==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CIRCADIAN CLOCK PROTEIN 26-MAR-04 1SUY . COMPND 2 MOLECULE: CIRCADIAN CLOCK PROTEIN KAIA; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOSYNECHOCOCCUS ELONGATUS; . AUTHOR I.VAKONAKIS,A.C.LIWANG . 282 4 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15908.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 204 72.3 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 . 18 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 136 48.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.1 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 2 0 0 0 0 0 2 4 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 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 0 136 0, 0.0 3,-0.6 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 88.9 -21.6 22.8 11.9 2 2 A M G > - 0 0 66 3,-0.4 3,-1.6 1,-0.2 2,-0.9 0.022 360.0 -63.6 -37.4 148.4 -20.0 22.3 8.5 3 3 A A G 3 S- 0 0 86 1,-0.3 -1,-0.2 2,-0.1 3,-0.1 -0.094 110.0 -44.7 -42.5 86.4 -22.2 23.8 5.8 4 4 A R G < S+ 0 0 199 -2,-0.9 2,-1.5 -3,-0.6 -1,-0.3 0.709 101.0 154.2 54.1 20.6 -24.8 21.3 6.7 5 5 A M < + 0 0 120 -3,-1.6 -3,-0.4 4,-0.1 -1,-0.2 -0.610 19.1 178.1 -81.8 89.0 -22.0 18.7 6.8 6 6 A S > - 0 0 57 -2,-1.5 4,-1.1 -3,-0.1 3,-0.1 -0.382 45.1-105.4 -85.7 168.3 -23.4 16.1 9.2 7 7 A P H > S+ 0 0 116 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.648 116.5 66.3 -67.9 -13.1 -21.7 12.9 10.2 8 8 A A H > S+ 0 0 60 2,-0.2 4,-3.7 1,-0.2 5,-0.3 0.970 94.1 52.8 -72.6 -55.6 -24.1 11.1 8.0 9 9 A D H > S+ 0 0 70 1,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.901 110.7 50.3 -46.1 -45.8 -22.9 12.5 4.7 10 10 A K H X S+ 0 0 41 -4,-1.1 4,-2.9 2,-0.2 -1,-0.3 0.937 111.4 47.1 -59.4 -46.2 -19.5 11.4 5.6 11 11 A R H X S+ 0 0 119 -4,-1.6 4,-3.9 2,-0.2 -2,-0.2 0.902 109.2 55.0 -62.1 -38.5 -20.8 7.9 6.4 12 12 A K H X S+ 0 0 102 -4,-3.7 4,-2.5 2,-0.2 -2,-0.2 0.941 108.4 48.4 -58.6 -44.6 -22.6 8.1 3.1 13 13 A L H X S+ 0 0 34 -4,-2.9 4,-5.0 -5,-0.3 5,-0.3 0.951 112.5 47.9 -58.1 -49.2 -19.3 8.8 1.5 14 14 A L H X S+ 0 0 20 -4,-2.9 4,-3.2 1,-0.3 -2,-0.2 0.918 110.1 52.8 -56.6 -44.6 -17.8 5.9 3.4 15 15 A D H X S+ 0 0 75 -4,-3.9 4,-1.7 2,-0.2 -1,-0.3 0.877 117.2 38.4 -58.5 -39.1 -20.8 3.8 2.3 16 16 A E H X S+ 0 0 71 -4,-2.5 4,-4.6 2,-0.2 5,-0.3 0.908 115.0 51.4 -79.1 -43.9 -20.0 4.8 -1.2 17 17 A L H X S+ 0 0 1 -4,-5.0 4,-3.5 2,-0.2 5,-0.3 0.878 109.6 54.1 -59.4 -35.8 -16.2 4.6 -0.8 18 18 A R H X S+ 0 0 135 -4,-3.2 4,-2.5 -5,-0.3 -1,-0.2 0.963 116.5 34.8 -61.7 -53.8 -16.8 1.1 0.6 19 19 A S H X S+ 0 0 50 -4,-1.7 4,-3.9 2,-0.2 -2,-0.2 0.915 119.0 52.4 -68.0 -43.3 -18.8 -0.0 -2.4 20 20 A I H X S+ 0 0 22 -4,-4.6 4,-2.8 2,-0.2 -2,-0.2 0.960 111.2 46.2 -57.8 -51.4 -16.7 2.0 -4.8 21 21 A Y H X S+ 0 0 2 -4,-3.5 4,-1.6 -5,-0.3 -1,-0.2 0.957 114.5 49.1 -53.3 -51.3 -13.5 0.5 -3.4 22 22 A R H >X S+ 0 0 52 -4,-2.5 4,-2.1 -5,-0.3 3,-0.5 0.925 109.3 51.5 -52.8 -50.3 -15.2 -2.9 -3.7 23 23 A T H 3X S+ 0 0 31 -4,-3.9 4,-2.6 1,-0.3 5,-0.2 0.892 103.7 58.9 -55.9 -41.5 -16.2 -2.1 -7.2 24 24 A I H 3X S+ 0 0 0 -4,-2.8 4,-0.6 1,-0.2 -1,-0.3 0.884 107.1 48.0 -55.4 -40.1 -12.6 -1.2 -8.1 25 25 A V H X< S+ 0 0 0 -4,-1.6 3,-0.7 -3,-0.5 4,-0.5 0.941 110.4 49.2 -66.6 -49.9 -11.6 -4.7 -7.0 26 26 A L H >< S+ 0 0 54 -4,-2.1 3,-0.5 1,-0.3 -2,-0.2 0.867 118.2 40.7 -58.5 -38.6 -14.3 -6.5 -9.0 27 27 A E H >< S+ 0 0 34 -4,-2.6 3,-3.1 1,-0.2 8,-0.3 0.532 87.3 95.4 -88.1 -6.9 -13.4 -4.5 -12.1 28 28 A Y T << S+ 0 0 50 -3,-0.7 -1,-0.2 -4,-0.6 -2,-0.2 0.835 97.7 34.9 -51.3 -32.5 -9.7 -4.8 -11.3 29 29 A F T < S+ 0 0 33 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.1 0.137 92.1 141.0-107.4 17.3 -9.7 -7.8 -13.7 30 30 A N < - 0 0 46 -3,-3.1 -3,-0.1 1,-0.1 5,-0.1 -0.222 47.7-147.3 -59.7 149.9 -12.4 -6.3 -16.0 31 31 A T S S+ 0 0 122 3,-0.0 -1,-0.1 1,-0.0 -4,-0.0 0.718 95.7 0.6 -91.0 -25.0 -11.9 -6.9 -19.7 32 32 A D S S+ 0 0 136 -5,-0.0 2,-0.2 3,-0.0 -2,-0.1 0.421 99.5 117.5-138.0 -12.6 -13.4 -3.5 -20.7 33 33 A A - 0 0 33 1,-0.1 2,-2.1 -6,-0.1 3,-0.2 -0.452 64.2-134.3 -65.7 126.7 -14.3 -1.9 -17.4 34 34 A K >> - 0 0 140 -2,-0.2 3,-4.0 1,-0.2 4,-0.7 -0.489 24.7-177.8 -81.8 71.1 -12.3 1.3 -17.0 35 35 A V H >> S+ 0 0 17 -2,-2.1 4,-3.3 -8,-0.3 3,-0.8 0.789 76.3 76.3 -39.4 -30.9 -11.3 0.6 -13.4 36 36 A N H 3> S+ 0 0 94 1,-0.3 4,-4.2 2,-0.2 -1,-0.3 0.876 89.1 55.3 -50.5 -38.8 -9.7 4.0 -13.6 37 37 A E H <> S+ 0 0 98 -3,-4.0 4,-2.2 2,-0.2 -1,-0.3 0.881 111.0 44.6 -62.4 -36.5 -13.2 5.5 -13.3 38 38 A R H S+ 0 0 0 -4,-3.6 5,-3.5 -5,-0.3 -1,-0.2 0.927 115.0 39.4 -54.5 -46.5 -11.2 10.1 -0.8 47 47 A F H ><5S+ 0 0 34 -4,-2.6 3,-1.8 -5,-0.2 -2,-0.2 0.982 121.5 41.6 -66.3 -59.0 -9.2 13.3 -1.2 48 48 A F H 3<5S+ 0 0 167 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.906 112.3 54.9 -55.4 -46.7 -12.2 15.6 -1.2 49 49 A A T 3<5S- 0 0 14 -4,-4.4 -1,-0.3 -5,-0.2 -2,-0.2 0.254 112.3-122.4 -74.2 16.5 -13.9 13.8 1.6 50 50 A D T < 5 + 0 0 65 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.858 50.4 175.0 44.0 40.3 -10.7 14.3 3.6 51 51 A I < - 0 0 3 -5,-3.5 2,-0.2 -6,-0.3 -1,-0.2 -0.616 22.8-137.5 -80.7 133.4 -10.5 10.5 3.9 52 52 A S >> - 0 0 4 -2,-0.3 4,-1.2 -3,-0.1 3,-0.8 -0.594 21.6-115.4 -89.9 152.0 -7.4 9.1 5.6 53 53 A V H 3> S+ 0 0 6 1,-0.2 4,-4.0 -2,-0.2 5,-0.3 0.759 106.9 81.8 -55.1 -23.4 -5.6 6.1 4.3 54 54 A S H 3> S+ 0 0 0 2,-0.2 4,-4.7 1,-0.2 5,-0.3 0.946 95.1 39.3 -46.3 -62.6 -6.6 4.5 7.6 55 55 A Q H <>>S+ 0 0 11 -3,-0.8 4,-4.5 1,-0.2 5,-0.5 0.910 115.7 53.1 -56.7 -42.4 -10.1 3.6 6.3 56 56 A V H X5S+ 0 0 1 -4,-1.2 4,-1.2 1,-0.2 -1,-0.2 0.915 116.9 39.3 -58.5 -41.4 -8.6 2.7 3.0 57 57 A L H X5S+ 0 0 3 -4,-4.0 4,-1.6 184,-0.2 181,-0.4 0.922 124.2 38.9 -73.1 -46.9 -6.2 0.4 4.9 58 58 A E H X5S+ 0 0 43 -4,-4.7 4,-1.9 -5,-0.3 -3,-0.2 0.950 115.1 51.0 -70.0 -50.5 -8.8 -0.8 7.4 59 59 A I H X5S+ 0 0 29 -4,-4.5 4,-2.0 -5,-0.3 5,-0.2 0.880 108.3 56.1 -54.6 -38.1 -11.7 -1.0 4.9 60 60 A H H XX S+ 0 0 16 -4,-2.0 4,-1.6 1,-0.2 3,-0.5 0.909 111.2 56.0 -61.3 -40.8 -13.3 -6.8 2.6 64 64 A M H 3X S+ 0 0 6 -4,-2.9 4,-2.6 1,-0.3 3,-0.3 0.907 104.2 53.3 -57.4 -41.1 -10.2 -9.0 2.1 65 65 A D H 3X S+ 0 0 63 -4,-2.6 4,-2.1 1,-0.2 -1,-0.3 0.811 103.6 59.3 -62.8 -28.8 -11.5 -11.1 5.0 66 66 A T H S+ 0 0 2 -4,-2.8 5,-2.4 1,-0.2 4,-0.4 0.867 109.5 44.9 -51.6 -38.6 -12.5 -19.1 -0.5 72 72 A K H <5S+ 0 0 110 -4,-1.6 3,-0.3 -3,-0.3 -2,-0.2 0.961 117.2 41.5 -71.2 -53.1 -12.5 -21.4 2.5 73 73 A L H <5S+ 0 0 143 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.829 126.6 36.6 -63.8 -32.3 -16.3 -22.1 2.5 74 74 A E T <5S- 0 0 91 -4,-4.0 -1,-0.2 -5,-0.2 -2,-0.2 0.461 105.2-131.7 -97.8 -4.2 -16.2 -22.4 -1.3 75 75 A G T 5 + 0 0 65 -4,-0.4 2,-0.4 -5,-0.4 -3,-0.2 0.960 50.7 156.7 51.5 57.9 -12.8 -24.1 -1.3 76 76 A R < - 0 0 118 -5,-2.4 -1,-0.2 -8,-0.1 186,-0.1 -0.921 56.6 -83.1-118.3 142.8 -11.4 -21.7 -4.0 77 77 A S > - 0 0 47 -2,-0.4 185,-0.9 1,-0.2 3,-0.9 -0.135 37.4-161.8 -41.6 113.5 -7.8 -20.8 -4.8 78 78 A E G > S+ 0 0 81 1,-0.2 3,-2.6 2,-0.1 -1,-0.2 0.549 73.2 93.3 -79.6 -6.3 -7.2 -18.0 -2.3 79 79 A D G > + 0 0 82 1,-0.3 3,-2.8 2,-0.2 -1,-0.2 0.841 66.6 76.0 -53.9 -34.4 -4.3 -16.9 -4.4 80 80 A I G X S+ 0 0 1 -3,-0.9 3,-2.1 1,-0.3 4,-0.5 0.675 71.9 86.7 -52.3 -15.1 -6.7 -14.5 -6.1 81 81 A L G X> + 0 0 13 -3,-2.6 4,-1.2 1,-0.3 3,-0.6 0.720 69.0 77.3 -59.3 -20.2 -6.3 -12.5 -2.9 82 82 A L H <> S+ 0 0 8 -3,-2.8 4,-2.5 1,-0.2 -1,-0.3 0.804 82.7 66.0 -60.5 -28.7 -3.2 -11.0 -4.5 83 83 A D H <> S+ 0 0 0 -3,-2.1 4,-3.2 1,-0.2 -1,-0.2 0.925 97.5 51.9 -59.2 -46.0 -5.6 -8.8 -6.5 84 84 A Y H <> S+ 0 0 0 -3,-0.6 4,-4.3 -4,-0.5 5,-0.2 0.888 110.0 49.6 -58.8 -39.2 -6.7 -7.0 -3.4 85 85 A R H X S+ 0 0 35 -4,-1.2 4,-3.0 2,-0.2 5,-0.4 0.918 114.3 44.2 -66.3 -41.8 -3.1 -6.3 -2.5 86 86 A L H X S+ 0 0 10 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.847 119.9 43.3 -69.0 -33.7 -2.5 -5.0 -6.0 87 87 A T H X S+ 0 0 0 -4,-3.2 4,-2.6 -5,-0.2 -2,-0.2 0.874 116.7 46.4 -77.8 -40.3 -5.7 -3.1 -5.8 88 88 A L H X S+ 0 0 0 -4,-4.3 4,-2.4 -5,-0.2 5,-0.2 0.940 119.5 39.1 -67.5 -49.1 -5.1 -1.9 -2.2 89 89 A I H X S+ 0 0 4 -4,-3.0 4,-2.5 -5,-0.2 -2,-0.2 0.910 119.5 47.4 -68.1 -42.9 -1.5 -0.8 -2.9 90 90 A D H X S+ 0 0 16 -4,-1.6 4,-2.0 -5,-0.4 -2,-0.2 0.927 113.0 48.7 -64.3 -45.7 -2.4 0.6 -6.3 91 91 A V H X S+ 0 0 1 -4,-2.6 4,-2.3 2,-0.2 5,-0.3 0.961 114.4 44.2 -58.9 -54.0 -5.4 2.4 -5.0 92 92 A I H X S+ 0 0 2 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.903 113.9 51.2 -57.7 -43.1 -3.5 4.0 -2.1 93 93 A A H X S+ 0 0 1 -4,-2.5 4,-1.3 -5,-0.2 -1,-0.2 0.820 109.3 52.1 -64.4 -32.3 -0.6 4.8 -4.4 94 94 A H H X S+ 0 0 54 -4,-2.0 4,-1.4 -3,-0.3 -2,-0.2 0.954 116.5 35.6 -70.7 -51.2 -3.0 6.5 -6.9 95 95 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.877 114.1 58.5 -71.2 -35.5 -4.7 8.8 -4.4 96 96 A a H X S+ 0 0 2 -4,-2.7 4,-1.7 -5,-0.3 -1,-0.2 0.875 104.8 52.4 -60.2 -34.6 -1.4 9.3 -2.5 97 97 A E H X S+ 0 0 12 -4,-1.3 4,-1.7 -5,-0.2 -1,-0.2 0.902 104.9 54.6 -66.8 -40.7 0.0 10.6 -5.8 98 98 A M H X S+ 0 0 45 -4,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.905 104.2 55.5 -59.3 -41.6 -2.8 13.0 -6.1 99 99 A Y H < S+ 0 0 7 -4,-2.1 -1,-0.2 1,-0.2 3,-0.2 0.934 105.2 51.5 -56.3 -48.8 -2.0 14.4 -2.6 100 100 A R H >< S+ 0 0 48 -4,-1.7 3,-0.9 1,-0.2 -1,-0.2 0.853 111.4 48.1 -57.3 -36.5 1.6 15.1 -3.7 101 101 A R H 3< S+ 0 0 187 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.801 101.8 63.0 -75.0 -29.5 0.2 17.0 -6.7 102 102 A S T 3< S+ 0 0 38 -4,-2.0 -1,-0.2 -3,-0.2 -2,-0.2 0.354 85.4 93.7 -76.4 7.9 -2.2 18.9 -4.6 103 103 A I S < S- 0 0 15 -3,-0.9 2,-0.5 -5,-0.2 -1,-0.1 -0.834 70.4-150.1-106.9 99.1 0.8 20.4 -2.9 104 104 A P - 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