==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PHOTOSYNTHESIS 23-MAR-07 2UWV . 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) . 34180.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 590 71.7 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 . 62 7.5 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 . 1 0.1 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 . 30 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 99 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 334 40.6 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 3 0 4 1 0 0 0 1 1 0 2 0 0 3 0 0 0 0 0 2 0 3 2 1 1 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 . 6 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,-1.9 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 152.8 29.5 114.5 20.7 2 12 H L H > + 0 0 102 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.758 360.0 53.4 -61.3 -33.1 31.7 111.3 21.1 3 13 H A H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.874 109.2 50.1 -68.6 -40.0 29.1 109.2 22.8 4 14 H S H > S+ 0 0 37 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.888 112.3 48.2 -60.9 -42.8 26.7 109.9 20.0 5 15 H L H X S+ 0 0 97 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.914 111.5 49.2 -64.6 -44.9 29.4 108.9 17.5 6 16 H A H X S+ 0 0 20 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.911 112.4 47.2 -64.7 -40.8 30.2 105.7 19.4 7 17 H I H X S+ 0 0 23 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.913 113.3 47.1 -71.0 -39.9 26.6 104.6 19.7 8 18 H Y H X S+ 0 0 162 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.936 113.8 49.4 -64.0 -47.4 25.8 105.3 16.0 9 19 H S H X S+ 0 0 52 -4,-2.6 4,-3.1 1,-0.2 -2,-0.2 0.894 107.7 54.9 -54.1 -46.3 29.0 103.5 15.0 10 20 H F H X S+ 0 0 19 -4,-2.4 4,-3.2 1,-0.2 -1,-0.2 0.889 106.2 49.7 -59.6 -44.8 28.1 100.5 17.2 11 21 H W H X S+ 0 0 141 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.822 111.7 49.0 -64.8 -31.9 24.7 100.0 15.6 12 22 H I H X S+ 0 0 96 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.932 112.7 48.7 -70.8 -44.1 26.4 100.1 12.1 13 23 H F H X S+ 0 0 90 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.943 110.5 51.0 -59.0 -45.6 28.9 97.6 13.4 14 24 H L H X S+ 0 0 18 -4,-3.2 4,-2.5 2,-0.2 -1,-0.2 0.868 107.0 51.9 -65.1 -40.6 26.2 95.4 14.8 15 25 H A H X S+ 0 0 66 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.938 112.0 48.4 -56.6 -46.3 24.2 95.3 11.5 16 26 H G H X S+ 0 0 44 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.848 111.3 50.6 -58.3 -37.3 27.4 94.2 9.8 17 27 H L H X S+ 0 0 11 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.926 109.9 48.3 -73.8 -40.7 28.0 91.6 12.5 18 28 H I H X S+ 0 0 72 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.891 111.4 51.0 -64.8 -37.9 24.5 90.1 12.1 19 29 H Y H X S+ 0 0 116 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.976 112.3 47.0 -60.4 -54.5 24.9 90.0 8.3 20 30 H Y H X S+ 0 0 86 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.906 115.1 47.0 -50.9 -47.1 28.2 88.2 8.8 21 31 H L H X S+ 0 0 5 -4,-3.0 4,-1.7 2,-0.2 -1,-0.2 0.903 111.3 48.0 -67.9 -47.5 26.7 85.8 11.3 22 32 H Q H < S+ 0 0 14 -4,-2.9 -1,-0.2 2,-0.2 -2,-0.2 0.943 113.9 47.9 -61.1 -44.3 23.6 84.9 9.3 23 33 H T H >< S+ 0 0 12 -4,-2.5 3,-1.9 -5,-0.3 -2,-0.2 0.911 108.8 53.8 -66.5 -37.8 25.6 84.3 6.1 24 34 H E H >< S+ 0 0 18 -4,-2.5 3,-1.3 1,-0.3 -1,-0.2 0.882 105.6 55.5 -55.8 -37.8 28.1 82.1 8.1 25 35 H N T 3< S+ 0 0 0 -4,-1.7 -1,-0.3 1,-0.3 3,-0.2 0.326 94.2 69.1 -83.4 11.4 25.2 80.1 9.2 26 36 H M T < + 0 0 5 -3,-1.9 4,-0.4 1,-0.1 -1,-0.3 0.264 65.3 103.7-107.2 13.7 24.1 79.6 5.6 27 37 H R S < S+ 0 0 19 -3,-1.3 2,-0.3 38,-0.1 40,-0.2 0.614 83.2 42.3 -71.0 -12.1 27.1 77.3 4.9 28 38 H E S S+ 0 0 29 -3,-0.2 37,-0.0 37,-0.1 41,-0.0 -0.977 113.0 16.9-133.2 149.1 24.8 74.2 5.1 29 39 H G S S+ 0 0 0 -2,-0.3 216,-2.7 1,-0.2 218,-0.2 0.299 91.1 145.4 83.0 -8.3 21.3 73.5 3.7 30 40 H Y + 0 0 12 -4,-0.4 37,-0.2 214,-0.2 2,-0.2 -0.858 34.0 60.6-114.5 151.3 21.2 76.4 1.2 31 41 H P S S- 0 0 62 0, 0.0 214,-0.1 0, 0.0 38,-0.1 0.427 90.5-122.0 -66.7 153.3 20.1 77.2 -1.5 32 42 H L - 0 0 13 -2,-0.2 8,-2.3 212,-0.1 2,-0.3 -0.272 30.2-150.6 -62.0 152.1 16.6 76.6 -0.3 33 43 H E B -AB 39 243A 43 210,-2.8 210,-2.4 6,-0.3 2,-0.2 -0.841 13.4-116.6-126.8 154.0 14.6 74.0 -2.4 34 44 H N > - 0 0 45 4,-2.8 3,-2.4 -2,-0.3 6,-0.1 -0.487 50.5 -92.2 -77.7 168.5 10.9 73.4 -3.3 35 45 H E T 3 S+ 0 0 10 1,-0.3 -1,-0.1 -2,-0.2 44,-0.0 0.615 128.1 59.1 -57.7 -16.6 9.5 70.2 -2.0 36 46 H D T 3 S- 0 0 116 2,-0.1 -1,-0.3 3,-0.0 0, 0.0 0.413 119.5-106.3 -94.1 0.3 10.5 68.6 -5.3 37 47 H G S < S+ 0 0 39 -3,-2.4 -2,-0.1 1,-0.3 3,-0.1 0.325 79.2 124.0 95.1 -6.8 14.2 69.4 -4.8 38 48 H T S S- 0 0 63 1,-0.1 -4,-2.8 -5,-0.0 -1,-0.3 -0.522 75.6 -80.9 -84.9 158.9 14.6 72.2 -7.4 39 49 H P B -A 33 0A 100 0, 0.0 -6,-0.3 0, 0.0 -1,-0.1 -0.317 48.7-119.8 -60.5 132.2 15.9 75.6 -6.3 40 50 H A - 0 0 9 -8,-2.3 -8,-0.1 203,-0.2 3,-0.1 -0.402 11.5-129.7 -72.8 151.8 13.3 77.8 -4.7 41 51 H A S S+ 0 0 109 1,-0.2 2,-0.8 -2,-0.1 -1,-0.1 0.912 96.5 58.5 -64.2 -44.7 12.5 81.1 -6.3 42 52 H N + 0 0 128 1,-0.1 -1,-0.2 -3,-0.0 -2,-0.1 -0.810 52.8 166.0 -99.0 108.7 12.9 83.0 -3.1 43 53 H Q - 0 0 58 -2,-0.8 3,-0.3 1,-0.3 -1,-0.1 0.396 48.6-120.0 -94.0 -2.5 16.3 82.6 -1.5 44 54 H G - 0 0 39 1,-0.2 -1,-0.3 3,-0.0 0, 0.0 -0.139 36.3 -66.4 80.3 176.6 15.8 85.5 1.0 45 55 H P S S+ 0 0 120 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.527 107.8 82.9 -81.6 -10.5 17.9 88.7 1.3 46 56 H F S S- 0 0 69 -3,-0.3 2,-0.2 -24,-0.0 -27,-0.0 -0.860 70.2-147.0 -96.1 127.5 21.1 87.1 2.6 47 57 H P - 0 0 67 0, 0.0 -21,-0.1 0, 0.0 -3,-0.0 -0.540 31.4 -87.2 -84.8 160.9 23.4 85.7 -0.2 48 58 H L - 0 0 74 -2,-0.2 2,-0.1 1,-0.1 -24,-0.1 -0.343 46.4-118.9 -63.0 142.9 25.7 82.7 0.2 49 59 H P - 0 0 21 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.498 37.3 -84.6 -73.4 159.8 29.1 83.4 1.7 50 60 H K - 0 0 187 -2,-0.1 15,-0.1 1,-0.1 0, 0.0 -0.331 60.3 -95.3 -52.3 141.3 32.3 82.7 -0.2 51 61 H P - 0 0 87 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.124 37.6-163.9 -60.1 154.5 33.4 79.0 0.4 52 62 H K E -C 65 0B 37 13,-2.1 13,-1.9 -3,-0.1 2,-0.4 -0.945 11.2-137.9-132.4 159.6 35.8 78.0 3.1 53 63 H T E -C 64 0B 76 -2,-0.3 2,-0.5 11,-0.2 11,-0.2 -0.972 4.8-153.9-124.3 128.0 37.6 74.8 3.2 54 64 H F E -C 63 0B 9 9,-3.0 9,-1.8 -2,-0.4 2,-0.6 -0.840 16.2-139.5 -93.6 128.9 38.2 72.6 6.3 55 65 H I E -C 62 0B 63 -2,-0.5 392,-3.1 390,-0.4 7,-0.2 -0.798 20.6-145.1 -85.8 116.4 41.3 70.3 6.2 56 66 H L E > -C 61 0B 21 5,-2.5 5,-0.5 -2,-0.6 3,-0.4 -0.583 15.6-117.6 -84.5 143.6 40.3 67.0 7.7 57 67 H P T > 5S+ 0 0 28 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 -0.300 85.7 30.9 -76.9 164.1 42.9 65.0 9.7 58 68 H H T 3 5S- 0 0 79 1,-0.2 -2,-0.0 2,-0.1 58,-0.0 0.807 128.4 -63.0 63.8 34.5 44.3 61.5 8.9 59 69 H G T 3 5S+ 0 0 77 -3,-0.4 -1,-0.2 2,-0.1 3,-0.1 0.671 97.2 132.7 69.6 17.9 44.0 61.8 5.1 60 70 H R T < 5 - 0 0 43 -3,-1.1 2,-0.4 1,-0.3 -2,-0.1 0.580 61.1-131.5 -80.9 -9.0 40.2 62.1 5.2 61 71 H G E < -C 56 0B 38 -5,-0.5 -5,-2.5 2,-0.0 2,-0.3 -0.785 29.1 -58.7 109.2-143.5 40.3 65.0 2.8 62 72 H T E -C 55 0B 87 -2,-0.4 2,-0.4 -7,-0.2 -7,-0.2 -0.906 27.6-141.3-139.7 170.8 38.6 68.4 3.0 63 73 H L E -C 54 0B 42 -9,-1.8 -9,-3.0 -2,-0.3 2,-0.4 -0.994 14.8-167.8-135.5 130.5 35.1 69.9 3.2 64 74 H T E -C 53 0B 63 -2,-0.4 -11,-0.2 -11,-0.2 -2,-0.0 -0.980 19.7-136.2-120.6 130.7 34.2 73.0 1.3 65 75 H V E S+C 52 0B 8 -13,-1.9 -13,-2.1 -2,-0.4 2,-0.2 -0.989 79.8 37.3-146.2 142.8 31.0 74.8 2.2 66 76 H P S S+ 0 0 19 0, 0.0 -38,-0.1 0, 0.0 -1,-0.1 0.659 89.0 141.8 -65.1 153.5 28.8 76.1 0.8 67 77 H G - 0 0 26 -37,-0.2 -37,-0.1 -40,-0.2 -2,-0.0 -0.913 60.3 -53.3-148.8 173.2 28.9 73.4 -1.8 68 78 H P - 0 0 142 0, 0.0 2,-0.4 0, 0.0 -38,-0.0 -0.327 58.2-146.4 -55.1 132.8 26.4 71.4 -3.9 69 79 H E + 0 0 40 -38,-0.1 2,-0.3 -41,-0.0 3,-0.1 -0.847 28.2 156.7-104.9 131.4 23.9 69.8 -1.5 70 80 H S - 0 0 73 -2,-0.4 176,-0.1 1,-0.1 175,-0.0 -0.953 44.0-131.9-148.9 152.3 22.3 66.4 -2.1 71 81 H E - 0 0 41 -2,-0.3 35,-0.5 174,-0.2 -1,-0.1 0.794 29.9-153.0 -63.1 -35.9 20.7 63.8 0.1 72 82 H D + 0 0 122 1,-0.1 -1,-0.1 33,-0.1 -2,-0.0 0.761 67.8 69.9 63.5 29.1 22.7 61.0 -1.5 73 83 H R S S- 0 0 26 33,-0.0 2,-0.2 2,-0.0 -1,-0.1 -0.935 92.0 -92.9-164.1 154.7 20.0 58.5 -0.6 74 84 H P - 0 0 112 0, 0.0 2,-0.7 0, 0.0 0, 0.0 -0.508 30.2-147.5 -71.7 140.1 16.4 57.8 -1.6 75 85 H I - 0 0 44 -2,-0.2 2,-2.3 2,-0.1 23,-0.1 -0.916 3.9-153.7-115.0 102.2 13.6 59.5 0.4 76 86 H A + 0 0 25 -2,-0.7 15,-2.4 21,-0.3 16,-0.5 -0.335 54.3 111.4 -78.3 65.2 10.6 57.3 0.6 77 87 H L E -D 90 0C 12 -2,-2.3 2,-0.3 13,-0.3 -2,-0.1 -0.947 44.2-163.9-129.2 156.4 8.0 60.0 1.1 78 88 H A E -D 89 0C 46 11,-2.0 11,-1.7 -2,-0.3 -2,-0.0 -0.988 31.3 -93.3-138.1 147.6 5.1 61.4 -1.1 79 89 H R E -D 88 0C 105 -2,-0.3 9,-0.2 9,-0.2 3,-0.1 -0.131 22.8-166.7 -49.0 148.0 3.0 64.6 -1.0 80 90 H T S S+ 0 0 80 7,-0.7 2,-0.3 3,-0.2 -1,-0.1 0.303 71.6 41.3-115.5 1.0 -0.4 64.4 0.8 81 91 H A S S- 0 0 28 2,-0.1 4,-0.1 6,-0.1 5,-0.1 -0.898 77.9-120.1-141.1 170.0 -1.7 67.7 -0.7 82 92 H V S S+ 0 0 144 -2,-0.3 2,-0.3 2,-0.1 -3,-0.0 0.460 92.5 51.4 -95.0 -2.3 -1.8 69.6 -4.0 83 93 H S S > S- 0 0 63 1,-0.1 3,-0.5 0, 0.0 -3,-0.2 -0.846 93.3 -81.0-130.0 169.5 0.1 72.7 -2.6 84 94 H E T 3 S+ 0 0 79 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.1 -0.219 97.6 43.5 -64.2 147.2 3.3 73.5 -0.6 85 95 H G T 3 S+ 0 0 8 1,-0.3 181,-2.9 -4,-0.1 -1,-0.2 0.507 78.4 113.0 104.7 5.7 3.5 73.3 3.1 86 96 H F S < S- 0 0 75 -3,-0.5 -1,-0.3 179,-0.2 179,-0.2 -0.657 70.4 -88.7-106.9 163.7 1.8 70.0 4.0 87 97 H P - 0 0 10 0, 0.0 -7,-0.7 0, 0.0 2,-0.5 -0.283 32.8-128.6 -67.4 159.1 3.3 66.8 5.5 88 98 H H E -D 79 0C 0 163,-2.7 -9,-0.2 160,-0.2 3,-0.0 -0.958 21.6-135.4-114.4 118.2 4.8 64.0 3.3 89 99 H A E -D 78 0C 35 -11,-1.7 -11,-2.0 -2,-0.5 2,-0.1 -0.517 23.5-108.6 -75.3 134.0 3.5 60.5 4.1 90 100 H P E -D 77 0C 37 0, 0.0 -13,-0.3 0, 0.0 -1,-0.1 -0.418 20.7-150.2 -55.6 139.0 5.9 57.6 4.3 91 101 H T S S+ 0 0 92 -15,-2.4 -14,-0.1 2,-0.1 2,-0.1 0.627 78.7 1.4 -91.0 -15.6 5.4 55.3 1.2 92 102 H G S S- 0 0 44 -16,-0.5 3,-0.1 0, 0.0 0, 0.0 -0.310 121.6 -28.9-131.7-133.4 6.5 52.2 3.1 93 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