==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-AUG-08 2JKK . COMPND 2 MOLECULE: FOCAL ADHESION KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR D.LIETHA,M.J.ECK . 258 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13652.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 15.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 13 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 32.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 1 1 0 1 1 0 0 0 0 2 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 0 2 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 413 A R 0 0 261 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -88.4 -3.6 23.0 20.7 2 414 A D - 0 0 136 1,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.882 360.0-179.8-103.0 111.3 -2.0 23.5 24.1 3 415 A Y + 0 0 72 -2,-0.7 74,-2.5 73,-0.1 2,-0.3 0.509 46.3 115.1 -83.3 -3.5 0.5 20.8 25.1 4 416 A E B -a 77 0A 58 72,-0.2 2,-0.4 74,-0.1 74,-0.2 -0.512 48.4-165.6 -74.2 130.4 1.2 22.3 28.5 5 417 A I - 0 0 14 72,-2.6 2,-0.3 -2,-0.3 74,-0.1 -0.942 22.9-118.3-115.7 136.2 0.1 20.0 31.3 6 418 A Q > - 0 0 116 -2,-0.4 3,-2.0 1,-0.1 4,-0.3 -0.586 21.7-133.9 -66.8 131.6 -0.2 20.9 35.0 7 419 A R G > S+ 0 0 63 -2,-0.3 3,-2.0 1,-0.3 -1,-0.1 0.811 102.1 68.4 -58.4 -33.6 2.2 18.8 37.1 8 420 A E G 3 S+ 0 0 150 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.659 91.4 62.3 -61.0 -15.8 -0.6 18.1 39.6 9 421 A R G < S+ 0 0 92 -3,-2.0 21,-3.3 20,-0.1 2,-0.4 0.589 94.8 77.8 -81.5 -8.8 -2.4 16.0 36.9 10 422 A I E < -B 29 0A 16 -3,-2.0 2,-0.5 -4,-0.3 19,-0.2 -0.860 57.4-169.6-108.6 130.6 0.6 13.6 36.8 11 423 A E E -B 28 0A 116 17,-2.0 17,-1.9 -2,-0.4 2,-0.3 -0.978 23.3-138.6-115.3 111.8 1.3 10.9 39.3 12 424 A L E +B 27 0A 68 -2,-0.5 15,-0.2 15,-0.2 2,-0.1 -0.585 26.9 179.7 -74.4 130.2 4.8 9.5 38.8 13 425 A G E - 0 0 31 13,-2.7 14,-0.1 -2,-0.3 -1,-0.1 -0.105 40.2 -26.5-108.6-152.5 5.0 5.7 39.1 14 426 A R E - 0 0 182 11,-0.1 12,-2.6 1,-0.1 -1,-0.3 -0.233 65.2-103.0 -64.9 146.3 7.9 3.2 38.7 15 427 A C E +B 25 0A 69 10,-0.2 10,-0.3 1,-0.1 -1,-0.1 -0.480 37.1 175.1 -62.4 129.9 11.0 3.7 36.6 16 428 A I E - 0 0 82 8,-2.9 2,-0.3 1,-0.2 9,-0.2 0.274 59.3 -37.9-121.8 5.5 10.7 1.7 33.4 17 429 A G E -B 24 0A 31 7,-1.2 7,-2.3 2,-0.0 2,-0.3 -0.998 54.9-107.1 162.8-167.4 13.9 2.9 31.6 18 430 A E E -B 23 0A 151 -2,-0.3 2,-0.2 5,-0.3 5,-0.2 -0.990 17.4-172.4-155.2 153.7 16.3 5.7 30.9 19 431 A G E > -B 22 0A 29 3,-2.6 3,-0.5 -2,-0.3 136,-0.1 -0.753 51.7 -72.7-133.0-171.9 17.4 7.9 28.1 20 432 A Q T 3 S+ 0 0 158 -2,-0.2 3,-0.1 1,-0.2 36,-0.0 0.782 128.7 36.1 -49.5 -39.4 20.2 10.5 27.4 21 433 A F T 3 S- 0 0 26 1,-0.3 24,-2.0 22,-0.1 25,-0.3 0.614 123.8 -57.9 -97.7 -17.2 18.6 13.1 29.7 22 434 A G E < S-B 19 0A 6 -3,-0.5 -3,-2.6 22,-0.2 -1,-0.3 -0.985 72.3 -28.3 163.3-174.7 17.2 11.1 32.5 23 435 A D E -B 18 0A 51 -2,-0.3 20,-2.6 -5,-0.2 2,-0.4 -0.254 42.9-140.5 -69.2 152.2 14.8 8.3 33.8 24 436 A V E -BC 17 42A 8 -7,-2.3 -8,-2.9 18,-0.2 -7,-1.2 -0.973 24.1-171.6-115.1 132.8 11.6 7.2 32.1 25 437 A H E -BC 15 41A 30 16,-2.8 16,-3.4 -2,-0.4 2,-0.3 -0.843 23.8-129.1-118.5 153.8 8.7 6.4 34.4 26 438 A Q E + C 0 40A 67 -12,-2.6 -13,-2.7 -2,-0.3 2,-0.3 -0.735 47.6 143.6 -86.7 154.9 5.3 4.9 34.0 27 439 A G E -BC 12 39A 7 12,-2.5 12,-2.3 -2,-0.3 2,-0.4 -0.918 42.5 -91.6-166.0-164.6 2.6 7.0 35.6 28 440 A I E -BC 11 38A 47 -17,-1.9 -17,-2.0 -2,-0.3 2,-0.5 -0.973 14.5-149.8-131.6 141.5 -0.9 8.3 35.4 29 441 A Y E -BC 10 37A 45 8,-3.2 8,-2.8 -2,-0.4 2,-0.3 -0.972 22.7-163.6-109.1 120.2 -2.5 11.5 33.9 30 442 A M E + 0 0 74 -21,-3.3 6,-0.1 -2,-0.5 -2,-0.0 -0.788 13.1 171.2-104.9 144.5 -5.6 12.5 35.8 31 443 A S E > - C 0 34A 21 3,-0.5 3,-1.8 -2,-0.3 -2,-0.0 -0.985 43.7 -79.3-150.8 148.6 -8.4 14.9 34.6 32 444 A P T 3 S- 0 0 93 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.217 109.6 -4.0 -57.3 135.2 -11.8 15.9 36.1 33 445 A E T 3 S+ 0 0 200 1,-0.2 0, 0.0 0, 0.0 0, 0.0 0.455 113.5 104.5 62.4 9.7 -14.6 13.4 35.5 34 446 A N E < S-C 31 0A 99 -3,-1.8 -3,-0.5 1,-0.0 -1,-0.2 -0.885 77.6-103.3-114.0 148.5 -12.4 11.2 33.3 35 447 A P E - 0 0 116 0, 0.0 2,-0.1 0, 0.0 -6,-0.0 -0.306 50.0 -92.2 -58.5 147.8 -10.6 7.9 34.0 36 448 A A E - 0 0 60 -6,-0.1 2,-0.5 1,-0.1 -6,-0.2 -0.430 40.5-139.3 -60.0 134.7 -6.9 8.1 34.8 37 449 A M E -C 29 0A 66 -8,-2.8 -8,-3.2 -2,-0.1 2,-0.3 -0.895 12.4-125.7-102.9 128.5 -4.9 7.6 31.6 38 450 A A E +C 28 0A 44 -2,-0.5 51,-1.4 -10,-0.2 2,-0.3 -0.547 40.0 174.4 -69.0 134.7 -1.7 5.5 31.8 39 451 A V E -CD 27 88A 0 -12,-2.3 -12,-2.5 -2,-0.3 2,-0.4 -0.950 33.7-127.9-141.1 153.2 1.4 7.4 30.5 40 452 A A E -CD 26 87A 15 47,-2.1 47,-2.9 -2,-0.3 2,-0.5 -0.878 26.5-155.6 -93.7 141.2 5.1 7.2 30.1 41 453 A I E -CD 25 86A 0 -16,-3.4 -16,-2.8 -2,-0.4 2,-0.5 -0.959 5.3-159.3-125.5 116.0 7.0 10.1 31.6 42 454 A K E -CD 24 85A 6 43,-2.5 43,-2.3 -2,-0.5 2,-0.3 -0.794 17.8-159.9 -90.1 130.3 10.5 11.1 30.3 43 455 A T E - D 0 84A 16 -20,-2.6 2,-0.7 -2,-0.5 41,-0.2 -0.771 20.9-137.3-112.8 155.0 12.3 13.2 32.9 44 456 A a > - 0 0 4 39,-1.1 3,-0.6 -2,-0.3 -22,-0.2 -0.951 27.6-158.1-111.4 101.8 15.2 15.5 32.5 45 457 A K T 3 S- 0 0 113 -24,-2.0 2,-0.2 -2,-0.7 -1,-0.2 0.951 73.6 -5.9 -54.4 -84.1 17.2 14.5 35.6 46 458 A N T 3 S+ 0 0 134 -25,-0.3 2,-1.1 36,-0.1 -1,-0.2 -0.465 78.5 160.8-115.1 58.5 19.5 17.4 36.4 47 459 A a < + 0 0 17 -3,-0.6 36,-0.2 -2,-0.2 -3,-0.1 -0.684 3.8 164.2 -81.8 95.2 18.9 19.7 33.5 48 460 A T + 0 0 124 -2,-1.1 2,-0.3 33,-0.0 -1,-0.1 -0.061 50.3 59.6-112.0 25.1 20.2 23.0 34.9 49 461 A S S > S- 0 0 39 1,-0.1 4,-2.4 0, 0.0 5,-0.2 -0.988 77.6-121.4-153.7 154.4 20.5 25.0 31.7 50 462 A D H > S+ 0 0 117 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.848 110.1 56.9 -63.9 -39.6 18.4 26.3 28.8 51 463 A S H > S+ 0 0 78 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.863 111.9 41.1 -61.5 -40.3 20.5 24.5 26.2 52 464 A V H > S+ 0 0 53 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.940 115.5 50.2 -73.7 -46.3 19.9 21.1 27.8 53 465 A R H X S+ 0 0 49 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.883 112.3 48.9 -58.0 -39.3 16.2 21.8 28.5 54 466 A E H X S+ 0 0 90 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.900 110.1 49.7 -68.4 -41.5 15.8 22.9 24.9 55 467 A K H X S+ 0 0 129 -4,-1.8 4,-0.5 2,-0.2 -2,-0.2 0.876 112.5 49.5 -62.3 -38.4 17.5 19.8 23.5 56 468 A F H >< S+ 0 0 3 -4,-2.5 3,-1.4 1,-0.2 4,-0.5 0.960 111.3 47.3 -63.6 -51.4 15.3 17.6 25.7 57 469 A L H >X S+ 0 0 32 -4,-2.3 4,-1.8 1,-0.3 3,-0.9 0.738 96.4 71.2 -67.1 -25.3 12.1 19.3 24.6 58 470 A Q H 3X S+ 0 0 80 -4,-1.6 4,-1.7 1,-0.3 -1,-0.3 0.795 90.2 63.3 -63.2 -24.9 12.9 19.1 20.9 59 471 A E H S+ 0 0 4 -3,-0.9 4,-2.4 -4,-0.5 -2,-0.2 0.929 107.8 54.0 -68.1 -43.5 8.6 16.4 22.2 61 473 A L H X S+ 0 0 72 -4,-1.8 4,-0.5 1,-0.2 -2,-0.2 0.809 107.5 52.8 -60.0 -34.0 8.5 18.7 19.2 62 474 A T H >< S+ 0 0 38 -4,-1.7 3,-1.2 -5,-0.2 4,-0.3 0.950 111.5 43.6 -63.5 -50.9 9.5 15.7 17.0 63 475 A M H >< S+ 0 0 2 -4,-1.7 3,-1.5 1,-0.3 11,-0.3 0.833 103.1 66.6 -68.5 -28.7 6.8 13.4 18.3 64 476 A R H 3< S+ 0 0 132 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.751 89.8 67.9 -61.0 -25.2 4.2 16.1 18.1 65 477 A Q T << S+ 0 0 129 -3,-1.2 2,-0.3 -4,-0.5 -1,-0.3 0.728 91.6 74.8 -68.4 -22.8 4.6 16.0 14.3 66 478 A F < + 0 0 17 -3,-1.5 2,-0.3 -4,-0.3 8,-0.3 -0.725 46.7 177.3-109.4 143.0 3.1 12.5 14.0 67 479 A D + 0 0 115 -2,-0.3 5,-0.1 6,-0.1 6,-0.1 -0.799 33.3 130.1-142.1 88.4 -0.5 11.2 14.2 68 480 A H > - 0 0 25 3,-0.4 3,-1.6 -2,-0.3 -2,-0.0 -0.997 60.5-126.5-149.3 139.8 -0.6 7.5 13.6 69 481 A P T 3 S+ 0 0 76 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.691 110.8 47.4 -57.5 -21.2 -2.2 4.5 15.3 70 482 A H T 3 S+ 0 0 28 47,-0.1 80,-2.4 79,-0.1 2,-0.4 0.030 98.9 73.5-117.8 26.0 1.2 2.7 15.3 71 483 A I B < S-f 150 0B 3 -3,-1.6 -3,-0.4 78,-0.3 80,-0.2 -0.993 91.8-106.0-130.8 134.8 3.4 5.4 16.6 72 484 A V - 0 0 7 78,-2.2 2,-0.3 -2,-0.4 -6,-0.1 -0.305 39.9-125.9 -62.1 141.4 3.3 6.5 20.3 73 485 A K - 0 0 72 -4,-0.1 15,-2.2 -6,-0.1 2,-0.5 -0.637 6.4-124.0 -96.2 143.8 1.5 9.8 20.8 74 486 A L E - E 0 87A 16 -11,-0.3 13,-0.2 -8,-0.3 3,-0.1 -0.733 24.4-178.0 -75.3 128.3 2.7 12.9 22.6 75 487 A I E - 0 0 52 11,-2.5 2,-0.3 -2,-0.5 12,-0.2 0.802 54.7 -69.1 -92.1 -46.3 0.2 13.8 25.3 76 488 A G E - E 0 86A 0 10,-1.9 10,-2.9 -71,-0.0 -1,-0.4 -0.988 41.3-105.0 175.8-169.6 1.9 16.9 26.5 77 489 A V E -aE 4 85A 19 -74,-2.5 -72,-2.6 -2,-0.3 2,-0.5 -0.910 8.8-142.8-138.6 158.0 4.9 18.6 28.3 78 490 A I E - E 0 84A 4 6,-2.5 6,-1.4 -2,-0.3 -72,-0.1 -0.987 17.4-173.6-123.8 113.3 5.7 20.3 31.6 79 491 A T + 0 0 67 -2,-0.5 2,-0.3 4,-0.2 4,-0.2 0.302 55.6 87.7-101.7 8.0 8.1 23.1 30.9 80 492 A E S S- 0 0 143 2,-0.2 4,-0.2 4,-0.1 -2,-0.1 -0.787 94.3 -47.9 -99.3 150.0 8.8 24.2 34.5 81 493 A N S S+ 0 0 104 -2,-0.3 -2,-0.1 1,-0.2 2,-0.1 -0.410 130.7 37.8 -65.6 131.3 11.7 22.5 36.4 82 494 A P S S- 0 0 62 0, 0.0 2,-0.2 0, 0.0 -2,-0.2 0.463 95.1-146.8 -82.3 138.8 12.0 19.6 36.4 83 495 A V - 0 0 2 -39,-0.2 -39,-1.1 -36,-0.2 2,-0.3 -0.512 18.6-173.4 -75.1 130.9 10.8 19.4 32.8 84 496 A W E -DE 43 78A 30 -6,-1.4 -6,-2.5 -2,-0.2 2,-0.4 -0.923 18.7-150.2-124.6 149.4 8.8 16.3 31.8 85 497 A I E -DE 42 77A 0 -43,-2.3 -43,-2.5 -2,-0.3 2,-0.5 -0.978 17.3-152.9-115.9 132.5 7.6 14.9 28.5 86 498 A I E +DE 41 76A 0 -10,-2.9 -11,-2.5 -2,-0.4 -10,-1.9 -0.945 18.6 172.9-115.3 124.2 4.4 12.9 28.8 87 499 A M E -DE 40 74A 7 -47,-2.9 -47,-2.1 -2,-0.5 -13,-0.2 -0.821 41.6 -87.5-124.6 160.1 3.6 10.2 26.2 88 500 A E E -D 39 0A 34 -15,-2.2 2,-0.4 -2,-0.3 -49,-0.2 -0.450 49.1-122.9 -65.1 141.8 0.9 7.5 25.9 89 501 A L - 0 0 30 -51,-1.4 2,-0.8 -62,-0.1 -51,-0.1 -0.722 8.2-148.5 -88.0 136.4 1.9 4.3 27.7 90 502 A C > - 0 0 10 -2,-0.4 3,-1.6 1,-0.1 52,-0.3 -0.931 19.8-158.5-101.1 104.3 2.2 0.9 25.9 91 503 A T T 3 S+ 0 0 104 -2,-0.8 52,-0.2 52,-0.4 -1,-0.1 0.652 80.8 58.0 -66.1 -22.4 1.2 -1.1 28.9 92 504 A L T 3 S- 0 0 73 50,-2.0 -1,-0.3 1,-0.3 51,-0.2 0.423 97.3-147.1 -93.0 1.2 2.8 -4.5 27.8 93 505 A G < + 0 0 30 -3,-1.6 49,-3.2 49,-0.5 -1,-0.3 -0.367 48.5 10.3 81.4-144.3 6.3 -3.0 27.4 94 506 A E B > -G 141 0B 122 47,-0.2 4,-1.9 1,-0.1 47,-0.2 -0.525 59.6-136.0 -87.1 135.7 9.0 -3.9 25.0 95 507 A L H > S+ 0 0 0 45,-2.6 4,-2.8 42,-0.4 5,-0.2 0.873 98.9 59.3 -56.0 -43.2 8.3 -6.2 22.1 96 508 A R H > S+ 0 0 56 41,-0.4 4,-2.0 44,-0.3 -1,-0.2 0.942 110.4 41.8 -57.9 -49.5 11.5 -8.3 22.4 97 509 A S H > S+ 0 0 63 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.897 112.6 54.9 -60.3 -45.2 10.6 -9.5 25.9 98 510 A F H X S+ 0 0 21 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.923 109.6 46.8 -54.4 -47.4 7.0 -9.9 25.0 99 511 A L H < S+ 0 0 0 -4,-2.8 4,-0.2 1,-0.2 -1,-0.2 0.871 114.0 47.7 -65.1 -38.9 7.9 -12.3 22.1 100 512 A Q H < S+ 0 0 93 -4,-2.0 3,-0.5 -5,-0.2 -1,-0.2 0.902 117.8 40.8 -66.2 -43.5 10.3 -14.3 24.3 101 513 A V H < S+ 0 0 111 -4,-2.7 3,-0.3 1,-0.2 -2,-0.2 0.880 121.3 40.4 -74.3 -39.7 7.8 -14.7 27.2 102 514 A R S >X S+ 0 0 106 -4,-2.6 3,-2.0 -5,-0.3 4,-0.7 0.200 78.5 119.1 -99.2 17.6 4.7 -15.3 25.0 103 515 A K G >4 S+ 0 0 96 -3,-0.5 3,-0.6 1,-0.3 -1,-0.2 0.838 76.9 44.3 -53.9 -44.0 6.4 -17.6 22.5 104 516 A F G 34 S+ 0 0 202 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.315 116.7 50.6 -84.5 10.8 4.3 -20.8 23.1 105 517 A S G <4 S+ 0 0 68 -3,-2.0 2,-0.4 2,-0.0 -2,-0.2 0.388 97.2 77.2-123.4 -6.6 1.2 -18.6 23.2 106 518 A L << - 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H 0 142B 0 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.831 10.5-169.7-118.0 156.4 2.5 -2.7 18.4 149 561 A K E - H 0 141B 22 -8,-2.0 -8,-3.2 -2,-0.3 2,-0.3 -0.995 32.1-102.9-145.9 144.0 3.8 0.8 18.0 150 562 A L E -fH 71 140B 5 -80,-2.4 -78,-2.2 -2,-0.3 -10,-0.2 -0.524 47.6-130.5 -59.0 131.3 7.1 2.5 17.3 151 563 A G - 0 0 4 -12,-2.7 5,-0.1 -2,-0.3 -79,-0.1 0.016 46.4 -47.8 -75.2-171.7 8.4 3.9 20.6 152 564 A D > - 0 0 11 1,-0.1 4,-1.2 -81,-0.1 -1,-0.2 -0.340 47.8-139.2 -62.8 135.4 9.6 7.4 21.4 153 565 A F H > S+ 0 0 1 2,-0.2 4,-0.6 1,-0.2 -1,-0.1 0.872 102.4 52.1 -69.8 -36.9 12.1 8.6 18.7 154 566 A G H >4 S+ 0 0 16 1,-0.2 3,-1.1 -95,-0.2 -1,-0.2 0.950 113.1 45.4 -58.6 -47.5 14.4 10.2 21.2 155 567 A L H 34 S+ 0 0 63 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.671 103.6 64.4 -70.3 -20.2 14.5 7.0 23.2 156 568 A S H 3< 0 0 3 -4,-1.2 -1,-0.2 -3,-0.1 -2,-0.2 0.708 360.0 360.0 -72.7 -20.7 15.1 4.9 20.1 157 569 A R << 0 0 135 -3,-1.1 -2,-0.2 -4,-0.6 -3,-0.1 0.965 360.0 360.0 -93.6 360.0 18.5 6.5 19.5 158 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 159 584 A L 0 0 160 0, 0.0 2,-2.0 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 129.6 25.8 3.0 15.9 160 585 A P >> + 0 0 26 0, 0.0 3,-2.0 0, 0.0 4,-0.9 -0.397 360.0 170.3 -81.2 65.9 23.5 0.1 15.5 161 586 A I G >4 + 0 0 25 -2,-2.0 3,-1.1 1,-0.3 8,-0.1 0.826 68.4 57.5 -41.7 -50.4 25.9 -1.8 13.0 162 587 A K G 34 S+ 0 0 35 1,-0.3 -1,-0.3 -3,-0.2 36,-0.0 0.660 114.7 38.0 -64.8 -17.4 24.0 -5.1 13.0 163 588 A W G <4 S+ 0 0 28 -3,-2.0 -1,-0.3 2,-0.1 22,-0.2 0.544 96.3 106.7-102.2 -13.5 20.8 -3.4 11.8 164 589 A M << - 0 0 1 -3,-1.1 15,-0.1 -4,-0.9 -30,-0.0 -0.411 69.8-116.8 -85.8 143.9 22.3 -0.8 9.4 165 590 A A >> - 0 0 0 13,-0.2 4,-2.1 -2,-0.1 3,-0.8 -0.342 31.5-113.9 -66.6 150.9 22.3 -0.7 5.5 166 591 A P H 3> S+ 0 0 0 0, 0.0 4,-3.5 0, 0.0 5,-0.3 0.894 118.0 55.6 -55.1 -40.3 25.8 -1.0 3.9 167 592 A E H 3> S+ 0 0 14 69,-0.2 6,-1.8 1,-0.2 4,-1.5 0.766 108.2 49.0 -60.5 -30.4 25.4 2.6 2.5 168 593 A S H <> S+ 0 0 3 -3,-0.8 4,-1.1 4,-0.3 -1,-0.2 0.890 115.8 42.4 -74.8 -43.1 24.8 3.8 6.1 169 594 A I H < S+ 0 0 38 -4,-2.1 -2,-0.2 2,-0.1 -1,-0.1 0.956 124.8 34.6 -64.6 -51.0 27.8 2.0 7.5 170 595 A N H < S+ 0 0 60 -4,-3.5 -3,-0.2 -5,-0.2 -2,-0.2 0.814 137.8 13.0 -76.0 -34.9 30.1 2.9 4.6 171 596 A F H < S- 0 0 149 -4,-1.5 -3,-0.2 -5,-0.3 -1,-0.2 0.296 92.6-117.8-132.1 4.9 29.0 6.4 3.6 172 597 A R < + 0 0 210 -4,-1.1 2,-0.5 1,-0.2 -4,-0.3 0.819 59.0 153.9 54.6 34.3 26.7 7.6 6.4 173 598 A R - 0 0 134 -6,-1.8 2,-0.5 -8,-0.1 -1,-0.2 -0.831 21.9-173.5 -94.4 129.1 23.8 7.8 4.1 174 599 A F + 0 0 40 -2,-0.5 2,-0.3 -3,-0.1 -43,-0.1 -0.979 19.2 145.9-126.9 116.2 20.4 7.5 5.8 175 600 A T > - 0 0 34 -2,-0.5 4,-2.6 1,-0.1 3,-0.3 -0.826 65.3 -90.7-137.7 177.4 17.3 7.3 3.6 176 601 A S H > S+ 0 0 28 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.882 127.8 56.4 -60.5 -33.6 13.9 5.7 3.5 177 602 A A H > S+ 0 0 29 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.814 106.2 46.9 -67.1 -36.6 15.6 2.9 1.6 178 603 A S H > S+ 0 0 0 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.845 109.1 56.3 -73.7 -33.3 18.1 2.4 4.4 179 604 A D H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.937 103.3 55.5 -53.7 -44.7 15.1 2.4 6.7 180 605 A V H X S+ 0 0 2 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.922 105.3 51.2 -57.7 -47.2 13.7 -0.4 4.5 181 606 A W H X S+ 0 0 7 -4,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.919 110.4 48.3 -49.7 -52.7 16.9 -2.5 5.2 182 607 A M H X S+ 0 0 2 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.880 108.7 54.0 -62.2 -37.7 16.6 -2.0 9.0 183 608 A F H X S+ 0 0 1 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.886 102.1 58.3 -63.8 -39.0 13.0 -3.0 8.9 184 609 A G H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.923 109.2 45.0 -51.3 -49.2 14.0 -6.2 7.1 185 610 A V H X S+ 0 0 2 -4,-1.6 4,-2.5 -22,-0.2 -2,-0.2 0.882 110.1 54.6 -63.2 -41.5 16.1 -7.0 10.1 186 611 A C H X S+ 0 0 1 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.905 107.7 50.3 -61.1 -38.8 13.3 -6.0 12.5 187 612 A M H X S+ 0 0 2 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.886 109.2 51.2 -64.8 -41.5 11.0 -8.5 10.7 188 613 A W H X S+ 0 0 12 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.923 108.9 51.0 -57.5 -48.4 13.6 -11.2 11.1 189 614 A E H <>S+ 0 0 1 -4,-2.5 5,-2.8 2,-0.2 6,-0.6 0.902 111.2 49.5 -54.8 -43.9 13.8 -10.4 14.9 190 615 A I H ><5S+ 0 0 2 -4,-2.2 3,-2.0 1,-0.2 -2,-0.2 0.959 110.7 47.3 -61.8 -53.1 10.0 -10.7 15.1 191 616 A L H 3<5S+ 0 0 13 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.766 110.6 54.7 -59.9 -29.2 9.9 -14.0 13.3 192 617 A M T 3<5S- 0 0 47 -4,-1.9 3,-0.4 -5,-0.2 -1,-0.3 0.212 117.5-113.8 -87.9 13.0 12.7 -15.3 15.5 193 618 A H T < 5S- 0 0 33 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.871 79.5 -40.8 55.3 41.4 10.7 -14.3 18.7 194 619 A G S - 0 0 111 -2,-0.3 3,-0.7 1,-0.1 2,-0.1 -0.507 28.9-104.4 -78.0 149.0 19.1 -10.5 18.0 197 622 A P T 3 S+ 0 0 0 0, 0.0 -35,-0.1 0, 0.0 -1,-0.1 -0.437 97.3 8.5 -71.2 145.4 20.7 -10.4 14.5 198 623 A F T > S- 0 0 22 1,-0.2 3,-1.7 -2,-0.1 2,-0.1 0.848 82.4-168.4 54.5 42.5 24.3 -11.6 14.1 199 624 A Q T < S+ 0 0 149 -3,-0.7 -1,-0.2 1,-0.3 3,-0.1 -0.386 71.0 17.2 -61.0 132.6 24.6 -12.9 17.7 200 625 A G T 3 S+ 0 0 85 1,-0.3 2,-0.4 -2,-0.1 -1,-0.3 0.555 101.6 114.8 80.9 7.7 28.2 -13.8 18.6 201 626 A V < - 0 0 22 -3,-1.7 -1,-0.3 2,-0.0 2,-0.2 -0.921 67.5-120.5-112.9 137.3 29.6 -11.7 15.7 202 627 A K >> - 0 0 165 -2,-0.4 3,-1.3 1,-0.1 4,-0.6 -0.495 19.3-121.9 -79.2 145.0 31.7 -8.6 16.2 203 628 A N H >> S+ 0 0 77 1,-0.3 3,-1.6 2,-0.2 4,-0.6 0.888 110.8 54.0 -51.7 -49.1 30.4 -5.2 14.9 204 629 A N H 34 S+ 0 0 155 1,-0.3 4,-0.4 2,-0.2 -1,-0.3 0.707 107.1 53.1 -60.7 -23.4 33.5 -4.6 12.7 205 630 A D H <> S+ 0 0 92 -3,-1.3 4,-1.6 1,-0.2 -1,-0.3 0.574 89.3 81.5 -84.6 -13.5 33.1 -8.0 11.1 206 631 A V H S+ 0 0 33 -4,-0.4 4,-1.2 1,-0.2 -1,-0.2 0.924 109.5 44.8 -59.1 -44.7 32.6 -7.9 5.7 209 634 A R H <>S+ 0 0 99 -4,-1.6 5,-2.7 2,-0.2 -2,-0.2 0.877 113.5 48.8 -65.1 -45.0 29.9 -10.5 5.8 210 635 A I H ><5S+ 0 0 5 -4,-2.1 3,-1.0 1,-0.2 -2,-0.2 0.846 112.5 47.8 -64.7 -38.9 27.2 -8.3 4.2 211 636 A E H 3<5S+ 0 0 90 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.752 105.8 58.9 -74.7 -25.3 29.6 -7.3 1.4 212 637 A N T 3<5S- 0 0 145 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.374 125.2-106.7 -77.7 1.6 30.4 -11.0 0.9 213 638 A G T < 5 + 0 0 52 -3,-1.0 -3,-0.2 1,-0.3 2,-0.2 0.512 69.3 148.3 85.6 9.2 26.7 -11.5 0.3 214 639 A E < - 0 0 81 -5,-2.7 2,-0.3 -6,-0.1 -1,-0.3 -0.532 21.4-178.2 -75.9 142.1 25.8 -13.1 3.5 215 640 A R - 0 0 59 -2,-0.2 16,-0.1 0, 0.0 -5,-0.0 -0.961 39.1 -80.6-135.9 157.7 22.2 -12.5 4.9 216 641 A L - 0 0 9 -2,-0.3 -28,-0.0 1,-0.1 15,-0.0 -0.273 59.2-110.2 -54.1 136.5 20.3 -13.5 8.0 217 642 A P - 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.243 37.0 -84.9 -74.0 163.3 18.9 -17.0 7.5 218 643 A M - 0 0 95 1,-0.1 3,-0.1 4,-0.0 -30,-0.0 -0.502 49.0-120.8 -65.4 122.4 15.3 -17.9 7.0 219 644 A P > - 0 0 2 0, 0.0 3,-1.8 0, 0.0 8,-0.1 -0.354 36.9 -90.8 -58.5 146.4 13.6 -18.2 10.4 220 645 A P T 3 S+ 0 0 108 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.367 112.2 8.7 -58.4 135.8 12.0 -21.7 11.2 221 646 A N T 3 S+ 0 0 153 1,-0.3 -113,-0.0 -3,-0.1 -3,-0.0 0.525 90.8 140.4 60.7 12.7 8.3 -21.7 10.1 222 647 A C < - 0 0 10 -3,-1.8 -1,-0.3 1,-0.1 -4,-0.0 -0.647 61.8-110.1 -71.9 132.1 8.7 -18.3 8.3 223 648 A P >> - 0 0 18 0, 0.0 4,-2.3 0, 0.0 3,-0.9 -0.431 19.1-126.5 -64.2 140.2 6.7 -18.5 5.0 224 649 A P H 3> S+ 0 0 102 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.871 111.0 58.1 -56.2 -35.1 9.0 -18.6 2.0 225 650 A T H 3> S+ 0 0 66 1,-0.2 4,-1.2 2,-0.2 29,-0.1 0.821 107.5 46.2 -64.5 -30.6 7.0 -15.6 0.6 226 651 A L H <> S+ 0 0 3 -3,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.898 111.1 50.4 -81.6 -41.0 7.8 -13.6 3.7 227 652 A Y H X S+ 0 0 44 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.890 108.5 54.7 -58.8 -39.4 11.5 -14.5 3.7 228 653 A S H X S+ 0 0 52 -4,-2.5 4,-1.4 -5,-0.2 -1,-0.2 0.885 106.5 50.0 -59.9 -40.5 11.6 -13.5 -0.0 229 654 A L H X S+ 0 0 3 -4,-1.2 4,-1.4 1,-0.2 -1,-0.2 0.916 110.6 51.5 -65.1 -41.4 10.2 -10.0 0.9 230 655 A M H X S+ 0 0 0 -4,-2.1 4,-0.9 1,-0.2 -2,-0.2 0.878 106.2 52.3 -59.5 -45.1 12.9 -9.8 3.6 231 656 A T H < S+ 0 0 55 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.804 106.6 55.4 -64.8 -29.2 15.7 -10.6 1.1 232 657 A K H >< S+ 0 0 108 -4,-1.4 3,-1.3 1,-0.2 -1,-0.2 0.860 102.4 55.1 -67.8 -39.1 14.4 -7.8 -1.1 233 658 A C H 3< S+ 0 0 0 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.754 106.7 54.8 -58.8 -26.8 14.7 -5.4 1.8 234 659 A W T 3< S+ 0 0 5 -4,-0.9 -1,-0.2 -5,-0.1 2,-0.2 -0.021 71.2 140.9-103.4 27.8 18.4 -6.5 2.0 235 660 A A < - 0 0 19 -3,-1.3 6,-0.1 1,-0.2 5,-0.1 -0.547 55.1-134.8 -62.3 131.2 19.3 -5.7 -1.7 236 661 A Y S S+ 0 0 102 -2,-0.2 -69,-0.2 1,-0.1 -1,-0.2 0.904 93.5 69.3 -56.4 -41.2 22.8 -4.3 -1.5 237 662 A D S > S- 0 0 75 1,-0.1 3,-2.1 -71,-0.1 4,-0.5 -0.722 78.5-148.1 -83.4 117.5 21.7 -1.6 -4.0 238 663 A P G > S+ 0 0 35 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.810 95.3 63.8 -52.9 -35.1 19.2 0.8 -2.3 239 664 A S G 3 S+ 0 0 107 1,-0.2 -3,-0.0 -3,-0.0 -2,-0.0 0.666 98.9 55.2 -63.1 -20.6 17.4 1.4 -5.6 240 665 A R G < S+ 0 0 193 -3,-2.1 -1,-0.2 -5,-0.1 -6,-0.1 0.576 85.7 98.3 -94.0 -11.0 16.4 -2.3 -5.7 241 666 A R S < S- 0 0 15 -3,-1.2 -8,-0.2 -4,-0.5 -9,-0.0 -0.453 80.4-106.8 -74.9 147.9 14.7 -2.4 -2.3 242 667 A P - 0 0 8 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.372 32.6-117.1 -65.8 152.7 10.9 -2.1 -2.0 243 668 A R > - 0 0 177 1,-0.1 4,-2.2 -63,-0.0 3,-0.4 -0.491 29.4-106.9 -79.2 162.1 9.4 1.1 -0.7 244 669 A F H > S+ 0 0 1 1,-0.2 4,-2.6 2,-0.2 -121,-0.3 0.810 122.0 61.8 -62.9 -29.0 7.4 0.9 2.5 245 670 A T H > S+ 0 0 85 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.917 107.3 43.3 -59.0 -45.2 4.3 1.4 0.4 246 671 A E H > S+ 0 0 100 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.902 111.9 54.7 -63.4 -45.1 5.1 -1.8 -1.4 247 672 A L H X S+ 0 0 0 -4,-2.2 4,-3.1 1,-0.2 5,-0.2 0.916 106.0 51.1 -56.6 -49.3 6.0 -3.6 1.9 248 673 A K H X S+ 0 0 72 -4,-2.6 4,-2.1 -129,-0.2 -1,-0.2 0.899 111.2 47.7 -57.4 -43.6 2.6 -2.8 3.5 249 674 A A H X S+ 0 0 58 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.931 115.6 45.5 -64.8 -43.1 0.6 -4.1 0.5 250 675 A Q H X S+ 0 0 78 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.903 112.3 49.0 -65.9 -47.3 2.7 -7.3 0.4 251 676 A L H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 -1,-0.2 0.862 107.2 57.3 -61.2 -37.4 2.5 -7.8 4.2 252 677 A S H X S+ 0 0 45 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.923 109.8 44.6 -57.3 -47.5 -1.3 -7.3 4.0 253 678 A T H X S+ 0 0 79 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.906 113.4 49.6 -62.5 -45.8 -1.5 -10.2 1.4 254 679 A I H X S+ 0 0 5 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.872 111.0 50.3 -63.0 -40.1 0.8 -12.5 3.4 255 680 A L H X S+ 0 0 15 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.940 110.5 48.4 -62.7 -51.0 -1.2 -11.9 6.6 256 681 A E H < S+ 0 0 130 -4,-2.1 3,-0.2 1,-0.2 -2,-0.2 0.905 111.2 52.1 -55.1 -44.4 -4.5 -12.7 4.9 257 682 A E H < S+ 0 0 133 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.888 112.1 46.1 -56.9 -40.6 -2.9 -15.8 3.5 258 683 A E H < 0 0 80 -4,-1.9 -149,-0.2 -5,-0.1 -1,-0.2 0.698 360.0 360.0 -81.6 -22.5 -1.7 -16.9 7.0 259 684 A K < 0 0 161 -4,-1.7 -4,-0.0 -3,-0.2 -3,-0.0 -0.414 360.0 360.0 -60.5 360.0 -5.0 -16.2 8.9