==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-OCT-09 3A7Z . COMPND 2 MOLECULE: CATIONIC TRYPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR J.YAMANE,M.YAO,I.TANAKA . 223 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9218.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 135 60.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 69 30.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 6.7 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 1 0 0 1 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 . 3 2 2 5 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 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 19 A I 0 0 2 0, 0.0 2,-0.5 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 124.4 -8.0 -8.6 14.5 2 20 A V B +A 171 0A 9 169,-2.9 169,-2.0 1,-0.2 123,-0.1 -0.874 360.0 5.9-102.9 131.9 -10.3 -9.4 17.4 3 21 A G S S+ 0 0 47 121,-0.6 -1,-0.2 -2,-0.5 169,-0.1 0.713 103.4 115.7 74.9 23.0 -12.0 -6.5 19.4 4 22 A G - 0 0 37 -3,-0.3 2,-0.3 167,-0.1 134,-0.2 0.015 58.7-108.3-103.1-153.0 -10.8 -3.8 17.0 5 23 A Y E -B 137 0B 96 132,-2.7 132,-2.9 -3,-0.1 2,-0.5 -0.942 34.7 -86.6-141.7 160.6 -12.5 -1.4 14.6 6 24 A T E -B 136 0B 76 -2,-0.3 130,-0.2 130,-0.2 129,-0.1 -0.590 36.9-151.7 -68.8 119.2 -12.9 -0.8 10.9 7 25 A a - 0 0 18 128,-1.9 -1,-0.2 -2,-0.5 129,-0.1 0.898 35.1-114.8 -58.6 -43.8 -9.8 1.2 9.8 8 26 A G > - 0 0 26 127,-0.5 3,-1.8 -3,-0.1 4,-0.3 0.032 46.0 -58.4 103.4 136.6 -11.5 3.1 6.9 9 27 A A T 3 S- 0 0 55 1,-0.3 44,-0.1 2,-0.1 43,-0.1 -0.224 117.9 -9.8 -53.2 125.2 -10.5 2.6 3.3 10 28 A N T 3 S+ 0 0 26 42,-0.4 -1,-0.3 2,-0.1 43,-0.1 0.651 92.5 124.6 60.6 22.9 -6.8 3.4 2.6 11 29 A T S < S+ 0 0 84 -3,-1.8 -2,-0.1 1,-0.3 -1,-0.1 0.580 75.3 49.1 -83.9 -10.1 -6.2 4.9 6.1 12 30 A V S > S+ 0 0 7 -4,-0.3 3,-2.0 87,-0.1 -1,-0.3 -0.710 74.5 175.5-125.7 74.0 -3.3 2.5 6.6 13 31 A P T 3 S+ 0 0 30 0, 0.0 88,-1.4 0, 0.0 38,-0.3 0.606 72.9 55.0 -69.5 -12.8 -1.5 3.1 3.3 14 32 A Y T 3 S+ 0 0 19 86,-0.2 15,-2.3 88,-0.1 2,-0.4 0.485 81.7 110.7 -92.2 -8.7 1.5 0.8 4.1 15 33 A Q E < -J 28 0C 5 -3,-2.0 36,-0.4 13,-0.2 37,-0.4 -0.563 48.5-174.0 -71.8 123.5 -0.7 -2.2 4.8 16 34 A V E -J 27 0C 0 11,-2.6 11,-1.1 -2,-0.4 2,-0.5 -0.848 19.7-140.5-114.7 154.0 -0.4 -4.9 2.1 17 35 A S E -JK 26 49C 1 32,-2.3 32,-2.8 -2,-0.3 2,-0.6 -0.951 15.1-142.9-105.6 131.5 -2.2 -8.2 1.5 18 36 A L E -JK 25 48C 0 7,-3.2 6,-2.6 -2,-0.5 7,-1.0 -0.890 24.4-167.6 -93.9 126.9 -0.1 -11.1 0.3 19 37 A N E +JK 23 47C 18 28,-2.8 28,-2.7 -2,-0.6 4,-0.2 -0.955 31.5 166.4-124.3 127.6 -2.1 -13.1 -2.2 20 38 A S S S- 0 0 30 2,-2.1 3,-0.1 -2,-0.4 26,-0.1 -0.335 97.7 -46.5-126.5 49.8 -1.6 -16.6 -3.6 21 39 A G S S+ 0 0 69 26,-0.1 2,-0.3 1,-0.0 -2,-0.1 0.166 140.5 28.6 100.0 -13.6 -5.1 -17.0 -5.1 22 40 A Y S S- 0 0 131 -4,-0.0 -2,-2.1 0, 0.0 2,-0.3 -0.935 102.9 -81.4-166.5 154.3 -6.5 -15.8 -1.7 23 41 A H E +J 19 0C 35 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.553 52.5 158.0 -62.2 132.0 -5.3 -13.4 1.1 24 42 A F E + 0 0 34 -6,-2.6 2,-0.3 1,-0.4 151,-0.2 0.511 57.6 6.7-131.4 -12.3 -3.0 -15.4 3.4 25 43 A b E -J 18 0C 7 -7,-1.0 -7,-3.2 151,-0.1 -1,-0.4 -0.980 61.2-122.9-163.9 156.4 -0.8 -12.8 5.2 26 44 A G E +J 17 0C 0 151,-3.0 12,-0.4 -2,-0.3 2,-0.3 -0.448 27.9 177.8 -93.0 176.5 -0.3 -9.1 5.8 27 45 A G E -J 16 0C 0 -11,-1.1 -11,-2.6 -2,-0.2 2,-0.4 -0.951 24.9-117.9-166.6 173.8 2.9 -7.1 5.1 28 46 A S E -JL 15 36C 0 8,-2.5 8,-2.8 -2,-0.3 2,-0.5 -0.990 19.8-131.6-129.7 126.9 4.2 -3.6 5.3 29 47 A L E + L 0 35C 1 -15,-2.3 74,-2.4 -2,-0.4 6,-0.2 -0.650 26.8 174.3 -75.7 122.8 5.5 -1.5 2.4 30 48 A I E - 0 0 19 4,-2.6 2,-0.3 -2,-0.5 5,-0.2 0.602 66.5 -9.6-111.2 -13.8 8.9 -0.0 3.4 31 49 A N E > S- L 0 34C 47 3,-1.3 3,-0.8 70,-0.1 -1,-0.3 -0.936 91.2 -72.9-162.0-175.8 9.8 1.5 0.0 32 50 A S T 3 S+ 0 0 42 -2,-0.3 62,-3.3 1,-0.2 60,-0.1 0.722 128.7 23.0 -60.1 -22.4 8.5 1.5 -3.6 33 51 A Q T 3 S+ 0 0 74 60,-0.2 57,-2.7 1,-0.1 2,-0.4 0.377 109.7 74.1-128.0 12.0 9.8 -2.1 -4.2 34 52 A W E < -LM 31 89C 1 -3,-0.8 -4,-2.6 55,-0.2 -3,-1.3 -0.984 47.3-170.4-134.0 139.7 10.1 -3.8 -0.8 35 53 A V E -LM 29 88C 0 53,-2.6 53,-2.8 -2,-0.4 2,-0.5 -0.949 13.7-146.2-122.1 139.7 7.7 -5.3 1.7 36 54 A V E +LM 28 87C 0 -8,-2.8 -8,-2.5 -2,-0.4 2,-0.2 -0.924 33.6 149.2-103.2 132.2 8.5 -6.6 5.2 37 55 A S E - M 0 86C 0 49,-2.9 49,-2.3 -2,-0.5 2,-0.3 -0.730 49.2 -70.7-141.1-169.6 6.4 -9.6 6.4 38 56 A A > - 0 0 0 -12,-0.4 3,-1.5 47,-0.3 47,-0.3 -0.701 32.0-131.5 -88.7 142.9 6.8 -12.6 8.7 39 57 A A G > S+ 0 0 2 -2,-0.3 3,-2.2 1,-0.3 -1,-0.1 0.840 108.4 65.4 -59.1 -33.0 9.1 -15.5 7.7 40 58 A H G 3 S+ 0 0 62 1,-0.3 -1,-0.3 41,-0.1 137,-0.0 0.611 93.1 63.5 -68.9 -6.1 6.2 -17.9 8.6 41 59 A b G < S+ 0 0 3 -3,-1.5 -1,-0.3 -15,-0.0 -2,-0.2 0.404 77.4 131.1 -89.2 -1.3 4.4 -16.2 5.7 42 60 A Y < + 0 0 135 -3,-2.2 2,-0.3 -4,-0.1 -3,-0.0 -0.285 21.7 130.6 -58.2 133.3 7.0 -17.6 3.3 43 61 A K - 0 0 54 3,-0.0 3,-0.3 0, 0.0 2,-0.1 -0.918 52.7-100.6-166.2 165.3 5.7 -19.3 0.1 44 62 A S S S+ 0 0 98 -2,-0.3 25,-0.0 1,-0.2 0, 0.0 -0.438 94.8 39.7 -84.8 163.7 6.3 -19.2 -3.6 45 63 A G S S+ 0 0 65 1,-0.2 2,-0.4 22,-0.1 -1,-0.2 0.857 74.2 171.0 70.3 39.0 4.0 -17.4 -6.1 46 64 A I - 0 0 9 -3,-0.3 21,-2.7 -26,-0.1 2,-0.5 -0.675 19.1-165.5 -83.4 131.0 3.2 -14.4 -4.0 47 65 A Q E -KN 19 66C 50 -28,-2.7 -28,-2.8 -2,-0.4 2,-0.4 -0.982 17.0-139.4-110.4 128.9 1.3 -11.4 -5.5 48 66 A V E -KN 18 65C 0 17,-3.0 17,-2.6 -2,-0.5 2,-0.6 -0.751 12.8-158.1 -89.8 129.9 1.5 -8.3 -3.4 49 67 A R E -KN 17 64C 52 -32,-2.8 -32,-2.3 -2,-0.4 3,-0.3 -0.942 13.3-178.0-116.1 111.5 -1.7 -6.3 -3.2 50 68 A L E + N 0 63C 2 13,-3.2 13,-2.0 -2,-0.6 -34,-0.1 -0.669 61.4 30.0-101.5 159.5 -1.4 -2.6 -2.3 51 69 A G S S+ 0 0 6 -36,-0.4 10,-0.3 -38,-0.3 2,-0.2 0.694 83.9 156.0 69.6 19.1 -4.1 -0.0 -1.8 52 70 A E + 0 0 10 -37,-0.4 -42,-0.4 -3,-0.3 -1,-0.2 -0.559 20.3 151.8 -80.3 139.8 -6.6 -2.7 -0.6 53 71 A D S S+ 0 0 14 1,-0.4 2,-0.8 4,-0.3 -1,-0.2 0.396 81.0 29.7-116.7 -78.0 -9.6 -2.1 1.6 54 72 A N S > S- 0 0 27 80,-0.2 3,-1.4 3,-0.2 -1,-0.4 -0.723 73.7-160.4 -78.7 112.3 -12.2 -4.8 0.8 55 73 A I T 3 S+ 0 0 30 78,-2.5 -1,-0.2 -2,-0.8 79,-0.1 0.611 88.8 52.7 -71.9 -8.3 -9.9 -7.7 -0.3 56 74 A N T 3 S+ 0 0 123 77,-0.2 2,-0.4 1,-0.1 -1,-0.3 0.389 106.2 56.6-104.5 0.9 -12.8 -9.3 -2.2 57 75 A V S < S- 0 0 76 -3,-1.4 2,-0.7 76,-0.1 -4,-0.3 -0.998 76.8-129.1-136.9 130.5 -13.8 -6.2 -4.3 58 76 A V + 0 0 116 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.1 -0.719 34.0 171.6 -78.4 114.9 -11.9 -4.1 -6.7 59 77 A E - 0 0 98 -2,-0.7 -1,-0.2 -5,-0.2 -7,-0.0 0.573 51.2 -95.3-109.4 -14.3 -12.6 -0.6 -5.4 60 78 A G S S+ 0 0 61 -9,-0.0 -8,-0.1 0, 0.0 -2,-0.1 0.241 105.5 72.1 127.2 -12.4 -10.2 1.6 -7.5 61 79 A N + 0 0 68 -10,-0.3 -9,-0.1 38,-0.0 2,-0.1 0.344 67.3 123.2-114.3 6.1 -7.0 2.2 -5.6 62 80 A E - 0 0 32 -13,-0.0 2,-0.4 -11,-0.0 -11,-0.3 -0.318 38.9-167.5 -67.2 146.0 -5.3 -1.2 -5.8 63 81 A Q E -N 50 0C 37 -13,-2.0 -13,-3.2 2,-0.1 2,-0.6 -0.977 6.9-163.8-126.9 123.3 -1.9 -2.1 -7.2 64 82 A F E +N 49 0C 77 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.940 16.5 169.9-104.7 118.5 -1.3 -5.8 -7.8 65 83 A I E -N 48 0C 13 -17,-2.6 -17,-3.0 -2,-0.6 2,-0.1 -0.993 29.2-128.5-134.3 123.5 2.4 -6.5 -8.2 66 84 A S E -N 47 0C 52 -2,-0.4 25,-2.9 -19,-0.3 26,-0.3 -0.378 29.1-112.1 -65.1 147.0 4.0 -10.0 -8.3 67 85 A A E -O 90 0C 17 -21,-2.7 23,-0.3 23,-0.2 3,-0.1 -0.610 21.6-166.0 -78.7 139.6 7.0 -10.7 -6.0 68 86 A S E S- 0 0 57 21,-2.9 2,-0.3 1,-0.4 22,-0.2 0.712 72.1 -3.4 -94.5 -27.7 10.3 -11.2 -7.8 69 87 A K E -O 89 0C 88 20,-1.2 20,-3.0 2,-0.0 2,-0.4 -0.975 55.8-149.8-161.3 151.3 12.0 -12.6 -4.8 70 88 A S E -O 88 0C 39 -2,-0.3 2,-0.5 18,-0.2 18,-0.2 -0.949 8.4-162.5-120.3 143.4 11.6 -13.4 -1.1 71 89 A I E -O 87 0C 35 16,-3.1 16,-2.7 -2,-0.4 2,-0.3 -0.937 6.0-159.2-128.2 107.0 14.3 -13.4 1.5 72 90 A V E -O 86 0C 46 -2,-0.5 14,-0.2 14,-0.2 12,-0.1 -0.619 42.0 -88.2 -78.2 142.8 13.7 -15.2 4.8 73 91 A H > - 0 0 23 12,-2.4 3,-1.7 -2,-0.3 -1,-0.1 -0.225 34.8-123.9 -50.7 137.0 15.9 -14.0 7.7 74 92 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.761 109.7 42.1 -56.8 -23.8 19.1 -16.1 7.7 75 93 A S T 3 S+ 0 0 72 8,-0.1 2,-0.1 2,-0.1 -2,-0.1 0.198 78.8 142.2-112.6 15.2 18.4 -17.2 11.3 76 94 A Y < - 0 0 55 -3,-1.7 2,-0.5 9,-0.1 7,-0.2 -0.379 32.1-164.0 -61.1 128.6 14.7 -17.9 11.1 77 95 A N > - 0 0 65 5,-2.2 4,-2.2 -2,-0.1 5,-0.5 -0.971 7.7-162.9-116.8 111.6 13.7 -20.9 13.3 78 96 A S T 4 S+ 0 0 80 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.670 87.5 55.1 -69.6 -19.3 10.2 -22.1 12.3 79 97 A N T 4 S+ 0 0 151 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.901 123.8 22.1 -79.7 -43.4 9.9 -24.1 15.6 80 98 A T T 4 S- 0 0 68 2,-0.1 -2,-0.2 -3,-0.0 -1,-0.1 0.590 96.8-131.8 -95.5 -14.7 10.5 -21.2 18.0 81 99 A L >< + 0 0 31 -4,-2.2 3,-0.8 1,-0.3 2,-0.2 0.603 49.3 159.3 63.4 17.1 9.6 -18.4 15.6 82 100 A N T 3 + 0 0 39 -5,-0.5 -5,-2.2 1,-0.2 -1,-0.3 -0.506 66.7 16.4 -65.1 139.2 12.8 -16.7 16.5 83 101 A N T 3 S+ 0 0 17 -7,-0.2 2,-1.9 1,-0.2 -10,-0.2 0.904 80.0 179.2 62.9 44.6 13.8 -14.2 13.8 84 102 A D < + 0 0 1 -3,-0.8 2,-0.3 75,-0.2 123,-0.2 -0.505 35.0 114.7 -80.8 76.2 10.3 -14.2 12.2 85 103 A I + 0 0 0 -2,-1.9 -12,-2.4 -47,-0.3 2,-0.3 -0.998 36.5 178.0-149.4 141.1 10.9 -11.7 9.4 86 104 A M E -MO 37 72C 0 -49,-2.3 -49,-2.9 -2,-0.3 2,-0.4 -0.995 18.3-141.6-144.7 144.0 11.1 -11.8 5.7 87 105 A L E -MO 36 71C 0 -16,-2.7 -16,-3.1 -2,-0.3 2,-0.4 -0.868 13.5-164.2-104.1 142.8 11.6 -9.3 2.9 88 106 A I E -MO 35 70C 0 -53,-2.8 -53,-2.6 -2,-0.4 2,-0.4 -0.991 7.2-150.8-128.5 123.0 9.7 -9.5 -0.4 89 107 A K E -MO 34 69C 40 -20,-3.0 -21,-2.9 -2,-0.4 -20,-1.2 -0.804 16.0-130.2 -95.5 136.9 10.8 -7.6 -3.5 90 108 A L E - 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