==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-SEP-06 2ID8 . COMPND 2 MOLECULE: PROTEINASE K; . SOURCE 2 ORGANISM_SCIENTIFIC: ENGYODONTIUM ALBUM; . AUTHOR J.WANG,M.DAUTER,Z.DAUTER . 279 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10546.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 3 1.1 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-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 59 21.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 0 1 0 1 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 1 1 3 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 PARALLEL BRIDGES PER LADDER . 1 3 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 0 0 0 0 0 1 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 1 A A 0 0 48 0, 0.0 24,-2.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 157.8 55.9 58.5 10.2 2 2 A A E -A 24 0A 59 22,-0.2 2,-0.6 25,-0.0 22,-0.2 -0.999 360.0-158.8-143.5 135.4 58.0 60.0 12.9 3 3 A Q E > -A 23 0A 28 20,-2.5 20,-2.7 -2,-0.4 3,-0.6 -0.961 21.1-147.0-112.4 109.6 57.1 61.5 16.2 4 4 A T T 3 S+ 0 0 93 -2,-0.6 18,-0.2 18,-0.2 -2,-0.0 -0.445 77.1 15.4 -75.6 152.2 59.9 63.8 17.5 5 5 A N T 3 S+ 0 0 133 -2,-0.1 -1,-0.2 1,-0.1 17,-0.2 0.895 89.8 172.3 50.5 46.2 60.6 64.1 21.2 6 6 A A < - 0 0 12 15,-2.5 -1,-0.1 -3,-0.6 76,-0.1 -0.368 45.2 -80.2 -76.8 161.3 58.6 61.0 21.9 7 7 A P >> - 0 0 20 0, 0.0 4,-1.9 0, 0.0 3,-0.9 -0.345 50.9-111.7 -53.6 144.1 58.4 59.3 25.3 8 8 A W H 3> S+ 0 0 27 1,-0.3 4,-2.5 199,-0.2 12,-0.1 0.800 114.3 57.4 -54.2 -36.9 61.5 57.2 25.6 9 9 A G H 3> S+ 0 0 1 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.862 105.3 49.3 -67.2 -36.4 59.7 53.9 25.4 10 10 A L H <> S+ 0 0 0 -3,-0.9 4,-0.7 2,-0.2 14,-0.2 0.924 112.9 47.7 -63.8 -46.9 58.1 54.7 22.1 11 11 A A H >< S+ 0 0 0 -4,-1.9 3,-1.1 1,-0.2 -2,-0.2 0.926 110.0 55.5 -58.6 -39.8 61.5 55.7 20.7 12 12 A R H >< S+ 0 0 4 -4,-2.5 3,-1.6 1,-0.3 -1,-0.2 0.889 101.0 55.0 -63.0 -42.2 63.0 52.5 22.1 13 13 A I H 3< S+ 0 0 1 -4,-1.8 262,-3.2 1,-0.3 263,-0.3 0.662 110.6 47.4 -74.2 -6.4 60.6 50.2 20.4 14 14 A S T << S+ 0 0 14 -3,-1.1 2,-0.3 -4,-0.7 -1,-0.3 0.089 106.1 68.5-115.1 26.1 61.6 51.7 17.1 15 15 A S < - 0 0 16 -3,-1.6 242,-0.1 1,-0.1 261,-0.1 -0.977 65.6-144.5-137.0 148.6 65.4 51.6 17.5 16 16 A T S S+ 0 0 84 -2,-0.3 -1,-0.1 2,-0.1 -4,-0.1 0.527 92.4 52.7 -82.2 -5.6 68.1 48.9 17.8 17 17 A S S > S- 0 0 52 -5,-0.0 3,-0.5 240,-0.0 -3,-0.1 -0.948 83.4-118.7-131.4 151.3 69.8 51.2 20.4 18 18 A P T 3 S+ 0 0 59 0, 0.0 168,-0.1 0, 0.0 167,-0.1 -0.346 85.6 50.8 -76.5 164.3 68.8 53.0 23.6 19 19 A G T 3 S+ 0 0 78 166,-0.4 2,-0.1 1,-0.3 167,-0.1 0.472 72.3 127.0 92.2 3.1 69.0 56.8 23.9 20 20 A T < - 0 0 57 -3,-0.5 -1,-0.3 -12,-0.1 -8,-0.1 -0.454 43.0-157.3 -89.8 170.0 67.1 58.0 20.9 21 21 A S + 0 0 62 -2,-0.1 -15,-2.5 -10,-0.1 2,-0.4 0.521 61.0 84.7-126.8 -12.5 64.2 60.4 20.9 22 22 A T - 0 0 26 -17,-0.2 2,-0.7 -18,-0.2 -18,-0.2 -0.862 61.7-145.2-102.9 132.0 62.1 59.9 17.7 23 23 A Y E -A 3 0A 0 -20,-2.7 -20,-2.5 -2,-0.4 2,-0.4 -0.875 17.1-164.3 -93.0 114.9 59.4 57.2 17.4 24 24 A Y E +A 2 0A 120 -2,-0.7 2,-0.3 -22,-0.2 -22,-0.2 -0.855 22.5 151.3 -96.9 127.5 59.4 55.9 13.8 25 25 A Y - 0 0 35 -24,-2.2 2,-0.2 -2,-0.4 -11,-0.0 -0.995 50.5 -93.1-157.7 152.9 56.3 53.9 12.8 26 26 A D > - 0 0 44 -2,-0.3 3,-2.0 1,-0.1 4,-0.1 -0.521 38.6-124.9 -68.7 137.1 54.2 53.1 9.7 27 27 A E T 3 S+ 0 0 132 1,-0.3 -1,-0.1 -2,-0.2 4,-0.1 0.680 102.0 81.1 -63.5 -16.7 51.4 55.6 9.4 28 28 A S T > S- 0 0 25 1,-0.1 3,-2.5 2,-0.1 -1,-0.3 0.874 74.9-174.6 -56.4 -32.9 48.7 52.9 9.4 29 29 A A T < - 0 0 1 -3,-2.0 58,-3.0 1,-0.3 59,-0.4 0.734 64.7 -52.3 55.6 33.2 49.3 53.0 13.1 30 30 A G T > S+ 0 0 0 206,-0.3 3,-2.1 1,-0.2 59,-0.3 0.638 84.7 166.5 79.1 7.5 47.0 50.1 14.1 31 31 A Q T < + 0 0 117 -3,-2.5 -1,-0.2 1,-0.3 57,-0.2 -0.331 66.4 25.6 -55.8 136.3 44.0 51.4 12.2 32 32 A G T 3 S+ 0 0 27 55,-0.5 93,-2.8 1,-0.4 94,-0.5 0.321 102.5 101.8 92.9 -13.5 41.4 48.6 11.9 33 33 A S E < -b 126 0B 1 -3,-2.1 56,-1.7 92,-0.2 -1,-0.4 -0.587 58.3-146.3 -94.4 165.3 42.6 46.7 15.1 34 34 A a E -bc 127 89B 3 92,-2.0 94,-2.4 -2,-0.2 2,-0.5 -1.000 6.7-163.7-134.3 140.8 41.0 46.8 18.5 35 35 A V E -bc 128 90B 0 54,-2.8 56,-2.4 -2,-0.4 2,-0.5 -0.983 8.9-151.6-127.9 121.2 42.6 46.6 21.9 36 36 A Y E -bc 129 91B 0 92,-2.8 94,-2.9 -2,-0.5 2,-0.7 -0.788 8.4-155.4 -86.7 122.6 40.7 45.8 25.0 37 37 A V E -bc 130 92B 1 54,-2.9 56,-2.3 -2,-0.5 2,-0.8 -0.941 5.9-163.3-103.1 105.9 42.3 47.4 28.1 38 38 A I E + c 0 93B 0 92,-2.2 94,-0.5 -2,-0.7 56,-0.2 -0.850 51.1 85.5 -98.5 104.1 41.2 45.2 31.1 39 39 A D E S- c 0 94B 0 54,-2.3 57,-2.1 -2,-0.8 56,-1.6 -0.608 96.5 -33.3-169.1-148.1 41.9 47.5 34.0 40 40 A T S S- 0 0 0 1,-0.4 26,-0.4 54,-0.2 27,-0.2 0.349 98.1 -92.5 -83.6 5.1 40.5 50.3 36.1 41 41 A G - 0 0 0 52,-0.4 -1,-0.4 -4,-0.2 2,-0.4 -0.605 38.6 -91.6 108.9-178.6 38.6 51.8 33.1 42 42 A I - 0 0 4 21,-0.5 2,-1.7 -2,-0.2 3,-0.1 -0.982 17.7-133.1-136.3 128.2 39.5 54.4 30.5 43 43 A E > - 0 0 39 -2,-0.4 3,-2.1 1,-0.2 6,-0.2 -0.621 31.0-177.0 -74.5 83.7 38.7 58.1 30.7 44 44 A A T 3 S+ 0 0 34 -2,-1.7 7,-0.4 1,-0.3 9,-0.4 0.754 72.4 66.7 -60.7 -27.2 37.4 58.0 27.1 45 45 A S T 3 S+ 0 0 102 -3,-0.1 -1,-0.3 5,-0.1 5,-0.1 0.518 70.2 121.4 -71.2 -9.7 36.8 61.8 27.1 46 46 A H X> - 0 0 9 -3,-2.1 3,-2.4 1,-0.2 4,-0.5 -0.400 69.0-133.2 -57.6 129.4 40.6 62.5 27.3 47 47 A P G >4 S+ 0 0 102 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 0.806 102.0 69.5 -53.7 -33.1 41.5 64.5 24.2 48 48 A E G 34 S+ 0 0 23 1,-0.3 32,-2.5 2,-0.1 34,-0.1 0.702 93.4 57.5 -57.2 -23.2 44.5 62.2 23.6 49 49 A F G X4 S- 0 0 0 -3,-2.4 3,-2.8 30,-0.2 -1,-0.3 0.622 90.1-152.6 -89.8 -15.4 42.1 59.4 22.6 50 50 A E T << - 0 0 108 -3,-1.3 -2,-0.1 -4,-0.5 -5,-0.1 0.775 67.5 -55.4 60.0 29.1 40.5 61.4 19.9 51 51 A G T 3 S+ 0 0 72 -7,-0.4 -1,-0.3 -5,-0.4 -6,-0.1 0.450 116.7 110.3 83.4 -3.4 37.1 59.6 20.1 52 52 A R < + 0 0 35 -3,-2.8 38,-2.8 26,-0.1 2,-0.4 0.415 61.2 76.0 -88.1 1.3 38.8 56.2 19.6 53 53 A A E +d 90 0B 9 -9,-0.4 2,-0.3 36,-0.2 38,-0.2 -0.884 52.7 165.9-111.3 142.7 38.2 55.0 23.2 54 54 A Q E -d 91 0B 82 36,-2.0 38,-2.6 -2,-0.4 2,-0.3 -0.983 34.8-120.8-149.7 148.9 35.0 53.7 24.7 55 55 A M E +d 92 0B 41 -2,-0.3 38,-0.2 36,-0.2 3,-0.1 -0.640 29.7 171.2 -79.1 134.2 34.0 51.9 27.8 56 56 A V E + 0 0 29 36,-2.7 2,-0.3 1,-0.4 37,-0.2 0.518 61.6 14.0-121.0 -15.3 32.2 48.6 27.0 57 57 A K E -d 93 0B 78 35,-1.4 37,-2.7 6,-0.1 -1,-0.4 -0.941 53.0-174.3-160.1 141.2 31.9 46.9 30.4 58 58 A T E -d 94 0B 39 -2,-0.3 37,-0.2 35,-0.2 5,-0.1 -0.995 15.9-165.0-134.0 145.8 32.2 47.6 34.1 59 59 A Y S S+ 0 0 68 35,-2.3 2,-0.2 -2,-0.4 36,-0.1 0.154 76.3 66.1-105.9 13.1 32.0 45.4 37.2 60 60 A Y S S- 0 0 63 2,-0.3 -2,-0.1 34,-0.2 34,-0.1 -0.669 104.2 -84.0-125.0-176.6 31.6 48.3 39.6 61 61 A Y S S+ 0 0 238 -2,-0.2 2,-0.3 2,-0.1 -3,-0.0 0.809 110.7 22.9 -63.6 -33.8 29.1 51.0 40.3 62 62 A S - 0 0 61 2,-0.2 -2,-0.3 1,-0.0 -3,-0.1 -0.909 65.1-134.8-127.3 158.4 30.4 53.2 37.5 63 63 A S S S+ 0 0 56 -2,-0.3 -21,-0.5 -5,-0.1 -6,-0.1 0.459 70.8 117.9 -86.3 -5.6 32.3 52.8 34.3 64 64 A R S S- 0 0 153 -23,-0.1 2,-1.1 1,-0.1 -2,-0.2 -0.344 71.3-124.9 -62.4 130.3 34.5 55.9 35.3 65 65 A D + 0 0 2 1,-0.1 -24,-0.1 -23,-0.1 -1,-0.1 -0.790 34.7 173.4 -75.3 96.8 38.2 55.3 35.8 66 66 A G S S+ 0 0 20 -2,-1.1 -1,-0.1 -26,-0.4 -25,-0.1 0.334 72.7 46.8 -88.3 6.9 38.5 56.8 39.3 67 67 A N S S- 0 0 42 -27,-0.2 146,-0.1 30,-0.1 -1,-0.1 0.805 89.7-133.9-111.8 -54.3 42.1 55.7 39.6 68 68 A G S > S+ 0 0 0 144,-0.1 4,-2.5 -28,-0.1 5,-0.2 -0.069 77.4 101.5 116.6 -28.7 44.1 56.6 36.5 69 69 A H H > S+ 0 0 36 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.901 84.0 45.0 -58.5 -46.2 45.9 53.3 36.0 70 70 A G H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.891 112.7 51.4 -68.3 -39.2 43.7 52.0 33.2 71 71 A T H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 140,-0.4 0.879 110.2 50.8 -65.8 -39.0 43.8 55.4 31.4 72 72 A H H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 139,-0.3 0.958 112.5 44.7 -62.9 -50.0 47.6 55.4 31.6 73 73 A C H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.932 112.5 51.9 -61.7 -42.6 47.8 51.9 30.1 74 74 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.4 0.895 106.8 55.2 -60.3 -35.9 45.3 52.7 27.4 75 75 A G H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.874 105.3 50.5 -66.6 -35.5 47.3 55.7 26.5 76 76 A T H < S+ 0 0 0 -4,-1.8 8,-2.4 -3,-0.2 9,-0.2 0.850 113.8 47.3 -71.3 -31.6 50.5 53.7 26.0 77 77 A V H < S- 0 0 0 -4,-1.9 8,-2.9 6,-0.2 -2,-0.2 0.968 138.7 -13.0 -65.8 -51.3 48.5 51.3 23.7 78 78 A G H < S+ 0 0 0 -4,-2.6 -3,-0.2 5,-0.2 -2,-0.2 0.334 82.8 127.7-150.9 15.5 46.8 54.0 21.6 79 79 A S X - 0 0 0 -4,-1.9 4,-1.4 -5,-0.4 -30,-0.2 -0.368 63.4-114.4 -72.3 162.6 46.8 57.6 22.6 80 80 A R T 4 S+ 0 0 136 -32,-2.5 -1,-0.1 1,-0.2 6,-0.1 0.960 109.0 22.1 -58.9 -57.7 47.9 60.2 20.0 81 81 A T T 4 S+ 0 0 24 1,-0.1 -1,-0.2 -33,-0.1 5,-0.0 0.839 134.9 33.1 -84.6 -36.3 51.0 61.4 21.8 82 82 A Y T 4 S+ 0 0 33 -7,-0.1 2,-0.2 -34,-0.1 -2,-0.2 0.442 97.0 100.5-106.1 1.2 51.8 58.5 24.2 83 83 A G < - 0 0 0 -4,-1.4 3,-0.3 1,-0.1 -6,-0.2 -0.577 57.6-150.4-102.3 148.8 50.7 55.4 22.2 84 84 A V S S+ 0 0 0 -8,-2.4 2,-0.7 1,-0.3 -6,-0.2 0.877 101.4 37.6 -71.5 -45.0 52.3 52.8 20.2 85 85 A A S > S- 0 0 0 -8,-2.9 3,-1.6 -9,-0.2 -1,-0.3 -0.817 74.1-177.4-114.1 84.8 49.3 52.2 17.9 86 86 A K T 3 S+ 0 0 14 -2,-0.7 -56,-0.2 -3,-0.3 -1,-0.1 0.548 77.3 42.0 -73.7 -7.5 47.9 55.7 17.4 87 87 A K T 3 S+ 0 0 96 -58,-3.0 -55,-0.5 2,-0.1 -1,-0.3 0.239 85.8 118.3-119.7 12.7 44.9 54.8 15.3 88 88 A T < - 0 0 1 -3,-1.6 2,-0.5 -59,-0.4 -54,-0.2 -0.219 67.1-112.1 -71.2 165.3 43.7 51.7 17.1 89 89 A Q E -c 34 0B 52 -56,-1.7 -54,-2.8 -59,-0.3 2,-0.4 -0.899 30.7-151.8 -94.0 131.0 40.2 51.4 18.7 90 90 A L E -cd 35 53B 0 -38,-2.8 -36,-2.0 -2,-0.5 2,-0.5 -0.893 10.2-169.5-108.6 132.0 40.3 51.1 22.5 91 91 A F E -cd 36 54B 7 -56,-2.4 -54,-2.9 -2,-0.4 2,-0.4 -0.988 13.4-144.4-120.5 125.8 37.7 49.3 24.6 92 92 A G E -cd 37 55B 0 -38,-2.6 -36,-2.7 -2,-0.5 -35,-1.4 -0.770 15.4-177.4 -97.0 132.0 37.7 49.6 28.3 93 93 A V E -cd 38 57B 0 -56,-2.3 -54,-2.3 -2,-0.4 2,-1.2 -0.967 18.4-148.8-125.9 108.9 36.7 46.8 30.6 94 94 A K E +cd 39 58B 2 -37,-2.7 -35,-2.3 -2,-0.5 -54,-0.2 -0.690 41.8 142.7 -88.2 95.0 36.7 47.8 34.3 95 95 A V + 0 0 0 -56,-1.6 2,-0.4 -2,-1.2 8,-0.2 0.484 59.6 71.9-102.5 -11.6 37.6 44.8 36.4 96 96 A L S S- 0 0 8 -57,-2.1 6,-0.2 -3,-0.2 -37,-0.1 -0.878 79.8-127.0-110.1 141.0 39.7 46.8 38.9 97 97 A D > - 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