==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-NOV-04 1WU0 . COMPND 2 MOLECULE: ATP SYNTHASE C CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SP. PS3; . AUTHOR T.NAKANO,T.IKEGAMI,T.SUZUKI,M.YOSHIDA,H.AKUTSU . 72 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5558.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 66 91.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 75.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.4 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 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 A M 0 0 233 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 77.6 -4.9 -12.7 24.5 2 2 A S - 0 0 82 1,-0.1 4,-0.5 0, 0.0 0, 0.0 -0.913 360.0 -91.9-168.7-169.3 -6.8 -15.5 22.7 3 3 A L S > S+ 0 0 142 -2,-0.3 4,-2.2 2,-0.2 5,-0.2 0.816 116.8 58.0 -90.6 -38.1 -7.4 -17.3 19.4 4 4 A G H > S+ 0 0 49 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.914 107.2 47.6 -57.4 -46.8 -10.3 -15.1 18.3 5 5 A V H > S+ 0 0 85 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.843 107.1 59.6 -63.4 -34.4 -8.2 -12.0 18.5 6 6 A L H >> S+ 0 0 55 -4,-0.5 4,-1.5 1,-0.2 3,-0.8 0.948 103.7 48.3 -58.3 -52.0 -5.5 -13.8 16.6 7 7 A A H 3X S+ 0 0 57 -4,-2.2 4,-3.2 1,-0.3 -1,-0.2 0.816 108.8 56.2 -57.8 -31.3 -7.9 -14.4 13.7 8 8 A A H 3X S+ 0 0 47 -4,-1.4 4,-1.1 1,-0.2 -1,-0.3 0.820 103.1 53.8 -69.6 -32.0 -8.7 -10.7 14.0 9 9 A A H < S+ 0 0 25 -4,-1.1 3,-0.6 1,-0.2 4,-0.2 0.868 102.0 49.8 -66.6 -38.3 -3.1 13.9 -11.2 34 34 A I H >< S+ 0 0 76 -4,-1.5 3,-1.4 1,-0.2 -1,-0.2 0.801 104.0 60.0 -69.7 -29.7 -0.9 16.7 -10.0 35 35 A A H 3< S+ 0 0 2 -4,-1.1 9,-0.3 1,-0.3 -1,-0.2 0.724 83.4 82.0 -69.2 -21.8 1.8 15.5 -12.3 36 36 A R T << S+ 0 0 194 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.777 76.7 93.2 -52.9 -27.9 -0.8 16.1 -15.1 37 37 A Q S < S- 0 0 119 -3,-1.4 6,-0.1 -4,-0.2 -3,-0.0 -0.148 85.4-123.7 -64.0 163.2 0.4 19.7 -14.9 38 38 A P S > S+ 0 0 107 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.909 113.4 46.6 -75.0 -45.3 3.2 21.1 -17.1 39 39 A E T 3 S+ 0 0 169 1,-0.3 -4,-0.1 2,-0.1 -3,-0.1 0.626 112.9 53.6 -70.9 -13.5 5.3 22.3 -14.2 40 40 A L T 3> S+ 0 0 40 -6,-0.2 4,-0.6 1,-0.2 -1,-0.3 -0.108 71.0 117.4-110.8 32.0 4.7 18.9 -12.7 41 41 A R T X4 S+ 0 0 187 -3,-1.4 3,-0.9 1,-0.2 4,-0.3 0.883 79.5 46.5 -64.7 -40.3 5.8 17.0 -15.7 42 42 A P T >> S+ 0 0 85 0, 0.0 4,-0.9 0, 0.0 3,-0.8 0.671 95.7 76.4 -75.0 -18.2 8.7 15.4 -13.7 43 43 A V H 3> S+ 0 0 25 1,-0.3 4,-2.3 2,-0.2 3,-0.3 0.794 81.0 70.8 -61.4 -28.4 6.2 14.7 -10.9 44 44 A L H S+ 0 0 145 -3,-0.8 4,-1.6 -4,-0.3 -1,-0.3 0.832 110.2 50.2 -60.2 -33.7 8.2 10.0 -12.4 46 46 A T H X S+ 0 0 74 -4,-0.9 4,-1.5 -3,-0.3 -1,-0.2 0.826 110.9 48.4 -73.4 -33.5 7.5 10.6 -8.7 47 47 A T H X S+ 0 0 10 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.803 108.6 54.8 -75.3 -31.3 4.0 9.3 -9.0 48 48 A M H X S+ 0 0 127 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.884 111.7 42.9 -68.6 -40.8 5.3 6.2 -10.9 49 49 A F H X S+ 0 0 158 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.822 111.4 55.0 -73.9 -33.3 7.7 5.3 -8.1 50 50 A I H X S+ 0 0 79 -4,-1.5 4,-1.3 2,-0.2 -1,-0.2 0.828 107.0 52.6 -68.1 -32.8 5.1 6.1 -5.5 51 51 A G H X S+ 0 0 14 -4,-1.5 4,-1.2 2,-0.2 -2,-0.2 0.940 110.8 44.2 -67.6 -49.8 2.8 3.7 -7.2 52 52 A V H >X S+ 0 0 90 -4,-1.7 4,-1.3 1,-0.2 3,-0.8 0.922 111.0 54.6 -60.5 -46.2 5.2 0.8 -7.2 53 53 A A H 3< S+ 0 0 50 -4,-2.4 -1,-0.2 1,-0.3 3,-0.2 0.837 105.9 53.8 -56.0 -34.0 6.2 1.5 -3.7 54 54 A L H >< S+ 0 0 15 -4,-1.3 3,-1.3 1,-0.2 -1,-0.3 0.804 102.8 56.8 -70.1 -30.2 2.6 1.2 -2.9 55 55 A V H X< S+ 0 0 74 -4,-1.2 3,-1.5 -3,-0.8 -1,-0.2 0.761 94.5 66.7 -71.0 -25.7 2.6 -2.2 -4.5 56 56 A E T 3X S+ 0 0 117 -4,-1.3 4,-1.2 1,-0.3 -1,-0.3 0.490 89.2 68.1 -72.8 -2.6 5.3 -3.2 -2.1 57 57 A A H <> S+ 0 0 27 -3,-1.3 4,-2.1 -5,-0.2 5,-0.3 0.631 88.5 64.8 -88.8 -17.6 2.7 -2.9 0.6 58 58 A L H <> S+ 0 0 65 -3,-1.5 4,-1.9 -4,-0.2 -2,-0.2 0.962 114.2 28.4 -68.0 -53.9 0.9 -5.9 -0.8 59 59 A P H > S+ 0 0 77 0, 0.0 4,-1.8 0, 0.0 -2,-0.2 0.853 121.3 55.5 -75.0 -37.3 3.7 -8.3 -0.0 60 60 A I H >X S+ 0 0 97 -4,-1.2 4,-1.4 2,-0.2 3,-0.5 0.969 115.5 36.4 -58.3 -57.5 4.9 -6.3 2.9 61 61 A I H 3X S+ 0 0 40 -4,-2.1 4,-2.4 1,-0.2 3,-0.3 0.901 111.8 61.6 -62.1 -42.5 1.5 -6.3 4.6 62 62 A G H 3X S+ 0 0 17 -4,-1.9 4,-1.6 -5,-0.3 -1,-0.2 0.825 104.4 49.4 -52.5 -34.5 0.9 -9.8 3.4 63 63 A V H S+ 0 0 116 -4,-2.6 5,-2.6 1,-0.2 4,-0.7 0.842 101.2 61.3 -61.7 -35.2 3.5 -13.1 10.9 68 68 A I H ><5S+ 0 0 15 -4,-2.2 3,-2.4 3,-0.2 -1,-0.2 0.959 101.9 50.2 -55.5 -56.2 0.5 -12.5 13.1 69 69 A Y H 3<5S+ 0 0 166 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.901 102.5 60.0 -48.4 -49.0 -0.6 -16.2 12.9 70 70 A L H 3<5S- 0 0 157 -4,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.728 133.4 -96.3 -53.0 -21.2 2.9 -17.2 13.8 71 71 A G T <<5 0 0 54 -3,-2.4 -3,-0.2 -4,-0.7 -2,-0.2 0.584 360.0 360.0 110.7 20.3 2.1 -15.2 17.0 72 72 A R < 0 0 223 -5,-2.6 -4,-0.0 -4,-0.2 -7,-0.0 -0.196 360.0 360.0 64.4 360.0 3.7 -12.0 16.0