==== 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 3MO9 . 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) . 10733.0 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 . 81 33.8 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 . 16 6.7 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 . 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 . 5 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,-0.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 122.9 -11.3 -4.3 1.4 2 17 A V B 3 +A 182 0A 10 180,-2.3 180,-1.6 1,-0.2 134,-0.1 -0.752 360.0 8.7 -92.9 139.7 -14.8 -5.1 2.5 3 18 A G T 3 S+ 0 0 41 132,-0.6 146,-0.3 -2,-0.4 -1,-0.2 0.803 97.7 142.1 64.6 33.3 -16.2 -8.6 2.0 4 19 A G < - 0 0 21 -3,-0.6 2,-0.3 144,-0.1 144,-0.2 -0.321 45.1-134.6 -95.3 177.2 -12.8 -9.9 0.9 5 20 A T E -B 147 0B 90 142,-2.8 142,-2.5 -2,-0.1 2,-0.1 -0.940 37.7 -88.2-127.0 155.9 -10.9 -13.1 1.6 6 21 A E E -B 146 0B 107 -2,-0.3 140,-0.3 140,-0.2 2,-0.2 -0.411 46.5-125.4 -63.5 135.9 -7.3 -13.6 2.6 7 22 A A - 0 0 3 138,-2.7 2,-0.1 53,-0.1 138,-0.1 -0.499 22.5-105.4 -78.3 147.4 -5.0 -13.7 -0.4 8 23 A Q > - 0 0 128 -2,-0.2 3,-1.7 1,-0.1 4,-0.4 -0.478 39.8-113.5 -65.2 148.0 -2.6 -16.6 -1.0 9 24 A R T 3 S+ 0 0 116 1,-0.3 -1,-0.1 2,-0.1 3,-0.1 0.682 111.7 39.5 -70.1 -10.6 0.8 -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 0.234 88.8 93.1-117.7 17.4 2.1 -15.4 -3.7 11 26 A S S < S+ 0 0 50 -3,-1.7 -2,-0.1 1,-0.2 -1,-0.1 0.826 94.0 29.0 -77.4 -33.2 -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 -0.608 64.1 164.5-133.4 69.7 -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 0.616 72.9 61.2 -74.0 -11.0 3.5 -10.1 -6.1 14 29 A S T 3 S+ 0 0 10 95,-0.2 20,-2.4 97,-0.1 98,-0.2 0.492 79.3 110.1 -86.6 -3.5 3.2 -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 -0.492 48.1-173.3 -74.3 134.0 1.2 -5.3 -4.4 16 31 A I E -I 32 0C 1 16,-2.2 16,-0.8 -2,-0.2 2,-0.5 -0.907 22.2-131.6-124.8 160.6 3.0 -2.9 -2.0 17 32 A S E -IJ 31 56C 0 39,-2.3 39,-2.3 -2,-0.3 2,-0.6 -0.949 15.4-154.0-108.1 120.6 2.3 -1.3 1.3 18 33 A L E +IJ 30 55C 1 12,-3.1 11,-2.9 -2,-0.5 12,-1.7 -0.880 24.3 179.0 -94.6 123.3 2.9 2.5 1.6 19 34 A Q E -IJ 28 54C 10 35,-2.9 35,-2.9 -2,-0.6 2,-0.3 -0.907 17.4-148.9-127.9 153.0 3.7 3.3 5.2 20 35 A Y E -IJ 27 53C 51 7,-2.5 7,-2.3 -2,-0.3 2,-0.4 -0.889 31.8 -97.3-124.7 154.9 4.5 6.5 7.1 21 36 A R E -I 26 0C 121 31,-1.7 2,-0.5 -2,-0.3 31,-0.3 -0.540 37.7-178.8 -74.9 121.1 6.6 7.1 10.2 22 36AA S E > -I 25 0C 61 3,-3.9 3,-1.7 -2,-0.4 2,-0.5 -0.894 61.6 -59.1-123.0 93.4 4.3 7.3 13.2 23 36BA G T 3 S- 0 0 63 -2,-0.5 -2,-0.0 1,-0.3 0, 0.0 -0.560 119.1 -16.7 72.8-117.9 6.6 8.0 16.2 24 36CA S T 3 S+ 0 0 112 -2,-0.5 -1,-0.3 -3,-0.1 2,-0.2 0.334 135.0 55.1 -97.7 3.8 9.1 5.2 16.6 25 37 A S E < S-I 22 0C 76 -3,-1.7 -3,-3.9 -5,-0.0 2,-0.4 -0.722 78.4-114.7-131.3 176.7 7.1 3.0 14.3 26 38 A W E -I 21 0C 64 -5,-0.3 2,-0.4 -2,-0.2 -5,-0.2 -0.896 20.3-160.1-116.3 146.3 5.5 2.8 10.9 27 39 A A E -I 20 0C 30 -7,-2.3 -7,-2.5 -2,-0.4 2,-0.2 -0.989 23.9-116.2-126.0 137.4 1.8 2.6 10.0 28 40 A H E +I 19 0C 18 -2,-0.4 -9,-0.3 -9,-0.2 3,-0.1 -0.465 39.2 162.9 -64.3 132.5 0.3 1.4 6.8 29 41 A T E - 0 0 19 -11,-2.9 2,-0.3 1,-0.4 159,-0.2 0.658 56.6 -6.9-119.6 -38.2 -1.6 4.2 5.0 30 42 A C E -I 18 0C 7 -12,-1.7 -12,-3.1 157,-0.1 -1,-0.4 -0.931 58.4-119.5-151.1 172.4 -2.2 3.1 1.3 31 43 A G E +I 17 0C 2 157,-2.6 12,-0.4 -2,-0.3 2,-0.3 -0.412 28.6 166.5-106.2-171.5 -1.4 0.5 -1.3 32 44 A G E -I 16 0C 0 -16,-0.8 -16,-2.2 -2,-0.2 2,-0.4 -0.937 30.4-105.0 174.6 178.0 0.3 0.8 -4.6 33 45 A T E -IK 15 41C 0 8,-2.3 8,-2.9 -2,-0.3 2,-0.4 -0.997 22.6-124.5-135.0 132.7 1.9 -1.3 -7.4 34 46 A L E + K 0 40C 0 -20,-2.4 78,-3.7 -2,-0.4 6,-0.2 -0.606 34.6 166.0 -72.7 123.9 5.5 -2.0 -8.2 35 47 A I E + 0 0 3 4,-2.6 2,-0.3 -2,-0.4 5,-0.2 0.576 67.5 14.7-119.7 -18.6 6.0 -1.0 -11.9 36 48 A R E > S- K 0 39C 91 3,-1.9 3,-1.4 74,-0.1 -1,-0.4 -0.950 88.8 -99.3-140.3 166.6 9.8 -0.9 -12.1 37 49 A Q T 3 S+ 0 0 86 -2,-0.3 66,-2.3 1,-0.3 64,-0.1 0.831 127.9 25.9 -56.5 -25.5 12.4 -2.3 -9.7 38 50 A N T 3 S+ 0 0 49 64,-0.2 61,-2.5 62,-0.1 2,-0.4 0.169 112.5 76.6-124.1 20.8 12.7 1.3 -8.4 39 51 A W E < -KL 36 98C 5 -3,-1.4 -4,-2.6 59,-0.2 -3,-1.9 -0.997 51.0-170.5-133.3 137.5 9.2 2.8 -9.2 40 52 A V E -KL 34 97C 0 57,-2.4 57,-3.0 -2,-0.4 2,-0.5 -0.941 13.0-145.4-122.6 143.3 5.8 2.5 -7.6 41 53 A M E +KL 33 96C 0 -8,-2.9 -8,-2.3 -2,-0.4 2,-0.2 -0.915 33.5 146.8-108.6 130.2 2.5 3.7 -8.8 42 54 A T E - L 0 95C 0 53,-2.9 53,-2.3 -2,-0.5 2,-0.3 -0.763 50.1 -70.5-143.1-171.1 -0.1 4.9 -6.3 43 55 A A >> - 0 0 0 -12,-0.4 3,-1.2 51,-0.3 4,-0.6 -0.727 33.5-131.6 -89.8 140.0 -2.9 7.5 -6.0 44 56 A A G >4 S+ 0 0 0 -2,-0.3 3,-1.6 1,-0.2 -1,-0.1 0.897 106.4 59.4 -52.0 -44.6 -2.0 11.2 -5.7 45 57 A H G >4 S+ 0 0 52 1,-0.3 3,-0.8 2,-0.2 4,-0.3 0.711 93.9 66.6 -67.1 -16.1 -4.3 11.6 -2.7 46 58 A C G <4 S+ 0 0 5 -3,-1.2 3,-0.3 1,-0.2 -1,-0.3 0.811 106.4 41.1 -69.8 -28.0 -2.2 9.1 -0.8 47 59 A V G << S+ 0 0 15 -3,-1.6 -1,-0.2 -4,-0.6 -2,-0.2 0.085 79.6 106.6-112.4 26.5 0.8 11.4 -0.8 48 60 A D < + 0 0 63 -3,-0.8 -1,-0.2 2,-0.1 2,-0.1 0.874 66.1 81.8 -64.7 -40.0 -1.0 14.7 -0.1 49 61 A R S S- 0 0 124 -3,-0.3 2,-1.8 -4,-0.3 0, 0.0 -0.422 86.2-124.8 -76.0 144.5 0.4 14.7 3.4 50 62 A E + 0 0 191 -2,-0.1 2,-0.2 2,-0.0 -1,-0.1 -0.376 64.1 136.5 -82.4 57.7 3.9 15.9 4.2 51 63 A L - 0 0 61 -2,-1.8 2,-0.5 -4,-0.0 -31,-0.0 -0.503 63.5-103.5-100.5 167.6 4.9 12.7 5.9 52 64 A T - 0 0 91 -31,-0.3 -31,-1.7 -2,-0.2 2,-0.3 -0.858 47.7-162.0 -86.5 125.0 8.0 10.5 5.8 53 65 A F E -J 20 0C 15 -2,-0.5 21,-1.4 -33,-0.2 2,-0.3 -0.807 18.5-177.8-113.0 149.5 7.1 7.4 3.6 54 65AA R E -JM 19 73C 51 -35,-2.9 -35,-2.9 -2,-0.3 2,-0.4 -0.975 19.3-135.2-136.0 159.5 8.5 4.0 3.1 55 66 A V E -JM 18 72C 0 17,-3.2 17,-2.5 -2,-0.3 2,-0.5 -0.890 11.4-159.9-110.3 138.9 7.5 1.2 0.7 56 67 A V E -JM 17 71C 0 -39,-2.3 -39,-2.3 -2,-0.4 3,-0.3 -0.985 10.0-174.4-121.5 122.2 7.2 -2.4 1.8 57 68 A V E + M 0 70C 2 13,-2.2 13,-1.8 -2,-0.5 -41,-0.1 -0.760 68.5 31.0-107.9 160.1 7.3 -5.2 -0.9 58 69 A G S S+ 0 0 6 50,-0.5 10,-0.2 -43,-0.5 2,-0.2 0.758 86.1 153.5 63.7 21.9 6.7 -8.9 -0.3 59 70 A E + 0 0 19 -44,-0.4 -1,-0.2 -3,-0.3 3,-0.1 -0.558 14.4 151.8 -79.1 145.5 4.4 -7.9 2.5 60 71 A H + 0 0 9 1,-0.3 85,-1.6 4,-0.2 2,-0.6 0.446 68.7 32.7-133.8 -56.3 1.6 -10.3 3.6 61 72 A N B > -O 144 0D 14 3,-0.3 3,-1.2 83,-0.2 -1,-0.3 -0.926 64.7-157.5-106.5 117.2 0.7 -9.8 7.3 62 73 A L T 3 S+ 0 0 35 81,-3.0 -1,-0.1 -2,-0.6 82,-0.1 0.757 90.9 46.2 -64.4 -21.9 1.3 -6.3 8.5 63 74 A N T 3 S+ 0 0 112 80,-0.2 2,-0.3 2,-0.1 -1,-0.2 0.132 109.8 49.9-111.4 15.5 1.6 -7.3 12.1 64 75 A Q S < S- 0 0 123 -3,-1.2 2,-0.4 79,-0.1 -3,-0.3 -0.995 87.7 -98.6-148.5 149.1 4.0 -10.3 11.9 65 76 A N - 0 0 135 -2,-0.3 -3,-0.1 1,-0.2 -2,-0.1 -0.531 32.4-177.3 -65.6 121.8 7.4 -11.1 10.3 66 77 A N - 0 0 30 -2,-0.4 -1,-0.2 -5,-0.1 -4,-0.0 0.672 37.6-125.8 -89.6 -20.5 6.7 -13.0 7.0 67 78 A G S S+ 0 0 59 2,-0.0 -2,-0.1 0, 0.0 -8,-0.1 0.573 95.4 75.0 84.5 11.5 10.4 -13.5 6.1 68 79 A T + 0 0 29 -10,-0.2 2,-0.1 -11,-0.0 -9,-0.1 0.367 61.0 120.9-133.7 -1.5 9.9 -11.9 2.7 69 80 A E - 0 0 26 -13,-0.1 2,-0.4 2,-0.0 -11,-0.2 -0.443 37.5-167.4 -76.1 140.3 9.6 -8.1 3.2 70 81 A Q E -M 57 0C 43 -13,-1.8 -13,-2.2 -2,-0.1 2,-0.5 -0.997 12.4-152.5-117.6 136.1 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 -0.914 17.3 177.2-111.6 128.7 11.8 -2.1 3.1 72 83 A V E -M 55 0C 10 -17,-2.5 -17,-3.2 -2,-0.5 -2,-0.0 -0.995 25.5-124.8-139.1 132.6 12.7 0.8 0.9 73 84 A G E -M 54 0C 34 -2,-0.4 27,-2.6 -19,-0.2 2,-0.6 -0.331 28.1-116.8 -67.5 152.0 12.7 4.6 1.4 74 85 A V E +N 99 0C 31 -21,-1.4 25,-0.2 25,-0.2 -21,-0.2 -0.850 32.3 179.1 -91.5 124.7 10.8 6.8 -1.0 75 86 A Q E + 0 0 112 23,-2.6 2,-0.3 -2,-0.6 24,-0.2 0.829 63.0 12.4 -96.4 -42.6 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 -0.999 60.1-153.7-138.8 141.9 11.2 11.3 -5.1 77 88 A I E -N 97 0C 70 -2,-0.3 2,-0.6 20,-0.2 20,-0.2 -0.970 8.1-172.0-115.2 122.2 7.4 11.8 -5.4 78 89 A V E -N 96 0C 29 18,-3.3 18,-2.9 -2,-0.5 2,-0.3 -0.915 6.5-171.5-114.6 108.7 5.9 12.7 -8.8 79 90 A V E -N 95 0C 46 -2,-0.6 16,-0.2 16,-0.2 14,-0.1 -0.673 41.2 -89.9 -91.8 147.1 2.2 13.6 -8.7 80 91 A H > - 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