==== 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 3A7V . 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) . 9223.0 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 0.000 360.0 360.0 360.0 124.5 -8.0 -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 -0.888 360.0 6.7-103.8 131.7 -10.3 -9.5 17.5 3 21 A G S S+ 0 0 45 121,-0.6 -1,-0.2 -2,-0.4 169,-0.1 0.709 103.4 116.5 75.0 21.8 -11.9 -6.7 19.4 4 22 A G - 0 0 36 -3,-0.3 2,-0.3 167,-0.1 134,-0.2 0.006 58.0-110.7-101.9-153.2 -10.7 -4.0 17.0 5 23 A Y E -B 137 0B 98 132,-2.6 132,-3.0 -3,-0.1 2,-0.5 -0.945 35.0 -85.6-142.6 159.4 -12.5 -1.5 14.6 6 24 A T E -B 136 0B 73 -2,-0.3 130,-0.2 130,-0.2 129,-0.1 -0.581 37.1-151.6 -66.7 118.8 -12.9 -0.9 10.9 7 25 A a - 0 0 18 128,-2.0 -1,-0.2 -2,-0.5 129,-0.1 0.897 36.5-113.0 -59.0 -44.4 -9.8 1.2 10.0 8 26 A G > - 0 0 26 127,-0.5 3,-1.9 -3,-0.1 4,-0.3 -0.004 47.2 -57.4 106.7 137.4 -11.5 3.0 7.1 9 27 A A T 3 S- 0 0 56 1,-0.3 44,-0.1 2,-0.1 43,-0.1 -0.241 118.2 -12.0 -53.0 123.2 -10.5 2.5 3.4 10 28 A N T 3 S+ 0 0 26 42,-0.3 -1,-0.3 2,-0.1 43,-0.1 0.670 92.0 126.0 61.4 24.2 -6.8 3.3 2.7 11 29 A T S < S+ 0 0 83 -3,-1.9 -2,-0.1 1,-0.2 -1,-0.1 0.555 74.7 50.8 -83.9 -10.0 -6.2 4.8 6.1 12 30 A V S > S+ 0 0 8 -4,-0.3 3,-2.0 87,-0.1 -1,-0.2 -0.714 74.5 175.2-123.3 74.2 -3.3 2.4 6.7 13 31 A P T 3 S+ 0 0 30 0, 0.0 88,-1.5 0, 0.0 38,-0.3 0.606 72.4 54.8 -70.2 -13.4 -1.5 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 0.470 81.9 111.5 -91.2 -7.8 1.5 0.8 4.1 15 33 A Q E < -J 28 0C 5 -3,-2.0 36,-0.4 13,-0.2 37,-0.4 -0.560 48.2-173.7 -71.8 124.2 -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 -0.837 19.5-140.6-114.7 155.7 -0.3 -4.9 2.1 17 35 A S E -JK 26 49C 1 32,-2.2 32,-2.8 -2,-0.3 2,-0.6 -0.970 15.2-142.6-108.2 129.7 -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 24.7-166.8 -91.6 126.6 -0.1 -11.2 0.4 19 37 A N E +JK 23 47C 19 28,-2.8 28,-2.6 -2,-0.6 4,-0.2 -0.951 31.7 166.4-124.6 129.7 -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 97.6 -46.5-128.7 47.7 -1.6 -16.7 -3.5 21 39 A G S S+ 0 0 71 26,-0.1 2,-0.3 1,-0.0 -2,-0.1 0.179 140.5 27.1 101.0 -11.4 -5.1 -17.0 -5.0 22 40 A Y S S- 0 0 133 -4,-0.0 -2,-2.2 0, 0.0 2,-0.2 -0.932 103.5 -79.6-169.2 154.0 -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 -0.526 52.4 157.7 -61.2 131.9 -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 0.534 58.5 5.6-131.7 -14.0 -3.0 -15.5 3.5 25 43 A b E -J 18 0C 8 -7,-1.0 -7,-3.3 151,-0.1 -1,-0.4 -0.985 61.9-121.4-162.7 157.1 -0.8 -12.9 5.3 26 44 A G E +J 17 0C 0 151,-2.9 12,-0.4 -2,-0.3 2,-0.3 -0.397 27.5 177.7 -91.0 178.0 -0.2 -9.2 5.8 27 45 A G E -J 16 0C 0 -11,-1.1 -11,-2.6 -2,-0.1 2,-0.4 -0.955 24.6-118.6-167.8 171.6 2.9 -7.2 5.2 28 46 A S E -JL 15 36C 0 8,-2.7 8,-2.9 -2,-0.3 2,-0.5 -0.989 19.8-130.7-128.2 129.7 4.2 -3.6 5.3 29 47 A L E + L 0 35C 1 -15,-2.4 74,-2.4 -2,-0.4 6,-0.2 -0.658 27.2 173.8 -76.8 123.7 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 0.610 66.1 -9.7-111.4 -16.3 8.9 -0.1 3.3 31 49 A N E > S- L 0 34C 49 3,-1.3 3,-0.8 70,-0.1 -1,-0.3 -0.929 89.2 -76.4-159.8-175.7 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 0.706 128.6 28.4 -61.1 -20.0 8.5 1.4 -3.6 33 51 A Q T 3 S+ 0 0 76 60,-0.2 57,-2.8 1,-0.1 2,-0.4 0.423 110.4 68.9-118.9 -3.1 10.0 -2.0 -4.3 34 52 A W E < -LM 31 89C 1 -3,-0.8 -4,-2.5 55,-0.2 -3,-1.3 -0.976 47.5-169.2-135.7 140.4 10.1 -3.9 -0.9 35 53 A V E -LM 29 88C 0 53,-2.6 53,-2.5 -2,-0.4 2,-0.4 -0.951 14.1-146.2-121.6 139.1 7.7 -5.4 1.6 36 54 A V E +LM 28 87C 0 -8,-2.9 -8,-2.7 -2,-0.4 2,-0.2 -0.903 34.0 148.8-101.5 133.2 8.5 -6.6 5.2 37 55 A S E - M 0 86C 0 49,-2.7 49,-2.2 -2,-0.4 2,-0.3 -0.767 49.6 -69.6-143.6-169.9 6.5 -9.6 6.4 38 56 A A > - 0 0 0 -12,-0.4 3,-1.5 47,-0.3 47,-0.3 -0.707 32.2-133.4 -89.0 139.8 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 0.846 107.1 65.3 -56.5 -35.0 9.1 -15.5 7.7 40 58 A H G 3 S+ 0 0 64 1,-0.3 -1,-0.2 41,-0.1 137,-0.0 0.612 93.2 62.9 -67.1 -9.7 6.4 -17.9 8.6 41 59 A b G < S+ 0 0 4 -3,-1.5 -1,-0.3 -15,-0.1 -2,-0.2 0.450 77.2 132.4 -86.4 -5.9 4.4 -16.4 5.8 42 60 A Y < + 0 0 135 -3,-2.3 2,-0.3 -4,-0.1 -3,-0.0 -0.219 20.6 134.9 -54.4 133.2 7.0 -17.6 3.2 43 61 A K - 0 0 55 0, 0.0 3,-0.3 0, 0.0 2,-0.1 -0.939 50.7-103.2-162.4 166.1 5.7 -19.3 0.1 44 62 A S S S+ 0 0 98 -2,-0.3 25,-0.0 1,-0.2 0, 0.0 -0.494 95.0 40.1 -86.7 163.5 6.3 -19.2 -3.6 45 63 A G S S+ 0 0 68 1,-0.2 2,-0.4 -2,-0.1 -1,-0.2 0.872 75.0 171.2 70.5 40.1 4.0 -17.5 -6.1 46 64 A I - 0 0 8 -3,-0.3 21,-2.6 21,-0.1 2,-0.5 -0.689 19.7-164.9 -85.2 132.9 3.2 -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 -0.985 16.5-140.7-110.1 127.5 1.3 -11.5 -5.4 48 66 A V E -KN 18 65C 0 17,-2.8 17,-2.6 -2,-0.5 2,-0.6 -0.741 12.0-157.7 -88.4 128.0 1.5 -8.3 -3.3 49 67 A R E -KN 17 64C 53 -32,-2.8 -32,-2.2 -2,-0.5 3,-0.3 -0.933 13.8-177.2-113.3 110.6 -1.8 -6.4 -3.1 50 68 A L E + N 0 63C 2 13,-3.1 13,-2.1 -2,-0.6 -34,-0.1 -0.675 61.4 30.2-100.9 158.9 -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 0.696 84.5 156.6 70.4 21.3 -4.1 -0.1 -1.7 52 70 A E + 0 0 9 -37,-0.4 -42,-0.3 -3,-0.3 -1,-0.2 -0.577 21.0 149.7 -83.8 139.4 -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 0.357 80.8 30.7-116.0 -82.8 -9.6 -2.2 1.7 54 72 A N S > S- 0 0 27 80,-0.2 3,-1.3 1,-0.2 -1,-0.4 -0.642 72.8-161.2 -73.9 112.6 -12.1 -4.8 0.8 55 73 A I T 3 S+ 0 0 30 78,-2.4 -1,-0.2 -2,-0.7 79,-0.1 0.580 88.2 52.0 -75.6 -5.3 -9.9 -7.7 -0.3 56 74 A N T 3 S+ 0 0 125 77,-0.2 2,-0.4 1,-0.1 -1,-0.3 0.366 106.1 58.0-107.7 1.0 -12.9 -9.3 -2.2 57 75 A V S < S- 0 0 74 -3,-1.3 2,-0.8 76,-0.2 -4,-0.3 -0.999 77.2-129.3-135.6 132.2 -13.9 -6.2 -4.2 58 76 A V + 0 0 118 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.0 -0.740 34.3 172.3 -80.5 112.2 -11.9 -4.1 -6.7 59 77 A E - 0 0 96 -2,-0.8 -1,-0.2 -5,-0.2 -7,-0.0 0.558 50.5 -96.7-106.1 -14.5 -12.6 -0.6 -5.3 60 78 A G S S+ 0 0 62 -9,-0.0 -2,-0.1 0, 0.0 -8,-0.1 0.315 105.2 73.3 123.3 -7.5 -10.2 1.6 -7.4 61 79 A N + 0 0 65 -10,-0.3 -9,-0.1 38,-0.0 -3,-0.0 0.348 66.8 123.5-116.6 5.3 -7.0 2.1 -5.5 62 80 A E - 0 0 33 -13,-0.0 2,-0.4 -11,-0.0 -11,-0.2 -0.298 38.1-169.0 -67.6 146.6 -5.4 -1.3 -5.8 63 81 A Q E -N 50 0C 37 -13,-2.1 -13,-3.1 2,-0.1 2,-0.6 -0.962 7.6-163.8-128.8 120.5 -2.0 -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 -0.921 16.3 170.1-102.4 119.8 -1.3 -5.8 -7.7 65 83 A I E -N 48 0C 12 -17,-2.6 -17,-2.8 -2,-0.6 2,-0.1 -0.992 28.6-128.7-135.3 125.0 2.4 -6.6 -8.2 66 84 A S E -N 47 0C 54 -2,-0.4 25,-2.8 -19,-0.3 2,-0.3 -0.389 29.2-109.9 -68.5 147.4 4.0 -10.0 -8.3 67 85 A A E -O 90 0C 19 -21,-2.6 23,-0.3 23,-0.2 -22,-0.1 -0.595 23.5-168.5 -74.7 135.7 7.0 -10.8 -6.0 68 86 A S E S- 0 0 59 21,-3.1 2,-0.3 1,-0.4 22,-0.2 0.729 72.3 -1.4 -93.1 -29.1 10.3 -11.2 -7.9 69 87 A K E -O 89 0C 86 20,-1.2 20,-3.1 2,-0.0 2,-0.4 -0.980 57.0-151.8-160.2 149.8 12.2 -12.6 -4.9 70 88 A S E -O 88 0C 42 -2,-0.3 2,-0.5 18,-0.2 18,-0.2 -0.952 7.2-164.0-122.1 142.7 11.7 -13.4 -1.2 71 89 A I E -O 87 0C 36 16,-3.0 16,-2.6 -2,-0.4 2,-0.2 -0.922 6.0-159.4-130.2 104.4 14.4 -13.4 1.4 72 90 A V E -O 86 0C 47 -2,-0.5 14,-0.2 14,-0.2 12,-0.1 -0.596 43.0 -87.3 -75.6 143.5 13.7 -15.2 4.7 73 91 A H > - 0 0 22 12,-2.3 3,-1.9 -2,-0.2 -1,-0.1 -0.244 35.5-123.4 -50.6 136.0 15.9 -14.0 7.6 74 92 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.799 110.0 40.7 -53.0 -28.9 19.2 -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 0.177 79.1 142.5-110.7 16.3 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 -0.388 32.1-163.7 -61.4 129.1 14.8 -17.8 11.1 77 95 A N > - 0 0 66 5,-2.1 4,-2.2 -2,-0.1 5,-0.4 -0.975 7.8-162.4-116.2 113.7 13.8 -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 0.677 87.4 55.7 -72.0 -18.0 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 0.909 124.0 21.3 -78.6 -44.5 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 -1,-0.1 0.604 96.5-131.9 -96.5 -16.3 10.6 -21.3 17.9 81 99 A L >< + 0 0 34 -4,-2.2 3,-0.8 1,-0.3 2,-0.2 0.606 48.2 160.5 65.1 17.0 9.7 -18.5 15.5 82 100 A N T 3 + 0 0 39 -5,-0.4 -5,-2.1 1,-0.2 -1,-0.3 -0.506 67.4 15.8 -63.5 134.6 12.9 -16.7 16.5 83 101 A N T 3 S- 0 0 17 -7,-0.2 2,-1.9 1,-0.2 -1,-0.2 0.900 79.6-179.9 65.8 45.4 13.7 -14.1 13.8 84 102 A D < + 0 0 1 -3,-0.8 2,-0.3 75,-0.2 -1,-0.2 -0.509 36.2 113.9 -79.7 75.4 10.3 -14.3 12.2 85 103 A I + 0 0 0 -2,-1.9 -12,-2.3 -47,-0.3 2,-0.3 -0.997 36.4 176.9-149.9 143.1 10.9 -11.8 9.4 86 104 A M E -MO 37 72C 0 -49,-2.2 -49,-2.7 -2,-0.3 2,-0.4 -0.991 19.1-139.9-147.3 147.6 11.2 -11.9 5.6 87 105 A L E -MO 36 71C 0 -16,-2.6 -16,-3.0 -2,-0.3 2,-0.4 -0.886 13.7-164.2-107.0 141.9 11.7 -9.4 2.8 88 106 A I E -MO 35 70C 0 -53,-2.5 -53,-2.6 -2,-0.4 2,-0.4 -0.995 7.5-150.5-126.3 125.5 9.8 -9.5 -0.5 89 107 A K E -MO 34 69C 40 -20,-3.1 -21,-3.1 -2,-0.4 -20,-1.2 -0.828 16.3-130.9 -96.0 135.1 10.9 -7.6 -3.6 90 108 A L E - 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