==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 10-APR-07 2UYK . COMPND 2 MOLECULE: PROTEIN TDCF; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.D.BURMAN,C.E.M.STEVENSON,R.G.SAWERS,D.M.LAWSON . 382 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14776.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 261 68.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 75 19.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.8 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 0.8 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 . 25 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 22.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.6 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 3 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 3 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 . 6 0 9 0 0 0 3 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 0 0 0 0 3 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 K 0 0 96 0, 0.0 2,-0.4 0, 0.0 21,-0.2 0.000 360.0 360.0 360.0 157.5 30.7 18.8 17.2 2 3 A K E -A 21 0A 71 19,-1.6 19,-3.0 2,-0.0 2,-0.2 -0.996 360.0-129.9-128.7 129.0 31.4 16.4 20.1 3 4 A I E -A 20 0A 73 -2,-0.4 2,-0.5 17,-0.2 17,-0.2 -0.559 17.8-142.1 -70.6 136.2 29.9 12.9 20.5 4 5 A I E +A 19 0A 9 15,-2.5 15,-1.0 -2,-0.2 14,-0.5 -0.885 24.6 173.7-101.5 127.7 28.3 12.2 23.9 5 6 A E + 0 0 154 -2,-0.5 2,-0.3 13,-0.1 6,-0.1 -0.995 2.6 164.8-138.0 125.3 28.9 8.6 25.1 6 7 A T > - 0 0 22 -2,-0.4 3,-0.9 3,-0.1 53,-0.1 -0.997 37.6-146.7-141.3 139.0 27.8 7.3 28.6 7 8 A Q T 3 S+ 0 0 145 -2,-0.3 4,-0.1 1,-0.2 -1,-0.0 0.509 95.4 77.8 -78.0 -3.7 27.4 3.9 30.1 8 9 A R T 3 S+ 0 0 184 50,-0.1 -1,-0.2 2,-0.1 50,-0.2 0.468 96.3 46.7 -82.6 -5.8 24.6 5.4 32.2 9 10 A A S < S- 0 0 1 -3,-0.9 -3,-0.1 49,-0.1 26,-0.1 -0.926 111.3 -79.3-124.7 157.5 22.2 5.3 29.2 10 11 A P - 0 0 24 0, 0.0 -4,-0.1 0, 0.0 3,-0.1 -0.214 52.2-107.1 -58.5 143.1 21.8 2.2 27.0 11 12 A G - 0 0 58 25,-0.3 2,-0.1 1,-0.1 6,-0.1 -0.367 45.9 -86.9 -67.7 147.6 24.6 1.7 24.4 12 13 A A - 0 0 46 1,-0.1 -1,-0.1 4,-0.1 6,-0.0 -0.339 37.9-172.1 -53.5 125.7 23.6 2.5 20.7 13 14 A I + 0 0 107 -3,-0.1 -1,-0.1 -2,-0.1 3,-0.1 0.866 69.6 28.2 -78.2 -75.4 22.1 -0.5 19.0 14 15 A G S S- 0 0 23 1,-0.2 2,-2.0 3,-0.0 330,-0.0 0.264 114.2 -56.9 -72.4-166.7 22.0 0.9 15.5 15 16 A P S S+ 0 0 5 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.530 99.6 93.1 -78.5 73.4 24.0 3.5 13.5 16 17 A Y - 0 0 26 -2,-2.0 2,-0.3 341,-0.2 343,-0.2 -0.962 65.5-127.1-155.1 160.1 23.5 6.5 15.9 17 18 A V - 0 0 19 341,-1.2 343,-0.4 -2,-0.3 -12,-0.1 -0.836 26.0-119.5-108.2 156.8 25.2 8.1 18.9 18 19 A Q S S- 0 0 11 -14,-0.5 11,-2.6 -2,-0.3 2,-0.3 0.864 86.5 -12.7 -63.0 -40.6 23.5 8.9 22.2 19 20 A G E -AB 4 28A 0 -15,-1.0 -15,-2.5 9,-0.3 2,-0.4 -0.975 54.0-143.7-156.8 161.4 24.0 12.6 22.0 20 21 A V E -AB 3 27A 2 7,-2.3 7,-2.2 -2,-0.3 2,-0.6 -0.998 11.8-151.1-134.0 135.7 25.8 15.4 20.2 21 22 A D E +AB 2 26A 28 -19,-3.0 -19,-1.6 -2,-0.4 5,-0.2 -0.939 14.9 177.3-111.3 113.9 27.2 18.6 21.9 22 23 A L - 0 0 43 3,-3.0 2,-0.9 -2,-0.6 4,-0.1 0.314 51.4-109.5 -95.4 3.7 27.3 21.6 19.5 23 24 A G S S+ 0 0 38 2,-0.3 103,-0.2 1,-0.1 -1,-0.1 -0.618 112.7 37.0 98.0 -70.4 28.6 24.0 22.2 24 25 A S S S+ 0 0 81 -2,-0.9 102,-2.0 1,-0.1 2,-0.3 0.741 126.3 32.8 -82.9 -21.8 25.4 26.1 22.6 25 26 A M E - C 0 125A 8 100,-0.3 -3,-3.0 2,-0.0 2,-0.4 -0.982 61.1-156.4-141.6 144.6 23.1 23.2 22.2 26 27 A V E -BC 21 124A 1 98,-3.0 98,-2.9 -2,-0.3 2,-0.4 -0.988 9.9-163.5-124.0 133.8 22.9 19.5 22.9 27 28 A F E -BC 20 123A 5 -7,-2.2 -7,-2.3 -2,-0.4 2,-0.3 -0.937 5.7-157.6-110.8 137.5 20.7 17.0 21.1 28 29 A T E -B 19 0A 2 94,-2.3 -9,-0.3 -2,-0.4 -10,-0.1 -0.810 20.6-115.4-104.6 153.8 19.9 13.5 22.4 29 30 A S - 0 0 0 -11,-2.6 2,-0.5 -2,-0.3 93,-0.3 -0.338 56.3 -74.7 -66.1 163.9 18.7 10.5 20.4 30 31 A G - 0 0 3 330,-2.2 2,-0.5 355,-0.2 91,-0.3 -0.580 54.5-141.2 -67.5 118.3 15.3 9.2 21.2 31 32 A Q B -D 120 0A 12 89,-3.2 89,-2.3 -2,-0.5 25,-0.1 -0.738 17.5-167.9 -92.1 127.3 15.5 7.5 24.5 32 33 A I - 0 0 15 -2,-0.5 2,-2.3 87,-0.2 87,-0.2 -0.695 38.1 -96.1-108.8 158.2 13.6 4.3 25.1 33 34 A P S S+ 0 0 0 0, 0.0 2,-0.5 0, 0.0 19,-0.1 -0.390 71.7 136.6 -77.3 63.1 12.9 2.5 28.5 34 35 A V - 0 0 7 -2,-2.3 7,-0.2 7,-0.2 6,-0.1 -0.945 59.5-118.9-105.6 131.0 15.8 -0.0 28.1 35 36 A X > - 0 0 53 5,-2.6 4,-2.6 -2,-0.5 -26,-0.1 -0.558 16.3-144.1 -74.0 124.6 17.7 -0.5 31.3 36 37 A P T 4 S+ 0 0 31 0, 0.0 -25,-0.3 0, 0.0 -1,-0.1 0.780 95.9 39.8 -64.9 -26.2 21.4 0.5 30.7 37 38 A Q T 4 S+ 0 0 141 -29,-0.1 -2,-0.0 3,-0.1 -28,-0.0 0.871 132.1 19.1 -89.8 -36.2 22.9 -2.2 32.9 38 39 A T T 4 S- 0 0 89 2,-0.1 3,-0.1 0, 0.0 -1,-0.1 0.639 87.8-127.6-111.7 -19.0 20.6 -5.2 32.1 39 40 A G < + 0 0 40 -4,-2.6 2,-0.1 1,-0.3 0, 0.0 0.399 60.6 140.7 85.7 -4.3 18.9 -4.5 28.8 40 41 A E - 0 0 111 -6,-0.1 -5,-2.6 -5,-0.1 -1,-0.3 -0.418 46.8-143.0 -78.8 152.4 15.4 -5.2 30.2 41 42 A I - 0 0 61 -7,-0.2 -7,-0.2 -2,-0.1 7,-0.1 -0.963 24.0-126.5-109.0 119.5 12.3 -3.2 29.5 42 43 A P - 0 0 31 0, 0.0 6,-0.1 0, 0.0 9,-0.0 -0.404 11.9-138.2 -65.4 145.5 10.1 -2.7 32.5 43 44 A A S S+ 0 0 90 -2,-0.1 2,-0.2 4,-0.1 -2,-0.0 0.848 76.6 81.7 -73.8 -36.4 6.5 -3.8 31.9 44 45 A D S > S- 0 0 80 1,-0.1 4,-2.5 4,-0.0 3,-0.2 -0.524 74.3-137.2 -81.8 137.1 4.7 -1.0 33.6 45 46 A V H > S+ 0 0 18 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.853 104.5 56.1 -64.0 -34.4 4.1 2.3 31.9 46 47 A Q H > S+ 0 0 107 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.927 111.1 45.0 -57.3 -45.4 5.0 4.3 35.0 47 48 A D H > S+ 0 0 85 -3,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.883 112.4 50.9 -69.0 -37.6 8.4 2.5 35.2 48 49 A Q H X S+ 0 0 9 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.919 109.7 50.3 -64.7 -42.0 9.0 2.9 31.4 49 50 A A H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.940 112.1 47.6 -61.3 -47.2 8.3 6.6 31.7 50 51 A R H X S+ 0 0 74 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.921 113.4 48.2 -59.4 -44.2 10.7 7.0 34.6 51 52 A L H X S+ 0 0 23 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.895 108.3 52.0 -69.0 -42.0 13.4 5.0 32.8 52 53 A S H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.944 112.2 48.0 -57.1 -46.1 13.2 6.9 29.5 53 54 A L H X S+ 0 0 2 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.892 109.3 52.1 -63.8 -39.6 13.6 10.1 31.4 54 55 A E H X S+ 0 0 46 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.857 108.0 52.9 -64.1 -34.9 16.6 8.8 33.4 55 56 A N H X S+ 0 0 2 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.917 109.0 48.4 -68.6 -39.8 18.2 7.8 30.1 56 57 A V H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 3,-0.2 0.940 111.3 51.6 -59.2 -47.3 17.7 11.3 28.8 57 58 A K H X S+ 0 0 59 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.900 104.6 56.3 -57.2 -43.3 19.2 12.7 32.1 58 59 A A H X S+ 0 0 10 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.884 110.5 44.1 -58.0 -41.0 22.2 10.5 31.8 59 60 A I H X S+ 0 0 0 -4,-1.5 4,-1.2 -3,-0.2 -1,-0.2 0.918 113.4 48.5 -73.5 -44.8 23.1 11.9 28.4 60 61 A V H <>S+ 0 0 1 -4,-2.2 5,-2.2 1,-0.2 3,-0.3 0.910 114.4 48.3 -62.3 -38.8 22.5 15.6 29.3 61 62 A V H ><5S+ 0 0 66 -4,-2.9 3,-2.0 1,-0.2 -1,-0.2 0.888 105.2 57.4 -68.9 -41.0 24.6 15.1 32.4 62 63 A A H 3<5S+ 0 0 49 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.783 104.0 54.9 -60.1 -26.4 27.4 13.4 30.4 63 64 A A T 3<5S- 0 0 13 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.448 126.3-102.8 -83.0 -2.8 27.5 16.6 28.3 64 65 A G T < 5S+ 0 0 64 -3,-2.0 -3,-0.2 1,-0.3 2,-0.2 0.632 90.0 104.4 84.9 18.4 28.1 18.7 31.4 65 66 A L < - 0 0 16 -5,-2.2 -1,-0.3 -6,-0.2 2,-0.3 -0.434 57.4-138.8-112.9-171.7 24.5 19.9 31.6 66 67 A S > - 0 0 62 -2,-0.2 3,-2.3 -3,-0.1 4,-0.3 -0.909 37.0 -87.3-143.9 175.0 21.5 19.0 33.8 67 68 A V G > S+ 0 0 1 1,-0.3 3,-2.0 -2,-0.3 31,-0.1 0.853 121.3 64.0 -57.3 -36.0 17.8 18.4 33.5 68 69 A G G 3 S+ 0 0 22 1,-0.3 -1,-0.3 29,-0.2 32,-0.2 0.554 93.6 63.1 -67.1 -8.0 17.1 22.2 34.0 69 70 A D G < S+ 0 0 30 -3,-2.3 56,-2.4 30,-0.1 2,-0.3 0.493 77.3 108.4 -89.9 -8.3 19.0 22.9 30.8 70 71 A I E < +E 124 0A 1 -3,-2.0 54,-0.3 -4,-0.3 3,-0.1 -0.571 37.9 171.3 -74.1 131.7 16.5 21.0 28.7 71 72 A I E + 0 0 2 52,-2.9 32,-2.5 -2,-0.3 2,-0.3 0.597 61.8 28.1-118.0 -16.5 14.3 23.3 26.5 72 73 A K E -Ef 123 103A 10 51,-1.7 51,-2.3 30,-0.2 2,-0.4 -0.986 55.9-177.4-149.2 137.8 12.3 20.9 24.3 73 74 A M E -Ef 122 104A 0 30,-1.9 32,-1.3 -2,-0.3 2,-0.5 -0.993 11.6-158.5-128.8 137.7 11.1 17.3 24.5 74 75 A T E -Ef 121 105A 4 47,-2.3 47,-2.1 -2,-0.4 2,-0.6 -0.992 12.8-164.3-112.4 125.5 9.3 15.3 21.9 75 76 A V E -Ef 120 106A 1 30,-2.9 32,-1.7 -2,-0.5 2,-0.5 -0.936 3.6-169.9-115.9 104.2 7.4 12.4 23.5 76 77 A F E +Ef 119 107A 5 43,-2.8 43,-2.2 -2,-0.6 2,-0.3 -0.871 16.4 177.9 -92.4 127.6 6.3 9.6 21.1 77 78 A I E -Ef 118 108A 0 30,-2.5 32,-2.5 -2,-0.5 41,-0.2 -0.891 35.7-140.8-130.0 161.4 3.9 7.2 22.8 78 79 A T S S+ 0 0 38 39,-2.1 2,-0.3 -2,-0.3 40,-0.1 0.583 90.6 28.4 -96.4 -10.6 1.9 4.1 21.8 79 80 A D > - 0 0 60 38,-0.4 3,-2.3 28,-0.1 -1,-0.2 -0.797 55.1-159.2-155.7 108.9 -1.3 4.8 23.8 80 81 A L G > S+ 0 0 24 -2,-0.3 3,-1.7 1,-0.3 4,-0.3 0.692 93.0 73.2 -60.7 -18.7 -2.7 8.2 24.8 81 82 A N G 3 S+ 0 0 122 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.757 93.3 56.7 -66.2 -18.3 -4.6 6.4 27.6 82 83 A D G <> S+ 0 0 28 -3,-2.3 4,-2.6 1,-0.2 -1,-0.3 0.483 82.2 95.0 -78.3 -10.4 -1.2 6.1 29.3 83 84 A F H <> S+ 0 0 51 -3,-1.7 4,-3.5 1,-0.2 5,-0.2 0.851 75.6 54.9 -62.6 -37.9 -0.8 9.9 29.1 84 85 A A H > S+ 0 0 77 -3,-0.3 4,-2.0 -4,-0.3 -1,-0.2 0.937 114.3 41.9 -60.6 -44.7 -2.0 10.8 32.6 85 86 A T H > S+ 0 0 61 -4,-0.3 4,-2.2 -3,-0.2 -1,-0.2 0.933 116.4 48.1 -67.1 -45.3 0.5 8.4 34.2 86 87 A I H X S+ 0 0 3 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.934 111.4 51.0 -60.0 -45.4 3.3 9.4 31.9 87 88 A N H X S+ 0 0 34 -4,-3.5 4,-2.9 1,-0.2 -1,-0.2 0.856 108.3 52.1 -63.2 -38.5 2.6 13.1 32.5 88 89 A E H X S+ 0 0 92 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.929 111.9 45.2 -66.3 -41.4 2.6 12.6 36.3 89 90 A V H X S+ 0 0 12 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.912 114.5 50.0 -63.7 -41.4 6.0 10.9 36.1 90 91 A Y H X S+ 0 0 1 -4,-2.7 4,-2.1 -5,-0.2 5,-0.2 0.914 111.1 47.5 -64.8 -47.3 7.3 13.6 33.8 91 92 A K H X S+ 0 0 67 -4,-2.9 4,-2.9 1,-0.2 -1,-0.2 0.922 112.4 50.0 -58.3 -47.7 6.1 16.4 36.0 92 93 A Q H X S+ 0 0 95 -4,-2.4 4,-2.8 -5,-0.2 -2,-0.2 0.875 107.8 55.0 -60.4 -38.5 7.7 14.8 39.1 93 94 A F H X S+ 0 0 0 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.944 113.4 39.6 -60.8 -50.9 11.0 14.4 37.2 94 95 A F H <>S+ 0 0 0 -4,-2.1 5,-2.6 1,-0.2 3,-0.5 0.933 116.2 51.6 -67.0 -42.3 11.2 18.1 36.3 95 96 A D H ><5S+ 0 0 67 -4,-2.9 3,-1.7 1,-0.2 -2,-0.2 0.903 106.2 54.4 -62.3 -40.5 9.9 19.1 39.8 96 97 A E H 3<5S+ 0 0 111 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.801 111.2 45.9 -61.5 -29.7 12.5 16.9 41.5 97 98 A H T 3<5S- 0 0 68 -4,-1.1 -1,-0.3 -3,-0.5 -29,-0.2 0.215 111.0-122.7 -97.5 12.3 15.3 18.6 39.6 98 99 A Q T < 5 + 0 0 188 -3,-1.7 2,-0.4 1,-0.2 -3,-0.2 0.873 61.2 156.8 48.1 45.0 13.8 22.1 40.3 99 100 A A < - 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