==== 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 3A7Y . 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) . 9272.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 137 61.4 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 . 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 . 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,-0.4 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 124.7 -8.0 -8.6 14.5 2 20 A V B +A 171 0A 9 169,-3.0 169,-1.9 1,-0.2 123,-0.1 -0.883 360.0 5.9-103.3 131.8 -10.3 -9.4 17.5 3 21 A G S S+ 0 0 48 121,-0.5 -1,-0.2 -2,-0.4 169,-0.1 0.699 103.2 116.2 75.6 20.8 -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 0.031 58.7-109.6-101.0-152.7 -10.8 -3.8 17.0 5 23 A Y E -B 137 0B 96 132,-2.5 132,-2.8 -3,-0.1 2,-0.5 -0.944 35.5 -85.6-142.1 159.4 -12.5 -1.4 14.6 6 24 A T E -B 136 0B 74 -2,-0.3 130,-0.2 130,-0.2 129,-0.1 -0.581 37.3-151.1 -66.5 118.6 -12.9 -0.8 10.9 7 25 A a - 0 0 17 128,-2.0 -1,-0.2 -2,-0.5 129,-0.1 0.907 35.6-115.2 -57.2 -45.8 -9.8 1.2 9.9 8 26 A G > - 0 0 26 127,-0.5 3,-1.8 -3,-0.1 4,-0.3 0.010 45.8 -57.7 105.5 136.8 -11.5 3.0 7.0 9 27 A A T 3 S- 0 0 55 1,-0.3 44,-0.1 2,-0.1 43,-0.1 -0.221 117.7 -11.1 -53.1 123.9 -10.5 2.6 3.3 10 28 A N T 3 S+ 0 0 27 42,-0.4 -1,-0.3 2,-0.1 43,-0.1 0.653 92.5 124.6 60.5 22.2 -6.8 3.4 2.6 11 29 A T S < S+ 0 0 83 -3,-1.8 -2,-0.1 1,-0.2 -1,-0.1 0.579 75.0 50.4 -82.2 -10.8 -6.2 4.9 6.1 12 30 A V S > S+ 0 0 7 -4,-0.3 3,-2.2 87,-0.1 -1,-0.2 -0.683 74.1 175.1-123.5 73.7 -3.3 2.4 6.6 13 31 A P T 3 S+ 0 0 30 0, 0.0 88,-1.4 0, 0.0 38,-0.3 0.615 72.8 54.8 -69.4 -14.2 -1.5 3.1 3.3 14 32 A Y T 3 S+ 0 0 20 86,-0.2 15,-2.2 88,-0.1 2,-0.4 0.472 82.0 111.0 -90.7 -7.6 1.6 0.8 4.1 15 33 A Q E < -J 28 0C 6 -3,-2.2 37,-0.4 13,-0.2 36,-0.4 -0.570 47.9-174.8 -73.3 124.1 -0.7 -2.2 4.7 16 34 A V E -J 27 0C 0 11,-2.5 11,-1.1 -2,-0.4 2,-0.5 -0.855 20.0-140.6-115.4 154.0 -0.3 -4.9 2.1 17 35 A S E -JK 26 49C 1 32,-2.4 32,-2.9 -2,-0.3 2,-0.5 -0.955 15.3-142.2-105.5 132.4 -2.2 -8.2 1.5 18 36 A L E -JK 25 48C 0 7,-3.3 6,-2.7 -2,-0.5 7,-1.0 -0.875 24.4-166.8 -94.0 128.5 -0.1 -11.2 0.3 19 37 A N E +JK 23 47C 18 28,-2.7 28,-2.6 -2,-0.5 4,-0.2 -0.959 32.1 165.7-126.8 127.3 -2.1 -13.2 -2.2 20 38 A S S S- 0 0 31 2,-2.1 3,-0.1 -2,-0.4 26,-0.1 -0.347 98.1 -46.6-127.3 48.0 -1.6 -16.7 -3.6 21 39 A G S S+ 0 0 71 26,-0.1 2,-0.3 1,-0.0 -2,-0.1 0.169 140.2 28.6 100.4 -12.5 -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,-0.2 -0.938 103.1 -80.8-167.1 155.2 -6.5 -15.8 -1.7 23 41 A H E +J 19 0C 34 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.530 52.4 158.4 -63.0 132.3 -5.3 -13.4 1.0 24 42 A F E + 0 0 34 -6,-2.7 2,-0.3 1,-0.4 151,-0.2 0.494 57.8 5.6-132.2 -10.0 -3.0 -15.4 3.4 25 43 A b E -J 18 0C 6 -7,-1.0 -7,-3.3 151,-0.1 -1,-0.4 -0.977 61.0-122.6-166.1 156.1 -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 -0.455 27.7 177.2 -93.4 176.5 -0.3 -9.1 5.8 27 45 A G E -J 16 0C 0 -11,-1.1 -11,-2.5 -2,-0.2 2,-0.4 -0.955 25.4-116.9-166.9 173.3 2.9 -7.1 5.2 28 46 A S E -JL 15 36C 0 8,-2.6 8,-2.8 -2,-0.3 2,-0.5 -0.986 20.2-131.8-127.9 128.8 4.3 -3.6 5.3 29 47 A L E + L 0 35C 1 -15,-2.2 74,-2.3 -2,-0.4 6,-0.2 -0.683 26.8 174.2 -78.1 123.2 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 0.620 66.4 -9.2-111.2 -16.1 8.9 -0.1 3.4 31 49 A N E > S- L 0 34C 48 3,-1.3 3,-0.7 70,-0.1 -1,-0.3 -0.925 89.6 -76.6-157.8-173.5 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 0.731 128.6 28.4 -63.1 -20.1 8.6 1.4 -3.6 33 51 A Q T 3 S+ 0 0 75 60,-0.2 57,-2.8 1,-0.1 2,-0.4 0.423 110.2 68.7-118.5 -1.7 10.1 -2.1 -4.2 34 52 A W E < -LM 31 89C 2 -3,-0.7 -4,-2.5 55,-0.2 -3,-1.3 -0.979 47.2-170.2-136.5 139.9 10.1 -3.9 -0.9 35 53 A V E -LM 29 88C 0 53,-2.5 53,-2.6 -2,-0.4 2,-0.5 -0.944 14.3-146.1-122.5 139.5 7.7 -5.4 1.7 36 54 A V E +LM 28 87C 0 -8,-2.8 -8,-2.6 -2,-0.4 2,-0.2 -0.934 33.6 149.2-103.7 132.0 8.5 -6.7 5.2 37 55 A S E - M 0 86C 0 49,-2.7 49,-2.3 -2,-0.5 2,-0.3 -0.710 49.5 -70.9-140.0-169.5 6.4 -9.6 6.4 38 56 A A > - 0 0 0 -12,-0.4 3,-1.6 47,-0.3 47,-0.3 -0.713 32.1-130.7 -88.9 143.7 6.8 -12.7 8.7 39 57 A A G > S+ 0 0 2 -2,-0.3 3,-2.2 1,-0.3 -1,-0.1 0.825 108.6 65.9 -57.8 -32.8 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 0.601 93.0 63.1 -70.1 -4.5 6.2 -17.9 8.6 41 59 A b G < S+ 0 0 3 -3,-1.6 -1,-0.3 -15,-0.0 -2,-0.2 0.400 76.9 130.9 -91.0 -1.7 4.4 -16.3 5.7 42 60 A Y < + 0 0 134 -3,-2.2 2,-0.3 -4,-0.1 -3,-0.0 -0.295 21.8 132.2 -58.1 131.7 7.0 -17.6 3.2 43 61 A K - 0 0 56 3,-0.0 3,-0.3 0, 0.0 2,-0.1 -0.920 52.5-101.7-164.6 163.8 5.7 -19.4 0.1 44 62 A S S S+ 0 0 97 -2,-0.3 25,-0.0 1,-0.2 0, 0.0 -0.425 94.9 39.9 -83.8 164.0 6.3 -19.2 -3.6 45 63 A G S S+ 0 0 67 1,-0.2 2,-0.4 22,-0.1 -1,-0.2 0.883 74.3 171.8 69.2 41.5 4.0 -17.4 -6.1 46 64 A I - 0 0 10 -3,-0.3 21,-2.7 21,-0.1 2,-0.5 -0.704 18.7-166.0 -84.8 131.0 3.2 -14.4 -4.0 47 65 A Q E -KN 19 66C 49 -28,-2.6 -28,-2.7 -2,-0.4 2,-0.4 -0.983 16.9-140.1-110.3 128.7 1.4 -11.5 -5.5 48 66 A V E -KN 18 65C 0 17,-3.0 17,-2.6 -2,-0.5 2,-0.6 -0.760 12.2-157.8 -89.8 130.2 1.5 -8.3 -3.4 49 67 A R E -KN 17 64C 53 -32,-2.9 -32,-2.4 -2,-0.4 3,-0.3 -0.937 13.7-178.3-115.8 111.7 -1.7 -6.3 -3.2 50 68 A L E + N 0 63C 2 13,-3.2 13,-1.9 -2,-0.6 -34,-0.1 -0.655 61.3 31.4-101.6 160.3 -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,-0.2 0.691 84.4 157.0 70.0 19.3 -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 -0.551 20.9 149.8 -82.2 139.6 -6.5 -2.7 -0.5 53 71 A D S S+ 0 0 15 1,-0.4 2,-0.8 4,-0.3 -1,-0.2 0.368 80.9 29.7-117.2 -80.6 -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 -0.684 72.9-160.8 -77.7 112.0 -12.1 -4.8 0.8 55 73 A I T 3 S+ 0 0 31 78,-2.4 -1,-0.2 -2,-0.8 79,-0.1 0.599 88.4 52.1 -72.3 -7.7 -9.9 -7.7 -0.4 56 74 A N T 3 S+ 0 0 125 77,-0.2 2,-0.4 1,-0.1 -1,-0.2 0.356 106.2 58.6-106.0 2.1 -12.8 -9.3 -2.2 57 75 A V S < S- 0 0 75 -3,-1.3 2,-0.7 76,-0.2 -4,-0.3 -0.997 76.9-130.0-136.2 130.6 -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 34.3 171.1 -77.4 113.6 -11.9 -4.1 -6.8 59 77 A E - 0 0 97 -2,-0.7 -1,-0.2 -5,-0.2 -7,-0.0 0.573 51.1 -95.9-109.1 -14.0 -12.6 -0.6 -5.4 60 78 A G S S+ 0 0 62 -9,-0.0 -8,-0.1 0, 0.0 -2,-0.1 0.261 105.1 72.2 125.4 -11.7 -10.2 1.6 -7.5 61 79 A N + 0 0 68 -10,-0.3 -9,-0.1 38,-0.0 -3,-0.0 0.326 67.1 123.4-115.7 6.5 -7.0 2.2 -5.6 62 80 A E - 0 0 33 -13,-0.0 2,-0.4 -11,-0.0 -11,-0.2 -0.295 38.5-168.2 -66.8 146.5 -5.3 -1.3 -5.8 63 81 A Q E -N 50 0C 38 -13,-1.9 -13,-3.2 2,-0.1 2,-0.6 -0.962 7.1-163.7-127.7 123.4 -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 -0.936 16.4 170.2-104.6 118.5 -1.3 -5.8 -7.8 65 83 A I E -N 48 0C 12 -17,-2.6 -17,-3.0 -2,-0.6 2,-0.1 -0.995 29.0-128.5-134.4 124.7 2.4 -6.5 -8.2 66 84 A S E -N 47 0C 52 -2,-0.4 25,-3.0 -19,-0.3 2,-0.3 -0.398 28.9-112.0 -67.2 146.8 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 -0.609 21.6-166.4 -77.4 138.3 7.0 -10.7 -6.1 68 86 A S E S- 0 0 59 21,-2.8 2,-0.3 1,-0.3 22,-0.2 0.731 72.0 -2.2 -94.2 -27.8 10.3 -11.2 -7.9 69 87 A K E -O 89 0C 88 20,-1.2 20,-2.8 2,-0.0 2,-0.4 -0.975 56.1-149.4-160.1 150.7 12.1 -12.7 -4.8 70 88 A S E -O 88 0C 41 -2,-0.3 2,-0.5 18,-0.2 18,-0.2 -0.942 8.0-163.5-118.5 142.9 11.6 -13.5 -1.1 71 89 A I E -O 87 0C 35 16,-3.1 16,-2.7 -2,-0.4 2,-0.3 -0.921 5.8-160.2-128.2 105.1 14.4 -13.4 1.5 72 90 A V E -O 86 0C 48 -2,-0.5 14,-0.2 14,-0.2 12,-0.1 -0.605 42.6 -88.3 -77.0 142.1 13.7 -15.2 4.8 73 91 A H > - 0 0 23 12,-2.4 3,-1.8 -2,-0.3 -1,-0.1 -0.236 35.4-123.0 -50.7 136.9 15.9 -14.1 7.6 74 92 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.777 109.9 41.7 -55.5 -26.2 19.1 -16.2 7.7 75 93 A S T 3 S+ 0 0 73 8,-0.1 2,-0.1 2,-0.1 -2,-0.1 0.191 79.0 142.5-110.7 14.7 18.5 -17.3 11.3 76 94 A Y < - 0 0 56 -3,-1.8 2,-0.5 9,-0.1 7,-0.2 -0.369 31.8-164.4 -58.7 130.7 14.7 -17.9 11.1 77 95 A N > - 0 0 64 5,-2.1 4,-2.2 1,-0.1 5,-0.5 -0.976 8.0-162.9-120.5 111.3 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 0.659 87.5 55.6 -70.9 -18.9 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 0.892 123.9 21.8 -78.2 -44.1 9.9 -24.2 15.6 80 98 A T T 4 S- 0 0 70 2,-0.1 -2,-0.2 -3,-0.1 3,-0.1 0.599 96.9-132.0 -96.4 -15.8 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 0.609 48.4 160.3 64.3 17.3 9.6 -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 -0.508 66.9 15.9 -65.2 137.4 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 -1,-0.2 0.906 80.2-179.6 63.6 47.1 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 -0.485 35.6 114.6 -81.9 75.6 10.3 -14.3 12.3 85 103 A I + 0 0 0 -2,-2.0 -12,-2.4 -47,-0.3 2,-0.3 -0.999 36.9 179.0-149.8 141.3 10.9 -11.8 9.5 86 104 A M E -MO 37 72C 0 -49,-2.3 -49,-2.7 -2,-0.3 2,-0.4 -0.996 18.0-141.6-144.4 144.1 11.1 -11.9 5.7 87 105 A L E -MO 36 71C 0 -16,-2.7 -16,-3.1 -2,-0.3 2,-0.4 -0.882 13.8-165.2-104.7 141.5 11.7 -9.4 2.9 88 106 A I E -MO 35 70C 0 -53,-2.6 -53,-2.5 -2,-0.4 2,-0.4 -0.992 7.3-151.3-127.8 122.4 9.8 -9.5 -0.4 89 107 A K E -MO 34 69C 42 -20,-2.8 -21,-2.8 -2,-0.4 -20,-1.2 -0.797 16.3-130.3 -93.1 137.1 10.9 -7.6 -3.5 90 108 A L E - 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