==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SERINE PROTEASE 20-JUL-96 1LVY . COMPND 2 MOLECULE: ELASTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR M.SCHILTZ,T.PRANGE . 240 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10725.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 153 63.8 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 . 82 34.2 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 . 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 . 20 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 4.2 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 1 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 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 . 5 2 2 5 2 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,-0.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 124.3 -11.3 33.7 35.9 2 17 A V B 3 +A 182 0A 12 180,-2.6 180,-1.6 1,-0.2 134,-0.1 -0.758 360.0 8.3 -89.4 130.8 -14.8 34.5 34.8 3 18 A G T 3 S+ 0 0 43 132,-0.7 -1,-0.2 -2,-0.4 2,-0.1 0.784 97.7 138.7 70.8 27.8 -16.1 38.0 35.3 4 19 A G < - 0 0 23 -3,-0.6 2,-0.3 131,-0.1 144,-0.2 -0.254 46.3-133.6 -97.5-176.2 -12.7 39.3 36.4 5 20 A T E -B 147 0B 90 142,-2.2 142,-3.0 -2,-0.1 2,-0.3 -0.887 40.5 -83.8-131.8 159.2 -10.8 42.5 35.8 6 21 A E E -B 146 0B 122 -2,-0.3 140,-0.3 140,-0.2 2,-0.2 -0.475 44.1-130.3 -69.5 131.9 -7.1 42.8 34.8 7 22 A A - 0 0 1 138,-2.7 2,-0.2 -2,-0.3 138,-0.1 -0.494 22.6-113.1 -78.0 147.1 -4.8 42.7 37.8 8 23 A Q > - 0 0 128 -2,-0.2 3,-1.4 1,-0.1 4,-0.3 -0.599 38.8-102.4 -75.2 154.2 -2.1 45.5 38.0 9 24 A R T 3 S+ 0 0 117 1,-0.2 3,-0.2 -2,-0.2 -1,-0.1 0.720 113.4 33.4 -50.5 -39.3 1.4 44.0 37.6 10 25 A N T 3 S+ 0 0 74 1,-0.1 -1,-0.2 99,-0.0 50,-0.0 0.072 90.9 104.9-108.2 26.8 2.8 43.9 41.1 11 26 A S S < S+ 0 0 44 -3,-1.4 -1,-0.1 1,-0.2 -2,-0.1 0.906 89.1 19.5 -72.5 -45.6 -0.5 43.2 42.7 12 27 A W > + 0 0 29 -4,-0.3 3,-1.6 -3,-0.2 -1,-0.2 -0.676 68.6 171.0-131.2 73.3 -0.2 39.5 43.6 13 28 A P T 3 S+ 0 0 32 0, 0.0 97,-1.4 0, 0.0 45,-0.3 0.482 73.5 60.3 -68.2 -9.2 3.6 38.7 43.6 14 29 A S T 3 S+ 0 0 8 95,-0.2 20,-2.5 97,-0.2 98,-0.2 0.524 80.0 110.1 -95.1 -4.3 3.3 35.2 45.1 15 30 A Q E < -I 33 0C 7 -3,-1.6 43,-0.6 18,-0.2 44,-0.4 -0.419 50.0-172.3 -70.6 130.9 1.1 34.1 42.0 16 31 A I E -IJ 32 57C 0 16,-2.3 16,-1.0 -2,-0.2 2,-0.5 -0.898 23.0-130.8-121.7 160.2 3.0 31.6 39.7 17 32 A S E -IJ 31 56C 0 39,-2.2 39,-2.0 -2,-0.3 2,-0.6 -0.953 19.3-152.5-107.0 118.4 2.2 30.1 36.3 18 33 A L E +IJ 30 55C 0 12,-2.9 11,-3.4 -2,-0.5 12,-1.7 -0.854 23.8 179.7 -97.3 121.1 2.6 26.3 36.2 19 34 A Q E -IJ 28 54C 11 35,-2.6 35,-2.6 -2,-0.6 2,-0.3 -0.883 19.7-152.3-124.0 152.0 3.5 25.2 32.7 20 35 A Y E -IJ 27 53C 67 7,-2.2 7,-2.7 -2,-0.3 2,-0.4 -0.880 31.5-103.9-125.6 154.3 4.3 22.0 30.8 21 36 A R E -I 26 0C 123 31,-1.8 2,-0.6 -2,-0.3 31,-0.3 -0.676 33.9-172.0 -77.5 125.6 6.3 21.4 27.7 22 36AA S E > -I 25 0C 52 3,-3.9 3,-2.0 -2,-0.4 2,-0.6 -0.917 63.6 -54.5-123.1 94.9 4.0 20.8 24.8 23 36BA G T 3 S- 0 0 66 -2,-0.6 -2,-0.0 1,-0.3 0, 0.0 -0.606 123.0 -22.2 76.3-117.3 6.1 19.7 21.8 24 36CA S T 3 S+ 0 0 127 -2,-0.6 -1,-0.3 -3,-0.1 2,-0.2 0.140 132.4 66.3-107.8 10.8 8.6 22.5 21.6 25 37 A S E < S-I 22 0C 70 -3,-2.0 -3,-3.9 2,-0.0 2,-0.4 -0.701 75.6-125.0-127.2 177.4 6.5 25.1 23.4 26 38 A W E -I 21 0C 81 -5,-0.3 2,-0.4 -2,-0.2 -5,-0.3 -0.983 20.3-156.1-123.8 135.9 5.3 25.4 27.0 27 39 A A E -I 20 0C 29 -7,-2.7 -7,-2.2 -2,-0.4 2,-0.2 -0.967 21.4-117.9-118.3 145.1 1.6 25.8 27.9 28 40 A H E +I 19 0C 18 -2,-0.4 -9,-0.3 -9,-0.2 3,-0.1 -0.450 40.4 163.1 -71.0 135.2 0.2 27.4 31.0 29 41 A T E + 0 0 43 -11,-3.4 157,-0.3 1,-0.4 2,-0.3 0.656 55.7 1.4-124.7 -28.7 -1.8 24.7 32.8 30 42 A a E -I 18 0C 5 -12,-1.7 -12,-2.9 157,-0.1 -1,-0.4 -0.945 60.6-117.3-153.5 164.5 -2.4 25.9 36.4 31 43 A G E +I 17 0C 0 157,-2.7 12,-0.3 -2,-0.3 2,-0.3 -0.333 32.9 179.0 -92.4-175.9 -1.8 28.6 38.9 32 44 A G E -I 16 0C 0 -16,-1.0 -16,-2.3 -2,-0.1 2,-0.4 -0.964 25.6-116.8-169.0 172.4 0.3 28.2 42.1 33 45 A T E -IK 15 41C 0 8,-2.5 8,-3.1 -2,-0.3 2,-0.6 -0.972 20.7-131.6-125.5 129.0 1.6 30.1 45.1 34 46 A L E + K 0 40C 1 -20,-2.5 78,-3.0 -2,-0.4 6,-0.2 -0.688 34.3 165.8 -76.4 116.9 5.3 30.7 45.9 35 47 A I E + 0 0 2 4,-2.2 2,-0.3 -2,-0.6 5,-0.2 0.645 66.9 12.0-115.1 -15.7 5.6 29.8 49.5 36 48 A R E > S- K 0 39C 88 3,-1.8 3,-1.2 74,-0.1 -1,-0.3 -0.899 89.1 -99.6-147.0 163.0 9.5 29.6 49.9 37 49 A Q T 3 S+ 0 0 81 -2,-0.3 66,-2.1 1,-0.3 64,-0.1 0.766 128.2 27.8 -64.5 -18.8 12.2 30.8 47.3 38 50 A N T 3 S+ 0 0 40 64,-0.2 61,-2.8 62,-0.1 2,-0.4 0.164 113.8 75.6-122.6 23.6 12.4 27.1 46.2 39 51 A W E < -KL 36 98C 3 -3,-1.2 -4,-2.2 59,-0.2 -3,-1.8 -0.999 51.2-173.5-138.3 133.5 8.9 25.8 47.0 40 52 A V E -KL 34 97C 0 57,-2.1 57,-2.7 -2,-0.4 2,-0.5 -0.960 15.6-143.8-121.6 142.4 5.5 26.4 45.3 41 53 A M E +KL 33 96C 0 -8,-3.1 -8,-2.5 -2,-0.3 2,-0.2 -0.919 35.0 148.0-105.1 130.2 2.1 25.2 46.5 42 54 A T E - L 0 95C 0 53,-3.0 53,-2.5 -2,-0.5 2,-0.3 -0.747 50.8 -72.1-148.0-173.3 -0.4 24.0 43.9 43 55 A A >> - 0 0 0 -12,-0.3 3,-1.1 51,-0.3 4,-0.5 -0.643 33.3-133.3 -89.1 145.9 -3.3 21.5 43.5 44 56 A A G >4 S+ 0 0 0 -2,-0.3 3,-1.5 1,-0.2 4,-0.2 0.907 105.0 64.5 -67.7 -27.7 -2.4 17.8 43.3 45 57 A H G >4 S+ 0 0 53 1,-0.3 3,-0.6 2,-0.2 4,-0.3 0.728 92.7 62.6 -67.9 -16.6 -4.7 17.4 40.3 46 58 A a G <4 S+ 0 0 9 -3,-1.1 -1,-0.3 1,-0.2 3,-0.2 0.746 108.1 41.3 -73.3 -28.0 -2.5 19.8 38.3 47 59 A V G << S+ 0 0 14 -3,-1.5 -1,-0.2 -4,-0.5 -2,-0.2 0.101 80.0 105.7-109.2 23.6 0.5 17.3 38.6 48 60 A D < + 0 0 61 -3,-0.6 2,-0.3 -4,-0.2 -1,-0.1 0.910 69.3 77.0 -65.6 -36.2 -1.5 14.1 38.0 49 61 A R S S- 0 0 185 -4,-0.3 2,-2.5 -3,-0.2 0, 0.0 -0.573 87.3-132.2 -75.5 125.9 0.0 14.0 34.5 50 62 A E + 0 0 174 -2,-0.3 2,-0.2 2,-0.0 -1,-0.1 -0.403 59.8 139.2 -78.8 82.0 3.6 12.8 34.4 51 63 A L - 0 0 73 -2,-2.5 2,-0.6 -4,-0.1 -29,-0.1 -0.690 63.9 -94.0-115.3 177.5 4.6 15.9 32.1 52 64 A T - 0 0 70 -31,-0.3 -31,-1.8 -2,-0.2 2,-0.3 -0.876 52.2-167.7 -93.3 120.3 7.7 18.1 32.1 53 65 A F E -J 20 0C 12 -2,-0.6 21,-1.3 -33,-0.2 2,-0.3 -0.855 17.2-179.2-116.1 150.2 6.8 21.2 34.2 54 65AA R E -JM 19 73C 52 -35,-2.6 -35,-2.6 -2,-0.3 2,-0.4 -0.908 20.0-133.1-137.0 164.6 8.3 24.6 34.9 55 66 A V E -JM 18 72C 0 17,-2.5 17,-2.7 -2,-0.3 2,-0.5 -0.953 9.9-156.9-119.3 140.4 7.3 27.5 37.0 56 67 A V E -JM 17 71C 0 -39,-2.0 -39,-2.2 -2,-0.4 2,-0.3 -0.984 12.6-172.2-119.1 119.4 7.2 31.1 35.9 57 68 A V E +JM 16 70C 1 13,-2.6 13,-2.3 -2,-0.5 -41,-0.1 -0.817 66.6 27.8-111.3 151.4 7.4 33.7 38.6 58 69 A G S S+ 0 0 6 -43,-0.6 2,-0.2 50,-0.4 10,-0.2 0.779 87.0 152.4 71.6 30.5 6.9 37.5 38.1 59 70 A E + 0 0 16 -44,-0.4 -1,-0.2 -3,-0.3 3,-0.1 -0.639 18.8 152.1 -93.6 153.8 4.7 36.8 35.2 60 71 A H + 0 0 7 1,-0.3 85,-1.3 4,-0.2 2,-0.7 0.409 69.0 37.6-140.1 -59.5 1.9 39.1 34.0 61 72 A N B > -O 144 0D 14 3,-0.3 3,-1.1 83,-0.2 -1,-0.3 -0.939 64.7-158.3-107.1 118.2 1.3 38.7 30.2 62 73 A L T 3 S+ 0 0 34 81,-3.6 -1,-0.1 -2,-0.7 82,-0.1 0.748 89.4 44.7 -65.0 -30.0 1.6 35.1 29.1 63 74 A N T 3 S+ 0 0 114 80,-0.3 2,-0.3 2,-0.0 -1,-0.2 0.270 112.1 56.0 -97.7 7.1 2.3 35.9 25.4 64 75 A Q S < S- 0 0 117 -3,-1.1 2,-0.5 79,-0.2 -3,-0.3 -0.995 84.4-103.1-145.2 153.2 4.8 38.7 25.9 65 76 A N + 0 0 125 -2,-0.3 -3,-0.1 1,-0.2 -2,-0.0 -0.537 29.1 178.6 -77.6 123.6 8.0 39.7 27.6 66 77 A N - 0 0 26 -2,-0.5 -1,-0.2 -5,-0.1 -4,-0.0 0.556 41.4-125.5 -96.7 -14.8 7.2 41.7 30.7 67 78 A G S S+ 0 0 63 1,-0.0 -2,-0.1 2,-0.0 -8,-0.1 0.528 96.2 77.5 77.3 5.3 11.0 42.1 31.6 68 79 A T + 0 0 25 -10,-0.2 -9,-0.1 40,-0.0 40,-0.1 0.579 62.3 119.2-122.4 -9.2 10.2 40.6 35.1 69 80 A E - 0 0 25 -13,-0.0 2,-0.4 2,-0.0 -11,-0.2 -0.217 39.5-167.2 -69.2 146.1 9.9 36.8 34.6 70 81 A Q E -M 57 0C 42 -13,-2.3 -13,-2.6 2,-0.0 2,-0.5 -0.996 11.0-154.4-130.3 131.4 12.0 34.1 36.1 71 82 A Y E +M 56 0C 111 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.950 18.8 172.0-116.4 121.8 11.8 30.6 34.7 72 83 A V E -M 55 0C 8 -17,-2.7 -17,-2.5 -2,-0.5 2,-0.1 -0.993 26.8-124.4-132.7 138.4 12.6 27.6 36.9 73 84 A G E -M 54 0C 32 -2,-0.4 27,-3.4 -19,-0.2 2,-0.6 -0.333 26.4-116.8 -81.9 165.1 12.3 23.8 36.5 74 85 A V E -N 99 0C 32 -21,-1.3 25,-0.2 25,-0.3 -21,-0.2 -0.851 28.9-179.7 -96.5 119.3 10.5 21.6 39.0 75 86 A Q E + 0 0 112 23,-3.3 2,-0.3 -2,-0.6 24,-0.2 0.804 65.7 12.7-100.3 -22.5 12.8 19.2 40.7 76 87 A K E -N 98 0C 89 22,-1.5 22,-2.8 2,-0.0 2,-0.5 -0.994 58.4-155.6-152.6 141.6 10.5 17.2 43.0 77 88 A I E -N 97 0C 72 -2,-0.3 2,-0.5 20,-0.2 20,-0.2 -0.979 8.6-172.2-119.0 127.4 6.7 16.9 43.3 78 89 A V E -N 96 0C 29 18,-2.5 18,-2.7 -2,-0.5 2,-0.2 -0.942 8.1-170.2-123.1 106.3 5.2 15.9 46.7 79 90 A V E -N 95 0C 47 -2,-0.5 16,-0.2 16,-0.2 14,-0.1 -0.693 39.9 -87.6 -95.6 150.0 1.5 15.3 46.4 80 91 A H > - 0 0 19 14,-2.0 3,-2.0 12,-0.4 -1,-0.1 -0.400 38.0-126.6 -57.0 132.2 -0.6 14.8 49.6 81 92 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.705 107.1 48.2 -55.8 -25.6 -0.5 11.1 50.5 82 93 A Y T 3 S+ 0 0 160 10,-0.1 2,-0.1 2,-0.0 11,-0.1 0.393 79.6 122.6 -95.3 0.0 -4.3 10.8 50.6 83 94 A W < - 0 0 29 -3,-2.0 2,-0.5 9,-0.2 9,-0.1 -0.380 43.2-165.7 -63.4 135.8 -5.0 12.6 47.3 84 95 A N > - 0 0 72 7,-0.5 3,-2.3 3,-0.3 6,-0.2 -0.938 16.8-150.7-128.2 111.5 -7.0 10.3 45.0 85 96 A T T 3 S+ 0 0 82 -2,-0.5 3,-0.4 1,-0.3 -1,-0.1 0.739 97.6 50.7 -44.7 -37.2 -7.3 11.2 41.3 86 97 A D T 3 S+ 0 0 152 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.433 112.8 47.2 -83.6 -2.0 -10.7 9.6 40.9 87 98 A D X + 0 0 72 -3,-2.3 3,-1.3 4,-0.1 -3,-0.3 -0.507 53.6 156.2-139.3 73.3 -12.2 11.3 44.0 88 99 A V G > S+ 0 0 47 -3,-0.4 3,-1.8 1,-0.2 5,-0.2 0.843 77.3 65.1 -64.7 -26.5 -11.4 15.2 44.0 89 99AA A G 3 S+ 0 0 22 1,-0.3 -1,-0.2 3,-0.1 3,-0.1 0.719 87.6 70.1 -69.0 -16.8 -14.5 15.6 46.3 90 99BA A G < S- 0 0 36 -3,-1.3 -1,-0.3 1,-0.3 2,-0.2 0.706 102.7-138.9 -74.3 -21.4 -12.7 13.6 48.9 91 100 A G < + 0 0 3 -3,-1.8 -7,-0.5 -4,-0.3 -1,-0.3 -0.547 67.5 118.6 96.7-161.6 -10.3 16.6 49.3 92 101 A Y + 0 0 75 -2,-0.2 2,-2.0 1,-0.2 -12,-0.4 0.668 35.4 154.4 64.5 27.8 -6.5 16.5 49.7 93 102 A D + 0 0 0 -5,-0.2 2,-0.3 -49,-0.1 131,-0.2 -0.519 32.8 112.2 -86.8 76.8 -6.1 18.5 46.5 94 103 A I + 0 0 0 -2,-2.0 -14,-2.0 -51,-0.3 2,-0.3 -0.998 37.4 175.0-151.2 141.2 -2.7 19.9 47.4 95 104 A A E -LN 42 79C 0 -53,-2.5 -53,-3.0 -2,-0.3 2,-0.4 -0.998 18.7-144.7-149.2 149.5 0.8 19.5 46.2 96 105 A L E -LN 41 78C 0 -18,-2.7 -18,-2.5 -2,-0.3 2,-0.5 -0.948 12.7-159.1-113.4 130.8 4.2 21.0 46.9 97 106 A L E -LN 40 77C 0 -57,-2.7 -57,-2.1 -2,-0.4 2,-0.6 -0.913 8.1-148.2-115.3 124.2 6.8 21.5 44.1 98 107 A R E -LN 39 76C 53 -22,-2.8 -23,-3.3 -2,-0.5 -22,-1.5 -0.807 24.3-133.3 -88.9 126.0 10.5 21.9 45.0 99 108 A L E - 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