==== 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 HYDROLASE 25-APR-94 2SFA . COMPND 2 MOLECULE: SERINE PROTEINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES FRADIAE; . AUTHOR K.KITADOKORO,H.TSUZUKI . 191 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7619.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 128 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 40.8 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 . 6 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 9 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 1 0 0 0 1 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 . 2 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 PARALLEL BRIDGES PER LADDER . 0 1 6 3 1 2 0 1 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 1 0 0 0 0 1 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 1 A I 0 0 36 0, 0.0 77,-1.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 137.2 12.3 17.1 12.6 2 2 A A > - 0 0 0 1,-0.1 3,-1.6 75,-0.1 15,-0.3 -0.636 360.0 -76.2-107.1 169.8 12.3 13.7 10.9 3 3 A G B 3 S+a 81 0A 0 77,-3.1 79,-2.8 1,-0.2 15,-0.2 -0.287 116.3 30.5 -60.7 141.9 10.3 12.1 8.1 4 4 A G T 3 S+ 0 0 0 13,-3.5 -1,-0.2 1,-0.3 107,-0.2 0.060 91.1 121.8 95.6 -24.5 6.8 11.0 9.2 5 5 A E < - 0 0 49 -3,-1.6 12,-2.8 1,-0.1 -1,-0.3 -0.369 69.1 -90.9 -76.7 151.7 6.4 13.8 11.8 6 6 A A E -C 16 0B 19 10,-0.2 2,-0.4 102,-0.1 10,-0.2 -0.270 34.2-168.4 -65.3 142.6 3.6 16.4 11.7 7 7 A I E -C 15 0B 1 8,-2.0 8,-2.6 40,-0.0 2,-0.4 -0.969 11.3-149.9-129.5 139.4 3.9 19.8 10.0 8 8 A Y E -CD 14 44B 49 36,-2.8 36,-2.6 -2,-0.4 2,-0.3 -0.974 6.9-135.0-123.0 133.8 1.3 22.5 10.5 9 9 A A E > - D 0 43B 0 4,-2.9 3,-1.8 -2,-0.4 34,-0.2 -0.583 37.1 -97.4 -82.9 142.0 0.1 25.2 8.1 10 10 A A T 3 S+ 0 0 41 32,-2.7 32,-0.1 1,-0.3 -1,-0.1 -0.378 113.5 15.3 -55.5 124.1 -0.3 28.8 9.4 11 11 A G T 3 S- 0 0 81 -2,-0.1 -1,-0.3 -3,-0.0 -2,-0.0 0.698 135.5 -41.2 80.8 21.4 -4.0 29.2 10.2 12 12 A G S < S+ 0 0 40 -3,-1.8 2,-0.1 1,-0.2 -4,-0.0 0.117 80.8 104.1 102.8 147.8 -4.8 25.4 10.2 13 13 A G - 0 0 38 -5,-0.1 -4,-2.9 2,-0.0 2,-0.4 0.082 40.0-145.5 113.8 131.5 -4.1 22.2 8.3 14 14 A R E +C 8 0B 87 -6,-0.2 2,-0.2 -2,-0.1 -6,-0.2 -0.976 24.5 155.9-123.5 139.9 -1.8 19.3 9.3 15 15 A a E -C 7 0B 11 -8,-2.6 -8,-2.0 -2,-0.4 2,-0.3 -0.687 38.0-103.0-138.2-165.9 0.3 17.1 7.0 16 16 A S E -C 6 0B 0 131,-2.5 17,-0.4 -10,-0.2 -10,-0.2 -0.948 27.9-113.4-124.2 150.6 3.4 14.9 7.5 17 17 A L - 0 0 1 -12,-2.8 -13,-3.5 -2,-0.3 133,-0.5 -0.582 24.8-164.6 -78.2 142.3 7.1 15.6 6.5 18 18 A G - 0 0 0 13,-3.0 2,-0.3 1,-0.3 132,-0.3 0.927 58.8 -30.3 -88.1 -78.7 8.3 13.2 3.8 19 19 A F E -E 31 0B 5 12,-0.6 12,-3.1 -16,-0.1 2,-0.4 -0.984 54.5-118.1-145.0 151.1 12.1 13.5 3.8 20 20 A N E +E 30 0B 4 58,-0.5 171,-1.7 -2,-0.3 2,-0.3 -0.740 41.3 176.8 -88.0 136.4 14.7 16.3 4.5 21 21 A V E -EF 29 190B 0 8,-3.1 8,-2.6 -2,-0.4 2,-0.3 -0.811 17.4-147.8-135.6 168.3 16.7 17.1 1.4 22 22 A R E -EF 28 189B 105 167,-1.9 167,-2.3 -2,-0.3 6,-0.2 -0.993 15.1-124.5-142.6 148.8 19.5 19.6 0.4 23 23 A S E > - F 0 188B 21 4,-2.9 3,-2.0 -2,-0.3 165,-0.2 -0.308 40.7 -97.9 -81.0 172.0 20.5 21.4 -2.8 24 24 A S T 3 S+ 0 0 130 163,-0.6 -1,-0.1 1,-0.3 164,-0.1 0.644 126.8 58.2 -66.1 -13.0 23.9 21.1 -4.3 25 25 A S T 3 S- 0 0 106 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.493 121.8-107.3 -94.6 -3.0 24.6 24.4 -2.6 26 26 A G S < S+ 0 0 44 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.555 70.0 144.7 91.9 6.2 23.8 23.0 0.8 27 27 A A - 0 0 17 1,-0.0 -4,-2.9 43,-0.0 -1,-0.3 -0.627 41.5-138.1 -77.1 141.7 20.5 24.7 1.3 28 28 A T E +E 22 0B 13 -2,-0.3 43,-2.3 -6,-0.2 2,-0.3 -0.784 27.3 165.3-110.4 146.9 18.0 22.4 3.1 29 29 A Y E -EG 21 70B 39 -8,-2.6 -8,-3.1 -2,-0.3 2,-0.4 -0.933 31.1-121.1-145.0 169.9 14.3 21.7 2.6 30 30 A A E -EG 20 69B 2 39,-2.3 39,-2.2 -2,-0.3 2,-0.3 -0.937 21.6-143.7-117.5 133.8 11.6 19.3 3.5 31 31 A L E +EG 19 68B 0 -12,-3.1 -13,-3.0 -2,-0.4 -12,-0.6 -0.766 34.9 146.1 -94.1 145.5 9.7 17.3 0.9 32 32 A T E - G 0 67B 0 35,-1.8 35,-1.9 -2,-0.3 2,-0.2 -0.804 54.0 -50.8-158.6-171.0 5.9 16.7 1.5 33 33 A A >> - 0 0 0 -17,-0.4 4,-1.9 33,-0.3 3,-1.0 -0.536 38.7-135.7 -76.9 146.0 2.8 16.4 -0.6 34 34 A G H 3> S+ 0 0 0 26,-0.4 4,-1.8 1,-0.3 27,-0.2 0.823 107.6 62.0 -68.0 -32.7 2.0 19.2 -3.2 35 35 A H H 34 S+ 0 0 41 25,-0.2 -1,-0.3 1,-0.2 4,-0.2 0.701 106.2 48.6 -68.8 -15.2 -1.6 19.2 -2.0 36 36 A a H X4 S+ 0 0 2 -3,-1.0 3,-2.2 2,-0.1 4,-0.4 0.914 108.9 47.2 -85.6 -55.0 -0.2 20.2 1.4 37 37 A T H >< S+ 0 0 0 -4,-1.9 3,-0.8 1,-0.3 -2,-0.2 0.772 100.2 71.6 -60.2 -22.1 2.1 23.1 0.3 38 38 A E T 3< S+ 0 0 92 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.1 0.760 91.2 59.3 -68.0 -21.5 -0.7 24.5 -1.8 39 39 A I T < S+ 0 0 91 -3,-2.2 2,-0.3 1,-0.2 -1,-0.2 0.750 115.3 0.4 -81.3 -23.3 -2.6 25.6 1.3 40 40 A A < - 0 0 15 -3,-0.8 -1,-0.2 -4,-0.4 -29,-0.0 -0.981 46.8-139.4-161.2 155.0 -0.1 27.9 3.0 41 41 A S S S+ 0 0 58 -2,-0.3 15,-2.9 14,-0.1 2,-0.4 0.716 87.4 61.9 -87.0 -25.3 3.3 29.5 2.7 42 42 A T E - H 0 55B 34 13,-0.2 -32,-2.7 -32,-0.1 2,-0.3 -0.929 63.8-170.4-116.9 134.1 4.4 29.2 6.4 43 43 A W E -DH 9 54B 0 11,-2.8 10,-3.0 -2,-0.4 11,-1.7 -0.895 4.3-165.3-126.2 145.7 4.8 26.0 8.3 44 44 A Y E -DH 8 52B 49 -36,-2.6 -36,-2.8 -2,-0.3 8,-0.2 -0.806 23.3-138.3-125.3 160.4 5.3 25.1 11.9 45 45 A T S S+ 0 0 50 6,-2.7 2,-0.3 -2,-0.3 7,-0.1 0.433 84.8 56.5-102.3 -0.5 6.4 21.9 13.8 46 46 A N S > S- 0 0 48 5,-0.5 3,-1.8 -38,-0.1 5,-0.1 -0.950 81.6-121.1-134.0 154.4 3.9 22.2 16.6 47 47 A S T 3 S+ 0 0 84 -2,-0.3 -35,-0.1 1,-0.3 -1,-0.1 0.768 113.0 58.5 -59.7 -35.2 0.1 22.4 16.8 48 48 A G T 3 S- 0 0 57 1,-0.0 -1,-0.3 -3,-0.0 -3,-0.0 0.535 105.3-132.1 -73.3 -9.3 0.3 25.8 18.7 49 49 A Q S < S+ 0 0 63 -3,-1.8 -2,-0.1 2,-0.1 3,-0.1 0.887 72.6 116.4 57.0 46.6 2.2 27.1 15.6 50 50 A T + 0 0 114 1,-0.2 2,-0.8 2,-0.0 -1,-0.1 0.591 57.7 71.3-113.5 -20.7 5.1 28.8 17.6 51 51 A S S S- 0 0 50 -5,-0.1 -6,-2.7 0, 0.0 -5,-0.5 -0.868 81.5-139.9-102.6 111.5 8.0 26.7 16.3 52 52 A L E +H 44 0B 80 -2,-0.8 -8,-0.3 -8,-0.2 3,-0.1 -0.507 24.8 179.5 -74.4 133.0 8.7 27.7 12.7 53 53 A L E - 0 0 2 -10,-3.0 19,-2.7 1,-0.3 20,-0.6 0.861 52.3-100.1 -87.7 -54.9 9.6 25.0 10.2 54 54 A G E -HI 43 71B 1 -11,-1.7 -11,-2.8 17,-0.3 2,-0.3 -0.995 37.7 -61.1 162.0-162.5 9.9 27.3 7.2 55 55 A T E -HI 42 70B 70 15,-1.2 15,-3.2 -2,-0.3 -13,-0.2 -0.919 52.6 -89.4-125.5 149.8 8.3 28.6 4.1 56 56 A R E + I 0 69B 100 -15,-2.9 13,-0.3 -2,-0.3 3,-0.1 -0.229 37.1 174.5 -55.2 134.6 7.0 27.1 0.9 57 57 A A E - 0 0 51 11,-3.3 2,-0.3 1,-0.4 12,-0.2 0.481 62.9 -6.9-121.4 -10.6 9.5 26.8 -1.9 58 58 A G E - I 0 68B 16 10,-1.4 10,-2.5 -24,-0.0 -1,-0.4 -0.892 50.5-159.1 176.4 151.3 7.6 24.8 -4.6 59 59 A T E + I 0 67B 62 -2,-0.3 2,-0.4 8,-0.2 8,-0.2 -0.981 8.4 178.9-148.9 131.6 4.5 23.0 -5.4 60 60 A S E + I 0 66B 29 6,-2.7 6,-2.3 -2,-0.3 -26,-0.4 -0.851 32.6 149.6-131.5 88.1 3.6 20.4 -8.0 61 61 A F + 0 0 25 -2,-0.4 2,-0.2 -27,-0.2 4,-0.2 -0.945 43.7 39.0-154.4 134.6 0.0 19.4 -7.5 62 62 A P S S+ 0 0 52 0, 0.0 2,-1.9 0, 0.0 70,-0.2 0.442 125.6 29.0 -66.2 169.7 -2.6 18.3 -9.4 63 63 A G B S+j 132 0C 34 68,-2.2 70,-2.3 -2,-0.2 2,-0.2 -0.556 136.3 20.0 85.3 -75.9 -0.7 15.9 -11.9 64 64 A N S S- 0 0 37 -2,-1.9 70,-0.1 68,-0.2 2,-0.1 -0.467 77.4-137.8-102.2-173.7 2.0 15.0 -9.4 65 65 A D + 0 0 1 -2,-0.2 2,-0.3 -4,-0.2 112,-0.2 -0.546 55.1 111.0-150.2 74.9 1.8 15.4 -5.7 66 66 A Y E + I 0 60B 17 -6,-2.3 -6,-2.7 -33,-0.3 2,-0.3 -0.965 32.6 177.2-145.7 155.4 5.0 16.8 -4.2 67 67 A G E -GI 32 59B 0 -35,-1.9 -35,-1.8 -2,-0.3 2,-0.4 -0.974 18.2-134.0-156.8 159.9 6.0 20.1 -2.6 68 68 A L E -GI 31 58B 8 -10,-2.5 -11,-3.3 -2,-0.3 -10,-1.4 -0.964 9.1-167.7-127.2 138.0 9.1 21.7 -1.0 69 69 A I E -GI 30 56B 1 -39,-2.2 -39,-2.3 -2,-0.4 2,-0.4 -0.987 22.9-132.3-123.0 125.4 9.5 23.8 2.2 70 70 A R E -GI 29 55B 102 -15,-3.2 -15,-1.2 -2,-0.4 2,-0.3 -0.707 26.7-120.1 -80.0 130.1 12.7 25.7 2.8 71 71 A H E - 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