==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-FEB-13 4JCT . COMPND 2 MOLECULE: ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES; . AUTHOR E.ZEILER,A.LIST,F.ALTE,M.GERSCH,R.WACHTEL,M.GROLL,S.SIEBER . 1288 14 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49156.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 918 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 182 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 104 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 89 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 461 35.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 1.6 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 0 0 4 24 0 0 0 0 0 7 0 0 0 7 0 0 0 0 0 7 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 7 7 14 7 0 7 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 . 1 7 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 7 0 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 3 A L 0 0 106 0, 0.0 1150,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 122.3 6.2 -32.8 26.4 2 4 A I - 0 0 78 10,-0.0 1128,-0.1 2,-0.0 1127,-0.0 -0.911 360.0-133.2-108.9 101.0 7.1 -30.4 29.2 3 5 A P - 0 0 0 0, 0.0 9,-1.9 0, 0.0 2,-0.6 -0.118 10.9-134.7 -58.0 153.3 6.6 -32.3 32.5 4 6 A T - 0 0 47 7,-0.2 7,-0.2 1123,-0.1 1123,-0.1 -0.749 15.1-157.9-122.9 82.9 4.6 -30.6 35.3 5 7 A V - 0 0 12 -2,-0.6 5,-3.3 4,-0.1 2,-0.5 -0.287 5.9-149.2 -56.2 133.1 6.1 -30.8 38.8 6 8 A I 0 0 54 3,-0.3 -1,-0.1 1124,-0.2 1120,-0.0 -0.954 360.0 360.0-106.7 122.3 3.8 -30.3 41.8 7 9 A E 0 0 123 -2,-0.5 -2,-0.0 0, 0.0 8,-0.0 -0.602 360.0 360.0 -75.9 360.0 5.4 -28.8 44.9 8 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 9 17 A A 0 0 73 0, 0.0 -3,-0.3 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 77.2 1.9 -27.1 40.1 10 18 A Y - 0 0 20 -5,-3.3 2,-0.2 2,-0.0 181,-0.1 -0.620 360.0-120.2-100.9 161.0 4.8 -25.9 38.0 11 19 A D >> - 0 0 25 -7,-0.2 4,-2.0 -2,-0.2 3,-0.7 -0.654 46.7 -97.6 -87.3 161.9 6.1 -26.7 34.5 12 20 A I H 3> S+ 0 0 0 -9,-1.9 4,-1.9 1,-0.3 5,-0.1 0.848 123.9 47.3 -55.0 -42.2 9.7 -28.1 34.6 13 21 A Y H 3> S+ 0 0 19 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.812 110.1 53.4 -67.4 -33.4 11.4 -24.7 33.7 14 22 A S H <> S+ 0 0 3 -3,-0.7 4,-1.4 2,-0.2 -1,-0.2 0.839 107.0 52.4 -68.8 -33.4 9.3 -22.9 36.3 15 23 A R H < S+ 0 0 14 -4,-2.0 4,-0.5 2,-0.2 -2,-0.2 0.917 111.9 45.5 -66.7 -42.9 10.4 -25.4 38.9 16 24 A L H ><>S+ 0 0 4 -4,-1.9 5,-2.0 1,-0.2 3,-1.3 0.859 106.3 60.2 -64.3 -37.2 14.0 -24.7 37.9 17 25 A L H ><5S+ 0 0 5 -4,-2.1 3,-1.8 1,-0.3 -1,-0.2 0.841 95.8 62.3 -60.2 -33.3 13.2 -20.9 38.0 18 26 A K T 3<5S+ 0 0 106 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.736 102.6 50.1 -64.1 -25.2 12.4 -21.3 41.6 19 27 A D T < 5S- 0 0 73 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.036 127.9-101.6-100.2 23.7 16.0 -22.4 42.2 20 28 A R T < 5S+ 0 0 24 -3,-1.8 33,-2.8 1,-0.2 2,-0.5 0.702 77.2 140.7 67.0 27.6 17.2 -19.3 40.3 21 29 A I E < -a 53 0A 26 -5,-2.0 2,-0.5 31,-0.2 -1,-0.2 -0.871 32.5-168.0-107.8 127.8 18.0 -21.2 37.1 22 30 A I E -a 54 0A 0 31,-3.1 33,-3.0 -2,-0.5 2,-0.8 -0.962 9.9-151.2-114.8 126.9 17.2 -19.8 33.6 23 31 A M E -a 55 0A 24 -2,-0.5 2,-1.0 31,-0.2 33,-0.2 -0.845 13.2-178.6-103.5 103.9 17.4 -22.1 30.6 24 32 A L E +a 56 0A 3 31,-2.7 33,-2.6 -2,-0.8 4,-0.1 -0.790 25.0 148.7 -95.7 88.9 18.4 -20.3 27.3 25 33 A G + 0 0 10 -2,-1.0 2,-0.3 31,-0.2 1125,-0.2 -0.203 45.8 51.5-121.9 42.3 18.2 -23.3 25.0 26 34 A S S S- 0 0 45 1124,-0.0 34,-0.3 3,-0.0 31,-0.1 -0.967 94.9 -54.6-161.2 172.6 17.1 -22.0 21.6 27 35 A A - 0 0 51 -2,-0.3 2,-1.1 31,-0.1 34,-0.2 -0.353 58.8-118.5 -56.3 130.3 17.7 -19.4 18.8 28 36 A I B +g 61 0B 2 32,-3.7 34,-2.5 4,-0.1 38,-0.2 -0.668 51.7 149.2 -82.6 98.2 17.7 -15.9 20.3 29 37 A D > - 0 0 70 -2,-1.1 4,-2.6 32,-0.2 5,-0.1 -0.572 63.9 -85.0-110.1-173.7 14.9 -13.9 18.7 30 38 A D H > S+ 0 0 51 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.748 125.4 54.2 -70.7 -25.5 12.8 -11.1 20.3 31 39 A N H > S+ 0 0 101 2,-0.2 4,-1.5 1,-0.1 -1,-0.2 0.922 112.9 43.1 -69.0 -47.3 10.3 -13.4 22.0 32 40 A V H > S+ 0 0 28 2,-0.2 4,-2.7 -5,-0.2 5,-0.3 0.897 112.2 54.7 -62.8 -45.6 13.1 -15.4 23.7 33 41 A A H X S+ 0 0 1 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.959 109.1 47.5 -49.5 -55.8 14.9 -12.1 24.5 34 42 A N H X S+ 0 0 6 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.794 112.5 49.5 -58.8 -34.3 11.7 -10.8 26.3 35 43 A S H X S+ 0 0 13 -4,-1.5 4,-1.4 2,-0.2 -1,-0.2 0.896 112.8 45.2 -73.4 -43.1 11.3 -14.0 28.2 36 44 A I H X S+ 0 0 6 -4,-2.7 4,-2.5 2,-0.2 3,-0.3 0.942 114.1 49.5 -65.7 -49.1 14.9 -14.2 29.5 37 45 A V H X S+ 0 0 0 -4,-2.9 4,-2.7 -5,-0.3 -1,-0.2 0.887 110.9 50.4 -52.6 -43.6 14.9 -10.5 30.4 38 46 A S H X S+ 0 0 0 -4,-1.5 4,-1.6 -5,-0.3 -1,-0.2 0.797 110.3 50.4 -68.9 -29.8 11.6 -11.0 32.2 39 47 A Q H X S+ 0 0 10 -4,-1.4 4,-2.3 -3,-0.3 -2,-0.2 0.865 111.7 46.4 -74.8 -39.2 13.1 -13.9 34.1 40 48 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.917 112.6 50.6 -68.2 -45.6 16.2 -11.9 35.1 41 49 A L H X S+ 0 0 16 -4,-2.7 4,-1.5 -5,-0.2 -2,-0.2 0.897 112.7 46.9 -56.1 -45.7 14.0 -9.0 36.2 42 50 A F H X S+ 0 0 16 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.947 112.4 48.8 -62.0 -50.5 11.9 -11.3 38.3 43 51 A L H X S+ 0 0 4 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.849 111.0 49.3 -62.1 -38.5 14.8 -13.1 39.9 44 52 A D H < S+ 0 0 23 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.847 111.0 50.9 -68.2 -35.8 16.6 -9.9 40.9 45 53 A A H < S+ 0 0 61 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.718 109.6 50.4 -75.9 -24.8 13.4 -8.5 42.4 46 54 A Q H < S- 0 0 97 -4,-1.5 -2,-0.2 1,-0.3 -1,-0.2 0.938 136.7 -6.3 -74.6 -51.9 12.8 -11.7 44.5 47 55 A D < - 0 0 47 -4,-2.1 -1,-0.3 -5,-0.1 3,-0.2 -0.863 55.4-173.4-149.1 111.1 16.4 -11.6 45.9 48 56 A P S S+ 0 0 55 0, 0.0 31,-0.1 0, 0.0 -4,-0.1 0.600 86.9 55.6 -76.2 -10.4 19.1 -9.2 44.7 49 57 A E S S+ 0 0 143 29,-0.1 2,-0.3 2,-0.1 30,-0.2 0.741 89.0 79.3 -99.2 -27.4 21.7 -11.0 46.8 50 58 A K S S- 0 0 129 -3,-0.2 -3,-0.1 -7,-0.2 28,-0.1 -0.637 84.3-107.1 -86.7 142.8 21.5 -14.6 45.6 51 59 A D - 0 0 35 -2,-0.3 2,-0.4 27,-0.1 29,-0.2 -0.139 22.8-133.7 -66.6 157.8 23.2 -15.6 42.3 52 60 A I E - b 0 80A 0 27,-2.8 29,-3.1 2,-0.0 2,-0.7 -0.943 9.6-148.1-115.6 136.7 21.4 -16.4 39.0 53 61 A F E -ab 21 81A 69 -33,-2.8 -31,-3.1 -2,-0.4 2,-0.7 -0.894 13.7-172.9-110.3 107.0 22.3 -19.5 36.9 54 62 A L E -ab 22 82A 0 27,-2.8 29,-2.1 -2,-0.7 2,-0.4 -0.874 8.9-156.2-106.0 110.4 21.8 -19.0 33.2 55 63 A Y E -ab 23 83A 20 -33,-3.0 -31,-2.7 -2,-0.7 2,-0.6 -0.721 9.0-155.8 -88.9 129.2 22.3 -22.1 31.1 56 64 A I E +ab 24 84A 0 27,-3.1 29,-2.8 -2,-0.4 -31,-0.2 -0.924 34.1 146.4-116.4 117.2 23.3 -21.5 27.5 57 65 A N E + 0 0 3 -33,-2.6 31,-0.2 -2,-0.6 29,-0.1 -0.728 37.7 134.8-138.0 85.6 22.6 -24.0 24.6 58 66 A S E - b 0 88A 0 29,-2.0 31,-2.5 -2,-0.2 34,-0.2 -0.993 57.1-149.0-144.9 131.3 22.0 -21.7 21.7 59 67 A P - 0 0 47 0, 0.0 2,-0.4 0, 0.0 32,-0.2 0.566 59.8-123.2 -69.7 -8.4 23.0 -21.3 18.0 60 68 A G + 0 0 3 -34,-0.3 -32,-3.7 30,-0.2 2,-0.4 -0.835 39.7 175.8 107.8-141.4 22.6 -17.6 18.5 61 69 A G B +g 28 0B 41 -2,-0.4 -32,-0.2 -34,-0.2 30,-0.1 -0.996 43.8 35.2 144.1-137.7 20.4 -15.2 16.6 62 70 A S > - 0 0 34 -34,-2.5 4,-2.1 -2,-0.4 5,-0.2 -0.314 54.9-149.2 -61.1 130.4 19.2 -11.6 16.6 63 71 A I H > S+ 0 0 17 56,-0.7 4,-2.0 2,-0.2 -1,-0.1 0.909 96.9 45.3 -68.3 -44.4 22.0 -9.1 17.6 64 72 A S H > S+ 0 0 15 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.780 112.4 53.8 -74.5 -25.1 19.7 -6.5 19.2 65 73 A A H >> S+ 0 0 0 2,-0.2 4,-1.4 -37,-0.2 3,-0.6 0.939 110.9 43.9 -68.6 -50.2 17.8 -9.3 21.0 66 74 A G H 3X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.2 -2,-0.2 0.860 109.7 57.5 -62.6 -35.8 20.9 -10.8 22.6 67 75 A M H 3X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.727 101.5 55.9 -69.0 -24.5 22.1 -7.3 23.4 68 76 A A H - d 0 113A 7 -31,-2.5 3,-2.5 -2,-0.5 2,-0.2 -0.907 50.7 -34.6-119.9 141.4 27.5 -20.0 19.0 90 98 A S T 3> S+ 0 0 20 23,-1.9 4,-2.3 -2,-0.4 3,-0.2 -0.350 139.6 12.7 56.6-113.7 27.6 -16.3 18.0 91 99 A M H 3> S+ 0 0 3 1,-0.2 4,-1.6 -2,-0.2 -1,-0.3 0.727 130.3 58.6 -67.0 -20.7 25.2 -14.5 20.4 92 100 A G H <> S+ 0 0 0 -3,-2.5 4,-1.8 -34,-0.2 -1,-0.2 0.923 109.5 41.7 -68.2 -47.3 25.2 -17.6 22.5 93 101 A S H > S+ 0 0 1 20,-0.4 4,-1.8 1,-0.2 -2,-0.2 0.823 112.6 56.1 -69.5 -32.5 29.0 -17.5 23.0 94 102 A F H X S+ 0 0 3 -4,-2.3 4,-1.0 2,-0.2 -1,-0.2 0.869 108.9 45.7 -67.7 -39.4 28.7 -13.7 23.5 95 103 A L H < S+ 0 0 0 -4,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.859 108.8 57.4 -70.6 -34.9 26.3 -14.1 26.3 96 104 A L H >< S+ 0 0 2 -4,-1.8 3,-1.0 1,-0.2 -2,-0.2 0.899 110.2 42.8 -60.4 -43.3 28.5 -16.8 27.8 97 105 A T H 3< S+ 0 0 2 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.743 103.5 68.2 -74.9 -23.8 31.5 -14.5 28.0 98 106 A A T 3< S+ 0 0 8 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.456 80.7 114.2 -75.0 -0.8 29.2 -11.8 29.3 99 107 A G S < S- 0 0 7 -3,-1.0 -18,-0.2 1,-0.2 5,-0.2 -0.099 81.4 -71.1 -66.1 169.1 28.8 -13.8 32.5 100 108 A A > - 0 0 18 -20,-3.0 3,-2.3 3,-0.3 -18,-0.2 -0.336 61.6 -89.6 -65.1 140.8 30.0 -12.6 35.9 101 109 A N T 3 S+ 0 0 136 1,-0.3 -1,-0.1 2,-0.2 -3,-0.0 -0.223 112.7 8.9 -53.7 133.7 33.8 -12.6 36.5 102 110 A G T 3 S+ 0 0 49 -3,-0.1 -1,-0.3 2,-0.1 -2,-0.1 0.301 117.6 83.6 75.7 -6.9 35.1 -15.9 37.9 103 111 A K < + 0 0 54 -3,-2.3 -21,-1.6 -23,-0.1 2,-0.5 -0.055 54.7 109.9-122.6 32.9 31.7 -17.4 37.3 104 112 A R E +c 82 0A 7 -23,-0.2 75,-2.4 -5,-0.2 76,-1.6 -0.939 43.3 172.5-112.8 119.2 31.6 -18.5 33.6 105 113 A F E -ce 83 180A 36 -23,-3.6 -21,-2.6 -2,-0.5 2,-0.3 -0.760 21.4-164.1-125.0 164.9 31.6 -22.2 32.9 106 114 A A E -ce 84 181A 0 74,-1.0 76,-1.2 -2,-0.3 -21,-0.2 -0.982 28.8-115.9-145.8 139.7 31.3 -24.8 30.2 107 115 A L > - 0 0 2 -23,-2.6 3,-2.2 -2,-0.3 76,-0.2 -0.557 43.9-100.4 -74.3 143.6 30.6 -28.5 30.3 108 116 A P T 3 S+ 0 0 42 0, 0.0 61,-0.6 0, 0.0 62,-0.3 0.625 117.6 40.2 -41.4 -33.0 33.5 -30.6 29.0 109 117 A N T 3 S+ 0 0 25 1074,-0.2 2,-0.3 59,-0.1 1074,-0.1 0.020 80.7 134.6-112.4 27.8 32.0 -31.3 25.5 110 118 A A < - 0 0 3 -3,-2.2 2,-0.5 -26,-0.2 -23,-0.2 -0.581 50.1-135.6 -79.0 134.3 30.5 -27.9 24.7 111 119 A E E -d 87 0A 6 -25,-3.0 -23,-2.7 -2,-0.3 2,-0.5 -0.813 21.2-165.5 -88.3 124.2 31.1 -26.5 21.2 112 120 A I E -dF 88 167A 2 55,-2.1 55,-2.6 -2,-0.5 2,-0.5 -0.956 8.2-174.4-112.0 128.6 31.9 -22.8 21.2 113 121 A M E -dF 89 166A 7 -25,-1.9 -23,-1.9 -2,-0.5 -20,-0.4 -0.978 10.4-172.3-121.0 116.4 31.8 -20.7 18.1 114 122 A I + 0 0 0 51,-0.7 -1,-0.1 -2,-0.5 50,-0.1 0.814 48.7 121.9 -71.2 -31.7 33.1 -17.1 18.5 115 123 A H - 0 0 38 50,-0.4 47,-0.2 48,-0.3 -25,-0.2 -0.034 42.8-169.3 -42.7 113.5 31.9 -16.2 14.9 116 124 A Q - 0 0 14 45,-2.0 -1,-0.1 -26,-0.1 -2,-0.1 -0.887 14.9-171.9-106.8 100.3 29.4 -13.4 14.8 117 125 A P - 0 0 67 0, 0.0 46,-0.0 0, 0.0 45,-0.0 -0.127 42.0 -69.0 -85.2-175.8 27.9 -13.2 11.3 118 126 A L > + 0 0 142 1,-0.1 3,-0.6 2,-0.1 -55,-0.1 0.851 54.6 172.2 -37.3 -74.1 25.6 -10.6 9.6 119 127 A G T 3 - 0 0 47 1,-0.2 -56,-0.7 2,-0.1 -1,-0.1 0.637 65.1 -81.9 70.5 19.2 22.4 -11.3 11.6 120 128 A G T > + 0 0 47 1,-0.1 3,-1.0 -58,-0.1 -1,-0.2 0.886 68.3 164.2 54.5 50.0 20.3 -8.3 10.2 121 129 A A T < + 0 0 8 -3,-0.6 -1,-0.1 1,-0.3 3,-0.1 0.506 63.8 70.1 -75.9 -5.1 21.8 -5.7 12.5 122 130 A Q T > S- 0 0 60 1,-0.3 3,-1.9 3,-0.1 -1,-0.3 0.131 84.6-155.2 -99.8 19.7 20.5 -2.9 10.3 123 131 A G T < - 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