==== 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 2VWO . 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, . 276 4 8 5 3 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13174.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 167 60.5 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 . 80 29.0 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 . 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 . 13 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 6.9 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 . 5 4 2 4 2 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 . 1 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 0.000 360.0 360.0 360.0 123.3 20.3 70.7 7.0 2 17 A V B -A 179 0A 10 177,-3.3 177,-1.5 142,-0.0 2,-0.2 -0.824 360.0 -16.0 -93.3 128.8 18.5 72.4 9.9 3 18 A G S S+ 0 0 27 130,-0.5 175,-0.1 -2,-0.5 142,-0.1 -0.487 96.3 100.6 72.0-148.1 20.9 73.5 12.5 4 19 A G S S- 0 0 27 -2,-0.2 2,-0.3 143,-0.1 142,-0.2 -0.249 71.3 -92.5 65.1-156.3 24.3 71.9 12.3 5 20 A Q E -B 145 0B 133 140,-2.4 140,-2.8 -3,-0.1 2,-0.1 -0.934 37.3 -77.4-148.8 171.9 27.3 73.8 10.8 6 21 A E E -B 144 0B 92 -2,-0.3 2,-0.5 138,-0.2 138,-0.3 -0.464 44.9-116.1 -74.7 144.0 29.1 74.3 7.6 7 22 A a - 0 0 2 136,-2.5 136,-0.2 -2,-0.1 3,-0.1 -0.697 31.8-142.3 -74.8 126.5 31.5 71.7 6.3 8 23 A K >> - 0 0 145 -2,-0.5 3,-2.2 1,-0.2 4,-0.5 -0.283 43.8 -58.0 -79.2 171.2 35.0 73.1 6.2 9 24 A D T 34 S+ 0 0 76 1,-0.3 -1,-0.2 2,-0.1 270,-0.1 -0.300 125.8 1.6 -47.3 125.5 37.6 72.3 3.5 10 25 A G T 34 S+ 0 0 1 -3,-0.1 267,-1.6 2,-0.1 -1,-0.3 0.387 101.8 107.7 81.7 -3.3 38.1 68.5 3.4 11 26 A E T <4 S+ 0 0 51 -3,-2.2 -2,-0.1 1,-0.2 3,-0.1 0.801 89.4 23.0 -82.9 -29.8 35.6 67.7 6.2 12 27 A a S >< S+ 0 0 8 -4,-0.5 3,-1.4 1,-0.1 -1,-0.2 -0.478 73.5 151.9-131.4 60.2 32.8 66.2 4.1 13 28 A P T 3 + 0 0 0 0, 0.0 92,-1.8 0, 0.0 42,-0.2 0.614 64.9 63.7 -77.6 -11.0 34.7 65.0 1.0 14 29 A W T 3 S+ 0 0 6 90,-0.2 17,-2.8 92,-0.1 2,-0.2 0.430 76.3 117.3 -88.6 -0.6 32.4 62.1 0.1 15 30 A Q E < -J 30 0C 9 -3,-1.4 40,-0.6 15,-0.2 2,-0.3 -0.488 41.9-175.1 -69.7 133.4 29.4 64.5 -0.5 16 31 A A E -JK 29 54C 1 13,-2.5 13,-1.6 -2,-0.2 2,-0.4 -0.900 12.2-147.6-119.0 157.6 28.0 64.5 -4.0 17 32 A L E -JK 28 53C 3 36,-2.3 36,-3.0 -2,-0.3 2,-0.5 -0.990 6.6-144.1-127.4 126.3 25.2 66.8 -5.3 18 33 A L E -JK 27 52C 0 9,-2.8 8,-2.1 -2,-0.4 9,-1.0 -0.779 21.2-161.5 -87.8 126.9 22.7 65.8 -8.0 19 34 A I E -JK 25 51C 9 32,-2.5 32,-2.1 -2,-0.5 6,-0.2 -0.902 3.6-144.0-116.8 137.8 21.9 68.8 -10.2 20 35 A N > - 0 0 27 4,-2.6 3,-2.7 -2,-0.4 30,-0.2 -0.131 44.3 -76.0 -91.2-172.5 18.9 69.1 -12.5 21 36 A E T 3 S+ 0 0 70 28,-0.5 29,-0.1 1,-0.3 -1,-0.1 0.652 131.9 58.5 -62.9 -11.9 18.4 70.7 -15.9 22 37 A E T 3 S- 0 0 134 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.328 116.3-115.2 -93.6 6.3 18.4 74.1 -14.2 23 38 A N S < S+ 0 0 119 -3,-2.7 2,-0.4 1,-0.3 -2,-0.1 0.751 76.0 132.2 61.5 23.9 21.9 73.4 -12.8 24 39 A E - 0 0 106 -4,-0.1 -4,-2.6 1,-0.0 -1,-0.3 -0.866 61.7-112.5-106.3 143.9 20.3 73.4 -9.3 25 40 A G E +J 19 0C 12 -2,-0.4 -6,-0.2 -6,-0.2 3,-0.1 -0.425 39.3 161.8 -69.5 140.9 20.8 70.8 -6.6 26 41 A F E + 0 0 21 -8,-2.1 2,-0.3 1,-0.5 157,-0.3 0.425 64.1 9.9-134.0 -12.4 17.8 68.7 -5.7 27 42 A b E -J 18 0C 0 -9,-1.0 -9,-2.8 157,-0.1 -1,-0.5 -0.984 67.0-122.0-160.1 159.1 19.4 65.7 -3.9 28 43 A G E -J 17 0C 1 157,-3.2 12,-0.4 -2,-0.3 2,-0.3 -0.444 19.2-169.4 -95.2 178.4 22.6 64.4 -2.4 29 44 A G E -J 16 0C 0 -13,-1.6 -13,-2.5 -2,-0.1 2,-0.5 -0.953 20.0-121.9-154.8 172.2 24.8 61.4 -3.0 30 45 A T E -JL 15 38C 0 8,-2.6 8,-2.9 -2,-0.3 2,-0.5 -0.982 24.1-126.3-122.8 125.8 27.8 59.6 -1.5 31 46 A I E + L 0 37C 0 -17,-2.8 76,-2.4 -2,-0.5 6,-0.2 -0.605 32.7 170.0 -70.0 123.6 31.0 59.0 -3.4 32 47 A L - 0 0 14 4,-2.9 2,-0.3 -2,-0.5 5,-0.2 0.717 62.7 -27.3-102.1 -30.1 31.8 55.3 -3.1 33 48 A S S S- 0 0 9 3,-1.4 -1,-0.4 72,-0.1 65,-0.1 -0.918 83.1 -66.6-167.7-176.9 34.6 55.0 -5.7 34 49 A E S S+ 0 0 70 -2,-0.3 64,-2.6 1,-0.2 62,-0.1 0.834 132.7 24.1 -57.5 -32.1 36.0 56.6 -8.8 35 50 A F S S+ 0 0 58 62,-0.2 59,-2.9 1,-0.1 2,-0.4 0.516 110.8 77.0-114.3 -6.5 33.0 55.6 -10.8 36 51 A Y E - M 0 93C 10 57,-0.2 -4,-2.9 -3,-0.1 -3,-1.4 -0.923 44.6-176.0-123.8 136.5 30.1 55.1 -8.3 37 52 A I E -LM 31 92C 0 55,-2.1 55,-3.0 -2,-0.4 2,-0.4 -0.969 18.6-143.1-120.1 135.5 27.8 57.3 -6.3 38 53 A L E +LM 30 91C 0 -8,-2.9 -8,-2.6 -2,-0.4 2,-0.2 -0.831 34.8 150.9 -95.6 132.9 25.3 56.1 -3.8 39 54 A T E - M 0 90C 0 51,-2.8 51,-2.2 -2,-0.4 2,-0.4 -0.816 46.7 -79.3-145.9-174.0 21.9 57.9 -3.6 40 55 A A >> - 0 0 0 -12,-0.4 3,-1.2 49,-0.2 4,-0.6 -0.786 28.4-135.8 -93.4 136.2 18.2 57.4 -2.8 41 56 A A G >4 S+ 0 0 0 -2,-0.4 3,-1.2 1,-0.2 4,-0.4 0.849 103.9 62.9 -53.1 -38.2 16.0 55.7 -5.3 42 57 A H G >4 S+ 0 0 4 1,-0.2 3,-0.8 2,-0.2 4,-0.3 0.756 92.9 64.5 -64.0 -20.7 13.3 58.4 -4.7 43 58 A b G X4 S+ 0 0 0 -3,-1.2 3,-1.4 1,-0.2 -1,-0.2 0.788 88.4 68.0 -70.1 -28.2 15.6 61.1 -6.0 44 59 A L G X< S+ 0 0 31 -3,-1.2 3,-0.5 -4,-0.6 -1,-0.2 0.755 97.9 53.0 -66.0 -23.4 15.6 59.5 -9.5 45 60 A Y G < S+ 0 0 101 -3,-0.8 -1,-0.3 -4,-0.4 -2,-0.2 0.646 95.9 71.0 -81.5 -14.6 12.0 60.5 -9.9 46 61 A Q G < S+ 0 0 79 -3,-1.4 2,-0.3 -4,-0.3 -1,-0.2 0.232 94.9 43.4-102.9 14.4 12.5 64.2 -9.0 47 61AA A < - 0 0 20 -3,-0.5 3,-0.1 1,-0.1 -28,-0.0 -0.984 68.9-134.5-147.8 148.4 14.4 65.5 -12.1 48 62 A K S S- 0 0 174 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.961 94.5 -14.4 -65.6 -46.0 13.9 65.0 -15.8 49 63 A R S S- 0 0 165 -3,-0.1 -28,-0.5 2,-0.0 -1,-0.3 -0.955 77.1-172.5-148.4 155.2 17.6 64.4 -16.3 50 64 A F - 0 0 31 -2,-0.3 21,-0.5 -30,-0.2 2,-0.2 -0.987 14.0-155.0-152.4 161.5 20.5 65.1 -13.9 51 65 A K E -K 19 0C 63 -32,-2.1 -32,-2.5 -2,-0.3 2,-0.4 -0.724 26.4-111.2-125.5 177.9 24.3 65.2 -13.5 52 66 A V E -KN 18 69C 0 17,-3.0 17,-2.9 -2,-0.2 2,-0.5 -0.958 19.4-163.2-119.3 130.1 26.6 65.0 -10.5 53 67 A R E -KN 17 68C 33 -36,-3.0 -36,-2.3 -2,-0.4 2,-0.3 -0.932 11.3-174.0-108.6 132.2 28.8 67.7 -9.0 54 68 A V E +KN 16 67C 0 13,-2.7 13,-2.1 -2,-0.5 -38,-0.1 -0.860 61.6 29.3-117.4 158.2 31.6 66.8 -6.6 55 69 A G S S+ 0 0 5 -40,-0.6 2,-0.3 48,-0.5 11,-0.1 0.485 80.2 137.0 79.8 1.1 33.9 69.0 -4.6 56 70 A D + 0 0 9 -41,-0.2 -1,-0.2 11,-0.1 3,-0.1 -0.653 19.0 160.8 -85.3 136.4 31.4 71.9 -4.1 57 71 A R S S+ 0 0 59 -2,-0.3 86,-2.3 1,-0.3 2,-0.3 0.461 75.0 37.2-123.7 -11.4 30.9 73.6 -0.8 58 72 A N B > -P 142 0D 25 3,-0.3 3,-1.7 84,-0.2 -1,-0.3 -0.879 61.5-161.3-144.8 108.1 29.2 76.8 -1.9 59 73 A T T 3 S+ 0 0 59 82,-2.7 83,-0.1 -2,-0.3 -1,-0.1 0.562 91.6 56.3 -71.9 -5.2 26.7 76.7 -4.7 60 74 A E T 3 S+ 0 0 141 81,-0.4 2,-0.4 1,-0.1 -1,-0.3 0.414 105.5 53.1-102.3 0.2 27.1 80.5 -5.3 61 75 A Q S < S- 0 0 130 -3,-1.7 2,-0.7 2,-0.0 -3,-0.3 -0.990 77.9-129.4-136.2 131.0 30.9 80.5 -5.9 62 76 A E - 0 0 187 -2,-0.4 2,-0.3 -6,-0.1 -3,-0.1 -0.667 38.2-171.4 -79.0 116.2 32.9 78.5 -8.3 63 77 A E > - 0 0 49 -2,-0.7 3,-1.8 -5,-0.1 -5,-0.0 -0.791 31.2 -89.6-112.2 152.8 35.7 77.0 -6.1 64 78 A G T 3 S+ 0 0 77 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 -0.308 111.4 31.8 -53.5 133.0 38.9 75.1 -7.0 65 79 A G T 3 S+ 0 0 25 1,-0.4 -1,-0.2 -9,-0.0 2,-0.2 0.230 80.4 131.7 102.4 -13.2 38.1 71.4 -7.0 66 80 A E < + 0 0 46 -3,-1.8 -1,-0.4 -11,-0.1 2,-0.3 -0.501 29.9 174.4 -67.2 139.0 34.5 71.4 -8.2 67 81 A A E -N 54 0C 26 -13,-2.1 -13,-2.7 -2,-0.2 2,-0.4 -0.995 23.4-138.8-147.2 150.6 33.9 69.0 -11.1 68 82 A V E -N 53 0C 86 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.890 17.9-171.9-111.8 137.7 30.8 67.8 -13.0 69 83 A H E -N 52 0C 14 -17,-2.9 -17,-3.0 -2,-0.4 2,-0.2 -0.994 15.7-137.6-131.7 135.1 30.2 64.2 -14.0 70 84 A E - 0 0 102 -2,-0.4 25,-2.6 -19,-0.2 2,-0.5 -0.594 26.1-116.1 -85.6 153.9 27.5 62.7 -16.3 71 85 A V E -O 94 0C 36 -21,-0.5 23,-0.3 23,-0.2 3,-0.1 -0.794 25.4-176.9 -95.5 125.9 25.8 59.5 -15.3 72 86 A E E S+ 0 0 116 21,-2.7 2,-0.4 -2,-0.5 22,-0.2 0.869 72.4 10.4 -84.9 -44.8 26.3 56.5 -17.6 73 87 A V E -O 93 0C 62 20,-1.8 20,-2.8 2,-0.0 2,-0.5 -0.999 60.3-151.3-142.2 136.3 24.0 54.0 -15.8 74 88 A V E -O 92 0C 66 -2,-0.4 2,-0.6 18,-0.2 18,-0.2 -0.944 8.4-165.8-107.0 128.1 21.4 54.3 -13.1 75 89 A I E -O 91 0C 37 16,-3.0 16,-2.6 -2,-0.5 2,-0.4 -0.899 12.6-177.5-113.3 100.1 20.9 51.2 -10.9 76 90 A K E -O 90 0C 87 -2,-0.6 14,-0.2 14,-0.2 12,-0.1 -0.844 37.2-102.7-100.3 130.4 17.6 51.6 -8.9 77 91 A H > - 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