==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 25-AUG-11 3TK5 . COMPND 2 MOLECULE: FACTOR X HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.SUZUKI,A.MOCHIZUKI,T.NAGATA,H.TAKANO,H.KANNO,M.KISHIDA,T.O . 287 2 8 7 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13188.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 176 61.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 86 30.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 . 19 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 4 1 4 4 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 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 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 16 A I 0 0 0 0, 0.0 2,-0.5 0, 0.0 179,-0.2 0.000 360.0 360.0 360.0 124.7 10.7 14.1 31.8 2 17 A V B -A 179 0A 14 177,-3.3 177,-1.5 142,-0.0 2,-0.1 -0.858 360.0 -19.9 -93.9 127.1 8.7 12.2 34.4 3 18 A G S S+ 0 0 27 -2,-0.5 175,-0.1 130,-0.4 142,-0.1 -0.469 95.1 98.2 75.4-149.0 10.0 12.6 37.9 4 19 A G S S- 0 0 20 -2,-0.1 2,-0.3 143,-0.1 142,-0.2 -0.118 72.4 -72.5 63.1-160.0 13.6 13.9 38.3 5 20 A Q E -B 145 0B 104 140,-3.0 140,-3.2 1,-0.0 2,-0.1 -0.822 40.2 -88.3-131.6 164.8 14.5 17.5 39.0 6 21 A E E -B 144 0B 65 -2,-0.3 2,-0.6 138,-0.3 138,-0.3 -0.439 45.7-113.5 -60.1 143.0 14.8 20.9 37.5 7 22 A a - 0 0 1 136,-2.5 136,-0.2 50,-0.2 2,-0.1 -0.800 39.5-142.5 -73.7 123.2 18.0 21.6 35.8 8 23 A K > - 0 0 105 -2,-0.6 3,-3.0 1,-0.2 4,-0.4 -0.435 42.8 -54.9 -85.0 165.2 19.4 24.4 38.0 9 24 A D T 3 S- 0 0 92 1,-0.3 -1,-0.2 2,-0.1 94,-0.0 -0.059 126.6 -0.5 -46.3 123.8 21.3 27.3 36.7 10 25 A G T 3 S+ 0 0 1 -3,-0.1 276,-1.7 1,-0.1 -1,-0.3 0.329 101.1 110.1 84.5 -8.2 24.3 26.0 34.6 11 26 A E S < S+ 0 0 58 -3,-3.0 -2,-0.1 1,-0.2 3,-0.1 0.710 84.6 26.8 -78.1 -25.5 23.6 22.3 35.1 12 27 A a > + 0 0 8 -4,-0.4 3,-1.6 1,-0.1 -1,-0.2 -0.396 68.8 151.0-133.8 56.1 22.4 21.2 31.7 13 28 A P T 3 + 0 0 0 0, 0.0 92,-1.9 0, 0.0 42,-0.3 0.633 67.4 63.7 -71.6 -15.3 24.1 23.7 29.3 14 29 A W T 3 S+ 0 0 7 90,-0.2 17,-2.3 92,-0.1 2,-0.2 0.362 75.1 117.8 -85.9 -1.3 24.3 21.2 26.4 15 30 A Q E < -J 30 0C 8 -3,-1.6 40,-0.6 15,-0.2 2,-0.3 -0.529 41.3-176.4 -64.4 129.8 20.5 20.9 26.1 16 31 A A E -JK 29 54C 0 13,-2.3 13,-1.8 -2,-0.2 2,-0.4 -0.909 11.6-151.0-117.5 157.7 19.1 22.1 22.8 17 32 A L E -JK 28 53C 7 36,-1.8 36,-2.9 -2,-0.3 2,-0.6 -0.997 9.1-141.5-128.9 123.1 15.4 22.3 21.9 18 33 A L E -JK 27 52C 0 9,-2.8 8,-2.1 -2,-0.4 9,-0.9 -0.768 26.2-164.6 -84.5 122.3 14.0 22.0 18.4 19 34 A I E -JK 25 51C 3 32,-2.1 32,-2.2 -2,-0.6 6,-0.2 -0.911 8.2-137.1-113.3 138.1 11.2 24.5 18.0 20 35 A N E > - K 0 50C 51 4,-2.7 3,-2.6 -2,-0.4 30,-0.2 -0.180 41.5 -83.7 -80.9-180.0 8.5 24.5 15.3 21 36 A E T 3 S+ 0 0 128 28,-0.6 29,-0.1 1,-0.3 -1,-0.1 0.678 131.4 54.9 -59.2 -20.2 7.1 27.5 13.4 22 37 A E T 3 S- 0 0 84 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.364 119.2-112.0 -90.8 3.3 4.7 28.2 16.3 23 38 A N S < S+ 0 0 104 -3,-2.6 2,-0.4 1,-0.3 -2,-0.1 0.649 73.5 135.2 72.8 18.9 7.7 28.3 18.7 24 39 A E - 0 0 44 1,-0.0 -4,-2.7 2,-0.0 -1,-0.3 -0.819 56.7-120.6 -97.0 135.8 6.7 25.2 20.5 25 40 A G E +J 19 0C 15 -2,-0.4 -6,-0.2 -6,-0.2 3,-0.1 -0.489 35.7 165.5 -69.6 142.6 9.3 22.5 21.4 26 41 A F E + 0 0 32 -8,-2.1 157,-0.3 1,-0.5 2,-0.3 0.424 64.5 11.8-132.8 -10.6 8.8 19.1 19.8 27 42 A b E -J 18 0C 2 -9,-0.9 -9,-2.8 157,-0.1 -1,-0.5 -0.976 66.5-124.9-162.9 162.2 12.2 17.4 20.3 28 43 A G E -J 17 0C 2 157,-3.9 12,-0.4 -2,-0.3 2,-0.3 -0.490 20.0-172.9-106.5 176.5 15.5 17.8 22.1 29 44 A G E -J 16 0C 0 -13,-1.8 -13,-2.3 -2,-0.2 2,-0.4 -0.934 20.4-121.5-158.1 171.6 19.1 17.9 21.0 30 45 A T E -JL 15 38C 0 8,-2.2 8,-3.1 -2,-0.3 2,-0.5 -0.993 24.6-123.5-124.2 130.9 22.7 18.0 22.4 31 46 A I E + L 0 37C 0 -17,-2.3 76,-2.3 -2,-0.4 6,-0.2 -0.633 32.1 171.4 -72.8 122.2 25.2 20.7 21.7 32 47 A L - 0 0 14 4,-2.7 2,-0.3 -2,-0.5 5,-0.2 0.730 65.0 -27.2-100.6 -34.9 28.3 19.0 20.2 33 48 A S S S- 0 0 30 3,-1.3 -1,-0.4 72,-0.1 3,-0.3 -0.936 83.0 -69.3-166.0 179.8 30.2 22.2 19.2 34 49 A E S S+ 0 0 98 -2,-0.3 64,-3.8 1,-0.2 62,-0.0 0.778 133.2 28.4 -52.0 -28.6 29.6 25.8 18.2 35 50 A F S S+ 0 0 43 62,-0.2 59,-2.6 1,-0.1 2,-0.4 0.593 108.8 73.9-108.8 -16.8 28.1 24.6 14.9 36 51 A Y E - M 0 93C 12 -3,-0.3 -4,-2.7 57,-0.2 -3,-1.3 -0.900 46.1-171.7-123.1 135.4 26.6 21.1 15.5 37 52 A I E -LM 31 92C 0 55,-2.3 55,-3.0 -2,-0.4 2,-0.5 -0.941 16.2-145.3-116.8 130.2 23.6 19.7 17.3 38 53 A L E +LM 30 91C 0 -8,-3.1 -8,-2.2 -2,-0.4 2,-0.2 -0.851 35.2 145.7 -95.1 132.8 23.0 16.0 17.9 39 54 A T E - M 0 90C 0 51,-3.2 51,-2.2 -2,-0.5 2,-0.4 -0.845 47.9 -73.7-150.6-175.9 19.4 14.7 17.7 40 55 A A >> - 0 0 0 -12,-0.4 3,-1.4 49,-0.2 4,-0.5 -0.741 28.6-136.3 -91.5 138.3 17.2 11.8 16.7 41 56 A A G >4 S+ 0 0 0 -2,-0.4 3,-1.3 1,-0.3 4,-0.2 0.864 104.8 59.4 -52.7 -41.8 16.5 11.0 13.0 42 57 A H G >4 S+ 0 0 14 1,-0.3 3,-0.8 2,-0.2 -1,-0.3 0.638 91.7 68.3 -68.6 -16.4 12.8 10.5 13.8 43 58 A b G X4 S+ 0 0 0 -3,-1.4 3,-1.7 1,-0.2 -1,-0.3 0.789 86.6 69.0 -69.4 -26.3 12.5 14.1 15.1 44 59 A L G << S+ 0 0 25 -3,-1.3 3,-0.4 -4,-0.5 -1,-0.2 0.647 94.5 55.1 -70.7 -16.4 13.0 15.4 11.6 45 60 A Y G < S+ 0 0 103 -3,-0.8 -1,-0.3 -4,-0.2 -2,-0.2 0.543 90.7 77.6 -87.8 -8.2 9.6 14.0 10.6 46 61 A Q S < S+ 0 0 84 -3,-1.7 2,-0.3 -4,-0.2 -1,-0.2 0.353 103.2 17.1 -88.8 4.3 7.9 15.9 13.4 47 61AA A - 0 0 23 -3,-0.4 3,-0.2 1,-0.1 -1,-0.2 -0.896 56.7-139.3-171.8 146.4 7.9 19.3 11.6 48 62 A K S S+ 0 0 111 1,-0.3 2,-0.4 -2,-0.3 -1,-0.1 0.974 96.7 15.6 -69.5 -57.7 8.4 21.0 8.2 49 63 A R S S+ 0 0 73 2,-0.0 -28,-0.6 0, 0.0 2,-0.3 -0.972 76.5 162.3-122.8 133.1 10.5 23.9 9.3 50 64 A F E -K 20 0C 26 -2,-0.4 21,-0.5 -30,-0.2 2,-0.2 -0.968 19.8-155.0-144.2 161.9 12.2 24.1 12.7 51 65 A K E -KN 19 70C 90 -32,-2.2 -32,-2.1 -2,-0.3 2,-0.5 -0.723 24.4-112.2-122.2 177.8 15.0 26.0 14.5 52 66 A V E -KN 18 69C 0 17,-3.2 17,-3.4 -2,-0.2 2,-0.5 -0.971 22.5-162.2-120.1 130.1 17.2 25.2 17.5 53 67 A R E +KN 17 68C 26 -36,-2.9 -36,-1.8 -2,-0.5 2,-0.3 -0.943 11.8 177.6-112.9 126.8 17.0 27.0 20.9 54 68 A V E +KN 16 67C 2 13,-2.7 13,-1.9 -2,-0.5 -38,-0.1 -0.754 57.6 37.0-119.3 164.9 19.8 26.9 23.4 55 69 A G S S+ 0 0 8 48,-0.6 2,-0.4 -40,-0.6 10,-0.2 0.631 80.8 132.4 71.9 13.7 20.3 28.5 26.8 56 70 A D + 0 0 12 -41,-0.2 -1,-0.2 -3,-0.2 3,-0.1 -0.842 17.6 153.5-103.9 133.1 16.6 28.1 27.8 57 71 A R S S+ 0 0 59 -2,-0.4 86,-3.0 1,-0.3 2,-0.4 0.579 76.2 37.7-122.1 -27.7 15.5 26.6 31.2 58 72 A N B > -P 142 0D 15 3,-0.3 3,-1.4 84,-0.2 -1,-0.3 -0.957 62.8-165.9-129.8 108.8 12.1 28.3 31.6 59 73 A T T 3 S+ 0 0 58 82,-2.5 83,-0.1 -2,-0.4 -1,-0.1 0.624 88.1 58.2 -71.4 -14.7 10.1 28.6 28.4 60 74 A E T 3 S+ 0 0 119 81,-0.5 2,-0.3 1,-0.1 -1,-0.3 0.441 106.8 49.6 -92.8 -2.1 7.7 31.1 30.1 61 75 A Q S < S- 0 0 126 -3,-1.4 2,-0.8 0, 0.0 -3,-0.3 -0.998 76.4-124.5-146.1 134.4 10.3 33.6 31.0 62 76 A E + 0 0 118 -2,-0.3 -3,-0.1 1,-0.2 -6,-0.1 -0.694 28.3 174.9 -78.8 108.1 13.2 35.5 29.3 63 77 A E - 0 0 79 -2,-0.8 2,-0.2 -5,-0.2 -1,-0.2 0.427 46.6-116.9 -96.2 -0.6 16.3 34.7 31.5 64 78 A G S S+ 0 0 62 1,-0.1 -8,-0.1 0, 0.0 -2,-0.1 -0.236 97.5 84.1 99.1 -41.6 18.7 36.5 29.1 65 79 A G + 0 0 5 -10,-0.2 -9,-0.1 -2,-0.2 -11,-0.1 0.502 61.8 122.1 -77.8 -4.6 20.8 33.6 28.0 66 80 A E + 0 0 54 -11,-0.1 2,-0.3 -13,-0.1 -11,-0.2 -0.233 34.1 178.6 -66.9 144.5 18.5 32.3 25.2 67 81 A A E -N 54 0C 33 -13,-1.9 -13,-2.7 2,-0.0 2,-0.4 -0.973 15.7-153.7-147.1 130.5 19.6 32.0 21.6 68 82 A V E -N 53 0C 75 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.867 17.0-167.5-101.1 134.4 17.7 30.7 18.6 69 83 A H E -N 52 0C 12 -17,-3.4 -17,-3.2 -2,-0.4 2,-0.2 -0.983 15.5-130.8-125.9 141.2 19.7 29.3 15.7 70 84 A E E -N 51 0C 82 -2,-0.4 25,-2.6 -19,-0.2 2,-0.5 -0.583 25.0-118.9 -84.9 148.1 18.7 28.4 12.2 71 85 A V E +O 94 0C 33 -21,-0.5 23,-0.3 23,-0.3 3,-0.1 -0.761 28.3 177.7 -90.4 127.6 19.5 25.0 10.7 72 86 A E E S+ 0 0 109 21,-3.0 2,-0.4 -2,-0.5 22,-0.2 0.838 70.5 15.4 -92.6 -45.0 21.7 25.1 7.6 73 87 A V E -O 93 0C 63 20,-1.9 20,-2.6 2,-0.0 2,-0.6 -0.999 59.3-153.0-135.7 134.5 22.1 21.4 7.0 74 88 A V E -O 92 0C 70 -2,-0.4 2,-0.7 18,-0.2 18,-0.2 -0.933 12.7-168.5-101.9 117.6 20.2 18.3 8.3 75 89 A I E -O 91 0C 46 16,-3.1 16,-2.5 -2,-0.6 2,-0.3 -0.873 11.4-179.1-108.9 99.6 22.4 15.2 8.3 76 90 A K E -O 90 0C 83 -2,-0.7 14,-0.2 14,-0.2 2,-0.2 -0.749 37.2-103.1 -97.1 141.4 20.2 12.2 8.8 77 91 A H > - 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