==== 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 UNKNOWN FUNCTION 23-NOV-05 2F4I . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN TM0957; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 707 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36070.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 482 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 137 19.4 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 . 4 0.6 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 . 23 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 228 32.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 3.3 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 4 0 4 4 4 0 0 0 0 0 0 0 8 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 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 PARALLEL BRIDGES PER LADDER . 3 1 0 4 4 4 0 0 0 0 4 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 4 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 39 A F 0 0 130 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 132.0 63.4 51.5 -9.1 2 40 A D > - 0 0 75 1,-0.1 4,-2.0 2,-0.0 5,-0.1 -0.881 360.0-179.8-109.6 100.9 62.6 47.8 -8.4 3 41 A P H > S+ 0 0 26 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.763 81.1 59.2 -70.1 -23.2 61.6 47.2 -4.8 4 42 A X H > S+ 0 0 107 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.944 111.1 39.5 -70.6 -49.4 61.1 43.5 -5.4 5 43 A R H > S+ 0 0 47 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.916 115.1 53.7 -61.0 -45.7 64.7 42.9 -6.5 6 44 A Y H X S+ 0 0 66 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.933 109.9 47.5 -59.6 -43.5 66.0 45.3 -3.9 7 45 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.885 109.7 52.5 -61.8 -43.3 64.2 43.4 -1.2 8 46 A R H X S+ 0 0 39 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.894 110.3 49.0 -62.3 -40.0 65.5 40.0 -2.5 9 47 A E H X S+ 0 0 69 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.878 109.7 50.9 -66.2 -41.2 69.0 41.4 -2.4 10 48 A L H X S+ 0 0 11 -4,-2.3 4,-2.8 -5,-0.2 -1,-0.2 0.878 107.9 54.5 -61.3 -37.9 68.6 42.6 1.2 11 49 A W H X S+ 0 0 12 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.925 106.7 49.6 -65.6 -46.7 67.3 39.2 2.2 12 50 A F H X S+ 0 0 11 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.859 112.1 49.0 -54.4 -41.4 70.4 37.5 0.8 13 51 A X H X S+ 0 0 110 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.922 112.5 48.3 -65.3 -42.4 72.5 40.0 2.8 14 52 A L H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.871 107.9 54.4 -65.4 -41.4 70.5 39.3 5.9 15 53 A Q H X S+ 0 0 52 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.906 108.5 49.6 -57.8 -44.2 70.8 35.5 5.4 16 54 A D H X S+ 0 0 75 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.905 109.7 51.2 -61.1 -44.1 74.6 35.9 5.3 17 55 A X H X S+ 0 0 45 -4,-1.9 4,-0.8 2,-0.2 3,-0.3 0.904 109.7 49.6 -60.8 -41.9 74.5 38.0 8.5 18 56 A X H >< S+ 0 0 21 -4,-2.4 3,-0.6 1,-0.2 4,-0.4 0.879 108.1 53.7 -67.1 -38.1 72.4 35.4 10.3 19 57 A N H 3< S+ 0 0 115 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.800 110.2 49.1 -58.5 -28.1 74.9 32.7 9.2 20 58 A E H 3< S- 0 0 167 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.623 133.2 -76.4 -91.3 -15.5 77.6 34.8 10.8 21 59 A G << + 0 0 51 -4,-0.8 2,-0.3 -3,-0.6 -2,-0.1 0.357 58.0 173.8 116.1 109.2 75.8 35.4 14.1 22 60 A L + 0 0 22 -4,-0.4 -1,-0.1 1,-0.0 2,-0.1 -0.963 38.0 39.6-145.1 128.9 73.0 37.7 14.7 23 61 A G S S- 0 0 23 -2,-0.3 35,-0.3 34,-0.1 2,-0.2 -0.001 70.6 -95.3 116.4 143.4 70.7 38.3 17.7 24 62 A Y E -a 58 0A 117 33,-2.5 35,-2.5 20,-0.2 2,-0.2 -0.540 57.5 -79.9 -84.1 153.6 71.1 38.5 21.5 25 63 A D E > -a 59 0A 84 33,-0.2 4,-2.3 -2,-0.2 5,-0.2 -0.360 40.3-141.3 -53.5 119.5 70.4 35.5 23.7 26 64 A A H > S+ 0 0 2 33,-2.6 4,-2.6 1,-0.2 5,-0.2 0.880 96.6 49.6 -54.7 -46.3 66.6 35.3 24.0 27 65 A V H > S+ 0 0 51 32,-0.2 4,-2.6 1,-0.2 5,-0.2 0.937 112.1 48.4 -63.5 -45.5 66.5 34.2 27.8 28 66 A E H > S+ 0 0 81 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.904 113.0 47.3 -59.5 -48.8 68.9 37.1 28.8 29 67 A V H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.962 114.8 45.3 -58.8 -53.0 66.9 39.7 26.9 30 68 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.891 112.2 51.6 -61.3 -41.0 63.5 38.6 28.2 31 69 A N H X S+ 0 0 63 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.908 111.0 48.6 -59.8 -41.6 64.8 38.3 31.8 32 70 A T H X S+ 0 0 5 -4,-2.1 4,-3.5 -5,-0.2 8,-0.3 0.891 108.6 53.4 -66.6 -38.6 66.2 41.8 31.6 33 71 A L H < S+ 0 0 3 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.901 109.9 49.1 -60.2 -40.9 62.9 43.1 30.2 34 72 A D H < S+ 0 0 74 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.808 119.6 37.2 -68.4 -34.2 61.1 41.6 33.2 35 73 A E H < S- 0 0 135 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.872 139.9 -7.7 -82.5 -42.1 63.5 43.1 35.6 36 74 A N X - 0 0 70 -4,-3.5 4,-2.2 -5,-0.2 3,-0.3 -0.634 54.2-169.3-165.0 89.7 64.2 46.6 34.0 37 75 A P H > S+ 0 0 50 0, 0.0 4,-2.8 0, 0.0 5,-0.1 0.831 89.9 54.2 -61.4 -34.2 62.8 47.4 30.5 38 76 A E H > S+ 0 0 64 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.913 109.0 48.6 -68.2 -39.1 64.9 50.6 30.2 39 77 A L H > S+ 0 0 49 -3,-0.3 4,-2.6 2,-0.2 5,-0.2 0.907 111.2 51.9 -59.8 -44.2 68.1 48.7 30.9 40 78 A A H X>S+ 0 0 0 -4,-2.2 4,-3.0 -8,-0.3 5,-0.6 0.943 108.7 49.3 -57.6 -48.4 66.9 46.2 28.3 41 79 A H H X5S+ 0 0 9 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.949 114.9 46.0 -56.4 -49.0 66.3 48.9 25.7 42 80 A Q H <5S+ 0 0 145 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.897 120.7 37.1 -58.3 -45.4 69.8 50.3 26.4 43 81 A X H <5S+ 0 0 115 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.852 133.8 14.3 -78.4 -39.4 71.6 47.0 26.4 44 82 A F H <5S+ 0 0 14 -4,-3.0 13,-0.5 -5,-0.2 2,-0.3 0.521 101.6 82.5-122.0 -11.9 69.8 45.2 23.6 45 83 A A E << -B 56 0A 21 -4,-1.9 2,-0.3 -5,-0.6 11,-0.2 -0.718 56.2-139.3-110.4 154.3 67.6 47.4 21.4 46 84 A X E -B 55 0A 129 9,-2.6 9,-3.1 -2,-0.3 2,-0.3 -0.792 13.0-150.1-102.6 151.8 68.2 49.7 18.4 47 85 A V - 0 0 73 -2,-0.3 2,-0.5 7,-0.2 7,-0.1 -0.900 5.0-152.0-115.8 144.1 66.5 53.1 17.9 48 86 A V > - 0 0 62 5,-0.4 3,-1.2 -2,-0.3 5,-0.2 -0.990 64.1 -31.6-123.7 125.8 65.8 54.5 14.5 49 87 A G T 3 S- 0 0 66 -2,-0.5 -2,-0.1 1,-0.2 0, 0.0 -0.442 110.2 -49.4 64.6-140.5 65.6 58.3 14.2 50 88 A V T 3 S+ 0 0 150 -2,-0.1 -1,-0.2 -3,-0.1 -3,-0.0 0.185 97.1 128.2-113.0 14.1 64.4 59.9 17.3 51 89 A S < - 0 0 45 -3,-1.2 -3,-0.1 1,-0.1 -2,-0.0 -0.098 66.2-119.1 -70.9 171.3 61.3 57.8 18.0 52 90 A N S S+ 0 0 81 -5,-0.1 106,-3.0 106,-0.1 2,-0.3 0.346 77.4 110.3 -95.3 5.7 60.2 55.9 21.1 53 91 A Y E - C 0 157A 53 104,-0.2 2,-0.5 -5,-0.2 -5,-0.4 -0.632 54.7-154.4 -84.3 141.2 60.2 52.5 19.5 54 92 A R E - C 0 156A 30 102,-3.1 102,-2.3 -2,-0.3 2,-0.6 -0.976 6.7-150.2-121.0 119.8 62.9 50.0 20.5 55 93 A Y E -BC 46 155A 25 -9,-3.1 -9,-2.6 -2,-0.5 2,-0.3 -0.845 15.4-170.8-105.2 118.8 63.9 47.3 18.0 56 94 A Y E -BC 45 154A 1 98,-3.1 98,-1.7 -2,-0.6 2,-0.4 -0.772 13.9-166.4-108.9 145.4 65.1 44.0 19.3 57 95 A I E + C 0 153A 9 -13,-0.5 -33,-2.5 -2,-0.3 2,-0.3 -0.990 18.3 176.7-131.1 123.0 66.7 41.0 17.6 58 96 A I E -aC 24 152A 0 94,-2.9 94,-2.6 -2,-0.4 2,-0.3 -0.857 12.5-166.3-122.0 153.0 66.9 37.7 19.6 59 97 A Q E +aC 25 151A 70 -35,-2.5 -33,-2.6 -2,-0.3 2,-0.3 -0.986 28.6 110.6-135.6 152.0 68.0 34.2 18.9 60 98 A G E - C 0 150A 18 90,-1.9 90,-2.5 -2,-0.3 2,-0.4 -0.987 58.2 -79.4 176.4-165.6 67.5 31.0 20.8 61 99 A V E + C 0 149A 58 -2,-0.3 2,-0.3 88,-0.2 88,-0.2 -0.999 43.4 179.6-127.4 128.3 65.9 27.6 21.0 62 100 A G E - C 0 148A 3 86,-2.4 86,-2.9 -2,-0.4 2,-0.5 -0.882 26.5-122.7-127.4 160.3 62.3 27.2 22.1 63 101 A E E -DC 75 147A 65 12,-2.4 12,-2.3 -2,-0.3 2,-0.3 -0.900 32.5-115.9-102.5 132.4 59.9 24.4 22.6 64 102 A I E +D 74 0A 0 82,-2.7 81,-3.1 -2,-0.5 10,-0.2 -0.491 36.5 171.3 -67.8 122.3 56.6 24.5 20.6 65 103 A V E + 0 0 57 8,-2.9 2,-0.3 1,-0.4 9,-0.2 0.723 68.8 2.9-100.7 -36.5 53.7 24.8 23.1 66 104 A E E -D 73 0A 92 7,-1.3 7,-2.7 77,-0.1 2,-0.5 -0.975 61.2-143.4-155.4 140.9 50.9 25.4 20.6 67 105 A I E -D 72 0A 70 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.923 25.3-178.8-106.7 124.7 50.7 25.5 16.7 68 106 A X E > -D 71 0A 83 3,-3.0 3,-0.8 -2,-0.5 -2,-0.0 -0.713 42.4-105.4-116.2 171.1 48.3 28.1 15.3 69 107 A D T 3 S+ 0 0 161 -2,-0.2 3,-0.1 1,-0.2 65,-0.1 0.802 122.0 34.5 -61.8 -30.7 47.2 29.0 11.7 70 108 A D T 3 S- 0 0 28 1,-0.1 19,-2.2 18,-0.0 20,-0.3 0.153 128.6 -37.3-116.8 12.8 49.4 32.1 11.9 71 109 A G E < -DE 68 88A 0 -3,-0.8 -3,-3.0 17,-0.3 2,-0.4 -0.978 60.9 -78.9 160.6-171.8 52.3 31.1 14.0 72 110 A I E -DE 67 87A 2 15,-2.3 15,-2.8 -2,-0.3 2,-0.5 -0.978 23.6-137.5-125.9 141.1 53.7 29.1 16.9 73 111 A L E -DE 66 86A 17 -7,-2.7 -8,-2.9 -2,-0.4 -7,-1.3 -0.868 31.7-169.8 -91.7 131.8 53.7 29.7 20.7 74 112 A V E -DE 64 85A 0 11,-2.5 11,-2.0 -2,-0.5 10,-0.9 -0.974 18.8-145.9-133.2 136.1 57.2 28.9 22.1 75 113 A X E +D 63 0A 67 -12,-2.3 -12,-2.4 -2,-0.4 3,-0.1 -0.911 22.3 165.8-101.5 126.8 58.5 28.5 25.6 76 114 A V + 0 0 23 -2,-0.5 2,-0.3 -14,-0.2 -1,-0.1 0.492 68.9 44.1-111.8 -13.7 62.2 29.6 26.2 77 115 A R S S- 0 0 13 -50,-0.0 3,-0.4 0, 0.0 -1,-0.1 -0.946 78.2-124.5-130.5 153.1 62.0 29.7 30.0 78 116 A E S S+ 0 0 121 -2,-0.3 -2,-0.1 1,-0.2 0, 0.0 -0.413 85.5 32.5 -85.7 166.7 60.5 27.4 32.6 79 117 A N S S+ 0 0 160 1,-0.2 2,-0.3 -2,-0.1 -1,-0.2 0.666 81.9 139.8 62.6 24.6 58.0 28.3 35.4 80 118 A R - 0 0 102 -3,-0.4 -1,-0.2 1,-0.1 4,-0.1 -0.682 55.4-135.0 -98.4 154.3 56.2 31.0 33.2 81 119 A X S S+ 0 0 158 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.1 0.925 88.2 10.8 -70.1 -45.5 52.4 31.5 33.2 82 120 A V S S- 0 0 61 1,-0.1 -1,-0.1 2,-0.0 0, 0.0 -0.854 101.3 -71.1-129.0 160.5 52.1 31.8 29.4 83 121 A P - 0 0 24 0, 0.0 -8,-0.2 0, 0.0 -1,-0.1 -0.133 37.4-133.8 -50.1 148.9 54.5 31.1 26.5 84 122 A D S S+ 0 0 1 -10,-0.9 82,-2.6 1,-0.2 2,-0.4 0.891 81.9 28.6 -72.1 -42.7 57.4 33.6 26.1 85 123 A L E -Ef 74 166A 0 -11,-2.0 -11,-2.5 80,-0.3 2,-0.6 -0.950 52.1-159.3-130.9 136.8 57.1 34.2 22.3 86 124 A F E -Ef 73 167A 18 80,-2.8 82,-2.4 -2,-0.4 2,-0.9 -0.964 18.9-160.8-109.7 107.2 54.4 34.1 19.6 87 125 A L E +Ef 72 168A 2 -15,-2.8 -15,-2.3 -2,-0.6 2,-0.2 -0.817 28.7 170.3 -90.3 102.9 56.4 33.6 16.4 88 126 A S E -E 71 0A 0 80,-1.7 -17,-0.3 -2,-0.9 42,-0.1 -0.676 51.6-127.0-121.1 168.2 53.8 34.8 13.8 89 127 A N S S+ 0 0 13 -19,-2.2 2,-1.8 -2,-0.2 -18,-0.1 0.170 73.1 116.0 -93.7 12.5 53.2 35.7 10.1 90 128 A H + 0 0 47 -20,-0.3 2,-0.6 78,-0.2 -2,-0.1 -0.599 42.3 164.6 -83.5 79.1 51.7 39.1 11.1 91 129 A I + 0 0 21 -2,-1.8 2,-0.3 31,-0.1 35,-0.1 -0.898 0.8 151.7-108.8 112.3 54.5 41.1 9.4 92 130 A F > - 0 0 89 -2,-0.6 3,-0.6 373,-0.0 4,-0.1 -0.971 44.2 -12.3-134.2 148.8 53.8 44.8 8.8 93 131 A G T 3 S- 0 0 21 -2,-0.3 3,-0.4 1,-0.2 4,-0.2 -0.120 101.0 -30.4 69.6-152.6 56.0 47.9 8.5 94 132 A N T 3> S+ 0 0 46 1,-0.2 4,-2.6 2,-0.1 5,-0.3 0.256 89.8 109.0-104.8 8.5 59.6 48.6 9.3 95 133 A G H <> S+ 0 0 18 -3,-0.6 4,-2.1 2,-0.2 -1,-0.2 0.812 81.9 47.5 -52.4 -41.1 60.4 46.2 12.2 96 134 A I H > S+ 0 0 3 -3,-0.4 4,-2.0 2,-0.2 6,-0.3 0.964 117.1 40.5 -70.8 -49.6 62.6 43.9 10.2 97 135 A V H > S+ 0 0 4 -4,-0.2 4,-1.5 1,-0.2 6,-0.5 0.857 119.7 46.3 -68.8 -33.8 64.7 46.7 8.6 98 136 A N H < S+ 0 0 14 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.885 114.8 45.1 -76.4 -38.8 64.9 48.7 11.8 99 137 A A H < S+ 0 0 0 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.851 125.2 33.0 -68.6 -36.7 65.7 45.7 14.1 100 138 A T H < S- 0 0 3 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.682 93.1-137.9 -93.2 -24.6 68.4 44.3 11.7 101 139 A G < + 0 0 49 -4,-1.5 -3,-0.2 -5,-0.3 -4,-0.1 0.647 59.0 136.5 68.1 18.8 69.7 47.6 10.2 102 140 A I S S+ 0 0 7 -6,-0.3 2,-0.3 -5,-0.3 -5,-0.1 0.815 73.9 15.3 -68.0 -29.0 69.7 45.9 6.8 103 141 A A - 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