==== 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 4DP9 . 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) . 5147.0 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 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 62 0, 0.0 27,-2.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 131.7 30.4 -2.4 1.1 2 2 X D E -a 28 0A 97 25,-0.2 2,-0.4 27,-0.1 27,-0.2 -0.739 360.0-169.7 -93.3 135.9 31.3 0.9 2.7 3 3 X V E -a 29 0A 0 25,-2.9 27,-2.9 -2,-0.4 2,-0.3 -0.986 15.9-137.6-127.3 121.4 28.5 3.5 3.2 4 4 X L E -aB 30 15A 43 11,-2.7 11,-2.1 -2,-0.4 2,-0.8 -0.618 5.4-143.0 -78.0 139.0 29.3 7.1 4.2 5 5 X L E S+aB 31 14A 0 25,-3.0 27,-2.7 -2,-0.3 28,-2.0 -0.882 85.1 8.3 -99.9 103.3 27.2 8.7 6.8 6 6 X G S S- 0 0 0 7,-2.6 6,-0.2 -2,-0.8 9,-0.2 0.248 94.6-100.5 91.2 133.6 27.1 12.2 5.5 7 7 X A > - 0 0 14 4,-2.7 3,-2.4 25,-0.1 -2,-0.0 -0.414 31.7-104.3 -82.1 166.8 28.4 13.1 2.0 8 8 X D T 3 S+ 0 0 141 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.570 122.5 55.2 -68.9 -9.2 31.8 14.7 1.3 9 9 X D T 3 S- 0 0 126 2,-0.1 -1,-0.3 24,-0.1 -3,-0.0 0.283 124.9-101.5-101.3 10.7 30.0 18.0 0.6 10 10 X G S < S+ 0 0 41 -3,-2.4 -2,-0.1 1,-0.3 23,-0.0 0.331 71.5 151.2 88.5 -7.2 28.3 17.9 4.1 11 11 X S - 0 0 58 1,-0.1 -4,-2.7 -5,-0.1 2,-1.7 -0.299 55.4-118.2 -59.8 143.8 24.9 16.7 2.7 12 12 X L S S+ 0 0 59 -6,-0.2 2,-0.3 78,-0.1 -1,-0.1 -0.576 71.9 119.2 -87.5 85.2 22.9 14.6 5.2 13 13 X A - 0 0 30 -2,-1.7 -7,-2.6 79,-0.2 2,-0.4 -0.989 67.9-117.6-147.8 148.4 22.9 11.5 3.1 14 14 X F E -B 5 0A 5 79,-0.5 -9,-0.2 -2,-0.3 79,-0.1 -0.790 41.5-123.9 -80.5 135.5 23.9 7.9 3.0 15 15 X V E S+B 4 0A 61 -11,-2.1 -11,-2.7 -2,-0.4 2,-0.1 -0.928 101.7 17.2-128.3 108.8 26.5 7.4 0.2 16 16 X P S S+ 0 0 50 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.624 80.8 179.1 -77.4 162.1 25.4 5.2 -1.5 17 17 X S S S+ 0 0 49 1,-0.3 78,-2.5 -2,-0.1 2,-0.4 0.730 70.8 42.3-100.9 -28.2 21.8 5.2 -0.3 18 18 X E E S+d 95 0B 138 76,-0.2 2,-0.3 -4,-0.1 -1,-0.3 -0.991 75.1 138.1-120.2 128.6 20.4 2.4 -2.6 19 19 X F E -d 96 0B 22 76,-1.6 78,-2.2 -2,-0.4 2,-0.4 -0.978 39.7-128.6-161.5 163.4 22.4 -0.7 -3.1 20 20 X S E +d 97 0B 71 -2,-0.3 2,-0.3 76,-0.2 78,-0.2 -0.939 25.1 173.8-122.7 146.7 22.2 -4.5 -3.4 21 21 X I E -d 98 0B 2 76,-2.5 78,-2.6 -2,-0.4 3,-0.0 -0.841 27.3-115.6-139.4 169.3 24.2 -7.1 -1.6 22 22 X S > - 0 0 62 -2,-0.3 3,-1.9 76,-0.2 52,-0.2 -0.738 54.0 -69.3-102.0 163.2 24.4 -10.9 -1.1 23 23 X P T 3 S+ 0 0 60 0, 0.0 52,-0.2 0, 0.0 -1,-0.1 -0.253 118.9 11.4 -54.6 140.1 23.8 -12.7 2.1 24 24 X G T 3 S+ 0 0 54 50,-3.2 2,-0.4 1,-0.3 51,-0.1 0.306 87.8 143.9 76.8 -9.8 26.5 -12.3 4.8 25 25 X E < - 0 0 80 -3,-1.9 49,-0.6 49,-0.3 -1,-0.3 -0.561 54.9-115.8 -62.1 122.8 28.2 -9.4 2.8 26 26 X K E - C 0 73A 115 -2,-0.4 2,-0.5 47,-0.1 47,-0.2 -0.253 24.6-161.5 -59.6 139.9 29.5 -6.8 5.4 27 27 X I E - C 0 72A 0 45,-2.0 45,-2.4 2,-0.0 2,-0.6 -0.999 6.0-167.0-115.9 124.3 28.0 -3.3 5.3 28 28 X V E -aC 2 71A 20 -27,-2.6 -25,-2.9 -2,-0.5 2,-0.6 -0.942 3.6-161.7-112.9 107.8 30.2 -0.8 7.1 29 29 X F E -aC 3 70A 0 41,-2.8 41,-2.2 -2,-0.6 2,-0.5 -0.818 15.7-164.8 -87.8 122.4 28.4 2.5 7.8 30 30 X K E -aC 4 69A 80 -27,-2.9 -25,-3.0 -2,-0.6 39,-0.2 -0.933 22.3-120.0-122.6 124.3 31.1 5.1 8.5 31 31 X N E +a 5 0A 2 37,-3.1 36,-2.5 -2,-0.5 -25,-0.1 -0.396 46.4 153.7 -59.4 125.3 30.6 8.6 10.1 32 32 X N - 0 0 19 -27,-2.7 2,-0.3 1,-0.4 -26,-0.2 0.736 55.9 -10.0-120.2 -58.7 31.8 11.1 7.5 33 33 X A S S+ 0 0 22 -28,-2.0 -1,-0.4 -22,-0.1 -24,-0.1 -0.987 115.8 25.3-150.6 144.9 30.2 14.5 7.9 34 34 X G S S- 0 0 40 -2,-0.3 -28,-0.1 1,-0.2 -1,-0.1 0.632 90.7-168.8 79.5 9.0 27.4 16.0 9.9 35 35 X F + 0 0 72 -30,-0.2 -1,-0.2 2,-0.1 2,-0.2 -0.239 60.4 90.6 -60.8 161.2 27.5 13.5 12.7 36 36 X P + 0 0 57 0, 0.0 2,-0.3 0, 0.0 28,-0.2 0.412 69.0 154.3 -60.2 149.8 26.2 12.4 15.1 37 37 X H B -G 63 0C 0 26,-1.5 26,-3.1 -2,-0.2 2,-0.3 -0.937 23.7-168.2-136.1 166.2 24.3 9.9 12.9 38 38 X N - 0 0 0 -2,-0.3 2,-0.4 24,-0.2 49,-0.1 -0.892 19.0-130.7-142.4 179.6 22.8 6.5 13.4 39 39 X I + 0 0 0 -2,-0.3 18,-2.6 19,-0.2 2,-0.5 -0.970 26.5 178.0-137.0 116.9 21.5 3.7 11.2 40 40 X V E -E 83 0B 10 43,-2.9 43,-2.3 -2,-0.4 2,-0.4 -0.982 22.2-140.4-123.4 124.4 18.0 2.3 12.0 41 41 X F E -E 82 0B 4 -2,-0.5 2,-0.6 16,-0.2 41,-0.3 -0.721 29.1-116.3 -81.2 134.1 16.3 -0.4 10.0 42 42 X D > - 0 0 51 39,-2.5 3,-2.5 -2,-0.4 39,-0.3 -0.592 18.4-147.4 -74.3 113.8 12.5 0.3 9.8 43 43 X E T 3 S+ 0 0 141 -2,-0.6 3,-0.4 1,-0.3 -1,-0.2 0.690 96.4 51.4 -59.2 -19.7 10.9 -2.6 11.6 44 44 X D T 3 S+ 0 0 139 1,-0.2 -1,-0.3 37,-0.0 -2,-0.1 0.382 109.6 49.0 -96.3 4.5 7.9 -2.4 9.2 45 45 X S S < S+ 0 0 50 -3,-2.5 36,-2.0 36,-0.2 -3,-0.2 -0.088 89.3 89.5-140.8 37.4 9.9 -2.5 6.0 46 46 X I S S- 0 0 26 -3,-0.4 34,-0.2 34,-0.2 3,-0.2 -0.831 84.2 -66.2-124.9 169.0 12.4 -5.4 6.4 47 47 X P > - 0 0 18 0, 0.0 3,-2.4 0, 0.0 -1,-0.1 0.020 67.7 -69.5 -66.2 160.1 12.0 -9.0 5.3 48 48 X S T 3 S- 0 0 120 1,-0.3 28,-0.0 0, 0.0 0, 0.0 -0.124 114.7 -3.1 -55.8 122.9 9.6 -11.5 6.9 49 49 X G T 3 S+ 0 0 81 1,-0.2 -1,-0.3 -3,-0.2 2,-0.2 0.442 88.9 146.5 84.4 -5.0 10.6 -12.5 10.4 50 50 X V < - 0 0 28 -3,-2.4 2,-0.8 1,-0.1 -1,-0.2 -0.500 48.1-131.4 -71.4 137.0 13.8 -10.5 10.6 51 51 X D > - 0 0 78 -2,-0.2 3,-1.8 1,-0.2 4,-0.5 -0.761 10.6-156.8 -85.5 107.2 14.6 -9.0 14.1 52 52 X A G >> S+ 0 0 17 -2,-0.8 3,-1.4 1,-0.3 4,-1.2 0.822 89.9 64.4 -55.4 -29.7 15.4 -5.4 13.5 53 53 X S G 34 S+ 0 0 90 1,-0.3 -1,-0.3 2,-0.2 5,-0.1 0.726 94.7 59.1 -71.3 -17.7 17.5 -5.4 16.8 54 54 X K G <4 S+ 0 0 175 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.693 120.7 25.3 -74.8 -20.6 19.9 -7.9 15.4 55 55 X I T <4 S+ 0 0 12 -3,-1.4 2,-0.3 -4,-0.5 -2,-0.2 0.391 111.9 70.5-125.5 -2.9 20.8 -5.5 12.5 56 56 X S < - 0 0 20 -4,-1.2 2,-0.2 -5,-0.1 -16,-0.2 -0.855 66.1-125.4-125.2 153.8 20.1 -1.9 13.7 57 57 X M - 0 0 10 -18,-2.6 -16,-0.2 -2,-0.3 2,-0.2 -0.576 43.9-109.5 -74.8 156.2 21.1 0.8 16.0 58 58 X S > - 0 0 45 -2,-0.2 3,-0.5 1,-0.1 -19,-0.2 -0.491 28.7-109.6 -75.1 167.2 18.4 2.0 18.3 59 59 X E T 3 S+ 0 0 92 1,-0.2 -1,-0.1 -2,-0.2 -19,-0.1 0.799 120.9 51.1 -66.5 -27.0 17.1 5.4 17.6 60 60 X E T 3 S+ 0 0 151 25,-0.1 -1,-0.2 2,-0.0 2,-0.2 0.680 91.7 91.9 -83.6 -22.3 18.7 6.7 20.8 61 61 X D < - 0 0 85 -3,-0.5 2,-0.4 -22,-0.0 -4,-0.1 -0.491 60.3-170.8 -69.3 145.3 22.1 5.2 19.9 62 62 X L - 0 0 71 -2,-0.2 2,-0.6 -24,-0.1 -24,-0.2 -0.992 30.5-136.2-137.5 150.1 24.5 7.5 18.1 63 63 X L B +G 37 0C 9 -26,-3.1 -26,-1.5 -2,-0.4 4,-0.1 -0.916 30.1 178.3 -95.1 118.8 27.8 7.3 16.3 64 64 X N + 0 0 102 -2,-0.6 2,-0.4 -28,-0.2 -1,-0.1 0.526 47.6 67.7-102.8 -13.3 29.5 10.5 17.7 65 65 X A S > S- 0 0 48 4,-0.0 3,-2.0 0, 0.0 -34,-0.2 -0.909 84.7-104.6-118.5 140.3 33.0 10.5 16.1 66 66 X K T 3 S+ 0 0 129 -2,-0.4 -34,-0.2 1,-0.2 3,-0.1 -0.443 111.8 20.9 -53.9 132.1 34.3 11.0 12.6 67 67 X G T 3 S+ 0 0 40 -36,-2.5 -1,-0.2 1,-0.3 -35,-0.1 0.231 88.6 135.8 88.8 -12.0 35.3 7.6 11.4 68 68 X E < - 0 0 71 -3,-2.0 -37,-3.1 -38,-0.1 -1,-0.3 -0.429 39.1-157.5 -65.5 146.3 33.2 5.7 13.9 69 69 X T E -C 30 0A 65 -39,-0.2 2,-0.4 -3,-0.1 -39,-0.2 -0.855 26.5-153.0-128.4 161.7 31.3 2.8 12.3 70 70 X F E -C 29 0A 47 -41,-2.2 -41,-2.8 -2,-0.3 2,-0.4 -0.993 24.7-163.1-126.8 119.6 28.4 0.5 12.6 71 71 X E E +C 28 0A 115 -2,-0.4 2,-0.3 -43,-0.2 -43,-0.2 -0.919 15.7 162.4-105.9 137.3 28.9 -2.8 10.9 72 72 X V E -C 27 0A 11 -45,-2.4 -45,-2.0 -2,-0.4 2,-0.4 -0.998 24.0-154.8-150.2 146.2 26.2 -5.3 10.0 73 73 X A E -C 26 0A 50 -2,-0.3 2,-0.3 -47,-0.2 -47,-0.1 -0.966 17.0-150.2-117.1 136.2 25.7 -8.2 7.7 74 74 X L + 0 0 2 -49,-0.6 -50,-3.2 -2,-0.4 -49,-0.3 -0.778 16.4 177.5 -99.5 147.8 22.3 -9.1 6.5 75 75 X S + 0 0 70 -2,-0.3 -1,-0.1 -52,-0.2 2,-0.1 0.710 51.2 81.8-118.4 -43.9 21.2 -12.6 5.7 76 76 X N S S- 0 0 77 1,-0.1 22,-0.2 -29,-0.1 2,-0.1 -0.376 79.6-115.6 -72.3 138.7 17.6 -12.8 4.7 77 77 X K + 0 0 129 -2,-0.1 2,-0.2 20,-0.1 22,-0.2 -0.390 68.2 60.4 -70.3 151.5 16.8 -12.0 1.2 78 78 X G E S- F 0 98B 26 20,-2.4 20,-2.9 -31,-0.1 2,-0.4 -0.767 85.3 -39.0 128.3-172.4 14.6 -9.0 0.3 79 79 X E E - F 0 97B 109 -2,-0.2 2,-0.5 18,-0.2 18,-0.2 -0.686 42.9-168.9 -94.0 137.4 14.4 -5.2 0.7 80 80 X Y E - F 0 96B 3 16,-2.7 16,-2.5 -2,-0.4 2,-0.4 -0.962 5.4-159.2-126.5 115.8 15.5 -3.4 3.8 81 81 X S E + F 0 95B 32 -36,-2.0 -39,-2.5 -2,-0.5 2,-0.3 -0.760 19.3 172.5 -92.3 140.5 14.6 0.3 4.3 82 82 X F E -EF 41 94B 4 12,-2.4 12,-2.6 -2,-0.4 2,-0.3 -0.896 10.2-176.4-143.3 168.4 16.7 2.2 6.8 83 83 X Y E -EF 40 93B 27 -43,-2.3 -43,-2.9 -2,-0.3 2,-0.6 -0.984 34.2-109.1-158.2 162.0 17.2 5.8 8.0 84 84 X C >> - 0 0 0 8,-2.5 3,-0.7 -2,-0.3 4,-0.5 -0.931 34.9-143.1 -96.2 118.7 19.3 8.0 10.3 85 85 X S G >4 S+ 0 0 27 -2,-0.6 3,-1.1 1,-0.2 4,-0.3 0.923 93.4 43.2 -58.6 -49.0 16.9 9.0 13.1 86 86 X P G 34 S+ 0 0 73 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 0.745 125.5 36.4 -69.4 -16.8 17.9 12.6 13.8 87 87 X H G <>>S+ 0 0 35 -3,-0.7 5,-2.1 5,-0.2 4,-0.5 0.194 80.8 111.0-118.4 15.1 18.1 13.3 10.0 88 88 X Q T X<5S+ 0 0 86 -3,-1.1 3,-1.8 -4,-0.5 -1,-0.1 0.933 80.2 47.0 -62.5 -49.1 15.3 11.3 8.6 89 89 X G T 345S+ 0 0 85 -4,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.827 104.4 62.4 -63.4 -28.0 13.1 14.2 7.5 90 90 X A T 345S- 0 0 75 -3,-0.2 -1,-0.3 -4,-0.1 -2,-0.2 0.605 128.6 -98.3 -67.3 -13.6 16.1 15.9 5.9 91 91 X G T <<5S+ 0 0 43 -3,-1.8 2,-1.9 -4,-0.5 -3,-0.2 0.544 73.8 146.8 109.7 7.6 16.2 12.9 3.6 92 92 X M < + 0 0 0 -5,-2.1 -8,-2.5 -8,-0.2 2,-0.3 -0.564 37.9 117.1 -83.4 82.8 18.9 10.7 5.2 93 93 X V E + F 0 83B 66 -2,-1.9 -79,-0.5 -10,-0.2 2,-0.3 -0.889 35.6 175.6-139.2 165.7 17.4 7.4 4.3 94 94 X G E - F 0 82B 9 -12,-2.6 -12,-2.4 -2,-0.3 2,-0.3 -0.967 20.1-136.1-163.7 177.3 18.3 4.4 2.1 95 95 X K E -dF 18 81B 60 -78,-2.5 -76,-1.6 -2,-0.3 2,-0.4 -0.948 11.6-165.5-149.1 126.7 17.3 0.9 1.0 96 96 X V E -dF 19 80B 0 -16,-2.5 -16,-2.7 -2,-0.3 2,-0.5 -0.943 8.7-153.4-113.1 135.9 19.4 -2.2 0.7 97 97 X T E -dF 20 79B 35 -78,-2.2 -76,-2.5 -2,-0.4 2,-0.6 -0.936 2.6-154.7-109.2 126.9 18.3 -5.2 -1.3 98 98 X V E dF 21 78B 2 -20,-2.9 -20,-2.4 -2,-0.5 -76,-0.2 -0.896 360.0 360.0 -97.7 118.9 19.7 -8.7 -0.4 99 99 X N 0 0 119 -78,-2.6 -2,-0.0 -2,-0.6 -79,-0.0 -0.785 360.0 360.0-118.3 360.0 19.5 -11.0 -3.3