==== 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 17-SEP-07 2RAQ . COMPND 2 MOLECULE: CONSERVED PROTEIN MTH889; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER THERMAUTOTROPHICUS . AUTHOR F.FOROUHAR,M.SU,X.XU,J.SEETHARAMAN,L.MAO,R.XIAO,L-C.MA,K.CON . 652 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27615.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 512 78.5 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 . 258 39.6 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 . 3 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 . 76 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 15.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.2 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 9 5 0 0 0 0 0 0 0 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 1 6 1 4 12 4 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 1 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 3 A A 0 0 69 0, 0.0 2,-0.3 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 144.2 -1.9 61.7 4.5 2 4 A K + 0 0 124 2,-0.2 55,-1.6 82,-0.1 56,-0.2 -0.964 360.0 12.7-157.0 163.6 -2.9 64.0 7.5 3 5 A G S S+ 0 0 11 -2,-0.3 80,-2.8 586,-0.2 2,-0.4 -0.389 117.8 6.0 54.2-137.4 -1.6 65.8 10.6 4 6 A L E +A 82 0A 0 54,-0.4 54,-2.2 78,-0.2 78,-0.2 -0.559 54.9 165.4 -84.3 129.8 2.2 65.9 10.5 5 7 A I E S+ 0 0 10 76,-2.1 50,-3.2 -2,-0.4 2,-0.3 0.626 73.8 26.9-108.9 -24.7 4.0 64.6 7.5 6 8 A R E +AB 81 54A 13 75,-1.4 75,-2.3 48,-0.3 2,-0.4 -0.999 59.5 178.4-142.4 139.3 7.5 66.1 8.4 7 9 A I E -AB 80 53A 0 46,-3.1 46,-3.4 -2,-0.3 2,-0.5 -0.997 6.6-168.2-138.4 134.2 9.1 67.0 11.6 8 10 A V E +AB 79 52A 0 71,-3.0 70,-2.3 -2,-0.4 71,-1.6 -0.956 15.6 169.6-126.6 112.5 12.7 68.5 12.1 9 11 A L E -AB 77 51A 1 42,-2.4 42,-2.6 -2,-0.5 2,-0.5 -0.940 28.6-136.5-126.4 146.4 14.1 68.6 15.5 10 12 A D E +AB 76 50A 37 66,-2.8 66,-1.8 -2,-0.4 65,-1.4 -0.883 32.9 178.5 -98.1 124.8 17.6 69.4 16.9 11 13 A I E -AB 74 49A 0 38,-2.1 38,-1.8 -2,-0.5 2,-0.3 -0.919 25.3-138.5-129.2 155.7 18.7 67.1 19.7 12 14 A L E +AB 73 48A 50 61,-2.5 61,-2.3 -2,-0.3 36,-0.2 -0.818 31.8 168.9-103.7 152.0 21.7 66.4 22.0 13 15 A K - 0 0 2 34,-0.8 34,-0.2 -2,-0.3 59,-0.1 -0.987 37.9 -99.6-165.3 138.7 22.8 62.9 22.8 14 16 A P - 0 0 60 0, 0.0 32,-0.2 0, 0.0 31,-0.1 -0.103 48.1-107.7 -43.3 160.4 25.5 60.5 24.4 15 17 A H S S+ 0 0 63 30,-0.5 4,-0.1 29,-0.1 31,-0.1 0.904 93.5 89.4 -71.0 -39.1 27.9 59.0 21.8 16 18 A E + 0 0 140 1,-0.1 2,-0.1 2,-0.1 3,-0.0 -0.793 65.0 50.3 -92.1 146.3 26.1 55.7 22.3 17 19 A P S S- 0 0 38 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 0.604 98.7-129.6 -75.3 144.7 23.9 54.7 21.0 18 20 A I >> - 0 0 58 -2,-0.1 3,-1.5 1,-0.1 4,-1.1 -0.104 26.2-105.1 -55.4 159.2 25.7 55.4 17.7 19 21 A I H 3> S+ 0 0 1 1,-0.3 4,-2.1 2,-0.2 5,-0.1 0.788 114.7 63.7 -75.4 -28.2 23.5 57.3 15.3 20 22 A P H 3> S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.731 102.8 56.5 -64.6 -19.1 22.6 54.6 12.8 21 23 A E H <> S+ 0 0 74 -3,-1.5 4,-2.2 2,-0.2 5,-0.3 0.986 103.6 49.4 -66.2 -68.0 20.9 53.1 15.8 22 24 A Y H X S+ 0 0 3 -4,-1.1 4,-0.8 1,-0.2 -1,-0.1 0.799 112.9 50.6 -40.9 -39.3 18.7 56.1 16.4 23 25 A A H >X S+ 0 0 0 -4,-2.1 4,-1.3 2,-0.2 3,-1.3 0.979 109.4 47.9 -62.2 -60.1 17.9 56.0 12.6 24 26 A K H >X S+ 0 0 75 -4,-2.0 4,-1.1 1,-0.2 3,-0.9 0.914 111.3 53.2 -40.9 -51.7 16.9 52.3 12.5 25 27 A Y H 3X S+ 0 0 82 -4,-2.2 4,-0.6 1,-0.3 -1,-0.2 0.615 105.7 49.8 -76.3 -15.3 14.7 52.7 15.6 26 28 A L H << S+ 0 0 3 -3,-1.3 -1,-0.3 -4,-0.8 -2,-0.2 0.617 100.5 62.5 -98.8 -13.4 12.6 55.6 14.3 27 29 A S H << S+ 0 0 17 -4,-1.3 5,-0.3 -3,-0.9 -2,-0.2 0.856 99.7 60.7 -63.5 -34.6 11.8 53.9 11.1 28 30 A E H < S+ 0 0 130 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.891 88.0 102.1 -57.9 -43.0 10.3 51.5 13.6 29 31 A L S >< S- 0 0 25 -4,-0.6 3,-1.3 1,-0.2 2,-0.4 0.231 87.0 -77.5 -43.8 158.4 7.9 54.3 14.8 30 32 A R T 3 S- 0 0 162 1,-0.3 29,-0.5 29,-0.1 -1,-0.2 -0.427 107.3 -8.4 -72.2 114.3 4.3 54.7 13.8 31 33 A G T 3 S+ 0 0 36 -2,-0.4 25,-2.9 1,-0.2 2,-0.8 0.766 87.7 151.3 78.3 26.8 3.6 56.1 10.4 32 34 A V < - 0 0 11 -3,-1.3 147,-0.4 -5,-0.3 23,-0.3 -0.804 27.6-174.0-101.8 101.0 7.2 57.0 9.7 33 35 A E - 0 0 61 -2,-0.8 147,-1.6 21,-0.5 146,-1.0 0.913 69.3 -38.2 -56.3 -45.4 8.0 56.9 5.9 34 36 A G E -CD 54 178A 0 20,-2.2 20,-2.4 145,-0.2 2,-0.4 -0.981 53.4-131.9-171.3 167.5 11.7 57.5 6.6 35 37 A V E -CD 53 177A 0 142,-2.0 142,-1.5 -2,-0.3 2,-0.5 -0.991 7.1-159.5-135.6 143.3 14.2 59.4 8.8 36 38 A N E -CD 52 176A 0 16,-2.9 16,-3.4 -2,-0.4 2,-0.6 -0.989 7.4-175.5-120.6 125.8 17.2 61.5 8.1 37 39 A I E -CD 51 175A 1 138,-2.8 138,-1.6 -2,-0.5 2,-0.4 -0.913 4.0-178.2-120.7 102.7 19.9 62.1 10.8 38 40 A T E -CD 50 174A 0 12,-1.6 12,-3.6 -2,-0.6 2,-0.6 -0.831 31.5-115.5 -97.5 147.5 22.7 64.5 9.9 39 41 A L E +C 49 0A 5 134,-2.8 10,-0.3 -2,-0.4 3,-0.1 -0.670 30.6 180.0 -81.6 114.7 25.5 65.1 12.4 40 42 A X E - 0 0 81 8,-2.6 2,-0.3 -2,-0.6 9,-0.2 0.928 64.9 -14.5 -84.2 -47.1 25.6 68.8 13.5 41 43 A E E -C 48 0A 114 7,-1.8 7,-3.7 2,-0.0 2,-0.6 -0.940 55.4-147.7-161.8 130.8 28.5 68.9 16.0 42 44 A I E +C 47 0A 85 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.918 23.4 176.2-110.3 118.0 30.4 66.3 17.8 43 45 A D - 0 0 66 3,-1.2 -2,-0.0 -2,-0.6 0, 0.0 -0.313 41.0-106.0-105.3-167.4 31.8 67.2 21.2 44 46 A K S S+ 0 0 202 -2,-0.1 -29,-0.1 3,-0.0 -1,-0.1 0.910 116.6 32.8 -89.8 -51.4 33.6 65.1 23.9 45 47 A E S S- 0 0 158 -31,-0.1 -30,-0.5 -30,-0.0 2,-0.1 0.990 131.9 -6.5 -49.6 -62.7 30.8 64.7 26.3 46 48 A T - 0 0 24 -32,-0.2 -3,-1.2 -31,-0.1 2,-0.2 -0.033 62.4-120.5-137.8-155.9 28.0 64.5 23.8 47 49 A E E - C 0 42A 12 -5,-0.2 -34,-0.8 -34,-0.2 2,-0.6 -0.823 12.4-139.6-178.9 114.5 26.9 64.9 20.2 48 50 A N E +BC 12 41A 27 -7,-3.7 -8,-2.6 -2,-0.2 -7,-1.8 -0.781 26.0 173.0-102.6 118.9 24.5 67.1 18.3 49 51 A I E -BC 11 39A 1 -38,-1.8 -38,-2.1 -2,-0.6 2,-0.5 -0.836 26.4-136.3-117.0 153.1 22.4 65.7 15.5 50 52 A K E -BC 10 38A 4 -12,-3.6 -12,-1.6 -2,-0.3 2,-0.6 -0.951 19.4-156.5-104.0 136.2 19.6 67.0 13.4 51 53 A V E -BC 9 37A 2 -42,-2.6 -42,-2.4 -2,-0.5 2,-0.6 -0.938 10.3-175.2-121.0 112.7 16.7 64.7 12.9 52 54 A T E -BC 8 36A 0 -16,-3.4 -16,-2.9 -2,-0.6 2,-0.4 -0.926 12.9-177.7-107.9 111.9 14.4 65.0 9.9 53 55 A I E -BC 7 35A 2 -46,-3.4 -46,-3.1 -2,-0.6 2,-0.4 -0.906 5.0-174.7-123.3 141.2 11.5 62.7 10.0 54 56 A Q E +BC 6 34A 33 -20,-2.4 -20,-2.2 -2,-0.4 -21,-0.5 -0.988 25.3 95.6-137.0 138.4 8.9 62.2 7.5 55 57 A G - 0 0 0 -50,-3.2 2,-0.4 -2,-0.4 -23,-0.2 -0.935 63.0 -48.2-179.8-147.5 5.7 60.2 7.3 56 58 A N S S- 0 0 61 -25,-2.9 -51,-0.2 -2,-0.3 -52,-0.1 -0.927 103.4 -19.2-117.9 139.7 1.9 60.1 7.8 57 59 A D S S- 0 0 57 -55,-1.6 -1,-0.2 -2,-0.4 -52,-0.2 0.855 87.6-161.5 32.8 50.3 -0.1 61.4 10.8 58 60 A L - 0 0 0 -54,-2.2 2,-0.8 -56,-0.2 -54,-0.4 -0.162 14.9-123.1 -59.5 153.9 3.1 61.1 12.9 59 61 A D > - 0 0 50 -29,-0.5 4,-2.6 1,-0.2 5,-0.2 -0.846 17.6-167.7-109.5 106.1 2.9 61.0 16.6 60 62 A F H > S+ 0 0 19 -2,-0.8 4,-2.3 1,-0.2 -1,-0.2 0.875 88.8 49.4 -58.6 -37.5 4.9 63.7 18.2 61 63 A D H > S+ 0 0 90 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.868 109.8 48.1 -75.5 -36.9 4.6 62.1 21.6 62 64 A E H > S+ 0 0 29 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.987 114.3 49.6 -59.3 -55.5 5.7 58.6 20.5 63 65 A I H X S+ 0 0 3 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.897 116.6 40.7 -49.3 -48.7 8.6 60.2 18.7 64 66 A T H X S+ 0 0 21 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.889 113.1 49.9 -78.7 -38.7 9.6 62.3 21.6 65 67 A R H X S+ 0 0 151 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.928 111.7 54.4 -61.4 -37.8 9.1 59.7 24.4 66 68 A A H X S+ 0 0 6 -4,-3.0 4,-1.7 -5,-0.3 -2,-0.2 0.890 105.3 50.7 -61.4 -42.6 11.2 57.4 22.2 67 69 A I H <>S+ 0 0 1 -4,-1.9 5,-1.5 -5,-0.2 -1,-0.2 0.908 110.4 49.1 -66.5 -36.8 14.1 59.8 21.9 68 70 A E H ><5S+ 0 0 119 -4,-1.9 3,-2.2 1,-0.2 -2,-0.2 0.925 106.3 57.5 -67.7 -37.4 14.2 60.2 25.7 69 71 A S H 3<5S+ 0 0 83 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.881 102.1 55.3 -55.4 -41.2 14.2 56.4 26.0 70 72 A Y T 3<5S- 0 0 80 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.369 126.1-104.0 -77.5 7.9 17.3 56.3 23.9 71 73 A G T < 5S+ 0 0 49 -3,-2.2 -3,-0.2 1,-0.2 -2,-0.1 0.169 79.9 130.8 93.3 -14.7 19.0 58.7 26.4 72 74 A G < - 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