==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PHOTOSYNTHESIS 03-APR-10 2XB3 . COMPND 2 MOLECULE: PSBP PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOSYNECHOCOCCUS ELONGATUS; . AUTHOR F.MICHOUX,K.TAKASAKA,P.NIXON,J.W.MURRAY . 155 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8302.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 110 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 64 41.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.9 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 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.6 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 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 1 0 1 1 1 0 2 0 1 1 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 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 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 24 A S 0 0 155 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -67.9 -7.1 10.8 -3.4 2 25 A G + 0 0 41 2,-0.1 17,-2.3 17,-0.0 2,-0.2 -0.195 360.0 114.5-100.0 35.5 -8.8 11.6 -0.0 3 26 A L E -A 18 0A 18 15,-0.2 2,-0.3 17,-0.0 13,-0.0 -0.672 53.3-153.9-111.1 167.7 -11.8 9.7 -1.6 4 27 A Q E -A 17 0A 64 13,-2.2 13,-2.1 -2,-0.2 2,-0.3 -0.945 22.7-106.8-149.8 140.3 -13.3 6.4 -0.6 5 28 A A E -A 16 0A 66 -2,-0.3 2,-0.5 11,-0.2 11,-0.2 -0.566 19.6-169.9 -87.1 138.5 -15.3 3.9 -2.6 6 29 A Y E -A 15 0A 47 9,-2.9 9,-2.1 -2,-0.3 2,-0.5 -0.982 15.1-178.8-115.9 118.3 -19.0 3.2 -2.6 7 30 A V E -A 14 0A 77 -2,-0.5 2,-0.6 7,-0.2 7,-0.2 -0.978 9.3-175.2-121.4 123.2 -19.7 0.0 -4.6 8 31 A D E >> +A 13 0A 14 5,-2.9 4,-2.4 -2,-0.5 5,-1.7 -0.799 11.8 168.3-122.7 84.6 -23.2 -1.1 -5.0 9 32 A S T 45S+ 0 0 105 -2,-0.6 -1,-0.1 1,-0.2 5,-0.1 0.603 76.5 64.3 -77.9 -8.7 -23.3 -4.4 -6.8 10 33 A Y T 45S+ 0 0 212 3,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.944 117.9 25.0 -66.4 -47.5 -27.0 -4.9 -5.9 11 34 A D T 45S- 0 0 38 -3,-0.2 -2,-0.2 2,-0.2 -1,-0.1 0.624 113.9-115.2-102.1 -20.9 -27.9 -1.8 -7.9 12 35 A G T <5S+ 0 0 2 -4,-2.4 144,-1.9 1,-0.3 2,-0.3 0.883 71.2 87.0 97.6 48.3 -25.1 -1.9 -10.3 13 36 A Y E < -AB 8 155A 0 -5,-1.7 -5,-2.9 142,-0.2 2,-0.3 -0.985 44.4-159.3-162.3 161.7 -22.9 1.2 -9.9 14 37 A E E +AB 7 154A 71 140,-2.1 140,-2.3 -2,-0.3 2,-0.3 -0.970 8.7 173.5-142.8 161.2 -20.0 2.7 -8.0 15 38 A F E -A 6 0A 3 -9,-2.1 -9,-2.9 -2,-0.3 2,-0.3 -0.957 27.8-122.2-153.7 164.6 -18.5 6.1 -7.1 16 39 A L E +A 5 0A 65 133,-0.4 -11,-0.2 -2,-0.3 136,-0.1 -0.847 33.3 176.4-101.8 149.6 -15.8 7.6 -5.0 17 40 A Y E -A 4 0A 16 -13,-2.1 -13,-2.2 -2,-0.3 3,-0.1 -0.976 37.8 -71.1-149.5 163.0 -16.7 10.2 -2.4 18 41 A P E > -A 3 0A 7 0, 0.0 3,-1.3 0, 0.0 -15,-0.2 -0.175 49.2-109.5 -65.9 148.0 -14.9 12.1 0.2 19 42 A R T 3 S+ 0 0 156 -17,-2.3 3,-0.1 1,-0.3 -17,-0.0 -0.491 102.9 34.4 -77.9 134.7 -13.6 10.4 3.2 20 43 A G T 3 S+ 0 0 43 1,-0.4 17,-0.9 -2,-0.2 2,-0.3 0.546 84.9 124.3 90.9 6.2 -15.4 11.4 6.4 21 44 A W E < -C 36 0B 13 -3,-1.3 -1,-0.4 15,-0.2 2,-0.3 -0.715 47.4-151.4 -88.7 152.8 -18.8 11.7 4.7 22 45 A V E -C 35 0B 65 13,-2.4 13,-2.5 -2,-0.3 2,-0.3 -0.908 14.6-104.0-130.8 155.1 -21.6 9.6 6.2 23 46 A Q E -C 34 0B 76 -2,-0.3 2,-0.4 11,-0.2 11,-0.3 -0.562 21.4-159.1 -84.2 137.2 -24.7 8.1 4.8 24 47 A V E -C 33 0B 50 9,-2.0 9,-0.7 -2,-0.3 2,-0.7 -0.930 21.4-129.6-110.1 140.0 -28.2 9.4 5.3 25 48 A Q + 0 0 157 -2,-0.4 2,-0.2 7,-0.1 7,-0.1 -0.784 40.1 165.4 -96.0 116.3 -31.0 6.9 4.8 26 49 A V - 0 0 65 -2,-0.7 2,-0.2 5,-0.2 7,-0.0 -0.751 32.2 -91.1-128.4 176.0 -33.7 8.3 2.5 27 50 A E > - 0 0 167 -2,-0.2 3,-1.6 1,-0.1 -1,-0.0 -0.471 56.7 -45.1 -96.0 159.0 -36.7 7.2 0.4 28 51 A D T 3 S+ 0 0 140 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 -0.140 113.1 33.0 -55.3 153.1 -37.0 6.1 -3.2 29 52 A P T 3 S+ 0 0 59 0, 0.0 19,-2.4 0, 0.0 2,-0.4 -0.977 107.5 81.3 -83.2 9.2 -36.2 6.8 -5.9 30 53 A V E < - D 0 47B 37 -3,-1.6 17,-0.3 17,-0.2 -4,-0.1 -0.624 54.8-175.7 -80.4 126.9 -33.0 8.0 -4.2 31 54 A D E + 0 0 42 15,-3.2 2,-0.4 -2,-0.4 -5,-0.2 0.896 64.1 7.6 -94.0 -50.4 -30.7 5.0 -3.5 32 55 A V E - D 0 46B 3 14,-1.1 14,-2.3 -7,-0.1 2,-0.4 -0.995 54.4-176.9-133.2 143.3 -27.8 6.5 -1.5 33 56 A V E +CD 24 45B 23 -9,-0.7 -9,-2.0 -2,-0.4 2,-0.3 -0.981 6.8 178.5-126.1 137.1 -27.1 9.9 0.0 34 57 A F E +CD 23 44B 8 10,-2.0 10,-2.2 -2,-0.4 2,-0.3 -0.977 9.3 177.4-129.2 142.7 -23.8 10.7 1.7 35 58 A H E -CD 22 43B 43 -13,-2.5 -13,-2.4 -2,-0.3 2,-0.3 -0.914 35.5 -84.9-142.0 168.9 -23.1 14.1 3.2 36 59 A D E -C 21 0B 25 6,-1.9 -15,-0.2 3,-0.7 6,-0.1 -0.574 29.0-134.8 -78.4 136.1 -20.4 15.9 5.1 37 60 A I S S+ 0 0 110 -17,-0.9 3,-0.3 -2,-0.3 -1,-0.1 0.898 105.0 25.9 -49.0 -49.2 -20.5 15.6 8.8 38 61 A I S S+ 0 0 148 1,-0.2 2,-1.2 2,-0.1 -1,-0.1 0.952 129.6 39.2 -83.9 -57.2 -19.9 19.4 9.3 39 62 A E > + 0 0 57 1,-0.2 3,-2.2 3,-0.1 -3,-0.7 -0.612 67.9 176.2 -94.8 72.4 -21.3 20.9 6.1 40 63 A T T 3 S+ 0 0 76 -2,-1.2 -1,-0.2 -3,-0.3 -3,-0.1 0.672 73.8 70.8 -63.3 -12.0 -24.3 18.6 5.8 41 64 A T T 3 S+ 0 0 46 -3,-0.1 2,-0.5 -6,-0.1 -1,-0.3 0.868 81.2 79.8 -60.2 -46.6 -25.3 20.8 2.8 42 65 A E S < S+ 0 0 11 -3,-2.2 -6,-1.9 -6,-0.1 2,-0.3 -0.600 70.1 145.9 -69.9 117.3 -22.4 19.3 0.8 43 66 A N E -DE 35 133B 36 90,-1.7 90,-2.1 -2,-0.5 2,-0.3 -0.973 43.2-143.3-149.5 164.1 -23.5 15.9 -0.5 44 67 A V E +DE 34 132B 0 -10,-2.2 -10,-2.0 -2,-0.3 2,-0.3 -0.926 26.2 177.3-123.0 150.9 -23.5 13.2 -3.2 45 68 A S E -DE 33 131B 18 86,-2.2 86,-2.0 -2,-0.3 2,-0.5 -0.988 20.8-145.6-155.8 144.6 -26.5 11.1 -4.1 46 69 A V E -DE 32 130B 0 -14,-2.3 -15,-3.2 -2,-0.3 -14,-1.1 -0.967 12.9-165.4-118.2 126.9 -27.6 8.4 -6.6 47 70 A V E -DE 30 129B 23 82,-2.5 82,-2.3 -2,-0.5 2,-0.4 -0.860 2.7-165.6-104.8 139.8 -31.1 8.2 -8.0 48 71 A V E + E 0 128B 22 -19,-2.4 2,-0.3 -2,-0.4 80,-0.2 -0.989 13.2 165.6-128.9 123.5 -32.4 5.1 -9.8 49 72 A N E - E 0 127B 74 78,-1.9 78,-2.3 -2,-0.4 2,-0.2 -0.881 28.3-122.8-123.8 163.6 -35.6 5.0 -12.0 50 73 A T E - E 0 126B 116 -2,-0.3 76,-0.3 76,-0.3 2,-0.3 -0.595 21.0-162.5-102.3 165.9 -36.8 2.3 -14.5 51 74 A V - 0 0 48 74,-2.6 2,-1.2 -2,-0.2 3,-0.1 -0.941 25.2-114.6-155.4 138.1 -37.7 2.6 -18.3 52 75 A A S S- 0 0 91 -2,-0.3 3,-0.1 1,-0.2 74,-0.0 -0.472 89.9 -39.6 -74.4 94.6 -39.6 0.6 -21.0 53 76 A S S S+ 0 0 115 -2,-1.2 2,-1.6 1,-0.3 -1,-0.2 0.448 86.3 147.0 69.4 3.5 -37.1 -0.5 -23.7 54 77 A T + 0 0 25 1,-0.2 71,-0.3 -3,-0.1 -1,-0.3 -0.604 20.2 174.9 -64.0 92.1 -35.1 2.8 -23.6 55 78 A K + 0 0 82 -2,-1.6 2,-0.3 -3,-0.1 -1,-0.2 0.828 55.2 37.9 -71.8 -32.0 -31.9 0.9 -24.3 56 79 A S - 0 0 35 -3,-0.2 3,-0.2 1,-0.1 4,-0.1 -0.808 65.0-134.9-131.4 156.1 -29.8 4.1 -24.5 57 80 A L S > S+ 0 0 4 -2,-0.3 3,-1.0 65,-0.2 4,-0.5 0.744 104.3 65.2 -78.6 -27.4 -29.3 7.6 -23.1 58 81 A E G > S+ 0 0 99 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.789 94.0 59.5 -67.1 -27.9 -29.0 9.1 -26.5 59 82 A E G 3 S+ 0 0 114 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.2 0.569 94.8 63.6 -81.3 -7.4 -32.6 8.2 -27.3 60 83 A L G < S- 0 0 36 -3,-1.0 2,-0.2 1,-0.4 -1,-0.2 0.661 121.3 -97.0 -79.1 -19.5 -33.8 10.4 -24.3 61 84 A G < - 0 0 13 -3,-0.7 -1,-0.4 -4,-0.5 0, 0.0 -0.777 53.3 -41.2 133.8-175.4 -32.3 13.3 -26.2 62 85 A S > - 0 0 46 -2,-0.2 4,-2.5 -3,-0.1 5,-0.2 -0.335 65.5-100.0 -74.2 166.8 -29.2 15.4 -26.3 63 86 A P H > S+ 0 0 26 0, 0.0 4,-3.1 0, 0.0 27,-0.2 0.883 124.0 50.4 -61.3 -38.9 -27.5 16.3 -23.1 64 87 A E H > S+ 0 0 100 25,-0.2 4,-2.7 2,-0.2 5,-0.2 0.919 111.0 48.9 -60.5 -45.8 -29.0 19.9 -23.1 65 88 A E H > S+ 0 0 114 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.892 114.1 46.1 -62.3 -41.0 -32.5 18.4 -23.7 66 89 A V H X S+ 0 0 7 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.914 111.3 52.9 -64.4 -45.9 -32.0 15.9 -20.9 67 90 A G H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 5,-0.3 0.950 106.3 52.6 -51.0 -51.0 -30.7 18.7 -18.7 68 91 A D H X S+ 0 0 76 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.872 113.1 45.5 -56.0 -38.6 -33.7 20.8 -19.3 69 92 A R H X>S+ 0 0 107 -4,-1.5 4,-2.9 2,-0.2 5,-0.5 0.894 107.0 55.0 -77.9 -43.5 -35.9 17.9 -18.3 70 93 A L H X>S+ 0 0 19 -4,-2.9 5,-2.2 2,-0.2 4,-2.0 0.920 116.7 39.7 -48.6 -46.8 -34.0 16.9 -15.2 71 94 A L H <>S+ 0 0 9 -4,-2.3 5,-1.8 -5,-0.2 -2,-0.2 0.907 115.9 50.3 -75.2 -40.3 -34.5 20.5 -13.9 72 95 A R H <5S+ 0 0 203 -4,-2.3 6,-0.4 -5,-0.3 -2,-0.2 0.928 128.0 20.2 -57.1 -49.4 -38.0 20.9 -15.2 73 96 A N H <5S+ 0 0 97 -4,-2.9 -3,-0.2 4,-0.2 -2,-0.2 0.814 134.4 16.6 -98.3 -39.0 -39.3 17.6 -13.6 74 97 A I T < - 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0 0 85 16,-2.5 2,-0.3 -2,-0.6 17,-0.2 0.924 61.3 -9.7 -90.3 -54.6 -25.0 26.0 -16.8 88 111 A A E -F 103 0B 44 15,-1.4 15,-3.2 -25,-0.0 -1,-0.4 -0.987 50.2-166.1-148.8 154.1 -23.6 23.3 -19.0 89 112 A A E +F 102 0B 34 -2,-0.3 2,-0.3 13,-0.2 -25,-0.2 -0.975 25.8 151.4-140.9 122.2 -24.5 19.9 -20.5 90 113 A T E -F 101 0B 83 11,-2.6 11,-3.3 -2,-0.3 2,-0.3 -0.850 32.2-122.6-145.8 171.6 -21.9 17.7 -22.1 91 114 A S E -F 100 0B 64 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.963 17.9-175.9-126.8 149.2 -21.2 13.9 -22.7 92 115 A Q E -F 99 0B 95 7,-2.2 7,-1.5 -2,-0.3 2,-0.3 -0.793 15.1-144.2-122.7 166.4 -18.5 11.5 -21.8 93 116 A K E +F 98 0B 165 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.968 20.8 170.1-131.0 126.1 -17.8 7.8 -22.7 94 117 A A E > -F 97 0B 51 3,-1.8 3,-2.0 -2,-0.3 -2,-0.0 -0.989 70.0 -17.4-133.7 143.5 -16.2 5.5 -20.2 95 118 A D T 3 S- 0 0 107 -2,-0.3 59,-0.0 1,-0.2 0, 0.0 -0.367 128.1 -42.3 42.1-138.2 -16.1 1.7 -20.9 96 119 A D T 3 S+ 0 0 111 -3,-0.1 2,-0.4 2,-0.1 -1,-0.2 0.020 117.2 104.6 -99.8 30.0 -18.7 1.3 -23.6 97 120 A K E < -F 94 0B 42 -3,-2.0 -3,-1.8 58,-0.0 2,-0.6 -0.904 62.0-140.4-115.6 136.6 -21.2 3.7 -21.9 98 121 A T E -F 93 0B 17 -2,-0.4 24,-0.4 -5,-0.2 2,-0.4 -0.835 19.4-167.0 -88.8 125.9 -22.3 7.2 -22.6 99 122 A Y E -F 92 0B 6 -7,-1.5 -7,-2.2 -2,-0.6 2,-0.5 -0.884 13.3-141.4-101.9 142.5 -22.7 9.4 -19.6 100 123 A Y E -FG 91 120B 15 20,-2.9 20,-2.1 -2,-0.4 2,-0.5 -0.915 16.1-156.4 -96.0 133.2 -24.4 12.8 -19.8 101 124 A I E -FG 90 119B 18 -11,-3.3 -11,-2.6 -2,-0.5 2,-0.4 -0.941 12.0-175.6-117.0 123.2 -22.8 15.4 -17.5 102 125 A L E -FG 89 118B 0 16,-2.6 16,-2.7 -2,-0.5 2,-0.4 -0.947 12.9-164.7-125.4 134.4 -24.9 18.4 -16.4 103 126 A E E +FG 88 117B 32 -15,-3.2 -16,-2.5 -2,-0.4 -15,-1.4 -0.941 25.2 159.0-114.3 134.4 -23.9 21.5 -14.4 104 127 A Y E -FG 86 116B 0 12,-1.8 12,-2.7 -2,-0.4 2,-0.4 -0.993 33.9-130.9-154.8 154.6 -26.7 23.6 -12.9 105 128 A A E -FG 85 115B 19 -20,-2.6 -20,-2.7 -2,-0.3 2,-0.4 -0.871 18.5-165.3-106.3 146.8 -27.5 26.1 -10.2 106 129 A V E -FG 84 114B 5 8,-2.1 8,-2.4 -2,-0.4 2,-0.4 -0.985 3.4-164.0-132.3 121.7 -30.4 25.8 -7.8 107 130 A T E -FG 83 113B 39 -24,-1.8 -24,-1.9 -2,-0.4 6,-0.2 -0.886 8.6-165.4-102.4 141.8 -31.9 28.6 -5.6 108 131 A L 0 0 58 4,-1.3 4,-0.3 -2,-0.4 -26,-0.1 -0.584 360.0 360.0-136.6 74.3 -34.2 27.7 -2.7 109 132 A P 0 0 110 0, 0.0 -2,-0.0 0, 0.0 -29,-0.0 -0.404 360.0 360.0 -74.2 360.0 -36.5 30.2 -0.8 110 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 111 138 A A 0 0 107 0, 0.0 2,-0.5 0, 0.0 -4,-0.0 0.000 360.0 360.0 360.0 116.1 -32.4 32.1 -0.5 112 139 A Q - 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