==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 27-APR-10 2KX6 . COMPND 2 MOLECULE: PHOTOACTIVE YELLOW PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HALORHODOSPIRA HALOPHILA; . AUTHOR P.L.RAMACHANDRAN,J.E.LOVETT,P.J.CARL,M.CAMMARATA,J.H.LEE,J.O . 125 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9673.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 29 23.2 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 . 9 7.2 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 . 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 . 1 0.8 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 . 6 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 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 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 . 1 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 M 0 0 234 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 162.3 -27.7 4.2 -2.2 2 2 A E - 0 0 195 2,-0.0 3,-0.1 0, 0.0 0, 0.0 0.086 360.0 -26.1-168.2 -59.2 -28.4 2.2 1.0 3 3 A H S S+ 0 0 174 1,-0.1 2,-0.2 0, 0.0 0, 0.0 -0.023 108.5 89.8-168.6 42.0 -25.7 -0.4 1.8 4 4 A V + 0 0 139 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.674 62.9 79.4-148.5 87.8 -24.1 -1.5 -1.6 5 5 A A - 0 0 80 -2,-0.2 2,-0.2 -3,-0.1 0, 0.0 -0.940 37.5-178.5-169.3-174.8 -21.1 0.6 -2.7 6 6 A F - 0 0 150 -2,-0.3 -2,-0.0 1,-0.1 3,-0.0 -0.735 18.3-139.2-167.1-144.8 -17.3 1.2 -2.3 7 7 A G - 0 0 61 -2,-0.2 -1,-0.1 0, 0.0 3,-0.1 0.095 52.2 -76.1-160.2 -75.4 -14.5 3.5 -3.6 8 8 A S S S+ 0 0 77 1,-0.2 2,-0.3 48,-0.0 0, 0.0 0.121 99.4 14.8-171.4 -50.2 -11.0 2.2 -4.4 9 9 A E + 0 0 87 2,-0.1 -1,-0.2 1,-0.0 46,-0.0 -0.991 42.8 156.1-144.8 148.9 -9.0 1.5 -1.2 10 10 A D + 0 0 156 -2,-0.3 2,-0.1 -3,-0.1 -1,-0.0 -0.120 66.4 54.7-168.8 50.9 -9.7 1.2 2.6 11 11 A I S S- 0 0 77 2,-0.1 -2,-0.1 0, 0.0 3,-0.0 -0.071 92.7 -95.3-147.5-111.0 -6.9 -0.8 4.1 12 12 A E S S- 0 0 39 2,-0.1 -3,-0.0 -2,-0.1 0, 0.0 0.334 90.8 -22.7-162.2 -20.4 -3.1 -0.3 4.0 13 13 A N S S- 0 0 10 1,-0.2 2,-0.1 16,-0.0 4,-0.1 -0.019 84.8 -88.9-159.4 -89.4 -1.7 -2.4 1.1 14 14 A T S S- 0 0 22 2,-0.1 -1,-0.2 41,-0.0 3,-0.1 -0.436 72.3 -29.6-166.3-119.1 -3.4 -5.6 -0.4 15 15 A L S S+ 0 0 37 1,-0.2 2,-1.4 15,-0.2 7,-0.2 0.869 119.3 62.8 -91.6 -47.3 -3.4 -9.4 0.4 16 16 A A S S+ 0 0 25 14,-0.4 14,-1.0 6,-0.1 2,-0.2 -0.668 89.1 98.1 -81.3 88.5 0.1 -10.0 1.8 17 17 A K S S- 0 0 43 -2,-1.4 3,-0.1 12,-0.2 11,-0.1 -0.696 81.0 -52.8-150.3-159.9 -0.2 -7.7 5.0 18 18 A M S S- 0 0 97 -2,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.937 93.6 -42.8 -53.5 -98.8 -0.8 -7.5 8.8 19 19 A D S S+ 0 0 131 1,-0.1 -1,-0.2 -3,-0.1 -3,-0.0 -0.968 81.7 109.7-148.5 128.2 -4.2 -9.3 9.7 20 20 A D S S- 0 0 126 -2,-0.3 -1,-0.1 -3,-0.1 -2,-0.0 0.201 108.2 -26.3-169.8 -10.7 -7.6 -9.3 8.0 21 21 A G S S- 0 0 56 -6,-0.1 -6,-0.1 2,-0.0 -2,-0.1 0.102 81.5-146.6 179.7 -39.6 -7.8 -12.8 6.6 22 22 A Q - 0 0 166 -7,-0.2 2,-0.3 1,-0.1 -6,-0.1 0.625 15.6-167.9 58.9 140.1 -4.2 -14.0 6.0 23 23 A L - 0 0 84 -8,-0.2 -1,-0.1 22,-0.0 24,-0.0 -0.906 38.1 -60.3-147.4 171.3 -3.1 -16.4 3.2 24 24 A D S S+ 0 0 155 -2,-0.3 2,-0.1 1,-0.1 -2,-0.0 -0.328 87.2 88.4 -59.5 132.9 -0.0 -18.4 2.1 25 25 A G S S- 0 0 55 1,-0.3 -1,-0.1 -2,-0.0 -9,-0.0 -0.551 80.5 -44.4-178.8-112.3 3.1 -16.2 1.5 26 26 A L - 0 0 72 -2,-0.1 -1,-0.3 4,-0.0 4,-0.1 0.287 59.4 -94.7-116.6-120.2 5.9 -15.0 3.8 27 27 A A S S+ 0 0 78 2,-0.2 -9,-0.0 -11,-0.1 -11,-0.0 -0.008 108.7 28.2-165.4 36.1 5.8 -13.5 7.4 28 28 A F S S- 0 0 114 1,-0.1 2,-0.3 95,-0.1 0, 0.0 0.137 105.5 -91.7-159.2 -65.6 5.7 -9.7 6.8 29 29 A G - 0 0 4 93,-0.1 -2,-0.2 92,-0.1 -12,-0.2 -0.967 31.9-152.4 165.8-159.8 4.1 -8.7 3.5 30 30 A A - 0 0 4 -14,-1.0 -14,-0.4 90,-0.3 -15,-0.2 -0.614 23.0-175.9 159.3 145.7 5.0 -8.0 -0.2 31 31 A I - 0 0 22 -2,-0.2 10,-1.2 -16,-0.1 9,-0.7 0.479 42.4-152.4-123.5 -27.9 4.0 -6.0 -3.4 32 32 A Q - 0 0 15 8,-0.2 8,-1.0 7,-0.2 9,-0.5 0.574 12.5-161.1 58.8 146.0 6.6 -7.4 -5.7 33 33 A L - 0 0 2 6,-0.3 2,-0.2 7,-0.1 6,-0.2 -0.689 6.9-137.2-138.3-172.2 8.1 -5.7 -8.8 34 34 A D - 0 0 100 -2,-0.2 83,-0.1 83,-0.1 6,-0.1 -0.550 50.6 -63.4-134.2-160.7 10.1 -6.6 -12.0 35 35 A G S S+ 0 0 61 -2,-0.2 48,-0.0 1,-0.2 82,-0.0 0.941 133.3 33.2 -60.2 -53.6 13.1 -5.1 -13.9 36 36 A D S S- 0 0 148 2,-0.0 -1,-0.2 -3,-0.0 25,-0.0 0.741 125.8 -92.4 -76.2 -25.2 11.5 -1.7 -14.8 37 37 A G + 0 0 1 1,-0.2 25,-1.5 25,-0.1 2,-0.4 0.541 69.9 156.1 119.0 20.3 9.4 -1.5 -11.6 38 38 A N B -A 61 0A 62 23,-0.2 -1,-0.2 24,-0.1 23,-0.2 -0.652 49.1-109.9 -80.2 123.6 6.1 -3.1 -12.8 39 39 A I - 0 0 16 21,-0.7 20,-0.6 -2,-0.4 -6,-0.3 -0.239 29.4-173.3 -51.5 134.1 3.9 -4.6 -10.0 40 40 A L > + 0 0 59 -8,-1.0 2,-1.9 -9,-0.7 3,-0.6 0.506 48.7 116.4-108.1 -13.9 3.9 -8.5 -10.1 41 41 A Q T 3 + 0 0 16 -10,-1.2 17,-0.1 -9,-0.5 -2,-0.1 -0.373 56.2 81.3 -60.2 83.8 1.2 -9.0 -7.3 42 42 A Y T 3 S+ 0 0 145 -2,-1.9 -1,-0.2 16,-0.1 4,-0.1 0.267 87.3 41.3-171.2 6.9 -1.3 -10.6 -9.7 43 43 A N S < S+ 0 0 143 -3,-0.6 -2,-0.0 2,-0.1 -3,-0.0 -0.387 94.3 59.2-168.3 80.8 -0.3 -14.3 -10.1 44 44 A A S S- 0 0 71 -3,-0.0 2,-0.1 -2,-0.0 -3,-0.1 0.178 117.2 -7.2-169.8 -43.4 0.9 -16.3 -7.0 45 45 A A S S- 0 0 39 -22,-0.0 -2,-0.1 0, 0.0 -30,-0.1 -0.460 70.9-141.4-172.7 89.1 -2.0 -16.2 -4.4 46 46 A E - 0 0 162 -4,-0.1 -4,-0.0 -2,-0.1 -5,-0.0 -0.097 19.6-121.7 -55.2 152.8 -5.1 -14.1 -5.1 47 47 A G - 0 0 28 1,-0.1 2,-0.1 -24,-0.0 -1,-0.0 0.808 41.5 -85.5 -63.7-116.0 -6.7 -12.3 -2.1 48 48 A D S S+ 0 0 118 6,-0.2 -1,-0.1 0, 0.0 -2,-0.0 -0.540 87.1 90.1-169.1 93.1 -10.4 -13.0 -1.4 49 49 A I - 0 0 111 -2,-0.1 -3,-0.0 3,-0.1 0, 0.0 0.347 57.8-153.2-152.7 -39.0 -13.4 -11.2 -3.1 50 50 A T + 0 0 147 2,-0.2 3,-0.1 1,-0.1 0, 0.0 0.965 67.0 79.9 50.4 87.2 -14.3 -13.2 -6.2 51 51 A G S S- 0 0 79 1,-0.5 2,-0.2 2,-0.0 -1,-0.1 0.229 95.2 -18.4 178.5 -31.5 -15.8 -10.7 -8.7 52 52 A R S S- 0 0 171 1,-0.3 -1,-0.5 2,-0.0 -2,-0.2 -0.839 97.3 -11.0-166.4-160.5 -13.1 -8.7 -10.5 53 53 A D - 0 0 88 -2,-0.2 -1,-0.3 2,-0.1 -11,-0.0 -0.016 63.8-113.5 -48.6 155.4 -9.4 -7.5 -10.5 54 54 A P S S- 0 0 42 0, 0.0 -6,-0.2 0, 0.0 -1,-0.1 0.860 88.5 -47.2 -60.3 -34.2 -7.4 -8.2 -7.3 55 55 A K - 0 0 47 -46,-0.0 -2,-0.1 -41,-0.0 -41,-0.0 -0.174 69.6 -95.9-158.9-101.0 -7.2 -4.4 -6.8 56 56 A Q S S+ 0 0 120 -2,-0.1 4,-0.2 4,-0.1 -3,-0.0 0.197 97.4 92.3-174.2 -22.0 -6.3 -2.0 -9.7 57 57 A V > + 0 0 22 2,-0.1 3,-2.0 9,-0.1 -18,-0.2 0.713 58.7 122.0 -59.9 -20.4 -2.6 -1.4 -9.2 58 58 A I T 3 S+ 0 0 29 1,-0.3 -18,-0.1 -17,-0.1 3,-0.1 -0.127 81.8 8.7 -48.5 136.7 -1.9 -4.2 -11.6 59 59 A G T 3 S+ 0 0 58 -20,-0.6 2,-0.5 1,-0.2 -1,-0.3 0.126 103.1 119.3 76.2 -22.4 0.1 -3.1 -14.7 60 60 A K S < S- 0 0 88 -3,-2.0 -21,-0.7 -4,-0.2 -1,-0.2 -0.673 70.8-120.3 -79.3 122.4 0.7 0.3 -13.0 61 61 A N B > -A 38 0A 73 -2,-0.5 3,-1.3 1,-0.2 4,-0.4 -0.363 9.5-142.5 -63.7 123.4 4.4 1.2 -12.3 62 62 A F T 3 S+ 0 0 2 -25,-1.5 5,-0.3 1,-0.3 4,-0.2 0.572 93.3 84.6 -61.2 -7.4 4.9 1.6 -8.4 63 63 A F T 3 S- 0 0 101 -26,-0.3 9,-0.3 1,-0.1 -1,-0.3 0.887 118.0 -21.3 -63.3 -46.9 7.2 4.4 -9.7 64 64 A K S < S+ 0 0 151 -3,-1.3 -2,-0.2 7,-0.1 -1,-0.1 -0.113 126.4 60.1-167.1 61.3 4.5 7.1 -10.2 65 65 A D S S+ 0 0 103 -4,-0.4 -3,-0.1 -5,-0.1 -2,-0.1 0.194 109.1 31.1-171.9 19.2 0.8 5.8 -10.5 66 66 A V S S+ 0 0 36 1,-0.2 -4,-0.1 -4,-0.2 -3,-0.1 0.412 108.0 59.6-147.8 -46.1 0.1 3.9 -7.2 67 67 A A - 0 0 9 -5,-0.3 2,-1.2 3,-0.1 -1,-0.2 -0.880 58.9-162.9-100.5 108.1 2.1 5.5 -4.4 68 68 A P S S+ 0 0 81 0, 0.0 28,-0.1 0, 0.0 3,-0.1 -0.263 88.4 47.2 -87.1 52.5 1.3 9.3 -3.7 69 69 A C S S+ 0 0 54 -2,-1.2 2,-1.2 1,-0.1 26,-0.1 0.384 76.4 95.4-154.1 -42.7 4.6 9.7 -1.8 70 70 A T + 0 0 19 -3,-0.2 2,-0.4 -8,-0.1 -1,-0.1 -0.516 44.1 165.1 -66.9 95.0 7.5 8.1 -3.7 71 71 A D + 0 0 146 -2,-1.2 -1,-0.1 4,-0.1 -7,-0.1 -0.603 48.1 62.3-114.3 66.8 8.8 11.4 -5.5 72 72 A S S S- 0 0 63 -2,-0.4 4,-0.1 -9,-0.3 -2,-0.0 -0.888 110.7 -57.2-166.1-175.0 12.3 10.2 -6.7 73 73 A P S S- 0 0 79 0, 0.0 3,-0.0 0, 0.0 -3,-0.0 0.841 106.6 -60.9 -48.2 -37.0 13.9 7.5 -9.1 74 74 A E S S- 0 0 16 -12,-0.0 -2,-0.2 -10,-0.0 -37,-0.0 -0.106 110.1 -7.6-169.8 -79.0 12.1 4.8 -7.0 75 75 A F S S- 0 0 12 -4,-0.1 -4,-0.1 -5,-0.1 18,-0.0 0.800 108.9 -66.0-100.0 -79.5 12.9 4.3 -3.2 76 76 A Y S S- 0 0 137 -6,-0.1 -6,-0.0 -4,-0.1 0, 0.0 0.064 96.4 -53.1-168.5 25.3 15.9 6.5 -2.1 77 77 A G S S+ 0 0 45 0, 0.0 3,-0.1 0, 0.0 4,-0.0 0.823 106.4 114.9 93.4 44.0 18.7 4.9 -4.1 78 78 A K + 0 0 94 1,-0.1 12,-0.1 3,-0.1 11,-0.0 -0.289 62.7 61.1-136.3 45.9 18.2 1.3 -3.0 79 79 A F S S+ 0 0 35 3,-0.1 -1,-0.1 9,-0.0 9,-0.0 0.083 93.9 59.4-159.1 21.6 17.3 -0.5 -6.2 80 80 A K S S+ 0 0 146 -3,-0.1 -2,-0.1 3,-0.1 0, 0.0 0.340 115.8 31.8-130.5 -12.7 20.4 0.1 -8.4 81 81 A E S > S+ 0 0 148 3,-0.1 4,-1.6 2,-0.1 6,-0.2 0.587 119.8 50.2-115.5 -37.1 22.9 -1.6 -6.1 82 82 A G H >>S+ 0 0 10 2,-0.2 5,-1.1 1,-0.2 4,-1.0 0.734 115.1 46.2 -74.1 -26.7 20.6 -4.3 -4.6 83 83 A V H 45S+ 0 0 48 2,-0.2 -1,-0.2 3,-0.1 -2,-0.1 0.828 116.9 42.0 -80.4 -41.1 19.5 -5.2 -8.2 84 84 A A H 45S+ 0 0 86 1,-0.1 -2,-0.2 2,-0.1 -1,-0.1 0.758 114.8 52.1 -75.8 -31.5 23.1 -5.4 -9.6 85 85 A S H <5S- 0 0 92 -4,-1.6 -3,-0.2 0, 0.0 -2,-0.2 0.899 101.8-130.6 -71.9 -45.5 24.5 -7.2 -6.5 86 86 A G T <5S+ 0 0 38 -4,-1.0 -3,-0.1 -5,-0.2 -4,-0.1 0.764 86.6 76.6 93.5 34.7 21.9 -10.0 -6.5 87 87 A N < - 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0 0 89 0, 0.0 2,-0.2 0, 0.0 -4,-0.1 0.272 13.7-175.4 -45.9 174.8 -2.3 8.5 8.5 103 103 A T - 0 0 50 -6,-0.5 -7,-0.1 2,-0.0 -6,-0.1 -0.902 29.8-131.6-160.1 179.6 0.4 6.1 9.9 104 104 A K + 0 0 189 -2,-0.2 0, 0.0 -9,-0.1 0, 0.0 -0.328 43.0 160.3-143.4 53.7 4.1 5.8 10.8 105 105 A V - 0 0 15 20,-0.0 2,-0.3 1,-0.0 -11,-0.2 0.057 33.2-139.8 -66.5-178.2 5.3 2.5 9.2 106 106 A K - 0 0 110 16,-1.3 16,-0.2 17,-0.1 -13,-0.2 -0.847 21.7-134.5-149.7 105.9 8.9 1.5 8.5 107 107 A V - 0 0 2 -2,-0.3 -15,-1.4 14,-0.1 2,-0.4 -0.384 15.6-168.2 -74.1 139.6 9.5 -0.3 5.1 108 108 A H E -B 91 0B 49 -17,-0.2 13,-1.1 -2,-0.1 -17,-0.2 -0.849 13.5-176.5-127.4 90.5 11.7 -3.5 4.8 109 109 A M E +BC 90 120B 9 -19,-1.7 -19,-1.0 -2,-0.4 2,-0.3 -0.470 7.4 165.0 -86.5 159.1 12.4 -4.3 1.1 110 110 A K E -BC 89 119B 75 9,-1.0 2,-1.6 -21,-0.2 9,-0.9 -0.965 51.6 -83.6-168.2 155.2 14.4 -7.5 -0.2 111 111 A K S S- 0 0 78 -23,-1.8 7,-0.2 -2,-0.3 5,-0.1 -0.549 70.7-113.5 -71.3 91.8 15.1 -9.5 -3.3 112 112 A A - 0 0 8 -2,-1.6 5,-0.2 5,-0.4 4,-0.2 0.452 31.9-167.8 -23.8 155.8 11.9 -11.6 -3.1 113 113 A L S S+ 0 0 131 3,-0.1 -1,-0.1 2,-0.1 -2,-0.0 0.341 80.4 74.9-126.9 -10.5 11.5 -15.4 -2.4 114 114 A S S S- 0 0 49 1,-0.1 -2,-0.0 3,-0.0 -84,-0.0 0.704 128.1 -24.4 -78.7 -23.7 7.7 -15.6 -3.3 115 115 A G S S- 0 0 33 2,-0.0 -1,-0.1 -71,-0.0 -2,-0.1 0.209 100.0 -74.1 175.0 49.6 8.5 -15.4 -7.1 116 116 A D S S+ 0 0 143 -4,-0.2 2,-0.2 1,-0.1 -3,-0.1 0.930 86.7 103.7 48.7 99.2 11.8 -13.7 -8.1 117 117 A S S S- 0 0 7 -5,-0.2 -5,-0.4 -85,-0.1 2,-0.2 -0.928 74.8 -89.6-174.7-168.4 11.4 -9.8 -7.7 118 118 A Y - 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