==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-JUL-03 1PYV . COMPND 2 MOLECULE: ATP SYNTHASE BETA CHAIN, MITOCHONDRIAL PRECURSOR; . SOURCE 2 ORGANISM_SCIENTIFIC: NICOTIANA PLUMBAGINIFOLIA; . AUTHOR P.MOBERG,S.NILSSON,A.STAHL,A.C.ERIKSSON,E.GLASER,L.MALER . 53 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4405.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 34 64.2 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 . 4 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 15.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 37.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.9 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 2 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 . 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 A 0 0 117 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 56.1 -5.5 4.9 4.8 2 2 A S - 0 0 86 0, 0.0 2,-3.5 0, 0.0 0, 0.0 -0.889 360.0 -28.2-158.6 122.7 -2.7 2.6 5.9 3 3 A R S >> S+ 0 0 176 -2,-0.3 3,-0.6 1,-0.2 4,-0.6 -0.321 131.7 64.6 70.5 -62.0 -2.1 -1.1 5.3 4 4 A R H 3> S+ 0 0 190 -2,-3.5 4,-0.9 1,-0.3 3,-0.3 0.708 94.8 62.5 -62.4 -20.0 -5.8 -1.7 4.9 5 5 A L H 3> S+ 0 0 76 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.893 89.9 63.8 -71.6 -41.7 -5.6 0.6 1.9 6 6 A L H <> S+ 0 0 36 -3,-0.6 4,-1.6 1,-0.2 -1,-0.2 0.752 96.7 64.2 -53.2 -24.0 -3.3 -1.8 0.1 7 7 A A H >X S+ 0 0 18 -4,-0.6 4,-4.4 -3,-0.3 3,-1.1 0.990 102.6 41.8 -63.2 -63.3 -6.3 -4.1 0.3 8 8 A S H 3X S+ 0 0 60 -4,-0.9 4,-1.4 1,-0.3 -1,-0.2 0.805 112.5 58.4 -53.7 -31.0 -8.5 -2.0 -1.9 9 9 A L H 3X S+ 0 0 13 -4,-2.0 4,-0.9 2,-0.2 -1,-0.3 0.857 117.3 31.5 -67.2 -36.3 -5.4 -1.5 -4.1 10 10 A L H < S+ 0 0 52 -4,-2.5 3,-3.4 2,-0.2 -2,-0.2 0.932 100.9 53.7 -77.4 -50.3 -7.9 -8.2 -8.7 15 15 A Q T 3< S+ 0 0 116 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.706 110.4 51.3 -56.9 -19.6 -11.3 -7.5 -10.0 16 16 A R T 3 S- 0 0 174 -4,-0.4 2,-0.8 3,-0.1 -1,-0.3 0.286 117.5-117.4 -99.5 6.9 -9.4 -6.2 -13.0 17 17 A G S < S- 0 0 74 -3,-3.4 -3,-0.1 1,-0.2 -2,-0.1 -0.220 76.0 -45.8 86.3 -44.5 -7.5 -9.4 -13.3 18 18 A G S S+ 0 0 41 -2,-0.8 2,-0.2 -6,-0.1 -1,-0.2 0.414 104.8 111.7 147.1 46.6 -4.2 -7.5 -12.7 19 19 A G + 0 0 17 -6,-0.5 -3,-0.1 1,-0.2 -2,-0.1 -0.564 42.4 61.4-124.9-171.3 -4.1 -4.4 -14.8 20 20 A L S S+ 0 0 118 -2,-0.2 -1,-0.2 1,-0.2 -4,-0.0 0.890 124.8 28.4 54.8 42.1 -4.2 -0.6 -14.4 21 21 A I S S+ 0 0 26 -3,-0.2 -1,-0.2 -8,-0.1 5,-0.2 0.055 99.5 81.8 166.8 -31.4 -1.0 -0.9 -12.3 22 22 A S S S- 0 0 75 3,-0.1 -3,-0.1 1,-0.1 -9,-0.0 0.959 125.2 -6.6 -59.2 -54.9 0.7 -4.0 -13.7 23 23 A R S > S+ 0 0 184 3,-0.1 4,-0.6 2,-0.1 -1,-0.1 0.703 129.6 70.2-110.5 -36.4 2.2 -2.2 -16.6 24 24 A S T >4 S+ 0 0 65 2,-0.2 3,-2.5 1,-0.2 4,-0.2 0.936 119.7 15.0 -44.7 -88.5 0.6 1.2 -16.3 25 25 A L G >4 S+ 0 0 24 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.664 124.3 67.8 -63.6 -15.4 2.2 2.6 -13.2 26 26 A G G >4 S+ 0 0 14 1,-0.2 3,-0.9 -5,-0.2 -1,-0.3 0.477 74.9 85.3 -82.2 -3.6 4.7 -0.2 -13.8 27 27 A N G << S+ 0 0 103 -3,-2.5 -1,-0.2 -4,-0.6 -2,-0.2 0.680 111.0 16.9 -69.6 -17.6 5.8 1.6 -16.9 28 28 A S G < >S+ 0 0 6 -3,-0.9 5,-2.7 -4,-0.2 6,-0.6 -0.264 80.3 130.5-150.8 52.5 8.1 3.5 -14.6 29 29 A I T X 5S+ 0 0 43 -3,-0.9 3,-1.0 3,-0.2 -2,-0.1 0.837 81.2 48.9 -75.3 -35.0 8.3 1.6 -11.3 30 30 A P T 3 5S+ 0 0 110 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.744 104.7 59.0 -75.0 -25.1 12.2 1.8 -11.4 31 31 A K T 3 5S- 0 0 139 1,-0.0 -2,-0.2 4,-0.0 -4,-0.0 0.277 129.1 -99.5 -85.5 10.3 11.9 5.5 -12.0 32 32 A S T < 5S- 0 0 111 -3,-1.0 -3,-0.2 1,-0.2 4,-0.1 0.830 73.1 -59.5 74.6 34.1 10.0 5.8 -8.8 33 33 A A S >< S+ 0 0 96 -4,-0.6 3,-1.2 1,-0.2 4,-0.3 -0.403 73.8 71.9 72.8 -68.6 2.5 11.5 -9.9 38 38 A S T 3 S+ 0 0 123 -2,-3.0 -1,-0.2 1,-0.3 2,-0.2 0.900 124.1 5.5 -39.9 -57.7 -1.2 12.2 -10.5 39 39 A R T 3 S+ 0 0 167 1,-0.1 -1,-0.3 2,-0.1 -14,-0.1 -0.602 95.2 110.2-132.7 71.5 -2.1 8.9 -8.9 40 40 A A < + 0 0 21 -3,-1.2 4,-0.4 -2,-0.2 7,-0.2 0.331 64.8 74.0-121.0 -1.3 1.1 7.3 -7.6 41 41 A S S > S+ 0 0 109 -4,-0.3 4,-1.3 2,-0.2 5,-0.1 0.955 107.9 28.8 -76.5 -55.0 0.2 7.7 -3.9 42 42 A P H > S+ 0 0 38 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.809 130.5 41.8 -75.0 -31.9 -2.4 4.9 -3.7 43 43 A K H > S+ 0 0 53 2,-0.2 4,-1.8 1,-0.1 -2,-0.2 0.705 104.3 70.0 -85.4 -23.3 -0.7 3.0 -6.5 44 44 A G H > S+ 0 0 18 -4,-0.4 4,-3.0 2,-0.2 3,-0.5 0.960 95.5 50.3 -57.2 -56.9 2.7 3.7 -5.1 45 45 A F H X S+ 0 0 91 -4,-1.3 4,-0.9 1,-0.3 -1,-0.2 0.834 118.5 40.5 -50.8 -36.3 2.2 1.5 -2.0 46 46 A L H X S+ 0 0 25 -4,-0.5 4,-0.8 2,-0.2 -1,-0.3 0.681 114.7 53.0 -85.2 -21.0 1.1 -1.2 -4.4 47 47 A L H X S+ 0 0 6 -4,-1.8 4,-0.6 -3,-0.5 -2,-0.2 0.716 106.6 52.8 -84.1 -24.0 3.9 -0.2 -6.8 48 48 A N H X S+ 0 0 112 -4,-3.0 4,-1.5 2,-0.2 3,-0.2 0.803 106.1 53.2 -79.1 -31.8 6.5 -0.4 -4.1 49 49 A R H X S+ 0 0 117 -4,-0.9 4,-2.8 -5,-0.3 -2,-0.2 0.794 100.2 61.9 -72.0 -29.7 5.3 -4.0 -3.3 50 50 A A H < S+ 0 0 62 -4,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.829 110.2 40.3 -64.4 -32.7 5.8 -4.9 -6.9 51 51 A V H < S+ 0 0 90 -4,-0.6 -1,-0.2 -3,-0.2 -2,-0.2 0.757 112.1 58.1 -85.1 -28.5 9.4 -4.1 -6.5 52 52 A Q H < 0 0 131 -4,-1.5 -2,-0.2 1,-0.2 -3,-0.2 0.971 360.0 360.0 -64.4 -56.8 9.6 -5.7 -3.1 53 53 A Y < 0 0 230 -4,-2.8 -1,-0.2 -5,-0.0 -2,-0.1 0.767 360.0 360.0 -37.6 360.0 8.5 -9.1 -4.2