==== 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 4DP8 . 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) . 5193.0 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 . 11 11.1 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 . 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 X I 0 0 57 0, 0.0 27,-2.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 138.0 30.2 -2.7 1.0 2 2 X D E -a 28 0A 119 25,-0.2 2,-0.4 27,-0.0 27,-0.2 -0.833 360.0-170.1 -96.1 133.1 31.3 0.7 2.6 3 3 X V E -a 29 0A 1 25,-2.8 27,-2.9 -2,-0.4 2,-0.3 -0.994 14.8-138.2-126.0 125.5 28.7 3.3 3.1 4 4 X L E -aB 30 15A 39 11,-2.9 11,-2.0 -2,-0.4 2,-0.9 -0.645 7.4-142.1 -81.8 138.1 29.4 6.9 4.1 5 5 X L E S+aB 31 14A 0 25,-3.0 27,-2.6 -2,-0.3 28,-2.1 -0.872 84.6 7.6 -96.6 102.3 27.3 8.6 6.7 6 6 X G S S- 0 0 0 7,-2.5 6,-0.2 -2,-0.9 9,-0.2 0.295 93.4-100.4 93.4 133.6 27.2 12.1 5.3 7 7 X A > - 0 0 16 4,-2.6 3,-2.4 25,-0.1 -2,-0.0 -0.419 33.1-103.9 -83.0 167.6 28.5 13.0 1.9 8 8 X D T 3 S+ 0 0 139 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.590 122.1 54.3 -71.0 -10.2 31.9 14.7 1.4 9 9 X D T 3 S- 0 0 123 2,-0.1 -1,-0.3 24,-0.1 -3,-0.0 0.245 125.8 -99.6 -99.7 9.9 30.1 18.0 0.7 10 10 X G S < S+ 0 0 39 -3,-2.4 -2,-0.1 1,-0.3 23,-0.0 0.327 70.9 152.9 89.6 -7.0 28.3 17.8 4.0 11 11 X S - 0 0 58 1,-0.1 -4,-2.6 -5,-0.1 2,-1.7 -0.290 53.0-120.2 -57.9 141.4 25.0 16.5 2.5 12 12 X L S S+ 0 0 57 -6,-0.2 2,-0.3 78,-0.1 -1,-0.1 -0.601 71.5 116.7 -86.7 79.9 22.9 14.5 5.0 13 13 X A - 0 0 32 -2,-1.7 -7,-2.5 79,-0.1 2,-0.4 -0.989 69.0-117.0-144.1 149.9 22.9 11.3 2.9 14 14 X F E -B 5 0A 4 79,-0.4 -9,-0.2 -2,-0.3 79,-0.1 -0.769 41.7-123.8 -78.2 136.7 24.0 7.7 3.0 15 15 X V E S+B 4 0A 61 -11,-2.0 -11,-2.9 -2,-0.4 2,-0.1 -0.934 102.2 18.0-130.0 108.0 26.5 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 0.643 81.4 178.1 -74.1 161.4 25.5 5.0 -1.5 17 17 X S + 0 0 47 1,-0.3 78,-2.5 -2,-0.1 2,-0.4 0.676 69.6 41.8-102.8 -25.4 21.9 5.0 -0.3 18 18 X E E S+d 95 0B 137 76,-0.2 2,-0.3 -4,-0.1 -1,-0.3 -0.998 75.8 135.4-123.6 128.2 20.5 2.3 -2.5 19 19 X F E -d 96 0B 22 76,-1.6 78,-2.3 -2,-0.4 2,-0.4 -0.974 41.3-125.2-161.8 167.6 22.4 -0.8 -3.1 20 20 X S E +d 97 0B 69 -2,-0.3 2,-0.3 76,-0.2 78,-0.2 -0.963 24.6 175.8-124.1 145.7 22.3 -4.6 -3.2 21 21 X I E -d 98 0B 3 76,-2.4 78,-2.4 -2,-0.4 3,-0.1 -0.864 26.9-111.6-137.7 169.4 24.4 -7.2 -1.3 22 22 X S > - 0 0 64 -2,-0.3 3,-2.3 76,-0.2 52,-0.3 -0.697 52.4 -72.2 -95.9 163.2 24.6 -11.0 -1.0 23 23 X P T 3 S+ 0 0 61 0, 0.0 52,-0.3 0, 0.0 -1,-0.1 -0.180 119.4 11.8 -57.3 140.1 23.8 -12.9 2.1 24 24 X G T 3 S+ 0 0 52 50,-3.3 2,-0.4 1,-0.2 51,-0.1 0.307 89.8 138.2 77.5 -5.5 26.3 -12.6 4.9 25 25 X E < - 0 0 74 -3,-2.3 49,-0.7 49,-0.3 -1,-0.2 -0.566 52.8-123.8 -75.0 119.7 28.1 -9.6 3.1 26 26 X K E - C 0 73A 107 -2,-0.4 2,-0.5 47,-0.2 47,-0.2 -0.287 14.1-152.6 -65.8 145.3 29.0 -6.9 5.6 27 27 X I E - C 0 72A 0 45,-2.4 45,-2.1 -6,-0.0 2,-0.7 -0.992 9.0-160.0-110.4 126.3 27.9 -3.3 5.3 28 28 X V E -aC 2 71A 20 -27,-2.7 -25,-2.8 -2,-0.5 2,-0.5 -0.931 3.1-161.7-111.3 108.9 30.4 -0.9 7.0 29 29 X F E -aC 3 70A 0 41,-2.9 41,-2.0 -2,-0.7 2,-0.5 -0.804 11.9-164.3 -90.1 122.1 28.6 2.4 7.8 30 30 X K E -aC 4 69A 95 -27,-2.9 -25,-3.0 -2,-0.5 2,-0.3 -0.945 21.9-121.7-119.9 123.9 31.3 5.0 8.4 31 31 X N E +a 5 0A 1 37,-3.2 36,-2.7 -2,-0.5 -25,-0.1 -0.454 47.4 153.4 -64.2 121.0 30.8 8.4 10.0 32 32 X N - 0 0 14 -27,-2.6 2,-0.3 1,-0.4 -26,-0.2 0.766 52.8 -9.6-120.2 -54.6 31.9 10.9 7.5 33 33 X A S S+ 0 0 20 -28,-2.1 -1,-0.4 -22,-0.1 -24,-0.1 -0.992 113.2 23.2-153.4 146.1 30.2 14.4 7.7 34 34 X G S S- 0 0 39 -2,-0.3 -28,-0.1 1,-0.2 -1,-0.1 0.663 90.0-171.9 75.1 16.1 27.4 16.1 9.5 35 35 X F + 0 0 68 -30,-0.1 -1,-0.2 2,-0.1 29,-0.1 -0.229 59.6 99.8 -71.6 168.0 27.3 13.6 12.3 36 36 X P + 0 0 55 0, 0.0 2,-0.3 0, 0.0 28,-0.2 0.302 67.3 156.0 -56.3 143.9 25.9 12.7 14.8 37 37 X H B -G 63 0C 0 26,-2.1 26,-3.2 -2,-0.1 2,-0.3 -0.955 22.1-177.2-137.3 160.8 24.4 9.9 12.8 38 38 X N - 0 0 0 -2,-0.3 2,-0.4 24,-0.2 49,-0.1 -0.906 22.9-126.2-145.8 179.6 22.9 6.5 13.4 39 39 X I + 0 0 0 -2,-0.3 18,-2.8 19,-0.2 2,-0.4 -0.970 27.1 175.4-132.6 118.2 21.5 3.6 11.3 40 40 X V E -E 83 0B 11 43,-2.9 43,-2.3 -2,-0.4 2,-0.4 -0.986 22.5-140.7-126.3 123.6 18.1 2.2 12.1 41 41 X F E -E 82 0B 5 -2,-0.4 2,-0.6 11,-0.3 41,-0.3 -0.755 28.5-115.3 -81.7 137.3 16.3 -0.4 10.1 42 42 X D > - 0 0 52 39,-2.7 3,-2.3 -2,-0.4 39,-0.3 -0.603 19.0-149.2 -75.2 111.7 12.6 0.2 9.7 43 43 X E T 3 S+ 0 0 148 -2,-0.6 3,-0.4 1,-0.3 -1,-0.1 0.724 95.1 48.4 -55.6 -26.3 10.9 -2.7 11.6 44 44 X D T 3 S+ 0 0 140 1,-0.2 -1,-0.3 4,-0.0 -2,-0.1 0.362 112.1 47.9 -95.2 4.8 7.9 -2.6 9.2 45 45 X S S < S+ 0 0 53 -3,-2.3 36,-1.8 36,-0.2 -3,-0.2 -0.093 90.6 88.1-141.0 36.6 9.9 -2.5 6.0 46 46 X I S S- 0 0 21 -3,-0.4 34,-0.2 34,-0.2 3,-0.1 -0.840 90.2 -64.5-121.1 168.7 12.5 -5.3 6.4 47 47 X P > - 0 0 19 0, 0.0 3,-2.4 0, 0.0 -1,-0.1 -0.131 67.6 -81.6 -61.6 151.1 12.0 -9.0 5.4 48 48 X S T 3 S+ 0 0 121 1,-0.3 3,-0.1 -4,-0.1 -4,-0.0 -0.134 112.0 9.0 -58.2 134.6 9.5 -11.1 7.2 49 49 X G T 3 S+ 0 0 85 1,-0.3 2,-0.3 -3,-0.1 -1,-0.3 0.378 88.8 137.5 80.5 -6.9 10.7 -12.4 10.5 50 50 X V < - 0 0 25 -3,-2.4 2,-0.8 -7,-0.1 -1,-0.3 -0.573 55.2-128.9 -72.8 137.4 13.9 -10.4 10.7 51 51 X D >> - 0 0 81 -2,-0.3 3,-1.6 1,-0.2 4,-0.5 -0.765 13.8-158.5 -85.2 109.2 14.6 -8.9 14.1 52 52 X A H >> S+ 0 0 16 -2,-0.8 3,-1.1 1,-0.3 4,-0.9 0.806 88.7 63.7 -57.6 -30.6 15.3 -5.2 13.4 53 53 X S H 34 S+ 0 0 88 1,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.757 95.4 57.2 -67.7 -24.8 17.2 -5.0 16.7 54 54 X K H <4 S+ 0 0 176 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.627 117.8 32.5 -76.2 -17.1 19.9 -7.4 15.6 55 55 X I H << S+ 0 0 13 -3,-1.1 2,-0.3 -4,-0.5 -2,-0.2 0.366 111.8 70.7-120.5 -0.7 20.8 -5.3 12.6 56 56 X S < - 0 0 20 -4,-0.9 2,-0.2 -3,-0.1 -16,-0.2 -0.844 69.9-125.2-119.0 157.0 20.2 -1.8 13.9 57 57 X M - 0 0 13 -18,-2.8 -16,-0.2 -2,-0.3 2,-0.1 -0.610 47.4-106.4 -74.9 151.5 21.5 0.8 16.2 58 58 X S > - 0 0 47 -2,-0.2 3,-0.9 1,-0.1 -19,-0.2 -0.439 30.4-109.0 -69.1 165.3 18.7 1.9 18.5 59 59 X E T 3 S+ 0 0 89 1,-0.2 -1,-0.1 -2,-0.1 -19,-0.1 0.803 120.0 51.9 -64.5 -28.1 17.3 5.3 17.8 60 60 X E T 3 S+ 0 0 154 25,-0.1 2,-0.3 2,-0.0 -1,-0.2 0.572 91.1 91.8 -85.0 -14.9 19.0 6.7 20.9 61 61 X D < - 0 0 85 -3,-0.9 2,-0.3 -22,-0.1 -4,-0.1 -0.609 60.2-170.6 -79.7 144.4 22.4 5.4 20.0 62 62 X L - 0 0 77 -2,-0.3 2,-0.6 -24,-0.1 -24,-0.2 -0.989 30.8-145.3-137.1 148.0 24.7 7.7 18.0 63 63 X L B +G 37 0C 9 -26,-3.2 -26,-2.1 -2,-0.3 4,-0.1 -0.953 32.4 163.3 -98.6 117.3 28.0 7.7 16.1 64 64 X N + 0 0 101 -2,-0.6 2,-0.3 -28,-0.2 -1,-0.1 0.390 45.1 78.2-125.1 5.7 29.2 11.2 16.9 65 65 X A S > S- 0 0 48 0, 0.0 3,-1.7 0, 0.0 -34,-0.2 -0.927 86.3-105.5-104.7 140.6 33.0 11.0 16.0 66 66 X K T 3 S+ 0 0 132 -2,-0.3 -34,-0.2 1,-0.2 3,-0.1 -0.458 107.0 21.2 -60.5 133.3 34.4 11.1 12.4 67 67 X G T 3 S+ 0 0 41 -36,-2.7 -1,-0.2 1,-0.3 -35,-0.1 0.245 86.7 135.1 91.0 -13.7 35.5 7.6 11.3 68 68 X E < - 0 0 75 -3,-1.7 -37,-3.2 -38,-0.1 -1,-0.3 -0.431 40.4-154.4 -62.2 147.9 33.4 5.7 13.9 69 69 X T E -C 30 0A 72 -39,-0.2 2,-0.4 -3,-0.1 -39,-0.2 -0.884 25.0-157.2-127.6 158.9 31.6 2.8 12.3 70 70 X F E -C 29 0A 43 -41,-2.0 -41,-2.9 -2,-0.3 2,-0.4 -0.992 22.8-164.9-127.5 122.4 28.6 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 -0.908 13.2 166.5-110.7 137.0 29.0 -2.9 10.9 72 72 X V E -C 27 0A 11 -45,-2.1 -45,-2.4 -2,-0.4 2,-0.4 -0.979 21.7-152.7-150.2 139.5 26.2 -5.2 10.1 73 73 X A E -C 26 0A 54 -2,-0.3 2,-0.4 -47,-0.2 -47,-0.2 -0.885 14.2-154.6-107.1 142.6 25.8 -8.3 8.0 74 74 X L + 0 0 2 -49,-0.7 -50,-3.3 -2,-0.4 -49,-0.3 -0.852 19.0 169.4-112.2 146.3 22.5 -9.2 6.6 75 75 X S + 0 0 67 -2,-0.4 -1,-0.1 -52,-0.3 2,-0.1 0.676 49.1 85.1-123.0 -45.7 21.4 -12.7 5.7 76 76 X N S S- 0 0 87 1,-0.1 22,-0.2 -29,-0.1 2,-0.1 -0.351 79.8-116.0 -67.0 135.9 17.7 -13.0 4.9 77 77 X K + 0 0 134 -2,-0.1 2,-0.2 20,-0.1 22,-0.2 -0.384 67.4 62.7 -70.6 147.8 16.8 -12.1 1.4 78 78 X G E S- F 0 98B 26 20,-2.3 20,-2.8 -31,-0.1 2,-0.4 -0.782 84.6 -42.5 132.9-174.3 14.6 -9.2 0.5 79 79 X E E - F 0 97B 106 -2,-0.2 2,-0.5 18,-0.2 18,-0.2 -0.713 43.3-167.5 -92.9 136.2 14.4 -5.4 0.8 80 80 X Y E - F 0 96B 2 16,-2.8 16,-2.6 -2,-0.4 2,-0.4 -0.966 4.5-159.5-125.9 115.2 15.5 -3.5 3.9 81 81 X S E + F 0 95B 30 -36,-1.8 -39,-2.7 -2,-0.5 2,-0.3 -0.752 19.2 172.7 -92.0 143.3 14.7 0.2 4.4 82 82 X F E -EF 41 94B 3 12,-2.5 12,-2.6 -2,-0.4 2,-0.3 -0.911 9.6-174.1-144.2 167.7 16.8 2.1 6.9 83 83 X Y E -EF 40 93B 28 -43,-2.3 -43,-2.9 -2,-0.3 2,-0.6 -0.979 33.8-109.3-158.0 162.4 17.3 5.7 8.1 84 84 X C >> - 0 0 0 8,-2.4 3,-0.9 -2,-0.3 4,-0.6 -0.920 34.5-144.6 -95.4 117.5 19.4 8.0 10.2 85 85 X S G >4 S+ 0 0 28 -2,-0.6 3,-0.9 1,-0.2 4,-0.3 0.923 93.2 44.4 -59.9 -45.0 17.0 8.9 13.1 86 86 X P G 34 S+ 0 0 68 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.713 125.6 34.2 -74.1 -10.3 18.1 12.5 13.7 87 87 X H G <4>S+ 0 0 49 -3,-0.9 5,-2.1 5,-0.2 4,-0.5 0.168 79.5 112.9-122.9 6.1 18.2 13.3 9.9 88 88 X Q T X<5S+ 0 0 88 -3,-0.9 3,-1.8 -4,-0.6 -3,-0.1 0.915 79.6 49.4 -53.7 -48.3 15.4 11.2 8.5 89 89 X G T 3 5S+ 0 0 85 -4,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.804 102.8 62.0 -66.0 -26.6 13.2 14.2 7.5 90 90 X A T 3 5S- 0 0 72 -3,-0.4 -1,-0.3 2,-0.1 -2,-0.2 0.580 128.9 -98.7 -66.8 -12.8 16.2 15.8 5.8 91 91 X G T < 5S+ 0 0 43 -3,-1.8 2,-1.9 -4,-0.5 -3,-0.2 0.545 73.2 149.0 106.0 9.7 16.2 12.8 3.6 92 92 X M < + 0 0 0 -5,-2.1 -8,-2.4 -8,-0.2 2,-0.3 -0.561 36.2 120.2 -85.2 83.4 18.9 10.6 5.2 93 93 X V E + F 0 83B 66 -2,-1.9 -79,-0.4 -10,-0.2 2,-0.3 -0.893 34.8 176.5-136.3 163.0 17.3 7.3 4.3 94 94 X G E - F 0 82B 9 -12,-2.6 -12,-2.5 -2,-0.3 2,-0.3 -0.962 19.1-139.8-160.3 175.3 18.3 4.2 2.2 95 95 X K E -dF 18 81B 61 -78,-2.5 -76,-1.6 -2,-0.3 2,-0.4 -0.946 10.2-165.9-150.1 129.8 17.4 0.8 1.1 96 96 X V E -dF 19 80B 0 -16,-2.6 -16,-2.8 -2,-0.3 2,-0.5 -0.940 9.3-152.4-113.8 134.2 19.5 -2.3 0.7 97 97 X T E -dF 20 79B 35 -78,-2.3 -76,-2.4 -2,-0.4 2,-0.6 -0.927 2.3-155.1-104.9 126.5 18.4 -5.4 -1.2 98 98 X V E dF 21 78B 2 -20,-2.8 -20,-2.3 -2,-0.5 -76,-0.2 -0.901 360.0 360.0 -97.2 116.7 19.8 -8.8 -0.2 99 99 X N 0 0 119 -78,-2.4 -2,-0.0 -2,-0.6 -79,-0.0 -0.686 360.0 360.0-126.2 360.0 19.5 -11.0 -3.2