==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SERINE PROTEINASE 02-JAN-95 1ELT . COMPND 2 MOLECULE: ELASTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMO SALAR; . AUTHOR G.I.BERGLUND,A.O.SMALAAS . 236 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9813.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 148 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 31.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 2.1 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 . 21 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 3.8 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 2 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 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 2 2 3 5 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 1 1 0 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 V 0 0 0 0, 0.0 2,-0.5 0, 0.0 181,-0.2 0.000 360.0 360.0 360.0 124.2 9.4 37.6 88.5 2 17 A V B -A 181 0A 11 179,-2.9 179,-1.9 211,-0.1 2,-0.1 -0.866 360.0 -4.7 -97.3 127.8 10.3 34.4 90.4 3 18 A G S S+ 0 0 28 132,-0.5 144,-0.1 -2,-0.5 177,-0.1 -0.472 97.2 82.0 86.2-163.5 9.1 34.2 94.0 4 19 A G S S- 0 0 37 -2,-0.1 2,-0.3 145,-0.1 144,-0.3 -0.302 77.4 -91.9 67.4-147.1 7.3 37.1 95.5 5 20 A R E -B 147 0B 109 142,-2.7 142,-2.8 -3,-0.1 2,-0.2 -0.968 38.9 -71.5-160.4 169.5 3.6 37.7 94.9 6 21 A V E -B 146 0B 80 -2,-0.3 140,-0.3 140,-0.3 139,-0.1 -0.493 57.2-123.2 -69.0 131.3 1.0 39.4 92.7 7 22 A A - 0 0 4 138,-3.0 3,-0.1 -2,-0.2 138,-0.1 -0.345 27.0 -96.2 -73.5 159.8 1.1 43.1 93.4 8 23 A Q > - 0 0 152 1,-0.1 3,-1.7 -2,-0.1 4,-0.2 -0.596 63.5 -83.4 -72.0 139.6 -2.0 45.0 94.5 9 24 A P T 3 S- 0 0 67 0, 0.0 -1,-0.1 0, 0.0 51,-0.1 -0.158 107.5 -3.2 -49.8 130.5 -3.5 46.6 91.4 10 25 A N T 3 S+ 0 0 38 49,-0.3 50,-0.1 2,-0.1 -2,-0.0 0.703 88.0 131.1 60.1 28.0 -1.8 49.9 90.4 11 26 A S S < S+ 0 0 52 -3,-1.7 -1,-0.1 1,-0.3 97,-0.0 0.539 72.1 47.9 -86.2 -8.4 0.5 50.0 93.4 12 27 A W S > S- 0 0 21 -4,-0.2 3,-2.1 96,-0.1 -1,-0.3 -0.673 75.0-179.4-128.9 75.8 3.6 50.7 91.3 13 28 A P T 3 S+ 0 0 14 0, 0.0 97,-1.3 0, 0.0 45,-0.3 0.528 73.4 56.1 -57.6 -14.0 2.2 53.6 89.1 14 29 A W T 3 S+ 0 0 28 95,-0.2 20,-2.2 97,-0.1 2,-0.2 0.498 80.4 111.5 -96.1 -6.8 5.3 54.2 87.0 15 30 A Q E < -I 33 0C 5 -3,-2.1 43,-0.5 18,-0.2 44,-0.4 -0.497 48.3-172.8 -68.8 133.3 5.6 50.6 85.9 16 31 A I E -I 32 0C 2 16,-2.1 16,-0.7 -2,-0.2 2,-0.5 -0.860 21.5-133.7-126.2 158.6 4.9 50.2 82.1 17 32 A S E -IJ 31 56C 0 39,-1.8 39,-2.6 -2,-0.3 2,-0.6 -0.974 16.2-154.0-112.5 123.7 4.5 47.2 79.8 18 33 A L E +IJ 30 55C 0 12,-3.1 11,-2.7 -2,-0.5 12,-1.8 -0.903 21.7 177.1-100.9 121.2 6.4 47.3 76.5 19 34 A Q E -IJ 28 54C 16 35,-3.1 35,-2.4 -2,-0.6 2,-0.3 -0.862 18.4-146.8-124.8 155.3 4.7 45.2 73.8 20 35 A Y E -IJ 27 53C 73 7,-1.9 7,-2.5 -2,-0.3 2,-0.2 -0.923 23.6-111.6-123.6 150.9 5.4 44.6 70.1 21 36 A K E +I 26 0C 96 31,-2.1 31,-0.3 -2,-0.3 2,-0.3 -0.556 31.5 171.8 -82.0 140.4 2.9 43.9 67.3 22 36AA S E > -I 25 0C 60 3,-3.1 3,-1.9 -2,-0.2 2,-0.2 -0.822 68.7 -48.6-147.9 102.3 2.7 40.6 65.6 23 36BA G T 3 S- 0 0 54 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 -0.506 122.7 -22.4 68.9-130.7 -0.2 40.3 63.2 24 36CA S T 3 S+ 0 0 128 -2,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.509 126.3 83.4 -90.0 -2.2 -3.3 41.5 65.0 25 37 A S E < -I 22 0C 55 -3,-1.9 -3,-3.1 2,-0.0 2,-0.4 -0.579 62.6-148.6-105.3 161.1 -1.8 40.9 68.4 26 38 A Y E -I 21 0C 58 -5,-0.2 2,-0.4 -2,-0.2 -5,-0.2 -0.987 17.4-156.9-123.3 132.9 0.6 42.7 70.8 27 39 A Y E -I 20 0C 113 -7,-2.5 -7,-1.9 -2,-0.4 2,-0.2 -0.957 18.2-121.5-116.7 133.2 2.9 40.6 73.0 28 40 A H E +I 19 0C 22 -2,-0.4 -9,-0.2 -9,-0.2 3,-0.1 -0.498 41.6 156.7 -68.3 136.4 4.5 41.8 76.2 29 41 A T E + 0 0 48 -11,-2.7 2,-0.3 1,-0.4 156,-0.3 0.586 56.3 8.9-133.1 -27.7 8.3 41.6 76.0 30 42 A a E -I 18 0C 5 -12,-1.8 -12,-3.1 156,-0.1 -1,-0.4 -0.955 57.5-127.2-153.5 165.5 9.7 44.0 78.6 31 43 A G E +I 17 0C 2 156,-3.1 12,-0.4 -2,-0.3 2,-0.3 -0.382 28.6 169.8-101.1-174.5 9.0 46.3 81.5 32 44 A G E -I 16 0C 0 -16,-0.7 -16,-2.1 -2,-0.2 2,-0.4 -0.958 28.4-107.7-179.6 177.0 10.0 50.0 81.9 33 45 A S E -IK 15 41C 0 8,-2.4 8,-2.7 -2,-0.3 2,-0.7 -0.988 20.2-130.0-130.9 134.1 9.5 53.1 84.0 34 46 A L E + K 0 40C 1 -20,-2.2 78,-2.7 -2,-0.4 6,-0.2 -0.738 34.3 166.9 -79.6 115.4 7.5 56.3 83.2 35 47 A I E + 0 0 12 4,-2.2 2,-0.3 -2,-0.7 5,-0.2 0.636 65.2 10.2-107.5 -18.7 10.0 59.1 84.0 36 48 A R E > S- K 0 39C 94 3,-1.5 3,-1.5 74,-0.1 -1,-0.3 -0.933 90.8 -93.8-149.7 162.0 8.3 62.1 82.4 37 49 A Q T 3 S+ 0 0 96 -2,-0.3 66,-2.5 1,-0.3 64,-0.1 0.842 126.9 25.5 -51.8 -35.0 4.9 62.5 80.9 38 50 A G T 3 S+ 0 0 6 64,-0.2 61,-2.8 62,-0.1 2,-0.4 0.216 112.2 81.7-115.3 19.5 6.2 61.7 77.4 39 51 A W E < -KL 36 98C 20 -3,-1.5 -4,-2.2 59,-0.2 -3,-1.5 -0.979 48.9-170.7-134.0 136.4 9.2 59.6 78.3 40 52 A V E -KL 34 97C 0 57,-2.3 57,-2.7 -2,-0.4 2,-0.5 -0.928 12.3-149.1-122.5 140.5 9.9 56.0 79.2 41 53 A M E +KL 33 96C 0 -8,-2.7 -8,-2.4 -2,-0.4 2,-0.2 -0.925 34.0 144.3-108.2 129.3 13.2 54.5 80.5 42 54 A T E - L 0 95C 0 53,-2.6 53,-2.4 -2,-0.5 2,-0.3 -0.792 50.5 -67.1-147.5-172.2 13.8 50.8 79.6 43 55 A A >> - 0 0 0 -12,-0.4 3,-1.3 51,-0.3 4,-0.7 -0.677 32.4-132.2 -88.0 145.1 16.7 48.4 78.6 44 56 A A H >> S+ 0 0 0 -2,-0.3 3,-1.0 1,-0.3 4,-0.8 0.883 106.2 62.4 -60.7 -37.1 18.6 48.8 75.4 45 57 A H H 34 S+ 0 0 55 1,-0.2 -1,-0.3 2,-0.2 161,-0.0 0.681 98.5 58.3 -65.8 -13.2 18.2 45.0 74.7 46 58 A a H <4 S+ 0 0 5 -3,-1.3 -1,-0.2 1,-0.1 -2,-0.2 0.778 117.7 26.8 -83.4 -27.7 14.4 45.5 74.6 47 59 A V H << S+ 0 0 6 -3,-1.0 -2,-0.2 -4,-0.7 -1,-0.1 0.205 80.8 108.0-125.3 18.2 14.4 48.0 71.8 48 60 A D S < S+ 0 0 60 -4,-0.8 2,-0.3 2,-0.1 -1,-0.1 0.084 73.5 70.6 -86.5 27.1 17.4 47.5 69.6 49 61 A S S S- 0 0 49 -3,-0.1 2,-1.2 2,-0.0 -3,-0.0 -0.919 93.2-106.2-133.4 158.9 15.3 46.0 66.8 50 62 A A + 0 0 114 -2,-0.3 2,-0.3 2,-0.0 -2,-0.1 -0.738 61.7 146.3 -89.4 89.5 12.8 47.7 64.5 51 63 A R - 0 0 125 -2,-1.2 2,-0.9 -4,-0.1 -2,-0.0 -0.825 57.1-105.3-120.3 162.9 9.5 46.5 66.0 52 64 A T - 0 0 86 -31,-0.3 -31,-2.1 -2,-0.3 2,-0.2 -0.842 48.7-152.4 -90.3 109.2 6.1 48.2 66.2 53 65 A W E -J 20 0C 22 -2,-0.9 21,-0.5 -33,-0.2 2,-0.4 -0.509 22.1-170.7 -89.0 153.1 5.8 49.2 69.8 54 65AA R E -J 19 0C 80 -35,-2.4 -35,-3.1 -2,-0.2 2,-0.5 -0.996 9.8-159.1-136.4 129.9 2.9 49.7 72.2 55 66 A V E -JM 18 72C 0 17,-2.8 17,-2.9 -2,-0.4 2,-0.6 -0.974 6.7-158.9-113.6 123.7 3.5 51.1 75.7 56 67 A V E -JM 17 71C 2 -39,-2.6 -39,-1.8 -2,-0.5 3,-0.4 -0.923 7.2-170.7-108.7 118.2 0.9 50.5 78.3 57 68 A L E S+ M 0 70C 1 13,-2.8 13,-2.2 -2,-0.6 -41,-0.1 -0.724 70.6 23.9 -99.6 155.2 0.6 52.7 81.3 58 69 A G S S+ 0 0 4 -43,-0.5 10,-0.2 -45,-0.3 -1,-0.2 0.706 89.1 157.8 63.5 25.3 -1.6 52.0 84.3 59 70 A E + 0 0 15 -44,-0.4 -49,-0.3 -3,-0.4 -1,-0.2 -0.381 19.6 147.9 -84.8 149.5 -1.6 48.3 83.6 60 71 A H S S+ 0 0 8 1,-0.2 85,-1.0 4,-0.2 2,-0.7 0.316 72.3 36.3-137.3 -68.0 -2.2 45.4 85.9 61 72 A N B > -O 144 0D 37 83,-0.2 3,-1.6 3,-0.2 -1,-0.2 -0.889 69.3-156.6 -97.1 108.7 -3.9 42.4 84.1 62 73 A L T 3 S+ 0 0 42 81,-2.8 -1,-0.1 -2,-0.7 82,-0.1 0.814 88.7 48.3 -54.4 -35.1 -2.4 42.2 80.6 63 74 A N T 3 S+ 0 0 119 80,-0.2 2,-0.4 2,-0.0 -1,-0.3 0.335 103.1 71.0 -91.2 5.4 -5.3 40.3 79.1 64 75 A T S < S- 0 0 66 -3,-1.6 2,-1.1 0, 0.0 -4,-0.2 -0.964 72.3-133.9-128.5 143.0 -8.1 42.5 80.4 65 76 A N + 0 0 144 -2,-0.4 -3,-0.1 1,-0.2 -2,-0.0 -0.803 33.6 170.3 -92.4 100.2 -9.3 46.1 79.7 66 77 A E - 0 0 75 -2,-1.1 -1,-0.2 -5,-0.2 -7,-0.0 0.569 46.6-114.8 -89.6 -14.7 -9.7 47.3 83.2 67 78 A G S S+ 0 0 61 -3,-0.1 -2,-0.1 2,-0.0 -9,-0.0 0.295 98.2 81.3 99.7 -11.5 -10.3 51.0 82.5 68 79 A K + 0 0 116 -10,-0.2 2,-0.1 40,-0.0 40,-0.1 0.456 66.6 108.1-105.8 0.6 -7.2 52.5 84.1 69 80 A E - 0 0 32 -13,-0.0 2,-0.5 1,-0.0 -11,-0.2 -0.417 52.0-156.2 -81.3 151.2 -4.8 51.9 81.2 70 81 A Q E -M 57 0C 35 -13,-2.2 -13,-2.8 -2,-0.1 2,-0.5 -0.986 13.3-151.0-126.2 109.6 -3.3 54.5 78.9 71 82 A I E +M 56 0C 92 -2,-0.5 2,-0.3 -15,-0.2 -15,-0.2 -0.766 22.5 178.9 -83.5 127.1 -2.2 53.0 75.6 72 83 A M E -M 55 0C 10 -17,-2.9 -17,-2.8 -2,-0.5 2,-0.3 -0.909 19.9-142.5-130.7 155.1 0.7 54.9 74.0 73 84 A T - 0 0 67 -2,-0.3 27,-2.2 -19,-0.2 2,-0.5 -0.758 25.6-111.1-112.9 164.0 2.9 54.6 70.9 74 85 A V E -N 99 0C 26 -21,-0.5 25,-0.3 -2,-0.3 -21,-0.1 -0.853 24.4-178.8-102.0 125.3 6.6 55.4 70.5 75 86 A N E S+ 0 0 104 23,-2.9 2,-0.3 -2,-0.5 24,-0.2 0.896 72.4 0.8 -83.8 -45.4 7.8 58.3 68.4 76 87 A S E -N 98 0C 44 22,-1.6 22,-2.9 2,-0.0 2,-0.4 -0.999 57.8-146.0-149.7 147.4 11.5 57.8 68.9 77 88 A V E -N 97 0C 49 -2,-0.3 2,-0.5 20,-0.2 20,-0.2 -0.943 10.3-165.0-115.0 131.7 14.0 55.4 70.5 78 89 A F E -N 96 0C 67 18,-3.0 18,-2.5 -2,-0.4 2,-0.4 -0.958 7.8-169.2-119.5 110.2 17.3 56.5 72.0 79 90 A I E -N 95 0C 58 -2,-0.5 16,-0.2 16,-0.2 14,-0.1 -0.824 34.3 -99.8-101.5 138.3 19.8 53.8 72.8 80 91 A H > - 0 0 25 14,-2.0 3,-1.9 -2,-0.4 14,-0.1 -0.309 27.7-130.5 -55.8 132.9 22.9 54.5 74.8 81 92 A S T 3 S+ 0 0 114 1,-0.3 -1,-0.2 3,-0.0 -2,-0.0 0.670 104.8 57.8 -59.0 -21.1 25.9 54.9 72.4 82 93 A G T 3 S+ 0 0 33 10,-0.1 -1,-0.3 2,-0.0 2,-0.1 0.513 79.0 120.5 -89.3 -2.8 28.0 52.5 74.5 83 94 A W < - 0 0 35 -3,-1.9 2,-0.4 9,-0.2 9,-0.1 -0.387 36.2-179.3 -68.3 131.4 25.5 49.6 74.1 84 95 A N > - 0 0 79 7,-0.5 3,-2.3 3,-0.3 6,-0.3 -0.919 14.6-163.1-131.4 104.7 26.8 46.4 72.5 85 96 A S T 3 S+ 0 0 68 -2,-0.4 3,-0.4 1,-0.3 -1,-0.1 0.676 91.3 63.3 -60.0 -19.7 24.1 43.6 72.3 86 97 A D T 3 S+ 0 0 145 1,-0.3 -1,-0.3 2,-0.1 2,-0.2 0.605 112.5 35.4 -79.4 -12.3 26.9 41.1 71.7 87 98 A D X + 0 0 85 -3,-2.3 3,-1.9 1,-0.1 -3,-0.3 -0.606 61.0 168.7-142.8 78.5 28.2 41.9 75.2 88 99 A V G > S+ 0 0 49 -3,-0.4 3,-1.7 1,-0.3 5,-0.2 0.841 78.8 65.3 -60.6 -30.3 25.4 42.6 77.7 89 99AA A G 3 S+ 0 0 19 1,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.564 84.2 74.7 -69.9 -9.2 28.0 42.4 80.5 90 99BA G G < S- 0 0 25 -3,-1.9 -1,-0.3 -6,-0.3 2,-0.2 0.670 98.6-139.3 -75.8 -14.4 29.7 45.5 79.1 91 100 A G < + 0 0 4 -3,-1.7 -7,-0.5 -4,-0.3 -1,-0.3 -0.564 68.5 115.3 93.2-160.3 26.9 47.6 80.5 92 101 A Y + 0 0 94 1,-0.2 2,-2.0 -2,-0.2 -12,-0.3 0.735 37.6 155.5 61.9 24.1 25.1 50.6 79.0 93 102 A D + 0 0 0 -5,-0.2 2,-0.3 -49,-0.1 130,-0.2 -0.542 32.9 109.6 -82.8 76.6 21.9 48.6 78.8 94 103 A I + 0 0 0 -2,-2.0 -14,-2.0 -51,-0.3 2,-0.3 -0.995 37.5 173.5-152.6 143.8 19.6 51.6 78.9 95 104 A A E -LN 42 79C 0 -53,-2.4 -53,-2.6 -2,-0.3 2,-0.4 -0.984 19.2-141.8-150.2 152.6 17.3 53.3 76.4 96 105 A L E -LN 41 78C 0 -18,-2.5 -18,-3.0 -2,-0.3 2,-0.5 -0.947 11.1-154.6-118.2 142.5 14.8 56.1 76.4 97 106 A L E -LN 40 77C 0 -57,-2.7 -57,-2.3 -2,-0.4 2,-0.7 -0.978 6.0-150.0-119.4 126.7 11.5 56.1 74.5 98 107 A R E -LN 39 76C 100 -22,-2.9 -23,-2.9 -2,-0.5 -22,-1.6 -0.877 23.4-141.6 -94.5 117.6 9.8 59.4 73.4 99 108 A L E - 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