==== 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 3A82 . 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) . 9175.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 134 60.1 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 . 14 6.3 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 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 . 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,-0.4 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 121.3 -8.0 -8.6 14.5 2 20 A V B +A 171 0A 10 169,-3.0 169,-1.9 1,-0.2 123,-0.1 -0.855 360.0 4.1 -99.7 131.9 -10.3 -9.4 17.5 3 21 A G S S+ 0 0 45 121,-0.6 -1,-0.2 -2,-0.4 169,-0.1 0.739 103.2 116.4 71.2 25.4 -12.0 -6.5 19.3 4 22 A G - 0 0 35 -3,-0.3 2,-0.3 167,-0.1 134,-0.2 0.007 58.8-106.6-102.3-151.8 -10.8 -3.8 17.0 5 23 A Y E -B 137 0B 97 132,-2.7 132,-3.1 -3,-0.1 2,-0.4 -0.948 33.8 -88.7-141.8 159.8 -12.4 -1.4 14.6 6 24 A T E -B 136 0B 75 -2,-0.3 130,-0.2 130,-0.2 129,-0.1 -0.590 36.9-151.5 -70.3 121.7 -12.9 -0.8 10.9 7 25 A a - 0 0 18 128,-2.1 -1,-0.2 -2,-0.4 129,-0.1 0.916 34.8-113.4 -62.2 -44.8 -9.9 1.3 9.9 8 26 A G > - 0 0 25 127,-0.5 3,-1.8 -3,-0.1 4,-0.3 -0.013 47.2 -58.5 107.2 138.6 -11.5 3.1 7.0 9 27 A A T 3 S- 0 0 53 1,-0.3 44,-0.1 2,-0.1 43,-0.1 -0.239 117.9 -9.4 -55.9 125.3 -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 0.638 91.7 125.3 63.8 22.1 -6.8 3.5 2.7 11 29 A T S < S+ 0 0 84 -3,-1.8 -2,-0.1 1,-0.2 -1,-0.1 0.548 74.6 49.6 -83.6 -9.0 -6.2 5.0 6.1 12 30 A V S > S+ 0 0 7 -4,-0.3 3,-2.0 87,-0.1 -1,-0.2 -0.725 74.6 176.0-126.6 74.2 -3.3 2.6 6.7 13 31 A P T 3 S+ 0 0 31 0, 0.0 88,-1.6 0, 0.0 38,-0.3 0.589 72.8 55.1 -69.9 -11.5 -1.5 3.2 3.4 14 32 A Y T 3 S+ 0 0 19 86,-0.2 15,-2.5 88,-0.1 2,-0.4 0.484 82.2 109.5 -93.8 -8.5 1.5 0.9 4.1 15 33 A Q E < -J 28 0C 5 -3,-2.0 37,-0.4 13,-0.2 36,-0.4 -0.578 49.0-174.5 -73.1 125.5 -0.6 -2.1 4.8 16 34 A V E -J 27 0C 1 11,-2.4 11,-1.1 -2,-0.4 2,-0.5 -0.845 20.2-139.3-117.1 156.2 -0.4 -4.8 2.1 17 35 A S E -JK 26 49C 1 32,-2.4 32,-2.9 -2,-0.3 2,-0.5 -0.960 14.9-143.4-108.9 131.8 -2.2 -8.0 1.5 18 36 A L E -JK 25 48C 0 7,-3.0 6,-2.6 -2,-0.5 7,-1.0 -0.878 23.5-168.0 -94.2 126.4 -0.1 -11.0 0.3 19 37 A N E +JK 23 47C 22 28,-2.9 28,-2.6 -2,-0.5 4,-0.2 -0.965 30.2 167.4-126.1 127.3 -2.2 -13.1 -2.2 20 38 A S S S- 0 0 30 2,-2.2 3,-0.1 -2,-0.4 26,-0.1 -0.340 97.6 -46.1-124.8 46.6 -1.5 -16.5 -3.6 21 39 A G S S+ 0 0 69 26,-0.1 2,-0.3 1,-0.0 -2,-0.1 0.194 141.2 26.4 102.1 -12.2 -5.0 -17.0 -5.1 22 40 A Y S S- 0 0 132 -4,-0.0 -2,-2.2 0, 0.0 2,-0.3 -0.929 103.9 -79.2-169.6 155.9 -6.4 -15.7 -1.8 23 41 A H E +J 19 0C 35 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.552 51.5 159.9 -65.0 131.6 -5.2 -13.4 1.1 24 42 A F E + 0 0 33 -6,-2.6 2,-0.3 1,-0.4 151,-0.2 0.505 58.2 2.2-128.8 -12.8 -2.8 -15.4 3.4 25 43 A b E -J 18 0C 6 -7,-1.0 -7,-3.0 151,-0.1 -1,-0.4 -0.979 61.0-120.9-164.7 158.8 -0.8 -12.7 5.2 26 44 A G E +J 17 0C 0 151,-3.0 12,-0.4 -2,-0.3 2,-0.3 -0.434 28.3 178.1 -93.7 177.7 -0.3 -9.0 5.8 27 45 A G E -J 16 0C 0 -11,-1.1 -11,-2.4 -2,-0.2 2,-0.4 -0.951 24.9-116.4-166.0 174.8 2.9 -7.0 5.2 28 46 A S E -JL 15 36C 0 8,-2.5 8,-2.8 -2,-0.3 2,-0.5 -0.991 20.1-131.0-129.8 128.0 4.2 -3.5 5.4 29 47 A L E + L 0 35C 1 -15,-2.5 74,-2.3 -2,-0.4 6,-0.2 -0.662 27.4 173.4 -76.6 124.4 5.5 -1.4 2.4 30 48 A I E - 0 0 19 4,-2.5 2,-0.3 -2,-0.5 5,-0.2 0.598 66.9 -7.7-112.3 -16.4 8.9 0.1 3.4 31 49 A N E > S- L 0 34C 48 3,-1.3 3,-0.9 70,-0.1 -1,-0.3 -0.931 91.2 -75.5-158.8-177.2 9.8 1.6 0.0 32 50 A S T 3 S+ 0 0 42 -2,-0.3 62,-3.3 1,-0.2 60,-0.1 0.709 128.2 24.9 -59.6 -19.8 8.5 1.6 -3.5 33 51 A Q T 3 S+ 0 0 73 60,-0.2 57,-2.8 1,-0.1 2,-0.4 0.387 109.7 73.1-125.6 8.6 9.8 -2.0 -4.2 34 52 A W E < -LM 31 89C 0 -3,-0.9 -4,-2.5 55,-0.2 -3,-1.3 -0.982 48.1-169.8-135.5 138.1 10.1 -3.8 -0.9 35 53 A V E -LM 29 88C 0 53,-2.7 53,-2.7 -2,-0.4 2,-0.5 -0.941 13.4-146.1-121.0 140.1 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 33.8 148.8-102.6 132.1 8.5 -6.5 5.2 37 55 A S E - M 0 86C 0 49,-2.8 49,-2.3 -2,-0.5 2,-0.3 -0.750 49.3 -70.0-141.1-169.0 6.4 -9.5 6.5 38 56 A A > - 0 0 0 -12,-0.4 3,-1.8 47,-0.3 47,-0.3 -0.704 31.9-132.4 -89.0 140.9 6.8 -12.5 8.8 39 57 A A G > S+ 0 0 2 -2,-0.3 3,-2.2 1,-0.3 -1,-0.1 0.838 108.2 65.0 -57.7 -34.4 9.1 -15.4 7.8 40 58 A H G 3 S+ 0 0 63 1,-0.3 -1,-0.3 41,-0.1 137,-0.0 0.633 92.7 64.9 -68.2 -6.9 6.3 -17.8 8.7 41 59 A b G < S+ 0 0 4 -3,-1.8 -1,-0.3 -15,-0.0 -2,-0.2 0.407 77.1 132.0 -86.9 -0.6 4.4 -16.2 5.8 42 60 A Y < + 0 0 134 -3,-2.2 2,-0.3 -4,-0.1 -3,-0.0 -0.282 19.7 129.9 -60.7 134.4 6.9 -17.5 3.3 43 61 A K - 0 0 54 3,-0.0 3,-0.3 0, 0.0 2,-0.1 -0.931 52.5-101.8-164.7 167.1 5.7 -19.3 0.2 44 62 A S S S+ 0 0 98 -2,-0.3 25,-0.0 1,-0.2 0, 0.0 -0.485 93.9 42.6 -86.7 163.6 6.3 -19.1 -3.6 45 63 A G S S+ 0 0 67 1,-0.2 2,-0.4 -2,-0.1 -1,-0.2 0.854 73.6 171.3 76.1 38.9 4.0 -17.4 -6.0 46 64 A I - 0 0 9 -3,-0.3 21,-2.7 -26,-0.1 2,-0.5 -0.667 19.6-166.6 -87.1 130.7 3.2 -14.2 -4.0 47 65 A Q E -KN 19 66C 50 -28,-2.6 -28,-2.9 -2,-0.4 2,-0.5 -0.979 17.6-140.4-108.6 129.0 1.3 -11.3 -5.5 48 66 A V E -KN 18 65C 0 17,-3.0 17,-2.6 -2,-0.5 2,-0.6 -0.756 12.9-158.3 -89.0 129.5 1.6 -8.1 -3.4 49 67 A R E -KN 17 64C 50 -32,-2.9 -32,-2.4 -2,-0.5 3,-0.3 -0.939 13.1-177.6-116.4 113.1 -1.7 -6.2 -3.2 50 68 A L E + N 0 63C 2 13,-3.2 13,-2.0 -2,-0.6 -34,-0.1 -0.656 60.5 31.1-103.9 161.9 -1.4 -2.5 -2.3 51 69 A G S S+ 0 0 6 -36,-0.4 10,-0.3 -38,-0.3 2,-0.2 0.728 84.3 157.7 65.9 24.3 -4.1 0.1 -1.8 52 70 A E + 0 0 9 -37,-0.4 -42,-0.4 -3,-0.3 -1,-0.2 -0.569 21.8 149.3 -84.1 140.6 -6.6 -2.5 -0.5 53 71 A D S S+ 0 0 14 1,-0.4 2,-0.8 4,-0.3 -1,-0.1 0.301 80.7 30.5-117.5 -82.6 -9.6 -2.0 1.7 54 72 A N S > S- 0 0 28 80,-0.2 3,-1.1 1,-0.2 -1,-0.4 -0.630 73.1-161.5 -73.9 111.8 -12.1 -4.7 0.7 55 73 A I T 3 S+ 0 0 29 78,-2.5 -1,-0.2 -2,-0.8 79,-0.1 0.599 87.2 52.5 -74.6 -6.0 -9.9 -7.6 -0.4 56 74 A N T 3 S+ 0 0 126 77,-0.2 2,-0.4 1,-0.1 -1,-0.2 0.449 106.5 56.3-103.8 -3.7 -12.8 -9.2 -2.2 57 75 A V S < S- 0 0 77 -3,-1.1 2,-0.8 76,-0.1 -4,-0.3 -0.994 77.9-128.3-132.1 133.7 -13.8 -6.2 -4.3 58 76 A V + 0 0 112 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.0 -0.743 33.5 172.9 -79.3 113.0 -11.8 -4.0 -6.8 59 77 A E - 0 0 99 -2,-0.8 -1,-0.2 -5,-0.2 -7,-0.0 0.547 51.1 -97.5-105.6 -12.7 -12.6 -0.6 -5.4 60 78 A G S S+ 0 0 61 -9,-0.0 -2,-0.1 0, 0.0 -8,-0.1 0.290 104.9 74.1 120.6 -9.8 -10.2 1.6 -7.5 61 79 A N + 0 0 70 -10,-0.3 -9,-0.1 38,-0.0 2,-0.1 0.348 67.3 120.5-113.5 7.3 -7.0 2.3 -5.5 62 80 A E - 0 0 31 -13,-0.0 2,-0.4 2,-0.0 -11,-0.3 -0.334 41.1-165.8 -71.8 148.9 -5.4 -1.1 -5.8 63 81 A Q E -N 50 0C 38 -13,-2.0 -13,-3.2 -2,-0.1 2,-0.6 -0.984 7.2-162.9-127.2 125.1 -2.0 -2.0 -7.2 64 82 A F E +N 49 0C 77 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.952 17.5 168.5-107.6 117.5 -1.3 -5.7 -7.8 65 83 A I E -N 48 0C 14 -17,-2.6 -17,-3.0 -2,-0.6 2,-0.1 -0.991 29.4-129.7-135.7 122.3 2.4 -6.4 -8.3 66 84 A S E -N 47 0C 53 -2,-0.4 25,-2.9 -19,-0.3 26,-0.3 -0.377 29.0-111.1 -67.6 147.7 4.0 -9.9 -8.3 67 85 A A E -O 90 0C 20 -21,-2.7 23,-0.3 23,-0.2 3,-0.1 -0.597 20.2-164.6 -76.7 138.7 7.0 -10.6 -6.1 68 86 A S E S- 0 0 55 21,-2.5 2,-0.3 1,-0.4 22,-0.2 0.697 73.3 -5.6 -90.3 -25.2 10.3 -11.1 -7.9 69 87 A K E -O 89 0C 78 20,-1.1 20,-2.8 -23,-0.0 2,-0.4 -0.975 55.8-148.9-164.9 151.5 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 -0.970 9.3-161.0-125.4 144.5 11.6 -13.3 -1.1 71 89 A I E -O 87 0C 37 16,-3.1 16,-2.6 -2,-0.4 2,-0.3 -0.932 5.5-159.2-129.7 106.1 14.3 -13.3 1.5 72 90 A V E -O 86 0C 49 -2,-0.5 14,-0.2 14,-0.2 12,-0.1 -0.629 40.7 -90.4 -80.9 141.1 13.7 -15.1 4.7 73 91 A H > - 0 0 23 12,-2.3 3,-1.9 -2,-0.3 -1,-0.1 -0.226 33.8-126.5 -50.7 134.0 15.9 -14.0 7.6 74 92 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.778 107.8 43.5 -56.8 -26.6 19.0 -16.2 7.6 75 93 A S T 3 S+ 0 0 72 8,-0.1 2,-0.1 2,-0.1 -2,-0.1 0.223 78.5 139.4-106.8 12.9 18.5 -17.1 11.3 76 94 A Y < - 0 0 53 -3,-1.9 2,-0.5 9,-0.1 7,-0.2 -0.402 35.0-162.5 -60.2 127.7 14.7 -17.7 11.2 77 95 A N > - 0 0 65 5,-2.1 4,-2.1 -2,-0.1 5,-0.5 -0.969 7.3-162.6-114.1 113.9 13.8 -20.7 13.3 78 96 A S T 4 S+ 0 0 78 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.689 87.8 54.6 -72.8 -18.0 10.3 -22.0 12.4 79 97 A N T 4 S+ 0 0 151 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.917 124.1 22.4 -78.1 -45.0 10.0 -24.0 15.7 80 98 A T T 4 S- 0 0 74 2,-0.1 -2,-0.2 76,-0.0 77,-0.1 0.578 97.1-132.5 -95.3 -13.7 10.7 -21.1 18.1 81 99 A L >< + 0 0 32 -4,-2.1 3,-0.7 1,-0.2 2,-0.2 0.612 48.7 159.0 60.3 20.0 9.7 -18.4 15.6 82 100 A N T 3 + 0 0 37 -5,-0.5 -5,-2.1 1,-0.2 -1,-0.2 -0.546 66.2 16.3 -68.2 138.7 12.9 -16.5 16.6 83 101 A N T 3 S+ 0 0 18 -2,-0.2 2,-1.9 -7,-0.2 -1,-0.2 0.917 79.4 179.3 63.2 44.9 13.8 -14.0 13.8 84 102 A D < + 0 0 1 -3,-0.7 2,-0.3 75,-0.2 123,-0.2 -0.524 35.4 114.6 -81.4 74.7 10.3 -14.2 12.3 85 103 A I + 0 0 0 -2,-1.9 -12,-2.3 -47,-0.3 2,-0.3 -0.997 36.0 175.8-147.6 144.3 11.0 -11.7 9.5 86 104 A M E -MO 37 72C 0 -49,-2.3 -49,-2.8 -2,-0.3 2,-0.4 -0.990 19.4-140.4-148.4 145.4 11.1 -11.8 5.7 87 105 A L E -MO 36 71C 0 -16,-2.6 -16,-3.1 -2,-0.3 2,-0.4 -0.883 13.3-163.6-106.6 143.2 11.6 -9.2 2.9 88 106 A I E -MO 35 70C 0 -53,-2.7 -53,-2.7 -2,-0.4 2,-0.4 -0.994 7.3-150.7-127.5 126.3 9.6 -9.4 -0.4 89 107 A K E -MO 34 69C 37 -20,-2.8 -21,-2.5 -2,-0.4 -20,-1.1 -0.832 14.9-130.7 -98.4 137.9 10.7 -7.5 -3.5 90 108 A L E - 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0 0 27 -88,-1.6 -72,-0.3 -2,-0.4 2,-0.1 -0.987 44.1-113.6-147.1 147.5 2.7 4.9 1.0 102 120 A S - 0 0 56 -2,-0.3 2,-0.4 -72,-0.1 -72,-0.3 -0.445 26.3-132.6 -78.5 158.1 5.8 3.4 2.7 103 121 A I - 0 0 15 -74,-2.3 83,-0.1 -89,-0.2 2,-0.1 -0.934 25.9-110.9-110.8 137.4 6.3 3.3 6.5 104 122 A S B -c 186 0B 63 81,-0.7 83,-2.8 -2,-0.4 -73,-0.1 -0.344 24.5-123.8 -65.9 143.3 9.5 4.4 8.1 105 123 A L - 0 0 28 81,-0.2 83,-0.1 -75,-0.1 -1,-0.1 -0.513 40.7 -95.4 -76.2 152.7 11.9 1.9 9.8 106 124 A P - 0 0 6 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.379 20.9-159.8 -72.1 152.2 12.6 2.7 13.4 107 125 A T S S+ 0 0 132 1,-0.3 2,-0.3 -3,-0.1 -2,-0.0 0.610 84.9 11.6 -95.8 -22.5 15.7 4.6 14.5 108 126 A S S S- 0 0 79 0, 0.0 -1,-0.3 0, 0.0 2,-0.1 -0.978 91.5 -90.7-146.3 162.4 15.4 3.2 18.0 109 127 A c - 0 0 54 -2,-0.3 2,-0.2 -3,-0.1 79,-0.1 -0.374 43.2-118.4 -70.7 148.1 13.4 0.5 19.7 110 128 A A - 0 0 28 78,-0.1 2,-0.2 -2,-0.1 -1,-0.1 -0.566 28.6-122.5 -87.1 154.4 10.0 1.5 21.2 111 129 A S > - 0 0 82 -2,-0.2 3,-2.3 1,-0.1 31,-0.3 -0.622 29.5 -87.1 -97.3 155.3 9.3 1.2 25.0 112 130 A A T 3 S+ 0 0 57 1,-0.3 31,-0.2 -2,-0.2 -1,-0.1 -0.314 116.8 37.0 -48.4 136.1 6.8 -0.7 27.0 113 131 A G T 3 S+ 0 0 60 29,-2.9 -1,-0.3 1,-0.4 2,-0.1 0.076 82.3 131.9 98.7 -21.6 3.7 1.6 27.3 114 132 A T < - 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