5.262 1.00 21.34 N ATOM 1279 CA ALA A 87 23.483 -79.444 -5.843 1.00 34.53 C ATOM 1280 C ALA A 87 22.206 -79.174 -6.633 1.00 20.20 C ATOM 1281 O ALA A 87 21.641 -78.075 -6.583 1.00 62.15 O ATOM 1282 CB ALA A 87 24.705 -79.294 -6.748 1.00 10.13 C ATOM 0 H ALA A 87 24.200 -81.394 -5.563 1.00 21.34 H new ATOM 0 HA ALA A 87 23.558 -78.716 -5.035 1.00 34.53 H new ATOM 0 HB1 ALA A 87 24.722 -78.291 -7.173 1.00 10.13 H new ATOM 0 HB2 ALA A 87 25.612 -79.456 -6.165 1.00 10.13 H new ATOM 0 HB3 ALA A 87 24.655 -80.028 -7.552 1.00 10.13 H new ATOM 1288 N PHE A 88 21.760 -80.195 -7.360 1.00 23.24 N ATOM 1289 CA PHE A 88 20.545 -80.101 -8.160 1.00 53.22 C ATOM 1290 C PHE A 88 19.312 -80.053 -7.250 1.00 41.43 C ATOM 1291 O PHE A 88 18.347 -79.342 -7.533 1.00 24.23 O ATOM 1292 CB PHE A 88 20.462 -81.287 -9.134 1.00 13.44 C ATOM 1293 CG PHE A 88 19.625 -81.010 -10.359 1.00 60.45 C ATOM 1294 CD1 PHE A 88 20.194 -80.406 -11.473 1.00 2.04 C ATOM 1295 CD2 PHE A 88 18.279 -81.341 -10.399 1.00 41.43 C ATOM 1296 CE1 PHE A 88 19.440 -80.148 -12.601 1.00 65.45 C ATOM 1297 CE2 PHE A 88 17.520 -81.085 -11.525 1.00 43.45 C ATOM 1298 CZ PHE A 88 18.101 -80.485 -12.625 1.00 72.11 C ATOM 0 H PHE A 88 22.226 -81.101 -7.411 1.00 23.24 H new ATOM 0 HA PHE A 88 20.573 -79.180 -8.742 1.00 53.22 H new ATOM 0 HB2 PHE A 88 21.470 -81.559 -9.448 1.00 13.44 H new ATOM 0 HB3 PHE A 88 20.048 -82.148 -8.609 1.00 13.44 H new ATOM 0 HD1 PHE A 88 21.239 -80.135 -11.457 1.00 2.04 H new ATOM 0 HD2 PHE A 88 17.818 -81.805 -9.539 1.00 41.43 H new ATOM 0 HE1 PHE A 88 19.897 -79.684 -13.463 1.00 65.45 H new ATOM 0 HE2 PHE A 88 16.474 -81.354 -11.545 1.00 43.45 H new ATOM 0 HZ PHE A 88 17.508 -80.279 -13.504 1.00 72.11 H new ATOM 1308 N VAL A 89 19.355 -80.803 -6.148 1.00 5.13 N ATOM 1309 CA VAL A 89 18.285 -80.770 -5.149 1.00 63.22 C ATOM 1310 C VAL A 89 18.179 -79.367 -4.550 1.00 22.42 C ATOM 1311 O VAL A 89 17.090 -78.801 -4.450 1.00 63.11 O ATOM 1312 CB VAL A 89 18.523 -81.787 -3.998 1.00 62.24 C ATOM 1313 CG1 VAL A 89 17.428 -81.688 -2.937 1.00 41.30 C ATOM 1314 CG2 VAL A 89 18.621 -83.215 -4.532 1.00 71.34 C ATOM 0 H VAL A 89 20.119 -81.441 -5.924 1.00 5.13 H new ATOM 0 HA VAL A 89 17.361 -81.043 -5.659 1.00 63.22 H new ATOM 0 HB VAL A 89 19.474 -81.532 -3.531 1.00 62.24 H new ATOM 0 HG11 VAL A 89 17.622 -82.412 -2.145 1.00 41.30 H new ATOM 0 HG12 VAL A 89 17.419 -80.683 -2.516 1.00 41.30 H new ATOM 0 HG13 VAL A 89 16.460 -81.899 -3.392 1.00 41.30 H new ATOM 0 HG21 VAL A 89 18.788 -83.903 -3.703 1.00 71.34 H new ATOM 0 HG22 VAL A 89 17.693 -83.478 -5.041 1.00 71.34 H new ATOM 0 HG23 VAL A 89 19.452 -83.285 -5.234 1.00 71.34 H new ATOM 1324 N LYS A 90 19.326 -78.818 -4.161 1.00 72.24 N ATOM 1325 CA LYS A 90 19.397 -77.469 -3.612 1.00 63.21 C ATOM 1326 C LYS A 90 18.824 -76.471 -4.611 1.00 31.12 C ATOM 1327 O LYS A 90 18.042 -75.589 -4.252 1.00 14.12 O ATOM 1328 CB LYS A 90 20.852 -77.111 -3.264 1.00 12.24 C ATOM 1329 CG LYS A 90 21.047 -75.684 -2.753 1.00 73.32 C ATOM 1330 CD LYS A 90 20.195 -75.400 -1.521 1.00 40.24 C ATOM 1331 CE LYS A 90 20.370 -73.968 -1.033 1.00 1.53 C ATOM 1332 NZ LYS A 90 19.453 -73.651 0.091 1.00 60.33 N ATOM 0 H LYS A 90 20.227 -79.293 -4.217 1.00 72.24 H new ATOM 0 HA LYS A 90 18.806 -77.426 -2.697 1.00 63.21 H new ATOM 0 HB2 LYS A 90 21.213 -77.807 -2.507 1.00 12.24 H new ATOM 0 HB3 LYS A 90 21.470 -77.254 -4.150 1.00 12.24 H new ATOM 0 HG2 LYS A 90 22.098 -75.525 -2.512 1.00 73.32 H new ATOM 0 HG3 LYS A 90 20.791 -74.977 -3.542 1.00 73.32 H new ATOM 0 HD2 LYS A 90 19.146 -75.579 -1.755 1.00 40.24 H new ATOM 0 HD3 LYS A 90 20.466 -76.092 -0.724 1.00 40.24 H new ATOM 0 HE2 LYS A 90 21.401 -73.816 -0.714 1.00 1.53 H new ATOM 0 HE3 LYS A 90 20.186 -73.278 -1.857 1.00 1.53 H new ATOM 0 HZ1 LYS A 90 19.603 -72.668 0.395 1.00 60.33 H new ATOM 0 HZ2 LYS A 90 18.468 -73.771 -0.220 1.00 60.33 H new ATOM 0 HZ3 LYS A 90 19.645 -74.292 0.887 1.00 60.33 H new ATOM 1346 N TYR A 91 19.202 -76.638 -5.876 1.00 10.11 N ATOM 1347 CA TYR A 91 18.699 -75.797 -6.953 1.00 12.44 C ATOM 1348 C TYR A 91 17.184 -75.945 -7.082 1.00 44.40 C ATOM 1349 O TYR A 91 16.464 -74.971 -7.319 1.00 2.03 O ATOM 1350 CB TYR A 91 19.391 -76.168 -8.271 1.00 54.24 C ATOM 1351 CG TYR A 91 18.741 -75.559 -9.497 1.00 52.31 C ATOM 1352 CD1 TYR A 91 18.998 -74.245 -9.870 1.00 71.31 C ATOM 1353 CD2 TYR A 91 17.868 -76.305 -10.281 1.00 52.30 C ATOM 1354 CE1 TYR A 91 18.401 -73.692 -10.985 1.00 23.41 C ATOM 1355 CE2 TYR A 91 17.267 -75.760 -11.395 1.00 24.51 C ATOM 1356 CZ TYR A 91 17.537 -74.452 -11.744 1.00 4.44 C ATOM 1357 OH TYR A 91 16.949 -73.906 -12.859 1.00 53.33 O ATOM 0 H TYR A 91 19.861 -77.355 -6.179 1.00 10.11 H new ATOM 0 HA TYR A 91 18.921 -74.755 -6.721 1.00 12.44 H new ATOM 0 HB2 TYR A 91 20.432 -75.848 -8.226 1.00 54.24 H new ATOM 0 HB3 TYR A 91 19.396 -77.253 -8.375 1.00 54.24 H new ATOM 0 HD1 TYR A 91 19.675 -73.647 -9.278 1.00 71.31 H new ATOM 0 HD2 TYR A 91 17.657 -77.330 -10.012 1.00 52.30 H new ATOM 0 HE1 TYR A 91 18.610 -72.669 -11.261 1.00 23.41 H new ATOM 0 HE2 TYR A 91 16.589 -76.353 -11.991 1.00 24.51 H new ATOM 0 HH TYR A 91 16.037 -73.620 -12.641 1.00 53.33 H new ATOM 1367 N LEU A 92 16.715 -77.169 -6.911 1.00 51.34 N ATOM 1368 CA LEU A 92 15.297 -77.479 -7.032 1.00 60.14 C ATOM 1369 C LEU A 92 14.512 -76.807 -5.900 1.00 5.34 C ATOM 1370 O LEU A 92 13.437 -76.248 -6.120 1.00 21.55 O ATOM 1371 CB LEU A 92 15.096 -79.005 -7.002 1.00 42.10 C ATOM 1372 CG LEU A 92 14.020 -79.565 -7.948 1.00 14.12 C ATOM 1373 CD1 LEU A 92 12.636 -79.011 -7.618 1.00 1.11 C ATOM 1374 CD2 LEU A 92 14.384 -79.276 -9.406 1.00 4.50 C ATOM 0 H LEU A 92 17.301 -77.973 -6.686 1.00 51.34 H new ATOM 0 HA LEU A 92 14.924 -77.095 -7.981 1.00 60.14 H new ATOM 0 HB2 LEU A 92 16.046 -79.481 -7.244 1.00 42.10 H new ATOM 0 HB3 LEU A 92 14.843 -79.298 -5.983 1.00 42.10 H new ATOM 0 HG LEU A 92 13.984 -80.645 -7.805 1.00 14.12 H new ATOM 0 HD11 LEU A 92 11.903 -79.429 -8.307 1.00 1.11 H new ATOM 0 HD12 LEU A 92 12.370 -79.282 -6.596 1.00 1.11 H new ATOM 0 HD13 LEU A 92 12.646 -77.925 -7.714 1.00 1.11 H new ATOM 0 HD21 LEU A 92 13.612 -79.679 -10.061 1.00 4.50 H new ATOM 0 HD22 LEU A 92 14.460 -78.199 -9.555 1.00 4.50 H new ATOM 0 HD23 LEU A 92 15.340 -79.743 -9.642 1.00 4.50 H new ATOM 1386 N HIS A 93 15.068 -76.866 -4.689 1.00 5.42 N ATOM 1387 CA HIS A 93 14.457 -76.240 -3.514 1.00 23.34 C ATOM 1388 C HIS A 93 14.441 -74.719 -3.654 1.00 11.23 C ATOM 1389 O HIS A 93 13.614 -74.039 -3.039 1.00 14.15 O ATOM 1390 CB HIS A 93 15.201 -76.645 -2.228 1.00 35.40 C ATOM 1391 CG HIS A 93 14.856 -78.017 -1.725 1.00 30.45 C ATOM 1392 ND1 HIS A 93 14.997 -79.236 -2.296 1.00 2.31 N flip ATOM 1393 CD2 HIS A 93 14.302 -78.244 -0.483 1.00 73.34 C flip ATOM 1394 CE1 HIS A 93 14.531 -80.166 -1.398 1.00 65.23 C flip ATOM 1395 NE2 HIS A 93 14.119 -79.539 -0.314 1.00 2.30 N flip ATOM 0 H HIS A 93 15.947 -77.345 -4.495 1.00 5.42 H new ATOM 0 HA HIS A 93 13.428 -76.593 -3.446 1.00 23.34 H new ATOM 0 HB2 HIS A 93 16.274 -76.597 -2.412 1.00 35.40 H new ATOM 0 HB3 HIS A 93 14.978 -75.917 -1.448 1.00 35.40 H new ATOM 0 HD1 HIS A 93 15.379 -79.429 -3.222 1.00 2.31 H new ATOM 0 HD2 HIS A 93 14.056 -77.480 0.239 1.00 73.34 H new ATOM 0 HE1 HIS A 93 14.506 -81.234 -1.554 1.00 65.23 H new ATOM 1404 N LYS A 94 15.368 -74.188 -4.449 1.00 64.43 N ATOM 1405 CA LYS A 94 15.390 -72.762 -4.756 1.00 13.01 C ATOM 1406 C LYS A 94 14.124 -72.380 -5.516 1.00 4.10 C ATOM 1407 O LYS A 94 13.463 -71.390 -5.191 1.00 53.20 O ATOM 1408 CB LYS A 94 16.633 -72.403 -5.580 1.00 13.44 C ATOM 1409 CG LYS A 94 17.944 -72.490 -4.803 1.00 34.11 C ATOM 1410 CD LYS A 94 19.161 -72.357 -5.719 1.00 31.12 C ATOM 1411 CE LYS A 94 19.084 -71.114 -6.597 1.00 75.41 C ATOM 1412 NZ LYS A 94 20.298 -70.949 -7.437 1.00 1.31 N ATOM 0 H LYS A 94 16.113 -74.725 -4.892 1.00 64.43 H new ATOM 0 HA LYS A 94 15.429 -72.203 -3.821 1.00 13.01 H new ATOM 0 HB2 LYS A 94 16.689 -73.069 -6.441 1.00 13.44 H new ATOM 0 HB3 LYS A 94 16.519 -71.390 -5.967 1.00 13.44 H new ATOM 0 HG2 LYS A 94 17.971 -71.705 -4.048 1.00 34.11 H new ATOM 0 HG3 LYS A 94 17.990 -73.442 -4.275 1.00 34.11 H new ATOM 0 HD2 LYS A 94 20.067 -72.318 -5.114 1.00 31.12 H new ATOM 0 HD3 LYS A 94 19.238 -73.242 -6.350 1.00 31.12 H new ATOM 0 HE2 LYS A 94 18.205 -71.177 -7.239 1.00 75.41 H new ATOM 0 HE3 LYS A 94 18.956 -70.233 -5.968 1.00 75.41 H new ATOM 0 HZ1 LYS A 94 20.204 -70.092 -8.018 1.00 1.31 H new ATOM 0 HZ2 LYS A 94 21.134 -70.862 -6.825 1.00 1.31 H new ATOM 0 HZ3 LYS A 94 20.407 -71.777 -8.057 1.00 1.31 H new ATOM 1426 N GLY A 95 13.789 -73.186 -6.518 1.00 31.54 N ATOM 1427 CA GLY A 95 12.578 -72.972 -7.285 1.00 21.24 C ATOM 1428 C GLY A 95 12.675 -71.782 -8.219 1.00 10.52 C ATOM 1429 O GLY A 95 13.710 -71.107 -8.280 1.00 3.03 O ATOM 0 H GLY A 95 14.341 -73.991 -6.814 1.00 31.54 H new ATOM 0 HA2 GLY A 95 12.359 -73.867 -7.867 1.00 21.24 H new ATOM 0 HA3 GLY A 95 11.742 -72.824 -6.601 1.00 21.24 H new ATOM 1433 N SER A 96 11.592 -71.523 -8.942 1.00 75.45 N ATOM 1434 CA SER A 96 11.539 -70.421 -9.895 1.00 64.44 C ATOM 1435 C SER A 96 11.466 -69.081 -9.154 1.00 73.22 C ATOM 1436 O SER A 96 10.876 -68.994 -8.073 1.00 41.20 O ATOM 1437 CB SER A 96 10.329 -70.600 -10.825 1.00 73.31 C ATOM 1438 OG SER A 96 10.191 -69.523 -11.741 1.00 75.44 O ATOM 0 H SER A 96 10.731 -72.067 -8.885 1.00 75.45 H new ATOM 0 HA SER A 96 12.446 -70.423 -10.499 1.00 64.44 H new ATOM 0 HB2 SER A 96 10.433 -71.534 -11.378 1.00 73.31 H new ATOM 0 HB3 SER A 96 9.422 -70.684 -10.226 1.00 73.31 H new ATOM 0 HG SER A 96 9.411 -69.678 -12.313 1.00 75.44 H new ATOM 1444 N PRO A 97 12.084 -68.022 -9.716 1.00 15.32 N ATOM 1445 CA PRO A 97 12.069 -66.683 -9.113 1.00 63.34 C ATOM 1446 C PRO A 97 10.671 -66.060 -9.116 1.00 3.15 C ATOM 1447 O PRO A 97 10.374 -65.183 -8.302 1.00 13.01 O ATOM 1448 CB PRO A 97 13.026 -65.863 -10.002 1.00 53.52 C ATOM 1449 CG PRO A 97 13.784 -66.871 -10.804 1.00 13.42 C ATOM 1450 CD PRO A 97 12.864 -68.046 -10.966 1.00 51.42 C ATOM 0 HA PRO A 97 12.368 -66.712 -8.065 1.00 63.34 H new ATOM 0 HB2 PRO A 97 12.474 -65.181 -10.649 1.00 53.52 H new ATOM 0 HB3 PRO A 97 13.699 -65.255 -9.398 1.00 53.52 H new ATOM 0 HG2 PRO A 97 14.071 -66.463 -11.773 1.00 13.42 H new ATOM 0 HG3 PRO A 97 14.704 -67.162 -10.296 1.00 13.42 H new ATOM 0 HD2 PRO A 97 12.226 -67.942 -11.844 1.00 51.42 H new ATOM 0 HD3 PRO A 97 13.415 -68.979 -11.081 1.00 51.42 H new ATOM 1458 N LYS A 98 9.824 -66.513 -10.040 1.00 53.54 N ATOM 1459 CA LYS A 98 8.469 -65.969 -10.182 1.00 24.34 C ATOM 1460 C LYS A 98 7.411 -67.036 -9.892 1.00 74.31 C ATOM 1461 O LYS A 98 6.294 -66.715 -9.479 1.00 21.32 O ATOM 1462 CB LYS A 98 8.270 -65.401 -11.598 1.00 51.22 C ATOM 1463 CG LYS A 98 9.284 -64.324 -11.984 1.00 43.41 C ATOM 1464 CD LYS A 98 9.210 -63.110 -11.059 1.00 31.02 C ATOM 1465 CE LYS A 98 10.227 -62.039 -11.443 1.00 2.21 C ATOM 1466 NZ LYS A 98 10.027 -61.553 -12.834 1.00 75.23 N ATOM 0 H LYS A 98 10.050 -67.255 -10.702 1.00 53.54 H new ATOM 0 HA LYS A 98 8.351 -65.166 -9.454 1.00 24.34 H new ATOM 0 HB2 LYS A 98 8.331 -66.217 -12.318 1.00 51.22 H new ATOM 0 HB3 LYS A 98 7.266 -64.984 -11.673 1.00 51.22 H new ATOM 0 HG2 LYS A 98 10.289 -64.744 -11.951 1.00 43.41 H new ATOM 0 HG3 LYS A 98 9.104 -64.008 -13.012 1.00 43.41 H new ATOM 0 HD2 LYS A 98 8.206 -62.687 -11.095 1.00 31.02 H new ATOM 0 HD3 LYS A 98 9.386 -63.426 -10.031 1.00 31.02 H new ATOM 0 HE2 LYS A 98 10.149 -61.200 -10.751 1.00 2.21 H new ATOM 0 HE3 LYS A 98 11.234 -62.443 -11.342 1.00 2.21 H new ATOM 0 HZ1 LYS A 98 10.596 -60.696 -12.987 1.00 75.23 H new ATOM 0 HZ2 LYS A 98 10.324 -62.290 -13.505 1.00 75.23 H new ATOM 0 HZ3 LYS A 98 9.022 -61.333 -12.984 1.00 75.23 H new ATOM 1480 N SER A 99 7.765 -68.299 -10.104 1.00 22.33 N ATOM 1481 CA SER A 99 6.848 -69.405 -9.847 1.00 33.13 C ATOM 1482 C SER A 99 7.208 -70.080 -8.522 1.00 51.15 C ATOM 1483 O SER A 99 8.155 -70.871 -8.454 1.00 65.20 O ATOM 1484 CB SER A 99 6.906 -70.421 -10.998 1.00 24.15 C ATOM 1485 OG SER A 99 6.895 -69.773 -12.261 1.00 42.35 O ATOM 0 H SER A 99 8.680 -68.583 -10.453 1.00 22.33 H new ATOM 0 HA SER A 99 5.832 -69.016 -9.780 1.00 33.13 H new ATOM 0 HB2 SER A 99 7.808 -71.027 -10.906 1.00 24.15 H new ATOM 0 HB3 SER A 99 6.057 -71.101 -10.929 1.00 24.15 H new ATOM 0 HG SER A 99 6.934 -70.445 -12.974 1.00 42.35 H new ATOM 1491 N VAL A 100 6.472 -69.739 -7.465 1.00 74.22 N ATOM 1492 CA VAL A 100 6.717 -70.306 -6.145 1.00 45.42 C ATOM 1493 C VAL A 100 6.244 -71.755 -6.104 1.00 51.00 C ATOM 1494 O VAL A 100 5.154 -72.072 -6.582 1.00 74.34 O ATOM 1495 CB VAL A 100 5.993 -69.494 -5.038 1.00 21.34 C ATOM 1496 CG1 VAL A 100 6.278 -70.080 -3.655 1.00 13.01 C ATOM 1497 CG2 VAL A 100 6.394 -68.019 -5.106 1.00 20.43 C ATOM 0 H VAL A 100 5.701 -69.072 -7.500 1.00 74.22 H new ATOM 0 HA VAL A 100 7.790 -70.263 -5.957 1.00 45.42 H new ATOM 0 HB VAL A 100 4.919 -69.562 -5.211 1.00 21.34 H new ATOM 0 HG11 VAL A 100 5.759 -69.493 -2.897 1.00 13.01 H new ATOM 0 HG12 VAL A 100 5.928 -71.112 -3.618 1.00 13.01 H new ATOM 0 HG13 VAL A 100 7.351 -70.054 -3.463 1.00 13.01 H new ATOM 0 HG21 VAL A 100 5.877 -67.465 -4.323 1.00 20.43 H new ATOM 0 HG22 VAL A 100 7.471 -67.928 -4.964 1.00 20.43 H new ATOM 0 HG23 VAL A 100 6.120 -67.612 -6.079 1.00 20.43 H new ATOM 1507 N VAL A 101 7.076 -72.630 -5.551 1.00 73.33 N ATOM 1508 CA VAL A 101 6.749 -74.047 -5.440 1.00 33.12 C ATOM 1509 C VAL A 101 5.913 -74.314 -4.189 1.00 14.21 C ATOM 1510 O VAL A 101 6.035 -73.609 -3.185 1.00 71.23 O ATOM 1511 CB VAL A 101 8.028 -74.926 -5.401 1.00 1.53 C ATOM 1512 CG1 VAL A 101 8.843 -74.749 -6.681 1.00 0.11 C ATOM 1513 CG2 VAL A 101 8.882 -74.606 -4.174 1.00 23.20 C ATOM 0 H VAL A 101 7.989 -72.381 -5.170 1.00 73.33 H new ATOM 0 HA VAL A 101 6.171 -74.313 -6.325 1.00 33.12 H new ATOM 0 HB VAL A 101 7.715 -75.968 -5.330 1.00 1.53 H new ATOM 0 HG11 VAL A 101 9.735 -75.373 -6.634 1.00 0.11 H new ATOM 0 HG12 VAL A 101 8.240 -75.043 -7.540 1.00 0.11 H new ATOM 0 HG13 VAL A 101 9.136 -73.704 -6.784 1.00 0.11 H new ATOM 0 HG21 VAL A 101 9.770 -75.237 -4.174 1.00 23.20 H new ATOM 0 HG22 VAL A 101 9.181 -73.558 -4.202 1.00 23.20 H new ATOM 0 HG23 VAL A 101 8.304 -74.794 -3.269 1.00 23.20 H new ATOM 1523 N LYS A 102 5.048 -75.317 -4.268 1.00 25.24 N ATOM 1524 CA LYS A 102 4.222 -75.715 -3.130 1.00 22.23 C ATOM 1525 C LYS A 102 4.856 -76.903 -2.405 1.00 52.51 C ATOM 1526 O LYS A 102 4.804 -76.994 -1.180 1.00 64.20 O ATOM 1527 CB LYS A 102 2.803 -76.071 -3.605 1.00 14.41 C ATOM 1528 CG LYS A 102 1.856 -76.603 -2.517 1.00 2.24 C ATOM 1529 CD LYS A 102 1.388 -75.524 -1.525 1.00 35.55 C ATOM 1530 CE LYS A 102 2.415 -75.232 -0.431 1.00 34.44 C ATOM 1531 NZ LYS A 102 1.876 -74.323 0.614 1.00 11.03 N ATOM 0 H LYS A 102 4.898 -75.873 -5.110 1.00 25.24 H new ATOM 0 HA LYS A 102 4.157 -74.879 -2.433 1.00 22.23 H new ATOM 0 HB2 LYS A 102 2.354 -75.183 -4.051 1.00 14.41 H new ATOM 0 HB3 LYS A 102 2.880 -76.820 -4.394 1.00 14.41 H new ATOM 0 HG2 LYS A 102 0.983 -77.049 -2.994 1.00 2.24 H new ATOM 0 HG3 LYS A 102 2.359 -77.397 -1.966 1.00 2.24 H new ATOM 0 HD2 LYS A 102 1.175 -74.605 -2.071 1.00 35.55 H new ATOM 0 HD3 LYS A 102 0.454 -75.844 -1.063 1.00 35.55 H new ATOM 0 HE2 LYS A 102 2.729 -76.168 0.030 1.00 34.44 H new ATOM 0 HE3 LYS A 102 3.303 -74.784 -0.878 1.00 34.44 H new ATOM 0 HZ1 LYS A 102 2.605 -74.152 1.335 1.00 11.03 H new ATOM 0 HZ2 LYS A 102 1.600 -73.419 0.179 1.00 11.03 H new ATOM 0 HZ3 LYS A 102 1.044 -74.761 1.060 1.00 11.03 H new ATOM 1545 N LYS A 103 5.458 -77.806 -3.175 1.00 12.03 N ATOM 1546 CA LYS A 103 6.077 -79.008 -2.616 1.00 72.44 C ATOM 1547 C LYS A 103 6.913 -79.724 -3.672 1.00 14.24 C ATOM 1548 O LYS A 103 6.500 -79.839 -4.831 1.00 53.50 O ATOM 1549 CB LYS A 103 4.997 -79.956 -2.065 1.00 61.22 C ATOM 1550 CG LYS A 103 5.540 -81.279 -1.520 1.00 3.35 C ATOM 1551 CD LYS A 103 4.436 -82.135 -0.900 1.00 22.31 C ATOM 1552 CE LYS A 103 3.825 -81.468 0.329 1.00 15.43 C ATOM 1553 NZ LYS A 103 2.757 -82.295 0.946 1.00 35.52 N ATOM 0 H LYS A 103 5.531 -77.729 -4.189 1.00 12.03 H new ATOM 0 HA LYS A 103 6.734 -78.707 -1.800 1.00 72.44 H new ATOM 0 HB2 LYS A 103 4.453 -79.445 -1.271 1.00 61.22 H new ATOM 0 HB3 LYS A 103 4.279 -80.170 -2.857 1.00 61.22 H new ATOM 0 HG2 LYS A 103 6.020 -81.834 -2.326 1.00 3.35 H new ATOM 0 HG3 LYS A 103 6.306 -81.076 -0.772 1.00 3.35 H new ATOM 0 HD2 LYS A 103 3.657 -82.316 -1.641 1.00 22.31 H new ATOM 0 HD3 LYS A 103 4.843 -83.107 -0.622 1.00 22.31 H new ATOM 0 HE2 LYS A 103 4.607 -81.281 1.065 1.00 15.43 H new ATOM 0 HE3 LYS A 103 3.414 -80.499 0.047 1.00 15.43 H new ATOM 0 HZ1 LYS A 103 2.372 -81.802 1.777 1.00 35.52 H new ATOM 0 HZ2 LYS A 103 1.997 -82.453 0.254 1.00 35.52 H new ATOM 0 HZ3 LYS A 103 3.153 -83.211 1.240 1.00 35.52 H new ATOM 1567 N VAL A 104 8.089 -80.190 -3.263 1.00 20.25 N ATOM 1568 CA VAL A 104 8.962 -80.979 -4.122 1.00 63.52 C ATOM 1569 C VAL A 104 8.935 -82.442 -3.679 1.00 23.40 C ATOM 1570 O VAL A 104 9.034 -82.742 -2.487 1.00 41.12 O ATOM 1571 CB VAL A 104 10.416 -80.429 -4.117 1.00 12.25 C ATOM 1572 CG1 VAL A 104 10.979 -80.339 -2.700 1.00 24.45 C ATOM 1573 CG2 VAL A 104 11.325 -81.274 -5.010 1.00 13.11 C ATOM 0 H VAL A 104 8.462 -80.031 -2.327 1.00 20.25 H new ATOM 0 HA VAL A 104 8.593 -80.908 -5.145 1.00 63.52 H new ATOM 0 HB VAL A 104 10.383 -79.418 -4.523 1.00 12.25 H new ATOM 0 HG11 VAL A 104 11.997 -79.951 -2.737 1.00 24.45 H new ATOM 0 HG12 VAL A 104 10.357 -79.672 -2.103 1.00 24.45 H new ATOM 0 HG13 VAL A 104 10.985 -81.331 -2.247 1.00 24.45 H new ATOM 0 HG21 VAL A 104 12.336 -80.867 -4.988 1.00 13.11 H new ATOM 0 HG22 VAL A 104 11.339 -82.301 -4.646 1.00 13.11 H new ATOM 0 HG23 VAL A 104 10.949 -81.256 -6.033 1.00 13.11 H new ATOM 1583 N SER A 105 8.798 -83.349 -4.636 1.00 70.15 N ATOM 1584 CA SER A 105 8.604 -84.760 -4.345 1.00 14.10 C ATOM 1585 C SER A 105 9.605 -85.587 -5.136 1.00 74.04 C ATOM 1586 O SER A 105 9.643 -85.524 -6.368 1.00 24.02 O ATOM 1587 CB SER A 105 7.169 -85.166 -4.693 1.00 4.52 C ATOM 1588 OG SER A 105 6.231 -84.378 -3.974 1.00 72.03 O ATOM 0 H SER A 105 8.818 -83.128 -5.631 1.00 70.15 H new ATOM 0 HA SER A 105 8.767 -84.941 -3.283 1.00 14.10 H new ATOM 0 HB2 SER A 105 7.003 -85.049 -5.764 1.00 4.52 H new ATOM 0 HB3 SER A 105 7.018 -86.220 -4.460 1.00 4.52 H new ATOM 0 HG SER A 105 5.321 -84.653 -4.213 1.00 72.03 H new ATOM 1594 N ILE A 106 10.429 -86.338 -4.425 1.00 60.24 N ATOM 1595 CA ILE A 106 11.498 -87.104 -5.043 1.00 10.30 C ATOM 1596 C ILE A 106 11.201 -88.600 -4.944 1.00 61.14 C ATOM 1597 O ILE A 106 10.447 -89.032 -4.067 1.00 52.41 O ATOM 1598 CB ILE A 106 12.856 -86.789 -4.365 1.00 72.12 C ATOM 1599 CG1 ILE A 106 13.043 -85.267 -4.202 1.00 61.14 C ATOM 1600 CG2 ILE A 106 14.003 -87.369 -5.180 1.00 61.45 C ATOM 1601 CD1 ILE A 106 13.101 -84.503 -5.511 1.00 61.02 C ATOM 0 H ILE A 106 10.377 -86.434 -3.411 1.00 60.24 H new ATOM 0 HA ILE A 106 11.559 -86.822 -6.094 1.00 10.30 H new ATOM 0 HB ILE A 106 12.857 -87.248 -3.376 1.00 72.12 H new ATOM 0 HG12 ILE A 106 12.223 -84.874 -3.601 1.00 61.14 H new ATOM 0 HG13 ILE A 106 13.962 -85.083 -3.646 1.00 61.14 H new ATOM 0 HG21 ILE A 106 14.950 -87.139 -4.691 1.00 61.45 H new ATOM 0 HG22 ILE A 106 13.886 -88.450 -5.255 1.00 61.45 H new ATOM 0 HG23 ILE A 106 13.996 -86.934 -6.179 1.00 61.45 H new ATOM 0 HD11 ILE A 106 13.234 -83.441 -5.307 1.00 61.02 H new ATOM 0 HD12 ILE A 106 13.939 -84.865 -6.107 1.00 61.02 H new ATOM 0 HD13 ILE A 106 12.172 -84.653 -6.061 1.00 61.02 H new ATOM 1613 N HIS A 107 11.766 -89.383 -5.864 1.00 62.33 N ATOM 1614 CA HIS A 107 11.570 -90.831 -5.881 1.00 42.21 C ATOM 1615 C HIS A 107 12.913 -91.553 -5.898 1.00 3.14 C ATOM 1616 O HIS A 107 13.868 -91.101 -6.536 1.00 44.31 O ATOM 1617 CB HIS A 107 10.737 -91.271 -7.092 1.00 1.15 C ATOM 1618 CG HIS A 107 9.342 -90.715 -7.130 1.00 52.33 C ATOM 1619 ND1 HIS A 107 8.219 -91.496 -6.969 1.00 63.51 N ATOM 1620 CD2 HIS A 107 8.890 -89.452 -7.331 1.00 51.43 C ATOM 1621 CE1 HIS A 107 7.144 -90.743 -7.070 1.00 61.40 C ATOM 1622 NE2 HIS A 107 7.518 -89.496 -7.288 1.00 21.31 N ATOM 0 H HIS A 107 12.367 -89.035 -6.611 1.00 62.33 H new ATOM 0 HA HIS A 107 11.027 -91.096 -4.974 1.00 42.21 H new ATOM 0 HB2 HIS A 107 11.258 -90.972 -8.002 1.00 1.15 H new ATOM 0 HB3 HIS A 107 10.680 -92.359 -7.100 1.00 1.15 H new ATOM 0 HD2 HIS A 107 9.497 -88.574 -7.495 1.00 51.43 H new ATOM 0 HE1 HIS A 107 6.124 -91.089 -6.988 1.00 61.40 H new ATOM 0 HE2 HIS A 107 6.893 -88.699 -7.405 1.00 21.31 H new ATOM 1631 N ALA A 108 12.937 -92.701 -5.237 1.00 62.21 N ATOM 1632 CA ALA A 108 14.142 -93.505 -5.021 1.00 71.54 C ATOM 1633 C ALA A 108 14.605 -94.254 -6.276 1.00 51.20 C ATOM 1634 O ALA A 108 15.534 -95.064 -6.202 1.00 13.21 O ATOM 1635 CB ALA A 108 13.917 -94.485 -3.874 1.00 1.01 C ATOM 0 H ALA A 108 12.101 -93.114 -4.824 1.00 62.21 H new ATOM 0 HA ALA A 108 14.941 -92.809 -4.765 1.00 71.54 H new ATOM 0 HB1 ALA A 108 14.818 -95.079 -3.721 1.00 1.01 H new ATOM 0 HB2 ALA A 108 13.687 -93.932 -2.963 1.00 1.01 H new ATOM 0 HB3 ALA A 108 13.085 -95.145 -4.118 1.00 1.01 H new ATOM 1641 N SER A 109 13.953 -94.003 -7.411 1.00 22.12 N ATOM 1642 CA SER A 109 14.137 -94.820 -8.614 1.00 13.31 C ATOM 1643 C SER A 109 15.588 -94.810 -9.099 1.00 70.35 C ATOM 1644 O SER A 109 16.250 -93.774 -9.105 1.00 20.01 O ATOM 1645 CB SER A 109 13.227 -94.298 -9.726 1.00 75.32 C ATOM 1646 OG SER A 109 11.863 -94.355 -9.336 1.00 74.32 O ATOM 0 H SER A 109 13.289 -93.237 -7.524 1.00 22.12 H new ATOM 0 HA SER A 109 13.879 -95.848 -8.360 1.00 13.31 H new ATOM 0 HB2 SER A 109 13.497 -93.270 -9.969 1.00 75.32 H new ATOM 0 HB3 SER A 109 13.376 -94.889 -10.630 1.00 75.32 H new ATOM 0 HG SER A 109 11.300 -94.014 -10.063 1.00 74.32 H new ATOM 1652 N SER A 110 16.052 -95.988 -9.506 1.00 53.15 N ATOM 1653 CA SER A 110 17.446 -96.221 -9.865 1.00 44.34 C ATOM 1654 C SER A 110 17.774 -95.764 -11.293 1.00 21.33 C ATOM 1655 O SER A 110 16.904 -95.275 -12.018 1.00 40.12 O ATOM 1656 CB SER A 110 17.766 -97.707 -9.678 1.00 20.12 C ATOM 1657 OG SER A 110 16.784 -98.530 -10.293 1.00 61.20 O ATOM 0 H SER A 110 15.464 -96.816 -9.597 1.00 53.15 H new ATOM 0 HA SER A 110 18.072 -95.619 -9.206 1.00 44.34 H new ATOM 0 HB2 SER A 110 18.745 -97.926 -10.104 1.00 20.12 H new ATOM 0 HB3 SER A 110 17.822 -97.938 -8.614 1.00 20.12 H new ATOM 0 HG SER A 110 17.016 -99.473 -10.158 1.00 61.20 H new ATOM 1663 N ARG A 111 19.049 -95.932 -11.663 1.00 10.21 N ATOM 1664 CA ARG A 111 19.607 -95.461 -12.938 1.00 70.34 C ATOM 1665 C ARG A 111 18.693 -95.755 -14.136 1.00 33.55 C ATOM 1666 O ARG A 111 18.206 -96.877 -14.308 1.00 43.23 O ATOM 1667 CB ARG A 111 20.981 -96.110 -13.151 1.00 25.13 C ATOM 1668 CG ARG A 111 21.654 -95.774 -14.481 1.00 15.51 C ATOM 1669 CD ARG A 111 22.985 -96.508 -14.623 1.00 32.52 C ATOM 1670 NE ARG A 111 23.577 -96.337 -15.949 1.00 21.10 N ATOM 1671 CZ ARG A 111 24.502 -97.147 -16.463 1.00 63.31 C ATOM 1672 NH1 ARG A 111 24.953 -98.184 -15.765 1.00 42.52 N ATOM 1673 NH2 ARG A 111 24.972 -96.912 -17.679 1.00 12.12 N ATOM 0 H ARG A 111 19.734 -96.407 -11.075 1.00 10.21 H new ATOM 0 HA ARG A 111 19.699 -94.377 -12.878 1.00 70.34 H new ATOM 0 HB2 ARG A 111 21.641 -95.803 -12.339 1.00 25.13 H new ATOM 0 HB3 ARG A 111 20.870 -97.192 -13.080 1.00 25.13 H new ATOM 0 HG2 ARG A 111 20.995 -96.047 -15.305 1.00 15.51 H new ATOM 0 HG3 ARG A 111 21.819 -94.699 -14.547 1.00 15.51 H new ATOM 0 HD2 ARG A 111 23.681 -96.143 -13.868 1.00 32.52 H new ATOM 0 HD3 ARG A 111 22.834 -97.570 -14.430 1.00 32.52 H new ATOM 0 HE ARG A 111 23.263 -95.549 -16.515 1.00 21.10 H new ATOM 0 HH11 ARG A 111 24.591 -98.365 -14.829 1.00 42.52 H new ATOM 0 HH12 ARG A 111 25.661 -98.799 -16.166 1.00 42.52 H new ATOM 0 HH21 ARG A 111 24.626 -96.116 -18.215 1.00 12.12 H new ATOM 0 HH22 ARG A 111 25.680 -97.527 -18.080 1.00 12.12 H new ATOM 1687 N VAL A 112 18.487 -94.734 -14.968 1.00 42.33 N ATOM 1688 CA VAL A 112 17.641 -94.832 -16.160 1.00 22.53 C ATOM 1689 C VAL A 112 18.359 -94.243 -17.379 1.00 21.24 C ATOM 1690 O VAL A 112 19.475 -93.730 -17.261 1.00 51.15 O ATOM 1691 CB VAL A 112 16.294 -94.088 -15.962 1.00 42.34 C ATOM 1692 CG1 VAL A 112 15.484 -94.707 -14.823 1.00 12.25 C ATOM 1693 CG2 VAL A 112 16.537 -92.601 -15.712 1.00 12.43 C ATOM 0 H VAL A 112 18.903 -93.812 -14.835 1.00 42.33 H new ATOM 0 HA VAL A 112 17.439 -95.890 -16.326 1.00 22.53 H new ATOM 0 HB VAL A 112 15.711 -94.192 -16.877 1.00 42.34 H new ATOM 0 HG11 VAL A 112 14.545 -94.165 -14.708 1.00 12.25 H new ATOM 0 HG12 VAL A 112 15.274 -95.752 -15.052 1.00 12.25 H new ATOM 0 HG13 VAL A 112 16.054 -94.646 -13.896 1.00 12.25 H new ATOM 0 HG21 VAL A 112 15.582 -92.094 -15.575 1.00 12.43 H new ATOM 0 HG22 VAL A 112 17.145 -92.477 -14.816 1.00 12.43 H new ATOM 0 HG23 VAL A 112 17.058 -92.169 -16.566 1.00 12.43 H new ATOM 1703 N ASP A 113 17.726 -94.345 -18.547 1.00 71.41 N ATOM 1704 CA ASP A 113 18.257 -93.749 -19.776 1.00 61.45 C ATOM 1705 C ASP A 113 18.012 -92.241 -19.774 1.00 54.52 C ATOM 1706 O ASP A 113 16.871 -91.791 -19.647 1.00 71.24 O ATOM 1707 CB ASP A 113 17.607 -94.377 -21.024 1.00 13.55 C ATOM 1708 CG ASP A 113 17.966 -95.844 -21.212 1.00 74.32 C ATOM 1709 OD1 ASP A 113 19.101 -96.133 -21.644 1.00 52.52 O ATOM 1710 OD2 ASP A 113 17.112 -96.718 -20.940 1.00 41.05 O ATOM 0 H ASP A 113 16.841 -94.837 -18.670 1.00 71.41 H new ATOM 0 HA ASP A 113 19.329 -93.945 -19.810 1.00 61.45 H new ATOM 0 HB2 ASP A 113 16.524 -94.281 -20.949 1.00 13.55 H new ATOM 0 HB3 ASP A 113 17.916 -93.818 -21.907 1.00 13.55 H new ATOM 1715 N ALA A 114 19.082 -91.465 -19.913 1.00 61.52 N ATOM 1716 CA ALA A 114 18.985 -90.007 -19.907 1.00 14.04 C ATOM 1717 C ALA A 114 18.541 -89.477 -21.270 1.00 42.21 C ATOM 1718 O ALA A 114 18.997 -89.953 -22.314 1.00 32.43 O ATOM 1719 CB ALA A 114 20.314 -89.380 -19.506 1.00 51.25 C ATOM 0 H ALA A 114 20.030 -91.822 -20.032 1.00 61.52 H new ATOM 0 HA ALA A 114 18.231 -89.729 -19.171 1.00 14.04 H new ATOM 0 HB1 ALA A 114 20.219 -88.294 -19.508 1.00 51.25 H new ATOM 0 HB2 ALA A 114 20.589 -89.718 -18.507 1.00 51.25 H new ATOM 0 HB3 ALA A 114 21.086 -89.678 -20.216 1.00 51.25 H new ATOM 1725 N ASP A 115 17.660 -88.485 -21.247 1.00 54.31 N ATOM 1726 CA ASP A 115 17.130 -87.872 -22.464 1.00 31.20 C ATOM 1727 C ASP A 115 17.521 -86.400 -22.536 1.00 74.33 C ATOM 1728 O ASP A 115 18.099 -85.945 -23.526 1.00 33.11 O ATOM 1729 CB ASP A 115 15.600 -88.006 -22.502 1.00 63.02 C ATOM 1730 CG ASP A 115 14.963 -87.216 -23.639 1.00 34.15 C ATOM 1731 OD1 ASP A 115 14.830 -87.761 -24.756 1.00 60.54 O ATOM 1732 OD2 ASP A 115 14.586 -86.047 -23.419 1.00 71.54 O ATOM 0 H ASP A 115 17.291 -88.081 -20.386 1.00 54.31 H new ATOM 0 HA ASP A 115 17.556 -88.390 -23.323 1.00 31.20 H new ATOM 0 HB2 ASP A 115 15.335 -89.058 -22.605 1.00 63.02 H new ATOM 0 HB3 ASP A 115 15.187 -87.664 -21.553 1.00 63.02 H new ATOM 1737 N GLY A 116 17.234 -85.668 -21.466 1.00 25.12 N ATOM 1738 CA GLY A 116 17.444 -84.230 -21.458 1.00 51.02 C ATOM 1739 C GLY A 116 16.445 -83.503 -20.571 1.00 52.42 C ATOM 1740 O GLY A 116 15.287 -83.921 -20.437 1.00 24.24 O ATOM 0 H GLY A 116 16.857 -86.047 -20.597 1.00 25.12 H new ATOM 0 HA2 GLY A 116 18.455 -84.015 -21.113 1.00 51.02 H new ATOM 0 HA3 GLY A 116 17.367 -83.849 -22.476 1.00 51.02 H new ATOM 1744 N PHE A 117 16.888 -82.423 -19.950 1.00 5.24 N ATOM 1745 CA PHE A 117 16.035 -81.641 -19.069 1.00 2.31 C ATOM 1746 C PHE A 117 15.336 -80.555 -19.882 1.00 32.41 C ATOM 1747 O PHE A 117 15.990 -79.628 -20.364 1.00 0.02 O ATOM 1748 CB PHE A 117 16.884 -81.003 -17.951 1.00 64.33 C ATOM 1749 CG PHE A 117 17.690 -81.994 -17.139 1.00 64.31 C ATOM 1750 CD1 PHE A 117 18.789 -82.643 -17.688 1.00 52.42 C ATOM 1751 CD2 PHE A 117 17.348 -82.276 -15.824 1.00 54.12 C ATOM 1752 CE1 PHE A 117 19.524 -83.547 -16.944 1.00 24.34 C ATOM 1753 CE2 PHE A 117 18.081 -83.178 -15.077 1.00 3.23 C ATOM 1754 CZ PHE A 117 19.169 -83.815 -15.636 1.00 43.44 C ATOM 0 H PHE A 117 17.839 -82.066 -20.040 1.00 5.24 H new ATOM 0 HA PHE A 117 15.286 -82.289 -18.613 1.00 2.31 H new ATOM 0 HB2 PHE A 117 17.564 -80.277 -18.397 1.00 64.33 H new ATOM 0 HB3 PHE A 117 16.225 -80.452 -17.280 1.00 64.33 H new ATOM 0 HD1 PHE A 117 19.073 -82.438 -18.710 1.00 52.42 H new ATOM 0 HD2 PHE A 117 16.497 -81.783 -15.378 1.00 54.12 H new ATOM 0 HE1 PHE A 117 20.376 -84.044 -17.385 1.00 24.34 H new ATOM 0 HE2 PHE A 117 17.802 -83.384 -14.054 1.00 3.23 H new ATOM 0 HZ PHE A 117 19.742 -84.521 -15.053 1.00 43.44 H new ATOM 1764 N GLU A 118 14.014 -80.656 -20.043 1.00 33.04 N ATOM 1765 CA GLU A 118 13.280 -79.649 -20.798 1.00 23.02 C ATOM 1766 C GLU A 118 11.833 -79.591 -20.354 1.00 63.02 C ATOM 1767 O GLU A 118 11.378 -80.422 -19.583 1.00 13.12 O ATOM 1768 CB GLU A 118 13.365 -79.918 -22.306 1.00 70.42 C ATOM 1769 CG GLU A 118 12.743 -81.234 -22.754 1.00 51.04 C ATOM 1770 CD GLU A 118 12.668 -81.329 -24.268 1.00 53.34 C ATOM 1771 OE1 GLU A 118 11.687 -80.819 -24.850 1.00 62.15 O ATOM 1772 OE2 GLU A 118 13.601 -81.886 -24.887 1.00 71.34 O ATOM 0 H GLU A 118 13.442 -81.412 -19.667 1.00 33.04 H new ATOM 0 HA GLU A 118 13.742 -78.682 -20.598 1.00 23.02 H new ATOM 0 HB2 GLU A 118 12.874 -79.101 -22.835 1.00 70.42 H new ATOM 0 HB3 GLU A 118 14.413 -79.907 -22.605 1.00 70.42 H new ATOM 0 HG2 GLU A 118 13.330 -82.066 -22.365 1.00 51.04 H new ATOM 0 HG3 GLU A 118 11.742 -81.326 -22.333 1.00 51.04 H new ATOM 1779 N ILE A 119 11.107 -78.590 -20.803 1.00 14.51 N ATOM 1780 CA ILE A 119 9.708 -78.480 -20.450 1.00 51.30 C ATOM 1781 C ILE A 119 8.842 -78.971 -21.603 1.00 62.21 C ATOM 1782 O ILE A 119 8.459 -78.208 -22.490 1.00 44.42 O ATOM 1783 CB ILE A 119 9.333 -77.038 -20.029 1.00 2.53 C ATOM 1784 CG1 ILE A 119 10.263 -76.570 -18.891 1.00 24.02 C ATOM 1785 CG2 ILE A 119 7.867 -76.960 -19.596 1.00 53.12 C ATOM 1786 CD1 ILE A 119 10.338 -77.534 -17.715 1.00 71.13 C ATOM 0 H ILE A 119 11.458 -77.847 -21.408 1.00 14.51 H new ATOM 0 HA ILE A 119 9.522 -79.114 -19.583 1.00 51.30 H new ATOM 0 HB ILE A 119 9.462 -76.377 -20.886 1.00 2.53 H new ATOM 0 HG12 ILE A 119 11.266 -76.424 -19.292 1.00 24.02 H new ATOM 0 HG13 ILE A 119 9.920 -75.600 -18.531 1.00 24.02 H new ATOM 0 HG21 ILE A 119 7.628 -75.937 -19.305 1.00 53.12 H new ATOM 0 HG22 ILE A 119 7.226 -77.261 -20.425 1.00 53.12 H new ATOM 0 HG23 ILE A 119 7.702 -77.626 -18.749 1.00 53.12 H new ATOM 0 HD11 ILE A 119 11.012 -77.133 -16.958 1.00 71.13 H new ATOM 0 HD12 ILE A 119 9.344 -77.662 -17.285 1.00 71.13 H new ATOM 0 HD13 ILE A 119 10.712 -78.499 -18.059 1.00 71.13 H new ATOM 1798 N ARG A 120 8.613 -80.280 -21.612 1.00 2.03 N ATOM 1799 CA ARG A 120 7.717 -80.912 -22.573 1.00 61.44 C ATOM 1800 C ARG A 120 6.278 -80.742 -22.128 1.00 32.31 C ATOM 1801 O ARG A 120 5.979 -80.830 -20.936 1.00 1.25 O ATOM 1802 CB ARG A 120 8.039 -82.405 -22.714 1.00 4.12 C ATOM 1803 CG ARG A 120 9.154 -82.716 -23.699 1.00 2.23 C ATOM 1804 CD ARG A 120 9.488 -84.205 -23.695 1.00 30.01 C ATOM 1805 NE ARG A 120 10.525 -84.552 -24.666 1.00 3.51 N ATOM 1806 CZ ARG A 120 11.736 -85.010 -24.344 1.00 12.41 C ATOM 1807 NH1 ARG A 120 12.119 -85.061 -23.071 1.00 3.32 N ATOM 1808 NH2 ARG A 120 12.578 -85.395 -25.294 1.00 2.32 N ATOM 0 H ARG A 120 9.042 -80.931 -20.955 1.00 2.03 H new ATOM 0 HA ARG A 120 7.857 -80.431 -23.541 1.00 61.44 H new ATOM 0 HB2 ARG A 120 8.314 -82.799 -21.736 1.00 4.12 H new ATOM 0 HB3 ARG A 120 7.137 -82.931 -23.027 1.00 4.12 H new ATOM 0 HG2 ARG A 120 8.855 -82.410 -24.701 1.00 2.23 H new ATOM 0 HG3 ARG A 120 10.043 -82.140 -23.442 1.00 2.23 H new ATOM 0 HD2 ARG A 120 9.817 -84.497 -22.698 1.00 30.01 H new ATOM 0 HD3 ARG A 120 8.586 -84.776 -23.913 1.00 30.01 H new ATOM 0 HE ARG A 120 10.308 -84.436 -25.656 1.00 3.51 H new ATOM 0 HH11 ARG A 120 11.486 -84.749 -22.335 1.00 3.32 H new ATOM 0 HH12 ARG A 120 13.046 -85.412 -22.831 1.00 3.32 H new ATOM 0 HH21 ARG A 120 12.300 -85.341 -26.274 1.00 2.32 H new ATOM 0 HH22 ARG A 120 13.503 -85.745 -25.044 1.00 2.32 H new ATOM 1822 N ARG A 121 5.399 -80.493 -23.087 1.00 14.01 N ATOM 1823 CA ARG A 121 3.977 -80.334 -22.814 1.00 75.33 C ATOM 1824 C ARG A 121 3.184 -81.003 -23.933 1.00 64.21 C ATOM 1825 O ARG A 121 2.759 -80.303 -24.875 1.00 51.44 O ATOM 1826 CB ARG A 121 3.596 -78.843 -22.684 1.00 72.42 C ATOM 1827 CG ARG A 121 4.553 -78.026 -21.814 1.00 14.51 C ATOM 1828 CD ARG A 121 3.905 -76.751 -21.298 1.00 12.45 C ATOM 1829 NE ARG A 121 2.860 -77.049 -20.317 1.00 4.53 N ATOM 1830 CZ ARG A 121 2.055 -76.140 -19.771 1.00 42.14 C ATOM 1831 NH1 ARG A 121 2.170 -74.855 -20.089 1.00 1.44 N ATOM 1832 NH2 ARG A 121 1.136 -76.521 -18.896 1.00 65.01 N ATOM 1833 OXT ARG A 121 3.052 -82.245 -23.897 1.00 0.00 O ATOM 0 H ARG A 121 5.648 -80.396 -24.071 1.00 14.01 H new ATOM 0 HA ARG A 121 3.738 -80.809 -21.863 1.00 75.33 H new ATOM 0 HB2 ARG A 121 3.560 -78.400 -23.679 1.00 72.42 H new ATOM 0 HB3 ARG A 121 2.592 -78.771 -22.267 1.00 72.42 H new ATOM 0 HG2 ARG A 121 4.883 -78.632 -20.970 1.00 14.51 H new ATOM 0 HG3 ARG A 121 5.442 -77.773 -22.392 1.00 14.51 H new ATOM 0 HD2 ARG A 121 4.663 -76.113 -20.844 1.00 12.45 H new ATOM 0 HD3 ARG A 121 3.477 -76.194 -22.132 1.00 12.45 H new ATOM 0 HE ARG A 121 2.740 -78.021 -20.032 1.00 4.53 H new ATOM 0 HH11 ARG A 121 2.880 -74.557 -20.757 1.00 1.44 H new ATOM 0 HH12 ARG A 121 1.548 -74.167 -19.665 1.00 1.44 H new ATOM 0 HH21 ARG A 121 1.048 -77.506 -18.644 1.00 65.01 H new ATOM 0 HH22 ARG A 121 0.516 -75.830 -18.474 1.00 65.01 H new