==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-APR-10 3MO3 . COMPND 2 MOLECULE: CHYMOTRYPSIN-LIKE ELASTASE FAMILY MEMBER 1; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR T.PETROVA,S.GINELL,Y.KIM,G.JOACHIMIAK,A.JOACHIMIAK . 240 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10771.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 151 62.9 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 . 80 33.3 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 . 4 1.7 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 . 15 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 4.6 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 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 . 4 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 0.000 360.0 360.0 360.0 121.6 -11.3 -4.4 1.4 2 17 A V B 3 +A 182 0A 10 180,-2.3 180,-1.9 1,-0.2 134,-0.1 -0.765 360.0 11.8 -92.5 138.3 -14.8 -5.1 2.6 3 18 A G T 3 S+ 0 0 40 132,-0.6 146,-0.3 -2,-0.4 -1,-0.2 0.772 98.1 140.8 69.4 29.8 -16.2 -8.5 1.9 4 19 A G < - 0 0 21 -3,-0.6 2,-0.3 144,-0.1 144,-0.2 -0.262 45.3-135.4 -95.3 179.9 -12.8 -9.9 0.9 5 20 A T E -B 147 0B 88 142,-2.5 142,-2.5 -2,-0.1 2,-0.2 -0.939 38.0 -87.1-131.3 154.4 -11.0 -13.1 1.5 6 21 A E E -B 146 0B 117 -2,-0.3 140,-0.2 140,-0.2 2,-0.2 -0.439 46.3-128.3 -65.4 133.1 -7.4 -13.7 2.6 7 22 A A - 0 0 4 138,-2.6 2,-0.1 -2,-0.2 138,-0.1 -0.488 22.2-105.3 -76.7 149.9 -5.0 -13.8 -0.4 8 23 A Q > - 0 0 134 -2,-0.2 3,-1.8 1,-0.1 4,-0.4 -0.474 38.4-112.6 -67.2 150.2 -2.5 -16.5 -1.0 9 24 A R T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 3,-0.1 0.722 112.8 37.8 -69.4 -14.9 0.9 -15.2 -0.2 10 25 A N T 3 S+ 0 0 73 1,-0.1 -1,-0.3 99,-0.0 -2,-0.0 0.227 89.3 95.3-115.4 19.8 2.2 -15.4 -3.7 11 26 A S S < S+ 0 0 52 -3,-1.8 -2,-0.1 1,-0.2 -1,-0.1 0.871 94.0 25.7 -73.9 -36.9 -1.0 -14.3 -5.7 12 27 A W > + 0 0 26 -4,-0.4 3,-1.7 1,-0.1 -1,-0.2 -0.638 65.4 166.1-132.4 68.6 -0.3 -10.6 -6.1 13 28 A P T 3 S+ 0 0 34 0, 0.0 97,-1.4 0, 0.0 45,-0.3 0.613 72.3 62.4 -74.6 -6.7 3.4 -10.1 -6.0 14 29 A S T 3 S+ 0 0 9 95,-0.2 20,-2.8 97,-0.1 98,-0.2 0.541 78.7 110.2 -89.7 -4.3 3.3 -6.5 -7.4 15 30 A Q E < -I 33 0C 8 -3,-1.7 43,-0.5 18,-0.2 44,-0.4 -0.452 48.1-173.2 -70.1 133.0 1.2 -5.2 -4.4 16 31 A I E -IJ 32 57C 1 16,-2.2 16,-0.8 -2,-0.2 2,-0.5 -0.902 21.8-133.2-121.2 161.2 3.1 -2.8 -2.1 17 32 A S E -IJ 31 56C 0 39,-2.2 39,-2.2 -2,-0.3 2,-0.5 -0.968 15.9-153.3-108.6 123.4 2.2 -1.2 1.3 18 33 A L E -IJ 30 55C 0 12,-3.3 11,-3.0 -2,-0.5 12,-1.7 -0.879 23.6-179.0 -95.8 126.1 3.0 2.5 1.6 19 34 A Q E -IJ 28 54C 10 35,-2.7 35,-2.3 -2,-0.5 2,-0.3 -0.874 17.2-147.4-127.0 157.1 3.7 3.3 5.2 20 35 A Y E -IJ 27 53C 54 7,-2.3 7,-2.2 -2,-0.3 2,-0.4 -0.912 29.6-101.4-127.4 155.3 4.5 6.5 7.1 21 36 A R E -I 26 0C 123 31,-1.8 2,-0.5 -2,-0.3 31,-0.3 -0.590 35.8-178.3 -80.3 128.4 6.6 7.1 10.2 22 36AA S E > -I 25 0C 62 3,-3.6 3,-2.0 -2,-0.4 2,-0.4 -0.923 60.7 -59.7-128.9 98.7 4.5 7.5 13.2 23 36BA G T 3 S- 0 0 69 -2,-0.5 -2,-0.0 1,-0.3 0, 0.0 -0.458 119.4 -15.8 62.8-115.8 6.7 8.1 16.3 24 36CA S T 3 S+ 0 0 115 -2,-0.4 -1,-0.3 -3,-0.1 2,-0.2 0.409 133.1 55.4 -98.4 0.5 9.1 5.2 16.7 25 37 A S E < S-I 22 0C 78 -3,-2.0 -3,-3.6 -5,-0.0 2,-0.3 -0.693 76.9-116.6-129.9 175.7 7.0 2.9 14.4 26 38 A W E -I 21 0C 67 -5,-0.2 2,-0.4 -2,-0.2 -5,-0.2 -0.875 21.6-159.8-117.4 151.0 5.6 2.7 10.9 27 39 A A E -I 20 0C 31 -7,-2.2 -7,-2.3 -2,-0.3 2,-0.1 -0.996 22.7-114.9-134.9 137.0 1.9 2.6 9.9 28 40 A H E +I 19 0C 19 -2,-0.4 -9,-0.3 -9,-0.2 3,-0.1 -0.408 39.9 160.3 -62.2 132.0 0.2 1.4 6.7 29 41 A T E - 0 0 21 -11,-3.0 2,-0.3 1,-0.4 157,-0.2 0.662 57.2 -4.0-119.0 -38.6 -1.6 4.2 4.9 30 42 A C E -I 18 0C 7 -12,-1.7 -12,-3.3 157,-0.1 -1,-0.4 -0.948 58.8-120.4-150.8 166.1 -2.1 3.2 1.3 31 43 A G E +I 17 0C 2 157,-2.7 12,-0.4 -2,-0.3 2,-0.3 -0.396 29.5 170.3-100.7-173.7 -1.4 0.5 -1.3 32 44 A G E -I 16 0C 0 -16,-0.8 -16,-2.2 -2,-0.1 2,-0.4 -0.939 29.5-108.4 179.4 174.7 0.4 0.8 -4.6 33 45 A T E -IK 15 41C 0 8,-2.4 8,-3.0 -2,-0.3 2,-0.5 -0.992 23.1-126.6-127.9 131.3 1.8 -1.3 -7.4 34 46 A L E + K 0 40C 0 -20,-2.8 78,-3.5 -2,-0.4 6,-0.2 -0.641 35.0 166.4 -71.8 122.5 5.5 -2.0 -8.2 35 47 A I E + 0 0 3 4,-2.5 2,-0.3 -2,-0.5 5,-0.2 0.632 66.0 13.9-117.4 -21.8 6.0 -1.0 -11.9 36 48 A R E > S- K 0 39C 92 3,-1.7 3,-1.3 74,-0.1 -1,-0.4 -0.940 89.6 -98.1-135.0 166.9 9.8 -0.9 -12.1 37 49 A Q T 3 S+ 0 0 83 -2,-0.3 66,-2.3 1,-0.3 64,-0.1 0.818 127.6 25.7 -56.9 -22.8 12.4 -2.2 -9.7 38 50 A N T 3 S+ 0 0 51 64,-0.2 61,-3.1 62,-0.1 2,-0.4 0.220 111.8 77.1-126.5 19.7 12.7 1.3 -8.4 39 51 A W E < -KL 36 98C 6 -3,-1.3 -4,-2.5 59,-0.2 -3,-1.7 -0.993 51.6-168.5-131.7 139.1 9.2 2.9 -9.2 40 52 A V E -KL 34 97C 0 57,-2.5 57,-2.9 -2,-0.4 2,-0.5 -0.929 12.7-145.0-121.0 139.5 5.9 2.5 -7.5 41 53 A M E +KL 33 96C 0 -8,-3.0 -8,-2.4 -2,-0.4 2,-0.2 -0.918 34.3 146.8-102.8 130.5 2.5 3.6 -8.8 42 54 A T E - L 0 95C 0 53,-2.7 53,-2.2 -2,-0.5 2,-0.3 -0.739 50.3 -71.6-144.9-173.0 -0.1 4.9 -6.3 43 55 A A >> - 0 0 0 -12,-0.4 3,-1.0 51,-0.3 4,-0.5 -0.716 33.8-131.8 -87.9 140.8 -2.9 7.4 -5.9 44 56 A A G >4 S+ 0 0 0 -2,-0.3 3,-1.4 1,-0.2 -1,-0.1 0.881 105.7 60.9 -56.4 -38.5 -2.1 11.1 -5.8 45 57 A H G >4 S+ 0 0 56 1,-0.3 3,-0.9 2,-0.2 4,-0.3 0.744 93.9 65.5 -68.1 -18.8 -4.3 11.6 -2.7 46 58 A C G <4 S+ 0 0 3 -3,-1.0 -1,-0.3 1,-0.2 3,-0.2 0.757 106.3 41.8 -69.8 -25.9 -2.2 9.1 -0.7 47 59 A V G << S+ 0 0 14 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.125 80.7 104.7-111.9 24.2 0.8 11.4 -0.9 48 60 A D < + 0 0 60 -3,-0.9 -1,-0.1 2,-0.1 2,-0.1 0.887 66.8 80.9 -65.5 -40.2 -1.0 14.7 -0.2 49 61 A R S S- 0 0 124 -4,-0.3 2,-1.9 -3,-0.2 0, 0.0 -0.421 87.8-122.6 -74.3 144.0 0.3 14.7 3.4 50 62 A E + 0 0 196 -2,-0.1 2,-0.2 2,-0.0 -1,-0.1 -0.367 64.4 138.2 -79.3 60.1 3.8 16.0 4.2 51 63 A L - 0 0 62 -2,-1.9 2,-0.6 -4,-0.0 -31,-0.0 -0.502 62.7-104.8-102.8 165.7 4.9 12.6 5.8 52 64 A T - 0 0 91 -31,-0.3 -31,-1.8 -2,-0.2 2,-0.3 -0.869 48.0-163.7 -86.8 123.6 8.0 10.4 5.8 53 65 A F E -J 20 0C 15 -2,-0.6 21,-1.4 -33,-0.2 2,-0.3 -0.792 18.5-179.2-113.1 150.4 7.1 7.4 3.6 54 65AA R E -JM 19 73C 50 -35,-2.3 -35,-2.7 -2,-0.3 2,-0.4 -0.963 19.7-135.8-136.0 159.3 8.5 4.0 3.0 55 66 A V E -JM 18 72C 0 17,-3.0 17,-2.6 -2,-0.3 2,-0.5 -0.914 10.8-159.5-112.1 142.8 7.4 1.2 0.7 56 67 A V E -JM 17 71C 0 -39,-2.2 -39,-2.2 -2,-0.4 3,-0.3 -0.987 9.8-173.2-123.4 123.1 7.3 -2.4 1.8 57 68 A V E +JM 16 70C 2 13,-2.2 13,-1.9 -2,-0.5 -41,-0.1 -0.735 69.1 32.1-109.8 160.9 7.3 -5.1 -0.9 58 69 A G S S+ 0 0 5 50,-0.5 2,-0.3 -43,-0.5 10,-0.3 0.790 85.2 151.6 62.1 26.8 6.8 -8.8 -0.3 59 70 A E + 0 0 18 -44,-0.4 -1,-0.2 -3,-0.3 3,-0.1 -0.665 14.8 153.5 -87.9 144.3 4.4 -7.9 2.6 60 71 A H + 0 0 10 1,-0.4 85,-1.8 -2,-0.3 2,-0.6 0.509 69.6 32.8-129.6 -54.5 1.6 -10.3 3.6 61 72 A N B > -O 144 0D 11 3,-0.3 3,-1.1 83,-0.2 -1,-0.4 -0.931 64.4-157.2-108.9 119.0 0.8 -9.8 7.3 62 73 A L T 3 S+ 0 0 37 81,-2.9 -1,-0.1 -2,-0.6 82,-0.1 0.757 92.2 44.4 -66.7 -22.3 1.3 -6.2 8.5 63 74 A N T 3 S+ 0 0 116 80,-0.2 2,-0.3 2,-0.0 -1,-0.2 0.111 109.9 53.8-112.0 17.5 1.6 -7.3 12.1 64 75 A Q S < S- 0 0 124 -3,-1.1 2,-0.4 79,-0.1 -3,-0.3 -0.997 86.7-102.4-146.9 149.0 4.0 -10.3 11.8 65 76 A N - 0 0 134 -2,-0.3 -3,-0.1 1,-0.2 -2,-0.0 -0.572 31.7-176.9 -69.9 124.1 7.4 -11.1 10.2 66 77 A N - 0 0 29 -2,-0.4 -1,-0.2 -5,-0.1 -4,-0.0 0.595 35.8-127.8 -94.9 -16.9 6.7 -12.9 7.0 67 78 A G S S+ 0 0 61 1,-0.0 -2,-0.1 2,-0.0 -8,-0.1 0.534 94.8 75.4 80.1 8.0 10.4 -13.5 6.1 68 79 A T + 0 0 28 -10,-0.3 2,-0.1 40,-0.0 -9,-0.1 0.384 62.8 118.0-128.8 -2.7 9.9 -12.0 2.7 69 80 A E - 0 0 26 -13,-0.1 2,-0.4 2,-0.0 -11,-0.2 -0.449 38.8-167.1 -79.3 143.7 9.6 -8.2 3.1 70 81 A Q E -M 57 0C 45 -13,-1.9 -13,-2.2 -2,-0.1 2,-0.5 -0.994 11.8-152.8-121.5 136.1 12.0 -5.6 1.7 71 82 A Y E +M 56 0C 112 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.935 17.7 176.2-114.5 127.9 11.7 -2.1 3.1 72 83 A V E -M 55 0C 10 -17,-2.6 -17,-3.0 -2,-0.5 2,-0.2 -0.972 25.6-122.8-133.4 143.4 12.8 0.8 0.9 73 84 A G E -M 54 0C 31 -2,-0.4 27,-2.7 -19,-0.2 2,-0.6 -0.485 27.4-115.2 -79.1 155.5 12.6 4.6 1.4 74 85 A V E +N 99 0C 32 -21,-1.4 25,-0.2 25,-0.2 -21,-0.2 -0.851 32.2 178.2 -92.2 119.7 10.8 6.9 -1.0 75 86 A Q E + 0 0 111 23,-2.5 2,-0.3 -2,-0.6 24,-0.2 0.842 64.1 11.4 -91.4 -40.8 13.3 9.2 -2.7 76 87 A K E -N 98 0C 88 22,-1.5 22,-2.4 2,-0.0 2,-0.5 -0.998 59.1-153.9-142.2 143.7 11.1 11.2 -5.1 77 88 A I E -N 97 0C 69 -2,-0.3 2,-0.6 20,-0.2 20,-0.2 -0.981 8.6-173.2-118.8 121.8 7.4 11.7 -5.4 78 89 A V E -N 96 0C 29 18,-3.2 18,-2.6 -2,-0.5 2,-0.3 -0.918 7.5-171.6-113.6 107.4 5.9 12.8 -8.8 79 90 A V E -N 95 0C 45 -2,-0.6 16,-0.2 16,-0.2 14,-0.1 -0.674 41.0 -87.8 -93.7 149.3 2.2 13.5 -8.6 80 91 A H > - 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