==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 13-FEB-12 4DP7 . COMPND 2 MOLECULE: PLASTOCYANIN A, CHLOROPLASTIC; . SOURCE 2 ORGANISM_SCIENTIFIC: POPULUS NIGRA; . AUTHOR G.S.KACHALOVA,A.H.SHOSHEVA,G.P.BOURENKOV,A.A.DONCHEV,M.I.DIM . 99 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5231.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 63 63.6 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 . 12 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 2.0 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 X I 0 0 59 0, 0.0 27,-2.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 139.7 29.9 -2.8 0.9 2 2 X D E -a 28 0A 117 25,-0.2 2,-0.4 27,-0.1 27,-0.2 -0.831 360.0-169.3 -98.4 138.2 31.0 0.5 2.6 3 3 X V E -a 29 0A 1 25,-2.7 27,-2.9 -2,-0.4 2,-0.3 -0.989 15.1-135.8-130.2 125.7 28.4 3.2 3.1 4 4 X L E -aB 30 15A 52 11,-2.8 11,-2.1 -2,-0.4 2,-0.9 -0.671 7.8-141.8 -81.4 139.3 29.2 6.9 4.1 5 5 X L E S+aB 31 14A 0 25,-3.0 27,-2.4 -2,-0.3 28,-1.9 -0.851 84.6 4.9 -98.0 101.5 27.1 8.6 6.7 6 6 X G S S- 0 0 0 7,-2.4 6,-0.2 -2,-0.9 9,-0.2 0.249 92.1-100.0 90.5 136.6 26.9 12.1 5.3 7 7 X A > - 0 0 17 4,-2.6 3,-2.4 25,-0.1 -2,-0.0 -0.445 33.4-104.0 -83.4 166.8 28.4 13.0 1.9 8 8 X D T 3 S+ 0 0 138 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.597 122.0 56.2 -70.0 -11.1 31.7 14.7 1.4 9 9 X D T 3 S- 0 0 124 2,-0.1 -1,-0.3 24,-0.1 -3,-0.0 0.256 124.9-101.4 -97.8 7.6 29.9 18.1 0.7 10 10 X G S < S+ 0 0 37 -3,-2.4 -2,-0.2 1,-0.3 23,-0.0 0.376 70.7 153.6 87.7 -3.2 28.1 17.9 4.1 11 11 X S - 0 0 57 1,-0.1 -4,-2.6 -5,-0.1 2,-1.8 -0.313 53.7-118.8 -60.7 143.7 24.8 16.6 2.5 12 12 X L S S+ 0 0 61 -6,-0.2 2,-0.3 78,-0.1 -1,-0.1 -0.538 71.6 116.6 -85.0 79.3 22.7 14.6 4.9 13 13 X A - 0 0 32 -2,-1.8 -7,-2.4 79,-0.2 2,-0.4 -0.982 67.9-117.4-145.6 150.6 22.7 11.3 2.9 14 14 X F E -B 5 0A 5 79,-0.4 -9,-0.2 -2,-0.3 79,-0.1 -0.769 42.0-122.9 -79.8 137.1 23.9 7.7 2.9 15 15 X V E S+B 4 0A 60 -11,-2.1 -11,-2.8 -2,-0.4 2,-0.1 -0.923 102.2 16.9-127.3 110.5 26.4 7.2 0.1 16 16 X P S S+ 0 0 51 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.629 80.8 179.5 -74.7 164.9 25.3 5.0 -1.6 17 17 X S + 0 0 49 1,-0.3 78,-2.6 -2,-0.1 2,-0.4 0.720 69.7 42.5-103.3 -25.8 21.7 5.0 -0.4 18 18 X E E S+d 95 0B 142 76,-0.2 2,-0.3 -4,-0.1 -1,-0.3 -0.993 74.6 135.4-123.1 129.8 20.3 2.2 -2.6 19 19 X F E -d 96 0B 23 76,-1.7 78,-2.3 -2,-0.4 2,-0.3 -0.977 41.2-124.8-164.4 164.9 22.2 -0.9 -3.1 20 20 X S E +d 97 0B 70 -2,-0.3 2,-0.3 76,-0.2 78,-0.2 -0.956 23.9 179.4-119.6 147.0 22.0 -4.7 -3.3 21 21 X I E -d 98 0B 3 76,-2.4 78,-2.2 -2,-0.3 3,-0.1 -0.882 25.1-114.0-136.7 167.5 24.1 -7.3 -1.3 22 22 X S > - 0 0 67 -2,-0.3 3,-2.3 76,-0.2 52,-0.3 -0.698 52.7 -70.4 -97.1 161.3 24.3 -11.1 -1.1 23 23 X P T 3 S+ 0 0 52 0, 0.0 52,-0.3 0, 0.0 -1,-0.1 -0.152 119.9 9.8 -52.8 131.7 23.4 -13.2 2.0 24 24 X G T 3 S+ 0 0 51 50,-3.0 2,-0.4 1,-0.2 51,-0.2 0.338 90.7 138.8 85.2 -7.6 25.9 -12.8 4.8 25 25 X E < - 0 0 75 -3,-2.3 49,-0.8 49,-0.3 -1,-0.2 -0.576 51.2-124.5 -76.9 122.0 27.7 -9.9 3.1 26 26 X K E - C 0 73A 110 -2,-0.4 2,-0.5 47,-0.2 47,-0.3 -0.276 13.3-153.5 -68.4 146.6 28.7 -7.0 5.6 27 27 X I E - C 0 72A 0 45,-2.5 45,-2.4 -6,-0.0 2,-0.7 -0.996 8.8-160.4-113.0 125.0 27.6 -3.4 5.3 28 28 X V E -aC 2 71A 19 -27,-2.6 -25,-2.7 -2,-0.5 2,-0.5 -0.933 2.7-161.3-110.3 109.9 30.0 -1.0 7.0 29 29 X F E -aC 3 70A 0 41,-2.8 41,-2.0 -2,-0.7 2,-0.5 -0.785 11.2-162.0 -89.4 123.4 28.4 2.4 7.7 30 30 X K E -aC 4 69A 92 -27,-2.9 -25,-3.0 -2,-0.5 2,-0.3 -0.935 21.1-122.0-118.6 123.2 31.1 5.0 8.3 31 31 X N E +a 5 0A 1 37,-3.3 36,-2.8 -2,-0.5 -25,-0.1 -0.439 47.2 154.7 -63.8 120.6 30.5 8.3 10.0 32 32 X N - 0 0 18 -27,-2.4 2,-0.3 1,-0.3 -26,-0.2 0.798 50.6 -15.6-119.8 -59.9 31.6 10.9 7.5 33 33 X A S S+ 0 0 21 -28,-1.9 -1,-0.3 -22,-0.1 -24,-0.1 -0.993 112.8 29.8-153.8 148.8 30.1 14.4 7.7 34 34 X G S S- 0 0 36 -2,-0.3 -28,-0.1 1,-0.2 -1,-0.1 0.669 92.8-172.7 80.0 9.2 27.2 16.2 9.3 35 35 X F + 0 0 73 -30,-0.1 -1,-0.2 2,-0.1 2,-0.2 -0.266 59.0 95.9 -68.1 165.8 27.2 13.7 12.2 36 36 X P + 0 0 58 0, 0.0 2,-0.3 0, 0.0 28,-0.2 0.342 68.2 156.0 -63.1 149.0 25.9 12.7 14.8 37 37 X H B -G 63 0C 0 26,-1.9 26,-3.2 -2,-0.2 2,-0.3 -0.929 23.2-173.7-139.2 162.2 24.2 10.0 12.8 38 38 X N - 0 0 0 -2,-0.3 2,-0.4 24,-0.2 49,-0.1 -0.880 21.6-128.0-141.0 179.7 22.8 6.5 13.3 39 39 X I + 0 0 0 -2,-0.3 18,-2.9 19,-0.2 2,-0.4 -0.971 27.3 175.5-134.8 118.0 21.4 3.7 11.2 40 40 X V E -E 83 0B 12 43,-2.9 43,-2.3 -2,-0.4 2,-0.4 -0.987 23.0-139.5-126.4 127.5 18.0 2.3 12.1 41 41 X F E -E 82 0B 4 -2,-0.4 2,-0.6 11,-0.3 41,-0.3 -0.761 28.4-114.9 -88.5 137.5 16.2 -0.3 10.1 42 42 X D > - 0 0 54 39,-2.4 3,-2.5 -2,-0.4 39,-0.3 -0.575 19.9-148.5 -74.9 109.7 12.5 0.3 9.7 43 43 X E T 3 S+ 0 0 147 -2,-0.6 3,-0.4 1,-0.3 -1,-0.2 0.735 97.4 47.6 -54.8 -22.7 10.8 -2.7 11.6 44 44 X D T 3 S+ 0 0 139 1,-0.2 -1,-0.3 4,-0.0 -2,-0.1 0.335 111.2 50.6 -98.1 -0.5 7.9 -2.6 9.2 45 45 X S S < S+ 0 0 50 -3,-2.5 36,-2.0 36,-0.2 -3,-0.2 -0.060 91.5 83.1-132.5 33.0 9.9 -2.4 6.1 46 46 X I S S- 0 0 20 -3,-0.4 34,-0.2 34,-0.2 3,-0.1 -0.835 92.5 -60.5-122.3 171.8 12.4 -5.3 6.4 47 47 X P > - 0 0 19 0, 0.0 3,-2.6 0, 0.0 -1,-0.1 -0.115 65.7 -89.2 -58.6 140.0 11.9 -9.0 5.6 48 48 X S T 3 S+ 0 0 128 1,-0.3 3,-0.1 -4,-0.1 -4,-0.0 -0.125 111.3 14.6 -47.4 132.0 9.3 -10.9 7.4 49 49 X G T 3 S+ 0 0 85 1,-0.3 -1,-0.3 -3,-0.1 2,-0.3 0.259 88.8 133.4 87.0 -12.3 10.6 -12.4 10.5 50 50 X V < - 0 0 26 -3,-2.6 2,-0.8 -7,-0.1 -1,-0.3 -0.533 57.2-128.8 -72.5 136.3 13.8 -10.4 10.8 51 51 X D >> - 0 0 82 -2,-0.3 3,-1.6 1,-0.2 4,-0.5 -0.750 14.1-158.5 -84.1 108.1 14.6 -8.9 14.2 52 52 X A H >> S+ 0 0 16 -2,-0.8 3,-1.0 1,-0.3 4,-0.9 0.798 90.4 62.4 -56.2 -32.6 15.3 -5.2 13.5 53 53 X S H 34 S+ 0 0 91 1,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.742 96.3 58.6 -72.6 -18.7 17.2 -5.0 16.8 54 54 X K H <4 S+ 0 0 178 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.655 119.5 29.1 -76.3 -19.1 19.8 -7.6 15.6 55 55 X I H << S+ 0 0 12 -3,-1.0 2,-0.3 -4,-0.5 -2,-0.2 0.380 112.4 71.2-123.6 2.1 20.7 -5.3 12.6 56 56 X S < - 0 0 21 -4,-0.9 2,-0.2 -5,-0.1 -16,-0.2 -0.849 67.6-125.6-124.0 154.7 20.0 -1.8 13.9 57 57 X M - 0 0 12 -18,-2.9 -16,-0.2 -2,-0.3 2,-0.1 -0.618 45.8-107.2 -74.9 152.6 21.3 0.9 16.2 58 58 X S > - 0 0 47 -2,-0.2 3,-1.3 1,-0.1 -19,-0.2 -0.522 28.6-112.5 -69.2 160.2 18.6 2.1 18.5 59 59 X E T 3 S+ 0 0 85 1,-0.3 -1,-0.1 -2,-0.1 -19,-0.1 0.769 118.8 55.6 -63.2 -25.2 17.2 5.5 17.7 60 60 X E T 3 S+ 0 0 159 25,-0.0 2,-0.3 2,-0.0 -1,-0.3 0.604 91.3 87.6 -82.5 -16.1 18.8 6.8 20.9 61 61 X D < - 0 0 83 -3,-1.3 2,-0.3 2,-0.0 -4,-0.1 -0.632 60.6-174.9 -82.7 142.4 22.3 5.5 20.0 62 62 X L - 0 0 84 -2,-0.3 2,-0.6 -24,-0.1 -24,-0.2 -0.994 31.0-139.2-136.4 147.3 24.5 7.9 17.9 63 63 X L B +G 37 0C 20 -26,-3.2 -26,-1.9 -2,-0.3 4,-0.1 -0.932 32.0 168.1 -94.1 115.0 27.8 7.8 16.2 64 64 X N + 0 0 103 -2,-0.6 2,-0.4 -28,-0.2 -1,-0.1 0.483 47.9 76.2-112.6 0.2 29.1 11.3 17.1 65 65 X A S > S- 0 0 36 0, 0.0 3,-1.6 0, 0.0 -34,-0.2 -0.888 86.5-107.7-111.1 141.7 32.8 11.0 16.0 66 66 X K T 3 S+ 0 0 128 -2,-0.4 -34,-0.2 1,-0.2 3,-0.1 -0.485 105.9 23.3 -57.2 135.4 34.1 11.1 12.4 67 67 X G T 3 S+ 0 0 29 -36,-2.8 -1,-0.2 1,-0.4 -35,-0.1 0.203 85.4 134.6 90.5 -13.0 35.3 7.6 11.4 68 68 X E < - 0 0 73 -3,-1.6 -37,-3.3 -38,-0.1 -1,-0.4 -0.363 40.5-153.7 -65.1 150.8 33.2 5.6 13.8 69 69 X T E -C 30 0A 67 -39,-0.2 2,-0.4 -3,-0.1 -39,-0.2 -0.907 24.4-159.0-127.2 157.2 31.4 2.7 12.3 70 70 X F E -C 29 0A 44 -41,-2.0 -41,-2.8 -2,-0.3 2,-0.4 -0.988 22.8-165.8-128.4 123.7 28.4 0.5 12.6 71 71 X E E +C 28 0A 114 -2,-0.4 2,-0.3 -43,-0.2 -43,-0.2 -0.909 13.2 165.4-114.3 138.0 28.7 -2.9 10.8 72 72 X V E -C 27 0A 12 -45,-2.4 -45,-2.5 -2,-0.4 2,-0.4 -0.986 21.2-153.3-149.1 139.9 25.9 -5.3 10.1 73 73 X A E -C 26 0A 53 -2,-0.3 2,-0.4 -47,-0.3 -47,-0.2 -0.867 14.5-153.5-111.8 140.6 25.6 -8.3 7.9 74 74 X L + 0 0 3 -49,-0.8 -50,-3.0 -2,-0.4 -49,-0.3 -0.861 20.4 167.9-109.3 152.0 22.2 -9.3 6.5 75 75 X S + 0 0 66 -2,-0.4 2,-0.2 -52,-0.3 -1,-0.1 0.598 48.9 87.8-130.6 -44.0 21.2 -12.8 5.5 76 76 X N S S- 0 0 90 1,-0.1 22,-0.2 -29,-0.1 2,-0.1 -0.443 80.7-115.0 -66.6 135.6 17.5 -13.1 5.0 77 77 X K + 0 0 139 -2,-0.2 2,-0.2 20,-0.1 22,-0.2 -0.389 67.8 61.1 -70.3 147.8 16.5 -12.3 1.4 78 78 X G E S- F 0 98B 26 20,-2.3 20,-2.9 -31,-0.1 2,-0.4 -0.777 84.4 -41.4 132.9-174.0 14.4 -9.2 0.5 79 79 X E E - F 0 97B 111 18,-0.2 2,-0.5 -2,-0.2 18,-0.2 -0.697 42.8-167.9 -92.6 135.8 14.2 -5.4 0.8 80 80 X Y E - F 0 96B 2 16,-2.7 16,-2.5 -2,-0.4 2,-0.4 -0.964 4.2-160.0-124.8 113.7 15.4 -3.5 3.9 81 81 X S E + F 0 95B 26 -36,-2.0 -39,-2.4 -2,-0.5 2,-0.3 -0.760 18.9 172.0 -91.3 142.9 14.6 0.2 4.3 82 82 X F E -EF 41 94B 3 12,-2.4 12,-2.6 -2,-0.4 2,-0.3 -0.900 9.8-175.8-145.7 166.8 16.7 2.2 6.8 83 83 X Y E -EF 40 93B 29 -43,-2.3 -43,-2.9 -2,-0.3 2,-0.6 -0.979 34.7-108.5-158.8 163.6 17.3 5.7 8.0 84 84 X C > - 0 0 0 8,-2.4 3,-0.8 -2,-0.3 4,-0.5 -0.926 35.6-142.9 -97.1 115.9 19.3 8.0 10.2 85 85 X S G > S+ 0 0 28 -2,-0.6 3,-1.0 1,-0.2 4,-0.3 0.918 93.4 43.8 -60.1 -43.9 16.9 9.0 12.9 86 86 X P G 3 S+ 0 0 73 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 0.747 124.8 37.5 -72.8 -12.7 17.9 12.7 13.6 87 87 X H G < >S+ 0 0 35 -3,-0.8 5,-2.2 5,-0.2 4,-0.5 0.162 80.2 110.1-119.0 13.1 18.1 13.3 9.8 88 88 X Q T X 5S+ 0 0 85 -3,-1.0 3,-1.8 -4,-0.5 -1,-0.1 0.940 81.2 47.1 -62.3 -47.3 15.2 11.3 8.5 89 89 X G T 3 5S+ 0 0 85 -4,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.831 104.9 60.8 -65.7 -27.8 13.0 14.3 7.5 90 90 X A T 3 5S- 0 0 74 -3,-0.1 -1,-0.3 -4,-0.1 -2,-0.2 0.594 128.7 -99.5 -69.3 -12.1 16.0 15.9 5.8 91 91 X G T < 5S+ 0 0 43 -3,-1.8 2,-1.9 -4,-0.5 -3,-0.2 0.544 72.1 148.7 105.5 12.5 16.1 12.8 3.5 92 92 X M < + 0 0 0 -5,-2.2 -8,-2.4 -8,-0.2 2,-0.3 -0.564 37.2 119.9 -83.7 82.1 18.8 10.7 5.1 93 93 X V E + F 0 83B 67 -2,-1.9 -79,-0.4 -10,-0.2 2,-0.3 -0.888 35.0 176.3-137.8 164.3 17.2 7.3 4.2 94 94 X G E - F 0 82B 9 -12,-2.6 -12,-2.4 -2,-0.3 2,-0.3 -0.961 19.5-137.7-162.2 174.3 18.2 4.3 2.1 95 95 X K E -dF 18 81B 67 -78,-2.6 -76,-1.7 -2,-0.3 2,-0.4 -0.931 10.6-167.5-147.3 128.2 17.2 0.8 1.0 96 96 X V E -dF 19 80B 0 -16,-2.5 -16,-2.7 -2,-0.3 2,-0.5 -0.930 9.6-153.5-114.7 134.0 19.3 -2.4 0.7 97 97 X T E -dF 20 79B 39 -78,-2.3 -76,-2.4 -2,-0.4 2,-0.6 -0.933 3.0-153.6-105.4 126.4 18.1 -5.5 -1.2 98 98 X V E dF 21 78B 2 -20,-2.9 -20,-2.3 -2,-0.5 -76,-0.2 -0.882 360.0 360.0 -95.0 115.9 19.5 -8.9 -0.2 99 99 X N 0 0 125 -78,-2.2 -79,-0.0 -2,-0.6 -2,-0.0 -0.539 360.0 360.0-129.5 360.0 19.2 -11.1 -3.3