==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 04-JAN-13 4IN5 . COMPND 2 MOLECULE: REACTION CENTER PROTEIN L CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOBACTER SPHAEROIDES; . AUTHOR R.G.SAER,A.HARDJASA,M.E.MURPHY,J.T.BEATTY . 823 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34172.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 578 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 64 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 26 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 95 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 335 40.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.6 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 4 0 5 0 0 0 0 1 1 0 2 0 0 3 0 0 0 0 0 2 2 1 1 1 2 0 0 RESIDUES PER ALPHA HELIX . 2 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 PARALLEL BRIDGES PER LADDER . 9 2 4 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 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 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 L A 0 0 45 0, 0.0 2,-0.3 0, 0.0 618,-0.2 0.000 360.0 360.0 360.0 152.6 10.8 76.5 0.8 2 2 L L B -A 618 0A 6 616,-2.4 616,-2.8 614,-0.0 623,-0.2 -0.928 360.0-106.7-129.7 143.1 12.8 73.7 2.5 3 3 L L >> - 0 0 2 -2,-0.3 3,-1.8 614,-0.2 4,-0.5 -0.406 47.3-103.7 -60.1 155.2 16.3 73.1 3.6 4 4 L S T 34 S+ 0 0 7 610,-3.0 652,-0.2 1,-0.3 -1,-0.1 0.764 121.7 36.0 -55.0 -23.7 18.0 70.6 1.3 5 5 L F T 34 S+ 0 0 7 1,-0.1 3,-0.3 609,-0.1 -1,-0.3 0.352 94.9 93.2-113.2 5.5 17.7 67.8 3.9 6 6 L E T X> + 0 0 0 -3,-1.8 3,-1.9 1,-0.2 4,-0.6 0.813 61.6 74.6 -79.4 -31.6 14.4 68.8 5.4 7 7 L R G >< S+ 0 0 67 -4,-0.5 3,-1.7 1,-0.3 666,-0.2 0.868 86.7 61.4 -57.3 -40.8 11.7 66.8 3.5 8 8 L K G 34 S+ 0 0 1 -3,-0.3 677,-3.2 1,-0.3 -1,-0.3 0.725 105.2 50.0 -60.6 -19.2 12.3 63.4 5.0 9 9 L Y G <4 S+ 0 0 0 -3,-1.9 2,-2.0 -4,-0.2 -1,-0.3 0.598 85.0 89.8 -91.7 -12.6 11.4 64.8 8.4 10 10 L R << + 0 0 3 -3,-1.7 663,-2.8 -4,-0.6 -1,-0.1 -0.415 60.0 135.1 -86.5 66.8 8.1 66.4 7.3 11 11 L V - 0 0 0 -2,-2.0 663,-0.2 661,-0.2 2,-0.1 -0.614 60.5 -90.1-104.2 166.4 5.9 63.4 8.0 12 12 L P S S+ 0 0 51 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.421 78.0 55.2 -71.7 155.4 2.6 63.3 9.8 13 13 L G + 0 0 23 6,-0.1 -2,-0.1 -2,-0.1 804,-0.0 -0.224 45.4 94.1 115.6 162.4 2.3 62.9 13.6 14 14 L G + 0 0 12 1,-0.3 95,-0.2 95,-0.1 96,-0.2 0.186 52.8 138.6 107.5 -11.7 3.4 64.3 16.9 15 15 L T - 0 0 23 1,-0.1 -1,-0.3 94,-0.1 3,-0.1 -0.273 41.3-157.8 -66.6 148.0 0.5 66.6 17.6 16 16 L L S S+ 0 0 70 1,-0.3 2,-0.3 86,-0.1 -1,-0.1 0.713 78.3 23.5 -92.7 -29.0 -1.0 66.8 21.1 17 17 L V S S+ 0 0 65 2,-0.2 16,-0.5 1,-0.1 -1,-0.3 -0.997 117.2 21.1-139.6 139.2 -4.4 68.0 20.1 18 18 L G S > S- 0 0 42 -2,-0.3 3,-2.4 -3,-0.1 5,-0.2 0.448 80.1-131.7 94.9 1.6 -6.4 67.9 16.9 19 19 L G T 3 S- 0 0 46 1,-0.3 3,-0.4 2,-0.1 -2,-0.2 -0.280 81.4 -13.4 45.7-120.3 -4.8 64.9 15.1 20 20 L N T > S+ 0 0 133 1,-0.2 3,-1.5 2,-0.1 -1,-0.3 0.510 109.6 100.3 -84.0 -5.5 -4.1 66.0 11.5 21 21 L L T < S+ 0 0 111 -3,-2.4 -1,-0.2 1,-0.3 -2,-0.1 0.862 100.3 18.3 -57.6 -39.7 -6.2 69.2 11.5 22 22 L F T 3 S+ 0 0 54 -3,-0.4 10,-2.3 -5,-0.2 2,-1.6 0.131 88.8 126.2-116.8 22.5 -3.4 71.6 12.1 23 23 L D < + 0 0 5 -3,-1.5 2,-0.3 -5,-0.2 -3,-0.0 -0.597 51.6 84.8 -83.4 81.8 -0.5 69.3 11.0 24 24 L F - 0 0 54 -2,-1.6 7,-2.6 647,-0.2 8,-0.4 -0.959 66.0-115.8-164.9 176.1 1.2 71.5 8.4 25 25 L W E -C 30 0B 7 645,-3.1 2,-0.4 -2,-0.3 5,-0.2 -0.802 4.3-146.4-120.5 160.8 3.6 74.3 7.9 26 26 L V E > S-C 29 0B 93 3,-2.7 3,-1.5 -2,-0.3 644,-0.1 -0.928 78.2 -51.0-123.6 105.6 3.5 77.9 6.6 27 27 L G T 3 S- 0 0 37 -2,-0.4 512,-0.0 1,-0.3 -2,-0.0 -0.552 125.4 -18.8 61.9-128.1 6.8 78.4 4.9 28 28 L P T 3 S+ 0 0 27 0, 0.0 2,-0.3 0, 0.0 -1,-0.3 0.773 118.5 99.3 -76.2 -27.8 9.5 77.3 7.5 29 29 L F E < -C 26 0B 86 -3,-1.5 -3,-2.7 509,-0.1 2,-0.3 -0.393 65.3-143.0 -73.7 129.5 7.1 77.5 10.4 30 30 L Y E -C 25 0B 2 506,-2.1 -5,-0.2 -2,-0.3 -7,-0.1 -0.657 17.0-167.5 -75.1 146.4 5.4 74.5 11.8 31 31 L V > + 0 0 22 -7,-2.6 4,-0.8 -2,-0.3 -1,-0.2 0.845 17.7 155.7 -98.2 -88.4 1.8 75.2 12.9 32 32 L G H > - 0 0 0 -10,-2.3 4,-1.6 -8,-0.4 3,-0.2 0.005 68.8 -67.2 73.9 167.4 -0.0 72.7 15.0 33 33 L F H > S+ 0 0 72 -16,-0.5 4,-2.7 1,-0.2 -1,-0.2 0.898 138.1 51.5 -54.1 -46.7 -2.9 73.5 17.4 34 34 L F H > S+ 0 0 25 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.746 103.5 57.1 -70.8 -19.8 -0.5 75.4 19.6 35 35 L G H X S+ 0 0 13 -4,-0.8 4,-2.2 -3,-0.2 -1,-0.2 0.888 109.6 45.5 -68.9 -41.0 0.7 77.5 16.7 36 36 L V H X S+ 0 0 62 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.938 114.2 49.1 -64.1 -46.3 -3.0 78.5 16.1 37 37 L A H X S+ 0 0 14 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.936 111.1 50.6 -60.1 -44.0 -3.3 79.1 19.9 38 38 L T H X S+ 0 0 17 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.916 109.9 48.9 -58.0 -47.2 -0.1 81.2 19.8 39 39 L F H X S+ 0 0 162 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.936 112.7 48.7 -61.3 -42.5 -1.3 83.3 16.9 40 40 L F H X S+ 0 0 123 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.943 115.0 42.4 -63.2 -51.3 -4.6 84.0 18.6 41 41 L F H X S+ 0 0 56 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.922 119.0 44.9 -64.7 -42.5 -3.1 85.0 22.0 42 42 L A H X S+ 0 0 34 -4,-2.7 4,-2.4 -5,-0.3 -1,-0.2 0.878 113.2 49.5 -70.5 -39.2 -0.4 87.0 20.5 43 43 L A H X S+ 0 0 31 -4,-2.9 4,-2.8 -5,-0.3 5,-0.2 0.961 114.1 45.6 -65.4 -48.9 -2.7 88.7 17.9 44 44 L L H X S+ 0 0 60 -4,-2.7 4,-2.6 -5,-0.3 5,-0.2 0.934 113.6 49.6 -58.1 -46.4 -5.2 89.6 20.6 45 45 L G H X S+ 0 0 8 -4,-2.6 4,-1.4 -5,-0.2 -1,-0.2 0.892 112.2 47.2 -64.4 -39.4 -2.5 90.8 23.0 46 46 L I H X S+ 0 0 113 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.917 111.0 51.2 -68.5 -42.6 -0.9 93.0 20.3 47 47 L I H X S+ 0 0 108 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.911 109.9 51.4 -56.0 -43.8 -4.3 94.5 19.3 48 48 L L H X S+ 0 0 20 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.791 108.1 50.8 -68.9 -27.4 -5.0 95.3 22.9 49 49 L I H X S+ 0 0 58 -4,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.861 108.0 52.4 -75.0 -41.0 -1.6 97.0 23.2 50 50 L A H X S+ 0 0 34 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.907 111.4 47.5 -58.2 -41.2 -2.4 99.1 20.1 51 51 L W H X S+ 0 0 119 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.907 108.7 53.6 -63.9 -45.4 -5.7 100.1 21.8 52 52 L S H X S+ 0 0 14 -4,-2.0 4,-0.7 1,-0.2 -1,-0.2 0.838 106.1 54.9 -58.1 -32.0 -4.0 100.9 25.0 53 53 L A H X>S+ 0 0 0 -4,-1.7 5,-2.1 2,-0.2 4,-1.8 0.874 106.5 49.1 -68.6 -39.8 -1.7 103.2 23.0 54 54 L V H <5S+ 0 0 85 -4,-1.5 3,-0.3 1,-0.2 -2,-0.2 0.961 112.0 49.9 -63.4 -48.4 -4.7 105.1 21.5 55 55 L L H <5S+ 0 0 86 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.623 113.9 45.3 -59.2 -21.4 -6.1 105.5 25.1 56 56 L Q H <5S- 0 0 80 -4,-0.7 -1,-0.2 -3,-0.3 -2,-0.2 0.657 113.3-121.9 -95.5 -27.5 -2.7 106.8 26.2 57 57 L G T <5S+ 0 0 65 -4,-1.8 2,-0.3 -3,-0.3 -3,-0.2 0.780 71.1 94.2 91.1 32.6 -2.4 109.1 23.2 58 58 L T < - 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