==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 20-MAR-07 2EJQ . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN TTHA0227; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR P.H.REHSE,S.YOKOYAMA,RIKEN STRUCTURAL GENOMICS/PROTEOMICS . 222 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12334.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 158 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 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 . 1 0.5 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 . 11 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 39.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 2 0 0 0 0 1 0 1 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 2 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 . 3 0 0 2 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 2 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 T > 0 0 111 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 160.7 11.2 -23.7 -24.7 2 3 A Y H > + 0 0 61 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.856 360.0 55.0 -63.9 -36.4 11.2 -24.4 -21.0 3 4 A E H > S+ 0 0 131 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.914 108.9 47.3 -62.9 -45.0 14.7 -23.1 -20.7 4 5 A A H > S+ 0 0 51 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.840 110.5 53.2 -66.2 -33.7 13.7 -19.8 -22.3 5 6 A F H X S+ 0 0 6 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.932 108.4 48.9 -66.1 -47.5 10.7 -19.6 -20.0 6 7 A V H X S+ 0 0 34 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.915 111.4 50.9 -57.2 -44.9 12.8 -20.1 -16.8 7 8 A E H X S+ 0 0 138 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.819 109.3 50.1 -62.8 -35.7 15.2 -17.4 -18.1 8 9 A L H X S+ 0 0 25 -4,-1.6 4,-2.5 2,-0.2 5,-0.3 0.914 109.3 51.8 -70.5 -42.4 12.3 -15.0 -18.7 9 10 A V H X S+ 0 0 2 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.921 111.9 45.5 -59.3 -47.0 10.9 -15.5 -15.2 10 11 A E H X S+ 0 0 116 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.866 111.5 52.4 -65.5 -38.0 14.3 -14.8 -13.6 11 12 A R H X S+ 0 0 119 -4,-1.7 4,-0.6 2,-0.2 -2,-0.2 0.913 115.7 40.2 -66.7 -42.6 14.8 -11.7 -15.8 12 13 A L H >X S+ 0 0 0 -4,-2.5 3,-1.0 1,-0.2 4,-0.8 0.892 111.7 57.6 -72.3 -39.1 11.4 -10.3 -14.8 13 14 A W H >< S+ 0 0 31 -4,-2.9 3,-0.9 1,-0.3 -2,-0.2 0.875 101.8 55.8 -59.8 -38.0 11.8 -11.4 -11.2 14 15 A E H 3< S+ 0 0 140 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.732 98.0 62.2 -67.2 -22.7 15.0 -9.4 -10.9 15 16 A E H << S+ 0 0 62 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 0.757 83.5 100.3 -72.3 -23.8 13.2 -6.2 -11.9 16 17 A V S << S- 0 0 2 -3,-0.9 5,-0.1 -4,-0.8 -3,-0.0 -0.497 90.2-102.7 -69.0 121.6 11.0 -6.6 -8.8 17 18 A P >> - 0 0 26 0, 0.0 3,-1.7 0, 0.0 4,-0.5 -0.138 25.8-129.4 -45.3 126.6 12.2 -4.3 -6.0 18 19 A E G >4 S+ 0 0 134 1,-0.3 3,-1.8 2,-0.2 4,-0.1 0.844 102.6 62.3 -49.7 -43.4 14.2 -6.2 -3.3 19 20 A D G >4 S+ 0 0 79 1,-0.3 3,-0.9 2,-0.2 -1,-0.3 0.727 96.0 60.5 -61.3 -20.8 12.1 -5.0 -0.4 20 21 A F G <4 S+ 0 0 0 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.710 98.6 59.8 -76.2 -20.6 8.9 -6.6 -1.7 21 22 A K G X< S+ 0 0 15 -3,-1.8 3,-2.2 -4,-0.5 -1,-0.2 0.335 72.5 133.5 -90.8 8.3 10.7 -10.0 -1.5 22 23 A R T < S+ 0 0 111 -3,-0.9 3,-0.1 1,-0.3 -3,-0.0 -0.362 78.4 13.1 -62.7 128.9 11.3 -9.9 2.2 23 24 A G T 3 S+ 0 0 42 1,-0.2 2,-0.5 -2,-0.1 42,-0.3 0.361 105.0 110.7 88.5 -8.2 10.3 -13.1 3.8 24 25 A L < - 0 0 18 -3,-2.2 -1,-0.2 1,-0.1 42,-0.2 -0.894 52.8-161.8-106.5 125.3 10.2 -14.8 0.4 25 26 A Q - 0 0 141 40,-2.0 2,-0.3 -2,-0.5 41,-0.2 0.885 55.6 -91.4 -69.9 -41.0 12.8 -17.4 -0.5 26 27 A G E -a 66 0A 16 39,-1.1 41,-1.8 2,-0.0 2,-0.4 -0.956 43.4 -50.1 156.7-174.9 12.0 -17.2 -4.2 27 28 A V E -a 67 0A 31 -2,-0.3 2,-0.4 39,-0.2 41,-0.2 -0.816 38.7-157.7 -99.7 129.5 10.2 -18.3 -7.4 28 29 A H E -a 68 0A 79 39,-3.6 41,-2.6 -2,-0.4 2,-0.5 -0.896 5.2-157.3-105.8 133.9 10.0 -22.0 -8.4 29 30 A V E -a 69 0A 30 -2,-0.4 41,-0.2 39,-0.2 39,-0.1 -0.949 9.2-171.5-116.0 125.7 9.4 -23.0 -12.0 30 31 A F E -a 70 0A 75 39,-2.9 41,-3.1 -2,-0.5 42,-0.4 -0.888 24.5-142.2-115.6 146.1 7.9 -26.3 -12.9 31 32 A P S S+ 0 0 65 0, 0.0 41,-0.2 0, 0.0 -1,-0.1 0.757 75.7 90.8 -73.8 -26.7 7.5 -27.9 -16.3 32 33 A E S S- 0 0 117 39,-0.2 40,-1.1 40,-0.1 41,-0.7 -0.211 73.5-124.5 -73.3 162.4 4.1 -29.5 -15.5 33 34 A A - 0 0 36 39,-0.4 38,-0.1 38,-0.2 -1,-0.1 -0.626 16.4-151.8 -98.3 160.3 0.7 -28.0 -15.9 34 35 A K - 0 0 60 10,-0.3 10,-3.1 -2,-0.2 36,-0.1 -0.869 4.9-150.2-140.7 106.2 -1.8 -27.6 -13.1 35 36 A P B -C 43 0B 61 0, 0.0 8,-0.2 0, 0.0 5,-0.1 -0.304 31.3-108.3 -66.7 156.5 -5.6 -27.7 -13.8 36 37 A E - 0 0 55 6,-2.4 3,-0.4 3,-0.2 6,-0.2 -0.822 51.5-106.0 -85.4 115.3 -7.7 -25.7 -11.3 37 38 A P S S- 0 0 91 0, 0.0 2,-1.7 0, 0.0 -1,-0.1 -0.046 88.6 -5.5 -46.1 137.5 -9.4 -28.5 -9.4 38 39 A G S S+ 0 0 57 1,-0.1 2,-0.9 -3,-0.0 -2,-0.0 -0.188 117.2 81.4 75.1 -46.5 -13.1 -29.3 -10.1 39 40 A L S > S- 0 0 128 -2,-1.7 3,-0.5 -3,-0.4 -3,-0.2 -0.472 75.3-159.5 -95.0 65.7 -13.6 -26.4 -12.5 40 41 A E T 3 + 0 0 145 -2,-0.9 3,-0.1 1,-0.2 0, 0.0 0.021 64.2 45.6 -54.9 143.6 -12.2 -27.6 -15.8 41 42 A G T 3 S+ 0 0 70 1,-0.3 2,-0.4 -5,-0.0 -1,-0.2 0.153 95.6 99.8 109.2 -7.1 -10.9 -25.8 -18.9 42 43 A V < - 0 0 75 -3,-0.5 -6,-2.4 -6,-0.2 2,-0.4 -0.928 56.6-161.2-115.1 131.5 -9.1 -23.5 -16.5 43 44 A W B -C 35 0B 75 -2,-0.4 2,-0.7 -8,-0.2 -10,-0.0 -0.889 18.9-128.2-114.5 142.6 -5.4 -23.8 -15.7 44 45 A R - 0 0 61 -10,-3.1 -10,-0.3 -2,-0.4 29,-0.2 -0.793 17.2-169.7 -88.1 114.4 -3.5 -22.3 -12.8 45 46 A L - 0 0 30 -2,-0.7 25,-2.6 1,-0.2 2,-0.3 0.791 66.7 -24.7 -73.5 -29.2 -0.5 -20.4 -14.1 46 47 A G E -B 69 0A 5 23,-0.3 2,-0.3 -12,-0.1 23,-0.2 -0.973 57.6-161.2-167.4 177.9 1.1 -20.0 -10.6 47 48 A E E -B 68 0A 34 21,-2.1 21,-3.3 -2,-0.3 2,-0.5 -0.986 27.2-104.7-167.4 163.2 0.5 -19.9 -6.9 48 49 A Y E -B 67 0A 27 -2,-0.3 2,-0.9 19,-0.2 19,-0.2 -0.831 27.1-143.4 -97.6 130.2 1.9 -18.9 -3.5 49 50 A L E -B 66 0A 54 17,-4.0 17,-1.3 -2,-0.5 3,-0.1 -0.826 21.7-168.5 -97.0 104.5 3.2 -21.7 -1.4 50 51 A D - 0 0 76 -2,-0.9 15,-0.1 15,-0.2 11,-0.0 -0.841 23.1-148.8-101.6 120.3 2.3 -20.7 2.2 51 52 A P - 0 0 20 0, 0.0 -1,-0.1 0, 0.0 10,-0.1 0.880 43.1-164.8 -49.4 -41.1 3.8 -22.7 5.2 52 53 A G - 0 0 30 -3,-0.1 8,-0.4 7,-0.0 9,-0.1 -0.299 32.3 -15.4 86.0-171.7 0.6 -22.0 7.0 53 54 A P S S- 0 0 108 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.299 77.6 -98.6 -67.9 151.5 -0.2 -22.3 10.7 54 55 A P - 0 0 98 0, 0.0 5,-0.3 0, 0.0 2,-0.1 -0.213 32.5-130.0 -65.9 159.3 2.1 -24.2 13.1 55 56 A S B > -D 58 0C 54 3,-3.1 3,-0.7 1,-0.1 5,-0.0 -0.406 32.5 -98.2 -98.0-177.5 1.4 -27.8 14.1 56 57 A A T 3 S+ 0 0 99 1,-0.2 3,-0.1 -2,-0.1 -1,-0.1 0.789 127.4 46.9 -69.6 -27.5 1.4 -29.1 17.7 57 58 A F T 3 S- 0 0 204 1,-0.3 -1,-0.2 0, 0.0 2,-0.2 0.349 129.1 -48.4 -96.3 2.5 4.9 -30.3 17.0 58 59 A G B < -D 55 0C 33 -3,-0.7 -3,-3.1 2,-0.0 -1,-0.3 -0.652 57.0 -83.1 144.3 159.0 6.3 -27.2 15.3 59 60 A G - 0 0 52 -5,-0.3 3,-0.2 -2,-0.2 -7,-0.0 -0.354 28.0-133.3 -85.1 171.3 5.8 -24.5 12.7 60 61 A F > + 0 0 83 -8,-0.4 3,-2.2 1,-0.1 4,-0.4 0.196 69.4 113.0-111.4 15.4 6.6 -24.8 9.0 61 62 A E G > + 0 0 77 1,-0.3 3,-1.7 2,-0.2 -1,-0.1 0.785 67.0 71.5 -59.2 -25.8 8.5 -21.6 8.4 62 63 A D G 3 S+ 0 0 177 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.693 88.8 64.3 -62.4 -17.9 11.7 -23.6 7.7 63 64 A L G < S- 0 0 114 -3,-2.2 -1,-0.3 1,-0.1 -2,-0.2 0.758 103.7-146.2 -74.8 -25.2 10.0 -24.7 4.5 64 65 A G < - 0 0 8 -3,-1.7 2,-0.5 -4,-0.4 -1,-0.1 -0.095 15.6 -76.9 82.9 172.9 10.1 -21.1 3.4 65 66 A R + 0 0 8 -42,-0.3 -40,-2.0 -15,-0.1 -39,-1.1 -0.948 52.9 178.0-114.9 132.8 7.7 -19.1 1.3 66 67 A H E -aB 26 49A 32 -17,-1.3 -17,-4.0 -2,-0.5 2,-0.5 -0.941 30.9-140.7-136.9 156.7 7.6 -19.5 -2.5 67 68 A I E -aB 27 48A 0 -41,-1.8 -39,-3.6 -2,-0.3 2,-0.4 -0.953 28.1-156.8-109.9 129.2 5.9 -18.5 -5.6 68 69 A A E -aB 28 47A 0 -21,-3.3 -21,-2.1 -2,-0.5 2,-0.4 -0.915 6.1-163.2-111.5 140.4 5.4 -21.4 -8.0 69 70 A L E -aB 29 46A 0 -41,-2.6 -39,-2.9 -2,-0.4 2,-0.7 -0.959 9.2-148.5-119.9 138.9 5.0 -21.1 -11.8 70 71 A Y E >> -a 30 0A 27 -25,-2.6 4,-1.4 -2,-0.4 3,-0.6 -0.881 8.3-171.0-112.0 101.6 3.6 -23.9 -14.0 71 72 A Y H 3> S+ 0 0 28 -41,-3.1 4,-1.9 -2,-0.7 -38,-0.2 0.880 86.8 57.6 -56.8 -39.9 5.1 -23.8 -17.5 72 73 A G H 3> S+ 0 0 9 -40,-1.1 4,-2.2 -42,-0.4 -39,-0.4 0.844 102.6 53.5 -61.4 -34.8 2.6 -26.5 -18.7 73 74 A S H <> S+ 0 0 0 -41,-0.7 4,-1.9 -3,-0.6 -1,-0.2 0.884 107.0 52.2 -67.1 -38.0 -0.3 -24.3 -17.7 74 75 A F H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.898 109.5 49.7 -62.5 -43.4 1.0 -21.4 -19.7 75 76 A L H < S+ 0 0 82 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.932 108.1 53.1 -61.8 -46.8 1.4 -23.7 -22.8 76 77 A E H < S+ 0 0 117 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.909 117.4 37.0 -55.8 -45.6 -2.2 -25.0 -22.4 77 78 A V H < S+ 0 0 65 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.745 95.4 105.0 -80.1 -24.1 -3.6 -21.5 -22.4 78 79 A A < + 0 0 31 -4,-2.2 2,-0.2 -5,-0.2 3,-0.1 -0.345 40.8 154.6 -66.0 134.6 -1.2 -20.0 -24.9 79 80 A G > - 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