==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 12-DEC-04 1WV8 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN TTHA1013; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR E.MIZOHATA,M.HATTORI,S.KURAMITSU,M.SHIROUZU,S.YOKOYAMA,RIKEN . 71 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5323.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 44 62.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 12.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.4 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 . 9 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 22.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.4 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 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 PARALLEL BRIDGES PER LADDER . 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 R 0 0 156 0, 0.0 59,-2.7 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0-102.8 -5.9 10.3 47.6 2 3 A T E -a 60 0A 14 57,-0.2 2,-0.7 59,-0.1 59,-0.2 -0.908 360.0-158.1-106.3 122.4 -4.1 12.3 50.3 3 4 A L E -a 61 0A 8 57,-2.7 59,-2.7 -2,-0.5 2,-0.5 -0.892 11.7-147.9-102.2 112.7 -0.9 14.0 49.4 4 5 A K E -a 62 0A 82 -2,-0.7 18,-0.6 57,-0.2 2,-0.4 -0.685 18.5-179.4 -84.0 126.5 1.3 14.7 52.4 5 6 A V E -a 63 0A 0 57,-2.6 59,-3.2 -2,-0.5 2,-0.4 -0.994 16.5-143.3-127.6 126.7 3.4 17.8 52.1 6 7 A Q E -aB 64 19A 67 13,-3.4 13,-2.1 -2,-0.4 2,-0.6 -0.719 2.7-153.1 -92.9 141.2 5.8 19.0 54.9 7 8 A A E - B 0 18A 4 57,-3.0 2,-0.5 -2,-0.4 59,-0.5 -0.965 14.9-165.3-111.3 117.2 6.3 22.7 55.6 8 9 A L E - B 0 17A 90 9,-2.5 9,-2.9 -2,-0.6 2,-0.4 -0.910 17.5-128.0-108.1 127.9 9.7 23.2 57.1 9 10 A W E - B 0 16A 142 -2,-0.5 2,-0.7 7,-0.2 7,-0.2 -0.624 17.6-167.2 -80.3 128.2 10.5 26.5 58.9 10 11 A D E >> - B 0 15A 63 5,-2.6 5,-1.4 -2,-0.4 4,-1.1 -0.792 5.8-178.3-114.8 83.9 13.6 28.2 57.7 11 12 A G T 45S+ 0 0 48 -2,-0.7 3,-0.2 1,-0.2 -1,-0.2 0.816 79.0 55.1 -52.1 -38.8 14.2 30.9 60.3 12 13 A E T 45S+ 0 0 196 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.974 117.0 34.6 -61.6 -53.2 17.3 32.3 58.6 13 14 A A T 45S- 0 0 63 2,-0.2 -1,-0.2 -3,-0.1 -2,-0.2 0.479 106.6-127.8 -80.3 -2.6 15.5 32.9 55.3 14 15 A G T <5 + 0 0 34 -4,-1.1 2,-0.3 1,-0.2 -3,-0.2 0.900 69.5 103.9 57.3 45.3 12.3 33.8 57.0 15 16 A V E < -B 10 0A 26 -5,-1.4 -5,-2.6 -7,-0.1 2,-0.4 -0.992 69.8-119.6-153.9 156.8 10.1 31.3 55.1 16 17 A W E -BC 9 30A 50 14,-2.8 14,-1.7 -2,-0.3 2,-0.5 -0.821 33.2-148.7 -95.4 138.0 8.3 28.0 55.3 17 18 A V E -BC 8 29A 45 -9,-2.9 -9,-2.5 -2,-0.4 12,-0.2 -0.940 6.3-131.9-117.8 128.9 9.6 25.5 52.7 18 19 A A E +B 7 0A 2 10,-3.5 10,-0.5 -2,-0.5 2,-0.3 -0.515 26.3 174.7 -80.1 140.3 7.5 22.8 51.1 19 20 A E E +B 6 0A 98 -13,-2.1 -13,-3.4 -2,-0.2 2,-0.4 -0.986 2.2 174.3-144.0 130.0 8.8 19.2 50.9 20 21 A S - 0 0 13 -2,-0.3 6,-0.3 6,-0.3 -15,-0.1 -0.968 30.6-171.8-147.7 133.5 7.0 16.2 49.6 21 22 A D S S+ 0 0 155 -17,-0.4 -1,-0.1 -2,-0.4 -16,-0.1 0.575 99.5 50.8 -89.2 -12.8 7.7 12.5 48.9 22 23 A D S S+ 0 0 76 -18,-0.6 -1,-0.2 1,-0.2 -17,-0.1 0.632 104.4 62.5 -97.0 -18.6 4.2 12.2 47.2 23 24 A V S > S- 0 0 4 -19,-0.2 3,-0.8 3,-0.1 -3,-0.3 -0.939 81.6-133.0-116.6 117.3 4.6 15.2 44.9 24 25 A P T 3 S+ 0 0 55 0, 0.0 27,-0.1 0, 0.0 -3,-0.1 -0.294 80.2 1.0 -66.7 145.4 7.4 15.3 42.2 25 26 A G T 3 S+ 0 0 67 1,-0.2 2,-0.7 -5,-0.1 22,-0.0 0.798 81.9 168.7 47.2 37.8 9.7 18.2 41.6 26 27 A L < + 0 0 18 -3,-0.8 2,-0.3 -6,-0.3 -6,-0.3 -0.719 5.5 156.4 -85.3 118.6 8.1 20.2 44.4 27 28 A A + 0 0 79 -2,-0.7 2,-0.3 -8,-0.1 -8,-0.1 -0.841 21.4 119.9-143.1 100.2 10.1 23.3 45.2 28 29 A T + 0 0 12 -10,-0.5 -10,-3.5 -2,-0.3 2,-0.3 -0.984 26.2 177.1-162.9 151.0 8.3 26.2 46.9 29 30 A E E -C 17 0A 95 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.912 4.9-168.6-147.1 173.0 8.2 28.4 50.0 30 31 A A E -C 16 0A 3 -14,-1.7 -14,-2.8 -2,-0.3 6,-0.1 -0.964 36.4-112.2-165.3 150.2 6.3 31.4 51.4 31 32 A A S S+ 0 0 55 -2,-0.3 2,-0.3 -16,-0.2 -1,-0.1 0.782 102.1 29.4 -57.6 -31.7 6.6 33.8 54.3 32 33 A T S > S- 0 0 47 -16,-0.1 4,-1.9 1,-0.1 -16,-0.1 -0.884 78.9-119.8-129.2 163.8 3.5 32.3 56.0 33 34 A L H > S+ 0 0 49 -2,-0.3 4,-2.2 2,-0.2 5,-0.1 0.844 113.2 57.3 -69.8 -32.3 1.7 29.0 56.1 34 35 A E H > S+ 0 0 140 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.966 110.1 43.6 -61.0 -51.6 -1.5 30.5 54.6 35 36 A E H > S+ 0 0 90 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.856 110.0 56.0 -61.2 -38.6 0.5 31.7 51.5 36 37 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.913 109.4 47.9 -60.9 -40.3 2.4 28.4 51.3 37 38 A L H X S+ 0 0 81 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.951 110.9 50.2 -63.9 -49.9 -1.1 26.7 51.2 38 39 A A H X S+ 0 0 60 -4,-2.5 4,-1.0 1,-0.2 3,-0.2 0.958 112.7 46.3 -52.2 -55.7 -2.3 29.1 48.5 39 40 A K H >X S+ 0 0 95 -4,-3.0 4,-2.4 1,-0.2 3,-0.8 0.905 111.3 52.8 -55.9 -43.5 0.8 28.5 46.4 40 41 A L H 3X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.878 98.9 63.0 -60.4 -40.6 0.6 24.7 46.8 41 42 A A H 3< S+ 0 0 64 -4,-2.3 -1,-0.2 -3,-0.2 -2,-0.2 0.820 113.6 35.7 -54.6 -33.1 -3.1 24.6 45.7 42 43 A V H > S+ 0 0 62 0, 0.0 4,-2.0 0, 0.0 3,-0.5 0.987 113.5 50.2 -60.3 -52.2 -1.9 19.8 40.5 46 47 A E H 3X S+ 0 0 92 -4,-1.2 4,-2.7 1,-0.3 5,-0.2 0.883 110.7 48.4 -47.5 -51.1 0.4 21.1 37.7 47 48 A L H 3X S+ 0 0 17 -4,-2.7 4,-0.8 1,-0.2 -1,-0.3 0.822 109.5 53.6 -63.2 -32.8 3.3 19.1 39.0 48 49 A L H << S+ 0 0 16 -4,-1.9 -1,-0.2 -3,-0.5 -2,-0.2 0.828 113.2 42.4 -72.0 -32.7 1.1 15.9 39.2 49 50 A E H < S+ 0 0 147 -4,-2.0 4,-0.3 -3,-0.2 -2,-0.2 0.966 109.1 55.5 -76.5 -54.5 0.0 16.3 35.5 50 51 A E H < S+ 0 0 149 -4,-2.7 2,-0.2 -5,-0.2 -1,-0.2 0.750 117.0 45.6 -48.2 -26.2 3.4 17.2 34.1 51 52 A N S < S- 0 0 69 -4,-0.8 2,-1.5 -5,-0.2 0, 0.0 -0.621 118.1 -69.0-112.8 173.4 4.5 14.0 35.7 52 53 A G - 0 0 79 -2,-0.2 -3,-0.1 1,-0.2 -2,-0.1 -0.472 54.9-169.4 -65.8 92.8 3.0 10.5 35.8 53 54 A V + 0 0 63 -2,-1.5 -1,-0.2 -4,-0.3 -4,-0.1 0.937 17.6 167.1 -45.4 -90.5 -0.0 11.3 37.9 54 55 A A + 0 0 105 1,-0.2 2,-0.3 -6,-0.0 -2,-0.1 0.972 27.5 155.8 66.8 57.9 -1.5 7.9 38.9 55 56 A L - 0 0 50 -54,-0.0 2,-0.4 -7,-0.0 -1,-0.2 -0.884 44.0-132.8-119.4 148.4 -3.8 9.3 41.6 56 57 A E - 0 0 156 -2,-0.3 0, 0.0 2,-0.1 0, 0.0 -0.817 50.5 -85.2 -95.4 136.1 -7.1 8.1 43.1 57 58 A L S S+ 0 0 140 -2,-0.4 2,-0.1 1,-0.1 3,-0.0 -0.637 97.0 35.9-106.4 161.7 -9.7 10.9 43.4 58 59 A P S S- 0 0 123 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.530 79.6-155.2 -79.7 145.2 -10.8 13.2 44.8 59 60 A V - 0 0 56 -2,-0.1 2,-0.4 -4,-0.1 -57,-0.2 -0.704 9.8-168.0 -92.6 136.2 -7.3 14.3 45.9 60 61 A E E -a 2 0A 109 -59,-2.7 -57,-2.7 -2,-0.4 2,-0.5 -0.933 17.4-131.6-121.9 145.6 -6.7 16.4 49.0 61 62 A L E -a 3 0A 54 -2,-0.4 2,-0.7 -59,-0.2 -57,-0.2 -0.842 14.4-162.3 -97.8 122.3 -3.5 18.2 50.1 62 63 A R E -a 4 0A 115 -59,-2.7 -57,-2.6 -2,-0.5 2,-0.6 -0.870 5.8-161.9-107.7 101.3 -2.4 17.7 53.7 63 64 A L E -a 5 0A 44 -2,-0.7 2,-0.4 -59,-0.2 -57,-0.2 -0.734 11.7-163.6 -83.5 121.4 0.1 20.4 54.8 64 65 A E E -a 6 0A 57 -59,-3.2 -57,-3.0 -2,-0.6 2,-0.4 -0.898 13.6-177.9-113.0 134.8 2.0 19.2 57.9 65 66 A A - 0 0 57 -2,-0.4 2,-0.3 -59,-0.2 -57,-0.1 -0.990 13.6-153.9-131.3 122.3 4.1 21.4 60.2 66 67 A T - 0 0 137 -59,-0.5 -2,-0.0 -2,-0.4 -60,-0.0 -0.766 10.9-176.0-103.2 143.8 6.0 19.9 63.1 67 68 A R - 0 0 212 -2,-0.3 2,-0.2 0, 0.0 -2,-0.0 -0.999 27.0-121.7-134.9 133.4 7.0 21.6 66.4 68 69 A P - 0 0 112 0, 0.0 2,-0.4 0, 0.0 -2,-0.0 -0.564 27.3-136.0 -76.7 138.5 9.0 20.0 69.2 69 70 A L - 0 0 138 -2,-0.2 2,-0.5 0, 0.0 0, 0.0 -0.824 10.8-152.2-100.9 134.4 7.3 19.9 72.6 70 71 A V 0 0 138 -2,-0.4 0, 0.0 1,-0.1 0, 0.0 -0.874 360.0 360.0-106.6 130.9 9.1 20.8 75.9 71 72 A F 0 0 232 -2,-0.5 -1,-0.1 0, 0.0 0, 0.0 0.695 360.0 360.0-120.2 360.0 8.1 19.3 79.2