==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PHOTOSYNTHESIS/MEMBRANE PROTEIN 29-JUN-06 2HIT . COMPND 2 MOLECULE: REACTION CENTER PROTEIN L CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOBACTER SPHAEROIDES; . AUTHOR A.W.ROSZAK,A.T.GARDINER,N.W.ISAACS,R.J.COGDELL . 826 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34067.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 588 71.2 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 . 63 7.6 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 . 31 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 101 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 336 40.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.4 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 3 2 2 2 0 0 0 0 2 0 2 0 0 3 0 0 0 0 1 1 2 1 1 0 3 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 . 8 1 4 2 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 ANTIPARALLEL BRIDGES PER LADDER . 4 1 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 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 35 0, 0.0 2,-0.4 0, 0.0 620,-0.2 0.000 360.0 360.0 360.0 167.8 1.8 91.9 60.4 2 2 L L B -A 620 0A 4 618,-3.2 618,-3.5 616,-0.0 625,-0.2 -0.978 360.0-110.7-135.1 141.4 0.5 95.1 58.8 3 3 L L > - 0 0 2 -2,-0.4 3,-2.0 616,-0.2 4,-0.4 -0.361 47.6-103.4 -55.8 148.4 1.8 98.4 57.7 4 4 L S T 3 S+ 0 0 9 612,-2.0 654,-0.2 1,-0.3 3,-0.2 0.759 120.9 35.7 -49.1 -28.9 0.5 101.1 59.9 5 5 L F T 3 S+ 0 0 5 1,-0.1 3,-0.3 2,-0.1 -1,-0.3 0.421 95.0 92.7-108.3 3.9 -2.0 102.2 57.3 6 6 L E X> + 0 0 0 -3,-2.0 3,-1.7 1,-0.2 4,-0.7 0.721 61.4 74.1 -76.7 -28.9 -3.0 98.9 55.9 7 7 L R G >4 S+ 0 0 64 -4,-0.4 3,-1.8 1,-0.3 -1,-0.2 0.896 88.3 62.5 -62.3 -42.0 -6.0 97.5 57.8 8 8 L K G 34 S+ 0 0 1 -3,-0.3 679,-2.9 1,-0.3 -1,-0.3 0.711 105.9 47.2 -53.5 -22.8 -8.5 99.9 56.2 9 9 L Y G <4 S+ 0 0 1 -3,-1.7 2,-2.0 -4,-0.2 -1,-0.3 0.599 85.6 91.0 -95.2 -15.5 -7.8 98.3 52.8 10 10 L R << + 0 0 4 -3,-1.8 665,-2.6 -4,-0.7 -1,-0.2 -0.353 59.2 140.7 -83.1 57.2 -8.0 94.7 53.9 11 11 L V - 0 0 0 -2,-2.0 665,-0.2 663,-0.2 2,-0.1 -0.566 58.7 -94.2 -94.2 157.7 -11.7 94.4 53.1 12 12 L P S S+ 0 0 53 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.415 78.9 53.7 -63.8 147.9 -13.4 91.3 51.6 13 13 L G + 0 0 23 -2,-0.1 -2,-0.1 6,-0.1 806,-0.0 -0.198 44.8 92.9 114.8 162.8 -13.9 91.3 47.8 14 14 L G + 0 0 14 1,-0.3 95,-0.2 95,-0.1 96,-0.2 0.184 53.3 138.9 104.6 -15.6 -12.3 91.6 44.4 15 15 L T - 0 0 22 1,-0.1 -1,-0.3 94,-0.1 3,-0.1 -0.259 42.6-155.4 -63.1 149.6 -11.6 87.9 43.8 16 16 L L S S+ 0 0 75 1,-0.3 2,-0.3 86,-0.1 -1,-0.1 0.717 77.9 25.5 -92.9 -27.5 -12.2 86.6 40.2 17 17 L V S S+ 0 0 68 2,-0.2 16,-0.4 1,-0.1 -1,-0.3 -1.000 114.4 21.0-138.5 136.8 -12.8 83.0 41.3 18 18 L G S > S- 0 0 37 -2,-0.3 3,-2.5 -3,-0.1 4,-0.2 0.595 81.0-129.0 95.4 12.4 -13.9 81.2 44.4 19 19 L G T 3 S- 0 0 44 1,-0.3 3,-0.5 2,-0.1 -2,-0.2 -0.190 79.4 -17.6 45.8-127.5 -15.7 84.0 46.2 20 20 L N T > S+ 0 0 142 1,-0.2 3,-1.1 2,-0.1 -1,-0.3 0.485 110.2 102.4 -86.2 -4.7 -14.5 84.3 49.7 21 21 L L T < S+ 0 0 114 -3,-2.5 -1,-0.2 1,-0.3 -2,-0.1 0.829 100.8 15.0 -51.7 -41.7 -12.9 80.8 49.7 22 22 L F T 3 S+ 0 0 52 -3,-0.5 10,-1.9 -4,-0.2 2,-1.8 0.156 87.5 127.4-121.0 16.7 -9.4 82.1 49.3 23 23 L D < + 0 0 8 -3,-1.1 2,-0.3 -5,-0.2 -3,-0.0 -0.577 53.1 89.6 -77.9 86.1 -9.9 85.8 50.1 24 24 L F - 0 0 53 -2,-1.8 7,-2.4 649,-0.2 8,-0.4 -0.982 65.5-114.9-166.5 172.2 -7.1 86.1 52.7 25 25 L W E -C 30 0B 9 647,-4.3 2,-0.4 -2,-0.3 5,-0.2 -0.808 1.0-154.3-114.6 151.5 -3.5 86.8 53.4 26 26 L V E > S-C 29 0B 96 3,-2.3 3,-1.6 -2,-0.3 646,-0.1 -0.950 79.9 -47.6-111.3 106.8 -0.4 84.8 54.7 27 27 L G T 3 S- 0 0 36 -2,-0.4 512,-0.0 1,-0.3 645,-0.0 -0.535 124.1 -21.2 68.6-130.8 1.8 87.6 56.2 28 28 L P T 3 S+ 0 0 25 0, 0.0 2,-0.4 0, 0.0 -1,-0.3 0.685 118.1 100.7 -79.6 -20.1 2.0 90.4 53.7 29 29 L F E < -C 26 0B 87 -3,-1.6 -3,-2.3 509,-0.1 2,-0.2 -0.522 66.6-140.6 -82.4 125.7 1.0 88.2 50.8 30 30 L Y E -C 25 0B 2 506,-1.7 -5,-0.2 -2,-0.4 -7,-0.1 -0.572 19.8-169.4 -70.5 139.4 -2.4 88.2 49.4 31 31 L V > + 0 0 21 -7,-2.4 4,-1.0 -9,-0.3 -1,-0.2 0.758 20.5 149.4 -97.4 -85.8 -3.3 84.6 48.5 32 32 L G H > S- 0 0 0 -10,-1.9 4,-2.0 -8,-0.4 5,-0.2 -0.029 70.8 -60.9 66.9 177.9 -6.5 84.2 46.4 33 33 L F H > S+ 0 0 73 -16,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.907 140.1 48.2 -64.4 -43.5 -7.3 81.5 43.8 34 34 L F H > S+ 0 0 22 2,-0.2 4,-3.6 1,-0.2 -1,-0.2 0.801 105.3 58.6 -69.0 -30.0 -4.4 82.6 41.7 35 35 L G H X S+ 0 0 13 -4,-1.0 4,-2.9 2,-0.2 -2,-0.2 0.931 111.9 41.7 -54.4 -48.4 -2.1 82.6 44.8 36 36 L V H X S+ 0 0 58 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.933 116.1 49.0 -63.5 -45.1 -3.1 78.9 45.1 37 37 L A H X S+ 0 0 13 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.951 113.0 48.3 -60.9 -44.8 -2.7 78.4 41.3 38 38 L T H X S+ 0 0 19 -4,-3.6 4,-3.3 1,-0.2 5,-0.3 0.973 111.3 47.8 -62.8 -56.4 0.7 80.1 41.4 39 39 L F H X S+ 0 0 159 -4,-2.9 4,-3.2 1,-0.2 5,-0.3 0.922 113.1 50.0 -46.4 -48.6 2.0 78.1 44.4 40 40 L F H X S+ 0 0 118 -4,-2.6 4,-2.3 1,-0.2 5,-0.3 0.925 114.7 41.9 -60.8 -48.3 0.8 74.8 42.7 41 41 L F H X S+ 0 0 51 -4,-2.7 4,-2.9 2,-0.2 -1,-0.2 0.904 118.0 46.5 -67.2 -44.2 2.4 75.6 39.4 42 42 L A H X S+ 0 0 36 -4,-3.3 4,-2.9 -5,-0.2 5,-0.2 0.948 112.8 49.6 -60.2 -48.7 5.6 76.9 41.0 43 43 L A H X S+ 0 0 31 -4,-3.2 4,-3.0 -5,-0.3 5,-0.2 0.936 115.5 41.6 -60.4 -49.7 5.9 74.0 43.4 44 44 L L H X S+ 0 0 61 -4,-2.3 4,-2.7 -5,-0.3 5,-0.3 0.967 113.4 55.3 -63.6 -52.6 5.4 71.4 40.7 45 45 L G H X S+ 0 0 7 -4,-2.9 4,-2.1 -5,-0.3 -2,-0.2 0.889 112.1 42.6 -38.0 -51.4 7.7 73.4 38.4 46 46 L I H X S+ 0 0 110 -4,-2.9 4,-4.6 2,-0.2 5,-0.3 0.936 111.3 54.0 -70.7 -47.6 10.5 73.3 41.0 47 47 L I H X S+ 0 0 107 -4,-3.0 4,-2.0 2,-0.2 -1,-0.2 0.898 110.1 48.4 -51.6 -43.2 10.0 69.6 42.0 48 48 L L H X S+ 0 0 19 -4,-2.7 4,-4.4 2,-0.2 -1,-0.2 0.959 114.0 44.9 -68.0 -47.2 10.4 68.7 38.3 49 49 L I H X S+ 0 0 60 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.973 112.7 52.1 -53.8 -55.4 13.5 70.8 38.0 50 50 L A H X S+ 0 0 37 -4,-4.6 4,-1.3 2,-0.2 -1,-0.2 0.829 115.4 42.7 -49.8 -35.7 14.8 69.3 41.3 51 51 L W H X S+ 0 0 110 -4,-2.0 4,-1.4 -5,-0.3 5,-0.3 0.971 107.6 57.7 -73.6 -57.7 14.1 65.9 39.8 52 52 L S H X S+ 0 0 12 -4,-4.4 4,-1.2 1,-0.2 -2,-0.2 0.785 102.8 57.6 -41.9 -34.7 15.6 66.9 36.4 53 53 L A H >X>S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 3,-1.7 0.994 101.2 54.6 -57.0 -64.2 18.8 67.6 38.4 54 54 L V H 3<5S+ 0 0 78 -4,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.824 109.8 47.4 -29.9 -51.2 18.8 64.0 39.7 55 55 L L H 3<5S+ 0 0 75 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.666 113.0 46.2 -76.8 -26.2 18.7 62.7 36.1 56 56 L Q H <<5S- 0 0 78 -3,-1.7 -1,-0.3 -4,-1.2 -2,-0.2 0.752 114.1-127.5 -74.8 -32.7 21.5 65.0 34.9 57 57 L G T <5 + 0 0 65 -4,-2.7 2,-0.3 1,-0.3 -3,-0.2 0.680 69.4 103.2 90.6 26.3 23.3 63.9 38.1 58 58 L T < - 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0 0 58 1,-0.1 4,-2.6 -99,-0.1 -1,-0.3 -0.869 56.5-165.6-152.7 108.0 40.1 86.2 28.3 576 294 M W H > S+ 0 0 0 -101,-2.2 4,-2.6 -2,-0.3 5,-0.2 0.838 94.1 57.5 -65.6 -35.7 37.0 86.1 30.4 577 295 M Y H > S+ 0 0 111 -101,-0.4 4,-1.2 -102,-0.2 -1,-0.2 0.939 112.3 44.3 -54.6 -42.1 36.3 82.4 29.6 578 296 M V H > S+ 0 0 75 2,-0.2 4,-1.1 1,-0.2 3,-0.3 0.919 111.3 51.0 -69.4 -47.9 39.8 81.7 31.0 579 297 M W H >X S+ 0 0 22 -4,-2.6 3,-1.0 1,-0.2 4,-0.8 0.944 107.2 56.7 -52.6 -49.9 39.4 84.0 34.0 580 298 M G H >< S+ 0 0 19 -4,-2.6 3,-0.7 1,-0.3 -1,-0.2 0.851 100.8 56.5 -50.4 -39.9 36.2 82.2 34.8 581 299 M Q H 3< S+ 0 0 129 -4,-1.2 -1,-0.3 -3,-0.3 3,-0.2 0.848 115.6 36.8 -66.7 -29.6 37.9 78.8 34.9 582 300 M N H << S+ 0 0 107 -4,-1.1 -1,-0.2 -3,-1.0 -2,-0.2 0.391 117.3 49.0-101.3 -1.3 40.3 80.0 37.6 583 301 M H << 0 0 51 -4,-0.8 -1,-0.2 -3,-0.7 -2,-0.1 -0.528 360.0 360.0-143.5 63.8 38.0 82.3 39.7 584 302 M G 0 0 104 -3,-0.2 -4,-0.1 -2,-0.1 -5,-0.0 -0.250 360.0 360.0 60.1 360.0 34.8 80.3 40.4 585 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 586 9 H N 0 0 117 0, 0.0 6,-0.2 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 71.9 42.4 87.8 45.7 587 10 H F + 0 0 188 4,-0.1 2,-0.3 2,-0.1 0, 0.0 0.767 360.0 60.7 -46.4 -28.3 45.7 87.6 43.6 588 11 H D S > S- 0 0 29 1,-0.1 4,-1.8 0, 0.0 5,-0.2 -0.752 78.4-132.8-118.2 143.1 43.9 89.4 40.8 589 12 H L H > S+ 0 0 109 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.741 105.3 57.3 -64.6 -28.5 42.3 92.8 40.5 590 13 H A H > S+ 0 0 1 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.943 108.1 47.5 -66.7 -46.1 39.2 91.5 38.7 591 14 H S H > S+ 0 0 18 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.836 112.8 48.6 -59.8 -41.0 38.5 89.1 41.7 592 15 H L H X S+ 0 0 85 -4,-1.8 4,-2.5 -6,-0.2 -1,-0.2 0.905 112.8 49.8 -64.8 -42.7 39.0 92.0 44.1 593 16 H A H X S+ 0 0 26 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.933 113.0 43.5 -61.9 -47.7 36.7 94.1 42.0 594 17 H I H X S+ 0 0 22 -4,-3.0 4,-2.1 2,-0.2 -1,-0.2 0.900 115.2 48.6 -72.5 -36.1 33.9 91.6 41.8 595 18 H Y H X S+ 0 0 144 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.949 112.4 48.9 -67.1 -47.9 34.0 90.7 45.5 596 19 H S H X S+ 0 0 56 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.905 109.7 53.4 -55.8 -41.4 34.1 94.3 46.5 597 20 H F H X S+ 0 0 14 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.897 105.8 51.5 -65.6 -40.9 31.1 95.0 44.3 598 21 H W H X S+ 0 0 136 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.895 110.0 50.2 -61.4 -37.8 29.0 92.3 45.8 599 22 H I H X S+ 0 0 99 -4,-1.9 4,-2.3 1,-0.2 5,-0.2 0.978 111.9 47.8 -65.3 -49.8 29.8 93.7 49.3 600 23 H F H X S+ 0 0 83 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.917 110.5 51.8 -50.7 -49.6 28.8 97.1 48.1 601 24 H L H X S+ 0 0 20 -4,-3.0 4,-3.0 1,-0.3 5,-0.2 0.906 108.2 50.4 -63.0 -43.1 25.6 95.8 46.5 602 25 H A H X S+ 0 0 67 -4,-2.5 4,-2.1 2,-0.2 -1,-0.3 0.907 114.2 45.9 -56.0 -42.6 24.5 94.0 49.7 603 26 H G H X S+ 0 0 41 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.882 112.3 50.6 -69.1 -37.4 25.2 97.3 51.6 604 27 H L H X S+ 0 0 12 -4,-2.8 4,-3.4 -5,-0.2 5,-0.2 0.955 110.4 48.4 -62.9 -49.5 23.3 99.3 49.0 605 28 H I H X S+ 0 0 72 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.935 111.8 51.2 -60.7 -42.0 20.3 97.0 49.2 606 29 H Y H X S+ 0 0 111 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.963 113.3 43.6 -54.1 -56.8 20.4 97.2 52.9 607 30 H Y H X S+ 0 0 83 -4,-2.9 4,-2.3 1,-0.2 5,-0.2 0.935 113.6 51.7 -55.4 -52.1 20.4 101.1 52.8 608 31 H L H X S+ 0 0 4 -4,-3.4 4,-1.3 1,-0.2 -1,-0.2 0.898 109.1 50.2 -50.3 -46.3 17.7 101.2 50.1 609 32 H Q H >< S+ 0 0 14 -4,-2.7 3,-0.6 1,-0.2 -1,-0.2 0.937 110.4 48.7 -69.3 -40.8 15.4 98.9 52.1 610 33 H T H >< S+ 0 0 13 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.853 106.2 57.8 -63.2 -33.8 15.7 101.0 55.3 611 34 H E H >< S+ 0 0 18 -4,-2.3 3,-0.8 1,-0.3 -65,-0.3 0.831 103.4 55.0 -64.2 -28.1 15.1 104.2 53.3 612 35 H N T << S+ 0 0 1 -4,-1.3 -1,-0.3 -3,-0.6 3,-0.2 0.290 93.4 70.4 -89.8 13.1 11.8 102.6 52.2 613 36 H M T < + 0 0 7 -3,-1.6 4,-0.3 1,-0.1 -1,-0.2 0.106 63.8 102.2-113.7 21.7 10.8 102.1 55.9 614 37 H R S < S+ 0 0 18 -3,-0.8 2,-0.3 38,-0.1 40,-0.2 0.504 85.1 43.1 -78.7 -7.1 10.2 105.8 56.6 615 38 H E S S+ 0 0 35 -3,-0.2 -1,-0.1 37,-0.1 37,-0.0 -0.997 113.6 17.2-140.1 145.0 6.4 105.2 56.2 616 39 H G S S+ 0 0 0 -2,-0.3 -612,-2.0 1,-0.2 4,-0.2 0.450 93.8 153.9 81.0 4.4 4.1 102.5 57.5 617 40 H Y + 0 0 22 -4,-0.3 37,-0.2 -614,-0.2 -1,-0.2 -0.933 36.1 51.1-125.5 148.0 6.6 101.2 60.0 618 41 H P S S- 0 0 57 0, 0.0 -614,-0.1 0, 0.0 38,-0.1 0.358 92.0-119.9 -69.4 146.0 6.9 99.8 62.6 619 42 H L - 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