==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN TRANSPORT 22-JAN-04 1S62 . COMPND 2 MOLECULE: TOLA PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.DEPREZ,L.BLANCHARD,J.-P.SIMORRE,M.GAVIOLI,F.GUERLESQUIN, . 102 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6716.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 60 58.8 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 . 10 9.8 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 . 1 1.0 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 . 8 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 29.4 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+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 1 0 0 0 0 1 0 0 1 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 . 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 A A 0 0 107 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 102.4 12.4 -13.2 6.1 2 2 A E - 0 0 142 1,-0.1 4,-0.1 2,-0.0 3,-0.0 0.550 360.0-146.0 -99.4 -8.8 13.2 -12.4 2.5 3 3 A F - 0 0 153 1,-0.2 3,-0.2 2,-0.1 -1,-0.1 0.122 26.2 -87.1 67.8 174.8 16.0 -9.9 3.3 4 4 A G S S+ 0 0 61 1,-0.3 2,-0.2 2,-0.1 -1,-0.2 0.634 119.4 16.7 -92.5 -15.4 17.0 -6.8 1.4 5 5 A N + 0 0 99 3,-0.1 -1,-0.3 1,-0.1 -2,-0.1 -0.698 61.1 164.7-159.3 94.5 19.2 -8.7 -0.9 6 6 A T S S- 0 0 91 -3,-0.2 -3,-0.1 -2,-0.2 -1,-0.1 0.806 86.9 -26.7 -84.3 -30.7 18.9 -12.5 -1.1 7 7 A K S S- 0 0 187 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.345 128.5 -21.2-144.2 -68.6 20.9 -12.8 -4.3 8 8 A N S S+ 0 0 145 0, 0.0 2,-0.2 0, 0.0 3,-0.1 -0.422 96.9 111.1-153.4 65.8 20.9 -9.8 -6.5 9 9 A N + 0 0 49 1,-0.1 -5,-0.1 2,-0.1 0, 0.0 -0.681 16.0 101.1-131.5-178.4 17.9 -7.6 -5.7 10 10 A G S S+ 0 0 48 -2,-0.2 -1,-0.1 -5,-0.0 -5,-0.1 0.404 100.1 39.4 113.8 2.6 17.1 -4.3 -4.2 11 11 A A S S+ 0 0 92 -3,-0.1 -2,-0.1 75,-0.0 0, 0.0 0.108 81.2 99.4-165.7 23.2 16.6 -2.5 -7.5 12 12 A S S S- 0 0 84 1,-0.0 -3,-0.0 0, 0.0 0, 0.0 0.699 89.0-117.6 -90.4 -22.9 14.7 -4.9 -9.6 13 13 A G S > S+ 0 0 29 0, 0.0 4,-2.8 0, 0.0 5,-0.2 -0.327 103.8 78.4 116.3 -48.8 11.3 -3.4 -9.0 14 14 A A H > S+ 0 0 76 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.735 89.3 61.9 -66.1 -18.6 9.6 -6.3 -7.3 15 15 A D H > S+ 0 0 29 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.946 109.4 38.3 -70.2 -47.3 11.5 -5.3 -4.2 16 16 A I H > S+ 0 0 58 1,-0.2 4,-1.7 2,-0.2 3,-0.4 0.898 113.9 56.2 -68.8 -39.5 9.8 -1.9 -4.1 17 17 A N H X S+ 0 0 105 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.801 101.6 58.9 -62.9 -26.9 6.5 -3.6 -5.2 18 18 A N H X S+ 0 0 97 -4,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.881 102.0 52.3 -69.9 -36.0 6.9 -5.8 -2.1 19 19 A Y H X S+ 0 0 61 -4,-1.1 4,-0.7 -3,-0.4 -2,-0.2 0.879 111.4 46.9 -69.1 -31.1 6.9 -2.8 0.1 20 20 A A H X S+ 0 0 8 -4,-1.7 4,-1.1 1,-0.2 3,-0.5 0.845 110.0 54.8 -73.4 -33.3 3.7 -1.7 -1.6 21 21 A G H X S+ 0 0 20 -4,-1.9 4,-2.5 1,-0.2 5,-0.3 0.819 94.4 66.7 -69.2 -32.3 2.5 -5.3 -1.1 22 22 A Q H X S+ 0 0 62 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.839 103.2 47.6 -60.1 -30.2 3.1 -5.2 2.6 23 23 A I H X S+ 0 0 10 -4,-0.7 4,-1.2 -3,-0.5 -1,-0.2 0.857 108.4 55.6 -76.4 -35.1 0.3 -2.6 2.8 24 24 A K H X S+ 0 0 54 -4,-1.1 4,-0.7 1,-0.2 3,-0.3 0.920 110.8 43.1 -62.3 -46.5 -1.9 -4.8 0.6 25 25 A S H >X S+ 0 0 54 -4,-2.5 4,-1.0 1,-0.2 3,-0.6 0.847 108.3 60.1 -69.0 -34.5 -1.6 -7.7 3.0 26 26 A A H 3< S+ 0 0 15 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.794 97.8 60.4 -61.4 -32.4 -2.0 -5.5 6.1 27 27 A I H >< S+ 0 0 6 -4,-1.2 3,-1.3 -3,-0.3 4,-0.4 0.820 97.0 58.5 -68.0 -32.8 -5.4 -4.4 4.8 28 28 A E H XX S+ 0 0 25 -4,-0.7 3,-1.6 -3,-0.6 4,-1.6 0.897 97.9 59.1 -65.2 -40.1 -6.8 -8.0 4.9 29 29 A S T 3< S+ 0 0 86 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.309 102.8 56.4 -74.4 14.1 -6.1 -8.3 8.6 30 30 A K T <4 S+ 0 0 81 -3,-1.3 -1,-0.3 2,-0.2 -2,-0.2 0.464 125.6 14.9-119.3 -8.6 -8.4 -5.4 9.1 31 31 A F T <4 S- 0 0 127 -3,-1.6 2,-0.3 -4,-0.4 -2,-0.2 0.639 104.6-110.5-122.7 -64.7 -11.4 -6.9 7.3 32 32 A Y >< - 0 0 167 -4,-1.6 3,-1.1 -5,-0.2 -1,-0.3 -0.904 61.6 -48.4 161.4-154.9 -10.9 -10.7 6.9 33 33 A D T 3 S+ 0 0 109 -2,-0.3 -4,-0.1 1,-0.2 -5,-0.1 0.202 121.3 95.6 -86.6 23.6 -10.3 -12.8 3.9 34 34 A A T 3 S+ 0 0 47 -6,-0.3 -1,-0.2 1,-0.2 -6,-0.1 0.828 71.5 58.7 -78.0 -35.4 -13.2 -10.6 3.0 35 35 A S S < S+ 0 0 6 -3,-1.1 2,-2.0 1,-0.2 66,-0.3 0.703 86.3 89.0 -66.9 -17.5 -10.9 -8.1 1.3 36 36 A S + 0 0 49 64,-0.2 -1,-0.2 -4,-0.2 -3,-0.1 -0.414 58.9 132.0 -81.7 65.8 -10.0 -11.1 -0.8 37 37 A Y - 0 0 155 -2,-2.0 2,-0.3 29,-0.0 -2,-0.1 0.198 43.9-135.7 -86.4-142.6 -12.6 -10.6 -3.4 38 38 A A + 0 0 67 1,-0.0 3,-0.1 3,-0.0 63,-0.0 -0.945 68.0 40.6-176.1 157.3 -12.0 -10.6 -7.2 39 39 A G S S+ 0 0 85 -2,-0.3 2,-0.3 1,-0.3 -1,-0.0 0.805 90.9 107.7 70.1 30.5 -12.7 -8.8 -10.4 40 40 A K - 0 0 62 23,-0.0 2,-0.3 26,-0.0 -1,-0.3 -0.926 50.5-156.9-135.1 162.8 -12.3 -5.4 -8.8 41 41 A T - 0 0 74 -2,-0.3 21,-2.2 58,-0.1 22,-2.0 -1.000 5.9-175.0-141.1 139.7 -9.9 -2.5 -8.8 42 42 A a - 0 0 0 -2,-0.3 56,-3.2 19,-0.3 2,-0.4 -0.609 7.5-171.3-138.0 79.6 -9.3 0.2 -6.2 43 43 A T B -A 97 0A 43 54,-0.3 17,-3.4 -2,-0.2 2,-0.5 -0.535 11.7-161.4 -70.1 121.0 -6.8 2.8 -7.3 44 44 A L E -B 59 0B 0 52,-2.5 2,-1.5 -2,-0.4 52,-0.4 -0.938 17.6-141.5-113.6 124.6 -6.0 5.1 -4.4 45 45 A R E +B 58 0B 127 13,-3.4 13,-0.7 -2,-0.5 2,-0.3 -0.652 44.2 164.0 -81.0 88.2 -4.4 8.5 -4.8 46 46 A I E -B 57 0B 17 -2,-1.5 2,-0.4 11,-0.2 11,-0.2 -0.845 29.1-167.1-113.9 153.0 -2.2 8.3 -1.7 47 47 A K E -B 56 0B 75 9,-1.5 8,-2.4 -2,-0.3 9,-0.9 -0.949 10.9-155.6-140.3 112.6 0.8 10.3 -0.6 48 48 A L E -B 54 0B 13 43,-2.0 6,-0.3 -2,-0.4 -2,-0.0 -0.819 12.6-140.7 -95.6 118.6 2.9 9.0 2.3 49 49 A A E >> -B 53 0B 12 4,-3.2 3,-2.7 -2,-0.7 4,-0.6 -0.261 32.2-102.2 -67.6 159.0 4.9 11.6 4.2 50 50 A P T 34 S+ 0 0 76 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.662 122.4 65.7 -57.0 -15.9 8.5 10.7 5.4 51 51 A D T 34 S- 0 0 100 2,-0.2 30,-0.1 30,-0.1 -2,-0.1 0.446 122.6-103.8 -86.8 -0.9 6.9 10.2 8.8 52 52 A G T <4 S+ 0 0 18 -3,-2.7 2,-0.3 1,-0.3 27,-0.2 0.948 79.7 120.6 78.5 52.9 5.0 7.2 7.5 53 53 A M E < -B 49 0B 107 -4,-0.6 -4,-3.2 -6,-0.0 2,-0.9 -0.995 63.3-120.2-148.7 140.6 1.5 8.7 7.2 54 54 A L E +B 48 0B 34 -2,-0.3 -6,-0.2 -6,-0.3 3,-0.1 -0.725 27.8 174.2 -86.2 107.5 -0.9 9.2 4.3 55 55 A L E S+ 0 0 104 -8,-2.4 2,-0.4 -2,-0.9 -1,-0.2 0.866 74.0 42.5 -76.6 -37.4 -1.6 12.9 3.8 56 56 A D E +B 47 0B 71 -9,-0.9 -9,-1.5 -3,-0.2 2,-0.3 -0.906 62.4 162.9-112.7 140.1 -3.6 12.3 0.7 57 57 A I E +B 46 0B 37 -2,-0.4 -11,-0.2 -11,-0.2 -13,-0.0 -0.806 8.1 156.2-158.8 106.3 -6.1 9.5 0.2 58 58 A K E -B 45 0B 125 -13,-0.7 -13,-3.4 -2,-0.3 2,-0.7 -0.982 38.5-127.3-140.4 127.1 -8.7 9.4 -2.6 59 59 A P E +B 44 0B 43 0, 0.0 -15,-0.2 0, 0.0 -16,-0.1 -0.617 40.9 152.3 -76.6 111.1 -10.5 6.5 -4.2 60 60 A E + 0 0 104 -17,-3.4 -16,-0.2 -2,-0.7 -18,-0.1 0.009 40.7 110.1-124.2 21.5 -10.1 6.8 -8.0 61 61 A G S S- 0 0 33 -18,-0.5 -19,-0.3 2,-0.2 36,-0.0 0.321 80.2-100.6 -79.8-151.8 -10.4 3.1 -8.7 62 62 A G S S+ 0 0 59 -21,-2.2 -20,-0.2 1,-0.2 -1,-0.0 0.548 99.7 64.9-115.8 -13.0 -13.2 1.1 -10.4 63 63 A D > - 0 0 21 -22,-2.0 4,-2.0 1,-0.1 5,-0.2 -0.946 57.3-168.0-117.6 112.5 -15.1 -0.3 -7.4 64 64 A P H > S+ 0 0 92 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.780 89.7 47.9 -69.0 -27.4 -16.8 2.2 -5.2 65 65 A A H > S+ 0 0 66 2,-0.2 4,-2.1 3,-0.2 5,-0.3 0.951 113.1 44.9 -77.7 -51.7 -17.5 -0.3 -2.5 66 66 A L H > S+ 0 0 28 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.891 118.0 46.0 -56.9 -44.1 -14.0 -1.8 -2.3 67 67 A a H X S+ 0 0 2 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.872 108.6 54.8 -69.8 -38.9 -12.5 1.6 -2.4 68 68 A Q H X S+ 0 0 111 -4,-1.4 4,-0.6 1,-0.2 -2,-0.2 0.899 116.0 38.5 -62.2 -40.8 -14.9 3.1 0.3 69 69 A A H >X S+ 0 0 34 -4,-2.1 4,-2.3 1,-0.2 3,-0.5 0.825 108.5 63.6 -77.3 -34.7 -13.9 0.3 2.7 70 70 A A H 3X S+ 0 0 7 -4,-2.0 4,-3.1 -5,-0.3 5,-0.3 0.854 93.8 62.4 -58.6 -37.9 -10.3 0.3 1.7 71 71 A L H 3X S+ 0 0 35 -4,-1.7 4,-1.0 1,-0.2 -1,-0.2 0.889 111.1 37.6 -55.3 -44.0 -9.9 3.9 3.0 72 72 A A H < S+ 0 0 4 -4,-3.1 3,-0.8 1,-0.2 -1,-0.2 0.858 107.7 53.0 -67.0 -35.3 -5.7 1.0 5.0 75 75 A K H 3< S+ 0 0 136 -4,-1.0 -1,-0.2 -5,-0.3 -2,-0.2 0.757 109.8 49.1 -71.2 -23.3 -5.7 3.6 7.7 76 76 A L T 3< S+ 0 0 119 -4,-1.0 -1,-0.2 -3,-0.2 -2,-0.2 0.448 96.5 98.9 -92.3 -3.6 -6.0 0.9 10.3 77 77 A A S < S- 0 0 10 -3,-0.8 2,-0.8 -4,-0.3 -50,-0.1 -0.283 83.8-103.9 -80.1 168.3 -3.1 -1.0 8.6 78 78 A K + 0 0 173 -56,-0.2 -52,-0.1 -55,-0.1 -2,-0.1 -0.840 42.8 170.2-100.6 106.6 0.5 -1.0 9.8 79 79 A I - 0 0 36 -2,-0.8 2,-0.0 -27,-0.2 -56,-0.0 -0.966 19.9-147.8-119.4 116.9 2.7 1.2 7.6 80 80 A P - 0 0 55 0, 0.0 -28,-0.0 0, 0.0 -27,-0.0 -0.234 32.5 -79.5 -79.0 172.4 6.3 1.9 8.8 81 81 A K - 0 0 128 1,-0.1 -30,-0.1 -30,-0.1 7,-0.1 -0.578 56.0-103.2 -74.4 124.3 8.5 4.9 8.3 82 82 A P + 0 0 18 0, 0.0 -1,-0.1 0, 0.0 -30,-0.0 -0.283 48.8 171.5 -53.6 115.0 10.1 4.9 4.8 83 83 A P + 0 0 77 0, 0.0 -2,-0.0 0, 0.0 5,-0.0 0.909 50.1 63.8 -92.1 -75.6 13.7 3.8 5.3 84 84 A S S > S- 0 0 59 1,-0.1 4,-3.2 4,-0.1 5,-0.2 -0.285 78.2-131.4 -58.4 134.6 15.5 3.2 2.0 85 85 A Q H > S+ 0 0 154 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.857 106.7 54.5 -58.8 -36.5 15.9 6.3 -0.1 86 86 A A H > S+ 0 0 49 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.942 113.8 40.2 -63.0 -47.4 14.6 4.5 -3.2 87 87 A V H >> S+ 0 0 11 1,-0.2 4,-3.3 2,-0.2 3,-0.6 0.918 116.5 50.7 -66.7 -43.6 11.5 3.4 -1.4 88 88 A Y H 3X S+ 0 0 77 -4,-3.2 4,-1.9 1,-0.2 -2,-0.2 0.884 104.6 57.2 -60.9 -41.6 11.1 6.7 0.3 89 89 A E H 3< S+ 0 0 107 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.765 117.0 35.9 -62.9 -24.8 11.4 8.6 -3.0 90 90 A V H X< S+ 0 0 67 -4,-0.8 3,-1.9 -3,-0.6 -2,-0.2 0.838 111.5 57.7 -92.4 -45.0 8.5 6.6 -4.3 91 91 A F H >< S+ 0 0 14 -4,-3.3 -43,-2.0 1,-0.3 3,-1.0 0.785 92.2 70.0 -59.9 -30.5 6.4 6.4 -1.1 92 92 A K T 3< S+ 0 0 75 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.1 0.624 123.7 11.4 -66.3 -8.2 6.2 10.1 -0.8 93 93 A N T < S+ 0 0 95 -3,-1.9 -1,-0.3 -46,-0.1 -2,-0.2 -0.241 86.3 138.3-164.4 59.9 4.0 10.0 -3.9 94 94 A A < - 0 0 9 -3,-1.0 2,-0.9 -48,-0.1 -4,-0.1 -0.760 29.7-168.6-115.7 89.2 2.9 6.4 -4.6 95 95 A P - 0 0 65 0, 0.0 2,-0.3 0, 0.0 -50,-0.2 -0.620 21.5-172.6 -76.1 103.1 -0.7 6.2 -5.6 96 96 A L - 0 0 36 -2,-0.9 -52,-2.5 -52,-0.4 2,-0.5 -0.757 23.2-125.2-102.8 153.2 -1.3 2.4 -5.5 97 97 A D B -A 43 0A 39 -2,-0.3 2,-0.7 -54,-0.3 -54,-0.3 -0.791 17.9-156.6 -94.4 132.3 -4.2 0.3 -6.5 98 98 A F + 0 0 6 -56,-3.2 3,-0.1 -2,-0.5 -28,-0.1 -0.843 28.0 153.7-114.0 98.9 -5.6 -2.0 -3.8 99 99 A K - 0 0 104 -2,-0.7 -58,-0.1 1,-0.2 -64,-0.0 -0.604 59.9 -39.3-112.2 174.0 -7.5 -4.9 -5.3 100 100 A P S S- 0 0 17 0, 0.0 -1,-0.2 0, 0.0 -64,-0.2 -0.013 71.2-137.6 -37.3 119.9 -8.1 -8.4 -3.9 101 101 A H 0 0 25 -66,-0.3 -3,-0.0 -77,-0.1 -76,-0.0 -0.528 360.0 360.0 -91.4 157.3 -4.9 -9.4 -2.2 102 102 A H 0 0 207 -2,-0.2 -1,-0.1 -66,-0.0 -66,-0.0 -0.475 360.0 360.0 -83.5 360.0 -3.2 -12.8 -2.3