==== 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 2CCB . 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) . 4527.0 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 0 131 0, 0.0 62,-3.1 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 133.8 2.2 22.6 -13.2 2 3 A F E -A 62 0A 105 60,-0.2 2,-0.3 58,-0.0 60,-0.2 -0.836 360.0-161.6-103.6 149.0 4.4 21.2 -10.4 3 4 A K E -A 61 0A 114 58,-2.5 58,-2.4 -2,-0.3 2,-0.4 -0.957 7.0-148.9-124.3 148.3 7.2 18.6 -11.1 4 5 A K E -A 60 0A 89 -2,-0.3 2,-0.4 56,-0.2 56,-0.2 -0.955 4.4-160.3-117.7 140.8 8.7 16.4 -8.4 5 6 A V E -A 59 0A 39 54,-2.1 54,-3.0 -2,-0.4 2,-0.8 -0.940 20.8-130.8-113.9 143.3 12.3 15.1 -8.2 6 7 A L E +A 58 0A 93 -2,-0.4 2,-0.4 52,-0.2 52,-0.2 -0.805 37.6 170.8-101.0 104.3 13.0 12.0 -6.0 7 8 A L E -A 57 0A 48 50,-2.7 50,-3.0 -2,-0.8 2,-0.6 -0.916 28.2-150.2-121.1 141.4 16.0 12.8 -3.9 8 9 A T E -A 56 0A 70 -2,-0.4 48,-0.2 48,-0.3 2,-0.2 -0.935 18.7-163.9-109.4 113.2 17.7 11.1 -0.9 9 10 A G E -A 55 0A 0 46,-2.6 46,-1.9 -2,-0.6 2,-0.3 -0.562 5.2-151.4 -88.4 155.9 19.4 13.5 1.5 10 11 A T E +A 54 0A 63 44,-0.2 2,-0.3 -2,-0.2 44,-0.2 -0.950 17.2 168.9-129.3 154.1 21.9 12.3 4.1 11 12 A S E -A 53 0A 17 42,-2.2 42,-2.9 -2,-0.3 7,-0.1 -0.968 34.4-145.1-157.8 142.8 23.0 13.5 7.5 12 13 A E S S+ 0 0 96 -2,-0.3 39,-0.1 40,-0.2 3,-0.1 0.379 101.1 47.6 -84.4 5.9 25.2 12.3 10.4 13 14 A E S S- 0 0 140 1,-0.3 2,-0.3 40,-0.1 -1,-0.1 0.813 112.3 -22.8-112.8 -50.7 22.8 14.0 12.8 14 15 A S > - 0 0 46 39,-0.1 4,-1.9 1,-0.1 -1,-0.3 -0.995 49.4-106.4-161.9 162.5 19.0 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 0.857 119.8 54.0 -63.7 -37.7 16.3 12.5 9.8 16 17 A T H > S+ 0 0 104 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.947 108.8 47.8 -59.9 -47.0 15.2 16.1 9.7 17 18 A A H > S+ 0 0 31 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.846 108.9 54.6 -66.4 -31.5 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 0.925 107.2 50.0 -66.8 -38.1 18.8 14.5 6.0 19 20 A A H X S+ 0 0 17 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.937 110.1 51.4 -62.2 -42.4 15.5 15.9 4.5 20 21 A D H X S+ 0 0 84 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.859 103.3 59.1 -62.0 -37.1 17.1 19.4 4.6 21 22 A D H X S+ 0 0 70 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.911 108.9 43.7 -60.1 -43.6 20.2 18.0 2.7 22 23 A A H X S+ 0 0 3 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.911 114.7 48.6 -65.2 -43.5 18.0 16.9 -0.2 23 24 A I H X S+ 0 0 40 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.908 107.9 55.6 -66.2 -40.0 16.0 20.1 -0.2 24 25 A D H X S+ 0 0 84 -4,-3.1 4,-1.2 1,-0.2 -1,-0.2 0.901 108.8 47.9 -55.5 -46.3 19.2 22.2 -0.1 25 26 A R H X S+ 0 0 141 -4,-1.7 4,-0.9 2,-0.2 3,-0.3 0.902 110.3 51.1 -63.5 -43.3 20.4 20.3 -3.2 26 27 A A H >X S+ 0 0 1 -4,-2.2 4,-2.3 1,-0.2 3,-0.9 0.926 109.7 50.3 -59.3 -44.3 17.1 20.9 -5.0 27 28 A E H 3< S+ 0 0 117 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.733 103.5 60.6 -69.1 -21.6 17.3 24.6 -4.2 28 29 A D H 3< S+ 0 0 126 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.797 121.6 22.1 -67.6 -31.6 20.9 24.8 -5.6 29 30 A T H << S+ 0 0 81 -3,-0.9 2,-0.4 -4,-0.9 -2,-0.2 0.556 116.4 61.6-117.9 -17.9 19.7 23.7 -9.0 30 31 A L < - 0 0 47 -4,-2.3 3,-0.4 -5,-0.2 2,-0.3 -0.900 63.1-138.2-123.8 146.1 16.0 24.5 -9.3 31 32 A D S S+ 0 0 130 -2,-0.4 31,-0.1 1,-0.2 33,-0.1 -0.719 81.9 20.7 -94.1 151.2 13.8 27.5 -9.2 32 33 A N - 0 0 83 -2,-0.3 30,-2.5 1,-0.2 2,-0.4 0.840 68.8-178.3 65.9 41.9 10.5 27.7 -7.4 33 34 A V E +B 61 0A 31 -3,-0.4 28,-0.3 28,-0.3 -1,-0.2 -0.600 6.8 170.9 -68.9 124.1 10.9 24.8 -4.9 34 35 A V E - 0 0 74 26,-2.8 2,-0.3 -2,-0.4 27,-0.2 0.775 47.8 -15.7-113.4 -37.8 7.6 24.7 -3.0 35 36 A W E -B 60 0A 95 25,-1.3 25,-3.1 2,-0.0 -1,-0.4 -0.980 47.6-139.5-160.3 167.9 7.4 21.6 -0.8 36 37 A A E -B 59 0A 36 -2,-0.3 2,-0.5 23,-0.2 23,-0.2 -0.995 7.4-154.6-135.0 145.8 8.7 18.2 -0.1 37 38 A E E -B 58 0A 83 21,-2.3 21,-2.4 -2,-0.4 2,-0.4 -0.981 21.4-128.9-117.7 127.5 7.0 14.9 0.8 38 39 A V E +B 57 0A 84 -2,-0.5 19,-0.3 19,-0.2 3,-0.1 -0.600 32.6 167.5 -75.4 129.4 8.9 12.3 2.8 39 40 A V E + 0 0 68 17,-2.9 2,-0.3 1,-0.4 18,-0.2 0.519 61.7 2.1-118.1 -12.5 8.7 8.9 1.1 40 41 A D E -B 56 0A 107 16,-1.3 16,-3.0 2,-0.0 -1,-0.4 -0.947 52.8-162.1-167.2 153.7 11.3 6.8 3.0 41 42 A Q E +B 55 0A 106 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.991 21.5 152.9-139.3 147.2 13.8 7.0 5.8 42 43 A G E -B 54 0A 29 12,-2.3 12,-2.9 -2,-0.3 2,-0.4 -0.942 32.8-122.5-160.9 178.2 16.8 4.8 6.6 43 44 A V E -B 53 0A 58 -2,-0.3 2,-0.5 10,-0.2 10,-0.2 -0.989 11.6-145.7-138.7 124.9 20.2 4.5 8.2 44 45 A E E +B 52 0A 73 8,-2.9 8,-2.3 -2,-0.4 -2,-0.0 -0.791 34.6 154.4 -88.5 129.7 23.5 3.5 6.6 45 46 A I > + 0 0 108 -2,-0.5 3,-0.6 6,-0.2 2,-0.5 0.722 55.4 47.2-125.5 -54.8 25.5 1.6 9.2 46 47 A G T 3 S+ 0 0 81 1,-0.2 3,-0.1 5,-0.0 5,-0.0 -0.353 111.2 43.4-105.7 50.1 28.1 -0.9 7.9 47 48 A A T 3 S+ 0 0 83 -2,-0.5 2,-0.3 1,-0.2 -1,-0.2 0.139 105.5 68.7-156.9 3.7 30.0 1.0 5.2 48 49 A V S < S- 0 0 57 -3,-0.6 -1,-0.2 1,-0.1 3,-0.1 -0.902 72.7-133.5-127.7 154.8 30.4 4.4 7.0 49 50 A E S S+ 0 0 206 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.922 99.4 31.5 -71.7 -46.0 32.4 5.5 10.1 50 51 A E S S- 0 0 99 1,-0.0 -1,-0.2 0, 0.0 -6,-0.1 -0.917 102.5 -97.1-110.4 140.7 29.5 7.3 11.6 51 52 A R - 0 0 153 -2,-0.4 2,-0.5 -39,-0.1 -6,-0.2 -0.289 40.4-147.1 -49.1 138.2 25.8 6.2 11.1 52 53 A T E - B 0 44A 16 -8,-2.3 -8,-2.9 -4,-0.0 -40,-0.2 -0.956 2.3-146.9-121.3 115.8 24.3 8.2 8.3 53 54 A Y E -AB 11 43A 58 -42,-2.9 -42,-2.2 -2,-0.5 2,-0.4 -0.545 16.4-163.0 -78.1 142.3 20.6 9.0 8.5 54 55 A Q E -AB 10 42A 65 -12,-2.9 -12,-2.3 -44,-0.2 2,-0.4 -0.988 12.2-174.3-130.7 137.7 18.8 9.2 5.1 55 56 A T E -AB 9 41A 1 -46,-1.9 -46,-2.6 -2,-0.4 2,-0.5 -0.988 12.6-153.5-131.3 123.3 15.5 10.8 4.2 56 57 A E E -AB 8 40A 46 -16,-3.0 -17,-2.9 -2,-0.4 -16,-1.3 -0.839 20.8-179.9 -98.6 131.4 14.1 10.4 0.8 57 58 A V E -AB 7 38A 2 -50,-3.0 -50,-2.7 -2,-0.5 2,-0.7 -0.975 34.4-133.6-130.8 142.8 11.8 13.1 -0.4 58 59 A Q E -AB 6 37A 52 -21,-2.4 -21,-2.3 -2,-0.4 2,-0.6 -0.887 33.1-155.4 -82.3 116.3 9.8 14.0 -3.4 59 60 A V E -AB 5 36A 0 -54,-3.0 -54,-2.1 -2,-0.7 2,-0.4 -0.901 5.9-152.6-102.2 119.9 10.7 17.7 -3.8 60 61 A A E +AB 4 35A 0 -25,-3.1 -26,-2.8 -2,-0.6 -25,-1.3 -0.735 15.9 177.8 -95.7 137.2 8.1 19.7 -5.7 61 62 A F E -AB 3 33A 14 -58,-2.4 -58,-2.5 -2,-0.4 2,-0.5 -0.977 30.9-113.5-137.4 149.5 8.8 22.8 -7.7 62 63 A E E -A 2 0A 91 -30,-2.5 -60,-0.2 -2,-0.3 2,-0.2 -0.708 31.2-129.6 -88.2 129.3 6.6 25.0 -9.8 63 64 A L 0 0 67 -62,-3.1 -31,-0.0 -2,-0.5 -1,-0.0 -0.517 360.0 360.0 -79.0 144.4 7.3 24.9 -13.6 64 65 A D 0 0 195 -2,-0.2 -2,-0.0 -33,-0.1 0, 0.0 0.792 360.0 360.0 84.5 360.0 7.7 28.2 -15.5