==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 12-FEB-07 2OV1 . COMPND 2 MOLECULE: PERIPLASMIC BINDING PROTEIN COMPONENT OF AN ABC . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; . AUTHOR T.J.SMITH,B.WEI . 260 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12512.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 174 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 0 0.0 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 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 36.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 2 1 0 0 1 1 1 0 0 0 1 0 1 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 2 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 PARALLEL BRIDGES PER LADDER . 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 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 47 A D 0 0 195 0, 0.0 2,-0.1 0, 0.0 24,-0.0 0.000 360.0 360.0 360.0 107.1 17.1 -39.4 32.8 2 48 A A - 0 0 17 1,-0.1 2,-0.5 22,-0.1 22,-0.3 -0.298 360.0 -92.5 -90.2 174.7 16.2 -37.2 29.9 3 49 A M E -a 24 0A 11 20,-2.7 22,-3.1 -2,-0.1 2,-0.8 -0.759 35.8-126.6 -91.5 123.8 17.6 -34.0 28.5 4 50 A D E +a 25 0A 39 -2,-0.5 49,-3.2 47,-0.3 50,-0.9 -0.606 38.3 170.8 -73.4 107.4 15.9 -30.8 29.7 5 51 A I E -ab 26 54A 1 20,-1.3 22,-1.9 -2,-0.8 2,-0.4 -0.963 17.5-155.8-120.3 135.5 14.9 -28.8 26.6 6 52 A T E -ab 27 55A 14 48,-2.3 50,-2.8 -2,-0.4 2,-0.3 -0.876 10.5-171.9-110.7 142.8 12.7 -25.7 26.7 7 53 A V E -ab 28 56A 0 20,-3.3 22,-1.9 -2,-0.4 23,-0.2 -0.870 27.9-125.7-127.5 165.0 10.6 -24.5 23.8 8 54 A S S S+ 0 0 0 48,-1.1 22,-3.1 -2,-0.3 21,-0.3 0.964 86.2 17.7 -75.4 -54.0 8.5 -21.3 23.1 9 55 A I S >> S- 0 0 0 20,-0.2 3,-1.9 19,-0.1 4,-0.8 -0.868 78.6-106.4-125.2 155.7 5.1 -22.8 22.2 10 56 A P H 3> S+ 0 0 15 0, 0.0 4,-1.4 0, 0.0 3,-0.4 0.763 112.2 65.7 -45.4 -38.1 3.2 -26.1 22.6 11 57 A P H 3> S+ 0 0 0 0, 0.0 4,-1.5 0, 0.0 230,-0.1 0.843 99.3 54.6 -58.1 -31.5 3.5 -27.0 18.9 12 58 A Q H <> S+ 0 0 3 -3,-1.9 4,-3.3 2,-0.2 5,-0.3 0.873 99.2 59.2 -70.9 -35.6 7.2 -27.3 19.5 13 59 A Q H X S+ 0 0 68 -4,-0.8 4,-2.4 -3,-0.4 -1,-0.2 0.906 103.5 53.1 -58.9 -37.5 6.7 -29.8 22.3 14 60 A Y H X S+ 0 0 41 -4,-1.4 4,-1.9 1,-0.2 -1,-0.2 0.944 111.9 46.7 -59.1 -46.9 5.0 -32.0 19.7 15 61 A F H X S+ 0 0 3 -4,-1.5 4,-1.7 1,-0.2 5,-0.2 0.916 113.7 45.1 -60.9 -50.6 8.2 -31.6 17.6 16 62 A L H X>S+ 0 0 0 -4,-3.3 4,-3.2 1,-0.2 5,-0.7 0.836 112.1 53.0 -66.2 -31.2 10.6 -32.3 20.4 17 63 A E H X5S+ 0 0 83 -4,-2.4 4,-1.2 -5,-0.3 -1,-0.2 0.887 108.6 50.0 -70.5 -37.7 8.6 -35.3 21.6 18 64 A K H <5S+ 0 0 67 -4,-1.9 120,-0.2 -5,-0.2 -2,-0.2 0.827 124.1 30.2 -67.7 -34.9 8.6 -36.8 18.1 19 65 A I H <5S+ 0 0 0 -4,-1.7 115,-0.2 -5,-0.1 116,-0.2 0.906 129.8 33.2 -92.5 -50.2 12.3 -36.4 17.8 20 66 A G H ><5S+ 0 0 0 -4,-3.2 3,-1.7 -5,-0.2 -3,-0.2 0.834 78.8 177.2 -78.7 -33.0 13.6 -36.7 21.3 21 67 A G G >< - 0 0 50 0, 0.0 3,-2.0 0, 0.0 -2,-0.0 -0.312 24.2-115.8 -60.2 146.6 0.9 -21.6 27.5 32 78 A G T 3 S+ 0 0 27 1,-0.3 205,-0.2 -23,-0.1 -2,-0.0 0.667 114.8 52.0 -59.6 -19.6 -1.3 -22.8 24.7 33 79 A N T 3 S+ 0 0 128 2,-0.1 2,-0.3 181,-0.0 -1,-0.3 0.160 97.4 92.8-102.1 16.9 -4.1 -20.4 25.7 34 80 A N S < S- 0 0 50 -3,-2.0 180,-0.1 203,-0.1 3,-0.1 -0.763 79.6-117.2-110.2 156.1 -1.8 -17.4 25.8 35 81 A D - 0 0 33 -2,-0.3 3,-0.5 1,-0.2 -2,-0.1 -0.816 20.2-160.8 -90.7 115.3 -0.9 -14.8 23.2 36 82 A P S > S+ 0 0 19 0, 0.0 3,-2.2 0, 0.0 -1,-0.2 0.897 84.9 64.3 -63.8 -38.5 2.8 -15.2 22.5 37 83 A H T 3 S+ 0 0 124 1,-0.3 -2,-0.0 -3,-0.1 -3,-0.0 0.841 115.5 30.0 -54.4 -37.2 3.1 -11.7 21.0 38 84 A T T 3 S+ 0 0 104 -3,-0.5 -1,-0.3 2,-0.0 2,-0.3 0.056 95.8 132.2-110.4 24.5 2.2 -10.1 24.3 39 85 A Y < - 0 0 14 -3,-2.2 -9,-0.1 -5,-0.1 -5,-0.0 -0.585 37.5-165.5 -84.6 140.4 3.7 -12.8 26.4 40 86 A E - 0 0 111 -2,-0.3 26,-0.1 26,-0.0 -2,-0.0 -0.963 23.6-126.1-123.4 112.5 6.0 -12.1 29.4 41 87 A P - 0 0 8 0, 0.0 -11,-0.1 0, 0.0 -12,-0.0 -0.223 31.2-119.3 -54.5 148.9 7.9 -15.1 30.8 42 88 A K >> - 0 0 95 -13,-0.2 4,-2.2 1,-0.1 3,-0.6 -0.642 16.8-112.7 -94.0 153.8 7.4 -15.5 34.6 43 89 A P H 3> S+ 0 0 108 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.876 119.6 51.9 -47.1 -45.4 10.1 -15.3 37.3 44 90 A Q H 3> S+ 0 0 168 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.900 109.5 50.3 -60.4 -40.7 9.6 -19.0 38.0 45 91 A Q H <> S+ 0 0 43 -3,-0.6 4,-1.0 1,-0.2 -1,-0.2 0.884 109.0 50.6 -64.3 -41.0 10.1 -19.8 34.3 46 92 A L H < S+ 0 0 45 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.845 110.2 50.5 -65.7 -35.6 13.2 -17.8 34.1 47 93 A A H >< S+ 0 0 65 -4,-2.0 3,-1.5 -5,-0.3 -1,-0.2 0.851 104.0 58.2 -71.2 -35.3 14.6 -19.6 37.1 48 94 A A H >< S+ 0 0 58 -4,-1.8 3,-2.0 1,-0.3 4,-0.5 0.772 89.1 75.0 -66.3 -24.5 13.8 -22.9 35.6 49 95 A L T 3< S+ 0 0 4 -4,-1.0 3,-0.3 1,-0.3 -1,-0.3 0.643 75.2 78.4 -64.1 -11.8 16.0 -22.0 32.6 50 96 A S T < S+ 0 0 68 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.786 100.0 42.1 -65.3 -25.0 19.1 -22.7 34.8 51 97 A E S < S+ 0 0 129 -3,-2.0 2,-0.3 -4,-0.2 -47,-0.3 0.563 87.4 113.9 -95.4 -14.3 18.4 -26.4 34.1 52 98 A A - 0 0 6 -4,-0.5 -47,-0.2 -3,-0.3 3,-0.1 -0.456 48.9-165.2 -64.9 123.2 17.6 -26.0 30.5 53 99 A E S S- 0 0 89 -49,-3.2 25,-1.7 -2,-0.3 2,-0.3 0.763 75.2 -11.0 -78.1 -27.4 20.2 -27.7 28.4 54 100 A A E -bc 5 78A 0 -50,-0.9 -48,-2.3 23,-0.2 2,-0.4 -0.976 59.7-135.2-163.1 168.8 18.9 -25.9 25.4 55 101 A Y E -bc 6 79A 0 23,-3.1 25,-2.8 -2,-0.3 2,-0.9 -0.994 15.7-143.9-136.2 124.7 16.0 -23.7 24.1 56 102 A V E -bc 7 80A 0 -50,-2.8 -48,-1.1 -2,-0.4 2,-0.2 -0.805 18.9-159.5 -96.7 108.1 14.4 -24.2 20.8 57 103 A L E - c 0 81A 16 23,-1.6 25,-1.8 -2,-0.9 26,-0.1 -0.515 21.2-140.3 -81.5 149.2 13.4 -20.9 19.3 58 104 A I - 0 0 2 1,-0.2 2,-0.2 -2,-0.2 -1,-0.1 0.877 47.3-153.3 -73.0 -37.0 10.8 -20.7 16.6 59 105 A G > + 0 0 4 23,-0.1 3,-1.3 24,-0.1 -1,-0.2 -0.464 63.6 94.3 94.4-170.7 13.1 -18.1 15.0 60 106 A L T 3 S- 0 0 42 1,-0.3 41,-0.1 -2,-0.2 -1,-0.1 0.864 122.1 -57.7 50.7 42.7 12.2 -15.2 12.7 61 107 A G T 3 S+ 0 0 53 1,-0.1 -1,-0.3 38,-0.1 6,-0.0 0.738 102.8 128.7 64.2 25.6 12.1 -12.8 15.6 62 108 A F S < S+ 0 0 23 -3,-1.3 -2,-0.1 1,-0.2 4,-0.1 0.871 79.8 40.2 -76.7 -37.3 9.4 -14.8 17.5 63 109 A E S >> S+ 0 0 5 1,-0.2 4,-3.1 2,-0.1 3,-2.7 0.491 83.4 115.1 -88.5 -4.1 11.4 -14.8 20.7 64 110 A Q T 34 S+ 0 0 132 1,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.762 72.4 52.9 -32.1 -48.2 12.4 -11.2 20.1 65 111 A P T 34 S+ 0 0 67 0, 0.0 -1,-0.3 0, 0.0 4,-0.1 0.778 125.3 22.6 -68.0 -26.8 10.5 -10.0 23.2 66 112 A W T X> S+ 0 0 1 -3,-2.7 4,-1.8 2,-0.1 3,-1.2 0.609 89.0 104.9-115.5 -12.5 12.1 -12.5 25.6 67 113 A L H 3X S+ 0 0 44 -4,-3.1 4,-2.3 1,-0.3 5,-0.2 0.800 85.4 46.9 -35.1 -52.5 15.4 -13.4 23.9 68 114 A E H 3> S+ 0 0 124 -4,-0.4 4,-1.9 1,-0.2 -1,-0.3 0.871 108.8 53.7 -63.7 -37.7 17.6 -11.3 26.2 69 115 A K H <> S+ 0 0 67 -3,-1.2 4,-1.3 2,-0.2 -1,-0.2 0.820 109.3 52.3 -65.4 -30.2 15.8 -12.6 29.3 70 116 A L H >X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 3,-0.7 0.982 109.8 44.9 -67.9 -58.3 16.6 -16.0 28.1 71 117 A K H 3< S+ 0 0 83 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.782 115.7 49.9 -57.2 -27.5 20.4 -15.4 27.6 72 118 A A H 3< S+ 0 0 85 -4,-1.9 -1,-0.3 -5,-0.2 3,-0.3 0.775 107.9 52.8 -81.9 -27.5 20.4 -13.7 31.0 73 119 A A H << S- 0 0 32 -4,-1.3 -2,-0.2 -3,-0.7 -1,-0.2 0.806 135.0 -2.9 -77.4 -28.1 18.6 -16.6 32.6 74 120 A N >< + 0 0 22 -4,-1.9 3,-1.0 3,-0.1 -1,-0.3 -0.627 56.7 179.9-166.7 98.9 21.2 -19.1 31.3 75 121 A A T 3 S+ 0 0 83 -3,-0.3 -3,-0.1 1,-0.2 -4,-0.1 0.755 88.7 58.6 -73.6 -25.4 24.0 -18.0 29.0 76 122 A N T 3 S+ 0 0 158 2,-0.1 2,-0.5 -5,-0.0 -1,-0.2 0.403 82.7 111.8 -84.2 3.8 25.3 -21.6 28.8 77 123 A M S < S- 0 0 8 -3,-1.0 2,-0.3 -7,-0.1 -23,-0.2 -0.672 74.2-120.8 -82.7 124.1 21.9 -22.6 27.4 78 124 A K E -c 54 0A 88 -25,-1.7 -23,-3.1 -2,-0.5 2,-0.6 -0.472 20.9-146.5 -68.5 123.4 22.1 -23.8 23.8 79 125 A L E -c 55 0A 47 -2,-0.3 2,-0.8 -25,-0.2 -23,-0.2 -0.822 10.4-164.5 -97.6 119.0 19.9 -21.7 21.5 80 126 A I E -c 56 0A 3 -25,-2.8 -23,-1.6 -2,-0.6 2,-1.4 -0.850 7.0-160.5-107.3 99.3 18.4 -23.7 18.6 81 127 A D E > -c 57 0A 62 -2,-0.8 3,-1.4 1,-0.2 -23,-0.1 -0.659 8.6-174.7 -77.0 96.4 17.1 -21.5 15.8 82 128 A S T 3 S+ 0 0 2 -25,-1.8 -1,-0.2 -2,-1.4 33,-0.2 0.408 76.9 65.1 -76.0 7.1 14.8 -24.1 14.3 83 129 A A T > S+ 0 0 5 -26,-0.1 3,-1.5 32,-0.1 -1,-0.2 0.455 72.7 125.7-106.4 -1.4 14.1 -21.6 11.5 84 130 A Q T < S+ 0 0 100 -3,-1.4 31,-0.1 1,-0.2 3,-0.1 -0.230 70.0 20.7 -61.5 143.3 17.6 -21.4 10.1 85 131 A G T 3 S+ 0 0 83 1,-0.2 2,-0.4 0, 0.0 -1,-0.2 0.413 96.9 116.0 81.7 -1.6 18.1 -22.1 6.4 86 132 A I < - 0 0 29 -3,-1.5 -1,-0.2 25,-0.0 -3,-0.0 -0.854 66.8-126.6-106.4 136.7 14.4 -21.3 5.5 87 133 A T - 0 0 127 -2,-0.4 -3,-0.0 -3,-0.1 0, 0.0 -0.686 33.2-146.5 -80.4 115.2 13.3 -18.5 3.3 88 134 A P - 0 0 50 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.060 5.4-122.4 -71.5-177.3 10.7 -16.4 5.2 89 135 A L - 0 0 52 10,-0.4 10,-3.7 0, 0.0 81,-0.1 -0.978 29.1-111.1-127.1 140.0 7.6 -14.6 4.0 90 136 A E B -D 98 0B 118 -2,-0.4 8,-0.2 8,-0.2 5,-0.2 -0.373 46.4 -94.6 -66.2 153.6 7.1 -10.9 4.7 91 137 A M - 0 0 33 6,-2.2 -1,-0.1 3,-0.5 8,-0.1 -0.216 51.2 -85.6 -61.8 163.4 4.3 -10.2 7.2 92 138 A P S S+ 0 0 58 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 0.839 117.1 8.5 -38.7 -55.2 0.8 -9.5 5.6 93 139 A G S S+ 0 0 64 92,-0.2 2,-0.2 93,-0.1 94,-0.1 0.922 123.4 48.2 -95.8 -65.5 1.4 -5.7 5.1 94 140 A R - 0 0 90 92,-0.4 -3,-0.5 1,-0.1 -1,-0.1 -0.504 57.7-159.5 -79.0 148.4 4.9 -4.6 5.8 95 141 A L S S+ 0 0 115 -5,-0.2 -1,-0.1 -2,-0.2 -4,-0.1 0.722 77.1 82.9 -98.6 -28.2 7.9 -6.5 4.3 96 174 A M S S+ 0 0 135 -6,-0.1 2,-0.4 2,-0.0 -1,-0.1 0.783 89.6 60.1 -46.6 -35.0 10.6 -5.4 6.7 97 175 A V S S- 0 0 59 -6,-0.1 -6,-2.2 -3,-0.0 2,-0.2 -0.860 82.3-134.5-105.9 132.9 9.5 -8.1 9.2 98 176 A A B -D 90 0B 29 -2,-0.4 -8,-0.2 -8,-0.2 -2,-0.0 -0.539 25.2-110.2 -82.4 148.0 9.5 -11.8 8.4 99 177 A D - 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