==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-NOV-02 1J14 . COMPND 2 MOLECULE: TRYPSIN II, ANIONIC; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR M.T.STUBBS . 223 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9559.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 142 63.7 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 . 73 32.7 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 . 19 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 7.2 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 . 5 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 16 A I 0 0 1 0, 0.0 2,-0.4 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 119.3 0.2 49.8 50.6 2 17 A V B +A 171 0A 9 169,-3.2 169,-1.9 1,-0.2 123,-0.1 -0.844 360.0 2.0 -97.1 133.4 -1.1 53.0 52.0 3 18 A G S S+ 0 0 41 121,-0.6 -1,-0.2 -2,-0.4 2,-0.1 0.724 101.8 122.1 66.5 20.9 -2.8 55.4 49.6 4 19 A G - 0 0 26 -3,-0.4 2,-0.3 167,-0.1 134,-0.2 -0.140 57.9-112.4 -95.7-160.5 -2.4 53.1 46.6 5 20 A Y E -B 137 0B 108 132,-2.6 132,-3.4 -3,-0.1 2,-0.4 -0.917 33.5 -91.0-134.3 158.1 -5.1 51.7 44.3 6 21 A T E -B 136 0B 65 -2,-0.3 130,-0.2 130,-0.2 2,-0.1 -0.583 46.6-126.0 -72.6 123.5 -6.4 48.1 43.7 7 22 A a - 0 0 2 128,-2.2 3,-0.1 -2,-0.4 128,-0.1 -0.402 28.8 -98.3 -69.4 147.6 -4.4 46.5 40.9 8 23 A Q > - 0 0 154 1,-0.2 3,-2.4 -2,-0.1 4,-0.3 -0.363 62.2 -76.6 -62.3 142.2 -6.3 45.1 37.9 9 24 A E T 3 S- 0 0 91 1,-0.3 -1,-0.2 2,-0.1 44,-0.1 -0.155 112.4 -9.2 -48.2 123.0 -6.6 41.3 38.4 10 25 A N T 3 S+ 0 0 21 42,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.705 91.1 131.5 58.7 26.4 -3.3 39.6 37.6 11 26 A S S < S+ 0 0 66 -3,-2.4 -2,-0.1 1,-0.3 -1,-0.1 0.588 74.0 48.2 -81.1 -9.2 -1.7 42.8 36.2 12 27 A V S > S+ 0 0 5 -4,-0.3 3,-1.7 87,-0.1 -1,-0.3 -0.642 71.5 169.5-128.7 71.0 1.4 42.2 38.4 13 28 A P T 3 S+ 0 0 28 0, 0.0 88,-1.4 0, 0.0 38,-0.3 0.495 70.2 61.1 -64.9 -7.8 2.0 38.4 37.5 14 29 A Y T 3 S+ 0 0 24 86,-0.2 15,-2.3 88,-0.1 2,-0.4 0.456 78.8 107.0 -98.6 -4.3 5.4 38.3 39.2 15 30 A Q E < -J 28 0C 4 -3,-1.7 37,-0.4 13,-0.2 36,-0.4 -0.628 49.6-174.5 -77.9 129.6 4.0 39.2 42.6 16 31 A V E -J 27 0C 1 11,-2.5 11,-1.3 -2,-0.4 2,-0.5 -0.848 19.2-135.4-122.9 159.3 4.0 36.3 45.1 17 32 A S E -JK 26 49C 0 32,-2.0 32,-2.6 -2,-0.3 2,-0.7 -0.966 12.7-142.5-115.8 126.2 2.6 35.9 48.6 18 33 A L E -JK 25 48C 0 7,-2.9 6,-2.4 -2,-0.5 7,-1.1 -0.831 24.5-166.4 -90.5 119.4 4.7 34.2 51.2 19 34 A N E +JK 23 47C 15 28,-2.9 28,-2.5 -2,-0.7 4,-0.2 -0.918 28.9 169.6-113.3 132.2 2.3 32.2 53.4 20 37 A S S S- 0 0 43 2,-2.5 3,-0.1 -2,-0.4 -1,-0.1 -0.349 95.2 -52.9-129.6 45.5 3.1 30.6 56.8 21 38 A G S S+ 0 0 69 26,-0.1 2,-0.3 1,-0.1 -2,-0.1 0.066 140.0 34.5 100.7 -20.1 -0.5 29.8 57.5 22 39 A Y S S- 0 0 142 -4,-0.1 -2,-2.5 0, 0.0 2,-0.4 -0.949 104.2 -84.4-155.1 159.1 -1.3 33.4 56.8 23 40 A H E +J 19 0C 19 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.610 54.0 155.3 -71.1 126.6 0.2 36.1 54.4 24 41 A F E + 0 0 32 -6,-2.4 2,-0.3 1,-0.4 151,-0.3 0.595 58.8 3.6-126.9 -19.5 3.3 37.6 56.1 25 42 A b E -J 18 0C 7 -7,-1.1 -7,-2.9 151,-0.1 -1,-0.4 -0.950 61.1-129.3-158.6 170.2 5.5 38.9 53.3 26 43 A G E +J 17 0C 1 151,-3.0 12,-0.4 -2,-0.3 2,-0.3 -0.575 22.2 176.0-118.9-178.4 5.6 39.4 49.5 27 44 A G E -J 16 0C 0 -11,-1.3 -11,-2.5 -2,-0.2 2,-0.4 -0.980 26.5-108.4-173.5 174.3 8.1 38.6 46.8 28 45 A S E -JL 15 36C 0 8,-2.3 8,-2.6 -2,-0.3 2,-0.6 -0.973 22.7-131.9-124.2 133.0 9.0 38.6 43.1 29 46 A L E + L 0 35C 0 -15,-2.3 74,-2.0 -2,-0.4 6,-0.2 -0.723 26.1 175.0 -81.6 120.6 9.2 35.5 40.8 30 47 A I E - 0 0 19 4,-2.5 2,-0.3 -2,-0.6 5,-0.2 0.458 67.0 -6.1-106.5 -4.0 12.5 35.8 38.8 31 48 A N E > S- L 0 34C 40 3,-1.1 3,-1.5 70,-0.1 -1,-0.4 -0.912 91.2 -76.5-176.9 162.3 12.3 32.5 37.0 32 49 A D T 3 S+ 0 0 72 -2,-0.3 62,-2.3 1,-0.3 60,-0.1 0.552 128.7 23.0 -49.7 -10.6 10.2 29.3 37.0 33 50 A Q T 3 S+ 0 0 49 60,-0.2 57,-2.8 1,-0.1 2,-0.4 0.392 110.8 73.1-138.1 5.4 11.8 28.1 40.3 34 51 A W E < -LM 31 89C 10 -3,-1.5 -4,-2.5 55,-0.2 -3,-1.1 -0.979 46.6-176.0-132.3 138.4 13.2 31.1 42.1 35 52 A V E -LM 29 88C 0 53,-2.4 53,-2.9 -2,-0.4 2,-0.4 -0.944 15.6-145.4-126.4 140.3 11.7 34.0 44.0 36 53 A V E +LM 28 87C 0 -8,-2.6 -8,-2.3 -2,-0.4 51,-0.2 -0.921 32.4 147.5-109.7 136.8 13.5 36.9 45.6 37 54 A S E - M 0 86C 0 49,-2.8 49,-2.4 -2,-0.4 2,-0.4 -0.691 48.7 -62.7-144.6-162.3 12.3 38.5 48.8 38 55 A A > - 0 0 0 -12,-0.4 3,-2.3 47,-0.3 47,-0.2 -0.794 31.6-134.3 -99.5 139.1 13.6 40.2 52.0 39 56 A A G > S+ 0 0 2 -2,-0.4 3,-1.9 1,-0.3 -1,-0.1 0.861 106.2 65.1 -57.9 -32.9 15.9 38.5 54.4 40 57 A H G 3 S+ 0 0 57 1,-0.3 -1,-0.3 41,-0.1 137,-0.0 0.536 91.6 65.0 -70.8 0.2 13.8 39.8 57.2 41 58 A b G < S+ 0 0 4 -3,-2.3 -1,-0.3 -15,-0.1 -2,-0.2 0.220 75.7 138.7-102.0 9.6 10.9 37.6 55.9 42 59 A Y < + 0 0 101 -3,-1.9 2,-0.3 2,-0.0 -3,-0.0 -0.337 18.9 160.6 -62.2 135.6 12.8 34.4 56.7 43 60 A K - 0 0 55 -2,-0.1 3,-0.1 1,-0.0 -2,-0.0 -0.965 46.4-120.7-151.7 142.1 11.0 31.5 58.2 44 61 A S S S+ 0 0 96 -2,-0.3 2,-0.4 1,-0.2 26,-0.1 0.740 102.8 33.6 -57.9 -28.2 12.0 27.8 58.2 45 62 A R S S+ 0 0 212 2,-0.0 2,-0.4 21,-0.0 -1,-0.2 -0.975 72.0 169.3-136.1 119.9 8.9 26.7 56.3 46 63 A I - 0 0 7 -2,-0.4 21,-2.8 21,-0.2 2,-0.5 -0.980 23.2-153.4-132.3 140.9 7.2 28.9 53.7 47 64 A Q E -KN 19 66C 47 -28,-2.5 -28,-2.9 -2,-0.4 2,-0.5 -0.979 19.9-147.0-112.7 119.5 4.5 28.2 51.1 48 66 A V E -KN 18 65C 0 17,-3.4 17,-3.1 -2,-0.5 2,-0.6 -0.776 9.2-156.6 -89.5 128.7 4.8 30.5 48.1 49 67 A R E -KN 17 64C 52 -32,-2.6 -32,-2.0 -2,-0.5 3,-0.3 -0.932 12.2-175.9-113.7 118.6 1.5 31.5 46.5 50 68 A L E + N 0 63C 3 13,-2.8 13,-1.8 -2,-0.6 -34,-0.1 -0.689 60.3 34.0-108.3 161.3 1.4 32.6 42.8 51 69 A G S S+ 0 0 2 48,-0.4 10,-0.3 -36,-0.4 2,-0.2 0.739 83.1 155.7 68.8 24.8 -1.4 33.9 40.6 52 70 A E + 0 0 10 -37,-0.4 -42,-0.3 -3,-0.3 -1,-0.2 -0.506 21.9 145.5 -87.9 149.7 -3.0 35.7 43.5 53 71 A H S S+ 0 0 17 1,-0.4 82,-1.1 4,-0.2 2,-0.8 0.258 80.1 38.3-137.2 -71.1 -5.3 38.7 43.5 54 72 A N B > S-P 134 0D 26 3,-0.2 3,-0.9 80,-0.2 -1,-0.4 -0.816 74.0-160.1 -88.0 111.7 -7.8 38.2 46.3 55 73 A I T 3 S+ 0 0 19 78,-3.1 -1,-0.2 -2,-0.8 79,-0.1 0.752 87.4 43.9 -66.3 -22.5 -5.6 36.6 49.0 56 74 A N T 3 S+ 0 0 116 77,-0.2 2,-0.4 -3,-0.1 -1,-0.2 0.338 105.9 65.3-106.0 6.4 -8.6 35.2 50.9 57 75 A V S < S- 0 0 78 -3,-0.9 2,-0.5 76,-0.2 -4,-0.2 -0.992 76.2-125.4-133.7 135.7 -10.6 33.7 48.0 58 76 A L + 0 0 138 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.0 -0.644 33.7 167.4 -78.7 123.8 -9.9 30.9 45.5 59 77 A E - 0 0 61 -2,-0.5 -1,-0.2 -5,-0.1 -7,-0.0 0.544 53.2-103.5-114.0 -14.5 -10.3 32.4 42.0 60 78 A G S S+ 0 0 69 -9,-0.0 -2,-0.1 0, 0.0 -9,-0.0 0.268 102.3 81.4 109.3 -8.8 -8.8 29.6 39.8 61 79 A N + 0 0 37 -10,-0.3 -9,-0.1 38,-0.0 2,-0.1 0.420 63.5 120.6-108.4 2.4 -5.4 31.0 38.9 62 80 A E - 0 0 35 -13,-0.0 2,-0.4 -11,-0.0 -11,-0.2 -0.310 38.2-172.2 -74.3 150.6 -3.5 30.1 42.0 63 81 A Q E -N 50 0C 38 -13,-1.8 -13,-2.8 -2,-0.1 2,-0.6 -0.962 8.9-161.9-140.5 108.1 -0.4 27.9 42.2 64 82 A F E +N 49 0C 81 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.898 16.8 172.2 -97.3 118.9 0.7 27.1 45.8 65 83 A V E -N 48 0C 15 -17,-3.1 -17,-3.4 -2,-0.6 2,-0.2 -0.989 26.5-127.8-130.1 137.2 4.3 25.8 45.9 66 84 A N E -N 47 0C 88 -2,-0.4 25,-2.9 -19,-0.3 2,-0.3 -0.507 27.0-111.2 -83.6 148.2 6.4 25.1 49.0 67 85 A A E -O 90 0C 21 -21,-2.8 23,-0.2 23,-0.2 -21,-0.2 -0.620 30.1-179.7 -77.6 133.6 9.9 26.6 49.4 68 86 A A E S+ 0 0 63 21,-3.4 2,-0.5 1,-0.3 22,-0.2 0.814 74.1 25.6 -98.0 -48.8 12.7 24.0 49.2 69 87 A K E -O 89 0C 82 20,-1.6 20,-2.9 2,-0.0 2,-0.7 -0.972 63.0-170.7-123.7 119.1 15.7 26.3 49.8 70 88 A I E -O 88 0C 35 -2,-0.5 2,-0.6 18,-0.2 18,-0.2 -0.943 13.4-176.4-110.3 110.0 15.4 29.6 51.7 71 89 A I E -O 87 0C 37 16,-3.2 16,-2.9 -2,-0.7 2,-0.2 -0.914 8.5-163.8-116.0 109.1 18.7 31.5 51.4 72 90 A K E -O 86 0C 91 -2,-0.6 14,-0.2 14,-0.2 12,-0.1 -0.549 42.4 -89.1 -83.7 153.6 19.3 34.8 53.2 73 91 A H > - 0 0 19 12,-2.2 3,-2.4 10,-0.3 -1,-0.1 -0.477 36.8-129.5 -63.1 127.3 22.1 37.0 52.1 74 92 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.728 106.2 47.5 -50.0 -28.1 25.1 35.9 54.1 75 93 A N T 3 S+ 0 0 111 8,-0.1 2,-0.3 2,-0.1 -2,-0.1 0.037 76.6 141.4-105.4 26.0 25.8 39.4 55.2 76 94 A F < - 0 0 45 -3,-2.4 2,-0.7 9,-0.1 7,-0.2 -0.538 37.7-156.7 -69.8 129.0 22.3 40.4 56.2 77 95 A D B >>> -Q 82 0E 67 5,-2.0 4,-2.7 -2,-0.3 3,-0.7 -0.910 4.2-160.4-110.7 105.6 22.5 42.5 59.3 78 96 A R T 345S+ 0 0 182 -2,-0.7 -1,-0.1 1,-0.2 -2,-0.0 0.601 87.8 53.7 -61.5 -14.5 19.2 42.3 61.2 79 97 A E T 345S+ 0 0 173 1,-0.1 -1,-0.2 3,-0.1 -3,-0.0 0.801 122.4 24.3 -90.3 -32.1 19.8 45.5 63.1 80 98 A T T <45S- 0 0 64 -3,-0.7 -2,-0.2 2,-0.1 77,-0.1 0.577 95.6-130.4-105.5 -16.2 20.5 47.8 60.2 81 99 A Y T ><5 + 0 0 70 -4,-2.7 3,-1.0 1,-0.3 2,-0.2 0.699 51.2 158.3 68.7 22.3 18.6 45.9 57.5 82 100 A N B 3 < +Q 77 0E 33 -5,-0.7 -5,-2.0 1,-0.3 -1,-0.3 -0.547 65.9 15.6 -75.1 140.1 21.6 46.1 55.3 83 101 A N T 3 S+ 0 0 20 1,-0.2 2,-2.3 -2,-0.2 -10,-0.3 0.849 80.3 173.1 61.4 36.2 21.7 43.4 52.6 84 102 A D < + 0 0 0 -3,-1.0 2,-0.3 75,-0.1 -1,-0.2 -0.506 31.9 117.9 -76.4 75.4 18.0 42.7 53.3 85 103 A I + 0 0 0 -2,-2.3 -12,-2.2 -47,-0.2 2,-0.3 -0.991 36.9 179.7-144.5 143.9 17.7 40.3 50.4 86 104 A M E -MO 37 72C 0 -49,-2.4 -49,-2.8 -2,-0.3 2,-0.4 -0.972 15.7-144.2-144.1 151.7 16.8 36.6 50.4 87 105 A L E -MO 36 71C 0 -16,-2.9 -16,-3.2 -2,-0.3 2,-0.4 -0.953 9.5-161.1-121.4 140.5 16.3 34.0 47.6 88 106 A I E -MO 35 70C 0 -53,-2.9 -53,-2.4 -2,-0.4 2,-0.6 -0.986 4.8-157.0-125.4 121.5 13.7 31.1 47.7 89 107 A K E -MO 34 69C 46 -20,-2.9 -21,-3.4 -2,-0.4 -20,-1.6 -0.882 22.9-133.4 -96.5 123.6 14.0 28.0 45.5 90 108 A L E - 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