==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-APR-99 1QBO . COMPND 2 MOLECULE: PROTEIN (TRYPSIN); . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR M.WHITLOW . 223 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9225.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 134 60.1 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 . 3 1.3 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 . 20 9.0 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 . 1 0.4 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 1 6 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 7 A I 0 0 2 0, 0.0 2,-0.4 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 128.9 14.0 4.5 60.2 2 8 A V B +A 171 0A 11 169,-3.3 169,-1.8 1,-0.2 123,-0.1 -0.875 360.0 4.2-106.4 136.3 12.6 6.3 57.2 3 9 A G S S+ 0 0 45 121,-0.5 -1,-0.2 -2,-0.4 2,-0.1 0.652 100.6 122.9 67.7 19.9 8.9 6.2 56.3 4 10 A G - 0 0 31 -3,-0.3 2,-0.3 167,-0.1 134,-0.2 -0.186 56.0-114.9 -96.7-165.6 8.0 4.2 59.4 5 11 A Y E -B 137 0B 105 132,-3.0 132,-3.0 -3,-0.1 2,-0.6 -0.860 33.0 -88.8-128.9 164.2 5.5 4.9 62.2 6 12 A T E -B 136 0B 75 -2,-0.3 130,-0.2 130,-0.2 129,-0.1 -0.638 37.7-151.3 -74.0 118.7 5.7 5.5 66.0 7 13 A a - 0 0 14 128,-1.6 -1,-0.2 -2,-0.6 129,-0.1 0.847 34.5-114.0 -60.1 -42.2 5.6 2.0 67.5 8 14 A G > - 0 0 31 127,-0.5 3,-1.3 4,-0.0 4,-0.3 0.054 48.2 -56.5 108.7 140.7 4.0 3.0 70.7 9 15 A A T 3 S- 0 0 56 1,-0.3 44,-0.1 2,-0.1 43,-0.1 -0.276 120.2 -7.1 -55.3 122.1 5.8 2.7 74.1 10 16 A N T 3 S+ 0 0 32 42,-0.4 -1,-0.3 2,-0.2 43,-0.1 0.791 88.0 125.1 56.1 46.3 6.9 -0.9 74.7 11 17 A T S < S+ 0 0 89 -3,-1.3 -2,-0.1 1,-0.2 -1,-0.1 0.543 79.3 48.7 -95.8 -19.2 5.3 -2.6 71.7 12 18 A V S > S+ 0 0 6 -4,-0.3 3,-1.6 87,-0.1 -1,-0.2 -0.729 74.0 173.0-121.2 70.9 8.7 -4.0 70.7 13 19 A P T 3 S+ 0 0 30 0, 0.0 88,-1.2 0, 0.0 38,-0.4 0.656 72.1 56.7 -59.0 -23.1 9.8 -5.4 74.1 14 20 A Y T 3 S+ 0 0 23 86,-0.2 15,-2.0 88,-0.1 2,-0.3 0.502 80.6 112.2 -87.7 -7.4 12.9 -7.1 72.9 15 21 A Q E < -J 28 0C 7 -3,-1.6 36,-0.5 13,-0.2 37,-0.3 -0.583 47.9-170.7 -72.5 135.3 14.4 -3.8 71.4 16 22 A V E -JK 27 50C 1 11,-2.6 11,-1.3 -2,-0.3 2,-0.4 -0.884 17.6-140.7-128.7 146.0 17.5 -2.5 73.3 17 23 A S E -JK 26 49C 1 32,-2.1 32,-2.7 -2,-0.3 2,-0.5 -0.946 14.0-144.5-103.2 131.9 19.4 0.8 73.0 18 24 A L E -JK 25 48C 0 7,-3.0 6,-2.5 -2,-0.4 7,-0.8 -0.856 25.1-171.1 -96.6 122.7 23.3 0.6 73.3 19 25 A N E +JK 23 47C 22 28,-2.5 28,-1.9 -2,-0.5 4,-0.2 -0.979 31.0 166.9-126.0 134.6 24.6 3.7 75.2 20 26 A S S S- 0 0 32 2,-2.2 3,-0.1 -2,-0.4 26,-0.1 -0.305 98.0 -43.9-135.1 46.5 28.1 5.0 75.7 21 27 A G S S+ 0 0 70 26,-0.1 2,-0.3 1,-0.1 -2,-0.1 0.225 140.7 24.4 109.9 -10.4 27.1 8.5 77.0 22 28 A Y S S- 0 0 130 -4,-0.0 -2,-2.2 0, 0.0 2,-0.2 -0.938 102.8 -76.2-170.0 163.1 24.5 8.6 74.2 23 29 A H E +J 19 0C 37 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.493 52.0 157.1 -71.6 133.3 22.5 6.2 72.0 24 30 A F E + 0 0 32 -6,-2.5 2,-0.3 1,-0.5 151,-0.2 0.535 58.7 2.6-134.9 -14.0 24.7 4.7 69.2 25 31 A b E -J 18 0C 7 -7,-0.8 -7,-3.0 151,-0.1 -1,-0.5 -0.947 61.4-122.7-168.5 161.9 23.1 1.3 68.1 26 32 A G E +J 17 0C 1 151,-3.1 12,-0.4 -2,-0.3 2,-0.3 -0.466 28.0 177.9-104.4 178.6 20.1 -1.0 68.7 27 33 A G E -J 16 0C 0 -11,-1.3 -11,-2.6 -2,-0.2 2,-0.4 -0.907 23.1-116.2-170.1 171.9 20.2 -4.6 69.8 28 34 A S E -JL 15 36C 2 8,-2.1 8,-2.4 -2,-0.3 2,-0.6 -0.995 18.9-127.9-123.8 137.9 17.8 -7.5 70.7 29 35 A L E + L 0 35C 2 -15,-2.0 74,-2.3 -2,-0.4 6,-0.2 -0.726 27.0 172.8 -87.1 122.9 17.3 -9.3 74.0 30 36 A I E - 0 0 19 4,-2.0 2,-0.3 -2,-0.6 5,-0.2 0.584 68.7 -12.4-104.0 -17.1 17.6 -13.1 73.5 31 37 A N E > S- L 0 34C 56 3,-1.2 3,-0.8 70,-0.1 -1,-0.3 -0.929 87.5 -76.7-165.3 177.8 17.5 -14.1 77.2 32 38 A S T 3 S+ 0 0 37 -2,-0.3 62,-3.0 1,-0.2 60,-0.1 0.682 128.7 29.9 -59.7 -21.0 17.7 -12.5 80.6 33 39 A Q T 3 S+ 0 0 83 60,-0.2 57,-2.5 1,-0.1 2,-0.4 0.417 110.1 67.1-117.3 -5.1 21.5 -12.2 80.3 34 40 A W E < -LM 31 89C 9 -3,-0.8 -4,-2.0 55,-0.2 -3,-1.2 -0.956 46.5-172.6-128.7 144.9 22.4 -11.8 76.6 35 41 A V E -LM 29 88C 0 53,-2.6 53,-2.7 -2,-0.4 2,-0.4 -0.963 14.2-148.4-126.8 142.9 21.9 -9.2 73.8 36 42 A V E +LM 28 87C 2 -8,-2.4 -8,-2.1 -2,-0.3 2,-0.2 -0.942 31.6 147.9-110.7 139.0 22.7 -9.7 70.1 37 43 A S E - M 0 86C 0 49,-2.4 49,-2.2 -2,-0.4 2,-0.3 -0.722 49.9 -63.7-148.9-167.9 23.8 -6.7 68.0 38 44 A A > - 0 0 0 -12,-0.4 3,-1.8 47,-0.3 47,-0.3 -0.740 31.3-134.5 -93.5 139.3 26.1 -5.9 65.0 39 45 A A G > S+ 0 0 3 -2,-0.3 3,-2.0 1,-0.3 -1,-0.1 0.842 106.8 64.1 -55.8 -34.1 29.8 -6.4 65.2 40 46 A H G 3 S+ 0 0 66 1,-0.3 -1,-0.3 41,-0.1 137,-0.0 0.610 93.5 62.6 -71.3 -6.7 30.3 -2.9 63.6 41 47 A b G < S+ 0 0 4 -3,-1.8 -1,-0.3 -15,-0.1 -2,-0.2 0.381 76.3 138.6 -93.7 -0.7 28.6 -1.4 66.8 42 48 A Y < + 0 0 131 -3,-2.0 2,-0.3 -4,-0.1 -3,-0.1 -0.171 20.5 152.5 -55.8 134.5 31.5 -2.7 68.9 43 49 A K - 0 0 59 3,-0.0 2,-0.3 0, 0.0 3,-0.3 -0.979 44.9-112.7-154.8 156.6 32.7 -0.3 71.6 44 50 A S S S+ 0 0 97 -2,-0.3 0, 0.0 1,-0.2 0, 0.0 -0.724 97.3 31.5 -92.8 141.7 34.3 -0.4 75.0 45 51 A G S S+ 0 0 66 -2,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.921 76.2 174.5 76.9 51.8 32.0 0.7 77.8 46 52 A I - 0 0 8 -3,-0.3 21,-2.1 -26,-0.1 2,-0.4 -0.721 16.5-164.9 -90.2 140.2 28.6 -0.2 76.7 47 53 A Q E -KN 19 66C 49 -28,-1.9 -28,-2.5 -2,-0.3 2,-0.4 -0.977 17.7-137.9-119.8 131.0 25.5 0.2 78.9 48 54 A V E -KN 18 65C 0 17,-3.9 17,-2.6 -2,-0.4 2,-0.5 -0.804 13.6-159.3 -93.2 127.7 22.3 -1.7 77.8 49 55 A R E -KN 17 64C 52 -32,-2.7 -32,-2.1 -2,-0.4 3,-0.3 -0.946 13.7-174.7-116.0 114.0 19.0 0.2 78.0 50 56 A L E +KN 16 63C 2 13,-2.8 13,-1.6 -2,-0.5 -34,-0.1 -0.739 58.8 22.9-107.2 157.1 15.9 -1.9 78.1 51 57 A G S S+ 0 0 5 -36,-0.5 10,-0.2 -38,-0.4 -1,-0.2 0.694 84.0 159.6 58.9 25.6 12.1 -1.1 78.1 52 58 A E + 0 0 11 -37,-0.3 -42,-0.4 -3,-0.3 -1,-0.2 -0.491 22.9 161.8 -77.7 144.0 12.9 2.3 76.5 53 59 A D S S+ 0 0 18 1,-0.5 2,-0.6 4,-0.3 82,-0.4 0.479 78.9 25.2-117.8 -80.0 10.3 4.4 74.6 54 60 A N S > S- 0 0 30 3,-0.2 3,-1.3 80,-0.2 -1,-0.5 -0.828 73.0-153.5 -87.3 121.1 11.7 8.0 74.4 55 61 A I T 3 S+ 0 0 28 78,-2.3 -1,-0.1 -2,-0.6 79,-0.1 0.528 92.3 49.8 -74.6 -5.9 15.5 7.7 74.7 56 62 A N T 3 S+ 0 0 122 77,-0.2 2,-0.4 1,-0.1 -1,-0.2 0.285 104.8 61.3-112.7 5.6 15.8 11.2 76.2 57 63 A V S < S- 0 0 70 -3,-1.3 2,-0.9 76,-0.2 -4,-0.3 -0.999 73.8-135.9-133.4 131.9 13.1 10.9 78.9 58 64 A V + 0 0 110 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.0 -0.840 28.6 172.5 -90.9 112.7 13.0 8.5 81.9 59 65 A E - 0 0 89 -2,-0.9 -1,-0.2 -5,-0.2 -7,-0.0 0.365 51.3-103.5-100.7 1.1 9.4 7.3 81.8 60 66 A G S S+ 0 0 60 0, 0.0 -2,-0.1 0, 0.0 -8,-0.1 0.200 101.3 83.8 99.9 -16.2 9.8 4.7 84.5 61 67 A N + 0 0 56 -10,-0.2 2,-0.2 2,-0.0 38,-0.1 0.339 66.1 116.1 -99.7 4.5 9.9 1.3 82.7 62 68 A E - 0 0 31 -13,-0.0 2,-0.4 2,-0.0 -11,-0.2 -0.446 45.0-165.1 -81.7 148.7 13.6 1.3 81.9 63 69 A Q E -N 50 0C 37 -13,-1.6 -13,-2.8 -2,-0.2 2,-0.6 -0.997 8.4-163.4-127.7 118.3 16.3 -1.0 83.1 64 70 A F E +N 49 0C 74 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.952 16.7 172.0-109.5 110.8 19.9 0.3 82.5 65 71 A I E -N 48 0C 15 -17,-2.6 -17,-3.9 -2,-0.6 2,-0.1 -0.974 27.1-128.7-125.0 136.3 22.6 -2.5 82.8 66 72 A S E -N 47 0C 61 -2,-0.4 25,-2.8 -19,-0.3 26,-0.3 -0.367 27.7-114.4 -75.2 153.4 26.3 -2.4 82.1 67 73 A A E -O 90 0C 26 -21,-2.1 23,-0.3 23,-0.2 3,-0.1 -0.661 22.0-170.8 -88.7 139.4 27.9 -5.1 79.8 68 74 A S E S+ 0 0 71 21,-2.7 2,-0.3 1,-0.4 22,-0.2 0.628 72.5 14.3 -97.5 -29.5 30.4 -7.5 81.4 69 75 A K E -O 89 0C 93 20,-1.1 20,-2.3 2,-0.0 2,-0.4 -0.987 57.5-161.9-148.8 144.7 31.6 -9.1 78.2 70 76 A S E -O 88 0C 43 -2,-0.3 2,-0.4 18,-0.2 18,-0.2 -0.995 7.1-171.0-129.8 134.7 31.5 -8.5 74.4 71 77 A I E -O 87 0C 37 16,-2.7 16,-2.5 -2,-0.4 2,-0.3 -0.959 5.6-161.9-129.2 110.4 32.2 -11.2 71.8 72 78 A V E -O 86 0C 51 -2,-0.4 14,-0.2 14,-0.2 12,-0.1 -0.644 43.5 -87.4 -86.9 141.5 32.5 -10.2 68.1 73 79 A H > - 0 0 24 12,-2.0 3,-1.8 -2,-0.3 -1,-0.1 -0.264 35.6-122.3 -47.2 137.5 32.1 -13.1 65.7 74 80 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.725 110.1 42.4 -58.6 -27.7 35.4 -14.8 65.0 75 81 A S T 3 S+ 0 0 72 8,-0.1 2,-0.1 2,-0.1 -2,-0.1 0.023 77.8 139.9-109.1 21.6 35.2 -14.2 61.3 76 82 A Y < - 0 0 57 -3,-1.8 2,-0.5 9,-0.1 7,-0.2 -0.426 34.3-162.5 -65.1 136.4 33.9 -10.6 61.3 77 83 A N B >> -P 82 0D 71 5,-1.8 4,-2.6 -2,-0.1 5,-0.5 -0.977 9.5-160.1-124.8 111.8 35.5 -8.6 58.5 78 84 A S T 45S+ 0 0 79 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.723 88.9 58.4 -68.2 -19.1 35.2 -4.8 59.0 79 85 A N T 45S+ 0 0 151 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.914 122.5 20.2 -74.6 -41.5 35.9 -4.2 55.3 80 86 A T T 45S- 0 0 72 -3,-0.2 -2,-0.2 2,-0.1 -1,-0.1 0.648 94.5-130.1-100.0 -21.9 33.0 -6.2 53.9 81 87 A L T ><5 + 0 0 29 -4,-2.6 3,-0.8 1,-0.3 2,-0.2 0.669 49.8 161.1 71.1 21.4 30.8 -6.4 57.0 82 88 A N B 3 < +P 77 0D 36 -5,-0.5 -5,-1.8 1,-0.2 -1,-0.3 -0.578 67.2 15.4 -73.9 137.1 30.6 -10.2 56.4 83 89 A N T 3 S+ 0 0 15 -2,-0.2 2,-1.7 -7,-0.2 -10,-0.3 0.895 80.3 180.0 63.8 51.6 29.5 -11.9 59.7 84 90 A D < + 0 0 0 -3,-0.8 2,-0.3 75,-0.2 -1,-0.2 -0.588 36.5 110.7 -85.0 81.3 28.3 -8.5 61.3 85 91 A I + 0 0 0 -2,-1.7 -12,-2.0 -47,-0.3 2,-0.3 -0.984 37.3 176.6-157.8 141.0 27.1 -9.9 64.6 86 92 A M E -MO 37 72C 0 -49,-2.2 -49,-2.4 -2,-0.3 2,-0.4 -0.963 20.1-136.6-146.1 153.9 28.3 -9.6 68.2 87 93 A L E -MO 36 71C 0 -16,-2.5 -16,-2.7 -2,-0.3 2,-0.4 -0.923 13.2-161.4-116.3 144.2 26.9 -10.9 71.6 88 94 A I E -MO 35 70C 0 -53,-2.7 -53,-2.6 -2,-0.4 2,-0.5 -0.997 5.8-152.4-129.4 123.2 26.8 -8.8 74.8 89 95 A K E -MO 34 69C 44 -20,-2.3 -21,-2.7 -2,-0.4 -20,-1.1 -0.873 19.2-131.7 -96.2 132.8 26.5 -10.4 78.3 90 96 A L E - 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