==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 18-SEP-06 2IEC . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN CONSERVED IN ARCHAEA; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOPYRUS KANDLERI; . AUTHOR J.B.BONANNO,U.A.RAMAGOPAL,M.DICKEY,K.T.BAIN,A.POWELL, . 455 6 6 2 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19431.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 330 72.5 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 . 127 27.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 4 0.9 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 . 34 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 3 0 1 0 0 0 0 0 4 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 4 0 0 0 0 8 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 4 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 11 A L 0 0 85 0, 0.0 2,-0.1 0, 0.0 224,-0.0 0.000 360.0 360.0 360.0 127.4 -13.2 26.6 138.2 2 12 A S > - 0 0 63 1,-0.1 4,-2.6 4,-0.0 5,-0.2 -0.351 360.0 -94.2 -63.9 162.0 -12.7 29.2 141.0 3 13 A D H > S+ 0 0 82 1,-0.2 4,-2.1 2,-0.2 82,-0.2 0.859 125.9 50.7 -50.4 -42.4 -11.7 32.7 139.9 4 14 A R H > S+ 0 0 74 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.911 113.3 44.5 -63.3 -45.0 -7.9 32.0 140.3 5 15 A E H > S+ 0 0 25 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.845 111.8 54.1 -67.3 -36.0 -8.1 28.8 138.3 6 16 A R H X S+ 0 0 64 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.880 103.9 56.2 -65.9 -38.4 -10.3 30.7 135.7 7 17 A A H X S+ 0 0 0 -4,-2.1 4,-1.1 -5,-0.2 -2,-0.2 0.871 111.5 42.5 -57.3 -44.6 -7.5 33.3 135.5 8 18 A I H X S+ 0 0 0 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.930 114.5 49.6 -67.2 -51.3 -4.9 30.6 134.5 9 19 A F H X S+ 0 0 3 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.901 111.7 48.1 -54.4 -49.4 -7.3 28.7 132.1 10 20 A E H X S+ 0 0 7 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.806 109.1 53.9 -66.0 -32.0 -8.3 31.9 130.2 11 21 A A H X S+ 0 0 0 -4,-1.1 4,-2.2 -5,-0.2 -1,-0.2 0.906 111.5 45.2 -67.5 -42.3 -4.6 33.0 129.9 12 22 A G H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.3 0.950 112.0 52.1 -66.3 -46.0 -3.8 29.6 128.4 13 23 A I H X S+ 0 0 5 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.941 111.3 47.1 -53.3 -50.4 -6.8 29.8 126.1 14 24 A T H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.888 111.9 49.1 -61.3 -43.6 -5.8 33.3 124.8 15 25 A L H X S+ 0 0 2 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.964 115.5 43.9 -61.0 -48.6 -2.2 32.3 124.2 16 26 A G H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.901 116.0 47.5 -61.3 -42.7 -3.1 29.2 122.2 17 27 A A H X S+ 0 0 2 -4,-2.5 4,-2.0 -5,-0.3 5,-0.2 0.904 114.3 45.6 -67.5 -47.1 -5.9 31.0 120.3 18 28 A I H X S+ 0 0 3 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.901 112.3 51.9 -62.6 -44.8 -3.7 34.0 119.4 19 29 A Y H X S+ 0 0 9 -4,-2.4 4,-1.6 -5,-0.3 -2,-0.2 0.912 118.8 34.0 -61.8 -42.7 -0.8 31.8 118.3 20 30 A H H < S+ 0 0 15 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.682 116.6 54.1 -94.1 -23.2 -2.7 29.6 116.0 21 31 A Q H < S+ 0 0 6 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.879 121.6 29.5 -69.9 -42.5 -5.2 32.2 114.7 22 32 A F H >< S+ 0 0 6 -4,-2.4 3,-2.1 -5,-0.2 50,-0.3 0.701 87.2 104.7 -97.8 -19.7 -2.4 34.6 113.7 23 33 A C T 3< S+ 0 0 9 -4,-1.6 50,-0.2 -5,-0.3 347,-0.0 -0.396 82.7 37.0 -63.6 141.0 0.7 32.5 112.8 24 34 A G T 3 S+ 0 0 5 48,-2.5 -1,-0.3 1,-0.3 49,-0.1 0.241 81.6 138.7 95.7 -11.9 1.0 32.5 108.9 25 35 A T < - 0 0 4 -3,-2.1 47,-2.7 47,-0.2 -1,-0.3 -0.560 60.0-117.2 -66.9 124.3 -0.1 36.1 108.7 26 36 A P E +A 71 0A 4 0, 0.0 2,-0.3 0, 0.0 45,-0.3 -0.352 45.8 169.4 -62.6 138.9 2.0 38.0 106.1 27 37 A V E -A 70 0A 0 43,-2.7 43,-2.9 252,-0.1 249,-0.0 -0.984 19.4-169.8-154.8 149.8 4.0 40.8 107.7 28 38 A S >> - 0 0 20 -2,-0.3 3,-0.9 41,-0.2 4,-0.7 -0.906 48.0 -84.6-137.8 167.2 6.8 43.2 106.9 29 39 A P G >4 S+ 0 0 55 0, 0.0 3,-0.7 0, 0.0 4,-0.4 0.865 128.0 37.9 -45.0 -39.3 8.9 45.6 108.9 30 40 A G G 34 S+ 0 0 63 1,-0.2 4,-0.1 2,-0.2 -3,-0.0 0.456 114.7 51.0-124.9 25.8 6.3 48.3 108.6 31 41 A T G <> S+ 0 0 16 -3,-0.9 4,-2.1 2,-0.1 -1,-0.2 0.313 88.5 89.5 -41.3 -31.2 3.3 46.3 108.9 32 42 A A H S+ 0 0 154 -4,-0.4 4,-2.3 1,-0.2 -1,-0.3 0.889 112.0 50.3 -72.5 -39.5 3.2 47.3 114.5 34 44 A E H > S+ 0 0 78 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.859 112.0 49.5 -63.6 -35.0 -0.3 47.5 113.1 35 45 A V H X S+ 0 0 12 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.961 109.1 51.9 -65.6 -48.1 -0.4 43.6 113.0 36 46 A A H X S+ 0 0 6 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.910 111.2 48.0 -52.0 -47.7 0.8 43.6 116.7 37 47 A K H X S+ 0 0 114 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.860 107.9 53.2 -63.1 -41.7 -2.0 46.0 117.6 38 48 A a H X S+ 0 0 9 -4,-2.1 4,-2.0 2,-0.2 5,-0.2 0.937 109.6 50.7 -55.3 -46.2 -4.7 44.0 115.7 39 49 A I H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.916 108.9 51.1 -57.6 -46.8 -3.5 41.0 117.7 40 50 A E H X S+ 0 0 52 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.939 110.0 49.6 -52.5 -50.9 -3.8 43.0 121.0 41 51 A R H < S+ 0 0 63 -4,-2.5 4,-0.4 1,-0.2 -1,-0.2 0.822 111.5 47.4 -63.8 -38.7 -7.4 44.0 120.2 42 52 A A H >< S+ 0 0 1 -4,-2.0 3,-1.1 1,-0.2 4,-0.5 0.873 110.5 53.4 -68.9 -35.9 -8.5 40.5 119.4 43 53 A A H >< S+ 0 0 0 -4,-2.7 3,-1.2 1,-0.2 -2,-0.2 0.883 101.2 61.7 -66.6 -30.1 -6.9 39.3 122.6 44 54 A L T 3< S+ 0 0 76 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.621 95.5 60.4 -73.9 -11.8 -8.9 41.9 124.5 45 55 A L T < S+ 0 0 42 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.632 82.9 100.1 -85.5 -18.1 -12.2 40.4 123.5 46 56 A Q S X S- 0 0 10 -3,-1.2 3,-1.4 -4,-0.5 -36,-0.0 -0.352 92.8 -81.2 -72.3 148.1 -11.4 37.0 125.1 47 57 A P T 3 S+ 0 0 17 0, 0.0 -1,-0.1 0, 0.0 -33,-0.1 -0.307 109.5 0.0 -53.7 128.5 -13.0 36.4 128.6 48 58 A b T 3 S+ 0 0 25 1,-0.3 36,-2.8 -4,-0.1 2,-0.3 0.133 88.6 135.3 86.7 -14.2 -11.0 38.0 131.5 49 59 A V E < +B 83 0B 13 -3,-1.4 -1,-0.3 34,-0.2 34,-0.2 -0.513 15.6 160.9 -71.1 126.8 -8.3 39.6 129.4 50 60 A I E + 0 0 78 32,-2.4 2,-0.3 1,-0.3 -1,-0.2 0.505 65.2 31.2-123.1 -18.1 -7.7 43.1 130.7 51 61 A D E +B 82 0B 55 31,-1.4 31,-2.4 -8,-0.1 2,-0.4 -0.990 58.9 175.5-143.1 136.3 -4.3 43.8 129.2 52 62 A A E -B 81 0B 3 -2,-0.3 2,-0.4 29,-0.2 29,-0.2 -0.997 3.7-177.8-138.2 134.7 -2.5 42.6 126.1 53 63 A R E -B 80 0B 158 27,-2.4 27,-2.3 -2,-0.4 2,-0.4 -0.995 11.3-177.3-132.1 126.6 0.9 43.6 124.8 54 64 A V E -B 79 0B 9 -2,-0.4 2,-0.4 25,-0.2 25,-0.2 -0.980 10.7-171.2-130.2 130.6 2.1 42.1 121.5 55 65 A E E -B 78 0B 116 23,-2.8 23,-2.8 -2,-0.4 2,-0.6 -0.990 6.1-167.4-121.1 132.3 5.4 42.5 119.6 56 66 A V E -B 77 0B 14 -2,-0.4 2,-1.0 21,-0.2 21,-0.2 -0.946 15.7-157.1-112.9 108.9 6.0 41.2 116.1 57 67 A D + 0 0 85 19,-3.1 2,-0.4 -2,-0.6 20,-0.1 -0.685 25.4 156.2-101.2 93.2 9.7 41.4 115.5 58 68 A V - 0 0 17 -2,-1.0 2,-0.3 -29,-0.1 -26,-0.1 -0.889 17.1-172.3-120.3 133.6 10.5 41.5 111.8 59 69 A S >> - 0 0 51 -2,-0.4 3,-1.9 1,-0.0 4,-0.6 -0.867 42.2-102.0-122.4 163.1 13.7 42.9 110.0 60 70 A S G >4 S+ 0 0 87 -2,-0.3 3,-0.8 1,-0.3 -1,-0.0 0.752 120.0 63.1 -55.1 -27.3 14.5 43.4 106.3 61 71 A E G >4 S+ 0 0 162 1,-0.2 3,-1.4 2,-0.2 -1,-0.3 0.833 96.2 57.1 -63.0 -36.3 16.6 40.2 106.4 62 72 A D G <4 S+ 0 0 68 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.689 110.0 47.7 -65.7 -18.3 13.4 38.1 107.2 63 73 A T G << S+ 0 0 21 -3,-0.8 2,-2.0 -4,-0.6 -1,-0.3 0.205 75.2 116.5-110.9 9.2 12.0 39.6 104.0 64 74 A D < + 0 0 126 -3,-1.4 2,-0.3 4,-0.1 -1,-0.1 -0.464 58.8 88.8 -78.9 70.7 15.0 38.9 101.8 65 75 A N S > S- 0 0 29 -2,-2.0 3,-1.1 1,-0.0 383,-0.2 -0.946 95.6 -76.9-158.8 170.9 13.1 36.5 99.5 66 76 A Y T 3 S+ 0 0 98 381,-2.3 382,-0.1 -2,-0.3 383,-0.1 0.796 126.6 44.6 -47.6 -42.2 11.0 36.4 96.3 67 77 A G T 3 S- 0 0 20 380,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.778 97.9-136.0 -75.6 -27.1 7.8 37.6 98.0 68 78 A G S < S+ 0 0 40 -3,-1.1 2,-0.3 1,-0.3 -5,-0.1 0.765 72.3 79.9 70.7 27.8 9.5 40.4 100.0 69 79 A Y - 0 0 18 -7,-0.1 -1,-0.3 -41,-0.1 -41,-0.2 -0.962 60.4-148.1-149.5 168.3 7.6 39.6 103.2 70 80 A T E -A 27 0A 31 -43,-2.9 -43,-2.7 -2,-0.3 2,-0.4 -0.580 20.8-112.7-125.5-165.4 7.6 37.2 106.0 71 81 A E E -A 26 0A 41 -45,-0.3 5,-0.2 -2,-0.2 2,-0.1 -0.974 29.6-101.4-133.5 145.4 5.0 35.7 108.3 72 82 A V + 0 0 1 -47,-2.7 -48,-2.5 -2,-0.4 2,-0.3 -0.450 60.4 157.7 -59.8 135.7 4.1 36.0 111.9 73 83 A S >> - 0 0 40 -50,-0.2 4,-1.5 -49,-0.1 3,-0.8 -0.949 59.8 -83.8-154.0 170.1 5.5 32.9 113.6 74 84 A G T 34 S+ 0 0 6 -2,-0.3 22,-0.1 1,-0.2 30,-0.1 0.788 124.6 53.5 -44.7 -33.7 6.7 31.3 116.8 75 85 A R T 34 S+ 0 0 165 1,-0.2 -1,-0.2 20,-0.1 21,-0.2 0.789 117.0 30.5 -81.7 -29.0 10.1 33.0 116.2 76 86 A N T <4 S+ 0 0 11 -3,-0.8 -19,-3.1 -5,-0.2 2,-0.5 0.507 98.3 94.0-108.4 1.0 9.0 36.6 115.8 77 87 A L E < +B 56 0B 1 -4,-1.5 2,-0.4 -21,-0.2 19,-0.2 -0.824 43.5 176.3-106.8 122.0 5.9 36.8 118.0 78 88 A R E +B 55 0B 72 -23,-2.8 -23,-2.8 -2,-0.5 2,-0.4 -0.983 7.7 176.4-121.8 134.1 6.1 38.0 121.7 79 89 A V E -BC 54 94B 4 15,-2.3 15,-2.9 -2,-0.4 2,-0.4 -1.000 17.7-176.1-139.8 136.6 3.0 38.3 123.8 80 90 A T E -BC 53 93B 37 -27,-2.3 -27,-2.4 -2,-0.4 2,-0.4 -0.999 16.6-179.0-120.5 127.0 2.2 39.2 127.4 81 91 A I E -BC 52 92B 1 11,-3.4 11,-3.3 -2,-0.4 2,-0.5 -0.967 15.5-153.2-122.4 148.2 -1.4 38.9 128.5 82 92 A V E -BC 51 91B 14 -31,-2.4 -32,-2.4 -2,-0.4 -31,-1.4 -0.985 11.7-165.0-115.6 123.8 -3.0 39.7 131.9 83 93 A T E -BC 49 90B 0 7,-2.7 7,-1.7 -2,-0.5 2,-0.4 -0.857 3.4-169.3-101.7 143.0 -6.2 37.9 132.9 84 94 A R E + C 0 89B 100 -36,-2.8 2,-0.5 -2,-0.4 5,-0.2 -0.958 9.7 173.0-130.5 118.7 -8.5 39.0 135.7 85 95 A b E > - C 0 88B 6 3,-2.1 3,-2.0 -2,-0.4 2,-0.3 -0.978 68.9 -52.4-118.9 113.9 -11.3 36.8 136.9 86 96 A G T 3 S- 0 0 55 -2,-0.5 -38,-0.0 1,-0.3 0, 0.0 -0.427 124.6 -11.4 60.5-117.1 -12.9 38.3 140.1 87 97 A E T 3 S+ 0 0 128 -2,-0.3 26,-2.8 26,-0.1 2,-0.4 0.419 120.7 82.5 -94.9 -1.8 -10.1 38.9 142.6 88 98 A W E < -CD 85 112B 49 -3,-2.0 -3,-2.1 24,-0.2 2,-0.4 -0.844 52.8-166.3-117.4 146.4 -7.3 37.0 140.9 89 99 A E E -CD 84 111B 15 22,-3.0 22,-2.4 -2,-0.4 2,-0.4 -0.957 2.3-166.2-125.9 143.4 -4.9 37.8 138.1 90 100 A A E -CD 83 110B 0 -7,-1.7 -7,-2.7 -2,-0.4 2,-0.6 -0.991 12.7-147.2-127.2 137.0 -2.6 35.7 135.9 91 101 A V E -CD 82 109B 3 18,-3.2 17,-2.0 -2,-0.4 18,-1.0 -0.929 19.1-168.1-100.8 117.1 0.2 37.0 133.7 92 102 A G E -CD 81 107B 0 -11,-3.3 -11,-3.4 -2,-0.6 2,-0.3 -0.889 4.4-169.4-108.5 138.0 0.6 34.7 130.6 93 103 A K E -CD 80 106B 49 13,-3.0 13,-2.4 -2,-0.4 2,-0.4 -0.954 13.4-168.6-128.4 148.0 3.6 35.1 128.4 94 104 A L E +CD 79 105B 1 -15,-2.9 -15,-2.3 -2,-0.3 2,-0.3 -0.999 25.2 143.9-132.4 131.9 4.7 33.7 124.9 95 105 A E E - 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