==== 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 4DPC . 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) . 5137.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 61 61.6 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 . 11 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 10.1 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 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 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 60 0, 0.0 27,-2.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 131.8 30.5 -2.4 1.3 2 2 X D E -a 28 0A 113 25,-0.2 2,-0.5 27,-0.1 27,-0.2 -0.778 360.0-168.7 -93.1 138.5 31.3 1.0 2.9 3 3 X V E -a 29 0A 0 25,-2.9 27,-3.0 -2,-0.4 2,-0.3 -0.987 15.7-137.6-128.3 120.2 28.5 3.5 3.3 4 4 X L E -aB 30 15A 50 11,-2.9 11,-2.2 -2,-0.5 2,-0.9 -0.618 6.0-142.2 -78.7 138.8 29.3 7.1 4.2 5 5 X L E S+aB 31 14A 0 25,-2.9 27,-2.6 -2,-0.3 28,-2.1 -0.876 84.7 8.4 -98.8 101.3 27.2 8.8 6.8 6 6 X G S S- 0 0 0 7,-2.6 6,-0.2 -2,-0.9 9,-0.1 0.296 93.9-101.0 92.4 132.5 27.0 12.3 5.3 7 7 X A > - 0 0 14 4,-2.6 3,-2.4 25,-0.1 -2,-0.0 -0.407 32.9-103.8 -80.1 167.1 28.4 13.1 1.9 8 8 X D T 3 S+ 0 0 138 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.583 122.3 55.6 -69.0 -11.6 31.8 14.7 1.3 9 9 X D T 3 S- 0 0 124 2,-0.1 -1,-0.3 24,-0.1 -2,-0.0 0.201 125.1-100.9 -98.3 7.2 30.0 18.0 0.5 10 10 X G S < S+ 0 0 38 -3,-2.4 -2,-0.1 1,-0.3 23,-0.0 0.357 71.0 151.8 91.8 -3.4 28.2 17.9 3.9 11 11 X S - 0 0 58 1,-0.1 -4,-2.6 -5,-0.1 2,-1.7 -0.302 54.2-118.7 -64.8 145.3 24.8 16.7 2.5 12 12 X L S S+ 0 0 59 -6,-0.2 2,-0.3 78,-0.1 -1,-0.1 -0.579 72.1 116.5 -85.2 83.5 22.8 14.6 5.0 13 13 X A - 0 0 31 -2,-1.7 -7,-2.6 79,-0.2 2,-0.4 -0.992 68.7-116.8-147.2 152.0 22.8 11.5 3.0 14 14 X F E -B 5 0A 4 79,-0.5 -9,-0.2 -2,-0.3 3,-0.1 -0.764 41.6-124.1 -82.5 136.2 24.0 7.9 3.0 15 15 X V E S+B 4 0A 61 -11,-2.2 -11,-2.9 -2,-0.4 2,-0.1 -0.929 101.9 18.8-129.3 107.9 26.4 7.3 0.2 16 16 X P S S+ 0 0 50 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.621 80.8 177.1 -76.5 160.5 25.4 5.1 -1.4 17 17 X S S S+ 0 0 47 1,-0.3 78,-2.6 -2,-0.1 2,-0.4 0.715 70.2 42.1-101.3 -28.1 21.8 5.1 -0.3 18 18 X E E S+d 95 0B 138 76,-0.2 2,-0.3 -4,-0.1 -1,-0.3 -0.995 76.4 137.0-122.8 124.4 20.4 2.4 -2.5 19 19 X F E -d 96 0B 22 76,-1.6 78,-2.3 -2,-0.4 2,-0.4 -0.978 39.5-129.5-158.0 162.7 22.4 -0.8 -3.0 20 20 X S E +d 97 0B 72 -2,-0.3 2,-0.3 76,-0.2 78,-0.2 -0.961 21.5 177.8-122.5 149.0 22.3 -4.5 -3.1 21 21 X I E -d 98 0B 3 76,-2.2 78,-3.0 -2,-0.4 3,-0.1 -0.890 28.7-117.8-137.9 162.0 24.4 -7.2 -1.4 22 22 X S > - 0 0 65 -2,-0.3 3,-1.4 76,-0.2 52,-0.2 -0.688 56.8 -71.4 -94.3 162.0 24.5 -10.9 -1.2 23 23 X P T 3 S+ 0 0 54 0, 0.0 52,-0.2 0, 0.0 -1,-0.1 -0.155 114.5 15.7 -57.5 147.6 23.9 -12.5 2.3 24 24 X G T 3 S+ 0 0 56 50,-3.2 2,-0.2 1,-0.2 51,-0.1 0.295 87.5 137.3 75.2 -4.5 26.5 -12.3 5.1 25 25 X E < - 0 0 84 -3,-1.4 49,-0.6 49,-0.3 -1,-0.2 -0.604 58.8-110.7 -83.2 133.8 28.5 -9.4 3.3 26 26 X K E - C 0 73A 112 -2,-0.2 2,-0.5 47,-0.2 47,-0.2 -0.274 23.6-161.7 -61.4 137.5 29.6 -6.6 5.7 27 27 X I E - C 0 72A 0 45,-2.6 45,-2.5 2,-0.0 2,-0.7 -0.997 9.2-166.3-110.2 123.7 27.9 -3.2 5.5 28 28 X V E -aC 2 71A 15 -27,-2.7 -25,-2.9 -2,-0.5 2,-0.5 -0.924 3.6-161.4-111.5 108.7 30.2 -0.7 7.2 29 29 X F E -aC 3 70A 0 41,-2.9 41,-2.2 -2,-0.7 2,-0.5 -0.794 15.4-164.7 -87.8 121.9 28.4 2.6 7.9 30 30 X K E -aC 4 69A 92 -27,-3.0 -25,-2.9 -2,-0.5 2,-0.2 -0.947 22.2-120.0-120.9 123.4 31.1 5.2 8.5 31 31 X N E +a 5 0A 2 37,-3.1 36,-2.7 -2,-0.5 -25,-0.1 -0.419 47.1 153.3 -60.1 125.2 30.6 8.7 10.0 32 32 X N - 0 0 18 -27,-2.6 2,-0.3 1,-0.4 -26,-0.2 0.758 54.4 -10.1-121.9 -55.8 31.7 11.2 7.4 33 33 X A S S+ 0 0 20 -28,-2.1 -1,-0.4 -22,-0.1 -24,-0.1 -0.990 115.9 25.3-154.1 143.6 30.2 14.6 7.6 34 34 X G S S- 0 0 40 -2,-0.3 -28,-0.1 1,-0.2 -1,-0.0 0.614 93.0-170.5 79.5 9.1 27.3 16.2 9.5 35 35 X F + 0 0 75 -30,-0.2 -1,-0.2 2,-0.1 2,-0.2 -0.226 58.8 90.3 -64.9 163.3 27.5 13.7 12.4 36 36 X P + 0 0 55 0, 0.0 2,-0.3 0, 0.0 28,-0.2 0.358 68.2 152.9 -61.4 151.8 26.3 12.7 14.8 37 37 X H B -G 63 0C 0 26,-1.6 26,-3.1 -2,-0.2 2,-0.3 -0.928 24.9-164.6-137.9 168.0 24.3 10.1 12.8 38 38 X N - 0 0 0 -2,-0.3 2,-0.4 24,-0.2 49,-0.1 -0.886 17.5-129.3-143.4 178.4 22.8 6.7 13.4 39 39 X I + 0 0 0 -2,-0.3 18,-2.8 19,-0.2 2,-0.4 -0.972 27.2 174.6-134.1 116.1 21.5 3.8 11.3 40 40 X V E -E 83 0B 10 43,-2.9 43,-2.3 -2,-0.4 2,-0.4 -0.989 24.0-139.6-123.1 125.3 18.1 2.4 12.1 41 41 X F E -E 82 0B 4 -2,-0.4 2,-0.6 11,-0.3 41,-0.3 -0.728 29.4-114.9 -81.6 135.7 16.3 -0.2 10.1 42 42 X D > - 0 0 52 39,-2.5 3,-2.6 -2,-0.4 39,-0.3 -0.563 19.9-149.3 -70.6 112.4 12.6 0.5 9.8 43 43 X E T 3 S+ 0 0 144 -2,-0.6 3,-0.4 1,-0.3 -1,-0.2 0.699 96.6 49.7 -61.4 -19.0 11.0 -2.4 11.6 44 44 X D T 3 S+ 0 0 140 1,-0.2 -1,-0.3 37,-0.0 -2,-0.1 0.360 110.0 51.7 -95.2 -2.1 8.0 -2.3 9.3 45 45 X S S < S+ 0 0 48 -3,-2.6 36,-2.4 36,-0.2 -3,-0.2 -0.204 89.7 85.4-133.0 42.4 10.0 -2.2 6.1 46 46 X I S S- 0 0 25 -3,-0.4 34,-0.2 34,-0.2 3,-0.1 -0.868 87.3 -64.9-131.9 169.6 12.4 -5.2 6.4 47 47 X P > - 0 0 20 0, 0.0 3,-2.4 0, 0.0 31,-0.1 -0.137 65.6 -79.5 -63.7 153.6 11.9 -8.9 5.5 48 48 X S T 3 S+ 0 0 121 1,-0.3 3,-0.1 -3,-0.0 -3,-0.0 -0.124 113.1 8.0 -50.5 130.6 9.4 -11.1 7.3 49 49 X G T 3 S+ 0 0 82 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.381 89.6 139.7 82.6 -7.5 10.6 -12.4 10.6 50 50 X V < - 0 0 26 -3,-2.4 2,-0.8 -4,-0.1 -1,-0.2 -0.594 52.3-132.6 -77.3 135.5 13.8 -10.3 10.8 51 51 X D > - 0 0 79 -2,-0.3 3,-1.6 1,-0.2 4,-0.4 -0.732 12.6-160.3 -84.6 106.7 14.6 -8.8 14.2 52 52 X A G >> S+ 0 0 14 -2,-0.8 3,-1.2 1,-0.3 4,-0.9 0.811 87.5 64.9 -58.1 -30.0 15.4 -5.2 13.5 53 53 X S G 34 S+ 0 0 89 1,-0.3 -1,-0.3 2,-0.2 5,-0.1 0.755 94.7 58.2 -70.0 -19.2 17.2 -4.9 16.8 54 54 X K G <4 S+ 0 0 173 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.674 118.8 30.0 -79.5 -16.5 19.9 -7.4 15.6 55 55 X I T <4 S+ 0 0 13 -3,-1.2 2,-0.3 -4,-0.4 -2,-0.2 0.335 111.2 71.1-123.4 -1.5 20.8 -5.2 12.7 56 56 X S < - 0 0 19 -4,-0.9 2,-0.2 -16,-0.1 -16,-0.2 -0.862 68.3-125.1-121.7 153.5 20.1 -1.6 13.9 57 57 X M - 0 0 12 -18,-2.8 -16,-0.2 -2,-0.3 2,-0.1 -0.605 45.7-107.3 -73.0 154.3 21.2 1.0 16.2 58 58 X S > - 0 0 45 -2,-0.2 3,-1.1 1,-0.1 -19,-0.2 -0.498 29.6-111.1 -70.8 166.2 18.5 2.1 18.5 59 59 X E T 3 S+ 0 0 90 1,-0.3 -1,-0.1 -2,-0.1 -19,-0.1 0.792 118.5 55.5 -66.1 -27.7 17.2 5.6 17.6 60 60 X E T 3 S+ 0 0 152 25,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.569 91.6 88.0 -83.0 -15.1 18.7 6.9 20.8 61 61 X D < - 0 0 80 -3,-1.1 2,-0.4 -22,-0.1 -4,-0.1 -0.598 60.4-169.8 -85.2 147.3 22.2 5.7 20.0 62 62 X L - 0 0 70 -2,-0.2 2,-0.7 -24,-0.1 -24,-0.2 -0.986 29.9-132.3-137.0 147.6 24.6 7.8 18.0 63 63 X L B +G 37 0C 9 -26,-3.1 -26,-1.6 -2,-0.4 4,-0.1 -0.923 33.8 179.0 -88.9 117.6 27.9 7.6 16.2 64 64 X N + 0 0 98 -2,-0.7 2,-0.2 -28,-0.2 -1,-0.2 0.907 47.3 61.1 -88.7 -50.2 29.5 10.7 17.5 65 65 X A S > S- 0 0 53 1,-0.1 3,-1.9 -29,-0.1 -34,-0.2 -0.539 87.8 -99.3 -87.5 142.7 33.1 10.9 16.0 66 66 X K T 3 S+ 0 0 128 1,-0.2 -34,-0.2 -2,-0.2 -1,-0.1 -0.452 112.9 22.6 -55.3 135.1 34.2 11.3 12.4 67 67 X G T 3 S+ 0 0 26 -36,-2.7 -1,-0.2 1,-0.3 -35,-0.1 0.265 87.3 136.7 86.7 -10.9 35.3 7.8 11.3 68 68 X E < - 0 0 71 -3,-1.9 -37,-3.1 -38,-0.1 -1,-0.3 -0.431 39.4-155.2 -63.7 147.9 33.2 5.9 13.9 69 69 X T E -C 30 0A 59 -39,-0.2 2,-0.4 -3,-0.1 -39,-0.2 -0.888 26.0-157.0-129.5 157.9 31.4 3.0 12.3 70 70 X F E -C 29 0A 45 -41,-2.2 -41,-2.9 -2,-0.3 2,-0.4 -0.996 22.9-161.6-129.2 120.5 28.4 0.7 12.7 71 71 X E E +C 28 0A 114 -2,-0.4 2,-0.3 -43,-0.2 -43,-0.2 -0.896 15.1 166.2-105.8 137.9 28.8 -2.7 11.0 72 72 X V E -C 27 0A 8 -45,-2.5 -45,-2.6 -2,-0.4 2,-0.4 -0.990 20.3-158.9-145.6 145.3 26.1 -5.0 10.1 73 73 X A E -C 26 0A 45 -2,-0.3 2,-0.3 -47,-0.2 -47,-0.2 -0.982 18.2-146.7-120.5 140.1 25.7 -8.0 7.9 74 74 X L + 0 0 1 -49,-0.6 -50,-3.2 -2,-0.4 -49,-0.3 -0.775 16.9 179.4-101.4 156.0 22.3 -9.0 6.7 75 75 X S + 0 0 79 -2,-0.3 -1,-0.1 -52,-0.2 2,-0.1 0.641 53.7 74.1-117.4 -66.9 21.1 -12.6 6.2 76 76 X N S S- 0 0 82 1,-0.1 22,-0.2 -29,-0.1 -1,-0.1 -0.375 81.0-113.6 -68.2 136.5 17.6 -12.9 5.0 77 77 X K + 0 0 131 -2,-0.1 2,-0.3 20,-0.1 22,-0.2 -0.369 68.7 61.2 -66.7 149.7 16.8 -12.0 1.4 78 78 X G E S- F 0 98B 25 20,-2.3 20,-2.8 -31,-0.1 2,-0.4 -0.787 84.5 -38.6 128.7-173.9 14.6 -9.0 0.6 79 79 X E E - F 0 97B 110 -2,-0.3 2,-0.5 18,-0.2 18,-0.2 -0.720 42.6-170.0 -90.8 136.4 14.4 -5.2 0.9 80 80 X Y E - F 0 96B 2 16,-2.7 16,-2.6 -2,-0.4 2,-0.4 -0.967 5.6-159.7-127.4 114.0 15.5 -3.4 4.0 81 81 X S E + F 0 95B 31 -36,-2.4 -39,-2.5 -2,-0.5 2,-0.3 -0.758 19.0 172.2 -92.0 141.3 14.7 0.3 4.4 82 82 X F E -EF 41 94B 3 12,-2.5 12,-2.6 -2,-0.4 2,-0.3 -0.906 9.3-176.5-142.7 168.2 16.8 2.3 6.9 83 83 X Y E -EF 40 93B 26 -43,-2.3 -43,-2.9 -2,-0.3 2,-0.6 -0.981 34.9-106.4-158.8 163.9 17.3 5.8 8.0 84 84 X C > - 0 0 0 8,-2.4 4,-0.7 -2,-0.3 3,-0.3 -0.911 34.9-142.5 -94.0 120.4 19.3 8.1 10.3 85 85 X S T >4 S+ 0 0 28 -2,-0.6 3,-1.0 1,-0.2 4,-0.3 0.944 94.2 41.7 -60.6 -47.0 16.9 9.0 13.1 86 86 X P T 34 S+ 0 0 71 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.771 125.9 36.4 -74.6 -16.1 17.9 12.7 13.6 87 87 X H T 34>S+ 0 0 38 -3,-0.3 5,-2.2 5,-0.2 4,-0.5 0.206 80.1 109.8-116.9 15.3 18.1 13.4 9.9 88 88 X Q T X<5S+ 0 0 87 -3,-1.0 3,-1.8 -4,-0.7 -1,-0.1 0.913 81.8 48.4 -60.3 -45.6 15.3 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 0.787 103.8 61.3 -66.6 -26.1 13.1 14.3 7.6 90 90 X A T 3 5S- 0 0 71 -3,-0.4 -1,-0.3 2,-0.1 -2,-0.2 0.554 128.9 -99.3 -71.6 -10.4 16.1 15.9 5.9 91 91 X G T < 5S+ 0 0 44 -3,-1.8 2,-1.8 -4,-0.5 -3,-0.2 0.544 73.1 148.3 104.9 10.6 16.1 12.9 3.6 92 92 X M < + 0 0 0 -5,-2.2 -8,-2.4 -8,-0.2 2,-0.3 -0.566 36.6 118.9 -86.0 84.8 18.9 10.8 5.2 93 93 X V E + F 0 83B 66 -2,-1.8 -79,-0.5 -10,-0.2 2,-0.3 -0.898 35.4 177.1-139.5 165.6 17.3 7.4 4.3 94 94 X G E - F 0 82B 9 -12,-2.6 -12,-2.5 -2,-0.3 2,-0.3 -0.965 19.6-137.6-163.4 176.4 18.3 4.4 2.2 95 95 X K E -dF 18 81B 60 -78,-2.6 -76,-1.6 -2,-0.3 2,-0.4 -0.946 11.5-166.2-148.6 125.5 17.3 0.9 1.1 96 96 X V E -dF 19 80B 0 -16,-2.6 -16,-2.7 -2,-0.3 2,-0.5 -0.936 9.2-152.3-113.2 135.8 19.5 -2.2 0.8 97 97 X T E -dF 20 79B 36 -78,-2.3 -76,-2.2 -2,-0.4 2,-0.7 -0.928 4.1-153.1-106.7 121.6 18.3 -5.2 -1.1 98 98 X V E dF 21 78B 2 -20,-2.8 -20,-2.3 -2,-0.5 -76,-0.2 -0.864 360.0 360.0 -92.0 119.9 19.7 -8.6 0.0 99 99 X N 0 0 116 -78,-3.0 -2,-0.0 -2,-0.7 -79,-0.0 -0.709 360.0 360.0-141.4 360.0 19.7 -10.8 -3.0