==== 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 3A7T . 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) . 9243.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 133 59.6 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 0.000 360.0 360.0 360.0 122.7 -8.1 -8.7 14.5 2 20 A V B +A 171 0A 9 169,-3.0 169,-1.9 1,-0.2 123,-0.1 -0.870 360.0 5.9-101.1 132.2 -10.3 -9.4 17.5 3 21 A G S S+ 0 0 45 121,-0.5 -1,-0.2 -2,-0.4 169,-0.1 0.713 103.7 115.0 73.9 21.5 -12.0 -6.6 19.4 4 22 A G - 0 0 36 -3,-0.3 2,-0.3 167,-0.1 134,-0.2 0.058 58.9-109.4-101.1-150.9 -10.8 -3.9 17.0 5 23 A Y E -B 137 0B 97 132,-2.5 132,-3.1 -3,-0.1 2,-0.4 -0.951 34.8 -85.6-145.1 159.5 -12.5 -1.5 14.6 6 24 A T E -B 136 0B 75 -2,-0.3 130,-0.2 130,-0.2 129,-0.1 -0.593 36.9-151.0 -68.6 120.3 -12.9 -0.9 10.9 7 25 A a - 0 0 17 128,-2.2 -1,-0.2 -2,-0.4 129,-0.1 0.898 36.1-114.2 -60.7 -43.0 -9.8 1.2 9.9 8 26 A G > - 0 0 26 127,-0.5 3,-1.9 -3,-0.1 4,-0.3 0.024 47.3 -56.7 103.4 137.7 -11.5 3.0 7.0 9 27 A A T 3 S- 0 0 54 1,-0.3 44,-0.1 2,-0.1 43,-0.0 -0.221 117.9 -11.7 -55.2 124.5 -10.5 2.6 3.4 10 28 A N T 3 S+ 0 0 26 42,-0.4 -1,-0.3 2,-0.1 43,-0.1 0.669 92.0 125.8 61.0 24.0 -6.8 3.3 2.7 11 29 A T S < S+ 0 0 84 -3,-1.9 -2,-0.1 1,-0.2 -1,-0.1 0.549 74.5 50.2 -84.0 -9.6 -6.2 4.8 6.1 12 30 A V S > S+ 0 0 7 -4,-0.3 3,-2.0 87,-0.1 -1,-0.2 -0.712 74.2 174.8-123.8 73.7 -3.3 2.4 6.7 13 31 A P T 3 S+ 0 0 32 0, 0.0 88,-1.5 0, 0.0 38,-0.3 0.615 72.5 55.7 -69.6 -13.3 -1.5 3.0 3.3 14 32 A Y T 3 S+ 0 0 19 86,-0.2 15,-2.4 88,-0.1 2,-0.4 0.482 82.2 110.4 -89.6 -7.8 1.5 0.8 4.1 15 33 A Q E < -J 28 0C 5 -3,-2.0 37,-0.4 13,-0.2 36,-0.4 -0.573 48.8-173.7 -74.0 124.6 -0.7 -2.3 4.8 16 34 A V E -J 27 0C 1 11,-2.6 11,-1.1 -2,-0.4 2,-0.5 -0.838 19.7-140.8-115.0 155.0 -0.4 -4.9 2.1 17 35 A S E -JK 26 49C 1 32,-2.3 32,-3.0 -2,-0.3 2,-0.5 -0.967 15.0-143.5-107.7 129.7 -2.2 -8.2 1.5 18 36 A L E -JK 25 48C 0 7,-3.3 6,-2.5 -2,-0.5 7,-1.0 -0.858 23.9-166.5 -92.4 128.0 -0.2 -11.2 0.3 19 37 A N E +JK 23 47C 19 28,-2.8 28,-2.6 -2,-0.5 4,-0.2 -0.956 31.7 167.0-126.6 128.7 -2.2 -13.2 -2.1 20 38 A S S S- 0 0 30 2,-2.2 3,-0.1 -2,-0.4 26,-0.1 -0.301 97.8 -46.7-127.8 47.2 -1.6 -16.7 -3.5 21 39 A G S S+ 0 0 69 26,-0.1 2,-0.3 1,-0.0 -2,-0.1 0.189 140.6 27.8 101.2 -10.6 -5.1 -17.0 -5.0 22 40 A Y S S- 0 0 132 -4,-0.0 -2,-2.2 0, 0.0 2,-0.2 -0.929 103.6 -79.6-168.6 154.0 -6.5 -15.7 -1.7 23 41 A H E +J 19 0C 34 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.509 52.4 157.9 -60.1 132.4 -5.3 -13.5 1.1 24 42 A F E + 0 0 34 -6,-2.5 2,-0.3 1,-0.4 151,-0.2 0.503 58.4 6.1-132.8 -12.6 -3.0 -15.5 3.4 25 43 A b E -J 18 0C 7 -7,-1.0 -7,-3.3 151,-0.1 -1,-0.4 -0.985 60.8-123.2-163.6 156.1 -0.9 -12.9 5.2 26 44 A G E +J 17 0C 0 151,-3.0 12,-0.4 -2,-0.3 2,-0.3 -0.436 27.5 175.5 -91.2 178.2 -0.3 -9.2 5.8 27 45 A G E -J 16 0C 0 -11,-1.1 -11,-2.6 -2,-0.2 2,-0.4 -0.949 26.1-116.0-168.9 174.0 2.9 -7.2 5.2 28 46 A S E -JL 15 36C 0 8,-2.6 8,-2.9 -2,-0.3 2,-0.5 -0.987 20.1-131.2-128.9 128.1 4.2 -3.6 5.3 29 47 A L E + L 0 35C 1 -15,-2.4 74,-2.3 -2,-0.4 6,-0.2 -0.660 27.0 174.3 -76.1 124.1 5.5 -1.6 2.4 30 48 A I E - 0 0 18 4,-2.4 2,-0.3 -2,-0.5 5,-0.2 0.598 65.7 -9.5-111.6 -15.9 8.8 -0.0 3.4 31 49 A N E > S- L 0 34C 48 3,-1.2 3,-0.8 70,-0.1 -1,-0.3 -0.935 89.4 -75.7-160.2-176.9 9.8 1.5 0.0 32 50 A S T 3 S+ 0 0 41 -2,-0.3 62,-3.2 1,-0.2 60,-0.1 0.719 128.7 27.9 -58.5 -21.6 8.6 1.5 -3.6 33 51 A Q T 3 S+ 0 0 75 60,-0.2 57,-2.8 1,-0.1 2,-0.4 0.431 110.2 68.6-119.1 -3.4 10.0 -2.0 -4.2 34 52 A W E < -LM 31 89C 1 -3,-0.8 -4,-2.4 55,-0.2 -3,-1.2 -0.973 47.4-168.9-134.5 141.6 10.1 -3.9 -0.9 35 53 A V E -LM 29 88C 0 53,-2.5 53,-2.5 -2,-0.4 2,-0.5 -0.952 14.1-145.9-122.8 139.4 7.7 -5.4 1.6 36 54 A V E +LM 28 87C 0 -8,-2.9 -8,-2.6 -2,-0.4 2,-0.2 -0.917 33.8 148.5-102.6 132.3 8.4 -6.6 5.2 37 55 A S E - M 0 86C 0 49,-2.8 49,-2.2 -2,-0.5 2,-0.3 -0.745 49.4 -70.5-141.4-169.9 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 -0.698 32.0-131.8 -87.8 143.1 6.8 -12.7 8.8 39 57 A A G > S+ 0 0 2 -2,-0.3 3,-2.3 1,-0.3 -1,-0.1 0.844 108.1 65.6 -59.1 -33.7 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 0.605 93.1 63.6 -69.1 -6.6 6.2 -17.9 8.7 41 59 A b G < S+ 0 0 3 -3,-1.5 -1,-0.3 -15,-0.0 -2,-0.2 0.418 76.8 131.7 -87.1 -3.8 4.3 -16.3 5.7 42 60 A Y < + 0 0 137 -3,-2.3 2,-0.3 -4,-0.1 -3,-0.0 -0.267 21.1 132.0 -56.9 132.5 6.9 -17.6 3.2 43 61 A K - 0 0 56 3,-0.0 3,-0.3 0, 0.0 2,-0.1 -0.931 51.8-102.5-162.9 167.4 5.6 -19.3 0.1 44 62 A S S S+ 0 0 97 -2,-0.3 0, 0.0 1,-0.2 0, 0.0 -0.497 94.4 40.5 -87.7 163.3 6.2 -19.2 -3.6 45 63 A G S S+ 0 0 67 1,-0.2 2,-0.4 -2,-0.1 -1,-0.2 0.883 74.5 171.0 71.8 41.6 3.9 -17.5 -6.1 46 64 A I - 0 0 10 -3,-0.3 21,-2.7 21,-0.1 2,-0.5 -0.722 19.9-165.3 -87.6 132.6 3.1 -14.4 -4.0 47 65 A Q E -KN 19 66C 50 -28,-2.6 -28,-2.8 -2,-0.4 2,-0.5 -0.980 17.1-140.3-109.5 127.5 1.3 -11.5 -5.5 48 66 A V E -KN 18 65C 0 17,-2.9 17,-2.6 -2,-0.5 2,-0.6 -0.755 12.8-157.8 -88.4 126.8 1.5 -8.3 -3.3 49 67 A R E -KN 17 64C 51 -32,-3.0 -32,-2.3 -2,-0.5 3,-0.3 -0.928 13.7-177.6-113.5 112.3 -1.8 -6.4 -3.2 50 68 A L E + N 0 63C 2 13,-3.1 13,-2.0 -2,-0.6 -34,-0.1 -0.654 60.9 30.5-102.6 159.9 -1.4 -2.7 -2.3 51 69 A G S S+ 0 0 6 -36,-0.4 10,-0.3 -38,-0.3 2,-0.3 0.714 84.5 156.5 68.0 22.4 -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 -0.584 21.1 149.9 -84.2 140.0 -6.6 -2.7 -0.5 53 71 A D S S+ 0 0 15 1,-0.4 2,-0.8 4,-0.3 -1,-0.1 0.339 80.9 30.5-116.2 -82.2 -9.6 -2.1 1.7 54 72 A N S > S- 0 0 27 80,-0.2 3,-1.4 1,-0.2 -1,-0.4 -0.655 73.1-161.4 -75.0 111.4 -12.2 -4.8 0.8 55 73 A I T 3 S+ 0 0 29 78,-2.4 -1,-0.2 -2,-0.8 79,-0.1 0.585 87.7 52.5 -74.1 -6.3 -9.9 -7.7 -0.4 56 74 A N T 3 S+ 0 0 124 77,-0.2 2,-0.4 1,-0.1 -1,-0.3 0.327 106.2 57.4-106.5 2.9 -12.9 -9.3 -2.2 57 75 A V S < S- 0 0 75 -3,-1.4 2,-0.8 76,-0.1 -4,-0.3 -0.998 77.4-128.8-138.1 131.5 -13.9 -6.2 -4.3 58 76 A V + 0 0 114 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.0 -0.723 34.2 171.9 -79.4 112.4 -11.9 -4.1 -6.7 59 77 A E - 0 0 97 -2,-0.8 -1,-0.2 -5,-0.2 -7,-0.0 0.571 51.0 -96.9-106.0 -13.5 -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 0.339 104.7 73.7 121.4 -6.4 -10.2 1.5 -7.5 61 79 A N + 0 0 64 -10,-0.3 -9,-0.1 38,-0.0 2,-0.0 0.358 66.6 122.7-116.3 6.6 -7.0 2.1 -5.5 62 80 A E - 0 0 32 -13,-0.0 2,-0.4 2,-0.0 -11,-0.2 -0.303 39.0-168.1 -69.4 147.1 -5.4 -1.3 -5.8 63 81 A Q E -N 50 0C 38 -13,-2.0 -13,-3.1 2,-0.1 2,-0.6 -0.966 7.8-163.7-128.0 121.2 -2.0 -2.1 -7.2 64 82 A F E +N 49 0C 78 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.924 16.2 169.8-103.0 121.2 -1.3 -5.8 -7.8 65 83 A I E -N 48 0C 13 -17,-2.6 -17,-2.9 -2,-0.6 2,-0.1 -0.992 29.0-128.2-136.5 124.7 2.4 -6.6 -8.2 66 84 A S E -N 47 0C 51 -2,-0.4 25,-2.8 -19,-0.3 26,-0.3 -0.378 29.5-110.6 -66.3 146.4 4.0 -10.0 -8.3 67 85 A A E -O 90 0C 19 -21,-2.7 23,-0.3 23,-0.2 3,-0.1 -0.587 24.0-169.4 -73.8 137.7 6.9 -10.8 -6.0 68 86 A S E S+ 0 0 64 21,-3.0 2,-0.3 1,-0.4 22,-0.2 0.717 72.2 3.1 -93.3 -26.9 10.3 -11.2 -7.8 69 87 A K E -O 89 0C 89 20,-1.2 20,-2.9 2,-0.0 2,-0.4 -0.984 57.1-155.7-158.7 141.9 12.2 -12.5 -4.8 70 88 A S E -O 88 0C 40 -2,-0.3 2,-0.5 18,-0.2 18,-0.2 -0.966 7.6-164.4-119.5 143.7 11.6 -13.4 -1.2 71 89 A I E -O 87 0C 36 16,-3.1 16,-2.6 -2,-0.4 2,-0.3 -0.922 5.3-159.4-129.2 105.8 14.3 -13.4 1.5 72 90 A V E -O 86 0C 47 -2,-0.5 14,-0.2 14,-0.2 12,-0.1 -0.614 42.8 -87.2 -77.5 143.2 13.6 -15.2 4.7 73 91 A H > - 0 0 22 12,-2.4 3,-1.9 -2,-0.3 -1,-0.1 -0.220 35.4-123.9 -49.9 135.5 15.8 -14.1 7.6 74 92 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.799 109.8 40.8 -53.0 -29.7 19.1 -16.1 7.6 75 93 A S T 3 S+ 0 0 73 8,-0.1 2,-0.1 2,-0.1 -2,-0.1 0.186 79.0 142.6-109.7 16.6 18.4 -17.2 11.2 76 94 A Y < - 0 0 55 -3,-1.9 2,-0.5 9,-0.1 7,-0.2 -0.390 32.1-163.6 -60.9 129.0 14.7 -17.9 11.1 77 95 A N > - 0 0 64 5,-2.1 4,-2.1 -2,-0.1 5,-0.4 -0.972 7.4-162.9-114.9 112.1 13.7 -20.9 13.2 78 96 A S T 4 S+ 0 0 79 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.680 87.2 55.7 -70.8 -18.4 10.2 -22.2 12.3 79 97 A N T 4 S+ 0 0 150 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.912 123.9 21.3 -77.8 -44.8 9.9 -24.2 15.6 80 98 A T T 4 S- 0 0 69 2,-0.1 -2,-0.2 -3,-0.0 -1,-0.1 0.575 97.3-131.3 -95.7 -15.2 10.5 -21.3 18.0 81 99 A L >< + 0 0 34 -4,-2.1 3,-0.8 1,-0.2 2,-0.2 0.596 48.5 161.0 64.3 16.7 9.6 -18.5 15.5 82 100 A N T 3 + 0 0 39 -5,-0.4 -5,-2.1 1,-0.2 -1,-0.2 -0.491 66.9 15.3 -63.6 134.7 12.8 -16.7 16.5 83 101 A N T 3 S- 0 0 18 -7,-0.2 2,-1.9 1,-0.2 -1,-0.2 0.906 79.6-179.8 65.5 47.2 13.7 -14.2 13.8 84 102 A D < + 0 0 1 -3,-0.8 2,-0.3 75,-0.2 -1,-0.2 -0.510 35.8 114.4 -82.2 76.0 10.2 -14.3 12.2 85 103 A I + 0 0 0 -2,-1.9 -12,-2.4 -47,-0.3 2,-0.3 -0.998 36.1 177.1-149.9 144.0 10.9 -11.8 9.4 86 104 A M E -MO 37 72C 0 -49,-2.2 -49,-2.8 -2,-0.3 2,-0.4 -0.992 18.7-140.9-149.3 144.4 11.1 -11.9 5.7 87 105 A L E -MO 36 71C 0 -16,-2.6 -16,-3.1 -2,-0.3 2,-0.4 -0.879 13.1-163.6-106.0 143.0 11.6 -9.4 2.9 88 106 A I E -MO 35 70C 0 -53,-2.5 -53,-2.5 -2,-0.4 2,-0.4 -0.995 7.2-150.6-127.2 124.4 9.7 -9.5 -0.4 89 107 A K E -MO 34 69C 42 -20,-2.9 -21,-3.0 -2,-0.4 -20,-1.2 -0.829 16.4-130.5 -95.0 135.9 10.8 -7.6 -3.5 90 108 A L E - 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