==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER FLAVOPROTEIN 20-MAR-06 2CIE . COMPND 2 MOLECULE: VNG1446H; . SOURCE 2 ORGANISM_SCIENTIFIC: HALOBACTERIUM SALINARIUM; . AUTHOR M.GRININGER,F.SEILER,K.ZETH,D.OESTERHELT . 64 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4581.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 44 68.8 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 . 24 37.5 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 . 5 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 20.3 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+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 0 0 1 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 2 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 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 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 V 0 0 133 0, 0.0 62,-3.0 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 130.4 2.3 22.7 -13.3 2 3 A F E -A 62 0A 105 60,-0.2 2,-0.4 58,-0.0 60,-0.2 -0.814 360.0-161.6-101.6 149.6 4.5 21.2 -10.5 3 4 A K E -A 61 0A 116 58,-2.5 58,-2.5 -2,-0.3 2,-0.4 -0.954 7.1-149.0-124.3 148.7 7.2 18.6 -11.1 4 5 A K E -A 60 0A 89 -2,-0.4 2,-0.4 56,-0.2 56,-0.2 -0.950 4.3-160.7-116.2 141.7 8.8 16.4 -8.5 5 6 A V E -A 59 0A 38 54,-2.2 54,-3.0 -2,-0.4 2,-0.8 -0.942 20.4-130.8-116.4 144.0 12.3 15.0 -8.2 6 7 A L E +A 58 0A 93 -2,-0.4 2,-0.4 52,-0.2 52,-0.2 -0.816 36.8 171.2-101.2 106.4 13.0 12.1 -6.0 7 8 A L E -A 57 0A 50 50,-2.7 50,-3.1 -2,-0.8 2,-0.6 -0.917 27.4-150.8-121.2 143.4 16.1 12.8 -3.9 8 9 A T E -A 56 0A 69 -2,-0.4 48,-0.3 48,-0.3 2,-0.2 -0.950 19.1-166.2-111.9 114.1 17.8 11.1 -0.9 9 10 A G E -A 55 0A 0 46,-2.7 46,-1.9 -2,-0.6 2,-0.3 -0.621 5.5-150.5 -93.6 159.6 19.5 13.4 1.5 10 11 A T E +A 54 0A 62 -2,-0.2 2,-0.3 44,-0.2 44,-0.2 -0.956 16.9 170.9-133.1 153.9 22.0 12.3 4.1 11 12 A S E -A 53 0A 18 42,-2.4 42,-3.2 -2,-0.3 7,-0.1 -0.981 33.4-146.4-155.9 146.0 23.1 13.5 7.5 12 13 A E S S+ 0 0 99 -2,-0.3 39,-0.1 40,-0.2 3,-0.1 0.442 101.1 49.2 -88.8 3.7 25.2 12.2 10.4 13 14 A E S S- 0 0 142 1,-0.3 2,-0.3 40,-0.1 -1,-0.1 0.848 113.1 -28.3-107.7 -51.5 22.9 14.0 12.8 14 15 A S > - 0 0 45 39,-0.1 4,-1.8 1,-0.1 -1,-0.3 -0.994 49.3-102.8-162.5 164.6 19.2 13.3 12.1 15 16 A F H > S+ 0 0 77 -2,-0.3 4,-2.0 2,-0.2 5,-0.1 0.845 120.1 54.2 -62.3 -38.3 16.3 12.4 9.8 16 17 A T H > S+ 0 0 104 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.945 108.8 47.8 -60.3 -46.0 15.3 16.1 9.7 17 18 A A H > S+ 0 0 31 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.862 108.5 54.8 -66.9 -33.1 18.8 17.2 8.7 18 19 A A H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.921 107.3 50.3 -65.5 -40.8 18.9 14.5 6.0 19 20 A A H X S+ 0 0 17 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.938 110.1 50.6 -57.7 -44.7 15.6 15.9 4.5 20 21 A D H X S+ 0 0 85 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.861 103.9 58.7 -60.8 -39.0 17.2 19.4 4.6 21 22 A D H X S+ 0 0 69 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.915 109.5 43.7 -58.9 -43.2 20.3 18.0 2.8 22 23 A A H X S+ 0 0 3 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.933 114.9 48.3 -64.4 -45.7 18.1 16.9 -0.1 23 24 A I H X S+ 0 0 38 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.908 108.2 54.8 -64.9 -41.8 16.1 20.1 -0.2 24 25 A D H X S+ 0 0 85 -4,-3.1 4,-1.2 1,-0.2 -1,-0.2 0.905 109.0 48.9 -54.4 -46.0 19.3 22.3 -0.1 25 26 A R H X S+ 0 0 147 -4,-1.6 4,-0.8 -5,-0.2 3,-0.4 0.909 109.8 50.7 -65.2 -41.7 20.5 20.4 -3.2 26 27 A A H >X S+ 0 0 4 -4,-2.2 4,-2.3 1,-0.2 3,-1.2 0.947 109.9 50.4 -58.7 -45.5 17.2 20.9 -5.0 27 28 A E H 3< S+ 0 0 114 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.686 102.9 61.4 -68.3 -20.7 17.3 24.7 -4.2 28 29 A D H 3< S+ 0 0 126 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.771 121.1 21.9 -70.0 -28.6 20.9 24.9 -5.6 29 30 A T H << S+ 0 0 93 -3,-1.2 2,-0.4 -4,-0.8 -2,-0.2 0.555 116.0 62.5-120.8 -15.3 19.8 23.8 -9.0 30 31 A L < - 0 0 48 -4,-2.3 3,-0.4 -5,-0.2 2,-0.3 -0.907 64.3-137.0-124.6 145.8 16.1 24.5 -9.3 31 32 A D S S+ 0 0 132 -2,-0.4 -3,-0.1 1,-0.2 31,-0.0 -0.733 81.5 18.4 -94.2 147.7 13.9 27.6 -9.2 32 33 A N - 0 0 93 -2,-0.3 30,-2.4 1,-0.2 2,-0.3 0.841 67.9-177.4 67.7 46.4 10.7 27.8 -7.3 33 34 A V E +B 61 0A 33 -3,-0.4 28,-0.3 28,-0.2 -1,-0.2 -0.572 6.5 171.9 -70.1 128.8 11.0 24.8 -4.9 34 35 A V E - 0 0 73 26,-3.0 2,-0.3 1,-0.4 27,-0.2 0.799 49.2 -15.8-115.4 -39.7 7.6 24.8 -3.0 35 36 A W E -B 60 0A 98 25,-1.3 25,-2.8 2,-0.0 -1,-0.4 -0.968 47.3-142.3-158.7 170.3 7.4 21.7 -0.9 36 37 A A E -B 59 0A 36 -2,-0.3 2,-0.5 23,-0.2 23,-0.2 -0.997 7.4-153.7-141.0 146.5 8.7 18.2 -0.2 37 38 A E E -B 58 0A 86 21,-2.3 21,-2.5 -2,-0.3 2,-0.4 -0.973 21.5-127.7-120.0 127.0 7.1 14.9 0.9 38 39 A V E +B 57 0A 83 -2,-0.5 19,-0.2 19,-0.2 3,-0.1 -0.627 32.5 168.0 -73.5 130.3 9.0 12.3 2.8 39 40 A V E + 0 0 68 17,-2.7 2,-0.3 -2,-0.4 18,-0.2 0.550 61.7 3.1-117.9 -16.8 8.7 8.9 1.1 40 41 A D E -B 56 0A 104 16,-1.4 16,-3.1 2,-0.0 -1,-0.4 -0.967 52.2-161.2-165.3 153.7 11.3 6.8 3.0 41 42 A Q E +B 55 0A 107 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.995 21.3 155.2-139.2 143.7 13.9 7.0 5.8 42 43 A G E -B 54 0A 30 12,-2.5 12,-3.0 -2,-0.3 2,-0.4 -0.931 31.4-126.5-155.4 174.8 16.8 4.7 6.5 43 44 A V E -B 53 0A 58 -2,-0.3 2,-0.5 10,-0.2 10,-0.2 -0.991 12.3-146.1-138.2 127.6 20.3 4.5 8.2 44 45 A E E +B 52 0A 67 8,-2.9 8,-2.4 -2,-0.4 -2,-0.0 -0.815 32.1 156.0 -90.8 127.3 23.5 3.5 6.7 45 46 A I > + 0 0 113 -2,-0.5 3,-0.6 6,-0.2 -1,-0.2 0.740 61.5 44.2-121.4 -49.4 25.6 1.6 9.2 46 47 A G T 3 S+ 0 0 76 1,-0.2 -2,-0.1 5,-0.0 5,-0.0 0.864 109.7 48.1 -76.7 -43.7 28.2 -0.7 7.5 47 48 A A T 3 S+ 0 0 86 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 0.291 107.2 68.6 -80.5 10.1 29.7 1.3 4.7 48 49 A V S < S- 0 0 52 -3,-0.6 3,-0.1 1,-0.1 4,-0.0 -0.937 70.2-138.4-134.9 153.3 30.4 4.4 7.0 49 50 A E S S+ 0 0 215 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.905 101.0 30.0 -70.0 -44.9 32.5 5.5 9.9 50 51 A E S S- 0 0 104 1,-0.0 -1,-0.2 0, 0.0 -6,-0.1 -0.942 103.0 -96.0-114.6 139.8 29.6 7.2 11.5 51 52 A R - 0 0 156 -2,-0.4 2,-0.5 -3,-0.1 -6,-0.2 -0.285 41.8-150.1 -45.9 135.8 25.9 6.1 11.2 52 53 A T E - B 0 44A 15 -8,-2.4 -8,-2.9 -39,-0.0 2,-0.3 -0.964 0.7-146.0-123.2 121.4 24.4 8.2 8.4 53 54 A Y E -AB 11 43A 58 -42,-3.2 -42,-2.4 -2,-0.5 2,-0.4 -0.584 16.7-163.6 -81.5 140.8 20.6 9.0 8.5 54 55 A Q E -AB 10 42A 61 -12,-3.0 -12,-2.5 -2,-0.3 2,-0.4 -0.988 11.6-173.7-129.6 141.8 18.9 9.2 5.1 55 56 A T E -AB 9 41A 1 -46,-1.9 -46,-2.7 -2,-0.4 2,-0.4 -0.994 12.7-152.5-133.5 123.7 15.6 10.7 4.2 56 57 A E E -AB 8 40A 47 -16,-3.1 -17,-2.7 -2,-0.4 -16,-1.4 -0.835 21.4-178.8 -99.5 133.2 14.2 10.3 0.7 57 58 A V E -AB 7 38A 2 -50,-3.1 -50,-2.7 -2,-0.4 2,-0.7 -0.979 33.6-133.7-133.3 141.6 11.9 13.1 -0.4 58 59 A Q E -AB 6 37A 54 -21,-2.5 -21,-2.3 -2,-0.4 2,-0.6 -0.891 32.3-155.9 -83.6 118.3 9.8 14.0 -3.4 59 60 A V E -AB 5 36A 0 -54,-3.0 -54,-2.2 -2,-0.7 2,-0.4 -0.903 5.2-153.2-102.6 118.3 10.8 17.7 -3.9 60 61 A A E +AB 4 35A 0 -25,-2.8 -26,-3.0 -2,-0.6 -25,-1.3 -0.735 15.8 177.0 -92.4 136.7 8.1 19.7 -5.8 61 62 A F E -AB 3 33A 15 -58,-2.5 -58,-2.5 -2,-0.4 2,-0.5 -0.976 31.6-112.2-137.8 148.3 8.9 22.8 -7.8 62 63 A E E -A 2 0A 90 -30,-2.4 -60,-0.2 -2,-0.3 2,-0.2 -0.696 28.8-132.3 -85.5 126.5 6.7 25.0 -10.0 63 64 A L 0 0 68 -62,-3.0 -31,-0.0 -2,-0.5 -1,-0.0 -0.532 360.0 360.0 -75.0 146.5 7.4 24.9 -13.7 64 65 A D 0 0 200 -2,-0.2 -1,-0.2 -33,-0.0 -32,-0.1 0.038 360.0 360.0 63.8 360.0 7.7 28.4 -15.4