==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 18-APR-11 3RKL . COMPND 2 MOLECULE: STIV-A81; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS TURRETED ICOSAHEDRAL VIRUS; . AUTHOR N.G.LINTNER,E.T.LARSON,M.J.YOUNG,C.M.LAWRENCE . 320 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18120.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 77.8 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 . 42 13.1 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 . 8 2.5 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 . 16 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 180 56.2 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+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 4 0 0 0 4 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 4 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 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 S 0 0 181 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 171.0 2.9 79.3 63.9 2 3 A K - 0 0 181 2,-0.0 2,-0.5 0, 0.0 0, 0.0 -0.995 360.0-157.9-137.9 133.0 -0.4 78.9 65.8 3 4 A I - 0 0 106 -2,-0.4 2,-0.5 2,-0.0 0, 0.0 -0.947 15.2-162.5-105.6 128.3 -3.3 76.5 65.8 4 5 A T - 0 0 82 -2,-0.5 2,-0.5 2,-0.0 -2,-0.0 -0.950 5.7-169.8-116.9 126.6 -6.6 77.8 67.1 5 6 A I - 0 0 56 -2,-0.5 2,-0.4 9,-0.1 9,-0.1 -0.963 10.9-152.7-114.9 121.1 -9.4 75.5 68.2 6 7 A N E -A 13 0A 90 7,-1.7 7,-3.0 -2,-0.5 2,-0.5 -0.778 8.6-167.6 -97.8 135.3 -12.8 77.1 69.0 7 8 A I E -A 12 0A 68 -2,-0.4 2,-0.6 5,-0.2 5,-0.2 -0.986 9.7-178.1-127.1 119.1 -15.2 75.5 71.4 8 9 A K E > -A 11 0A 129 3,-2.4 3,-1.9 -2,-0.5 2,-0.4 -0.946 67.6 -60.5-115.1 103.9 -18.8 76.5 71.8 9 10 A D T 3 S- 0 0 151 -2,-0.6 64,-0.0 1,-0.3 0, 0.0 -0.438 122.3 -13.2 60.9-110.8 -20.4 74.4 74.5 10 11 A N T 3 S+ 0 0 70 -2,-0.4 11,-2.9 -3,-0.1 2,-0.4 0.144 120.3 92.8-106.0 19.4 -20.1 70.8 73.2 11 12 A T E < -AB 8 20A 21 -3,-1.9 -3,-2.4 9,-0.2 2,-0.4 -0.929 61.2-148.2-120.5 135.3 -19.1 71.7 69.6 12 13 A I E -AB 7 19A 0 7,-3.1 7,-2.9 -2,-0.4 2,-0.5 -0.863 10.2-158.0-100.1 135.7 -15.7 72.2 68.1 13 14 A E E +AB 6 18A 45 -7,-3.0 -7,-1.7 -2,-0.4 2,-0.3 -0.971 31.0 137.0-116.5 121.9 -15.3 74.7 65.3 14 15 A Y E > - B 0 17A 60 3,-2.5 3,-2.3 -2,-0.5 -9,-0.1 -0.948 58.2 -1.3-163.4 142.3 -12.4 74.3 63.0 15 16 A G T 3 S- 0 0 51 1,-0.3 3,-0.1 -2,-0.3 47,-0.0 0.811 126.0 -48.2 44.7 50.4 -11.4 74.4 59.2 16 17 A H T 3 S+ 0 0 209 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.529 121.8 97.8 72.0 9.9 -14.9 75.3 57.8 17 18 A K E < -B 14 0A 97 -3,-2.3 -3,-2.5 2,-0.0 2,-0.4 -0.887 59.3-148.0-130.0 157.1 -16.5 72.5 59.9 18 19 A E E -B 13 0A 135 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.987 13.3-165.4-122.8 135.7 -18.4 72.0 63.2 19 20 A F E -B 12 0A 17 -7,-2.9 -7,-3.1 -2,-0.4 2,-0.5 -0.976 6.3-153.1-130.4 118.8 -18.1 68.8 65.3 20 21 A V E -B 11 0A 84 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.794 3.9-154.7 -98.7 125.1 -20.5 67.9 68.1 21 22 A L + 0 0 3 -11,-2.9 3,-0.1 -2,-0.5 -11,-0.0 -0.732 19.6 167.2 -93.4 143.9 -19.4 65.7 71.0 22 23 A S S S+ 0 0 112 -2,-0.3 2,-0.2 1,-0.2 -1,-0.1 0.550 74.0 25.7-130.0 -22.7 -22.1 63.7 72.9 23 24 A N > - 0 0 82 1,-0.1 4,-3.4 2,-0.0 3,-0.3 -0.719 66.2-168.6-145.5 92.1 -20.3 61.2 75.1 24 25 A L H > S+ 0 0 33 1,-0.2 4,-2.9 -2,-0.2 5,-0.3 0.871 84.2 51.8 -56.3 -47.0 -16.8 62.4 75.9 25 26 A Q H > S+ 0 0 99 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.915 119.8 36.1 -55.8 -45.5 -15.4 59.2 77.4 26 27 A E H > S+ 0 0 72 -3,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.900 116.0 53.3 -75.9 -42.9 -16.5 57.2 74.4 27 28 A D H X S+ 0 0 5 -4,-3.4 4,-2.9 1,-0.2 5,-0.2 0.870 106.3 53.6 -61.4 -39.1 -15.8 59.9 71.8 28 29 A I H X S+ 0 0 27 -4,-2.9 4,-2.2 -5,-0.3 -1,-0.2 0.951 111.7 44.6 -63.1 -46.7 -12.2 60.3 73.1 29 30 A K H X S+ 0 0 109 -4,-1.3 4,-2.1 -5,-0.3 -2,-0.2 0.945 116.3 47.2 -59.5 -47.9 -11.5 56.6 72.6 30 31 A N H X S+ 0 0 25 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.902 112.3 48.2 -63.1 -43.5 -13.2 56.5 69.2 31 32 A L H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 -1,-0.2 0.889 110.5 51.8 -66.7 -38.4 -11.4 59.6 67.9 32 33 A A H X S+ 0 0 45 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.907 110.4 49.1 -63.1 -41.8 -8.0 58.3 69.1 33 34 A E H X S+ 0 0 72 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.898 110.5 50.5 -62.8 -42.9 -8.7 55.0 67.3 34 35 A I H X S+ 0 0 1 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.923 111.2 48.2 -61.6 -45.9 -9.6 56.9 64.1 35 36 A V H X S+ 0 0 30 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.936 113.1 47.8 -60.9 -46.2 -6.5 59.0 64.3 36 37 A Y H X S+ 0 0 144 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.934 112.9 48.5 -58.6 -48.5 -4.3 55.9 64.8 37 38 A Q H X S+ 0 0 35 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.887 111.3 49.8 -62.3 -40.4 -6.1 54.1 61.9 38 39 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.936 111.5 48.8 -63.1 -45.2 -5.6 57.0 59.6 39 40 A A H X S+ 0 0 45 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.910 113.0 47.0 -62.2 -42.2 -2.0 57.3 60.4 40 41 A K H X S+ 0 0 66 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.854 110.8 52.3 -68.5 -36.1 -1.4 53.6 59.9 41 42 A L H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.902 108.5 50.4 -65.5 -43.4 -3.3 53.6 56.6 42 43 A I H X S+ 0 0 14 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.933 110.4 51.4 -59.2 -43.8 -1.2 56.5 55.3 43 44 A E H < S+ 0 0 113 -4,-2.0 4,-0.4 1,-0.2 -2,-0.2 0.915 113.0 44.0 -58.2 -46.2 1.9 54.5 56.3 44 45 A K H >< S+ 0 0 40 -4,-2.1 3,-1.2 1,-0.2 4,-0.4 0.900 112.3 51.1 -70.7 -40.4 0.8 51.4 54.4 45 46 A L H >X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 3,-1.6 0.835 98.6 68.6 -65.1 -30.6 -0.4 53.3 51.3 46 47 A S T 3< S+ 0 0 58 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.701 85.0 69.9 -63.7 -20.1 3.0 55.0 51.2 47 48 A Q T <4 S+ 0 0 88 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.805 118.8 18.5 -59.5 -32.8 4.6 51.6 50.3 48 49 A Y T <4 S+ 0 0 59 -3,-1.6 2,-0.6 -4,-0.4 -2,-0.2 0.627 115.4 71.4-115.6 -23.5 2.9 51.9 46.9 49 50 A E < - 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