==== 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 HYDROLASE 31-JUL-08 3E0N . COMPND 2 MOLECULE: PROSTASIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.SPRAGGON,M.HORNSBY,A.SHIPWAY,J.L.HARRIS,S.A.LESLEY . 254 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11136.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 156 61.4 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 . 76 29.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 2.0 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 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 1 0 1 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 . 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 . 5 4 2 3 1 3 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 . 0 0 0 0 0 1 0 0 1 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 B I 0 0 1 0, 0.0 2,-0.4 0, 0.0 188,-0.2 0.000 360.0 360.0 360.0 127.0 33.1 -5.3 22.6 2 17 B T B +A 188 0A 17 186,-2.8 186,-1.5 1,-0.2 131,-0.1 -0.909 360.0 16.6-113.8 139.5 32.3 -8.3 20.4 3 18 B G S S+ 0 0 43 -2,-0.4 -1,-0.2 129,-0.3 184,-0.1 0.582 102.7 103.2 87.6 6.0 34.7 -9.8 17.9 4 19 B G - 0 0 29 -3,-0.2 2,-0.3 184,-0.1 143,-0.2 -0.083 62.8-115.7-105.6-154.7 37.8 -8.2 19.5 5 20 B S E -B 146 0B 60 141,-2.7 141,-2.6 -3,-0.1 2,-0.5 -0.912 33.3 -80.5-139.0 173.7 40.6 -9.4 21.7 6 21 B S E -B 145 0B 63 -2,-0.3 139,-0.2 139,-0.2 138,-0.1 -0.598 43.3-135.2 -77.9 125.0 42.0 -8.8 25.2 7 22 B A - 0 0 11 137,-2.8 2,-0.3 -2,-0.5 137,-0.1 -0.308 20.8-115.0 -64.6 154.5 44.2 -5.8 25.4 8 23 B V > - 0 0 96 1,-0.1 3,-2.1 135,-0.1 4,-0.3 -0.701 45.0 -85.7 -87.1 155.0 47.5 -6.1 27.3 9 24 B A T 3 S+ 0 0 32 -2,-0.3 -1,-0.1 1,-0.3 49,-0.1 -0.286 116.5 20.7 -59.0 136.9 47.9 -4.1 30.5 10 25 B G T 3 S+ 0 0 27 95,-0.2 -1,-0.3 2,-0.1 48,-0.0 0.294 92.4 111.5 89.9 -13.6 49.0 -0.5 29.8 11 26 B Q S < S+ 0 0 73 -3,-2.1 -2,-0.1 1,-0.2 3,-0.1 0.886 88.2 20.6 -63.0 -42.6 47.9 -0.7 26.1 12 27 B W S > S+ 0 0 18 -4,-0.3 3,-2.2 1,-0.1 -1,-0.2 -0.668 73.0 170.7-128.5 70.9 45.0 1.9 26.3 13 28 B P T 3 S+ 0 0 17 0, 0.0 94,-1.3 0, 0.0 44,-0.3 0.541 72.1 61.5 -70.4 -7.4 45.9 3.8 29.4 14 29 B W T 3 S+ 0 0 23 92,-0.2 16,-2.9 94,-0.1 2,-0.3 0.544 79.0 108.0 -90.6 -9.5 43.2 6.5 28.8 15 30 B Q E < -K 29 0C 6 -3,-2.2 42,-0.5 14,-0.2 2,-0.3 -0.528 48.9-179.7 -71.4 130.4 40.4 3.9 29.0 16 31 B V E -K 28 0C 0 12,-2.6 12,-1.4 -2,-0.3 2,-0.4 -0.884 23.3-132.8-125.4 163.7 38.4 4.2 32.2 17 32 B S E -KL 27 55C 2 38,-2.4 38,-2.8 -2,-0.3 2,-0.5 -0.917 15.8-155.4-113.9 135.5 35.5 2.4 33.7 18 33 B I E -KL 26 54C 0 8,-3.1 7,-3.1 -2,-0.4 8,-1.6 -0.958 10.8-168.4-112.6 129.5 32.5 4.3 35.1 19 34 B T E -KL 24 53C 23 34,-2.7 34,-1.7 -2,-0.5 2,-0.4 -0.835 11.9-154.8-113.7 154.4 30.3 2.6 37.7 20 35 B Y E > S-KL 23 52C 34 3,-2.6 3,-1.9 -2,-0.3 32,-0.2 -0.995 87.3 -12.8-128.2 122.8 27.0 3.7 39.1 21 36 B E T 3 S- 0 0 135 30,-2.4 -1,-0.1 -2,-0.4 31,-0.1 0.869 133.5 -53.6 48.0 39.6 26.2 2.5 42.6 22 38 B G T 3 S+ 0 0 59 29,-0.5 2,-0.5 1,-0.2 -1,-0.3 0.382 114.4 116.4 86.4 -5.0 29.2 0.1 42.1 23 39 B V E < S-K 20 0C 94 -3,-1.9 -3,-2.6 1,-0.0 2,-0.2 -0.859 71.1-119.1-101.2 130.4 28.0 -1.4 38.8 24 40 B H E +K 19 0C 40 -2,-0.5 -5,-0.3 -5,-0.3 3,-0.1 -0.473 45.5 157.9 -66.7 127.2 30.1 -0.9 35.7 25 41 B V E - 0 0 49 -7,-3.1 167,-0.3 1,-0.4 2,-0.3 0.593 55.2 -2.4-121.8 -26.7 27.8 1.0 33.3 26 42 B a E -K 18 0C 3 -8,-1.6 -8,-3.1 167,-0.1 -1,-0.4 -0.980 58.0-120.1-158.1 168.1 30.0 2.8 30.7 27 43 B G E -K 17 0C 0 167,-3.0 12,-0.4 -2,-0.3 2,-0.3 -0.481 25.6-176.6-101.7-178.1 33.5 3.5 29.6 28 44 B G E -K 16 0C 0 -12,-1.4 -12,-2.6 -2,-0.2 2,-0.5 -0.964 23.6-114.9-165.0 176.5 35.2 6.9 29.3 29 45 B S E -KM 15 37C 0 8,-2.6 8,-2.6 -2,-0.3 2,-0.3 -0.988 21.7-129.2-126.0 126.0 38.5 8.4 28.1 30 46 B L E + M 0 36C 0 -16,-2.9 79,-2.4 -2,-0.5 6,-0.3 -0.552 30.9 171.9 -68.3 125.7 40.9 10.2 30.4 31 47 B V - 0 0 14 4,-2.8 2,-0.3 -2,-0.3 5,-0.2 0.473 63.1 -4.9-117.8 -3.3 41.7 13.5 28.6 32 48 B S S S- 0 0 8 3,-1.3 -1,-0.3 212,-0.1 3,-0.1 -0.948 91.5 -75.0-164.1-175.5 43.7 15.3 31.3 33 49 B E S S+ 0 0 86 -2,-0.3 67,-2.9 1,-0.2 65,-0.1 0.720 130.0 18.1 -63.1 -17.8 44.8 14.8 34.9 34 50 B Q S S+ 0 0 27 65,-0.2 62,-2.8 1,-0.1 2,-0.4 0.424 110.8 76.0-134.6 -1.1 41.2 15.6 36.1 35 51 B W E - N 0 95C 15 60,-0.2 -4,-2.8 -3,-0.1 -3,-1.3 -0.952 46.0-174.7-123.4 145.3 38.8 15.3 33.2 36 52 B V E -MN 30 94C 0 58,-2.6 58,-3.0 -2,-0.4 2,-0.4 -0.972 16.3-143.4-129.4 140.9 37.3 12.3 31.4 37 53 B L E +MN 29 93C 0 -8,-2.6 -8,-2.6 -2,-0.4 2,-0.2 -0.902 34.1 150.2-104.6 136.8 35.0 12.4 28.3 38 54 B S E - N 0 92C 0 54,-2.6 54,-2.2 -2,-0.4 2,-0.4 -0.683 48.9 -69.8-144.8-165.2 32.2 9.9 28.2 39 55 B A > - 0 0 0 -12,-0.4 3,-1.8 52,-0.3 52,-0.3 -0.859 30.4-138.1-101.4 138.3 28.7 9.6 26.6 40 56 B A G > S+ 0 0 0 -2,-0.4 3,-2.1 1,-0.3 -1,-0.1 0.772 99.4 69.0 -62.5 -27.2 25.9 11.7 28.0 41 57 B H G 3 S+ 0 0 16 1,-0.3 -1,-0.3 2,-0.1 49,-0.0 0.714 90.9 62.7 -71.5 -10.7 23.4 8.8 27.8 42 58 B a G < S+ 0 0 9 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.519 101.5 55.2 -83.3 -6.0 25.4 7.1 30.7 43 58AB F S < S- 0 0 14 -3,-2.1 -1,-0.2 -4,-0.2 -2,-0.1 -0.591 74.9-174.5-131.4 65.1 24.5 10.1 33.0 44 58BB P > - 0 0 15 0, 0.0 3,-2.0 0, 0.0 -3,-0.1 -0.276 37.7-111.0 -63.1 151.1 20.7 10.4 33.0 45 58CB S T 3 S+ 0 0 124 1,-0.3 0, 0.0 3,-0.0 0, 0.0 0.770 113.6 59.6 -52.6 -34.8 19.5 13.5 35.0 46 58DB E T 3 S+ 0 0 133 2,-0.1 -1,-0.3 0, 0.0 2,-0.1 0.633 84.2 96.3 -76.9 -11.3 18.0 11.4 37.7 47 58EB H S < S- 0 0 67 -3,-2.0 2,-0.5 1,-0.1 3,-0.1 -0.455 79.1-118.4 -80.9 149.9 21.2 9.8 38.7 48 58FB H > - 0 0 116 1,-0.1 3,-2.3 -2,-0.1 4,-0.3 -0.800 9.2-140.8 -89.9 127.4 23.2 11.2 41.6 49 58GB K G > S+ 0 0 71 -2,-0.5 3,-1.7 1,-0.3 24,-0.4 0.888 102.4 60.3 -49.5 -41.8 26.6 12.5 40.7 50 58HB E G 3 S+ 0 0 137 1,-0.3 -1,-0.3 22,-0.1 24,-0.0 0.567 93.5 66.0 -68.9 -7.7 27.9 11.1 44.0 51 63 B A G < S+ 0 0 14 -3,-2.3 -30,-2.4 -30,-0.1 -29,-0.5 0.517 85.9 88.7 -92.9 1.8 26.9 7.6 43.0 52 64 B Y E < -L 20 0C 2 -3,-1.7 21,-0.5 -4,-0.3 2,-0.3 -0.669 52.0-175.6 -95.9 150.4 29.4 7.4 40.2 53 65 B E E -L 19 0C 86 -34,-1.7 -34,-2.7 -2,-0.3 2,-0.4 -0.965 13.8-146.9-136.0 153.0 33.0 6.2 40.5 54 66 B V E -LO 18 71C 0 17,-2.6 17,-2.7 -2,-0.3 2,-0.5 -0.991 7.5-158.0-118.9 128.0 35.7 6.1 37.8 55 67 B K E -LO 17 70C 52 -38,-2.8 -38,-2.4 -2,-0.4 2,-0.3 -0.956 15.4-178.1-109.1 125.7 38.3 3.3 37.8 56 68 B L E + O 0 69C 1 13,-3.2 13,-2.5 -2,-0.5 -40,-0.1 -0.795 58.9 26.6-114.4 153.9 41.6 4.1 35.9 57 69 B G S S+ 0 0 8 -42,-0.5 2,-0.4 48,-0.5 -1,-0.1 0.542 86.2 122.1 78.4 6.8 44.7 2.0 35.3 58 70 B A + 0 0 11 -43,-0.2 -1,-0.2 1,-0.2 3,-0.1 -0.873 33.5 176.5-107.5 131.3 42.8 -1.4 35.5 59 71 B H S S+ 0 0 62 -2,-0.4 85,-1.8 1,-0.2 2,-0.7 0.763 80.9 49.1 -93.3 -37.6 42.9 -3.9 32.6 60 72 B Q B > S-Q 143 0D 59 83,-0.2 3,-1.5 3,-0.2 -1,-0.2 -0.877 74.2-159.1-100.3 113.4 40.9 -6.6 34.4 61 73 B L T 3 S+ 0 0 14 81,-2.6 81,-0.2 -2,-0.7 -1,-0.2 0.794 90.3 44.7 -62.8 -27.7 37.8 -4.9 35.9 62 74 B D T 3 S+ 0 0 86 79,-2.3 2,-0.4 -3,-0.1 -1,-0.3 0.069 99.0 84.0-104.9 21.7 37.3 -7.7 38.4 63 75 B S S < S- 0 0 36 -3,-1.5 -3,-0.2 78,-0.3 -4,-0.1 -0.988 80.8-118.9-123.8 132.2 40.9 -8.1 39.5 64 76 B Y - 0 0 197 -2,-0.4 2,-0.4 -6,-0.1 -2,-0.1 -0.363 34.5-172.6 -59.4 144.0 42.5 -6.0 42.1 65 77 B S > - 0 0 24 1,-0.1 3,-1.2 3,-0.0 -7,-0.0 -0.981 30.7-149.1-144.0 132.6 45.5 -4.0 40.8 66 78 B E T 3 S+ 0 0 168 -2,-0.4 -1,-0.1 1,-0.2 -8,-0.1 0.705 104.3 58.2 -68.8 -16.5 47.9 -1.9 42.7 67 79 B D T 3 S+ 0 0 73 -10,-0.1 -1,-0.2 -3,-0.1 2,-0.1 0.584 86.8 99.0 -86.8 -8.1 48.1 0.2 39.5 68 80 B A < - 0 0 25 -3,-1.2 2,-0.3 -13,-0.0 -11,-0.2 -0.478 53.0-165.8 -80.1 144.7 44.4 0.9 39.5 69 81 B K E -O 56 0C 69 -13,-2.5 -13,-3.2 -2,-0.1 2,-0.4 -0.976 4.2-156.9-126.6 146.2 43.0 4.3 40.9 70 82 B V E -O 55 0C 74 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.986 14.6-178.5-126.1 134.9 39.4 4.9 41.7 71 83 B S E -O 54 0C 16 -17,-2.7 -17,-2.6 -2,-0.4 2,-0.2 -0.936 20.4-136.6-131.8 151.1 38.0 8.5 41.8 72 84 B T - 0 0 65 -2,-0.3 25,-2.6 -19,-0.2 2,-0.4 -0.473 33.3-106.8 -93.8 176.3 34.7 10.1 42.5 73 85 B L E -P 96 0C 7 -21,-0.5 23,-0.3 -24,-0.4 3,-0.1 -0.896 24.4-175.3-110.9 138.6 33.2 12.9 40.3 74 86 B K E S+ 0 0 104 21,-3.1 2,-0.3 -2,-0.4 22,-0.2 0.630 77.4 13.3-103.0 -13.9 33.0 16.6 41.1 75 87 B D E -P 95 0C 64 20,-1.4 20,-2.5 -26,-0.1 2,-0.4 -0.988 52.4-165.7-157.1 147.8 31.1 17.6 38.0 76 88 B I E -P 94 0C 36 -2,-0.3 18,-0.2 18,-0.2 -27,-0.1 -0.995 12.3-176.5-130.7 125.1 29.2 16.0 35.1 77 89 B I E -P 93 0C 25 16,-3.0 16,-2.8 -2,-0.4 2,-0.2 -0.877 5.3-167.7-127.0 97.3 28.5 18.3 32.1 78 90 B P E -P 92 0C 58 0, 0.0 14,-0.3 0, 0.0 12,-0.1 -0.536 41.1 -90.9 -75.3 155.8 26.4 16.7 29.4 79 91 B H > - 0 0 32 12,-2.5 3,-1.8 10,-0.5 12,-0.1 -0.401 35.2-128.6 -62.5 139.1 26.3 18.5 26.1 80 92 B P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 9,-0.0 0.787 105.5 63.9 -70.6 -18.2 23.2 20.7 26.3 81 93 B S T 3 S+ 0 0 43 2,-0.0 2,-0.3 8,-0.0 7,-0.1 0.623 78.9 116.1 -72.4 -11.4 21.9 19.4 23.0 82 94 B Y < - 0 0 33 -3,-1.8 2,-0.4 7,-0.3 7,-0.1 -0.424 41.3-179.4 -71.5 127.8 21.5 16.0 24.6 83 95 B L > - 0 0 122 5,-0.6 3,-2.1 -2,-0.3 -42,-0.0 -0.983 37.7-104.9-118.3 129.6 17.9 14.6 24.9 84 96 B Q T 3 S+ 0 0 90 -2,-0.4 3,-0.1 1,-0.3 -43,-0.0 -0.315 107.0 13.7 -57.9 134.7 17.5 11.1 26.6 85 97 B E T 3 S+ 0 0 138 1,-0.3 2,-0.3 2,-0.1 -1,-0.3 0.434 109.0 107.8 74.1 3.5 16.7 8.4 24.0 86 98 B G < - 0 0 26 -3,-2.1 -1,-0.3 2,-0.1 -45,-0.0 -0.726 68.7-137.2-104.0 159.4 17.8 10.8 21.2 87 99 B S > + 0 0 14 -2,-0.3 3,-0.7 -3,-0.1 -1,-0.1 0.855 68.6 98.4 -87.3 -33.7 21.0 10.5 19.2 88 100 B Q T 3 S+ 0 0 65 1,-0.2 -5,-0.6 -7,-0.1 3,-0.1 -0.210 89.0 7.2 -62.5 138.8 22.3 14.1 19.1 89 101 B G T 3 + 0 0 1 1,-0.2 2,-2.3 -7,-0.1 -10,-0.5 0.790 68.5 169.7 74.3 29.4 24.9 15.4 21.6 90 102 B D < + 0 0 0 -3,-0.7 2,-0.3 -51,-0.1 138,-0.2 -0.451 42.0 98.5 -80.8 74.6 25.8 12.1 23.2 91 103 B I - 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