==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 02-JAN-10 2KSC . COMPND 2 MOLECULE: CYANOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCOCCUS SP.; . AUTHOR D.A.VULETICH,C.J.FALZONE,J.T.J.LECOMTE . 123 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8677.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 99 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 . 5 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 16.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 58.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.6 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 1 1 0 0 1 0 0 1 1 0 0 1 1 1 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 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 2 A A 0 0 90 0, 0.0 5,-0.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 11.5 -14.6 7.9 -2.2 2 3 A S > - 0 0 71 1,-0.1 4,-1.1 4,-0.0 3,-0.4 -0.311 360.0-104.5 -74.8 161.3 -14.0 5.1 0.2 3 4 A L H >> S+ 0 0 37 1,-0.3 4,-2.1 2,-0.2 3,-1.5 0.924 124.1 52.4 -50.2 -49.7 -13.1 1.6 -0.9 4 5 A Y H 3> S+ 0 0 133 1,-0.3 4,-2.8 2,-0.2 -1,-0.3 0.869 103.1 58.6 -55.7 -38.0 -16.6 0.4 -0.1 5 6 A E H 34 S+ 0 0 141 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.763 107.9 48.2 -63.8 -24.2 -17.9 3.3 -2.3 6 7 A K H << S+ 0 0 125 -3,-1.5 -2,-0.2 -4,-1.1 -1,-0.2 0.946 127.7 21.1 -80.5 -54.1 -15.9 1.8 -5.2 7 8 A L H < S- 0 0 76 -4,-2.1 -2,-0.2 2,-0.1 -3,-0.2 0.905 89.1-145.4 -80.9 -45.3 -17.0 -1.9 -4.9 8 9 A G < + 0 0 67 -4,-2.8 2,-0.3 -5,-0.4 -3,-0.1 0.759 69.2 77.0 83.5 26.9 -20.2 -1.3 -3.0 9 10 A G - 0 0 27 -5,-0.2 4,-0.3 1,-0.1 -1,-0.2 -0.912 64.1-148.6-167.3 137.6 -19.9 -4.5 -1.0 10 11 A A S >> S+ 0 0 62 -2,-0.3 3,-3.1 2,-0.2 4,-1.0 0.976 101.0 51.7 -72.3 -57.9 -17.8 -5.8 2.0 11 12 A A H >> S+ 0 0 64 1,-0.3 4,-2.1 2,-0.2 3,-0.6 0.875 97.0 70.1 -45.9 -43.1 -17.6 -9.4 0.9 12 13 A A H 3> S+ 0 0 47 1,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.796 100.0 49.4 -46.4 -29.8 -16.3 -8.2 -2.5 13 14 A V H <> S+ 0 0 14 -3,-3.1 4,-2.7 -4,-0.3 5,-0.3 0.875 104.7 56.3 -78.5 -39.5 -13.2 -7.2 -0.5 14 15 A D H X S+ 0 0 2 -4,-1.4 4,-3.0 -5,-0.2 3,-0.7 0.959 114.2 52.4 -61.9 -52.9 -4.5 -12.0 -4.5 21 22 A Y H 3X S+ 0 0 40 -4,-3.3 4,-1.8 1,-0.3 -2,-0.2 0.929 107.1 52.5 -48.6 -52.8 -3.3 -13.5 -1.2 22 23 A G H 3X S+ 0 0 43 -4,-2.8 4,-1.1 -5,-0.3 -1,-0.3 0.845 112.6 46.6 -53.5 -35.2 -3.7 -17.0 -2.6 23 24 A K H S+ 0 0 151 -2,-1.6 4,-0.6 1,-0.2 -1,-0.2 0.498 70.2 76.3 -71.2 -1.4 7.7 -18.3 -2.6 29 30 A R H >4 S+ 0 0 160 2,-0.2 3,-0.8 1,-0.2 -1,-0.2 0.963 100.7 33.9 -73.4 -54.4 10.1 -15.7 -3.9 30 31 A V H >> S+ 0 0 13 -3,-0.4 3,-1.8 1,-0.2 4,-0.9 0.746 106.8 73.0 -72.6 -23.2 8.5 -12.6 -2.3 31 32 A N H 3< S+ 0 0 31 -4,-1.1 -1,-0.2 1,-0.3 3,-0.2 0.807 78.3 76.4 -60.5 -29.1 7.6 -14.8 0.7 32 33 A R T X< S+ 0 0 192 -3,-0.8 3,-0.5 -4,-0.6 -1,-0.3 0.804 98.0 46.1 -51.9 -29.6 11.3 -14.8 1.6 33 34 A F G X4 S+ 0 0 46 -3,-1.8 3,-0.9 1,-0.2 4,-0.5 0.834 103.3 60.9 -82.3 -35.3 10.7 -11.3 2.9 34 35 A F G 3< S+ 0 0 38 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.102 78.4 98.5 -79.7 25.6 7.5 -12.2 4.8 35 36 A V G < S+ 0 0 104 -3,-0.5 -1,-0.2 1,-0.1 -2,-0.1 0.880 84.8 41.0 -79.1 -40.2 9.6 -14.6 6.9 36 37 A N S < S+ 0 0 131 -3,-0.9 2,-0.2 -4,-0.2 -2,-0.2 0.886 108.5 70.4 -74.4 -40.1 10.0 -12.3 9.8 37 38 A T S S- 0 0 63 -4,-0.5 2,-0.0 1,-0.1 0, 0.0 -0.528 87.2-119.4 -79.9 145.3 6.3 -11.1 9.6 38 39 A D > - 0 0 73 -2,-0.2 4,-1.5 1,-0.1 -1,-0.1 -0.271 23.4-109.5 -78.0 168.5 3.6 -13.5 10.6 39 40 A M H > S+ 0 0 132 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.758 116.2 60.2 -69.4 -24.0 0.8 -14.6 8.3 40 41 A A H > S+ 0 0 73 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.983 111.3 34.7 -67.2 -59.0 -1.6 -12.5 10.3 41 42 A K H > S+ 0 0 128 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.756 109.9 70.8 -67.4 -23.6 0.0 -9.1 9.8 42 43 A Q H >X S+ 0 0 14 -4,-1.5 3,-2.2 1,-0.2 4,-1.2 0.971 94.0 50.9 -56.7 -58.3 0.9 -10.3 6.3 43 44 A K H 3X S+ 0 0 114 -4,-1.6 4,-1.7 1,-0.3 -1,-0.2 0.891 101.5 63.3 -46.5 -45.6 -2.6 -10.2 5.0 44 45 A Q H 3X S+ 0 0 118 -4,-1.0 4,-2.4 1,-0.2 -1,-0.3 0.828 100.3 55.1 -50.0 -33.3 -2.9 -6.7 6.3 45 46 A H H <>S+ 0 0 35 -4,-1.3 3,-2.1 2,-0.2 5,-1.0 0.963 99.1 55.2 -78.0 -56.9 -6.0 -0.4 -1.7 52 53 A Y H ><5S+ 0 0 54 -4,-1.9 3,-1.3 1,-0.3 -1,-0.2 0.705 97.2 73.2 -49.9 -17.9 -3.2 2.1 -2.6 53 54 A A H 3<5S+ 0 0 2 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.916 91.4 51.4 -64.4 -43.8 -3.7 0.6 -6.1 54 55 A F T <<5S- 0 0 95 -3,-2.1 -1,-0.3 -4,-0.5 -2,-0.2 0.265 133.3 -94.0 -77.5 14.5 -7.0 2.4 -6.6 55 56 A G T < 5 + 0 0 31 -3,-1.3 2,-3.1 1,-0.2 -3,-0.2 0.814 61.9 173.4 77.5 31.5 -5.2 5.6 -5.6 56 57 A G > < + 0 0 10 -5,-1.0 3,-0.5 1,-0.2 2,-0.2 -0.341 10.0 159.7 -71.4 65.4 -6.2 5.2 -2.0 57 58 A T T 3 + 0 0 99 -2,-3.1 3,-0.4 1,-0.2 -1,-0.2 0.025 23.6 132.0 -78.6 31.1 -4.0 8.2 -0.9 58 59 A D T 3 S- 0 0 120 1,-0.2 2,-0.3 -2,-0.2 -1,-0.2 0.936 85.0 -10.7 -46.8 -56.7 -6.1 8.4 2.2 59 60 A R S < S+ 0 0 212 -3,-0.5 -1,-0.2 1,-0.1 -3,-0.0 -0.811 83.4 124.3-152.9 106.0 -3.1 8.7 4.4 60 61 A F + 0 0 84 -3,-0.4 2,-1.1 -2,-0.3 3,-0.1 -0.251 12.5 162.4-159.6 59.5 0.5 8.0 3.2 61 62 A P - 0 0 106 0, 0.0 3,-0.0 0, 0.0 -4,-0.0 -0.007 46.0-135.6 -74.3 34.5 2.8 11.0 3.9 62 63 A G S > S+ 0 0 16 -2,-1.1 2,-3.2 1,-0.2 3,-0.9 -0.164 74.6 104.9 47.1-130.9 5.8 8.6 3.4 63 64 A R T 3> S+ 0 0 204 1,-0.3 4,-1.5 -3,-0.1 -1,-0.2 -0.300 94.2 38.0 61.0 -73.6 8.3 9.2 6.1 64 65 A S H 3> S+ 0 0 64 -2,-3.2 4,-3.7 1,-0.2 -1,-0.3 0.862 108.0 65.0 -73.3 -36.6 7.4 6.0 7.9 65 66 A M H <> S+ 0 0 57 -3,-0.9 4,-2.2 2,-0.2 -1,-0.2 0.907 105.0 45.6 -52.0 -45.5 6.9 4.1 4.7 66 67 A R H > S+ 0 0 98 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.981 115.5 43.8 -62.8 -58.9 10.6 4.5 3.9 67 68 A A H X S+ 0 0 46 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.921 112.9 53.6 -52.4 -48.3 11.8 3.5 7.4 68 69 A A H < S+ 0 0 55 -4,-3.7 4,-0.2 1,-0.3 -1,-0.2 0.922 117.2 36.5 -53.5 -47.8 9.3 0.7 7.5 69 70 A H H >X S+ 0 0 44 -4,-2.2 4,-1.4 -5,-0.3 3,-1.1 0.714 106.8 70.6 -78.2 -20.9 10.6 -0.7 4.2 70 71 A Q H 3X S+ 0 0 87 -4,-2.6 4,-1.3 1,-0.3 -2,-0.2 0.901 85.6 65.2 -62.0 -41.5 14.2 0.3 5.1 71 72 A D H 3X S+ 0 0 100 -4,-1.8 4,-1.3 1,-0.2 5,-0.3 0.760 102.8 52.3 -52.9 -24.0 14.3 -2.4 7.8 72 73 A L H <> S+ 0 0 59 -3,-1.1 4,-1.4 -4,-0.2 3,-0.4 0.970 102.0 52.4 -77.0 -59.0 14.1 -4.8 4.8 73 74 A V H < S+ 0 0 64 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.704 109.1 58.3 -50.9 -18.0 16.9 -3.4 2.6 74 75 A E H < S+ 0 0 127 -4,-1.3 -1,-0.2 3,-0.1 -2,-0.2 0.946 125.6 11.6 -78.1 -52.2 18.9 -3.9 5.8 75 76 A N H < S+ 0 0 128 -4,-1.3 2,-0.3 -3,-0.4 -2,-0.2 0.923 127.5 51.2 -89.9 -60.3 18.4 -7.6 6.3 76 77 A A S < S- 0 0 28 -4,-1.4 2,-2.2 -5,-0.3 -1,-0.1 -0.613 84.0-125.5 -83.0 138.8 16.8 -8.7 3.0 77 78 A G - 0 0 62 -2,-0.3 -4,-0.1 -3,-0.1 -1,-0.1 -0.418 40.0-174.1 -81.2 64.9 18.6 -7.8 -0.2 78 79 A L + 0 0 37 -2,-2.2 2,-0.2 -6,-0.1 3,-0.1 -0.231 7.0 172.2 -59.7 149.3 15.5 -6.2 -1.7 79 80 A T > - 0 0 53 1,-0.1 4,-0.6 0, 0.0 -1,-0.1 -0.772 44.3 -95.5-144.4-172.0 15.8 -5.0 -5.3 80 81 A D H >> S+ 0 0 60 -2,-0.2 3,-2.0 2,-0.2 4,-1.7 0.954 114.8 62.6 -78.0 -54.5 13.8 -3.6 -8.2 81 82 A V H 3> S+ 0 0 102 1,-0.3 4,-0.8 2,-0.2 -1,-0.2 0.699 100.7 61.7 -45.0 -17.6 13.0 -6.9 -10.1 82 83 A H H 3> S+ 0 0 56 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.888 100.8 48.0 -78.0 -41.1 11.2 -7.7 -6.8 83 84 A F H X S+ 0 0 105 -4,-1.7 4,-1.8 -3,-0.5 3,-0.7 0.953 102.5 59.6 -64.3 -51.0 2.7 -8.2 -12.2 89 90 A N H 3X S+ 0 0 17 -4,-2.0 4,-1.2 1,-0.3 -1,-0.2 0.870 102.2 55.8 -44.7 -43.1 0.8 -10.7 -10.0 90 91 A L H >X S+ 0 0 12 -4,-1.4 4,-1.8 1,-0.2 3,-0.8 0.925 103.4 53.7 -57.5 -46.4 -1.7 -7.9 -9.4 91 92 A V H S+ 0 0 17 -4,-1.8 5,-1.2 1,-0.2 -1,-0.2 0.749 106.9 62.0 -68.7 -22.9 -7.7 -8.1 -12.4 95 96 A Q H ><5S+ 0 0 90 -4,-1.1 3,-0.7 -5,-0.2 -1,-0.2 0.768 99.2 55.0 -73.2 -25.5 -7.5 -10.4 -15.5 96 97 A E H <<5S+ 0 0 106 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.817 100.2 58.3 -76.2 -31.5 -9.3 -13.1 -13.6 97 98 A L T 3<5S- 0 0 78 -4,-1.0 -1,-0.2 2,-0.1 -2,-0.2 0.419 117.4-115.3 -78.0 3.6 -12.2 -10.8 -12.6 98 99 A N T < 5 + 0 0 150 -3,-0.7 2,-0.4 1,-0.2 -3,-0.2 0.968 56.6 164.5 61.3 56.2 -12.7 -10.4 -16.4 99 100 A V < - 0 0 56 -5,-1.2 -1,-0.2 1,-0.1 5,-0.1 -0.903 41.3-105.0-109.5 132.2 -11.9 -6.6 -16.4 100 101 A S > - 0 0 59 -2,-0.4 4,-1.0 1,-0.1 -1,-0.1 0.050 25.0-123.7 -45.6 160.8 -11.1 -4.8 -19.7 101 102 A Q H > S+ 0 0 90 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.915 106.1 64.6 -77.1 -45.6 -7.4 -3.9 -20.3 102 103 A D H > S+ 0 0 114 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.859 107.5 44.8 -44.9 -40.9 -8.0 -0.2 -20.7 103 104 A L H > S+ 0 0 89 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.872 112.4 50.1 -73.0 -37.8 -9.1 -0.1 -17.1 104 105 A I H X S+ 0 0 3 -4,-1.0 4,-1.3 -3,-0.2 -2,-0.2 0.737 104.2 62.0 -72.0 -22.0 -6.1 -2.3 -16.0 105 106 A D H X S+ 0 0 76 -4,-2.6 4,-1.1 2,-0.2 -1,-0.2 0.915 101.1 49.9 -69.5 -43.7 -3.8 -0.0 -17.9 106 107 A E H X S+ 0 0 124 -4,-1.2 4,-1.7 -5,-0.2 3,-0.3 0.877 104.2 60.4 -62.4 -38.0 -4.7 3.0 -15.7 107 108 A V H X S+ 0 0 24 -4,-1.2 4,-1.9 1,-0.2 5,-0.3 0.922 99.5 55.2 -55.6 -46.7 -4.1 0.9 -12.6 108 109 A V H X S+ 0 0 73 -4,-1.3 4,-1.2 1,-0.2 -1,-0.2 0.869 104.0 56.7 -55.0 -37.9 -0.4 0.3 -13.6 109 110 A T H < S+ 0 0 102 -4,-1.1 3,-0.3 -3,-0.3 -1,-0.2 0.960 103.6 51.6 -59.0 -53.7 -0.0 4.1 -13.8 110 111 A I H >< S+ 0 0 56 -4,-1.7 3,-1.1 1,-0.3 -2,-0.2 0.946 120.4 33.6 -47.9 -59.0 -1.1 4.6 -10.2 111 112 A V H 3< S+ 0 0 17 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.624 104.4 78.3 -73.5 -12.1 1.4 2.1 -8.9 112 113 A G T 3< + 0 0 49 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.309 67.2 137.1 -78.9 11.1 3.7 3.1 -11.7 113 114 A S <> - 0 0 40 -3,-1.1 4,-1.1 1,-0.1 5,-0.1 -0.315 52.9-146.6 -60.3 138.4 4.6 6.1 -9.6 114 115 A V H > S+ 0 0 101 2,-0.2 4,-2.3 3,-0.1 -1,-0.1 0.812 96.1 54.8 -76.1 -30.9 8.3 6.9 -9.6 115 116 A Q H > S+ 0 0 140 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.988 105.3 48.7 -65.5 -61.0 8.1 8.2 -6.0 116 117 A H H > S+ 0 0 41 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.866 115.4 47.9 -46.8 -40.7 6.6 5.1 -4.4 117 118 A R H X S+ 0 0 114 -4,-1.1 4,-1.5 1,-0.2 3,-0.4 0.916 108.4 52.4 -68.2 -43.9 9.2 3.1 -6.2 118 119 A N H X S+ 0 0 73 -4,-2.3 4,-0.8 1,-0.2 5,-0.5 0.796 104.2 59.6 -62.4 -27.7 12.0 5.4 -5.1 119 120 A D H < S+ 0 0 13 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.882 99.9 55.4 -68.3 -38.6 10.8 4.9 -1.5 120 121 A V H < S+ 0 0 15 -4,-1.2 -47,-0.2 -3,-0.4 -2,-0.2 0.945 112.1 41.3 -59.4 -50.0 11.3 1.2 -1.7 121 122 A L H < S- 0 0 51 -4,-1.5 -1,-0.2 -48,-0.0 -2,-0.2 0.649 108.6-137.2 -72.5 -14.1 15.0 1.6 -2.7 122 123 A N < 0 0 36 -4,-0.8 -3,-0.2 -5,-0.2 -2,-0.1 0.937 360.0 360.0 54.2 95.3 15.2 4.4 -0.1 123 124 A R 0 0 255 -5,-0.5 -1,-0.1 0, 0.0 -2,-0.0 -0.911 360.0 360.0-152.8 360.0 17.2 7.2 -1.7