==== 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 13-JAN-06 2CC9 . COMPND 2 MOLECULE: VNG1446H; . SOURCE 2 ORGANISM_SCIENTIFIC: HALOBACTERIUM SALINARUM; . AUTHOR M.GRININGER,K.ZETH,D.OESTERHELT . 64 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4550.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 45 70.3 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 . 6 9.4 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 0 125 0, 0.0 62,-3.1 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 136.0 2.2 22.7 -13.4 2 3 A F E -A 62 0A 102 60,-0.2 2,-0.3 58,-0.0 60,-0.2 -0.856 360.0-161.3-107.5 150.1 4.4 21.3 -10.7 3 4 A K E -A 61 0A 115 58,-2.4 58,-2.4 -2,-0.3 2,-0.4 -0.943 7.2-147.7-124.8 149.5 7.2 18.7 -11.2 4 5 A K E -A 60 0A 89 -2,-0.3 2,-0.4 56,-0.2 56,-0.2 -0.959 4.6-160.7-119.6 140.6 8.8 16.5 -8.6 5 6 A V E -A 59 0A 42 54,-2.1 54,-2.9 -2,-0.4 2,-0.8 -0.944 20.5-131.8-113.3 142.6 12.4 15.2 -8.3 6 7 A L E +A 58 0A 93 -2,-0.4 2,-0.4 52,-0.2 52,-0.2 -0.807 37.0 170.2-101.3 103.3 13.1 12.2 -6.1 7 8 A L E -A 57 0A 49 50,-2.5 50,-3.2 -2,-0.8 2,-0.6 -0.898 27.9-151.1-119.4 142.7 16.1 12.9 -3.9 8 9 A T E -A 56 0A 69 -2,-0.4 48,-0.3 48,-0.3 2,-0.2 -0.948 18.2-163.0-112.2 113.2 17.7 11.2 -0.9 9 10 A G E -A 55 0A 0 46,-2.5 46,-2.0 -2,-0.6 2,-0.3 -0.570 5.4-149.9 -87.8 157.5 19.5 13.5 1.5 10 11 A T E +A 54 0A 64 44,-0.2 2,-0.3 -2,-0.2 44,-0.2 -0.931 17.8 168.6-129.0 154.3 22.0 12.4 4.1 11 12 A S E -A 53 0A 18 42,-1.9 42,-2.7 -2,-0.3 7,-0.1 -0.973 34.4-145.6-157.0 146.6 23.1 13.6 7.5 12 13 A E S S+ 0 0 102 -2,-0.3 39,-0.1 40,-0.2 3,-0.1 0.407 100.8 47.6 -86.8 2.9 25.2 12.3 10.4 13 14 A E S S- 0 0 142 1,-0.3 2,-0.3 40,-0.1 -1,-0.1 0.835 112.3 -23.9-111.4 -50.4 22.8 14.0 12.8 14 15 A S > - 0 0 47 39,-0.1 4,-1.9 1,-0.1 -1,-0.3 -0.997 49.4-105.2-162.7 163.7 19.1 13.4 12.1 15 16 A F H > S+ 0 0 79 -2,-0.3 4,-2.0 2,-0.2 5,-0.1 0.858 119.5 54.0 -63.0 -36.7 16.3 12.5 9.8 16 17 A T H > S+ 0 0 102 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.937 108.5 48.4 -62.2 -46.3 15.2 16.1 9.7 17 18 A A H > S+ 0 0 30 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.844 108.3 54.8 -65.0 -33.6 18.7 17.2 8.7 18 19 A A H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.921 107.7 49.4 -66.2 -39.7 18.8 14.6 6.0 19 20 A A H X S+ 0 0 16 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.928 110.3 51.3 -60.2 -43.5 15.6 16.0 4.5 20 21 A D H X S+ 0 0 85 -4,-2.2 4,-3.0 1,-0.2 -1,-0.2 0.865 103.5 59.2 -60.7 -37.6 17.1 19.4 4.6 21 22 A D H X S+ 0 0 67 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.910 108.8 43.9 -60.3 -43.4 20.2 18.1 2.8 22 23 A A H X S+ 0 0 3 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.917 114.0 49.3 -65.1 -45.1 18.0 17.0 -0.2 23 24 A I H X S+ 0 0 39 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.906 107.8 55.0 -63.2 -40.9 16.0 20.2 -0.2 24 25 A D H X S+ 0 0 86 -4,-3.0 4,-1.2 1,-0.2 -1,-0.2 0.906 108.5 48.9 -56.2 -45.9 19.2 22.4 -0.1 25 26 A R H X S+ 0 0 141 -4,-1.7 4,-0.8 2,-0.2 3,-0.4 0.908 110.0 50.9 -62.6 -43.2 20.4 20.6 -3.2 26 27 A A H >X S+ 0 0 1 -4,-2.2 4,-2.6 1,-0.2 3,-1.1 0.929 109.6 50.8 -57.5 -45.8 17.1 21.1 -5.0 27 28 A E H 3< S+ 0 0 113 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.721 102.2 61.6 -68.2 -22.6 17.3 24.8 -4.2 28 29 A D H 3< S+ 0 0 126 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.797 121.7 21.4 -64.6 -32.2 20.9 25.0 -5.5 29 30 A T H << S+ 0 0 86 -3,-1.1 2,-0.4 -4,-0.8 -2,-0.2 0.593 116.1 62.2-117.2 -22.7 19.6 24.0 -9.0 30 31 A L < - 0 0 46 -4,-2.6 3,-0.3 -5,-0.2 2,-0.3 -0.872 61.6-140.8-120.9 145.8 15.9 24.7 -9.2 31 32 A D S S+ 0 0 128 -2,-0.4 31,-0.1 1,-0.2 -3,-0.0 -0.699 80.5 22.5 -93.9 154.1 13.7 27.8 -9.0 32 33 A N - 0 0 81 -2,-0.3 30,-2.6 1,-0.2 2,-0.4 0.841 68.6-179.4 62.4 42.6 10.3 27.9 -7.3 33 34 A V E +B 61 0A 34 -3,-0.3 28,-0.3 28,-0.3 -1,-0.2 -0.611 5.9 170.4 -67.6 127.2 10.7 25.0 -4.9 34 35 A V E - 0 0 70 26,-2.7 2,-0.3 -2,-0.4 27,-0.2 0.715 49.2 -10.6-117.8 -29.5 7.4 24.8 -3.0 35 36 A W E -B 60 0A 103 25,-1.4 25,-2.9 2,-0.0 -1,-0.4 -0.988 46.6-143.7-167.6 162.2 7.2 21.6 -0.9 36 37 A A E -B 59 0A 38 -2,-0.3 2,-0.5 23,-0.2 23,-0.2 -0.993 9.4-155.1-136.5 141.9 8.8 18.2 -0.1 37 38 A E E -B 58 0A 82 21,-2.2 21,-2.4 -2,-0.3 2,-0.4 -0.980 19.9-129.7-117.5 124.5 7.1 15.0 0.8 38 39 A V E +B 57 0A 84 -2,-0.5 19,-0.3 19,-0.2 3,-0.1 -0.624 33.1 166.5 -72.3 128.1 9.0 12.3 2.8 39 40 A V E + 0 0 71 17,-2.8 2,-0.3 -2,-0.4 18,-0.2 0.539 61.1 5.1-117.9 -14.6 8.7 8.9 1.1 40 41 A D E -B 56 0A 105 16,-1.3 16,-2.9 2,-0.0 -1,-0.4 -0.961 52.9-165.7-164.8 154.7 11.4 6.8 2.9 41 42 A Q E +B 55 0A 106 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.993 21.3 146.0-143.4 145.0 13.9 6.9 5.8 42 43 A G E -B 54 0A 28 12,-2.3 12,-3.0 -2,-0.3 2,-0.4 -0.948 35.8-117.2-164.9-179.5 16.8 4.7 6.6 43 44 A V E -B 53 0A 59 -2,-0.3 2,-0.5 10,-0.2 10,-0.2 -0.991 12.9-145.6-138.0 126.2 20.3 4.5 8.1 44 45 A E E +B 52 0A 73 8,-2.9 8,-2.4 -2,-0.4 -2,-0.0 -0.798 33.6 153.0 -88.2 129.3 23.5 3.4 6.4 45 46 A I > + 0 0 110 -2,-0.5 3,-0.6 6,-0.2 2,-0.5 0.700 59.6 49.2-122.2 -55.5 25.7 1.6 8.9 46 47 A G T 3 S+ 0 0 80 1,-0.2 3,-0.1 5,-0.0 5,-0.0 -0.250 110.6 45.3 -97.8 43.7 28.1 -0.9 7.3 47 48 A A T 3 S+ 0 0 83 -2,-0.5 2,-0.2 1,-0.2 -1,-0.2 0.294 105.9 61.1-146.1 -13.9 29.6 1.3 4.5 48 49 A V S < S- 0 0 64 -3,-0.6 -1,-0.2 1,-0.1 3,-0.1 -0.734 75.2-125.0-120.9 162.6 30.4 4.5 6.5 49 50 A E S S+ 0 0 212 -2,-0.2 2,-0.4 1,-0.2 -1,-0.1 0.829 101.5 26.9 -74.0 -37.1 32.6 5.6 9.5 50 51 A E S S- 0 0 102 -3,-0.0 -1,-0.2 -6,-0.0 -3,-0.1 -0.961 104.0 -88.7-123.9 145.3 29.6 7.1 11.3 51 52 A R - 0 0 157 -2,-0.4 2,-0.5 -39,-0.1 -6,-0.2 -0.263 44.5-149.9 -47.1 136.7 25.9 6.1 11.0 52 53 A T E - B 0 44A 16 -8,-2.4 -8,-2.9 -4,-0.0 2,-0.3 -0.967 0.8-144.7-123.4 115.3 24.4 8.1 8.2 53 54 A Y E -AB 11 43A 57 -42,-2.7 -42,-1.9 -2,-0.5 2,-0.4 -0.571 15.8-161.9 -74.7 134.5 20.7 9.0 8.3 54 55 A Q E -AB 10 42A 71 -12,-3.0 -12,-2.3 -2,-0.3 2,-0.4 -0.981 10.1-176.1-121.7 132.3 19.0 9.0 4.9 55 56 A T E -AB 9 41A 1 -46,-2.0 -46,-2.5 -2,-0.4 2,-0.5 -0.987 12.6-153.4-129.0 121.3 15.7 10.7 4.1 56 57 A E E +AB 8 40A 48 -16,-2.9 -17,-2.8 -2,-0.4 -16,-1.3 -0.824 19.6 179.6 -96.9 129.5 14.1 10.4 0.7 57 58 A V E -AB 7 38A 2 -50,-3.2 -50,-2.5 -2,-0.5 2,-0.7 -0.972 33.0-135.1-129.8 142.7 11.9 13.2 -0.4 58 59 A Q E -AB 6 37A 53 -21,-2.4 -21,-2.2 -2,-0.4 2,-0.6 -0.898 31.8-155.1 -85.2 118.0 9.8 14.1 -3.5 59 60 A V E -AB 5 36A 0 -54,-2.9 -54,-2.1 -2,-0.7 2,-0.4 -0.902 5.6-154.4-103.1 117.7 10.7 17.8 -4.0 60 61 A A E +AB 4 35A 0 -25,-2.9 -26,-2.7 -2,-0.6 -25,-1.4 -0.741 15.2 176.8 -94.4 136.7 8.0 19.7 -5.8 61 62 A F E -AB 3 33A 14 -58,-2.4 -58,-2.4 -2,-0.4 2,-0.4 -0.981 31.0-112.8-137.7 148.4 8.8 22.9 -7.8 62 63 A E E -A 2 0A 91 -30,-2.6 -60,-0.2 -2,-0.3 2,-0.2 -0.667 29.9-129.4 -84.3 130.9 6.6 25.1 -9.9 63 64 A L 0 0 66 -62,-3.1 -31,-0.0 -2,-0.4 -1,-0.0 -0.553 360.0 360.0 -79.9 146.6 7.3 25.2 -13.7 64 65 A D 0 0 184 -2,-0.2 -2,-0.0 -33,-0.0 0, 0.0 0.673 360.0 360.0 73.9 360.0 7.7 28.6 -15.4