==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-AUG-06 2I4R . COMPND 2 MOLECULE: V-TYPE ATP SYNTHASE SUBUNIT F; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR S.M.VOROBIEV,M.SU,J.SEETHARAMAN,L.ZHAO,Y.FANG,K.CUNNINGHAM,L . 159 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9058.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 21.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 2.5 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 . 10 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 3 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 0 4 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 1 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 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 -2 A S 0 0 106 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 119.6 -15.7 66.7 59.9 2 -1 A H - 0 0 149 44,-0.1 44,-0.2 45,-0.1 2,-0.1 -0.723 360.0-173.4-125.7 79.3 -12.7 66.1 62.2 3 0 A X E -a 46 0A 84 42,-2.4 45,-2.1 -2,-0.4 44,-1.5 -0.345 22.7-126.6 -71.5 150.8 -12.2 69.2 64.2 4 4 A L E -a 48 0A 60 43,-0.2 2,-0.4 42,-0.2 19,-0.3 -0.876 29.6-173.1-100.6 127.1 -9.3 69.7 66.5 5 5 A A E -a 49 0A 0 43,-2.9 45,-2.9 -2,-0.5 2,-0.4 -0.918 8.2-155.4-120.5 148.7 -10.4 70.6 70.0 6 6 A V E -ab 50 24A 0 17,-2.1 19,-2.5 -2,-0.4 2,-0.5 -0.988 2.5-161.3-127.8 138.6 -8.1 71.6 72.8 7 7 A V E +ab 51 25A 0 43,-2.7 45,-0.6 -2,-0.4 2,-0.3 -0.976 39.5 87.0-121.0 126.0 -8.8 71.3 76.6 8 8 A G E S- b 0 26A 0 17,-2.3 19,-1.3 -2,-0.5 20,-0.1 -0.938 72.7 -51.6 166.2 172.9 -6.9 73.3 79.2 9 9 A D >> - 0 0 38 -2,-0.3 4,-2.4 17,-0.2 3,-1.0 -0.306 61.7-101.1 -65.8 153.6 -6.4 76.4 81.3 10 10 A P H 3> S+ 0 0 61 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.724 122.8 54.8 -48.4 -30.3 -6.3 79.8 79.4 11 11 A D H 3> S+ 0 0 139 2,-0.2 4,-0.5 1,-0.2 3,-0.4 0.889 112.3 42.5 -73.6 -39.6 -2.5 79.9 79.6 12 12 A F H <4 S+ 0 0 40 -3,-1.0 3,-0.3 1,-0.2 4,-0.2 0.861 117.6 46.8 -72.6 -35.9 -2.2 76.5 78.0 13 13 A T H X S+ 0 0 0 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.446 93.2 79.3 -88.2 0.3 -4.9 77.2 75.4 14 14 A I H X S+ 0 0 76 -4,-0.5 4,-2.2 -3,-0.4 5,-0.2 0.898 87.0 54.4 -75.7 -41.8 -3.6 80.7 74.4 15 15 A G H X S+ 0 0 49 -4,-0.5 4,-0.5 -3,-0.3 -1,-0.2 0.729 110.6 50.8 -63.7 -19.8 -0.8 79.6 72.1 16 16 A F H 4>S+ 0 0 48 -4,-0.2 5,-1.9 2,-0.2 -1,-0.2 0.850 107.9 48.4 -85.0 -40.3 -3.4 77.6 70.2 17 17 A X H ><5S+ 0 0 70 -4,-1.4 3,-1.6 1,-0.2 -2,-0.2 0.886 110.5 52.5 -67.1 -37.9 -6.0 80.3 69.8 18 18 A L H 3<5S+ 0 0 143 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.819 105.7 56.1 -66.9 -28.5 -3.2 82.6 68.5 19 19 A A T 3<5S- 0 0 79 -4,-0.5 -1,-0.3 -5,-0.2 -2,-0.2 0.224 129.5 -95.8 -87.4 13.6 -2.3 79.9 66.0 20 20 A G T < 5S+ 0 0 60 -3,-1.6 -3,-0.2 1,-0.3 2,-0.2 0.097 81.1 134.7 98.8 -23.8 -5.9 79.9 64.6 21 21 A I < + 0 0 39 -5,-1.9 -1,-0.3 1,-0.1 -2,-0.1 -0.419 21.6 170.4 -63.4 127.6 -7.3 77.0 66.7 22 22 A S + 0 0 108 -18,-0.2 2,-0.4 -2,-0.2 -1,-0.1 0.155 49.0 92.8-129.5 21.8 -10.8 78.1 68.0 23 23 A D + 0 0 25 -19,-0.3 -17,-2.1 2,-0.0 2,-0.3 -0.559 59.4 155.8-112.1 63.4 -12.3 74.9 69.4 24 24 A I E -b 6 0A 33 -2,-0.4 2,-0.6 -19,-0.2 -17,-0.2 -0.694 37.6-158.9 -98.3 144.6 -11.1 75.5 72.9 25 25 A Y E -b 7 0A 44 -19,-2.5 -17,-2.3 -2,-0.3 2,-0.9 -0.928 18.3-152.0-118.3 98.2 -12.5 74.2 76.2 26 26 A E E +b 8 0A 101 -2,-0.6 2,-0.3 -19,-0.2 -17,-0.2 -0.650 27.8 169.5 -77.8 107.6 -11.2 76.6 78.9 27 27 A V + 0 0 1 -19,-1.3 3,-0.1 -2,-0.9 -2,-0.0 -0.901 23.1 150.6-124.3 149.6 -11.0 74.5 82.0 28 28 A T + 0 0 87 -2,-0.3 2,-0.2 1,-0.3 -1,-0.1 0.464 56.0 71.6-135.9 -66.0 -9.5 75.0 85.4 29 29 A S S >> S- 0 0 33 1,-0.1 4,-1.6 4,-0.0 3,-0.9 -0.427 82.4-119.5 -70.7 131.5 -11.3 73.2 88.2 30 30 A D H 3> S+ 0 0 81 1,-0.3 4,-1.4 2,-0.2 -1,-0.1 0.733 115.4 55.4 -32.5 -37.2 -11.1 69.4 88.3 31 31 A E H 3> S+ 0 0 151 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.964 104.1 48.9 -67.3 -55.6 -14.9 69.4 87.9 32 32 A E H <> S+ 0 0 83 -3,-0.9 4,-2.5 1,-0.2 -2,-0.2 0.775 105.6 62.5 -56.9 -29.3 -15.0 71.4 84.7 33 33 A I H X S+ 0 0 0 -4,-1.6 4,-2.5 2,-0.2 5,-0.2 0.979 103.6 45.0 -60.5 -57.7 -12.3 69.1 83.2 34 34 A V H X S+ 0 0 21 -4,-1.4 4,-1.8 1,-0.2 -2,-0.2 0.857 113.3 51.4 -57.9 -37.5 -14.4 66.0 83.4 35 35 A K H X S+ 0 0 130 -4,-1.8 4,-3.3 2,-0.2 3,-0.3 0.981 108.5 50.8 -64.5 -51.8 -17.4 67.8 81.9 36 36 A A H X S+ 0 0 6 -4,-2.5 4,-3.1 1,-0.3 5,-0.3 0.925 110.8 48.3 -47.9 -54.6 -15.3 69.2 79.0 37 37 A V H X S+ 0 0 0 -4,-2.5 4,-1.5 1,-0.2 -1,-0.3 0.871 113.0 49.4 -57.3 -36.0 -14.0 65.8 78.2 38 38 A E H X S+ 0 0 95 -4,-1.8 4,-0.8 -3,-0.3 -2,-0.2 0.935 111.5 48.0 -69.1 -44.5 -17.6 64.5 78.4 39 39 A D H >X S+ 0 0 40 -4,-3.3 3,-1.3 1,-0.2 4,-0.9 0.950 111.5 49.4 -60.7 -49.6 -18.9 67.2 76.1 40 40 A V H 3< S+ 0 0 1 -4,-3.1 3,-0.5 1,-0.3 -1,-0.2 0.831 110.9 50.1 -60.3 -31.8 -16.2 66.7 73.5 41 41 A L H 3< S+ 0 0 62 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.625 106.4 58.2 -79.9 -12.4 -16.9 62.9 73.6 42 42 A K H << S+ 0 0 162 -3,-1.3 -1,-0.2 -4,-0.8 -2,-0.2 0.617 92.1 87.4 -90.1 -15.3 -20.6 63.8 73.1 43 43 A R < - 0 0 76 -4,-0.9 3,-0.1 -3,-0.5 -3,-0.0 -0.252 64.0-151.2 -79.0 170.5 -19.9 65.7 69.9 44 44 A D S S+ 0 0 157 1,-0.1 -1,-0.1 -2,-0.0 -4,-0.0 0.346 85.9 59.7-123.8 0.6 -19.8 64.1 66.4 45 45 A D S S+ 0 0 43 -43,-0.1 -42,-2.4 28,-0.0 2,-0.6 -0.014 75.0 104.9-121.0 28.2 -17.4 66.5 64.6 46 46 A V E +a 3 0A 11 -44,-0.2 -42,-0.2 -6,-0.2 -44,-0.1 -0.940 31.5 168.3-115.4 114.3 -14.3 66.1 66.7 47 47 A G E S+ 0 0 11 -44,-1.5 27,-2.2 -2,-0.6 2,-0.3 0.671 70.1 16.2 -95.3 -20.2 -11.5 64.1 65.2 48 48 A V E -ac 4 74A 39 -45,-2.1 -43,-2.9 25,-0.3 2,-0.4 -0.985 57.3-164.8-156.0 142.3 -8.7 65.1 67.6 49 49 A V E -ac 5 75A 0 25,-2.0 27,-2.5 -2,-0.3 2,-0.4 -0.987 11.1-150.6-133.8 123.5 -8.4 66.7 71.1 50 50 A I E +ac 6 76A 26 -45,-2.9 -43,-2.7 -2,-0.4 2,-0.3 -0.739 31.1 152.4 -90.5 139.4 -5.2 68.1 72.6 51 51 A X E -ac 7 77A 11 25,-2.2 27,-1.7 -2,-0.4 -43,-0.1 -0.968 45.9 -89.9-166.7 146.2 -5.0 68.0 76.4 52 52 A K E > - c 0 78A 43 -45,-0.6 3,-1.3 -2,-0.3 27,-0.2 -0.231 31.2-124.9 -62.4 151.0 -2.4 67.8 79.1 53 53 A Q G > S+ 0 0 106 25,-3.2 3,-1.6 1,-0.3 4,-0.4 0.891 105.9 68.7 -61.6 -40.5 -1.2 64.4 80.3 54 54 A E G 3 S+ 0 0 95 24,-0.4 -1,-0.3 1,-0.2 4,-0.2 0.308 84.9 73.4 -64.6 8.9 -2.1 65.4 83.9 55 55 A Y G < S+ 0 0 7 -3,-1.3 -1,-0.2 2,-0.1 -2,-0.1 0.605 77.4 71.3-101.2 -11.1 -5.8 65.3 83.1 56 56 A L S X S+ 0 0 26 -3,-1.6 3,-2.9 1,-0.2 -2,-0.1 0.941 92.3 55.2 -69.3 -49.0 -6.5 61.6 82.8 57 57 A K T 3 S+ 0 0 151 -4,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.813 100.4 63.5 -53.3 -31.5 -6.2 60.7 86.6 58 58 A K T 3 S+ 0 0 56 -4,-0.2 -1,-0.3 2,-0.1 -24,-0.2 0.470 90.6 93.0 -73.8 -0.3 -8.8 63.4 87.1 59 59 A L S < S- 0 0 5 -3,-2.9 5,-0.1 -26,-0.1 -3,-0.0 -0.773 86.6-108.2-103.3 138.0 -11.3 61.3 85.1 60 60 A P >> - 0 0 62 0, 0.0 4,-2.5 0, 0.0 3,-2.4 -0.420 36.0-119.1 -59.2 126.1 -13.7 58.6 86.4 61 61 A P H 3> S+ 0 0 98 0, 0.0 4,-1.0 0, 0.0 -2,-0.0 0.663 115.2 62.2 -40.9 -22.7 -12.3 55.2 85.3 62 62 A V H 34 S+ 0 0 124 2,-0.2 -3,-0.0 1,-0.1 5,-0.0 0.923 114.2 32.8 -69.4 -44.4 -15.5 54.8 83.3 63 63 A L H X> S+ 0 0 17 -3,-2.4 3,-2.4 2,-0.2 4,-1.5 0.859 114.3 58.3 -77.3 -42.8 -14.5 57.8 81.2 64 64 A R H 3< S+ 0 0 95 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.793 116.0 38.2 -58.6 -28.3 -10.8 57.2 81.5 65 65 A R T 3< S+ 0 0 50 -4,-1.0 -1,-0.3 -5,-0.4 4,-0.2 0.017 101.3 74.4-110.4 22.4 -11.6 53.9 79.9 66 66 A E T X> S+ 0 0 51 -3,-2.4 3,-0.8 2,-0.2 4,-0.6 0.699 96.9 48.5 -98.2 -34.4 -14.2 55.3 77.6 67 67 A I T 3< S+ 0 0 13 -4,-1.5 8,-0.1 1,-0.2 -2,-0.1 0.171 85.7 104.3 -86.1 14.7 -11.4 56.8 75.5 68 68 A D T 34 S+ 0 0 125 1,-0.2 -1,-0.2 -5,-0.1 -2,-0.2 0.970 87.1 36.9 -57.0 -55.5 -10.3 53.2 76.0 69 69 A E T <4 S- 0 0 74 -3,-0.8 -2,-0.2 -4,-0.2 -1,-0.2 0.956 82.4-174.3 -60.6 -50.9 -11.4 52.8 72.4 70 70 A K < + 0 0 46 -4,-0.6 -3,-0.1 2,-0.1 5,-0.1 0.855 28.0 150.2 52.6 37.9 -10.2 56.3 71.3 71 71 A V + 0 0 89 1,-0.2 3,-0.1 3,-0.1 -4,-0.1 0.980 63.7 13.9 -66.1 -65.9 -11.8 55.4 68.0 72 72 A E S S+ 0 0 71 1,-0.2 -1,-0.2 -31,-0.1 2,-0.2 -0.698 121.3 41.2-153.3 130.6 -12.7 59.0 67.1 73 73 A P S S- 0 0 9 0, 0.0 2,-0.4 0, 0.0 -25,-0.3 0.219 79.1-146.9 -75.2 166.3 -11.7 61.3 68.4 74 74 A T E -c 48 0A 49 -27,-2.2 -25,-2.0 -2,-0.2 2,-0.3 -0.839 17.2-137.1 -91.1 136.7 -8.0 60.5 68.9 75 75 A F E -c 49 0A 6 -2,-0.4 85,-2.6 -27,-0.2 2,-0.5 -0.747 12.2-160.7 -95.6 142.2 -6.6 62.1 72.1 76 76 A V E -cD 50 159A 16 -27,-2.5 -25,-2.2 -2,-0.3 2,-0.5 -0.936 9.3-158.8-125.6 106.7 -3.2 63.8 72.2 77 77 A S E -cD 51 158A 11 81,-1.6 81,-2.4 -2,-0.5 2,-0.6 -0.751 6.2-149.9 -95.8 129.9 -1.7 64.2 75.6 78 78 A V E cD 52 157A 25 -27,-1.7 -25,-3.2 -2,-0.5 -24,-0.4 -0.847 360.0 360.0 -94.9 117.9 1.0 66.8 76.3 79 79 A G 0 0 47 77,-2.7 77,-0.2 -2,-0.6 78,-0.1 0.120 360.0 360.0 -76.6 360.0 3.4 65.6 79.1 80 !* 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 81 -3 B H 0 0 197 0, 0.0 2,-0.3 0, 0.0 45,-0.2 0.000 360.0 360.0 360.0 95.3 18.8 76.7 73.3 82 -2 B S - 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