==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BLOOD CLOTTING 26-JUN-08 2VWN . COMPND 2 MOLECULE: ACTIVATED FACTOR XA HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.GROEBKE-ZBINDEN,D.W.BANNER,J.M.BENZ,F.BLASCO,G.DECORET, . 278 4 8 5 3 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13549.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 60.4 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 . 83 29.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 . 14 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 7.2 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 3 3 3 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 0.000 360.0 360.0 360.0 120.6 20.6 70.5 7.1 2 17 A V B -A 179 0A 8 177,-3.2 177,-1.6 142,-0.0 132,-0.1 -0.829 360.0 -15.5 -92.2 130.3 18.8 72.3 9.9 3 18 A G S S+ 0 0 27 130,-0.5 175,-0.1 -2,-0.5 142,-0.1 -0.442 96.7 99.3 67.4-150.9 21.3 73.3 12.6 4 19 A G S S- 0 0 27 -2,-0.1 2,-0.3 143,-0.1 142,-0.2 -0.321 73.2 -82.7 67.9-154.5 24.7 71.6 12.4 5 20 A Q E -B 145 0B 141 140,-2.5 140,-3.2 -3,-0.1 2,-0.2 -0.948 36.8 -87.4-146.9 162.8 27.7 73.4 10.9 6 21 A E E -B 144 0B 98 -2,-0.3 2,-0.5 138,-0.3 138,-0.3 -0.494 48.5-112.6 -71.7 141.3 29.4 74.2 7.6 7 22 A a - 0 0 2 136,-2.8 136,-0.2 -2,-0.2 3,-0.1 -0.657 31.3-138.4 -71.7 127.2 31.8 71.5 6.4 8 23 A K >> - 0 0 151 -2,-0.5 3,-2.4 1,-0.2 4,-0.5 -0.298 44.1 -62.4 -76.8 168.4 35.4 72.8 6.4 9 24 A D T 34 S+ 0 0 68 1,-0.3 -1,-0.2 2,-0.1 272,-0.1 -0.285 124.3 3.8 -53.1 126.4 37.8 72.1 3.7 10 25 A G T 34 S+ 0 0 1 -3,-0.1 269,-1.9 270,-0.1 -1,-0.3 0.349 101.9 107.5 81.8 -5.4 38.5 68.3 3.4 11 26 A E T <4 S+ 0 0 56 -3,-2.4 -2,-0.1 1,-0.2 3,-0.1 0.774 88.4 23.8 -77.8 -29.5 35.9 67.5 6.2 12 27 A a S >< S+ 0 0 9 -4,-0.5 3,-1.5 1,-0.1 -1,-0.2 -0.474 73.4 152.4-132.2 59.0 33.1 66.0 4.0 13 28 A P T 3 + 0 0 0 0, 0.0 92,-1.6 0, 0.0 42,-0.2 0.631 64.9 63.0 -77.8 -11.7 35.0 64.8 0.9 14 29 A W T 3 S+ 0 0 6 90,-0.2 17,-2.6 92,-0.1 2,-0.2 0.408 76.4 119.1 -89.6 1.0 32.7 61.9 -0.0 15 30 A Q E < -J 30 0C 11 -3,-1.5 40,-0.6 15,-0.2 2,-0.3 -0.487 40.9-175.9 -67.7 132.2 29.7 64.4 -0.6 16 31 A A E -JK 29 54C 1 13,-2.5 13,-1.6 -2,-0.2 2,-0.4 -0.906 12.7-147.3-119.2 156.9 28.3 64.4 -4.1 17 32 A L E -JK 28 53C 4 36,-2.5 36,-3.1 -2,-0.3 2,-0.5 -0.990 6.1-144.4-125.9 127.2 25.6 66.7 -5.4 18 33 A L E -JK 27 52C 0 9,-3.1 8,-2.2 -2,-0.4 9,-1.0 -0.787 23.3-164.4 -86.5 129.3 23.1 65.8 -8.1 19 34 A I E -JK 25 51C 9 32,-2.7 32,-2.2 -2,-0.5 6,-0.2 -0.915 5.7-142.0-120.2 141.2 22.3 68.8 -10.3 20 35 A N E > - K 0 50C 23 4,-2.6 3,-2.6 -2,-0.4 30,-0.2 -0.181 42.7 -80.7 -91.7-174.7 19.4 69.2 -12.7 21 36 A E T 3 S+ 0 0 94 28,-0.5 29,-0.1 1,-0.3 -1,-0.1 0.678 130.3 59.4 -62.3 -19.6 19.1 70.9 -16.1 22 37 A E T 3 S- 0 0 140 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.367 117.3-115.4 -84.8 2.8 18.9 74.3 -14.3 23 38 A N S < S+ 0 0 119 -3,-2.6 2,-0.4 1,-0.3 -2,-0.2 0.763 74.4 134.1 64.8 27.8 22.3 73.5 -12.8 24 39 A E - 0 0 111 -4,-0.1 -4,-2.6 2,-0.0 -1,-0.3 -0.867 59.1-117.1-110.3 142.5 20.7 73.4 -9.3 25 40 A G E +J 19 0C 21 -2,-0.4 -6,-0.2 -6,-0.2 3,-0.1 -0.534 37.4 162.5 -75.1 137.7 21.3 70.8 -6.7 26 41 A F E + 0 0 16 -8,-2.2 2,-0.3 1,-0.4 157,-0.3 0.480 63.5 12.3-129.5 -13.0 18.2 68.8 -5.7 27 42 A b E -J 18 0C 0 -9,-1.0 -9,-3.1 157,-0.1 -1,-0.4 -0.988 66.2-125.7-158.4 156.4 19.7 65.7 -4.0 28 43 A G E -J 17 0C 1 157,-3.5 12,-0.4 -2,-0.3 2,-0.3 -0.413 19.3-171.5 -94.3-178.6 23.0 64.4 -2.5 29 44 A G E -J 16 0C 0 -13,-1.6 -13,-2.5 -2,-0.1 2,-0.4 -0.947 21.2-117.7-157.4 175.5 25.1 61.3 -3.0 30 45 A T E -JL 15 38C 0 8,-2.4 8,-2.8 -2,-0.3 2,-0.5 -0.978 24.5-125.8-123.2 127.2 28.1 59.5 -1.6 31 46 A I E + L 0 37C 0 -17,-2.6 76,-2.3 -2,-0.4 6,-0.2 -0.602 32.3 170.5 -71.5 123.5 31.3 58.9 -3.5 32 47 A L - 0 0 13 4,-3.0 2,-0.3 -2,-0.5 5,-0.2 0.721 62.9 -27.3-103.0 -30.1 32.0 55.1 -3.4 33 48 A S S S- 0 0 20 3,-1.3 -1,-0.4 72,-0.1 3,-0.3 -0.924 84.0 -67.8-168.0-178.2 34.9 54.8 -5.8 34 49 A E S S+ 0 0 79 -2,-0.3 64,-2.8 1,-0.2 62,-0.1 0.801 133.7 26.3 -56.4 -29.0 36.2 56.6 -9.0 35 50 A F S S+ 0 0 59 62,-0.2 59,-2.9 1,-0.1 2,-0.4 0.531 109.5 78.0-113.4 -8.8 33.2 55.5 -10.9 36 51 A Y E - M 0 93C 10 -3,-0.3 -4,-3.0 57,-0.2 -3,-1.3 -0.911 43.6-177.3-123.7 134.6 30.4 55.0 -8.4 37 52 A I E -LM 31 92C 0 55,-2.2 55,-2.8 -2,-0.4 2,-0.4 -0.974 18.0-145.1-119.9 134.4 28.0 57.3 -6.5 38 53 A L E +LM 30 91C 0 -8,-2.8 -8,-2.4 -2,-0.4 2,-0.2 -0.832 33.8 150.6 -96.0 134.3 25.5 56.0 -3.9 39 54 A T E - M 0 90C 0 51,-2.8 51,-2.3 -2,-0.4 2,-0.4 -0.817 47.2 -78.9-147.8-174.1 22.1 57.9 -3.8 40 55 A A > - 0 0 0 -12,-0.4 3,-1.1 49,-0.3 4,-0.5 -0.789 29.2-135.0 -93.6 139.6 18.4 57.4 -2.9 41 56 A A G > S+ 0 0 0 -2,-0.4 3,-1.5 1,-0.2 4,-0.4 0.861 104.9 63.1 -58.2 -36.2 16.1 55.8 -5.5 42 57 A H G > S+ 0 0 14 1,-0.3 3,-1.1 2,-0.2 4,-0.3 0.793 91.8 66.0 -65.1 -20.5 13.5 58.5 -4.9 43 58 A b G X S+ 0 0 0 -3,-1.1 3,-1.3 1,-0.2 4,-0.5 0.773 88.3 67.1 -67.3 -25.9 16.0 61.1 -6.2 44 59 A L G < S+ 0 0 28 -3,-1.5 -1,-0.2 -4,-0.5 3,-0.2 0.666 94.2 58.4 -73.3 -17.3 15.9 59.7 -9.7 45 60 A Y G < S+ 0 0 102 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.631 93.2 68.8 -84.1 -13.5 12.2 60.7 -10.0 46 61 A Q S < S+ 0 0 87 -3,-1.3 2,-0.3 -4,-0.3 -1,-0.2 0.723 108.4 22.5 -86.0 -23.9 12.9 64.4 -9.5 47 61AA A - 0 0 8 -4,-0.5 -1,-0.2 -3,-0.2 3,-0.1 -0.954 59.3-152.5-145.8 124.3 14.9 65.2 -12.6 48 62 A K S S+ 0 0 197 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.892 93.8 29.4 -58.2 -41.5 14.7 63.2 -15.9 49 63 A R S S+ 0 0 181 -3,-0.1 -28,-0.5 2,-0.0 2,-0.3 -0.981 77.7 154.6-125.6 131.4 18.2 64.4 -16.7 50 64 A F E -K 20 0C 26 -2,-0.4 21,-0.5 -30,-0.2 2,-0.3 -0.975 23.0-153.3-149.4 163.3 20.9 65.1 -14.1 51 65 A K E -K 19 0C 70 -32,-2.2 -32,-2.7 -2,-0.3 2,-0.4 -0.770 23.1-113.9-128.4 175.0 24.6 65.3 -13.6 52 66 A V E -KN 18 69C 0 17,-2.8 17,-2.9 -2,-0.3 2,-0.5 -0.955 19.4-163.0-118.6 126.9 26.9 64.9 -10.6 53 67 A R E -KN 17 68C 34 -36,-3.1 -36,-2.5 -2,-0.4 2,-0.3 -0.939 11.0-174.9-105.9 133.4 29.1 67.6 -9.1 54 68 A V E +KN 16 67C 1 13,-2.5 13,-1.9 -2,-0.5 -38,-0.1 -0.826 61.5 30.8-118.4 161.0 31.9 66.7 -6.7 55 69 A G S S+ 0 0 9 -40,-0.6 2,-0.4 48,-0.5 11,-0.2 0.473 80.4 136.8 77.9 0.5 34.3 68.9 -4.7 56 70 A D + 0 0 10 -41,-0.2 -1,-0.2 1,-0.1 3,-0.1 -0.671 19.0 160.9 -86.1 132.6 31.7 71.8 -4.2 57 71 A R S S+ 0 0 56 -2,-0.4 86,-2.2 1,-0.3 2,-0.4 0.497 75.0 34.4-118.3 -12.2 31.4 73.5 -0.8 58 72 A N B > -P 142 0D 11 3,-0.3 3,-1.5 84,-0.2 -1,-0.3 -0.895 61.6-160.9-146.1 108.4 29.7 76.7 -1.9 59 73 A T T 3 S+ 0 0 58 82,-2.8 83,-0.1 -2,-0.4 -1,-0.1 0.591 90.5 59.4 -73.4 -4.7 27.2 76.6 -4.8 60 74 A E T 3 S+ 0 0 137 81,-0.5 2,-0.4 1,-0.1 -1,-0.3 0.509 104.6 49.3 -95.5 -6.8 27.5 80.4 -5.3 61 75 A Q S < S- 0 0 120 -3,-1.5 2,-0.8 2,-0.0 -3,-0.3 -0.997 77.8-131.6-133.6 132.0 31.3 80.5 -6.0 62 76 A E - 0 0 190 -2,-0.4 2,-0.3 -6,-0.1 -3,-0.1 -0.769 40.2-177.1 -82.9 115.3 33.2 78.3 -8.4 63 77 A E > - 0 0 92 -2,-0.8 3,-2.0 -5,-0.2 -5,-0.0 -0.784 32.9 -78.4-119.2 159.3 36.1 77.1 -6.4 64 78 A G T 3 S+ 0 0 77 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 -0.190 112.2 28.4 -52.0 131.1 39.2 75.0 -7.0 65 79 A G T 3 S+ 0 0 28 1,-0.4 -1,-0.2 -3,-0.0 2,-0.2 0.198 80.9 130.6 103.4 -14.4 38.5 71.3 -7.1 66 80 A E < + 0 0 46 -3,-2.0 -1,-0.4 -11,-0.2 2,-0.3 -0.491 29.5 172.0 -69.2 141.9 34.9 71.3 -8.3 67 81 A A E -N 54 0C 29 -13,-1.9 -13,-2.5 -2,-0.2 2,-0.4 -0.991 24.1-137.2-150.7 147.9 34.2 69.0 -11.2 68 82 A V E -N 53 0C 82 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.892 17.8-168.9-112.2 138.2 31.1 67.8 -13.1 69 83 A H E -N 52 0C 15 -17,-2.9 -17,-2.8 -2,-0.4 2,-0.2 -0.983 15.7-135.5-128.8 135.6 30.5 64.2 -14.2 70 84 A E - 0 0 90 -2,-0.4 25,-2.7 -19,-0.2 2,-0.5 -0.566 25.8-119.8 -80.8 151.6 27.9 62.7 -16.5 71 85 A V E -O 94 0C 33 -21,-0.5 23,-0.3 23,-0.3 3,-0.1 -0.814 26.1-178.7 -96.0 126.0 26.0 59.5 -15.4 72 86 A E E S+ 0 0 112 21,-2.7 2,-0.4 -2,-0.5 22,-0.2 0.859 70.9 16.2 -88.6 -42.5 26.5 56.5 -17.7 73 87 A V E -O 93 0C 57 20,-1.7 20,-2.7 2,-0.0 2,-0.5 -0.998 61.2-154.7-137.5 135.0 24.3 53.9 -16.0 74 88 A V E -O 92 0C 70 -2,-0.4 2,-0.6 18,-0.2 18,-0.2 -0.946 8.3-167.6-108.6 126.4 21.6 54.3 -13.3 75 89 A I E -O 91 0C 36 16,-3.0 16,-2.8 -2,-0.5 2,-0.5 -0.913 11.4-178.5-115.7 101.0 21.0 51.2 -11.1 76 90 A K E -O 90 0C 75 -2,-0.6 14,-0.2 14,-0.2 12,-0.1 -0.874 37.5-102.1-103.0 129.6 17.8 51.7 -9.1 77 91 A H > - 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