==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 24-OCT-06 2J8C . COMPND 2 MOLECULE: REACTION CENTER PROTEIN H CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOBACTER SPHAEROIDES; . AUTHOR J.KOEPKE,R.DIEHM,G.FRITZSCH . 823 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33583.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 580 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 0.9 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 . 97 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 336 40.8 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 5 0 5 0 0 0 0 0 2 0 2 0 0 3 0 0 0 0 1 1 1 2 1 1 2 0 0 RESIDUES PER ALPHA HELIX . 2 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 PARALLEL BRIDGES PER LADDER . 7 3 4 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 5 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 11 H D > 0 0 92 0, 0.0 4,-2.1 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 165.9 29.9 113.6 20.9 2 12 H L H > + 0 0 101 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.784 360.0 53.2 -62.2 -35.5 32.1 110.5 21.3 3 13 H A H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.901 108.6 49.1 -69.3 -40.8 29.4 108.4 22.9 4 14 H S H > S+ 0 0 32 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.916 112.3 49.2 -60.6 -44.6 26.9 109.1 20.1 5 15 H L H X S+ 0 0 102 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.913 111.3 50.2 -59.6 -44.7 29.5 108.1 17.6 6 16 H A H X S+ 0 0 23 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.910 113.3 43.9 -61.2 -44.7 30.3 105.0 19.5 7 17 H I H X S+ 0 0 20 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.927 113.8 49.7 -72.8 -40.8 26.7 103.8 19.8 8 18 H Y H X S+ 0 0 154 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.948 113.6 47.5 -58.6 -46.6 25.9 104.7 16.2 9 19 H S H X S+ 0 0 55 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.864 108.1 56.3 -63.2 -38.9 29.1 102.7 15.1 10 20 H F H X S+ 0 0 15 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.912 104.6 50.5 -62.7 -43.0 28.1 99.8 17.3 11 21 H W H X S+ 0 0 139 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.867 110.8 49.9 -64.5 -35.7 24.7 99.3 15.7 12 22 H I H X S+ 0 0 94 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.928 112.2 48.2 -65.1 -45.3 26.4 99.3 12.2 13 23 H F H X S+ 0 0 92 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.922 110.6 51.8 -57.5 -45.5 28.9 96.8 13.5 14 24 H L H X S+ 0 0 21 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.907 107.4 50.8 -64.2 -43.6 26.1 94.7 15.0 15 25 H A H X S+ 0 0 64 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.939 112.8 47.5 -58.8 -44.7 24.1 94.6 11.7 16 26 H G H X S+ 0 0 40 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.877 111.0 51.5 -59.9 -40.0 27.3 93.5 9.9 17 27 H L H X S+ 0 0 10 -4,-2.6 4,-3.3 2,-0.2 5,-0.2 0.924 109.2 49.3 -65.9 -44.1 27.9 90.8 12.5 18 28 H I H X S+ 0 0 71 -4,-2.6 4,-3.2 2,-0.2 5,-0.3 0.911 110.1 51.7 -60.1 -42.8 24.4 89.4 12.2 19 29 H Y H X S+ 0 0 114 -4,-2.1 4,-2.4 -5,-0.2 5,-0.2 0.947 112.4 46.6 -59.3 -46.0 24.8 89.3 8.5 20 30 H Y H X S+ 0 0 84 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.938 114.4 46.3 -58.8 -49.6 28.1 87.4 8.9 21 31 H L H X S+ 0 0 5 -4,-3.3 4,-1.8 2,-0.2 -2,-0.2 0.919 112.9 49.3 -63.0 -44.2 26.6 85.0 11.5 22 32 H Q H < S+ 0 0 16 -4,-3.2 -1,-0.2 1,-0.2 3,-0.2 0.952 113.2 46.0 -63.5 -44.9 23.5 84.3 9.4 23 33 H T H >< S+ 0 0 12 -4,-2.4 3,-2.0 -5,-0.3 -1,-0.2 0.899 109.2 55.1 -66.4 -36.4 25.4 83.6 6.3 24 34 H E H >< S+ 0 0 16 -4,-2.5 3,-1.1 1,-0.3 -1,-0.2 0.864 104.0 56.9 -59.6 -35.3 27.9 81.4 8.1 25 35 H N T 3< S+ 0 0 0 -4,-1.8 3,-0.3 1,-0.2 -1,-0.3 0.373 93.6 68.9 -79.7 8.2 24.9 79.4 9.3 26 36 H M T < + 0 0 6 -3,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.224 65.8 101.9-107.5 16.3 23.9 78.8 5.6 27 37 H R S < S+ 0 0 21 -3,-1.1 2,-0.3 38,-0.1 40,-0.2 0.587 83.0 44.9 -75.6 -11.7 26.9 76.5 4.9 28 38 H E S S+ 0 0 30 -3,-0.3 37,-0.0 37,-0.1 41,-0.0 -0.987 114.5 12.9-129.1 144.4 24.6 73.4 5.2 29 39 H G S S+ 0 0 0 -2,-0.3 216,-2.5 1,-0.2 218,-0.2 0.330 91.2 148.1 82.2 -5.0 21.1 72.7 3.8 30 40 H Y + 0 0 12 -4,-0.4 37,-0.3 214,-0.2 -1,-0.2 -0.831 35.3 60.2-111.8 154.2 21.0 75.7 1.3 31 41 H P S S- 0 0 61 0, 0.0 214,-0.1 0, 0.0 12,-0.1 0.450 90.6-123.4 -61.4 151.3 19.8 76.5 -1.4 32 42 H L - 0 0 12 -2,-0.2 8,-2.5 8,-0.1 2,-0.3 -0.340 31.5-148.7 -66.9 152.6 16.3 75.9 -0.1 33 43 H E B -AB 39 243A 42 210,-3.0 210,-3.1 6,-0.3 2,-0.1 -0.842 12.9-113.8-123.0 160.9 14.3 73.5 -2.2 34 44 H N > - 0 0 46 4,-3.2 3,-2.1 -2,-0.3 6,-0.1 -0.379 49.4 -94.8 -76.1 169.5 10.8 72.8 -3.2 35 45 H E T 3 S+ 0 0 9 1,-0.3 -1,-0.1 2,-0.1 5,-0.0 0.731 126.8 59.8 -61.8 -18.9 9.2 69.6 -1.9 36 46 H D T 3 S- 0 0 116 2,-0.1 -1,-0.3 3,-0.0 0, 0.0 0.339 121.0-105.9 -90.3 4.6 10.2 67.9 -5.2 37 47 H G S < S+ 0 0 41 -3,-2.1 -2,-0.1 1,-0.3 3,-0.1 0.414 80.5 124.8 88.3 -0.3 13.9 68.6 -4.6 38 48 H T S S- 0 0 61 1,-0.1 -4,-3.2 -5,-0.0 -1,-0.3 -0.513 74.1 -80.5 -85.9 160.9 14.3 71.4 -7.1 39 49 H P B -A 33 0A 98 0, 0.0 -6,-0.3 0, 0.0 2,-0.1 -0.367 47.5-120.5 -64.5 134.6 15.6 74.9 -6.1 40 50 H A - 0 0 8 -8,-2.5 -8,-0.1 203,-0.2 3,-0.0 -0.447 7.9-134.4 -73.0 147.1 13.1 77.2 -4.5 41 51 H A S S+ 0 0 109 1,-0.2 2,-0.8 -2,-0.1 -1,-0.1 0.869 94.8 59.7 -63.7 -41.2 12.3 80.5 -6.1 42 52 H N + 0 0 122 1,-0.2 -1,-0.2 3,-0.0 -2,-0.1 -0.822 52.6 160.9-100.2 106.6 12.5 82.4 -2.8 43 53 H Q - 0 0 60 -2,-0.8 3,-0.3 1,-0.3 -1,-0.2 0.466 49.1-123.0 -98.5 -4.7 15.9 82.0 -1.1 44 54 H G - 0 0 41 1,-0.2 -1,-0.3 3,-0.0 0, 0.0 -0.203 37.1 -62.3 81.6-179.3 15.5 85.0 1.1 45 55 H P S S+ 0 0 117 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.559 105.9 84.4 -84.3 -11.0 17.7 88.1 1.4 46 56 H F - 0 0 70 -3,-0.3 2,-0.1 -24,-0.0 -27,-0.0 -0.822 68.5-144.2 -96.3 130.9 21.0 86.5 2.6 47 57 H P - 0 0 67 0, 0.0 -21,-0.1 0, 0.0 -3,-0.0 -0.496 30.2 -92.6 -86.4 161.2 23.3 85.1 -0.1 48 58 H L - 0 0 71 -2,-0.1 -24,-0.1 1,-0.1 -25,-0.1 -0.457 46.1-116.3 -66.8 144.2 25.4 82.0 0.4 49 59 H P - 0 0 21 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.341 36.9 -84.7 -76.6 164.4 28.9 82.7 1.8 50 60 H K - 0 0 103 1,-0.1 15,-0.1 -2,-0.0 0, 0.0 -0.402 62.7 -91.5 -59.7 141.2 32.1 81.9 -0.2 51 61 H P - 0 0 91 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.163 38.5-161.1 -59.9 147.9 33.1 78.3 0.4 52 62 H K E -C 65 0B 34 13,-2.3 13,-2.1 -3,-0.1 2,-0.5 -0.938 9.8-139.7-122.1 156.9 35.5 77.2 3.2 53 63 H T E -C 64 0B 78 -2,-0.3 2,-0.5 11,-0.2 11,-0.2 -0.971 5.3-156.9-124.7 126.5 37.4 73.9 3.3 54 64 H F E -C 63 0B 8 9,-2.8 9,-1.9 -2,-0.5 2,-0.6 -0.866 15.9-140.6 -94.6 130.7 38.0 71.8 6.4 55 65 H I E -C 62 0B 63 -2,-0.5 392,-3.2 390,-0.4 7,-0.2 -0.845 19.4-145.5 -92.4 121.4 41.0 69.5 6.2 56 66 H L E > -C 61 0B 24 5,-2.9 5,-0.5 -2,-0.6 3,-0.4 -0.665 14.7-120.6 -91.4 139.7 40.0 66.2 7.7 57 67 H P T > 5S+ 0 0 28 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.197 84.9 35.3 -71.5 168.3 42.6 64.1 9.7 58 68 H H T 3 5S- 0 0 77 1,-0.3 -2,-0.0 2,-0.1 58,-0.0 0.767 129.1 -63.8 62.2 31.3 43.9 60.6 8.9 59 69 H G T 3 5S+ 0 0 75 -3,-0.4 -1,-0.3 2,-0.1 3,-0.1 0.655 96.6 133.5 75.5 15.6 43.6 60.9 5.2 60 70 H R T < 5 - 0 0 45 -3,-1.3 2,-0.3 1,-0.3 -2,-0.1 0.506 59.5-133.7 -82.2 -2.2 39.9 61.4 5.2 61 71 H G E < -C 56 0B 39 -5,-0.5 -5,-2.9 2,-0.0 2,-0.3 -0.696 31.8 -55.9 97.6-142.0 40.1 64.3 2.7 62 72 H T E -C 55 0B 84 -2,-0.3 2,-0.4 -7,-0.2 -7,-0.2 -0.896 27.9-139.0-138.8 164.8 38.3 67.6 3.0 63 73 H L E -C 54 0B 40 -9,-1.9 -9,-2.8 -2,-0.3 2,-0.5 -0.999 17.5-166.2-124.4 128.6 34.8 69.0 3.4 64 74 H T E -C 53 0B 62 -2,-0.4 -11,-0.2 -11,-0.2 -2,-0.0 -0.978 19.1-136.6-117.4 124.9 33.9 72.2 1.4 65 75 H V E S+C 52 0B 8 -13,-2.1 -13,-2.3 -2,-0.5 2,-0.2 -0.995 79.2 35.3-137.4 141.9 30.8 74.1 2.3 66 76 H P S S+ 0 0 19 0, 0.0 -38,-0.1 0, 0.0 -39,-0.1 0.581 89.4 142.9 -68.1 158.5 28.6 75.3 1.0 67 77 H G - 0 0 28 -37,-0.3 -37,-0.1 -40,-0.2 -2,-0.1 -0.920 59.3 -51.3-152.2 172.4 28.6 72.7 -1.7 68 78 H P - 0 0 141 0, 0.0 2,-0.4 0, 0.0 -38,-0.0 -0.278 58.6-142.4 -51.6 127.1 26.1 70.7 -3.8 69 79 H E + 0 0 42 -38,-0.1 2,-0.3 -41,-0.0 3,-0.1 -0.809 30.7 157.6 -97.4 132.7 23.5 69.2 -1.5 70 80 H S - 0 0 68 -2,-0.4 176,-0.1 1,-0.1 175,-0.0 -0.954 41.7-137.8-150.3 143.0 22.1 65.7 -2.1 71 81 H E - 0 0 42 -2,-0.3 35,-0.5 174,-0.2 -1,-0.1 0.817 27.2-155.7 -65.7 -31.5 20.4 63.2 0.2 72 82 H D + 0 0 125 1,-0.1 -1,-0.1 33,-0.1 -2,-0.0 0.753 65.3 73.6 59.2 28.0 22.3 60.3 -1.4 73 83 H R S S- 0 0 27 33,-0.0 -1,-0.1 2,-0.0 2,-0.1 -0.965 90.4 -96.4-160.5 153.4 19.6 57.9 -0.3 74 84 H P - 0 0 109 0, 0.0 2,-0.5 0, 0.0 0, 0.0 -0.477 31.1-148.4 -74.5 149.1 16.1 57.1 -1.4 75 85 H I - 0 0 46 -2,-0.1 2,-1.9 2,-0.1 23,-0.1 -0.935 1.8-154.3-123.9 110.1 13.3 58.7 0.6 76 86 H A + 0 0 25 -2,-0.5 15,-2.0 21,-0.3 16,-0.6 -0.447 53.3 108.1 -90.1 67.4 10.2 56.7 0.8 77 87 H L E -D 90 0C 12 -2,-1.9 2,-0.3 13,-0.3 -2,-0.1 -0.941 45.2-160.6-132.6 158.5 7.5 59.4 1.4 78 88 H A E -D 89 0C 43 11,-1.9 11,-2.2 -2,-0.3 -2,-0.0 -0.984 30.3 -91.9-140.2 153.8 4.8 60.8 -0.8 79 89 H R E -D 88 0C 108 -2,-0.3 9,-0.2 9,-0.2 3,-0.1 -0.215 23.1-168.1 -57.9 146.1 2.7 64.0 -0.9 80 90 H T S S+ 0 0 79 7,-0.9 2,-0.3 3,-0.2 -1,-0.1 0.384 71.3 42.8-112.3 -1.9 -0.6 63.9 0.9 81 91 H A S S- 0 0 26 6,-0.2 4,-0.1 2,-0.1 5,-0.1 -0.909 77.2-121.3-137.6 166.9 -1.9 67.3 -0.5 82 92 H V S S+ 0 0 144 -2,-0.3 2,-0.3 2,-0.1 -3,-0.0 0.493 94.3 47.9 -89.3 -3.2 -2.0 69.1 -3.9 83 93 H S S > S- 0 0 61 1,-0.1 3,-0.5 0, 0.0 -3,-0.2 -0.873 94.4 -81.9-133.5 171.2 -0.1 72.1 -2.5 84 94 H E T 3 S+ 0 0 80 -2,-0.3 -2,-0.1 1,-0.2 -1,-0.1 -0.196 96.3 46.8 -70.1 153.3 3.1 72.8 -0.4 85 95 H G T 3 S+ 0 0 7 1,-0.3 181,-3.1 180,-0.1 -1,-0.2 0.467 78.4 111.3 103.1 3.2 3.2 72.7 3.4 86 96 H F S < S- 0 0 74 -3,-0.5 -1,-0.3 179,-0.2 179,-0.2 -0.664 72.6 -87.6-107.4 163.5 1.5 69.4 4.2 87 97 H P - 0 0 11 0, 0.0 -7,-0.9 0, 0.0 2,-0.5 -0.226 33.7-130.2 -65.2 160.0 3.0 66.2 5.7 88 98 H H E -D 79 0C 1 163,-2.8 -9,-0.2 160,-0.2 3,-0.0 -0.971 22.5-133.9-114.6 121.9 4.4 63.5 3.4 89 99 H A E -D 78 0C 35 -11,-2.2 -11,-1.9 -2,-0.5 163,-0.0 -0.580 21.4-109.6 -80.8 133.5 3.2 60.0 4.2 90 100 H P E -D 77 0C 37 0, 0.0 -13,-0.3 0, 0.0 -1,-0.1 -0.378 20.5-152.5 -54.1 135.7 5.5 57.0 4.4 91 101 H T S S+ 0 0 95 -15,-2.0 2,-0.1 2,-0.1 -14,-0.1 0.573 78.2 5.9 -87.0 -14.1 5.0 54.8 1.3 92 102 H G S S- 0 0 42 -16,-0.6 3,-0.1 0, 0.0 0, 0.0 -0.387 120.6 -32.0-134.3-143.2 6.2 51.7 3.3 93 103 H D > - 0 0 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43.5 100.6 34.8 686 163 M I H >>S+ 0 0 0 0, 0.0 5,-2.1 0, 0.0 4,-1.0 0.906 112.6 49.5 -53.2 -41.9 41.3 105.5 36.4 689 166 M I H ><5S+ 0 0 63 -4,-2.2 3,-0.6 2,-0.2 -2,-0.2 0.937 113.1 45.7 -61.4 -46.3 44.3 106.6 34.2 690 167 M L H 3<5S+ 0 0 107 -4,-2.6 -1,-0.2 1,-0.3 -3,-0.2 0.864 113.6 49.4 -65.4 -35.8 41.9 108.6 31.9 691 168 M M H 3<5S- 0 0 62 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.643 115.2-121.9 -75.5 -15.5 40.2 110.1 35.0 692 169 M G T <<5S+ 0 0 35 -4,-1.0 2,-0.3 -3,-0.6 -66,-0.2 0.672 76.6 74.0 83.3 18.6 43.6 110.9 36.5 693 170 M S > < - 0 0 12 -5,-2.1 3,-1.3 -6,-0.2 -67,-0.2 -0.924 67.0-139.6-161.6 143.7 43.5 109.0 39.7 694 171 M W G > S+ 0 0 19 -69,-1.9 3,-2.4 -2,-0.3 -68,-0.1 0.705 96.4 80.9 -65.5 -21.1 43.7 105.5 41.2 695 172 M S G 3 S+ 0 0 32 -70,-0.3 -1,-0.2 1,-0.3 -69,-0.0 0.660 82.4 65.8 -61.2 -17.0 40.8 106.4 43.6 696 173 M E G < S+ 0 0 55 -3,-1.3 -1,-0.3 -75,-0.1 -2,-0.2 0.592 86.5 95.2 -77.0 -14.2 38.5 105.8 40.7 697 174 M A S < S- 0 0 0 -3,-2.4 -13,-0.2 -13,-0.1 -14,-0.1 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