==== 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 3A83 . 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) . 9249.0 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 0.000 360.0 360.0 360.0 124.1 -8.0 -8.6 14.6 2 20 A V B +A 171 0A 10 169,-3.0 169,-1.9 1,-0.2 123,-0.1 -0.883 360.0 6.7-102.9 132.4 -10.3 -9.4 17.5 3 21 A G S S+ 0 0 47 121,-0.5 -1,-0.2 -2,-0.4 169,-0.1 0.709 103.6 113.9 75.7 21.6 -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 0.036 59.4-108.2-102.9-150.2 -10.8 -3.9 17.0 5 23 A Y E -B 137 0B 96 132,-2.6 132,-2.9 -3,-0.1 2,-0.5 -0.948 34.6 -85.4-145.2 159.6 -12.5 -1.5 14.6 6 24 A T E -B 136 0B 74 -2,-0.3 130,-0.2 130,-0.2 129,-0.1 -0.592 37.7-151.9 -67.6 118.3 -13.0 -0.9 10.9 7 25 A a - 0 0 17 128,-2.1 -1,-0.2 -2,-0.5 129,-0.1 0.901 35.6-114.1 -58.9 -44.1 -9.9 1.1 9.9 8 26 A G > - 0 0 25 127,-0.5 3,-1.9 -3,-0.1 4,-0.3 0.017 46.5 -56.8 105.2 136.6 -11.5 3.0 7.0 9 27 A A T 3 S- 0 0 56 1,-0.3 44,-0.1 2,-0.1 43,-0.1 -0.222 118.3 -11.9 -52.4 121.5 -10.5 2.6 3.4 10 28 A N T 3 S+ 0 0 25 42,-0.4 -1,-0.3 2,-0.1 43,-0.1 0.671 91.7 126.5 62.8 24.2 -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 0.561 75.1 49.8 -83.4 -9.7 -6.2 4.8 6.1 12 30 A V S > S+ 0 0 7 -4,-0.3 3,-2.1 87,-0.1 -1,-0.2 -0.701 74.2 175.3-125.3 73.0 -3.3 2.4 6.7 13 31 A P T 3 S+ 0 0 31 0, 0.0 88,-1.4 0, 0.0 38,-0.3 0.599 72.9 55.3 -69.3 -13.1 -1.5 3.0 3.4 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 -91.3 -8.9 1.5 0.8 4.1 15 33 A Q E < -J 28 0C 5 -3,-2.1 37,-0.4 13,-0.2 36,-0.4 -0.554 48.6-173.8 -71.4 124.1 -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 -0.843 19.5-140.7-115.3 155.0 -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,-0.5 -0.968 15.3-142.4-108.8 129.5 -2.2 -8.2 1.6 18 36 A L E -JK 25 48C 0 7,-3.3 6,-2.5 -2,-0.5 7,-1.0 -0.852 24.5-166.5 -90.7 127.4 -0.1 -11.2 0.4 19 37 A N E +JK 23 47C 19 28,-2.8 28,-2.7 -2,-0.5 4,-0.2 -0.949 32.2 166.1-124.6 129.2 -2.2 -13.2 -2.1 20 38 A S S S- 0 0 31 2,-2.2 3,-0.1 -2,-0.4 26,-0.1 -0.279 98.1 -46.7-128.7 46.5 -1.6 -16.7 -3.6 21 39 A G S S+ 0 0 70 26,-0.1 2,-0.3 1,-0.0 -2,-0.1 0.164 140.4 28.2 102.8 -10.3 -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 -0.937 103.2 -80.0-168.6 153.6 -6.5 -15.7 -1.7 23 41 A H E +J 19 0C 35 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.529 52.5 157.8 -60.9 131.5 -5.3 -13.4 1.1 24 42 A F E + 0 0 34 -6,-2.5 2,-0.3 1,-0.4 151,-0.2 0.534 58.1 5.4-130.6 -15.2 -3.0 -15.4 3.4 25 43 A b E -J 18 0C 7 -7,-1.0 -7,-3.3 151,-0.1 -1,-0.4 -0.983 61.8-121.7-161.5 158.9 -0.8 -12.9 5.3 26 44 A G E +J 17 0C 0 151,-3.2 12,-0.4 -2,-0.3 2,-0.3 -0.439 27.6 177.0 -93.9 176.9 -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 -0.952 25.1-117.7-167.3 174.2 2.9 -7.2 5.2 28 46 A S E -JL 15 36C 0 8,-2.6 8,-3.0 -2,-0.3 2,-0.5 -0.990 19.9-131.5-130.0 126.9 4.2 -3.6 5.4 29 47 A L E + L 0 35C 1 -15,-2.3 74,-2.3 -2,-0.4 6,-0.2 -0.668 26.9 174.1 -75.8 124.3 5.5 -1.6 2.4 30 48 A I E - 0 0 18 4,-2.5 2,-0.3 -2,-0.5 5,-0.2 0.591 66.0 -9.5-112.5 -14.6 8.8 -0.1 3.4 31 49 A N E > S- L 0 34C 49 3,-1.2 3,-0.9 70,-0.1 -1,-0.3 -0.933 89.7 -75.8-161.9-177.0 9.8 1.5 0.0 32 50 A S T 3 S+ 0 0 41 -2,-0.3 62,-3.3 1,-0.2 60,-0.1 0.711 128.5 28.3 -60.8 -19.5 8.5 1.5 -3.6 33 51 A Q T 3 S+ 0 0 73 60,-0.2 57,-2.8 1,-0.1 2,-0.4 0.411 110.0 69.3-119.3 -2.0 10.0 -2.0 -4.2 34 52 A W E < -LM 31 89C 1 -3,-0.9 -4,-2.5 55,-0.2 -3,-1.2 -0.980 47.3-169.6-136.4 139.5 10.1 -3.9 -0.9 35 53 A V E -LM 29 88C 0 53,-2.6 53,-2.6 -2,-0.4 2,-0.5 -0.942 14.4-146.0-121.5 139.4 7.7 -5.4 1.6 36 54 A V E +LM 28 87C 0 -8,-3.0 -8,-2.6 -2,-0.4 2,-0.2 -0.915 33.7 148.9-102.4 132.3 8.4 -6.6 5.2 37 55 A S E - M 0 86C 0 49,-2.8 49,-2.3 -2,-0.5 2,-0.3 -0.751 49.2 -70.3-141.5-169.5 6.4 -9.6 6.4 38 56 A A > - 0 0 0 -12,-0.4 3,-1.4 47,-0.3 47,-0.3 -0.696 31.9-132.9 -88.3 142.3 6.8 -12.7 8.7 39 57 A A G > S+ 0 0 2 -2,-0.3 3,-2.3 1,-0.2 -1,-0.1 0.840 107.5 65.6 -58.9 -34.1 9.1 -15.5 7.7 40 58 A H G 3 S+ 0 0 63 1,-0.3 -1,-0.2 41,-0.1 137,-0.0 0.628 93.7 62.9 -67.7 -8.7 6.3 -17.9 8.7 41 59 A b G < S+ 0 0 4 -3,-1.4 -1,-0.3 -15,-0.1 -2,-0.2 0.415 77.2 131.8 -87.0 -3.2 4.4 -16.4 5.8 42 60 A Y < + 0 0 134 -3,-2.3 2,-0.3 -4,-0.1 -3,-0.0 -0.255 21.0 133.7 -56.2 133.7 7.0 -17.6 3.2 43 61 A K - 0 0 56 3,-0.0 3,-0.3 0, 0.0 2,-0.2 -0.932 51.2-103.6-163.1 167.3 5.7 -19.3 0.1 44 62 A S S S+ 0 0 97 -2,-0.3 25,-0.0 1,-0.2 0, 0.0 -0.511 94.3 40.9 -88.9 163.9 6.3 -19.2 -3.6 45 63 A G S S+ 0 0 68 1,-0.2 2,-0.4 -2,-0.2 -1,-0.2 0.873 74.8 170.7 72.1 39.6 3.9 -17.5 -6.1 46 64 A I - 0 0 10 -3,-0.3 21,-2.6 21,-0.1 2,-0.5 -0.691 20.2-164.8 -86.1 132.3 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,-0.5 -0.982 17.0-140.0-109.8 128.3 1.3 -11.5 -5.4 48 66 A V E -KN 18 65C 0 17,-2.9 17,-2.6 -2,-0.5 2,-0.6 -0.751 12.6-158.0 -88.8 127.4 1.5 -8.3 -3.3 49 67 A R E -KN 17 64C 52 -32,-2.8 -32,-2.3 -2,-0.5 3,-0.3 -0.926 13.9-178.2-113.6 110.3 -1.8 -6.4 -3.1 50 68 A L E + N 0 63C 2 13,-3.1 13,-2.0 -2,-0.6 -34,-0.1 -0.669 60.7 30.7-102.0 161.1 -1.4 -2.7 -2.2 51 69 A G S S+ 0 0 6 -36,-0.4 10,-0.3 -38,-0.3 2,-0.3 0.695 84.4 157.1 67.6 21.7 -4.1 -0.1 -1.7 52 70 A E + 0 0 9 -37,-0.4 -42,-0.4 -3,-0.3 -1,-0.2 -0.565 21.5 149.6 -83.0 139.3 -6.6 -2.7 -0.5 53 71 A D S S+ 0 0 14 1,-0.4 2,-0.7 4,-0.3 -1,-0.1 0.350 81.0 30.4-116.3 -82.3 -9.6 -2.1 1.7 54 72 A N S > S- 0 0 27 80,-0.2 3,-1.3 1,-0.2 -1,-0.4 -0.655 72.8-160.9 -74.8 112.6 -12.2 -4.8 0.8 55 73 A I T 3 S+ 0 0 31 78,-2.4 -1,-0.2 -2,-0.7 79,-0.1 0.579 88.4 52.1 -74.3 -5.6 -10.0 -7.7 -0.3 56 74 A N T 3 S+ 0 0 124 77,-0.2 2,-0.4 1,-0.1 -1,-0.2 0.352 106.0 57.4-106.9 2.3 -12.9 -9.3 -2.2 57 75 A V S < S- 0 0 76 -3,-1.3 2,-0.8 76,-0.1 -4,-0.3 -0.997 77.3-128.5-137.4 131.2 -13.9 -6.2 -4.3 58 76 A V + 0 0 117 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.0 -0.710 34.6 171.5 -78.3 112.0 -12.0 -4.1 -6.7 59 77 A E - 0 0 96 -2,-0.8 -1,-0.2 -5,-0.2 -7,-0.0 0.584 50.8 -96.8-106.5 -15.0 -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 0.319 104.7 73.1 124.8 -9.0 -10.2 1.6 -7.4 61 79 A N + 0 0 64 -10,-0.3 -9,-0.1 38,-0.0 2,-0.1 0.336 66.9 122.8-116.5 6.4 -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 -0.317 38.5-168.8 -69.4 146.8 -5.4 -1.3 -5.8 63 81 A Q E -N 50 0C 39 -13,-2.0 -13,-3.1 -2,-0.1 2,-0.6 -0.959 7.4-164.0-129.0 120.6 -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 -0.921 16.4 169.9-103.0 120.4 -1.3 -5.8 -7.7 65 83 A I E -N 48 0C 13 -17,-2.6 -17,-2.9 -2,-0.6 2,-0.1 -0.994 29.1-127.4-136.1 125.5 2.4 -6.6 -8.2 66 84 A S E -N 47 0C 52 -2,-0.4 25,-2.9 -19,-0.3 26,-0.3 -0.389 28.7-111.3 -67.4 146.6 4.0 -10.0 -8.3 67 85 A A E -O 90 0C 15 -21,-2.6 23,-0.3 23,-0.2 3,-0.1 -0.590 22.6-167.9 -75.1 137.8 7.0 -10.8 -6.0 68 86 A S E S- 0 0 60 21,-3.0 2,-0.3 1,-0.4 22,-0.2 0.703 72.1 -1.8 -94.8 -27.7 10.3 -11.2 -7.8 69 87 A K E -O 89 0C 87 20,-1.2 20,-2.9 2,-0.0 2,-0.4 -0.981 56.5-151.7-159.7 151.4 12.1 -12.6 -4.8 70 88 A S E -O 88 0C 40 -2,-0.3 2,-0.5 18,-0.2 18,-0.2 -0.967 7.4-163.1-123.3 142.9 11.6 -13.4 -1.2 71 89 A I E -O 87 0C 35 16,-3.0 16,-2.6 -2,-0.4 2,-0.2 -0.924 5.9-158.9-128.9 105.3 14.4 -13.4 1.5 72 90 A V E -O 86 0C 49 -2,-0.5 14,-0.2 14,-0.2 12,-0.1 -0.590 43.0 -88.0 -75.4 142.3 13.7 -15.2 4.7 73 91 A H > - 0 0 21 12,-2.3 3,-1.9 10,-0.3 -1,-0.1 -0.239 35.4-122.9 -51.0 137.6 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 0.780 110.0 41.6 -54.9 -27.0 19.1 -16.1 7.6 75 93 A S T 3 S+ 0 0 72 8,-0.1 2,-0.1 2,-0.1 -2,-0.1 0.179 78.6 143.2-110.1 14.7 18.5 -17.2 11.2 76 94 A Y < - 0 0 55 -3,-1.9 2,-0.5 9,-0.1 7,-0.2 -0.379 31.6-164.1 -60.8 128.4 14.7 -17.9 11.1 77 95 A N > - 0 0 64 5,-2.1 4,-2.2 -2,-0.1 5,-0.4 -0.973 7.2-163.2-114.3 111.8 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 0.684 87.1 55.5 -72.0 -18.1 10.3 -22.2 12.3 79 97 A N T 4 S+ 0 0 151 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.902 123.6 22.0 -77.5 -43.5 9.9 -24.2 15.6 80 98 A T T 4 S- 0 0 74 2,-0.1 -2,-0.2 -3,-0.1 -1,-0.1 0.594 96.8-131.8 -96.9 -16.0 10.6 -21.3 18.0 81 99 A L >< + 0 0 34 -4,-2.2 3,-0.8 1,-0.3 2,-0.2 0.603 49.0 159.7 65.2 17.6 9.6 -18.5 15.5 82 100 A N T 3 + 0 0 38 -5,-0.4 -5,-2.1 1,-0.3 -1,-0.3 -0.500 66.8 16.2 -66.5 137.3 12.8 -16.7 16.5 83 101 A N T 3 S+ 0 0 18 -7,-0.2 2,-2.0 1,-0.2 -10,-0.3 0.899 79.7 179.3 63.2 46.2 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 -0.497 35.3 114.0 -81.4 76.5 10.3 -14.3 12.2 85 103 A I + 0 0 0 -2,-2.0 -12,-2.3 -47,-0.3 2,-0.3 -0.998 36.7 178.1-150.3 141.8 10.9 -11.8 9.4 86 104 A M E -MO 37 72C 0 -49,-2.3 -49,-2.8 -2,-0.3 2,-0.4 -0.993 18.4-141.2-145.6 144.9 11.1 -11.9 5.7 87 105 A L E -MO 36 71C 0 -16,-2.6 -16,-3.0 -2,-0.3 2,-0.4 -0.879 13.4-164.2-105.5 142.5 11.7 -9.4 2.9 88 106 A I E -MO 35 70C 0 -53,-2.6 -53,-2.6 -2,-0.4 2,-0.4 -0.993 7.5-150.5-127.2 124.2 9.7 -9.5 -0.4 89 107 A K E -MO 34 69C 43 -20,-2.9 -21,-3.0 -2,-0.4 -20,-1.2 -0.822 16.4-130.7 -94.8 134.8 10.9 -7.6 -3.5 90 108 A L E - 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