==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 22-DEC-05 2FGO . COMPND 2 MOLECULE: FERREDOXIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR P.GIASTAS,N.PINOTSIS,I.M.MAVRIDIS . 81 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5201.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 37 45.7 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 . 6 7.4 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 . 1 1.2 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 . 3 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 19.8 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 1 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 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 . 1 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 . 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 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 S 0 0 1 0, 0.0 60,-2.7 0, 0.0 63,-0.2 0.000 360.0 360.0 360.0 160.6 1.6 16.8 20.2 2 2 A L B -A 60 0A 3 58,-0.3 2,-0.3 63,-0.1 58,-0.3 -0.570 360.0-155.1 -93.0 173.5 1.9 18.6 23.5 3 3 A K - 0 0 89 56,-2.5 2,-0.5 -2,-0.2 28,-0.1 -0.973 15.1-122.0-142.4 159.1 1.9 22.4 23.7 4 4 A I - 0 0 17 -2,-0.3 54,-0.2 54,-0.2 28,-0.1 -0.883 32.1-149.2-103.6 126.0 3.3 25.0 26.2 5 5 A T > - 0 0 33 52,-2.7 3,-2.0 -2,-0.5 25,-0.2 -0.319 31.8 -90.6 -88.7 177.2 0.8 27.3 27.7 6 6 A D T 3 S+ 0 0 139 1,-0.3 -1,-0.1 -2,-0.1 51,-0.0 0.565 114.6 76.5 -61.6 -12.2 0.9 30.9 29.0 7 7 A D T 3 + 0 0 112 50,-0.1 -1,-0.3 2,-0.0 50,-0.1 0.634 65.7 125.3 -78.0 -9.7 1.7 29.7 32.5 8 8 A C < - 0 0 19 -3,-2.0 -4,-0.0 49,-0.2 45,-0.0 -0.208 47.8-161.1 -51.2 132.4 5.3 29.0 31.4 9 9 A I - 0 0 102 20,-0.0 -1,-0.1 0, 0.0 20,-0.1 0.223 37.6-117.9-103.0 14.5 7.8 30.8 33.6 10 10 A N + 0 0 59 1,-0.1 -2,-0.1 2,-0.0 19,-0.0 0.868 62.9 147.8 57.1 40.0 10.7 30.6 31.1 11 11 A C - 0 0 62 1,-0.1 -1,-0.1 19,-0.0 -3,-0.0 0.646 47.6-141.6 -82.2 -15.2 12.9 28.5 33.4 12 12 A D > + 0 0 68 1,-0.1 3,-1.0 12,-0.0 -1,-0.1 0.234 64.4 120.6 75.7 -8.0 14.5 26.5 30.4 13 13 A V T 3 S+ 0 0 70 1,-0.3 4,-0.3 2,-0.2 40,-0.1 0.805 70.9 53.0 -66.9 -28.3 14.6 23.1 32.2 14 14 A C T >> S+ 0 0 12 1,-0.2 3,-1.2 2,-0.1 4,-0.9 0.796 91.7 75.4 -70.0 -29.3 12.5 21.4 29.5 15 15 A E G X4 S+ 0 0 80 -3,-1.0 3,-0.8 1,-0.3 8,-0.3 0.877 97.0 42.7 -59.3 -47.5 14.5 22.4 26.5 16 16 A P G 34 S+ 0 0 87 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.657 106.9 66.1 -71.0 -12.5 17.5 20.0 27.0 17 17 A E G <4 S+ 0 0 61 -3,-1.2 -2,-0.2 -4,-0.3 31,-0.1 0.716 73.3 100.7 -78.8 -21.6 15.1 17.1 27.8 18 18 A C X< - 0 0 27 -4,-0.9 3,-1.0 -3,-0.8 5,-0.1 -0.532 58.2-157.9 -74.0 120.1 13.4 16.8 24.5 19 19 A P T 3 S+ 0 0 45 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.729 93.9 42.5 -67.5 -20.0 14.9 13.9 22.5 20 20 A N T 3 S- 0 0 21 16,-0.1 -2,-0.1 -3,-0.0 -3,-0.0 0.331 109.1-116.7-107.1 4.7 13.7 15.5 19.2 21 21 A G < + 0 0 49 -3,-1.0 16,-0.1 -6,-0.1 -6,-0.0 0.829 65.4 144.2 69.5 28.0 14.6 19.1 19.8 22 22 A A + 0 0 5 14,-0.2 11,-2.7 10,-0.1 2,-0.4 0.624 46.6 78.1 -79.3 -15.1 11.0 20.2 19.7 23 23 A I E +B 32 0B 7 -8,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.791 50.5 156.7-101.5 136.7 11.3 22.9 22.4 24 24 A S E -B 31 0B 67 7,-2.3 7,-2.7 -2,-0.4 2,-0.4 -0.973 46.4 -93.5-145.5 164.4 12.7 26.4 22.0 25 25 A Q E -B 30 0B 122 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.702 43.4-165.3 -79.8 127.8 12.4 29.7 23.7 26 26 A G - 0 0 25 3,-2.1 4,-0.1 -2,-0.4 5,-0.0 -0.237 40.0 -81.4 -98.1-169.6 9.8 32.0 22.1 27 27 A E S S+ 0 0 181 1,-0.1 3,-0.1 -2,-0.1 -2,-0.0 0.840 122.5 2.0 -63.8 -36.8 9.1 35.7 22.4 28 28 A E S S+ 0 0 149 1,-0.3 2,-0.3 2,-0.0 -1,-0.1 0.586 136.0 6.8-121.8 -31.9 7.1 35.4 25.7 29 29 A I S S- 0 0 33 -20,-0.1 -3,-2.1 -25,-0.1 -1,-0.3 -0.881 87.3 -77.2-145.5 171.8 7.1 31.7 26.6 30 30 A Y E -B 25 0B 12 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.405 47.6-149.4 -75.0 157.4 8.7 28.4 25.4 31 31 A V E -B 24 0B 68 -7,-2.7 -7,-2.3 -28,-0.1 2,-0.5 -0.998 9.7-144.4-137.5 138.0 7.3 26.8 22.3 32 32 A I E -B 23 0B 14 -2,-0.4 -9,-0.2 -9,-0.2 -28,-0.1 -0.854 15.5-139.5 -99.3 131.1 6.8 23.2 21.0 33 33 A D >> - 0 0 70 -11,-2.7 3,-2.3 -2,-0.5 4,-1.1 -0.805 12.2-152.1 -83.9 109.9 7.2 22.6 17.3 34 34 A P T 34 S+ 0 0 40 0, 0.0 -1,-0.2 0, 0.0 3,-0.2 0.777 91.1 65.2 -60.2 -24.6 4.4 20.1 16.7 35 35 A N T 34 S+ 0 0 124 1,-0.2 -13,-0.0 -13,-0.1 43,-0.0 0.677 111.1 35.6 -71.2 -11.8 6.3 18.6 13.8 36 36 A L T <4 S+ 0 0 54 -3,-2.3 2,-0.8 -14,-0.1 -14,-0.2 0.508 94.2 97.9-114.1 -9.9 9.0 17.4 16.2 37 37 A C < + 0 0 11 -4,-1.1 37,-0.1 -3,-0.2 38,-0.1 -0.727 34.7 167.5 -90.4 113.7 6.9 16.5 19.2 38 38 A T > - 0 0 1 -2,-0.8 3,-2.2 36,-0.1 -1,-0.1 0.193 61.3-109.6 -97.1 8.3 6.1 12.7 19.3 39 39 A E T 3 S- 0 0 35 1,-0.3 3,-0.1 -37,-0.1 -2,-0.1 0.839 70.7 -71.8 53.1 34.1 4.8 13.0 22.9 40 40 A C T >> S+ 0 0 10 1,-0.2 4,-2.6 7,-0.1 3,-2.3 0.468 89.5 156.9 61.9 8.9 8.2 11.1 23.5 41 41 A V T <4 + 0 0 24 -3,-2.2 -1,-0.2 1,-0.3 4,-0.1 -0.401 66.9 27.6 -72.2 139.2 6.8 7.9 22.0 42 42 A G T 34 S+ 0 0 33 2,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.106 128.4 46.0 96.3 -18.8 9.7 5.8 20.7 43 43 A H T <4 S+ 0 0 78 -3,-2.3 2,-0.3 1,-0.4 -2,-0.2 0.721 117.7 13.0-114.1 -47.6 12.1 7.3 23.3 44 44 A Y < - 0 0 103 -4,-2.6 -1,-0.4 1,-0.1 -2,-0.2 -0.952 60.2-127.6-135.1 153.9 10.3 7.4 26.7 45 45 A D S S+ 0 0 179 -2,-0.3 -4,-0.1 -4,-0.1 -1,-0.1 0.679 101.0 26.7 -69.2 -23.5 7.2 5.9 28.3 46 46 A E S S- 0 0 111 -6,-0.1 -1,-0.1 -5,-0.0 5,-0.1 -0.977 103.7 -83.2-137.1 148.5 6.1 9.4 29.4 47 47 A P > - 0 0 23 0, 0.0 4,-0.9 0, 0.0 -7,-0.1 -0.313 35.7-153.3 -52.7 127.6 6.8 12.9 28.0 48 48 A Q H > S+ 0 0 46 1,-0.2 4,-0.8 2,-0.2 5,-0.2 0.871 90.2 58.5 -78.6 -35.9 10.1 14.0 29.5 49 49 A C H >> S+ 0 0 12 1,-0.2 4,-1.5 2,-0.2 3,-1.2 0.929 103.9 52.8 -58.8 -44.7 9.4 17.7 29.3 50 50 A Q H 34 S+ 0 0 69 1,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.855 101.8 61.3 -60.8 -33.3 6.3 17.2 31.6 51 51 A Q H 3< S+ 0 0 116 -4,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.787 113.9 32.5 -67.6 -22.9 8.5 15.4 34.1 52 52 A V H << S+ 0 0 52 -3,-1.2 -1,-0.2 -4,-0.8 -2,-0.2 0.587 86.4 113.7-109.2 -13.3 10.8 18.4 34.8 53 53 A C >< - 0 0 15 -4,-1.5 3,-0.5 -5,-0.2 5,-0.1 -0.397 54.4-152.7 -66.0 128.5 8.4 21.3 34.3 54 54 A P T 3 S+ 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.740 91.3 35.1 -75.4 -19.7 8.0 23.2 37.6 55 55 A V T 3 S- 0 0 57 0, 0.0 -2,-0.1 0, 0.0 -48,-0.0 0.223 100.1-123.3-118.6 13.0 4.5 24.6 36.8 56 56 A D < + 0 0 135 -3,-0.5 -6,-0.1 -6,-0.2 -48,-0.0 0.891 59.2 145.8 46.1 52.1 2.9 21.7 34.7 57 57 A C + 0 0 6 1,-0.1 -52,-2.7 -52,-0.1 -49,-0.2 -0.031 40.2 91.2-105.5 29.6 2.2 24.0 31.8 58 58 A I + 0 0 6 -54,-0.2 -54,-0.2 -8,-0.1 -1,-0.1 -0.591 54.5 160.4-123.0 71.9 2.8 21.4 29.0 59 59 A P - 0 0 51 0, 0.0 -56,-2.5 0, 0.0 -2,-0.0 -0.313 51.1 -73.6 -83.2 169.0 -0.6 19.7 28.3 60 60 A L B -A 2 0A 105 -58,-0.3 2,-0.7 1,-0.1 -58,-0.3 -0.304 54.2-115.0 -46.6 139.4 -1.8 17.8 25.3 61 61 A D > - 0 0 25 -60,-2.7 3,-2.1 3,-0.3 -1,-0.1 -0.788 19.0-159.3 -90.6 113.2 -2.5 20.1 22.4 62 62 A D T 3 S+ 0 0 143 -2,-0.7 3,-0.4 1,-0.3 -1,-0.2 0.687 93.8 55.6 -62.3 -18.6 -6.2 20.2 21.6 63 63 A A T 3 S+ 0 0 84 1,-0.2 -1,-0.3 -62,-0.1 -2,-0.0 0.544 112.4 42.6 -92.1 -4.5 -5.3 21.5 18.1 64 64 A N S < S+ 0 0 60 -3,-2.1 2,-0.4 -63,-0.2 -3,-0.3 -0.483 72.0 173.2-142.1 64.2 -3.0 18.5 17.4 65 65 A V + 0 0 120 -3,-0.4 2,-0.3 -5,-0.1 -3,-0.1 -0.649 11.8 177.2 -80.6 124.1 -4.6 15.3 18.6 66 66 A E - 0 0 49 -2,-0.4 2,-0.1 -65,-0.1 -2,-0.0 -0.959 24.0-130.7-132.9 146.1 -2.5 12.2 17.6 67 67 A S > - 0 0 55 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.460 33.7-107.5 -83.5 163.2 -2.7 8.5 18.2 68 68 A K H > S+ 0 0 151 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.914 123.0 53.5 -57.0 -41.5 0.1 6.3 19.4 69 69 A D H > S+ 0 0 134 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.918 109.9 46.7 -61.6 -43.1 0.4 4.9 15.9 70 70 A Q H > S+ 0 0 97 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.906 113.4 48.5 -63.0 -40.2 0.6 8.4 14.4 71 71 A L H X S+ 0 0 4 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.891 110.1 50.7 -68.8 -38.8 3.2 9.5 17.0 72 72 A M H X S+ 0 0 45 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.892 108.7 52.7 -67.5 -37.7 5.3 6.4 16.4 73 73 A E H X S+ 0 0 93 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.896 109.5 49.3 -62.0 -39.2 5.2 7.0 12.6 74 74 A K H X S+ 0 0 31 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.919 108.3 53.7 -65.2 -41.9 6.5 10.6 13.4 75 75 A Y H X S+ 0 0 11 -4,-2.5 4,-2.7 1,-0.2 6,-0.5 0.928 108.0 50.3 -54.3 -47.5 9.2 9.1 15.5 76 76 A R H X S+ 0 0 133 -4,-2.2 4,-2.2 1,-0.2 5,-0.2 0.913 112.1 46.7 -62.7 -39.7 10.4 6.9 12.7 77 77 A K H < S+ 0 0 145 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.913 115.0 45.8 -70.5 -38.8 10.5 9.8 10.2 78 78 A I H < S+ 0 0 57 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.933 126.2 29.0 -69.2 -41.2 12.3 12.0 12.5 79 79 A T H < S- 0 0 54 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.587 94.3-130.5 -95.7 -16.8 14.9 9.5 13.6 80 80 A G < 0 0 72 -4,-2.2 -3,-0.2 -5,-0.3 -4,-0.2 0.499 360.0 360.0 74.5 6.6 15.1 7.2 10.5 81 81 A K 0 0 155 -6,-0.5 -1,-0.3 -5,-0.2 -2,-0.1 -0.418 360.0 360.0 -89.0 360.0 14.6 4.3 13.0