==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER COMPLEX (ELECTRON TRANSPORT PROTEINS) 22-DEC-97 2PCF . COMPND 2 MOLECULE: PLASTOCYANIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SPINACIA OLERACEA; . AUTHOR M.UBBINK,M.EJDEBACK,B.G.KARLSSON,D.S.BENDALL . 349 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17828.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 212 60.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 90 25.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 1.4 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-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 . 53 15.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 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 0 RESIDUES PER ALPHA HELIX . 1 1 1 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 PARALLEL BRIDGES PER LADDER . 6 5 3 0 0 3 2 0 0 1 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 3 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 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 V 0 0 65 0, 0.0 27,-1.0 0, 0.0 2,-0.8 0.000 360.0 360.0 360.0 -8.2 92.1 78.6 -35.4 2 2 A E E -a 28 0A 97 25,-0.1 2,-0.5 27,-0.1 27,-0.1 -0.558 360.0-169.8 -71.8 108.2 89.0 77.4 -33.4 3 3 A V E -a 29 0A 0 25,-1.3 27,-2.0 -2,-0.8 2,-0.7 -0.872 7.8-165.9-103.8 125.9 90.1 77.8 -29.8 4 4 A L E -a 30 0A 81 11,-2.6 27,-0.2 -2,-0.5 11,-0.2 -0.882 13.4-145.2-113.1 105.4 87.9 76.2 -27.1 5 5 A L E S+a 31 0A 0 25,-1.8 27,-2.3 -2,-0.7 28,-0.5 -0.401 71.0 25.1 -66.5 140.9 88.7 77.5 -23.6 6 6 A G S S- 0 0 3 7,-0.5 6,-0.2 5,-0.3 28,-0.1 0.406 80.5-120.1 79.6 137.7 88.3 74.8 -20.9 7 7 A G - 0 0 27 4,-0.3 26,-0.2 25,-0.1 8,-0.0 0.636 51.2 -73.8 -80.5-118.8 88.5 71.0 -21.7 8 8 A G S S+ 0 0 66 24,-0.1 -2,-0.0 25,-0.0 -1,-0.0 0.284 123.3 16.7-127.8 7.1 85.5 68.8 -21.0 9 9 A D S S- 0 0 142 24,-0.1 25,-0.1 25,-0.0 -3,-0.0 0.454 136.6 -39.4-145.7 -41.8 85.6 68.6 -17.2 10 10 A G S S+ 0 0 11 23,-0.1 2,-0.9 24,-0.0 -4,-0.1 0.178 76.6 143.6 172.3 45.6 87.8 71.4 -15.8 11 11 A S - 0 0 59 2,-0.1 2,-1.4 -6,-0.1 -4,-0.3 -0.798 32.4-160.1-102.7 97.7 91.0 71.9 -18.0 12 12 A L + 0 0 23 -2,-0.9 2,-0.3 -6,-0.2 -7,-0.1 -0.583 48.4 109.9 -77.7 94.2 91.7 75.7 -18.0 13 13 A A S S- 0 0 31 -2,-1.4 -7,-0.5 -9,-0.1 2,-0.3 -0.929 73.2-103.8-165.7 139.3 93.9 76.0 -21.1 14 14 A F - 0 0 9 -2,-0.3 -9,-0.1 79,-0.2 79,-0.1 -0.481 40.9-130.5 -67.4 127.7 93.6 77.4 -24.6 15 15 A L S S+ 0 0 94 1,-0.3 -11,-2.6 -2,-0.3 2,-0.1 -0.880 102.8 13.7-128.4 103.4 93.0 74.6 -27.1 16 16 A P S S- 0 0 59 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.607 84.6-169.6 -79.7 170.9 94.9 75.1 -29.1 17 17 A G S S+ 0 0 27 1,-0.3 78,-0.4 -2,-0.1 2,-0.2 0.255 77.5 33.6-105.3 12.4 97.0 77.7 -27.3 18 18 A D + 0 0 90 76,-0.2 2,-0.3 -4,-0.0 -1,-0.3 -0.723 68.3 158.0-167.1 111.1 99.0 78.7 -30.4 19 19 A F E -c 96 0B 16 76,-1.2 78,-1.9 -2,-0.2 2,-0.5 -0.850 31.9-126.2-132.2 169.7 97.8 78.8 -34.0 20 20 A S E +c 97 0B 89 -2,-0.3 78,-0.2 76,-0.2 2,-0.2 -0.966 33.7 159.7-121.9 130.2 98.8 80.6 -37.2 21 21 A V E -c 98 0B 10 76,-0.8 78,-1.8 -2,-0.5 2,-0.2 -0.664 24.2-132.9-132.5-170.8 96.4 82.7 -39.4 22 22 A A > - 0 0 38 76,-0.3 3,-1.7 77,-0.2 2,-0.8 -0.823 44.1 -65.4-138.9 179.1 96.7 85.4 -42.0 23 23 A S T 3 S+ 0 0 65 -2,-0.2 52,-0.2 1,-0.2 3,-0.1 -0.562 124.0 31.0 -72.1 108.8 95.1 88.9 -42.8 24 24 A G T 3 S+ 0 0 61 50,-1.0 -1,-0.2 -2,-0.8 51,-0.1 0.159 93.1 109.5 129.3 -17.0 91.4 88.1 -43.5 25 25 A E < - 0 0 105 -3,-1.7 -1,-0.4 49,-0.2 2,-0.4 -0.301 61.0-130.5 -82.1 172.5 91.0 85.0 -41.2 26 26 A E - 0 0 102 47,-0.1 2,-0.3 -3,-0.1 47,-0.2 -0.984 9.7-145.9-129.1 135.0 88.9 85.1 -38.0 27 27 A I B -E 72 0C 2 45,-1.1 45,-0.7 -2,-0.4 2,-0.4 -0.703 14.9-162.7 -96.7 149.5 89.9 83.9 -34.5 28 28 A V E -a 2 0A 21 -27,-1.0 -25,-1.3 -2,-0.3 2,-0.3 -0.981 14.6-169.0-133.4 145.7 87.3 82.4 -32.1 29 29 A F E -a 3 0A 0 -2,-0.4 41,-0.8 -27,-0.1 2,-0.5 -0.669 12.5-178.1-133.1 79.9 87.4 81.7 -28.3 30 30 A K E -aB 4 69A 77 -27,-2.0 -25,-1.8 -2,-0.3 2,-0.5 -0.668 15.7-149.0 -81.8 124.2 84.5 79.5 -27.2 31 31 A N E +a 5 0A 3 37,-1.4 36,-0.4 -2,-0.5 -25,-0.2 -0.788 24.0 167.5 -95.1 130.2 84.5 78.9 -23.5 32 32 A N - 0 0 93 -27,-2.3 2,-0.3 -2,-0.5 3,-0.2 0.820 62.9 -3.4-104.5 -67.9 83.1 75.6 -22.3 33 33 A A S S+ 0 0 23 -28,-0.5 -1,-0.4 -26,-0.2 -23,-0.1 -0.938 113.5 45.3-128.9 152.4 83.9 75.0 -18.6 34 34 A G S S- 0 0 23 -2,-0.3 -1,-0.1 1,-0.1 -28,-0.1 0.712 92.8-148.8 91.3 21.5 85.9 77.1 -16.1 35 35 A F + 0 0 42 -3,-0.2 29,-0.2 29,-0.2 -1,-0.1 -0.203 68.7 64.8 -64.3 163.0 84.3 80.4 -17.1 36 36 A P + 0 0 3 0, 0.0 28,-0.2 0, 0.0 -3,-0.0 0.542 54.8 163.8 -79.5 155.5 84.6 83.2 -17.4 37 37 A H + 0 0 1 26,-1.8 2,-0.3 -2,-0.1 27,-0.1 -0.171 12.0 158.2-126.6 41.0 87.3 82.9 -20.1 38 38 A N - 0 0 3 25,-0.1 47,-2.4 46,-0.1 2,-0.3 -0.485 28.5-150.1 -68.2 128.3 87.4 86.4 -21.5 39 39 A V E -F 84 0D 0 -2,-0.3 18,-0.6 45,-0.2 2,-0.4 -0.709 10.7-165.7-100.2 153.2 90.7 87.0 -23.2 40 40 A V E -F 83 0D 3 43,-1.5 43,-0.8 -2,-0.3 2,-0.2 -0.967 19.3-129.7-140.7 123.0 92.5 90.4 -23.5 41 41 A F E -F 82 0D 1 -2,-0.4 2,-0.2 11,-0.3 41,-0.2 -0.509 26.2-144.7 -71.5 133.4 95.4 91.2 -25.9 42 42 A D - 0 0 41 39,-1.3 3,-0.5 -2,-0.2 39,-0.3 -0.608 13.4-129.0 -96.3 160.1 98.3 93.0 -24.0 43 43 A E S S+ 0 0 38 -2,-0.2 244,-0.1 1,-0.2 243,-0.1 -0.209 91.9 80.5-100.4 44.8 100.5 95.7 -25.5 44 44 A D S S+ 0 0 106 37,-0.2 -1,-0.2 -2,-0.1 -3,-0.0 0.601 100.8 28.5-119.3 -23.8 103.8 93.9 -24.6 45 45 A E S S+ 0 0 98 -3,-0.5 -2,-0.1 36,-0.2 34,-0.1 0.050 89.2 124.5-125.6 25.8 104.1 91.4 -27.4 46 46 A I - 0 0 25 1,-0.1 34,-0.1 34,-0.1 4,-0.0 -0.698 48.9-152.6 -90.1 141.2 102.3 93.3 -30.2 47 47 A P S S+ 0 0 65 0, 0.0 -1,-0.1 0, 0.0 31,-0.1 0.973 77.7 33.2 -75.6 -62.2 104.0 93.9 -33.5 48 48 A S S S- 0 0 62 1,-0.1 -2,-0.0 0, 0.0 30,-0.0 -0.255 89.9-107.7 -87.1-178.9 102.3 97.1 -34.8 49 49 A G + 0 0 44 -2,-0.1 -1,-0.1 3,-0.0 -3,-0.0 0.838 61.1 129.1 -75.3-101.7 101.0 99.9 -32.6 50 50 A V - 0 0 67 4,-0.0 2,-0.2 3,-0.0 -4,-0.1 0.305 68.1 -77.9 61.7 157.6 97.1 100.0 -32.4 51 51 A D > - 0 0 90 1,-0.1 4,-0.6 5,-0.0 3,-0.3 -0.573 26.3-136.0 -88.8 154.8 95.3 100.1 -29.1 52 52 A A H > S+ 0 0 2 1,-0.2 4,-0.9 -2,-0.2 3,-0.5 0.801 103.9 62.0 -79.8 -27.3 94.9 97.0 -26.8 53 53 A A H 4 S+ 0 0 71 1,-0.2 -1,-0.2 2,-0.2 -11,-0.0 0.716 95.9 62.7 -71.0 -17.0 91.2 97.8 -26.1 54 54 A K H 4 S+ 0 0 160 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.837 118.3 24.6 -77.1 -31.2 90.5 97.5 -29.9 55 55 A I H < S+ 0 0 15 -4,-0.6 -14,-0.3 -3,-0.5 -2,-0.2 0.349 117.0 74.9-113.0 5.0 91.5 93.8 -29.9 56 56 A S S < S- 0 0 13 -4,-0.9 -16,-0.2 -16,-0.2 2,-0.2 -0.545 83.2-103.4-108.5 177.8 90.8 93.1 -26.2 57 57 A M - 0 0 22 -18,-0.6 2,-0.1 -2,-0.2 5,-0.1 -0.592 29.2-129.3 -98.8 164.1 87.5 92.6 -24.3 58 58 A S - 0 0 41 3,-0.2 -1,-0.1 -2,-0.2 107,-0.0 -0.242 27.5-102.6 -98.6-168.5 85.8 95.2 -22.0 59 59 A E S S+ 0 0 37 1,-0.1 109,-0.3 107,-0.1 3,-0.1 0.774 119.3 48.2 -88.6 -27.6 84.5 94.8 -18.4 60 60 A E S S+ 0 0 138 1,-0.2 2,-1.3 107,-0.1 -1,-0.1 0.847 102.9 65.4 -81.1 -33.4 80.8 94.5 -19.5 61 61 A D S S+ 0 0 107 2,-0.1 2,-0.4 -23,-0.0 -3,-0.2 -0.682 70.8 156.4 -91.4 90.6 81.5 91.9 -22.2 62 62 A L - 0 0 44 -2,-1.3 2,-1.4 -3,-0.1 3,-0.3 -0.896 45.4-129.8-116.0 145.8 82.6 88.9 -20.2 63 63 A L + 0 0 2 -2,-0.4 -26,-1.8 1,-0.2 -25,-0.1 -0.619 57.6 133.0 -92.9 80.6 82.5 85.2 -21.3 64 64 A N + 0 0 37 -2,-1.4 -1,-0.2 -28,-0.2 -29,-0.2 0.633 51.2 80.1-102.1 -17.7 80.8 83.7 -18.2 65 65 A A S > S- 0 0 51 -3,-0.3 2,-1.7 1,-0.1 3,-1.0 -0.703 87.8-115.4 -93.3 145.5 78.2 81.6 -20.1 66 66 A P T 3 S+ 0 0 93 0, 0.0 -34,-0.1 0, 0.0 3,-0.1 -0.563 106.0 36.5 -77.3 83.5 79.0 78.3 -21.7 67 67 A G T 3 S+ 0 0 57 -2,-1.7 -35,-0.1 -36,-0.4 2,-0.0 0.125 81.8 113.8 160.5 -26.2 78.4 79.2 -25.4 68 68 A E < - 0 0 114 -3,-1.0 -37,-1.4 -37,-0.1 -1,-0.4 -0.370 46.6-163.1 -68.5 148.8 79.6 82.8 -25.8 69 69 A T B -B 30 0A 39 -39,-0.2 2,-0.7 -3,-0.1 -39,-0.2 -0.987 15.9-141.0-136.1 146.3 82.7 83.3 -28.1 70 70 A Y - 0 0 32 -41,-0.8 2,-0.4 -2,-0.3 -41,-0.1 -0.886 20.5-170.1-109.2 109.1 85.2 86.1 -28.6 71 71 A K - 0 0 103 -2,-0.7 2,-0.5 -43,-0.2 -43,-0.2 -0.823 2.4-167.3-100.2 133.9 86.1 86.7 -32.2 72 72 A V B -E 27 0C 6 -45,-0.7 -45,-1.1 -2,-0.4 2,-1.0 -0.947 10.9-151.2-122.8 115.7 89.0 89.0 -33.1 73 73 A T - 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