==== 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 04-AUG-08 3E1X . COMPND 2 MOLECULE: PROSTASIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.SPRAGGON,M.HORNSBY,A.SHIPWAY,J.L.HARRIS,S.A.LESLEY . 247 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11592.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 147 59.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 30.0 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 . 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 . 13 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 0 1 0 0 1 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 . 3 4 1 3 2 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 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 B I 0 0 1 0, 0.0 2,-0.4 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 123.4 3.5 32.2 3.2 2 17 B T B +A 188 0A 18 186,-3.5 186,-1.0 1,-0.2 131,-0.1 -0.835 360.0 8.0-106.3 138.2 1.4 34.6 1.2 3 18 B G S S+ 0 0 46 129,-0.5 -1,-0.2 -2,-0.4 2,-0.1 0.656 102.1 108.6 76.2 16.8 -1.4 33.4 -1.1 4 19 B G - 0 0 30 -3,-0.4 2,-0.3 184,-0.1 143,-0.2 -0.050 63.3-113.5-100.1-153.7 -1.2 29.8 -0.1 5 20 B S E -B 146 0B 58 141,-2.4 141,-2.5 -3,-0.1 2,-0.3 -0.920 33.8 -81.5-139.7 168.2 -3.6 27.7 2.0 6 21 B S E -B 145 0B 64 -2,-0.3 139,-0.2 139,-0.2 138,-0.1 -0.554 40.9-141.0 -73.0 128.5 -3.7 26.0 5.4 7 22 B A - 0 0 3 137,-3.4 2,-0.3 -2,-0.3 137,-0.1 -0.341 22.1-115.3 -71.3 167.5 -2.0 22.6 5.4 8 23 B V > - 0 0 93 1,-0.1 3,-2.2 -2,-0.1 4,-0.3 -0.802 41.7 -81.1-101.8 153.2 -3.7 19.9 7.5 9 24 B A T 3 S+ 0 0 53 -2,-0.3 -1,-0.1 1,-0.3 50,-0.1 -0.198 117.7 16.0 -46.2 135.1 -2.1 18.3 10.6 10 25 B G T 3 S+ 0 0 33 95,-0.2 -1,-0.3 2,-0.1 49,-0.0 0.382 93.1 112.3 81.6 -5.5 0.4 15.6 9.6 11 26 B Q S < S+ 0 0 73 -3,-2.2 -2,-0.1 1,-0.3 3,-0.1 0.883 89.0 22.6 -72.0 -37.5 0.6 16.8 5.9 12 27 B W S > S+ 0 0 17 -4,-0.3 3,-2.2 1,-0.1 -1,-0.3 -0.632 74.3 172.3-127.5 71.6 4.2 18.0 6.0 13 28 B P T 3 S+ 0 0 17 0, 0.0 94,-1.5 0, 0.0 44,-0.3 0.504 72.5 60.2 -70.8 -4.3 5.6 16.0 8.9 14 29 B W T 3 S+ 0 0 25 92,-0.2 16,-2.4 94,-0.1 2,-0.3 0.534 79.2 107.6 -94.4 -10.1 9.2 17.2 8.3 15 30 B Q E < -J 29 0C 4 -3,-2.2 42,-0.5 14,-0.2 43,-0.3 -0.533 48.9-179.4 -72.0 130.6 8.3 20.8 8.7 16 31 B V E -JK 28 56C 1 12,-2.3 12,-1.2 -2,-0.3 2,-0.5 -0.861 24.2-129.4-122.5 162.0 9.7 22.2 12.0 17 32 B S E -JK 27 55C 1 38,-2.4 38,-3.0 -2,-0.3 2,-0.5 -0.939 16.2-154.7-108.8 129.8 9.5 25.6 13.7 18 33 B I E -JK 26 54C 0 8,-3.1 7,-3.0 -2,-0.5 8,-1.6 -0.916 14.6-170.4-103.1 125.5 12.7 27.2 14.9 19 34 B T E -JK 24 53C 18 34,-3.1 34,-1.8 -2,-0.5 2,-0.4 -0.819 14.2-157.9-114.3 150.3 12.3 29.7 17.7 20 35 B Y E > S-JK 23 52C 24 3,-2.6 3,-1.8 -2,-0.3 32,-0.2 -0.991 85.5 -11.3-125.8 123.2 14.8 32.0 19.3 21 36 B E T 3 S- 0 0 135 30,-2.4 31,-0.1 -2,-0.4 -1,-0.1 0.889 133.2 -53.4 50.6 42.8 14.0 33.2 22.8 22 38 B G T 3 S+ 0 0 60 29,-0.6 2,-0.4 1,-0.2 -1,-0.3 0.357 115.2 112.8 82.7 -2.2 10.6 31.7 22.4 23 39 B V E < S-J 20 0C 93 -3,-1.8 -3,-2.6 1,-0.0 2,-0.3 -0.867 72.8-115.3-109.8 128.8 9.7 33.5 19.2 24 40 B H E +J 19 0C 40 -2,-0.4 -5,-0.3 -5,-0.3 3,-0.1 -0.486 44.9 159.4 -57.1 124.9 9.3 31.7 15.8 25 41 B V E - 0 0 50 -7,-3.0 2,-0.3 1,-0.4 167,-0.3 0.633 56.9 -0.3-119.7 -25.0 12.1 33.0 13.5 26 42 B a E -J 18 0C 5 -8,-1.6 -8,-3.1 167,-0.1 -1,-0.4 -0.981 60.1-117.6-158.3 162.9 12.5 30.3 10.8 27 43 B G E -J 17 0C 0 167,-3.0 12,-0.4 -2,-0.3 2,-0.3 -0.422 29.8-178.7 -94.4 175.5 11.3 27.0 9.4 28 44 B G E -J 16 0C 0 -12,-1.2 -12,-2.3 -2,-0.1 2,-0.4 -0.955 22.3-120.3-163.1 174.0 13.5 23.9 9.1 29 45 B S E -JL 15 37C 0 8,-2.5 8,-2.7 -2,-0.3 2,-0.3 -0.990 19.8-129.2-131.5 128.8 13.1 20.3 7.8 30 46 B L E + L 0 36C 0 -16,-2.4 79,-2.4 -2,-0.4 6,-0.3 -0.581 29.3 171.9 -72.2 131.3 13.7 17.2 9.8 31 47 B V - 0 0 24 4,-3.0 2,-0.3 -2,-0.3 5,-0.2 0.552 62.4 -5.9-121.8 -6.5 16.1 14.9 8.0 32 48 B S S S- 0 0 28 3,-1.4 -1,-0.2 75,-0.1 3,-0.2 -0.910 91.2 -72.4-164.6-170.3 16.7 12.1 10.6 33 49 B E S S+ 0 0 102 -2,-0.3 67,-3.1 1,-0.2 65,-0.1 0.747 130.4 16.9 -69.1 -23.5 16.0 11.3 14.2 34 50 B Q S S+ 0 0 14 65,-0.2 62,-2.5 211,-0.1 2,-0.4 0.345 111.3 81.9-131.3 8.0 18.3 14.0 15.5 35 51 B W E - M 0 95C 2 60,-0.2 -4,-3.0 -3,-0.2 -3,-1.4 -0.958 43.8-177.9-129.5 138.2 19.1 16.3 12.6 36 52 B V E -LM 30 94C 0 58,-2.4 58,-3.2 -2,-0.4 2,-0.4 -0.979 16.2-144.7-125.5 143.0 17.3 19.3 11.0 37 53 B L E +LM 29 93C 0 -8,-2.7 -8,-2.5 -2,-0.4 56,-0.2 -0.910 32.8 147.4-105.5 136.2 18.3 21.4 8.0 38 54 B S E - M 0 92C 0 54,-2.4 54,-2.1 -2,-0.4 2,-0.4 -0.618 50.9 -68.3-145.2-163.9 17.5 25.1 8.0 39 55 B A > - 0 0 0 -12,-0.4 3,-1.4 52,-0.3 52,-0.3 -0.815 30.5-134.1 -99.5 145.7 19.2 28.2 6.5 40 56 B A G > S+ 0 0 4 -2,-0.4 3,-2.2 1,-0.3 -1,-0.1 0.864 103.0 66.1 -62.4 -34.6 22.5 29.5 7.8 41 57 B H G 3 S+ 0 0 55 1,-0.3 -1,-0.3 43,-0.1 44,-0.0 0.688 89.4 66.9 -65.6 -13.0 21.1 33.0 7.9 42 58 B a G < S+ 0 0 10 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.523 97.0 58.6 -80.9 -5.1 18.7 32.0 10.7 43 58AB F S < S- 0 0 17 -3,-2.2 -1,-0.2 -4,-0.1 -2,-0.1 -0.593 72.4-174.0-129.0 67.8 21.6 31.5 13.0 44 58BB P > - 0 0 47 0, 0.0 3,-1.6 0, 0.0 -3,-0.0 -0.279 35.7-117.0 -62.2 150.0 23.6 34.6 13.4 45 58CB S T 3 S+ 0 0 114 1,-0.3 0, 0.0 3,-0.0 0, 0.0 0.774 110.8 64.5 -57.0 -28.7 26.9 34.3 15.4 46 58DB E T 3 S+ 0 0 140 2,-0.1 -1,-0.3 0, 0.0 2,-0.2 0.616 84.5 93.8 -74.0 -14.4 25.5 36.7 18.1 47 58EB H S < S- 0 0 63 -3,-1.6 2,-0.4 1,-0.0 3,-0.0 -0.562 78.6-121.5 -84.0 149.8 22.7 34.4 19.1 48 58FB H > - 0 0 112 -2,-0.2 3,-2.0 1,-0.1 4,-0.3 -0.764 10.2-140.3 -92.9 128.4 23.1 31.9 22.0 49 58GB K G > S+ 0 0 94 -2,-0.4 3,-1.8 1,-0.3 24,-0.4 0.879 100.9 59.7 -53.1 -42.0 22.7 28.2 21.1 50 58HB E G 3 S+ 0 0 175 1,-0.3 -1,-0.3 22,-0.1 24,-0.0 0.555 95.4 64.2 -66.1 -12.0 20.8 27.6 24.3 51 63 B A G < S+ 0 0 22 -3,-2.0 -30,-2.4 -30,-0.1 -29,-0.6 0.495 87.6 89.5 -92.3 -4.8 18.1 30.1 23.4 52 64 B Y E < -K 20 0C 2 -3,-1.8 21,-0.4 -4,-0.3 2,-0.3 -0.645 50.5-178.7 -91.5 153.2 16.9 28.2 20.3 53 65 B E E -K 19 0C 81 -34,-1.8 -34,-3.1 -2,-0.3 2,-0.4 -0.979 16.8-146.9-141.0 161.0 14.3 25.5 20.2 54 66 B V E -KN 18 71C 0 17,-2.6 17,-2.2 -2,-0.3 2,-0.5 -0.983 11.2-157.0-122.6 128.6 12.9 23.4 17.4 55 67 B K E -KN 17 70C 46 -38,-3.0 -38,-2.4 -2,-0.4 2,-0.3 -0.952 15.4-177.8-113.0 127.0 9.2 22.4 17.5 56 68 B L E +KN 16 69C 1 13,-3.2 13,-2.5 -2,-0.5 -40,-0.1 -0.821 60.8 30.2-120.0 152.9 8.3 19.3 15.6 57 69 B G S S+ 0 0 9 -42,-0.5 2,-0.3 48,-0.4 -1,-0.2 0.612 85.1 141.3 77.5 10.9 4.9 17.7 15.0 58 70 B A + 0 0 14 -43,-0.3 -1,-0.3 -3,-0.2 3,-0.2 -0.670 25.3 166.2 -89.6 138.2 3.2 21.1 15.2 59 71 B H S S+ 0 0 42 1,-0.4 85,-1.4 -2,-0.3 2,-0.6 0.706 81.2 30.4-106.9 -60.7 0.3 22.1 12.9 60 72 B Q B > S-P 143 0D 68 83,-0.2 3,-1.3 1,-0.1 -1,-0.4 -0.884 75.3-152.6-100.1 117.3 -1.0 25.2 14.7 61 73 B L T 3 S+ 0 0 21 81,-2.2 81,-0.2 -2,-0.6 -1,-0.1 0.816 93.6 46.0 -60.2 -32.8 2.0 26.9 16.4 62 74 B D T 3 S+ 0 0 88 79,-2.4 2,-0.3 2,-0.1 -1,-0.3 0.474 97.4 89.4 -90.5 -3.2 -0.2 28.5 19.1 63 75 B S S < S- 0 0 38 -3,-1.3 2,-0.3 78,-0.5 -4,-0.1 -0.717 79.2-119.2 -98.5 141.8 -2.2 25.4 19.9 64 76 B Y - 0 0 192 -2,-0.3 2,-0.4 -6,-0.1 -2,-0.1 -0.604 37.2-179.2 -73.8 142.0 -1.3 22.8 22.4 65 77 B S - 0 0 34 -2,-0.3 3,-0.5 1,-0.1 -7,-0.0 -0.989 33.7-150.8-142.7 134.7 -0.8 19.4 20.8 66 78 B E S S+ 0 0 153 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.618 100.0 59.9 -76.7 -8.6 0.0 16.1 22.4 67 79 B D S S+ 0 0 66 -10,-0.1 -1,-0.2 2,-0.0 38,-0.1 0.704 86.6 92.4 -89.5 -19.2 1.7 15.2 19.1 68 80 B A - 0 0 18 -3,-0.5 2,-0.4 -11,-0.1 -11,-0.2 -0.363 56.1-163.0 -79.5 150.0 4.2 18.0 19.1 69 81 B K E -N 56 0C 103 -13,-2.5 -13,-3.2 -2,-0.1 2,-0.4 -0.997 3.5-155.9-129.4 137.5 7.7 17.7 20.5 70 82 B V E +N 55 0C 78 -2,-0.4 2,-0.3 -15,-0.2 -15,-0.2 -0.934 17.0 177.9-115.2 137.9 10.0 20.6 21.4 71 83 B S E -N 54 0C 14 -17,-2.2 -17,-2.6 -2,-0.4 2,-0.2 -0.970 24.1-133.9-137.4 149.3 13.7 20.2 21.6 72 84 B T - 0 0 60 -2,-0.3 25,-2.9 -19,-0.2 2,-0.4 -0.434 37.1-104.1 -88.4 175.0 16.8 22.3 22.3 73 85 B L E -O 96 0C 7 -21,-0.4 23,-0.3 -24,-0.4 -21,-0.1 -0.905 22.1-170.6-107.9 133.3 19.9 22.1 20.0 74 86 B K E S+ 0 0 105 21,-2.5 2,-0.3 -2,-0.4 22,-0.2 0.751 80.9 9.4 -80.1 -32.3 23.2 20.3 20.8 75 87 B D E -O 95 0C 54 20,-1.6 20,-2.3 -26,-0.1 2,-0.4 -0.999 55.1-160.3-154.3 143.5 24.9 21.8 17.7 76 88 B I E -O 94 0C 33 -2,-0.3 18,-0.2 18,-0.2 -27,-0.0 -0.986 16.0-177.1-127.5 121.0 24.4 24.4 15.0 77 89 B I E -O 93 0C 21 16,-3.0 16,-2.7 -2,-0.4 2,-0.2 -0.853 4.4-170.7-125.9 92.6 26.5 24.0 11.9 78 90 B P E -O 92 0C 60 0, 0.0 14,-0.3 0, 0.0 12,-0.1 -0.511 43.0 -94.9 -73.9 151.9 26.2 26.6 9.2 79 91 B H > - 0 0 33 12,-2.5 3,-1.6 10,-0.5 12,-0.1 -0.504 34.6-124.6 -65.9 139.5 28.0 25.7 6.0 80 92 B P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 9,-0.0 0.680 105.0 63.6 -61.9 -23.1 31.4 27.4 6.2 81 93 B S T 3 S+ 0 0 34 8,-0.1 2,-1.0 2,-0.0 7,-0.2 0.621 72.2 104.6 -78.9 -10.5 30.9 29.2 2.9 82 94 B Y < + 0 0 46 -3,-1.6 7,-0.1 7,-0.4 3,-0.1 -0.564 39.6 156.6 -74.2 106.9 28.0 31.2 4.2 83 95 B L - 0 0 138 -2,-1.0 2,-0.3 5,-0.4 -1,-0.2 0.691 55.9 -21.4-107.0 -20.6 29.8 34.6 4.7 84 96 B Q S > S- 0 0 140 4,-0.2 3,-2.5 0, 0.0 -1,-0.3 -0.976 89.8 -42.6 179.7 168.1 27.0 37.2 4.6 85 97 B E T 3 S+ 0 0 165 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 -0.206 125.4 16.2 -55.8 140.8 23.5 38.0 3.5 86 98 B G T 3 S+ 0 0 25 1,-0.2 -1,-0.3 127,-0.1 88,-0.2 0.215 98.7 139.6 78.9 -13.2 22.7 36.8 -0.1 87 99 B S < - 0 0 18 -3,-2.5 3,-0.3 1,-0.1 -1,-0.2 -0.063 57.0-108.8 -62.7 160.0 25.8 34.5 0.2 88 100 B Q S S+ 0 0 82 -7,-0.2 -5,-0.4 1,-0.2 -4,-0.2 -0.322 98.2 54.8 -77.1 173.4 25.9 31.0 -1.1 89 101 B G + 0 0 0 1,-0.2 2,-2.5 -7,-0.1 -10,-0.5 0.749 63.3 162.5 70.1 27.4 26.0 28.1 1.4 90 102 B D + 0 0 2 -3,-0.3 2,-0.3 -51,-0.1 138,-0.2 -0.428 38.4 100.7 -79.0 71.6 22.9 29.4 3.1 91 103 B I - 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