==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 02-APR-97 1AG6 . COMPND 2 MOLECULE: PLASTOCYANIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SPINACIA OLERACEA; . AUTHOR Y.XUE,M.OKVIST,S.YOUNG . 99 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5149.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 67 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 21.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 1.0 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 . 14 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 3 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.0 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 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 RESIDUES PER ALPHA HELIX . 0 0 0 2 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 . 1 2 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 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 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 59 0, 0.0 27,-2.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 149.0 15.1 44.2 -7.4 2 2 A E E -a 28 0A 105 25,-0.2 2,-0.4 27,-0.0 27,-0.2 -0.938 360.0-167.2-111.7 136.4 14.8 41.4 -4.8 3 3 A V E -a 29 0A 0 25,-3.0 27,-2.9 -2,-0.4 2,-0.3 -0.989 14.2-138.7-123.5 125.3 16.1 41.9 -1.3 4 4 A L E -aB 30 15A 49 11,-2.9 11,-2.3 -2,-0.4 2,-0.9 -0.634 8.7-139.2 -85.5 140.1 16.4 38.9 1.1 5 5 A L E S-aB 31 14A 0 25,-2.6 27,-2.3 -2,-0.3 28,-1.3 -0.873 77.1 -3.6 -96.4 98.3 15.4 39.4 4.8 6 6 A G S S- 0 0 0 7,-2.8 6,-0.2 -2,-0.9 2,-0.1 0.243 84.8 -95.8 97.3 140.5 18.1 37.5 6.7 7 7 A G > - 0 0 4 4,-2.0 3,-2.4 1,-0.1 25,-0.0 -0.513 42.4-102.9 -75.8 170.3 21.1 35.5 5.4 8 8 A D T 3 S+ 0 0 138 1,-0.3 26,-0.1 -2,-0.1 -1,-0.1 0.786 124.6 58.1 -64.0 -26.6 20.6 31.7 5.2 9 9 A D T 3 S- 0 0 136 24,-0.1 -1,-0.3 25,-0.0 -3,-0.0 0.337 126.1-101.3 -81.5 3.3 22.7 31.4 8.4 10 10 A G < + 0 0 28 -3,-2.4 -2,-0.1 1,-0.2 -4,-0.0 0.446 65.7 161.2 84.6 10.7 20.2 33.7 10.3 11 11 A S - 0 0 46 1,-0.1 -4,-2.0 -5,-0.1 2,-1.6 -0.272 46.6-120.7 -66.8 144.5 22.4 36.8 10.0 12 12 A L + 0 0 59 -6,-0.2 2,-0.3 78,-0.2 81,-0.2 -0.589 68.4 116.7 -97.0 75.9 20.3 39.9 10.6 13 13 A A - 0 0 30 -2,-1.6 -7,-2.8 79,-0.1 2,-0.5 -0.978 64.6-125.5-139.2 144.5 20.9 41.7 7.3 14 14 A F E -B 5 0A 7 79,-0.4 -9,-0.2 -2,-0.3 79,-0.1 -0.843 41.7-123.0 -80.1 135.4 19.0 42.9 4.3 15 15 A L E S+B 4 0A 73 -11,-2.3 -11,-2.9 -2,-0.5 2,-0.2 -0.914 103.6 21.7-126.2 108.7 20.8 41.4 1.2 16 16 A P S S- 0 0 56 0, 0.0 -1,-0.2 0, 0.0 3,-0.2 0.548 83.7-178.0 -78.3 161.5 21.6 43.6 -0.5 17 17 A G S S+ 0 0 26 1,-0.3 78,-2.4 -2,-0.2 2,-0.4 0.599 72.9 33.3-103.2 -16.3 21.6 46.3 2.2 18 18 A D E S+d 95 0B 105 76,-0.2 -1,-0.3 -4,-0.1 2,-0.3 -0.931 81.3 142.9-140.9 112.0 22.5 49.4 0.1 19 19 A F E -d 96 0B 19 76,-1.9 78,-2.3 -2,-0.4 2,-0.4 -0.892 39.4-124.9-150.1 168.5 21.2 49.5 -3.4 20 20 A S E +d 97 0B 75 -2,-0.3 2,-0.3 76,-0.2 78,-0.2 -0.937 22.1 178.9-122.4 145.2 19.8 51.7 -6.2 21 21 A V E -d 98 0B 4 76,-2.4 78,-2.3 -2,-0.4 2,-0.3 -0.934 31.5-108.0-134.0 163.6 16.6 51.4 -8.2 22 22 A A > - 0 0 45 -2,-0.3 3,-2.1 77,-0.2 52,-0.2 -0.684 51.5 -87.2 -82.9 151.3 14.9 53.4 -10.9 23 23 A S T 3 S+ 0 0 58 -2,-0.3 52,-0.2 1,-0.3 -1,-0.1 -0.284 118.7 21.7 -52.4 131.7 11.8 55.4 -10.0 24 24 A G T 3 S+ 0 0 45 50,-2.7 2,-0.4 1,-0.3 -1,-0.3 0.435 88.8 132.2 83.3 2.7 8.9 53.0 -10.4 25 25 A E < - 0 0 69 -3,-2.1 49,-0.7 49,-0.3 -1,-0.3 -0.707 59.4-117.0 -83.1 137.9 10.9 49.8 -10.2 26 26 A E E - C 0 73A 96 -2,-0.4 2,-0.5 47,-0.2 47,-0.2 -0.460 18.8-150.3 -80.8 141.5 9.3 47.2 -7.8 27 27 A I E - C 0 72A 1 45,-2.9 45,-2.3 -2,-0.1 2,-0.6 -0.962 8.8-161.1-111.0 121.3 11.2 46.1 -4.7 28 28 A V E -aC 2 71A 25 -27,-2.7 -25,-3.0 -2,-0.5 2,-0.6 -0.945 0.1-162.2-106.0 110.5 10.5 42.6 -3.6 29 29 A F E -aC 3 70A 0 41,-3.2 41,-2.0 -2,-0.6 2,-0.5 -0.822 11.0-164.9 -92.9 121.1 11.4 41.9 0.0 30 30 A K E -aC 4 69A 78 -27,-2.9 -25,-2.6 -2,-0.6 39,-0.2 -0.918 18.4-127.8-113.6 120.6 11.6 38.1 0.5 31 31 A N E +a 5 0A 1 37,-3.1 36,-2.9 -2,-0.5 -25,-0.1 -0.469 38.9 161.2 -68.6 132.8 11.7 36.6 4.0 32 32 A N - 0 0 38 -27,-2.3 2,-0.3 1,-0.4 -26,-0.2 0.788 48.9 -33.4-120.0 -70.0 14.6 34.2 4.3 33 33 A A S S+ 0 0 20 -28,-1.3 -1,-0.4 -22,-0.2 -24,-0.1 -0.965 105.9 47.8-152.7 166.6 15.8 33.2 7.8 34 34 A G S S- 0 0 31 -2,-0.3 -28,-0.1 1,-0.2 -1,-0.1 0.667 90.8-174.7 75.4 13.8 16.1 34.7 11.3 35 35 A F + 0 0 70 -30,-0.1 -1,-0.2 2,-0.1 29,-0.1 -0.162 60.5 98.8 -71.7 171.1 12.5 36.0 11.2 36 36 A P + 0 0 46 0, 0.0 2,-0.3 0, 0.0 28,-0.2 0.341 66.5 154.9 -65.7 149.9 10.3 37.4 12.3 37 37 A H B +G 63 0C 0 26,-1.6 26,-3.2 -2,-0.1 2,-0.3 -0.949 17.3 173.3-136.9 158.1 11.2 40.4 10.1 38 38 A N - 0 0 2 -2,-0.3 2,-0.4 24,-0.2 24,-0.1 -0.897 27.9-118.6-147.2-170.8 9.4 43.4 8.6 39 39 A V + 0 0 0 -2,-0.3 18,-2.7 45,-0.1 2,-0.4 -0.965 30.5 169.5-137.5 114.5 10.2 46.5 6.6 40 40 A V E -E 83 0B 22 43,-2.6 43,-2.5 -2,-0.4 2,-0.4 -0.978 26.2-134.9-126.2 138.3 9.5 50.0 8.0 41 41 A F E -E 82 0B 5 -2,-0.4 2,-0.7 11,-0.3 41,-0.2 -0.773 22.0-121.2 -92.6 141.1 10.7 53.3 6.4 42 42 A D > - 0 0 31 39,-2.4 3,-2.4 -2,-0.4 39,-0.3 -0.708 15.8-151.3 -82.8 118.6 12.2 55.9 8.7 43 43 A E G > S+ 0 0 144 -2,-0.7 3,-0.6 1,-0.3 -1,-0.2 0.765 93.9 54.6 -74.0 -15.5 10.1 59.0 8.3 44 44 A D G 3 S+ 0 0 146 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.0 0.534 109.6 47.8 -80.1 -14.3 13.0 61.3 9.1 45 45 A E G < S+ 0 0 105 -3,-2.4 36,-2.0 36,-0.2 -1,-0.2 -0.213 92.7 82.7-126.3 41.2 15.3 59.8 6.5 46 46 A I S < S- 0 0 21 -3,-0.6 34,-0.2 34,-0.2 3,-0.1 -0.886 88.6 -70.4-132.0 169.8 13.2 59.7 3.3 47 47 A P > - 0 0 21 0, 0.0 3,-1.6 0, 0.0 31,-0.1 -0.099 58.2 -90.9 -63.4 154.5 12.5 62.4 0.6 48 48 A S T 3 S+ 0 0 111 1,-0.3 3,-0.1 3,-0.0 0, 0.0 -0.336 111.6 27.2 -61.2 139.7 10.3 65.4 1.4 49 49 A G T 3 S+ 0 0 88 1,-0.3 2,-0.5 -3,-0.1 -1,-0.3 0.550 89.9 120.4 86.6 2.7 6.6 64.8 0.5 50 50 A V < - 0 0 35 -3,-1.6 2,-0.7 -7,-0.1 -1,-0.3 -0.910 56.9-143.0-100.5 132.0 6.7 61.0 1.0 51 51 A D >> - 0 0 89 -2,-0.5 3,-1.3 1,-0.2 4,-0.6 -0.820 4.3-157.0 -91.1 115.8 4.4 59.6 3.6 52 52 A A H >> S+ 0 0 6 -2,-0.7 4,-1.5 1,-0.3 3,-0.8 0.801 87.3 68.8 -64.8 -22.4 6.2 56.7 5.3 53 53 A A H 34 S+ 0 0 75 1,-0.3 -1,-0.3 2,-0.2 3,-0.0 0.847 96.0 52.9 -68.3 -25.7 2.9 55.1 6.4 54 54 A K H <4 S+ 0 0 169 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.725 117.3 35.4 -78.6 -25.9 2.0 54.2 2.8 55 55 A I H << S+ 0 0 19 -3,-0.8 2,-0.2 -4,-0.6 -1,-0.2 0.516 102.8 84.4-106.8 -9.9 5.2 52.4 2.1 56 56 A S S < S- 0 0 20 -4,-1.5 -16,-0.2 -15,-0.1 2,-0.1 -0.647 81.8-107.1 -92.9 153.0 5.9 50.7 5.5 57 57 A M - 0 0 13 -18,-2.7 -1,-0.1 -2,-0.2 -16,-0.1 -0.395 45.8 -90.7 -65.6 152.5 4.4 47.5 6.7 58 58 A S > - 0 0 65 1,-0.1 3,-1.4 -2,-0.1 -19,-0.1 -0.350 39.8-115.8 -58.9 145.0 1.7 47.6 9.4 59 59 A E T 3 S+ 0 0 160 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.766 112.4 42.4 -64.3 -30.8 3.3 47.5 12.9 60 60 A E T 3 S+ 0 0 125 2,-0.0 2,-0.8 1,-0.0 -1,-0.3 0.441 91.9 97.2 -93.8 -2.1 1.8 44.2 13.9 61 61 A D < + 0 0 74 -3,-1.4 2,-0.3 2,-0.0 -4,-0.0 -0.830 50.4 169.0 -91.9 110.7 2.4 42.5 10.6 62 62 A L - 0 0 54 -2,-0.8 2,-0.6 -24,-0.1 -24,-0.2 -0.922 37.8-121.2-117.0 147.4 5.6 40.5 10.8 63 63 A L B +G 37 0C 11 -26,-3.2 -26,-1.6 -2,-0.3 4,-0.1 -0.836 38.5 166.9 -87.8 119.4 6.8 37.9 8.2 64 64 A N + 0 0 95 -2,-0.6 -1,-0.1 -28,-0.2 -29,-0.0 0.197 49.8 60.3-124.2 12.5 7.1 34.7 10.1 65 65 A A S > S- 0 0 34 -32,-0.0 3,-1.6 3,-0.0 -34,-0.2 -0.998 89.1 -92.6-139.6 145.8 7.6 32.0 7.4 66 66 A P T 3 S+ 0 0 98 0, 0.0 -34,-0.2 0, 0.0 3,-0.1 -0.223 106.3 16.7 -51.2 129.6 10.2 31.4 4.7 67 67 A G T 3 S+ 0 0 37 -36,-2.9 -35,-0.1 1,-0.3 2,-0.0 0.204 81.8 138.9 95.4 -14.0 9.4 32.9 1.3 68 68 A E < - 0 0 79 -3,-1.6 -37,-3.1 -38,-0.1 2,-0.3 -0.348 39.2-154.1 -58.3 145.2 6.7 35.4 2.4 69 69 A T E -C 30 0A 63 -39,-0.2 2,-0.4 -3,-0.1 -39,-0.2 -0.843 24.2-158.9-126.1 158.9 7.1 38.7 0.6 70 70 A Y E -C 29 0A 45 -41,-2.0 -41,-3.2 -2,-0.3 2,-0.4 -0.997 20.0-162.7-128.9 127.4 6.4 42.4 0.9 71 71 A K E +C 28 0A 114 -2,-0.4 2,-0.3 -43,-0.2 -43,-0.2 -0.936 14.4 166.6-117.0 135.0 6.4 44.3 -2.3 72 72 A V E -C 27 0A 13 -45,-2.3 -45,-2.9 -2,-0.4 2,-0.4 -0.988 21.5-150.3-145.4 150.1 6.7 48.1 -2.6 73 73 A T E -C 26 0A 63 -2,-0.3 2,-0.4 -47,-0.2 -47,-0.2 -0.991 10.7-157.8-125.2 131.2 7.4 50.6 -5.4 74 74 A L + 0 0 4 -49,-0.7 -50,-2.7 -2,-0.4 -49,-0.3 -0.852 18.2 167.4-110.4 137.3 9.1 54.0 -4.8 75 75 A T + 0 0 94 -2,-0.4 2,-0.3 -52,-0.2 -1,-0.1 0.629 49.6 88.9-118.6 -34.7 8.7 56.9 -7.1 76 76 A E S S- 0 0 102 1,-0.1 22,-0.2 -29,-0.1 -52,-0.1 -0.514 80.8-120.4 -72.0 127.6 10.0 60.1 -5.4 77 77 A K + 0 0 128 -2,-0.3 2,-0.3 22,-0.1 22,-0.2 -0.350 67.1 64.6 -68.0 149.9 13.7 60.4 -6.2 78 78 A G E S- F 0 98B 25 20,-2.4 20,-3.2 -31,-0.1 2,-0.3 -0.814 84.5 -45.7 137.1-171.2 16.2 60.4 -3.4 79 79 A T E - F 0 97B 74 -2,-0.3 2,-0.4 18,-0.2 18,-0.2 -0.720 43.7-165.9-107.8 140.1 17.6 58.2 -0.6 80 80 A Y E - F 0 96B 3 16,-2.4 16,-2.6 -2,-0.3 2,-0.4 -0.991 7.0-154.4-127.0 124.8 15.4 56.2 1.8 81 81 A K E + F 0 95B 47 -36,-2.0 -39,-2.4 -2,-0.4 2,-0.3 -0.839 21.9 170.9 -93.5 133.1 16.4 54.6 5.0 82 82 A F E -EF 41 94B 0 12,-2.3 12,-3.0 -2,-0.4 2,-0.3 -0.917 7.4-173.9-135.7 168.6 14.5 51.5 6.2 83 83 A Y E -EF 40 93B 42 -43,-2.5 -43,-2.6 -2,-0.3 2,-0.6 -0.964 33.0-106.0-153.5 166.9 14.8 48.9 8.9 84 84 A C >> - 0 0 0 8,-2.3 3,-0.9 -2,-0.3 4,-0.5 -0.909 33.2-143.7 -96.5 117.0 13.5 45.7 10.4 85 85 A S G >4 S+ 0 0 62 -2,-0.6 3,-1.3 1,-0.3 4,-0.3 0.901 94.6 43.2 -53.7 -51.7 11.6 46.7 13.6 86 86 A P G 34 S+ 0 0 65 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.783 124.5 36.9 -61.6 -26.7 12.5 43.7 15.8 87 87 A H G <4>S+ 0 0 34 -3,-0.9 5,-2.1 5,-0.2 3,-0.4 0.207 79.5 109.6-115.7 15.7 16.2 43.7 14.7 88 88 A Q T X<5S+ 0 0 79 -3,-1.3 3,-1.5 -4,-0.5 -1,-0.1 0.919 80.7 50.9 -65.9 -41.1 16.9 47.4 14.4 89 89 A G T 3 5S+ 0 0 88 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.768 105.3 58.9 -62.0 -25.9 19.2 47.4 17.4 90 90 A A T 3 5S- 0 0 64 -3,-0.4 -1,-0.3 -4,-0.1 -2,-0.2 0.404 126.4 -96.5 -86.0 3.0 21.1 44.5 15.9 91 91 A G T < 5S+ 0 0 47 -3,-1.5 2,-1.9 -4,-0.3 -3,-0.2 0.577 73.2 146.8 100.7 12.9 22.0 46.4 12.8 92 92 A M < + 0 0 0 -5,-2.1 -8,-2.3 -8,-0.2 2,-0.3 -0.557 33.5 121.7 -88.5 83.5 19.2 45.2 10.4 93 93 A V E - F 0 83B 61 -2,-1.9 -79,-0.4 -10,-0.2 2,-0.3 -0.942 36.3-175.6-137.7 153.8 18.9 48.5 8.5 94 94 A G E - F 0 82B 8 -12,-3.0 -12,-2.3 -2,-0.3 2,-0.4 -0.915 14.9-140.5-150.7 173.8 19.2 49.3 4.8 95 95 A K E -dF 18 81B 89 -78,-2.4 -76,-1.9 -2,-0.3 2,-0.4 -0.998 9.0-168.3-140.7 135.7 19.2 52.2 2.3 96 96 A V E -dF 19 80B 0 -16,-2.6 -16,-2.4 -2,-0.4 2,-0.5 -0.989 9.5-153.4-124.5 132.3 17.8 52.5 -1.2 97 97 A T E -dF 20 79B 39 -78,-2.3 -76,-2.4 -2,-0.4 2,-0.5 -0.948 10.1-156.6-101.9 127.4 18.6 55.3 -3.6 98 98 A V E dF 21 78B 1 -20,-3.2 -20,-2.4 -2,-0.5 -76,-0.2 -0.879 360.0 360.0-103.7 122.1 15.8 56.0 -6.2 99 99 A N 0 0 99 -78,-2.3 -77,-0.2 -2,-0.5 -1,-0.1 0.437 360.0 360.0-126.8 360.0 16.9 57.7 -9.4