==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 30-JUL-02 1M9W . COMPND 2 MOLECULE: PLASTOCYANIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; . AUTHOR D.MONLEON,B.CELDA . 98 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4731.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 56 57.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 19.4 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 . 7 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 10.2 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 . 1 1 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 PARALLEL BRIDGES PER LADDER . 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 A 0 0 89 0, 0.0 21,-0.1 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 129.6 2.4 -2.9 -15.5 2 2 A N - 0 0 100 22,-0.1 27,-0.2 1,-0.1 2,-0.2 0.616 360.0-170.1 13.5 96.5 2.7 -5.4 -12.6 3 3 A A B -a 29 0A 15 25,-3.1 27,-2.3 18,-0.0 2,-0.3 -0.552 16.9-168.9-106.8 167.4 4.1 -3.4 -9.5 4 4 A T - 0 0 70 25,-0.3 2,-0.3 -2,-0.2 27,-0.2 -0.931 9.0-166.0-146.4 155.7 5.5 -4.3 -6.1 5 5 A V - 0 0 2 -2,-0.3 27,-2.6 25,-0.0 2,-0.5 -0.992 17.5-129.8-152.7 153.6 6.3 -2.0 -3.1 6 6 A K E -Cd 17 32B 66 11,-2.5 11,-2.7 -2,-0.3 2,-0.5 -0.945 16.2-144.1-112.8 120.4 8.2 -2.2 0.2 7 7 A M E S+Cd 16 33B 0 25,-3.3 27,-2.8 -2,-0.5 28,-2.0 -0.758 83.3 31.2 -80.3 119.9 6.4 -1.0 3.4 8 8 A G S S- 0 0 0 7,-1.3 6,-0.2 -2,-0.5 8,-0.2 0.736 96.2-113.7 89.3 97.7 9.0 0.7 5.6 9 9 A S > - 0 0 22 4,-2.4 3,-2.6 6,-0.5 4,-0.2 -0.161 25.7-105.5 -59.5 155.9 11.8 2.4 3.5 10 10 A D T 3 S+ 0 0 101 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 0.712 121.5 61.1 -57.5 -17.9 15.4 1.1 3.6 11 11 A S T 3 S- 0 0 112 2,-0.1 -1,-0.3 24,-0.0 -2,-0.1 0.409 122.9-105.2 -85.0 -3.7 16.3 4.2 5.8 12 12 A G S < S+ 0 0 23 -3,-2.6 2,-0.4 1,-0.3 -2,-0.1 0.602 73.6 145.9 85.2 14.6 13.8 3.0 8.5 13 13 A A - 0 0 43 -4,-0.2 2,-2.6 1,-0.1 -4,-2.4 -0.710 60.8-115.8 -86.3 136.4 11.2 5.7 7.5 14 14 A L S S+ 0 0 46 -2,-0.4 2,-0.3 -6,-0.2 69,-0.1 -0.365 79.5 106.9 -68.2 65.3 7.5 4.8 7.8 15 15 A V - 0 0 41 -2,-2.6 -7,-1.3 76,-0.1 -6,-0.5 -0.988 68.0-120.7-145.8 148.5 6.8 5.1 4.1 16 16 A F E -C 7 0B 0 -2,-0.3 -9,-0.3 -9,-0.2 -7,-0.1 -0.760 34.0-113.3 -92.9 136.0 6.2 2.7 1.3 17 17 A E E S+C 6 0B 53 -11,-2.7 -11,-2.5 1,-0.4 2,-0.0 -0.964 110.9 27.0-117.9 111.0 8.6 2.6 -1.7 18 18 A P S S+ 0 0 57 0, 0.0 -1,-0.4 0, 0.0 3,-0.1 0.450 77.8 177.8 -78.2 142.9 7.2 3.5 -4.2 19 19 A S S S+ 0 0 43 1,-0.2 75,-1.3 74,-0.1 2,-0.3 0.345 78.8 33.2 -87.8 -3.9 4.7 5.7 -2.2 20 20 A T E S+f 94 0C 96 73,-0.2 2,-0.3 -4,-0.0 75,-0.2 -0.922 79.1 169.1-152.0 129.3 3.2 6.8 -5.6 21 21 A V E -f 95 0C 33 73,-1.0 75,-1.3 -2,-0.3 2,-0.4 -0.963 27.0-139.9-148.3 164.8 3.0 4.6 -8.8 22 22 A T E +f 96 0C 100 -2,-0.3 2,-0.2 73,-0.2 75,-0.2 -0.975 31.5 146.9-136.0 113.2 1.5 4.2 -12.3 23 23 A I E -f 97 0C 4 73,-2.3 75,-1.4 -2,-0.4 2,-0.4 -0.737 42.7-106.4-126.1 176.0 0.1 0.9 -13.7 24 24 A K > - 0 0 90 73,-0.3 3,-1.5 -2,-0.2 74,-0.3 -0.961 52.4 -61.3-125.9 141.4 -2.8 0.4 -16.2 25 25 A A T 3 S+ 0 0 27 72,-1.2 49,-0.3 -2,-0.4 73,-0.1 0.364 124.3 16.5 -11.6 99.7 -6.3 -0.9 -15.8 26 26 A G T 3 S+ 0 0 41 47,-2.4 -1,-0.3 1,-0.4 48,-0.2 0.208 97.2 117.3 111.3 -12.9 -6.2 -4.5 -14.5 27 27 A E < - 0 0 42 -3,-1.5 46,-2.0 46,-0.4 -1,-0.4 -0.270 53.0-130.9 -77.4 173.1 -2.5 -4.5 -13.4 28 28 A E E - B 0 72A 22 44,-0.2 -25,-3.1 -3,-0.1 2,-0.3 -0.675 14.8-145.4-124.8 176.0 -1.4 -5.1 -9.8 29 29 A V E -aB 3 71A 0 42,-3.3 42,-2.6 -2,-0.2 2,-0.4 -0.931 14.5-169.0-141.7 108.7 0.7 -3.9 -6.8 30 30 A K - 0 0 58 -27,-2.3 40,-0.2 -2,-0.3 -26,-0.1 -0.366 18.2-169.2-104.8 52.5 2.1 -6.8 -4.6 31 31 A W - 0 0 1 -2,-0.4 38,-2.1 -27,-0.2 2,-0.3 0.011 4.0-161.8 -49.5 142.8 3.5 -4.9 -1.6 32 32 A V E -dE 6 68B 45 -27,-2.6 -25,-3.3 36,-0.2 2,-0.4 -0.873 24.1-105.9-126.6 152.8 5.6 -6.4 1.2 33 33 A N E +d 7 0B 3 34,-2.9 33,-1.9 -2,-0.3 -25,-0.1 -0.682 47.9 147.4 -80.1 122.5 6.7 -5.6 4.8 34 34 A N + 0 0 40 -27,-2.8 2,-0.3 -2,-0.4 -26,-0.3 0.615 49.9 34.1-136.3 -29.9 10.4 -4.4 5.1 35 35 A K S S- 0 0 63 -28,-2.0 -1,-0.3 1,-0.1 -26,-0.1 -0.992 101.0 -6.6-154.7 157.4 10.7 -1.8 8.0 36 36 A L S S- 0 0 105 -2,-0.3 -1,-0.1 1,-0.1 -28,-0.1 0.781 94.4-117.8 38.2 51.3 9.9 -0.4 11.4 37 37 A S S S+ 0 0 51 26,-0.1 2,-0.2 -30,-0.1 26,-0.2 -0.011 82.4 65.1 -48.9 151.4 7.1 -2.9 11.8 38 38 A P + 0 0 52 0, 0.0 2,-0.3 0, 0.0 25,-0.2 0.493 62.9 168.4 -73.6 176.5 4.2 -3.2 12.2 39 39 A H B -I 62 0D 0 23,-2.1 23,-3.2 -2,-0.2 2,-0.3 -0.940 13.1-168.3-147.6 157.0 2.7 -1.9 8.9 40 40 A N - 0 0 3 -2,-0.3 2,-0.3 21,-0.2 21,-0.1 -0.945 13.8-145.3-147.3 161.8 -0.8 -1.9 7.2 41 41 A I + 0 0 0 -2,-0.3 15,-3.5 16,-0.3 2,-0.5 -0.807 25.6 162.6-138.1 98.6 -2.4 -1.1 3.8 42 42 A V E -G 82 0C 0 40,-3.1 40,-1.7 -2,-0.3 2,-0.1 -0.961 23.1-148.2-120.5 122.2 -5.9 0.5 3.6 43 43 A F E -G 81 0C 2 -2,-0.5 38,-0.3 8,-0.3 12,-0.1 -0.408 14.2-132.2 -82.0 162.0 -7.3 2.2 0.5 44 44 A A - 0 0 57 36,-2.7 37,-0.1 -2,-0.1 -1,-0.1 0.604 34.9-119.4 -90.3 -14.1 -9.8 5.1 0.6 45 45 A A - 0 0 49 35,-0.4 36,-0.1 1,-0.0 34,-0.0 0.847 38.7-178.0 72.7 39.7 -12.4 3.9 -2.0 46 46 A D - 0 0 69 34,-0.2 32,-0.1 2,-0.1 -1,-0.0 0.610 62.2 -15.1 -44.3 -24.3 -11.8 7.0 -4.3 47 47 A G S S- 0 0 56 2,-0.3 30,-0.0 30,-0.1 32,-0.0 0.224 108.7 -43.4-144.0-100.4 -14.5 6.0 -7.0 48 48 A V S S+ 0 0 132 2,-0.0 2,-0.1 27,-0.0 -2,-0.1 0.427 92.2 109.3-126.7 -9.8 -16.4 2.8 -7.8 49 49 A D S S- 0 0 40 1,-0.1 2,-2.0 26,-0.1 -2,-0.3 -0.370 80.8-107.0 -70.3 152.1 -13.7 0.2 -7.6 50 50 A A > + 0 0 46 1,-0.2 3,-2.1 -2,-0.1 4,-0.2 -0.510 40.6 172.4 -78.5 76.4 -13.7 -2.3 -4.7 51 51 A D G >> S+ 0 0 15 -2,-2.0 3,-2.4 1,-0.3 4,-0.6 0.852 75.7 74.7 -53.0 -29.3 -10.8 -0.9 -2.7 52 52 A T G 34 S+ 0 0 112 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.345 99.7 42.4 -63.4 1.5 -12.1 -3.5 -0.1 53 53 A A G <4 S+ 0 0 77 -3,-2.1 19,-0.4 19,-0.1 -1,-0.3 0.156 115.9 48.4-129.5 4.2 -10.5 -6.2 -2.5 54 54 A A T <4 S+ 0 0 1 -3,-2.4 2,-0.3 -4,-0.2 -2,-0.2 0.153 106.4 61.9-133.1 10.0 -7.2 -4.2 -3.1 55 55 A K S < S- 0 0 39 -4,-0.6 -13,-0.2 1,-0.1 15,-0.1 -0.881 78.2-123.1-132.7 162.9 -6.4 -3.2 0.6 56 56 A L - 0 0 54 -15,-3.5 2,-0.2 -2,-0.3 -14,-0.2 0.992 59.6 -96.2 -67.9 -68.7 -5.5 -5.2 3.8 57 57 A S > - 0 0 58 -16,-0.3 3,-0.5 3,-0.2 -16,-0.3 -0.573 30.0 -89.9 150.7 154.4 -8.3 -4.0 6.2 58 58 A H T 3 S+ 0 0 70 1,-0.3 -16,-0.1 -2,-0.2 3,-0.0 0.207 134.9 31.8 -69.8 15.1 -8.5 -1.2 8.9 59 59 A K T 3 S+ 0 0 179 25,-0.0 -1,-0.3 2,-0.0 -17,-0.0 0.343 92.0 112.1-145.0 -18.0 -7.3 -4.1 11.2 60 60 A G < - 0 0 19 -3,-0.5 2,-0.3 -19,-0.1 -3,-0.2 -0.307 51.8-159.6 -61.5 154.7 -5.1 -6.3 8.9 61 61 A L - 0 0 91 -21,-0.1 2,-0.6 -5,-0.1 -21,-0.2 -0.992 32.3-160.5-150.7 143.3 -1.4 -6.2 9.8 62 62 A A B +I 39 0D 4 -23,-3.2 -23,-2.1 -2,-0.3 3,-0.1 -0.968 31.9 152.0-114.2 108.7 2.1 -6.8 8.6 63 63 A F + 0 0 134 -2,-0.6 2,-0.4 -25,-0.2 -1,-0.1 0.676 52.3 64.6-112.9 -26.2 4.3 -7.3 11.7 64 64 A A S > S- 0 0 39 1,-0.0 3,-2.6 -27,-0.0 -31,-0.2 -0.860 93.9 -99.1-108.1 135.3 7.2 -9.6 10.6 65 65 A A T 3 S+ 0 0 87 -2,-0.4 -31,-0.2 1,-0.3 -1,-0.0 -0.294 111.7 25.7 -53.7 114.0 9.8 -8.6 7.9 66 66 A G T 3 S+ 0 0 50 -33,-1.9 -1,-0.3 1,-0.3 -32,-0.1 0.222 85.4 133.8 111.4 -11.6 8.7 -10.2 4.6 67 67 A E < - 0 0 68 -3,-2.6 -34,-2.9 -35,-0.1 -1,-0.3 -0.235 35.0-176.4 -62.2 162.9 4.9 -10.4 5.3 68 68 A S B -E 32 0B 72 -36,-0.2 2,-0.3 -7,-0.1 -36,-0.2 -0.993 31.6-162.3-161.3 162.5 2.7 -9.2 2.4 69 69 A F - 0 0 20 -38,-2.1 2,-0.3 -2,-0.3 -13,-0.1 -0.978 23.9-142.9-142.3 146.2 -0.7 -8.4 1.0 70 70 A T - 0 0 84 -2,-0.3 2,-0.3 -40,-0.2 -40,-0.2 -0.881 10.4-164.9-118.9 149.7 -1.4 -8.0 -2.8 71 71 A S E -B 29 0A 1 -42,-2.6 -42,-3.3 -2,-0.3 2,-0.3 -0.987 5.1-174.0-134.1 142.0 -3.7 -5.6 -4.7 72 72 A T E +B 28 0A 85 -19,-0.4 2,-0.3 -2,-0.3 -44,-0.2 -0.997 14.4 177.6-139.8 124.5 -5.0 -5.6 -8.3 73 73 A F + 0 0 3 -46,-2.0 -47,-2.4 -2,-0.3 -46,-0.4 -0.994 24.4 174.4-143.7 146.3 -7.2 -2.8 -9.8 74 74 A T + 0 0 79 -49,-0.3 -49,-0.1 -2,-0.3 -1,-0.1 0.192 43.1 113.3-131.7 15.3 -8.9 -1.6 -13.0 75 75 A E S S- 0 0 43 2,-0.1 22,-0.3 23,-0.0 -26,-0.1 -0.840 72.7-119.0 -94.3 109.0 -11.0 1.6 -12.6 76 76 A P S S+ 0 0 100 0, 0.0 2,-0.2 0, 0.0 22,-0.1 -0.299 80.2 64.5 -52.5 119.3 -9.1 4.2 -14.7 77 77 A G S S- 0 0 27 2,-0.0 20,-2.3 -30,-0.0 2,-0.4 -0.790 88.7 -73.6 147.6-178.9 -8.2 6.9 -12.2 78 78 A T E - H 0 96C 57 18,-0.2 2,-0.4 -2,-0.2 18,-0.3 -0.907 38.5-158.0-112.2 131.5 -6.0 7.2 -9.1 79 79 A Y E - H 0 95C 4 16,-1.4 16,-3.2 -2,-0.4 2,-0.2 -0.883 8.5-135.9-121.9 137.2 -6.7 5.8 -5.7 80 80 A T E + H 0 94C 37 -2,-0.4 -36,-2.7 14,-0.3 -35,-0.4 -0.582 25.3 165.5 -84.3 148.3 -5.5 6.7 -2.3 81 81 A Y E +GH 43 93C 2 12,-2.0 12,-2.8 -38,-0.3 2,-0.3 -0.942 4.9 174.6-155.5 168.6 -4.3 4.4 0.5 82 82 A Y E -GH 42 92C 35 -40,-1.7 -40,-3.1 -2,-0.3 2,-0.6 -0.964 37.4 -96.0-167.6 172.7 -2.4 4.6 3.8 83 83 A C >> - 0 0 0 8,-2.8 3,-2.1 -2,-0.3 4,-1.7 -0.935 31.4-141.0-105.9 114.7 -1.2 2.7 6.9 84 84 A E G >4 S+ 0 0 46 -2,-0.6 3,-0.7 1,-0.3 4,-0.3 0.861 98.5 41.5 -41.4 -61.5 -3.6 3.1 9.9 85 85 A P G 34 S+ 0 0 79 0, 0.0 -1,-0.3 0, 0.0 -46,-0.0 0.428 125.7 37.3 -71.4 -0.8 -1.0 3.3 12.8 86 86 A H G X>>S+ 0 0 32 -3,-2.1 5,-2.0 5,-0.2 3,-1.9 0.438 81.1 106.1-129.5 -3.7 1.3 5.6 10.7 87 87 A R G X<5S+ 0 0 113 -4,-1.7 3,-1.8 -3,-0.7 5,-0.1 0.882 85.4 46.4 -39.4 -59.5 -1.2 7.8 8.7 88 88 A G G 345S+ 0 0 90 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.524 110.8 54.3 -66.4 -13.1 -0.5 10.9 10.9 89 89 A A G <45S- 0 0 77 -3,-1.9 -1,-0.3 -75,-0.1 -2,-0.2 0.357 129.2 -91.8 -99.5 -6.1 3.3 10.3 10.5 90 90 A G T <<5S+ 0 0 38 -3,-1.8 2,-2.2 -4,-0.5 -3,-0.2 0.480 79.4 138.2 107.4 5.9 3.1 10.2 6.7 91 91 A M < + 0 0 1 -5,-2.0 -8,-2.8 -8,-0.2 2,-0.3 -0.366 47.6 111.8 -81.3 62.5 2.6 6.5 5.8 92 92 A V E + H 0 82C 68 -2,-2.2 -10,-0.3 -10,-0.3 2,-0.3 -0.932 38.1 157.0-132.6 149.3 0.0 7.6 3.1 93 93 A G E - H 0 81C 12 -12,-2.8 -12,-2.0 -2,-0.3 2,-0.3 -0.936 31.5-117.0-160.5-178.4 0.2 7.5 -0.7 94 94 A K E -fH 20 80C 69 -75,-1.3 -73,-1.0 -2,-0.3 -14,-0.3 -0.968 17.1-161.5-144.7 124.3 -1.6 7.4 -4.1 95 95 A V E -fH 21 79C 0 -16,-3.2 -16,-1.4 -2,-0.3 2,-0.4 -0.651 8.1-150.7 -95.8 153.7 -1.8 4.7 -6.9 96 96 A V E -fH 22 78C 29 -75,-1.3 -73,-2.3 -18,-0.3 -18,-0.2 -0.992 5.9-166.7-130.5 134.6 -2.8 5.3 -10.5 97 97 A V E f 23 0C 0 -20,-2.3 -72,-1.2 -2,-0.4 -73,-0.3 -0.326 360.0 360.0-127.9 65.0 -4.4 2.6 -12.8 98 98 A E 0 0 121 -75,-1.4 -75,-0.0 -74,-0.3 -23,-0.0 -0.976 360.0 360.0-168.5 360.0 -4.4 3.6 -16.5