==== 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 3A81 . 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) . 9230.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 136 61.0 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 . 70 31.4 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 . 15 6.7 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 1 3 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 0.000 360.0 360.0 360.0 124.5 -8.0 -8.7 14.6 2 20 A V B +A 171 0A 10 169,-3.2 169,-2.0 1,-0.2 123,-0.1 -0.889 360.0 6.6-103.8 131.4 -10.3 -9.5 17.6 3 21 A G S S+ 0 0 46 121,-0.5 -1,-0.2 -2,-0.5 169,-0.1 0.715 103.4 116.4 75.7 22.3 -12.0 -6.7 19.5 4 22 A G - 0 0 36 -3,-0.3 2,-0.3 167,-0.1 134,-0.2 0.031 58.1-111.2-102.2-151.1 -10.8 -4.0 17.1 5 23 A Y E -B 137 0B 96 132,-2.5 132,-2.8 -3,-0.1 2,-0.5 -0.953 34.9 -84.9-146.0 158.8 -12.5 -1.6 14.7 6 24 A T E -B 136 0B 75 -2,-0.3 130,-0.2 130,-0.2 129,-0.1 -0.575 37.5-151.2 -67.5 119.5 -13.0 -1.0 11.0 7 25 A a - 0 0 17 128,-2.1 -1,-0.2 -2,-0.5 129,-0.1 0.901 35.6-113.4 -59.5 -44.0 -9.9 1.1 10.0 8 26 A G > - 0 0 26 127,-0.5 3,-1.9 -3,-0.1 4,-0.3 0.007 47.0 -58.3 105.4 136.4 -11.5 3.0 7.1 9 27 A A T 3 S- 0 0 55 1,-0.3 44,-0.1 2,-0.1 43,-0.1 -0.243 118.1 -11.0 -53.6 123.7 -10.6 2.5 3.4 10 28 A N T 3 S+ 0 0 25 42,-0.4 -1,-0.3 2,-0.1 43,-0.1 0.646 91.6 126.1 61.4 22.4 -6.9 3.3 2.8 11 29 A T S < S+ 0 0 85 -3,-1.9 -2,-0.1 1,-0.2 -1,-0.1 0.568 74.9 50.6 -81.4 -10.1 -6.3 4.8 6.2 12 30 A V S > S+ 0 0 7 -4,-0.3 3,-2.2 87,-0.1 -1,-0.2 -0.711 74.1 175.3-123.6 72.9 -3.4 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 0.619 73.0 54.7 -69.2 -13.5 -1.6 3.0 3.4 14 32 A Y T 3 S+ 0 0 19 86,-0.2 15,-2.4 88,-0.1 2,-0.4 0.482 82.0 111.1 -90.8 -7.9 1.5 0.8 4.1 15 33 A Q E < -J 28 0C 5 -3,-2.2 36,-0.4 13,-0.2 37,-0.4 -0.556 48.2-173.8 -73.1 124.3 -0.7 -2.3 4.8 16 34 A V E -J 27 0C 0 11,-2.6 11,-1.1 -2,-0.4 2,-0.5 -0.844 19.6-140.8-114.8 156.9 -0.4 -5.0 2.2 17 35 A S E -JK 26 49C 1 32,-2.3 32,-2.9 -2,-0.3 2,-0.6 -0.971 15.1-143.0-110.6 128.5 -2.2 -8.2 1.6 18 36 A L E -JK 25 48C 0 7,-3.2 6,-2.5 -2,-0.5 7,-0.9 -0.858 24.8-167.0 -91.6 127.0 -0.1 -11.2 0.4 19 37 A N E +JK 23 47C 18 28,-2.9 28,-2.6 -2,-0.6 4,-0.2 -0.941 31.9 166.5-124.0 130.6 -2.2 -13.2 -2.1 20 38 A S S S- 0 0 30 2,-2.1 3,-0.1 -2,-0.4 26,-0.1 -0.299 98.1 -45.8-130.3 48.5 -1.7 -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 0.167 140.7 27.5 101.8 -11.6 -5.2 -17.0 -5.0 22 40 A Y S S- 0 0 131 -4,-0.0 -2,-2.1 0, 0.0 2,-0.2 -0.939 102.8 -80.1-167.6 154.3 -6.6 -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 -0.528 52.3 158.2 -60.6 131.3 -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 0.522 58.1 4.4-130.8 -12.7 -3.0 -15.5 3.4 25 43 A b E -J 18 0C 7 -7,-0.9 -7,-3.2 151,-0.1 -1,-0.4 -0.981 62.0-120.6-163.7 157.9 -0.9 -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 -0.415 27.5 177.3 -92.5 178.6 -0.3 -9.2 5.9 27 45 A G E -J 16 0C 0 -11,-1.1 -11,-2.6 -2,-0.1 2,-0.4 -0.953 25.1-117.4-169.3 172.3 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 19.7-131.6-128.8 127.1 4.2 -3.7 5.4 29 47 A L E + L 0 35C 1 -15,-2.4 74,-2.1 -2,-0.4 6,-0.2 -0.669 26.9 174.3 -75.7 122.1 5.4 -1.6 2.4 30 48 A I E - 0 0 18 4,-2.4 2,-0.3 -2,-0.5 5,-0.2 0.581 66.1 -10.2-109.2 -14.4 8.8 -0.1 3.4 31 49 A N E > S- L 0 34C 48 3,-1.2 3,-0.8 70,-0.1 -1,-0.3 -0.934 89.6 -75.2-162.8-176.9 9.7 1.5 0.1 32 50 A S T 3 S+ 0 0 41 -2,-0.3 62,-3.6 1,-0.2 60,-0.1 0.712 128.9 27.6 -60.0 -20.3 8.5 1.5 -3.5 33 51 A Q T 3 S+ 0 0 73 60,-0.2 57,-2.8 1,-0.1 2,-0.4 0.415 110.2 69.2-120.5 -2.7 10.0 -2.0 -4.2 34 52 A W E < -LM 31 89C 4 -3,-0.8 -4,-2.4 55,-0.2 -3,-1.2 -0.976 47.3-169.4-134.7 140.0 10.1 -3.8 -0.8 35 53 A V E -LM 29 88C 0 53,-2.6 53,-2.6 -2,-0.4 2,-0.4 -0.951 13.9-146.3-121.1 139.6 7.7 -5.4 1.7 36 54 A V E +LM 28 87C 0 -8,-3.0 -8,-2.6 -2,-0.4 2,-0.2 -0.909 33.5 149.0-101.9 133.6 8.4 -6.6 5.2 37 55 A S E - M 0 86C 0 49,-2.8 49,-2.2 -2,-0.4 2,-0.3 -0.749 49.4 -70.3-142.4-170.4 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 -0.703 32.4-132.2 -87.4 142.5 6.8 -12.7 8.8 39 57 A A G > S+ 0 0 2 -2,-0.3 3,-2.2 1,-0.3 -1,-0.1 0.834 107.6 65.7 -58.4 -33.4 9.1 -15.5 7.7 40 58 A H G 3 S+ 0 0 61 1,-0.3 -1,-0.3 41,-0.1 137,-0.0 0.631 93.3 63.1 -69.0 -8.5 6.3 -17.9 8.6 41 59 A b G < S+ 0 0 3 -3,-1.5 -1,-0.3 -15,-0.1 -2,-0.2 0.436 76.9 131.5 -86.5 -4.7 4.4 -16.3 5.7 42 60 A Y < + 0 0 133 -3,-2.2 2,-0.3 -4,-0.1 -3,-0.0 -0.246 21.7 133.6 -55.1 133.2 7.0 -17.5 3.2 43 61 A K - 0 0 56 3,-0.0 3,-0.3 0, 0.0 2,-0.2 -0.934 51.4-102.4-163.6 166.2 5.6 -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 -0.504 94.6 40.1 -86.9 162.6 6.2 -19.2 -3.6 45 63 A G S S+ 0 0 67 1,-0.2 2,-0.4 -2,-0.2 -1,-0.2 0.880 74.6 170.4 72.7 40.0 3.9 -17.4 -6.1 46 64 A I - 0 0 9 -3,-0.3 21,-2.6 21,-0.1 2,-0.5 -0.708 19.9-165.5 -87.1 131.9 3.1 -14.4 -4.0 47 65 A Q E -KN 19 66C 51 -28,-2.6 -28,-2.9 -2,-0.4 2,-0.5 -0.983 17.3-139.8-109.9 128.3 1.3 -11.4 -5.4 48 66 A V E -KN 18 65C 0 17,-3.0 17,-2.7 -2,-0.5 2,-0.6 -0.768 12.8-157.9 -88.9 126.3 1.5 -8.3 -3.3 49 67 A R E -KN 17 64C 51 -32,-2.9 -32,-2.3 -2,-0.5 3,-0.3 -0.930 13.7-176.9-112.0 111.9 -1.8 -6.4 -3.1 50 68 A L E + N 0 63C 2 13,-3.2 13,-2.0 -2,-0.6 -34,-0.1 -0.685 61.1 29.4-103.1 159.2 -1.4 -2.7 -2.2 51 69 A G S S+ 0 0 5 -36,-0.4 10,-0.3 -38,-0.3 2,-0.2 0.701 84.2 156.7 68.1 21.6 -4.1 -0.1 -1.6 52 70 A E + 0 0 9 -37,-0.4 -42,-0.4 -3,-0.3 -1,-0.2 -0.558 20.6 151.1 -82.2 140.9 -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 0.345 80.8 30.3-117.6 -82.1 -9.6 -2.2 1.8 54 72 A N S > S- 0 0 28 80,-0.2 3,-1.3 1,-0.2 -1,-0.4 -0.665 73.4-160.6 -75.1 112.6 -12.2 -4.8 0.8 55 73 A I T 3 S+ 0 0 30 78,-2.4 -1,-0.2 -2,-0.8 79,-0.1 0.590 88.4 52.7 -74.3 -5.6 -10.0 -7.7 -0.3 56 74 A N T 3 S+ 0 0 122 77,-0.2 2,-0.4 1,-0.1 -1,-0.3 0.343 105.7 57.1-106.9 2.6 -12.9 -9.3 -2.2 57 75 A V S < S- 0 0 74 -3,-1.3 2,-0.8 76,-0.1 -4,-0.3 -0.998 77.1-128.7-137.1 132.6 -13.9 -6.2 -4.2 58 76 A V + 0 0 116 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.0 -0.733 34.3 172.1 -79.3 113.4 -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 0.554 50.5 -97.1-107.9 -12.9 -12.6 -0.6 -5.3 60 78 A G S S+ 0 0 61 -9,-0.0 -8,-0.1 0, 0.0 -2,-0.1 0.306 104.8 73.5 122.0 -9.0 -10.2 1.5 -7.4 61 79 A N + 0 0 66 -10,-0.3 -9,-0.1 38,-0.0 2,-0.0 0.336 67.1 123.0-116.5 6.8 -7.0 2.2 -5.4 62 80 A E - 0 0 32 -13,-0.0 2,-0.4 -11,-0.0 -11,-0.2 -0.307 38.6-169.0 -69.4 146.7 -5.4 -1.3 -5.7 63 81 A Q E -N 50 0C 38 -13,-2.0 -13,-3.2 2,-0.1 2,-0.6 -0.963 7.6-163.8-127.9 123.1 -2.0 -2.1 -7.1 64 82 A F E +N 49 0C 75 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.934 16.3 170.4-104.6 120.0 -1.3 -5.8 -7.7 65 83 A I E -N 48 0C 12 -17,-2.7 -17,-3.0 -2,-0.6 2,-0.1 -0.995 28.5-128.4-135.9 124.5 2.4 -6.5 -8.2 66 84 A S E -N 47 0C 51 -2,-0.4 25,-2.8 -19,-0.3 26,-0.3 -0.384 29.1-110.2 -66.7 148.4 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 -0.604 23.0-167.8 -75.8 138.0 7.0 -10.7 -6.0 68 86 A S E S- 0 0 62 21,-3.1 2,-0.3 1,-0.4 22,-0.2 0.702 72.2 -1.0 -95.5 -27.5 10.3 -11.1 -7.8 69 87 A K E -O 89 0C 87 20,-1.2 20,-2.9 2,-0.0 2,-0.4 -0.976 57.0-150.5-159.8 151.2 12.1 -12.6 -4.8 70 88 A S E -O 88 0C 43 -2,-0.3 2,-0.5 18,-0.2 18,-0.2 -0.962 7.5-164.8-121.4 140.6 11.7 -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 -0.921 5.7-160.5-128.3 104.8 14.4 -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 -0.597 43.2 -87.6 -75.6 142.3 13.7 -15.2 4.7 73 91 A H > - 0 0 21 12,-2.4 3,-1.8 -2,-0.2 -1,-0.1 -0.238 35.3-123.8 -49.7 136.8 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 0.794 109.9 41.8 -55.2 -28.1 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 0.181 78.8 141.9-108.9 14.3 18.5 -17.2 11.2 76 94 A Y < - 0 0 55 -3,-1.8 2,-0.5 9,-0.1 7,-0.2 -0.380 32.7-163.3 -59.9 128.6 14.7 -17.9 11.1 77 95 A N > - 0 0 66 5,-2.1 4,-2.3 -2,-0.1 5,-0.5 -0.970 7.4-162.4-114.9 112.3 13.8 -20.9 13.2 78 96 A S T 4 S+ 0 0 78 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.675 87.8 54.6 -70.1 -18.2 10.3 -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 0.902 123.7 22.8 -80.2 -44.1 10.0 -24.2 15.5 80 98 A T T 4 S- 0 0 74 2,-0.1 -2,-0.2 -3,-0.0 3,-0.1 0.610 96.3-132.7 -94.5 -16.7 10.7 -21.3 17.9 81 99 A L >< + 0 0 36 -4,-2.3 3,-0.8 1,-0.3 2,-0.2 0.606 48.7 159.4 65.9 17.6 9.7 -18.5 15.5 82 100 A N T 3 + 0 0 38 -5,-0.5 -5,-2.1 1,-0.2 -1,-0.3 -0.503 66.5 16.3 -66.5 137.8 12.9 -16.7 16.5 83 101 A N T 3 S+ 0 0 17 -7,-0.2 2,-2.0 1,-0.2 -10,-0.2 0.905 79.7 179.5 62.6 46.7 13.8 -14.2 13.8 84 102 A D < + 0 0 1 -3,-0.8 2,-0.3 75,-0.2 -1,-0.2 -0.495 35.2 114.6 -81.5 75.9 10.3 -14.3 12.2 85 103 A I + 0 0 0 -2,-2.0 -12,-2.4 -47,-0.3 2,-0.3 -0.998 36.2 177.1-149.0 143.1 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 18.6-141.1-148.0 146.5 11.1 -11.8 5.7 87 105 A L E -MO 36 71C 0 -16,-2.6 -16,-3.0 -2,-0.3 2,-0.4 -0.883 12.9-163.8-108.2 142.0 11.6 -9.3 2.9 88 106 A I E -MO 35 70C 0 -53,-2.6 -53,-2.6 -2,-0.4 2,-0.4 -0.992 7.6-150.2-126.9 124.5 9.7 -9.5 -0.4 89 107 A K E -MO 34 69C 41 -20,-2.9 -21,-3.1 -2,-0.4 -20,-1.2 -0.828 16.5-130.8 -95.3 134.6 10.9 -7.5 -3.5 90 108 A L E - 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