==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SERINE PROTEINASE 26-AUG-94 1BIT . COMPND 2 MOLECULE: TRYPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMO SALAR; . AUTHOR G.I.BERGLUND . 222 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9465.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 134 60.4 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 31.1 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 17 7.7 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 . 13 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 4 3 1 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 16 A I 0 0 1 0, 0.0 2,-0.4 0, 0.0 170,-0.2 0.000 360.0 360.0 360.0 122.5 64.0 72.9 -9.8 2 17 A V B +A 170 0A 14 168,-3.4 168,-1.9 1,-0.2 123,-0.1 -0.888 360.0 1.9-104.4 135.2 66.7 75.6 -10.3 3 18 A G S S+ 0 0 45 121,-0.6 -1,-0.2 -2,-0.4 166,-0.1 0.597 103.2 117.1 66.2 18.1 68.7 76.8 -7.3 4 19 A G - 0 0 28 -3,-0.2 2,-0.3 166,-0.2 133,-0.2 -0.070 61.0-108.7 -96.2-158.7 67.0 74.4 -4.8 5 20 A Y E -B 136 0B 108 131,-2.8 131,-4.1 -3,-0.1 2,-0.3 -0.928 35.7 -91.2-131.3 156.5 68.2 71.5 -2.7 6 21 A E E -B 135 0B 93 -2,-0.3 129,-0.3 129,-0.2 128,-0.1 -0.527 52.3-117.7 -69.7 127.0 67.8 67.8 -2.8 7 22 A a - 0 0 2 127,-2.9 2,-0.2 -2,-0.3 3,-0.1 -0.405 29.5 -97.8 -65.9 150.6 64.8 67.0 -0.8 8 23 A K > - 0 0 167 1,-0.1 3,-3.1 2,-0.1 4,-0.4 -0.500 63.4 -87.3 -64.0 127.5 65.2 64.8 2.3 9 24 A A T 3 S- 0 0 54 1,-0.3 -1,-0.1 -2,-0.2 44,-0.1 -0.142 109.1 -1.3 -43.6 128.7 64.2 61.5 0.9 10 25 A Y T > S+ 0 0 58 42,-0.3 3,-0.6 2,-0.1 -1,-0.3 0.501 89.8 125.6 59.9 17.1 60.4 61.1 1.2 11 26 A S T < S+ 0 0 59 -3,-3.1 2,-0.3 1,-0.3 -2,-0.1 0.675 76.3 51.6 -71.1 -16.8 59.9 64.5 2.9 12 27 A Q T > S+ 0 0 29 -4,-0.4 3,-2.1 1,-0.1 -1,-0.3 -0.520 71.2 169.2-113.9 63.4 57.4 65.2 0.2 13 28 A A T < S+ 0 0 21 -3,-0.6 88,-1.1 -2,-0.3 38,-0.3 0.597 71.1 57.4 -53.8 -19.7 55.2 62.1 0.4 14 29 A H T 3 S+ 0 0 17 86,-0.2 15,-2.9 88,-0.1 -1,-0.3 0.507 80.0 112.9 -88.6 -12.8 52.4 63.4 -1.9 15 30 A Q E < -J 28 0C 6 -3,-2.1 37,-0.4 13,-0.2 36,-0.4 -0.538 44.9-177.2 -64.4 130.6 54.7 64.0 -4.8 16 31 A V E -J 27 0C 1 11,-2.0 11,-1.0 -2,-0.2 2,-0.4 -0.900 22.5-134.2-129.1 154.2 54.2 61.7 -7.8 17 32 A S E -JK 26 49C 1 32,-2.1 32,-2.9 -2,-0.3 2,-0.5 -0.890 15.4-143.0-104.1 135.7 55.9 61.3 -11.2 18 33 A L E -JK 25 48C 0 7,-3.0 6,-2.5 -2,-0.4 7,-0.9 -0.915 27.9-170.8-102.1 123.0 53.7 61.1 -14.3 19 34 A N E +JK 23 47C 17 28,-2.0 28,-2.4 -2,-0.5 4,-0.2 -0.984 32.7 162.7-128.1 133.3 55.4 58.6 -16.7 20 37 A S S S- 0 0 42 2,-2.1 3,-0.1 -2,-0.4 -2,-0.0 -0.411 97.9 -40.7-140.3 56.7 54.7 57.6 -20.3 21 38 A G S S+ 0 0 71 26,-0.1 2,-0.3 0, 0.0 -2,-0.1 0.193 141.4 23.2 100.4 -13.0 58.0 55.9 -21.1 22 39 A Y S S- 0 0 132 -4,-0.0 -2,-2.1 0, 0.0 2,-0.2 -0.928 100.4 -81.1-171.8 158.0 59.8 58.6 -19.2 23 40 A H E +J 19 0C 34 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.588 52.3 157.3 -64.0 131.1 59.0 61.2 -16.4 24 41 A F E + 0 0 30 -6,-2.5 2,-0.3 1,-0.5 150,-0.2 0.540 58.5 4.4-131.8 -18.9 57.3 64.2 -18.1 25 42 A b E -J 18 0C 8 -7,-0.9 -7,-3.0 150,-0.1 -1,-0.5 -0.963 62.4-124.4-157.6 166.6 55.3 65.9 -15.3 26 43 A G E +J 17 0C 1 150,-2.7 12,-0.4 -2,-0.3 2,-0.3 -0.410 23.6 179.3-107.6-179.2 54.7 65.9 -11.5 27 44 A G E -J 16 0C 0 -11,-1.0 -11,-2.0 -2,-0.2 2,-0.4 -0.910 23.9-118.6-172.7 172.4 51.4 65.7 -9.6 28 45 A S E -JL 15 36C 1 8,-1.9 8,-2.7 -2,-0.3 2,-0.5 -1.000 19.7-128.6-128.7 129.8 50.2 65.5 -6.0 29 46 A L E + L 0 35C 0 -15,-2.9 74,-2.0 -2,-0.4 6,-0.3 -0.681 27.3 176.4 -76.0 122.7 48.3 62.7 -4.4 30 47 A V - 0 0 17 4,-2.5 2,-0.3 -2,-0.5 5,-0.2 0.636 66.8 -13.9-105.1 -11.5 45.3 64.3 -2.7 31 48 A N S S- 0 0 46 3,-1.3 3,-0.4 71,-0.1 -1,-0.3 -0.906 88.5 -73.5-165.7-179.2 43.7 61.1 -1.5 32 49 A E S S+ 0 0 98 -2,-0.3 62,-2.4 1,-0.2 60,-0.1 0.758 128.6 29.3 -57.8 -31.9 44.0 57.3 -2.0 33 50 A N S S+ 0 0 34 60,-0.2 57,-3.1 1,-0.1 2,-0.4 0.528 110.6 65.7-108.9 -6.7 42.4 57.5 -5.5 34 51 A W E - M 0 89C 0 -3,-0.4 -4,-2.5 55,-0.2 -3,-1.3 -0.948 47.1-168.5-133.6 145.7 43.1 60.9 -7.0 35 52 A V E -LM 29 88C 0 53,-2.1 53,-2.7 -2,-0.4 2,-0.5 -0.959 15.1-144.6-123.9 139.3 46.1 62.9 -8.2 36 53 A V E +LM 28 87C 0 -8,-2.7 -8,-1.9 -2,-0.4 2,-0.2 -0.931 33.8 148.0-107.4 131.2 46.1 66.6 -9.0 37 54 A S E - M 0 86C 0 49,-2.9 49,-2.9 -2,-0.5 2,-0.4 -0.699 49.7 -70.7-141.4-166.6 48.3 67.8 -11.9 38 55 A A > - 0 0 0 -12,-0.4 3,-2.3 47,-0.3 47,-0.3 -0.826 30.4-136.0 -96.5 130.8 48.4 70.5 -14.7 39 56 A A G > S+ 0 0 2 -2,-0.4 3,-1.4 1,-0.3 -1,-0.1 0.704 106.0 66.2 -56.4 -23.3 46.0 70.2 -17.6 40 57 A H G 3 S+ 0 0 73 1,-0.3 -1,-0.3 41,-0.1 136,-0.0 0.573 93.3 60.0 -79.4 -5.4 48.9 71.1 -19.9 41 58 A b G < S+ 0 0 5 -3,-2.3 -1,-0.3 -15,-0.1 -2,-0.2 0.289 82.7 146.8 -96.4 0.7 50.4 67.7 -18.8 42 59 A Y < + 0 0 82 -3,-1.4 2,-0.3 -4,-0.1 -3,-0.1 -0.099 14.3 156.3 -51.3 134.6 47.4 65.9 -20.3 43 60 A K - 0 0 65 3,-0.0 3,-0.1 0, 0.0 -2,-0.1 -0.922 48.4-122.8-152.8 138.8 47.6 62.4 -21.8 44 61 A S S S+ 0 0 93 -2,-0.3 2,-0.3 1,-0.2 26,-0.2 0.752 100.1 23.7 -61.8 -24.3 44.6 60.1 -22.1 45 62 A R + 0 0 210 24,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.970 69.9 159.9-148.2 131.8 46.7 57.5 -20.2 46 63 A V - 0 0 8 -2,-0.3 21,-2.1 -3,-0.1 2,-0.5 -0.953 35.7-121.6-141.6 162.7 49.6 57.8 -17.8 47 64 A E E -KN 19 66C 51 -28,-2.4 -28,-2.0 -2,-0.3 2,-0.5 -0.946 24.8-146.6-108.7 123.3 51.3 55.7 -15.2 48 65 A V E -KN 18 65C 0 17,-3.4 17,-3.0 -2,-0.5 2,-0.6 -0.813 9.1-157.8 -90.9 120.6 51.5 57.4 -11.8 49 66 A R E -KN 17 64C 50 -32,-2.9 -32,-2.1 -2,-0.5 3,-0.3 -0.921 14.1-175.9-106.4 115.0 54.6 56.6 -9.8 50 67 A L E + N 0 63C 2 13,-3.4 13,-2.2 -2,-0.6 -34,-0.1 -0.644 59.1 34.2-104.3 160.6 54.3 57.1 -6.0 51 69 A G S S+ 0 0 3 -36,-0.4 10,-0.2 48,-0.4 2,-0.2 0.699 82.9 154.2 66.1 30.6 56.9 56.7 -3.3 52 70 A E + 0 0 12 -37,-0.4 -42,-0.3 -3,-0.3 -1,-0.2 -0.593 23.6 151.5 -93.6 149.4 59.8 58.0 -5.5 53 71 A H S S+ 0 0 12 1,-0.3 81,-1.9 4,-0.3 2,-0.7 0.441 84.4 25.7-128.6 -63.6 63.1 59.7 -4.6 54 72 A N B > S-P 133 0D 25 3,-0.3 3,-1.5 79,-0.2 -1,-0.3 -0.954 71.9-161.0-105.6 104.4 65.5 58.7 -7.4 55 73 A I T 3 S+ 0 0 25 77,-2.0 -1,-0.1 -2,-0.7 78,-0.1 0.533 87.7 54.6 -64.7 -12.3 63.3 58.0 -10.4 56 74 A K T 3 S+ 0 0 154 76,-0.3 2,-0.4 1,-0.1 -1,-0.3 0.320 103.8 59.9-101.5 2.9 66.1 56.0 -12.1 57 75 A V S < S- 0 0 77 -3,-1.5 2,-0.4 75,-0.2 -3,-0.3 -0.999 79.8-125.8-137.5 129.6 66.7 53.6 -9.3 58 76 A T + 0 0 124 -2,-0.4 -3,-0.1 1,-0.1 -6,-0.0 -0.654 31.6 171.0 -79.4 129.7 64.4 51.1 -7.6 59 77 A E - 0 0 65 -2,-0.4 -1,-0.1 -5,-0.0 -7,-0.0 0.513 49.4-111.9-113.3 -21.2 64.4 51.7 -3.9 60 78 A G S S+ 0 0 69 -9,-0.0 -2,-0.1 0, 0.0 -9,-0.0 0.297 99.6 89.1 99.5 -4.2 61.6 49.5 -2.7 61 79 A S + 0 0 7 -10,-0.2 38,-0.1 38,-0.1 -9,-0.1 0.575 64.4 108.8 -98.0 -12.6 59.3 52.4 -1.8 62 80 A E - 0 0 36 -13,-0.0 2,-0.4 2,-0.0 -11,-0.2 -0.229 43.6-169.7 -80.0 152.7 57.6 52.8 -5.1 63 81 A Q E -N 50 0C 27 -13,-2.2 -13,-3.4 -2,-0.1 2,-0.5 -0.986 9.1-159.7-130.8 123.2 54.1 52.1 -6.3 64 82 A F E +N 49 0C 86 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.957 17.8 173.3-108.5 119.1 53.3 52.3 -10.1 65 83 A I E -N 48 0C 4 -17,-3.0 -17,-3.4 -2,-0.5 2,-0.1 -0.996 24.1-136.4-131.0 128.5 49.6 52.7 -10.8 66 84 A S E -N 47 0C 64 -2,-0.4 25,-2.8 -19,-0.3 26,-0.4 -0.447 30.4-106.3 -79.2 157.0 48.0 53.4 -14.2 67 85 A S E -O 90 0C 17 -21,-2.1 23,-0.2 23,-0.2 3,-0.1 -0.589 18.3-164.1 -81.2 144.1 45.3 55.9 -14.5 68 86 A S E S+ 0 0 62 21,-3.2 2,-0.3 1,-0.4 22,-0.2 0.636 81.8 2.4 -96.5 -22.0 41.6 54.9 -15.0 69 87 A R E -O 89 0C 92 20,-1.2 20,-3.0 2,-0.0 2,-0.5 -0.933 56.1-155.4-165.1 144.0 40.8 58.5 -16.2 70 88 A V E -O 88 0C 17 -2,-0.3 2,-0.5 18,-0.2 18,-0.2 -0.994 18.5-170.7-124.7 111.2 42.5 61.8 -16.8 71 89 A I E -O 87 0C 41 16,-3.4 16,-3.0 -2,-0.5 2,-0.2 -0.938 5.5-159.9-114.3 108.4 40.2 64.9 -16.5 72 90 A R E -O 86 0C 108 -2,-0.5 14,-0.2 14,-0.2 12,-0.1 -0.477 42.1 -86.1 -77.6 151.6 41.3 68.4 -17.6 73 91 A H > - 0 0 17 12,-1.9 3,-2.0 10,-0.3 -1,-0.1 -0.375 37.1-126.8 -58.5 131.5 39.5 71.4 -16.3 74 92 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.763 108.4 46.0 -54.5 -27.7 36.6 72.0 -18.6 75 93 A N T 3 S+ 0 0 108 8,-0.1 7,-0.1 2,-0.0 -2,-0.1 0.120 77.4 138.6-103.0 17.0 37.7 75.7 -19.0 76 94 A Y < - 0 0 57 -3,-2.0 2,-0.4 9,-0.1 7,-0.2 -0.407 30.8-171.6 -57.4 136.8 41.4 75.0 -19.7 77 95 A S B > -Q 82 0E 34 5,-1.8 5,-1.7 1,-0.1 4,-0.5 -0.979 12.4-161.6-139.7 123.3 42.7 77.3 -22.5 78 96 A S T 5S+ 0 0 84 -2,-0.4 -1,-0.1 3,-0.2 -2,-0.0 0.761 81.2 69.1 -76.1 -32.8 46.2 76.7 -23.9 79 97 A Y T 5S+ 0 0 197 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.872 123.8 16.8 -58.0 -35.1 46.9 80.0 -25.6 80 98 A N T 5S- 0 0 43 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.313 101.7-126.0-117.5 6.7 47.0 81.7 -22.2 81 99 A I T > 5 + 0 0 46 -4,-0.5 3,-0.5 1,-0.2 2,-0.3 0.858 50.3 164.7 48.9 46.1 47.4 78.5 -20.0 82 100 A D B 3 < +Q 77 0E 25 -5,-1.7 -5,-1.8 1,-0.2 -1,-0.2 -0.731 57.3 17.2 -91.4 142.9 44.4 79.4 -17.9 83 101 A N T 3 S+ 0 0 21 -2,-0.3 2,-2.0 -7,-0.2 -10,-0.3 0.881 77.6 179.1 64.0 39.9 42.7 76.9 -15.5 84 102 A D < + 0 0 2 -3,-0.5 2,-0.3 74,-0.2 122,-0.2 -0.519 33.3 115.0 -76.5 66.1 45.8 74.7 -15.8 85 103 A I - 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