==== 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 HYDROLASE 09-NOV-98 1B0E . COMPND 2 MOLECULE: PROTEIN (ELASTASE); . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR H.A.SCHREUDER,W.A.METZ,N.P.PEET,J.T.PELTON,C.TARDIF . 240 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10723.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 159 66.2 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 . 83 34.6 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 . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 2.5 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 . 24 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 5.0 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 0 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 . 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 . 6 2 2 6 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 1 0, 0.0 3,-0.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 120.2 20.8 73.2 22.1 2 17 A V B +A 182 0A 11 180,-2.5 180,-1.7 1,-0.2 134,-0.2 -0.807 360.0 15.2 -98.6 139.4 21.6 75.5 19.2 3 18 A G S S+ 0 0 39 132,-0.6 146,-0.2 -2,-0.4 -1,-0.2 0.673 102.6 110.4 74.5 19.1 25.1 77.0 18.9 4 19 A G - 0 0 32 -3,-0.4 2,-0.3 131,-0.1 144,-0.2 -0.183 57.4-128.3-108.4-160.1 26.7 74.6 21.3 5 20 A T E -B 147 0B 94 142,-2.4 142,-2.3 -3,-0.1 2,-0.0 -0.967 37.9 -76.7-148.9 159.1 29.1 71.7 21.2 6 21 A E E -B 146 0B 101 -2,-0.3 140,-0.3 140,-0.2 2,-0.2 -0.348 50.2-128.1 -60.1 137.4 29.2 68.1 22.4 7 22 A A - 0 0 4 138,-2.6 2,-0.2 1,-0.1 3,-0.1 -0.499 28.1 -93.9 -84.3 157.5 29.9 67.8 26.1 8 23 A Q > - 0 0 152 -2,-0.2 3,-2.1 1,-0.1 4,-0.2 -0.501 62.2 -82.7 -67.4 138.0 32.6 65.6 27.5 9 24 A R T 3 S- 0 0 123 1,-0.3 -1,-0.1 -2,-0.2 51,-0.1 -0.183 109.1 -6.4 -47.0 128.7 31.1 62.2 28.5 10 25 A N T 3 S+ 0 0 32 49,-0.3 -1,-0.3 2,-0.1 50,-0.1 0.690 89.3 133.2 55.4 26.7 29.4 62.3 31.9 11 26 A S S < S+ 0 0 49 -3,-2.1 -2,-0.1 1,-0.3 -1,-0.1 0.556 74.5 44.7 -81.1 -9.4 30.6 65.8 32.6 12 27 A W S > S+ 0 0 26 -4,-0.2 3,-1.9 96,-0.1 -1,-0.3 -0.626 73.4 174.7-130.7 70.3 27.1 66.9 33.7 13 28 A P T 3 S+ 0 0 28 0, 0.0 97,-1.5 0, 0.0 45,-0.3 0.522 71.9 60.0 -58.1 -11.4 26.2 63.9 35.9 14 29 A S T 3 S+ 0 0 10 95,-0.2 20,-2.5 97,-0.1 2,-0.3 0.574 80.5 105.6 -92.9 -11.7 22.9 65.3 37.2 15 30 A Q E < -I 33 0C 6 -3,-1.9 44,-0.4 18,-0.2 43,-0.4 -0.521 51.6-172.1 -71.1 130.0 21.4 65.6 33.7 16 31 A I E -I 32 0C 1 16,-2.3 16,-0.8 -2,-0.3 2,-0.5 -0.804 22.5-130.4-121.3 161.4 18.8 62.9 32.9 17 32 A S E -IJ 31 56C 0 39,-1.9 39,-2.1 -2,-0.3 2,-0.6 -0.970 18.9-151.9-109.9 123.0 16.9 61.9 29.7 18 33 A L E -IJ 30 55C 0 12,-3.1 11,-3.0 -2,-0.5 12,-1.7 -0.890 22.6-179.1 -97.4 123.0 13.1 61.6 30.2 19 34 A Q E -IJ 28 54C 11 35,-2.7 35,-2.4 -2,-0.6 2,-0.3 -0.917 16.5-150.0-127.3 149.4 11.7 59.1 27.8 20 35 A Y E -IJ 27 53C 65 7,-2.2 7,-2.4 -2,-0.3 2,-0.7 -0.892 32.4 -99.7-119.2 151.8 8.2 57.8 27.0 21 36 A R E -I 26 0C 111 31,-2.3 2,-1.1 -2,-0.3 31,-0.3 -0.565 31.2-168.9 -71.4 108.9 7.0 54.4 25.7 22 36AA S E > -I 25 0C 57 3,-2.7 3,-1.8 -2,-0.7 2,-1.4 -0.704 53.7 -90.8-100.6 75.2 6.5 54.8 22.0 23 36BA G T 3 S+ 0 0 66 -2,-1.1 -1,-0.1 1,-0.3 -2,-0.0 -0.302 117.6 16.6 59.1 -87.5 4.7 51.5 21.5 24 36CA S T 3 S+ 0 0 109 -2,-1.4 -1,-0.3 -3,-0.1 2,-0.1 0.867 132.7 18.5 -83.0 -41.3 7.7 49.3 20.7 25 37 A S E < S-I 22 0C 74 -3,-1.8 -3,-2.7 -5,-0.0 2,-0.4 -0.384 78.6 -97.1-119.6-165.3 10.5 51.5 21.9 26 38 A W E -I 21 0C 66 -5,-0.3 2,-0.4 -2,-0.1 -5,-0.2 -0.959 30.3-160.4-119.5 136.9 11.4 54.5 24.1 27 39 A A E -I 20 0C 33 -7,-2.4 -7,-2.2 -2,-0.4 2,-0.2 -0.970 21.8-118.9-124.5 134.5 11.8 58.0 22.8 28 40 A H E +I 19 0C 22 -2,-0.4 -9,-0.3 -9,-0.2 3,-0.1 -0.481 40.0 160.8 -64.4 134.7 13.6 61.0 24.4 29 41 A T E - 0 0 31 -11,-3.0 2,-0.3 1,-0.4 157,-0.2 0.597 57.7 -2.7-129.1 -27.0 11.0 63.7 25.1 30 42 A a E -I 18 0C 5 -12,-1.7 -12,-3.1 157,-0.1 -1,-0.4 -0.951 59.9-117.6-160.0 167.6 12.6 66.0 27.7 31 43 A G E +I 17 0C 1 157,-3.1 12,-0.4 -2,-0.3 2,-0.3 -0.417 31.9 173.8 -99.5-176.0 15.6 66.6 29.9 32 44 A G E -I 16 0C 0 -16,-0.8 -16,-2.3 -2,-0.2 2,-0.4 -0.967 28.0-110.1-176.7 175.0 15.6 66.8 33.7 33 45 A T E -IK 15 41C 0 8,-2.4 8,-2.9 -2,-0.3 2,-0.5 -0.991 22.0-131.5-128.8 128.6 17.8 67.0 36.8 34 46 A L E + K 0 40C 0 -20,-2.5 78,-3.0 -2,-0.4 6,-0.2 -0.684 33.6 165.7 -76.9 118.4 18.4 64.3 39.4 35 47 A I E + 0 0 2 4,-2.3 2,-0.3 -2,-0.5 5,-0.2 0.594 65.2 13.1-111.5 -16.0 17.8 65.9 42.8 36 48 A R E > S- K 0 39C 91 3,-1.7 3,-1.3 74,-0.1 -1,-0.3 -0.929 89.5 -96.4-147.4 166.5 17.5 62.8 45.1 37 49 A Q T 3 S+ 0 0 90 -2,-0.3 66,-2.4 1,-0.3 64,-0.1 0.772 128.3 24.4 -60.9 -22.7 18.4 59.2 44.5 38 50 A N T 3 S+ 0 0 49 64,-0.2 61,-2.6 62,-0.1 2,-0.4 0.124 112.3 78.9-130.1 23.0 14.7 58.7 43.7 39 51 A W E < -KL 36 98C 5 -3,-1.3 -4,-2.3 59,-0.2 -3,-1.7 -0.998 49.6-171.4-136.8 135.8 13.5 62.1 42.6 40 52 A V E -KL 34 97C 0 57,-2.0 57,-2.9 -2,-0.4 2,-0.4 -0.959 13.3-146.4-125.1 138.9 13.9 64.0 39.3 41 53 A M E +KL 33 96C 0 -8,-2.9 -8,-2.4 -2,-0.4 2,-0.2 -0.902 34.6 143.4-106.1 130.7 13.0 67.7 38.6 42 54 A T E - L 0 95C 0 53,-2.7 53,-2.2 -2,-0.4 2,-0.3 -0.799 51.7 -64.9-149.1-172.0 11.6 68.6 35.2 43 55 A A >> - 0 0 0 -12,-0.4 3,-1.6 51,-0.2 4,-0.6 -0.682 34.0-132.9 -86.4 142.6 9.1 70.9 33.5 44 56 A A H >> S+ 0 0 0 -2,-0.3 3,-1.3 1,-0.3 4,-0.6 0.887 105.7 63.3 -58.4 -37.3 5.4 70.4 34.1 45 57 A H H 34 S+ 0 0 50 1,-0.3 -1,-0.3 2,-0.2 143,-0.0 0.609 96.4 59.8 -66.6 -9.4 4.8 70.6 30.3 46 58 A a H <4 S+ 0 0 2 -3,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.739 117.3 26.6 -85.9 -27.0 6.9 67.5 29.8 47 59 A V H << S+ 0 0 6 -3,-1.3 -2,-0.2 -4,-0.6 -1,-0.1 0.146 83.7 105.9-127.3 21.7 4.7 65.3 31.9 48 60 A D S < S+ 0 0 42 -4,-0.6 2,-0.3 2,-0.1 -1,-0.1 0.055 71.9 69.4 -92.3 25.6 1.1 66.7 31.9 49 61 A R S S- 0 0 119 -3,-0.1 2,-1.3 2,-0.0 0, 0.0 -0.975 95.9 -95.8-138.9 150.1 -0.3 64.0 29.6 50 62 A E + 0 0 204 -2,-0.3 2,-0.3 2,-0.0 -2,-0.1 -0.545 68.6 130.8 -74.3 91.9 -0.9 60.3 30.3 51 63 A L - 0 0 60 -2,-1.3 2,-0.6 -4,-0.1 -29,-0.1 -0.848 61.1-105.7-132.2 166.8 2.1 58.5 29.0 52 64 A T - 0 0 95 -2,-0.3 -31,-2.3 -31,-0.3 2,-0.3 -0.888 45.1-167.4 -98.9 121.2 4.4 55.8 30.4 53 65 A F E -J 20 0C 9 -2,-0.6 21,-1.9 21,-0.2 2,-0.3 -0.751 17.4-177.3-113.7 156.6 7.8 57.4 31.3 54 65AA R E -JM 19 73C 53 -35,-2.4 -35,-2.7 -2,-0.3 2,-0.4 -0.951 18.4-136.7-142.6 158.1 11.3 56.2 32.3 55 66 A V E -JM 18 72C 0 17,-3.1 17,-2.5 -2,-0.3 2,-0.5 -0.934 8.2-157.1-119.4 138.6 14.4 58.1 33.3 56 67 A V E -JM 17 71C 0 -39,-2.1 -39,-1.9 -2,-0.4 3,-0.3 -0.985 12.3-173.5-118.4 117.8 17.9 57.4 32.0 57 68 A V E + M 0 70C 1 13,-2.3 13,-1.6 -2,-0.5 -41,-0.1 -0.725 67.7 33.4-104.2 160.6 20.8 58.6 34.2 58 69 A G S S+ 0 0 3 -43,-0.4 10,-0.3 50,-0.4 -1,-0.2 0.750 88.6 155.8 66.4 25.8 24.5 58.4 33.3 59 70 A E + 0 0 12 -44,-0.4 -49,-0.3 -3,-0.3 -1,-0.2 -0.480 20.5 145.7 -90.2 150.4 23.5 59.0 29.7 60 71 A H S S+ 0 0 1 1,-0.3 85,-1.4 4,-0.2 2,-0.6 0.339 70.6 36.9-139.0 -64.7 25.6 60.5 26.8 61 72 A N B > -O 144 0D 12 3,-0.3 3,-0.9 83,-0.2 -1,-0.3 -0.907 64.5-155.7-102.2 116.9 24.7 58.9 23.4 62 73 A L T 3 S+ 0 0 40 81,-3.0 -1,-0.1 -2,-0.6 82,-0.1 0.769 91.0 44.4 -62.5 -24.1 21.0 58.1 23.0 63 74 A N T 3 S+ 0 0 115 80,-0.3 2,-0.3 2,-0.0 -1,-0.2 0.417 108.5 53.0-104.0 0.4 21.6 55.4 20.4 64 75 A Q S < S- 0 0 115 -3,-0.9 2,-0.5 0, 0.0 -3,-0.3 -0.960 83.4-106.3-135.8 153.9 24.6 53.5 21.8 65 76 A N + 0 0 127 -2,-0.3 -3,-0.1 1,-0.2 -2,-0.0 -0.670 30.4 179.2 -79.7 123.4 25.4 51.7 25.1 66 77 A N - 0 0 32 -2,-0.5 -1,-0.2 -5,-0.1 -7,-0.0 0.518 40.8-125.0 -98.9 -11.9 28.0 53.8 26.9 67 78 A G S S+ 0 0 59 1,-0.0 -2,-0.1 0, 0.0 -8,-0.1 0.493 94.4 81.6 80.4 4.5 28.2 51.4 29.8 68 79 A T + 0 0 21 -10,-0.3 -9,-0.1 40,-0.1 40,-0.1 0.441 65.6 113.1-118.2 -1.6 27.4 54.1 32.4 69 80 A E - 0 0 24 -13,-0.0 2,-0.4 -11,-0.0 -11,-0.2 -0.312 42.4-167.6 -79.2 152.9 23.6 54.2 32.1 70 81 A Q E -M 57 0C 43 -13,-1.6 -13,-2.3 -2,-0.1 2,-0.5 -0.993 11.4-153.9-136.8 129.0 20.9 53.2 34.6 71 82 A Y E +M 56 0C 102 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.927 19.3 171.1-108.5 129.8 17.3 52.9 33.4 72 83 A V E -M 55 0C 8 -17,-2.5 -17,-3.1 -2,-0.5 2,-0.1 -1.000 28.1-120.5-143.8 138.8 14.4 53.4 35.9 73 84 A G E -M 54 0C 30 -2,-0.4 27,-3.0 -19,-0.2 2,-0.6 -0.326 26.8-115.5 -74.7 156.3 10.7 53.7 35.6 74 85 A V E +N 99 0C 28 -21,-1.9 -21,-0.2 25,-0.2 25,-0.2 -0.861 30.5 179.4 -94.0 123.3 8.7 56.7 36.8 75 86 A Q E + 0 0 113 23,-2.5 2,-0.3 -2,-0.6 24,-0.2 0.814 64.0 15.1 -92.8 -37.9 6.4 55.8 39.6 76 87 A K E -N 98 0C 78 22,-1.8 22,-2.8 2,-0.0 2,-0.5 -0.999 58.7-154.5-144.9 139.0 4.7 59.1 40.5 77 88 A I E -N 97 0C 64 -2,-0.3 2,-0.6 20,-0.2 20,-0.2 -0.956 7.5-172.2-116.7 126.5 4.3 62.5 38.8 78 89 A V E -N 96 0C 29 18,-2.9 18,-2.7 -2,-0.5 2,-0.3 -0.945 7.6-170.2-120.8 104.4 3.7 65.6 40.8 79 90 A V E -N 95 0C 45 -2,-0.6 16,-0.2 16,-0.2 14,-0.1 -0.698 38.4 -91.3 -91.1 145.9 2.9 68.7 38.7 80 91 A H > - 0 0 21 14,-2.0 3,-1.9 12,-0.3 -1,-0.1 -0.381 33.1-127.2 -58.7 134.6 2.8 72.1 40.3 81 92 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.730 106.9 50.3 -53.0 -33.1 -0.8 73.0 41.5 82 93 A Y T 3 S+ 0 0 149 10,-0.1 2,-0.1 2,-0.0 -2,-0.1 0.483 83.3 117.9 -86.7 -7.2 -0.8 76.3 39.6 83 94 A W < - 0 0 23 -3,-1.9 2,-0.5 9,-0.2 9,-0.1 -0.394 45.1-164.6 -64.5 137.1 0.3 74.9 36.3 84 95 A N > - 0 0 97 7,-0.4 3,-2.1 3,-0.3 6,-0.2 -0.991 17.0-142.3-125.8 118.5 -2.0 75.2 33.3 85 96 A T T 3 S+ 0 0 95 -2,-0.5 3,-0.2 1,-0.3 -1,-0.1 0.783 99.8 44.9 -46.5 -38.0 -1.2 73.0 30.3 86 97 A D T 3 S+ 0 0 144 1,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.350 105.9 63.2 -93.8 5.7 -2.2 75.7 27.8 87 98 A D X + 0 0 73 -3,-2.1 3,-1.2 1,-0.1 4,-0.4 -0.567 47.2 159.7-135.3 74.6 -0.5 78.7 29.4 88 99 A V G > S+ 0 0 49 1,-0.2 3,-1.5 -2,-0.2 5,-0.2 0.873 74.9 61.0 -63.1 -35.2 3.3 78.3 29.6 89 99AA A G 3 S+ 0 0 26 1,-0.3 -1,-0.2 3,-0.1 3,-0.1 0.616 88.9 71.0 -70.4 -13.0 3.9 82.1 30.0 90 99BA A G < S- 0 0 34 -3,-1.2 -1,-0.3 1,-0.3 2,-0.2 0.770 100.3-140.4 -72.8 -23.4 1.9 82.2 33.3 91 100 A G < + 0 0 4 -3,-1.5 -7,-0.4 -4,-0.4 -1,-0.3 -0.640 68.0 117.6 99.0-160.1 4.8 80.2 34.9 92 101 A Y + 0 0 81 -2,-0.2 2,-1.9 1,-0.2 -12,-0.3 0.734 39.0 156.9 63.7 25.2 4.7 77.4 37.4 93 102 A D + 0 0 0 -5,-0.2 2,-0.3 -49,-0.1 131,-0.2 -0.528 31.0 107.0 -83.1 77.0 6.4 75.1 34.8 94 103 A I + 0 0 0 -2,-1.9 -14,-2.0 -51,-0.3 2,-0.3 -0.993 37.3 172.9-154.4 146.6 7.8 72.6 37.2 95 104 A A E -LN 42 79C 0 -53,-2.2 -53,-2.7 -2,-0.3 2,-0.4 -0.981 20.2-139.6-153.3 153.6 7.2 69.0 38.2 96 105 A L E -LN 41 78C 0 -18,-2.7 -18,-2.9 -2,-0.3 2,-0.5 -0.958 12.4-155.6-120.5 137.3 8.8 66.3 40.3 97 106 A L E -LN 40 77C 1 -57,-2.9 -57,-2.0 -2,-0.4 2,-0.6 -0.957 7.0-147.8-116.1 122.0 9.0 62.6 39.4 98 107 A R E -LN 39 76C 40 -22,-2.8 -23,-2.5 -2,-0.5 -22,-1.8 -0.817 24.3-134.4 -89.4 124.8 9.3 59.9 42.0 99 108 A L E - 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