==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PHOTOSYNTHESIS 02-AUG-06 2DW3 . COMPND 2 MOLECULE: INTRINSIC MEMBRANE PROTEIN PUFX; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOBACTER SPHAEROIDES; . AUTHOR Z.Y.WANG . 77 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8387.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 62 80.5 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 . 0 0.0 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 . 9 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 46.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 18.2 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 1 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 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 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 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 0 122 0, 0.0 4,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 114.0 -8.9 -51.6 16.6 2 2 A D > + 0 0 127 2,-0.3 5,-1.4 6,-0.0 4,-0.0 0.097 360.0 11.5-161.3 -72.0 -7.2 -49.6 13.8 3 3 A K T > 5S+ 0 0 147 3,-0.2 3,-1.0 2,-0.1 2,-0.5 0.814 105.5 87.2 -92.0 -37.8 -9.3 -48.5 10.8 4 4 A T T 3 5S- 0 0 115 1,-0.3 -2,-0.3 2,-0.1 -1,-0.0 -0.533 119.5 -23.0 -69.7 115.6 -12.7 -49.4 12.2 5 5 A I T 3 5S+ 0 0 156 -2,-0.5 -1,-0.3 1,-0.1 -2,-0.1 0.922 134.8 66.8 46.7 55.4 -14.0 -46.4 14.2 6 6 A F T < 5 + 0 0 131 -3,-1.0 2,-2.4 2,-0.1 -3,-0.2 0.140 43.8 161.1-156.8 -75.1 -10.4 -45.0 14.7 7 7 A N < - 0 0 97 -5,-1.4 -3,-0.1 1,-0.1 4,-0.0 -0.462 31.2-173.6 72.6 -76.4 -8.4 -43.8 11.8 8 8 A D + 0 0 102 -2,-2.4 -1,-0.1 -5,-0.1 -2,-0.1 0.517 38.9 49.7 60.7 145.0 -6.0 -41.8 13.9 9 9 A H S S- 0 0 156 1,-0.1 -1,-0.0 2,-0.1 0, 0.0 0.288 88.2 -96.3 75.7 155.1 -3.3 -39.5 12.5 10 10 A L - 0 0 130 1,-0.0 -1,-0.1 -3,-0.0 6,-0.1 0.809 40.8-152.6 -73.3 -31.1 -3.7 -36.8 9.9 11 11 A N - 0 0 115 1,-0.2 2,-3.3 2,-0.1 -2,-0.1 0.832 50.8 -87.4 60.1 32.8 -2.6 -39.2 7.1 12 12 A T - 0 0 107 1,-0.2 5,-0.3 2,-0.1 -1,-0.2 -0.337 58.3-159.3 68.1 -66.5 -1.3 -36.2 5.2 13 13 A N >> - 0 0 83 -2,-3.3 4,-2.2 3,-0.1 3,-0.5 0.952 11.9-146.5 54.6 93.5 -4.7 -35.7 3.6 14 14 A P H 3> S+ 0 0 102 0, 0.0 4,-3.4 0, 0.0 5,-0.2 0.890 98.3 58.1 -54.3 -42.7 -4.2 -33.6 0.4 15 15 A K H 3> S+ 0 0 135 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.886 108.8 45.4 -56.1 -40.6 -7.6 -31.9 0.9 16 16 A T H <> S+ 0 0 50 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.909 114.5 47.2 -70.7 -42.1 -6.4 -30.7 4.3 17 17 A N H X S+ 0 0 92 -4,-2.2 4,-2.8 -5,-0.3 -2,-0.2 0.896 111.6 51.6 -65.6 -40.9 -3.0 -29.5 3.0 18 18 A L H X S+ 0 0 103 -4,-3.4 4,-2.8 2,-0.2 5,-0.3 0.927 111.4 46.2 -61.8 -46.7 -4.6 -27.8 0.1 19 19 A R H X S+ 0 0 148 -4,-2.0 4,-2.7 -5,-0.2 -1,-0.2 0.893 113.5 49.8 -63.6 -40.6 -7.0 -25.9 2.3 20 20 A L H X S+ 0 0 107 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.927 113.4 45.7 -63.7 -46.3 -4.2 -25.0 4.7 21 21 A W H X S+ 0 0 201 -4,-2.8 4,-2.7 2,-0.2 5,-0.2 0.959 117.8 41.5 -61.4 -54.4 -2.0 -23.7 1.8 22 22 A V H X S+ 0 0 62 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.884 114.7 53.3 -61.7 -40.3 -4.8 -21.7 0.1 23 23 A A H X S+ 0 0 39 -4,-2.7 4,-2.9 -5,-0.3 5,-0.3 0.937 113.1 42.1 -60.8 -49.1 -6.0 -20.5 3.5 24 24 A F H X>S+ 0 0 130 -4,-2.6 4,-2.6 2,-0.2 5,-0.7 0.918 116.2 48.7 -64.5 -45.6 -2.6 -19.2 4.5 25 25 A Q H X5S+ 0 0 123 -4,-2.7 4,-1.7 -5,-0.2 5,-0.5 0.923 116.9 41.8 -61.1 -46.4 -1.8 -17.7 1.1 26 26 A M H X>S+ 0 0 111 -4,-2.9 4,-1.9 3,-0.2 5,-0.9 0.930 120.4 42.4 -67.3 -48.0 -5.2 -16.0 0.9 27 27 A M H X>S+ 0 0 137 -4,-2.9 4,-1.9 -5,-0.3 5,-0.6 0.986 125.6 31.7 -63.7 -61.4 -5.2 -14.8 4.5 28 28 A K H X>S+ 0 0 148 -4,-2.6 5,-1.1 -5,-0.3 4,-0.9 0.912 126.6 45.5 -64.3 -43.2 -1.5 -13.7 4.8 29 29 A G H XXS+ 0 0 31 -4,-1.7 5,-1.2 -5,-0.7 4,-1.1 0.994 124.1 28.7 -63.8 -66.1 -1.4 -12.7 1.1 30 30 A A H <>S+ 0 0 64 -4,-1.9 5,-1.2 -5,-0.5 4,-0.4 0.930 126.7 46.1 -62.5 -48.4 -4.7 -10.7 0.8 31 31 A G H XXS+ 0 0 43 -4,-1.9 4,-1.9 -5,-0.9 5,-0.5 0.992 123.8 27.9 -58.8 -69.9 -4.8 -9.6 4.4 32 32 A W H XXS+ 0 0 197 -4,-0.9 4,-2.6 -5,-0.6 5,-0.6 0.981 132.2 35.0 -57.1 -64.7 -1.2 -8.4 4.9 33 33 A A H XXS+ 0 0 32 -5,-1.2 4,-1.4 -4,-0.4 5,-1.0 0.896 121.6 50.6 -61.2 -41.9 -3.8 -6.1 0.3 35 35 A G H XXS+ 0 0 38 -4,-1.9 4,-1.8 -5,-1.2 5,-0.5 0.978 119.4 32.3 -60.7 -60.4 -4.7 -4.8 3.7 36 36 A V H XXS+ 0 0 75 -4,-2.6 4,-1.9 -5,-0.5 5,-0.8 0.948 126.3 42.3 -63.3 -52.1 -1.5 -2.8 4.3 37 37 A F H X + 0 0 99 -4,-1.1 5,-1.0 -5,-0.3 -3,-0.2 0.866 37.6 170.4 64.6 34.9 -2.8 19.2 -1.2 54 54 A L T 5 + 0 0 70 -6,-0.7 2,-0.9 -5,-0.3 -5,-0.1 0.892 49.7 88.2 -42.7 -56.4 0.6 17.8 -2.1 55 55 A P T 5S- 0 0 79 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.285 110.6 -41.3 -53.4 94.6 -0.2 17.7 -5.9 56 56 A I T 5S+ 0 0 140 -2,-0.9 2,-2.1 1,-0.2 0, 0.0 0.320 126.1 39.8 64.1 160.0 0.9 21.2 -6.8 57 57 A Q T 5 + 0 0 136 1,-0.1 2,-1.8 3,-0.1 3,-0.5 -0.467 63.0 176.0 71.1 -79.2 0.3 24.4 -4.9 58 58 A E < - 0 0 109 -2,-2.1 -1,-0.1 -5,-1.0 3,-0.1 -0.554 69.2 -48.2 79.7 -79.6 0.9 23.0 -1.4 59 59 A N S S- 0 0 142 -2,-1.8 -1,-0.2 1,-0.3 2,-0.1 0.362 109.9 -24.7-154.4 -43.2 0.5 26.2 0.6 60 60 A Q S S- 0 0 155 -3,-0.5 -1,-0.3 0, 0.0 -3,-0.1 -0.345 72.8 -85.8-147.6-130.7 2.6 29.0 -1.0 61 61 A A - 0 0 47 2,-0.2 -3,-0.0 -2,-0.1 0, 0.0 -0.841 15.4-133.9-164.1 122.3 5.7 29.3 -3.2 62 62 A P S S+ 0 0 143 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 0.664 78.5 110.9 -50.3 -15.8 9.5 29.3 -2.3 63 63 A A S S- 0 0 58 1,-0.1 3,-0.2 2,-0.0 -2,-0.2 -0.315 89.9-108.8 -63.4 144.3 9.7 32.2 -4.8 64 64 A P - 0 0 114 0, 0.0 2,-2.6 0, 0.0 -1,-0.1 0.765 46.6-176.5 -43.0 -30.4 10.4 35.7 -3.2 65 65 A N + 0 0 64 1,-0.2 2,-2.6 3,-0.1 -2,-0.0 -0.383 7.4 177.8 65.8 -77.0 6.7 36.5 -4.0 66 66 A I S S- 0 0 146 -2,-2.6 -1,-0.2 1,-0.2 3,-0.1 -0.261 80.7 -16.5 75.1 -53.8 7.0 40.1 -2.8 67 67 A T S S- 0 0 128 -2,-2.6 2,-0.7 1,-0.2 -1,-0.2 0.031 111.8 -72.0-175.4 46.6 3.4 40.7 -3.8 68 68 A G - 0 0 44 1,-0.1 -1,-0.2 2,-0.1 -3,-0.1 -0.844 55.9-102.2 99.8-116.3 2.2 38.0 -6.2 69 69 A A S S- 0 0 82 -2,-0.7 2,-0.2 -3,-0.1 -1,-0.1 0.078 83.9 -10.6-176.0 -51.1 3.6 38.1 -9.7 70 70 A L - 0 0 101 3,-0.1 -2,-0.1 1,-0.1 0, 0.0 -0.616 41.2-170.9-173.3 106.4 1.1 39.6 -12.2 71 71 A E S S- 0 0 175 -2,-0.2 -1,-0.1 1,-0.1 -3,-0.0 0.878 93.4 -25.3 -67.8 -38.5 -2.6 40.4 -11.7 72 72 A H S S- 0 0 153 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.004 107.7 -69.6-170.8 44.9 -3.1 41.1 -15.4 73 73 A H - 0 0 155 1,-0.1 2,-0.2 0, 0.0 -3,-0.1 0.886 64.3-174.2 60.0 105.7 0.2 42.1 -17.0 74 74 A H - 0 0 109 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.731 19.3-151.8-123.9 173.6 1.3 45.6 -15.8 75 75 A H + 0 0 162 -2,-0.2 0, 0.0 1,-0.1 0, 0.0 -0.783 18.2 168.8-152.9 102.7 4.1 48.0 -16.6 76 76 A H 0 0 166 -2,-0.3 -1,-0.1 1,-0.1 0, 0.0 0.739 360.0 360.0 -84.2 -25.7 5.5 50.5 -14.0 77 77 A H 0 0 234 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.135 360.0 360.0 65.5 360.0 8.5 51.5 -16.2