==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-APR-02 1LBW . COMPND 2 MOLECULE: FRUCTOSE 1,6-BISPHOSPHATASE/INOSITOL . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR K.A.STIEGLITZ,K.A.JOHNSON,H.YANG,M.F.ROBERTS,B.A.SEATON, . 504 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19662.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 360 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 107 21.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 1 0.2 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 . 36 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 119 23.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 3 1 0 1 0 2 1 0 0 2 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 3 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 PARALLEL BRIDGES PER LADDER . 6 2 6 6 0 2 2 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 . 2 0 0 1 1 0 2 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 M 0 0 66 0, 0.0 2,-0.2 0, 0.0 59,-0.0 0.000 360.0 360.0 360.0 136.9 57.5 27.6 -0.6 2 2 A D > - 0 0 72 1,-0.0 4,-3.0 111,-0.0 3,-0.3 -0.563 360.0 -83.3-120.0-176.5 56.8 24.6 -2.7 3 3 A E H > S+ 0 0 39 1,-0.3 4,-1.7 2,-0.2 5,-0.1 0.816 128.1 51.1 -60.7 -30.1 56.0 20.9 -2.4 4 4 A R H > S+ 0 0 209 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.845 109.3 48.4 -77.4 -32.9 59.8 20.2 -2.1 5 5 A D H > S+ 0 0 52 -3,-0.3 4,-2.7 1,-0.2 5,-0.3 0.943 109.7 55.6 -68.1 -36.8 60.2 22.8 0.6 6 6 A A H X S+ 0 0 0 -4,-3.0 4,-1.9 1,-0.2 5,-0.2 0.881 106.2 48.6 -63.0 -37.1 57.3 21.2 2.4 7 7 A L H X S+ 0 0 29 -4,-1.7 4,-2.4 -5,-0.2 -1,-0.2 0.965 112.2 49.3 -67.0 -44.5 58.8 17.8 2.4 8 8 A R H X S+ 0 0 107 -4,-1.8 4,-1.9 1,-0.2 5,-0.2 0.907 113.0 46.4 -56.8 -46.7 62.1 19.1 3.8 9 9 A I H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.891 111.6 51.4 -65.9 -38.5 60.4 21.1 6.5 10 10 A S H X S+ 0 0 0 -4,-1.9 4,-3.6 -5,-0.3 5,-0.2 0.945 108.3 52.4 -66.6 -44.5 58.2 18.2 7.5 11 11 A R H X S+ 0 0 108 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.895 109.7 46.1 -58.3 -46.6 61.1 15.8 7.8 12 12 A E H X S+ 0 0 101 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.923 114.3 50.8 -63.7 -41.7 63.2 18.0 10.1 13 13 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.976 106.8 52.5 -56.9 -55.3 60.0 18.6 12.2 14 14 A A H X S+ 0 0 3 -4,-3.6 4,-2.3 1,-0.2 -1,-0.2 0.836 109.8 53.6 -46.4 -35.8 59.4 14.8 12.3 15 15 A G H X S+ 0 0 29 -4,-1.6 4,-2.2 -5,-0.2 -1,-0.2 0.916 109.7 42.5 -69.7 -46.9 63.0 14.5 13.6 16 16 A E H X S+ 0 0 72 -4,-2.3 4,-2.5 -3,-0.3 -2,-0.2 0.972 117.4 46.5 -67.8 -47.3 62.7 17.0 16.5 17 17 A V H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 5,-0.4 0.946 111.9 51.0 -62.6 -44.5 59.3 15.7 17.6 18 18 A R H X S+ 0 0 104 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.931 110.7 51.2 -54.5 -47.0 60.5 12.1 17.4 19 19 A K H X S+ 0 0 145 -4,-2.2 4,-1.1 -5,-0.2 -1,-0.2 0.934 111.5 44.9 -54.3 -53.0 63.5 13.0 19.5 20 20 A A H >< S+ 0 0 24 -4,-2.5 3,-1.2 2,-0.2 4,-0.4 0.976 115.5 42.9 -63.7 -55.8 61.7 14.7 22.3 21 21 A I H >< S+ 0 0 3 -4,-2.0 3,-2.3 1,-0.3 -1,-0.2 0.913 108.9 59.3 -57.7 -44.6 58.8 12.2 22.8 22 22 A A H 3< S+ 0 0 71 -4,-2.0 -1,-0.3 -5,-0.4 -2,-0.2 0.791 102.7 56.0 -55.0 -28.9 61.1 9.2 22.6 23 23 A S T << S+ 0 0 98 -3,-1.2 -1,-0.3 -4,-1.1 -2,-0.2 0.525 92.7 83.9 -82.8 -9.0 63.1 10.6 25.5 24 24 A M S < S- 0 0 25 -3,-2.3 2,-0.0 -4,-0.4 5,-0.0 -0.851 73.1-127.4-111.3 137.2 60.2 10.9 28.0 25 25 A P >> - 0 0 80 0, 0.0 4,-2.2 0, 0.0 3,-1.4 -0.323 28.4-111.5 -66.5 149.9 58.8 8.2 30.2 26 26 A L H 3> S+ 0 0 54 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.862 116.8 59.8 -50.7 -47.6 55.1 7.4 30.2 27 27 A R H 34 S+ 0 0 184 1,-0.2 -1,-0.3 2,-0.2 64,-0.0 0.821 112.5 41.0 -56.9 -29.4 54.6 8.7 33.7 28 28 A E H X4 S+ 0 0 86 -3,-1.4 3,-2.5 2,-0.1 16,-0.4 0.934 108.8 57.3 -80.3 -50.8 55.9 12.1 32.4 29 29 A R H 3< S+ 0 0 20 -4,-2.2 16,-1.9 1,-0.3 17,-0.4 0.862 103.5 56.2 -44.3 -46.5 54.1 12.1 29.0 30 30 A V T 3< S+ 0 0 46 -4,-2.2 2,-0.4 61,-0.3 -1,-0.3 0.477 78.3 118.3 -75.7 -1.3 50.7 11.8 30.7 31 31 A K < - 0 0 102 -3,-2.5 13,-2.3 -5,-0.2 2,-0.4 -0.563 64.8-127.8 -78.3 136.7 51.0 14.8 33.0 32 32 A D B +A 43 0A 103 -2,-0.4 11,-0.2 11,-0.2 -1,-0.1 -0.547 44.3 153.0 -69.6 119.6 48.5 17.6 32.5 33 33 A V + 0 0 76 9,-3.1 10,-0.2 -2,-0.4 2,-0.2 0.552 57.6 165.3-114.9 -11.4 50.3 20.9 32.0 34 34 A G + 0 0 19 8,-1.1 2,-0.5 -3,-0.1 9,-0.1 -0.743 34.9 102.3-176.7 33.6 47.4 21.3 30.4 35 35 A M - 0 0 138 6,-0.3 2,-0.2 -2,-0.2 5,-0.1 -0.889 34.7-176.2-131.1 121.5 44.9 23.6 28.7 36 36 A G > - 0 0 7 4,-2.4 3,-1.9 -2,-0.5 32,-0.2 -0.539 44.7 -88.2-106.0 179.0 44.5 24.0 25.0 37 37 A K T 3 S+ 0 0 139 30,-1.9 31,-0.2 31,-0.5 32,-0.1 0.528 124.7 48.1 -67.7 -8.5 42.4 26.1 22.6 38 38 A D T 3 S- 0 0 64 2,-0.3 -1,-0.3 29,-0.2 30,-0.1 0.663 118.0-105.3-103.4 -18.0 39.6 23.5 22.6 39 39 A G S < S+ 0 0 41 -3,-1.9 -2,-0.1 1,-0.5 0, 0.0 0.215 83.3 126.7 102.3 0.4 39.4 23.0 26.3 40 40 A T - 0 0 49 1,-0.1 -4,-2.4 -5,-0.1 -1,-0.5 -0.605 68.1-100.7 -82.7 144.7 41.1 19.7 26.1 41 41 A P - 0 0 59 0, 0.0 2,-0.6 0, 0.0 -6,-0.3 -0.363 22.5-133.4 -67.1 144.2 44.1 19.3 28.3 42 42 A T - 0 0 4 26,-0.1 -9,-3.1 -2,-0.1 -8,-1.1 -0.900 23.5-154.3 -89.3 113.4 47.7 19.6 27.0 43 43 A K B > -A 32 0A 46 -2,-0.6 4,-1.9 -11,-0.2 3,-0.3 -0.566 32.0-104.8 -85.6 159.8 49.8 16.7 28.3 44 44 A A H > S+ 0 0 15 -13,-2.3 4,-2.0 -16,-0.4 5,-0.3 0.863 124.5 55.9 -51.7 -41.3 53.6 17.1 28.7 45 45 A A H > S+ 0 0 0 -16,-1.9 4,-1.9 1,-0.2 -1,-0.3 0.935 107.1 50.2 -56.4 -43.1 53.9 14.9 25.6 46 46 A D H > S+ 0 0 14 -17,-0.4 4,-1.6 -3,-0.3 -2,-0.2 0.892 110.4 47.8 -64.5 -35.7 51.8 17.4 23.7 47 47 A R H X S+ 0 0 95 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.929 110.1 49.9 -75.8 -41.6 53.7 20.5 24.7 48 48 A V H X S+ 0 0 52 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.878 112.6 48.3 -61.8 -43.8 57.1 19.1 24.0 49 49 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.3 -1,-0.2 0.870 112.4 49.0 -62.5 -40.0 56.0 18.0 20.5 50 50 A E H X S+ 0 0 1 -4,-1.6 4,-3.3 -5,-0.2 5,-0.4 0.984 110.1 50.0 -67.3 -52.7 54.4 21.4 19.8 51 51 A D H X S+ 0 0 92 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.903 111.7 48.6 -49.7 -46.2 57.4 23.4 20.9 52 52 A A H X S+ 0 0 11 -4,-2.0 4,-1.1 -5,-0.2 -1,-0.2 0.950 116.4 43.3 -62.1 -47.5 59.7 21.3 18.7 53 53 A A H >X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 3,-1.7 0.994 115.1 46.0 -58.2 -65.0 57.5 21.7 15.8 54 54 A L H 3X S+ 0 0 12 -4,-3.3 4,-2.3 1,-0.3 -1,-0.2 0.807 104.7 62.7 -55.2 -34.0 56.7 25.4 16.1 55 55 A E H 3< S+ 0 0 120 -4,-2.1 -1,-0.3 -5,-0.4 -2,-0.2 0.862 113.0 36.2 -58.7 -38.2 60.3 26.2 16.7 56 56 A I H X< S+ 0 0 18 -3,-1.7 3,-0.7 -4,-1.1 -2,-0.2 0.855 118.5 51.9 -79.4 -40.8 61.0 25.0 13.2 57 57 A L H >< S+ 0 0 0 -4,-2.1 3,-2.7 1,-0.2 -2,-0.2 0.920 97.6 56.4 -66.6 -55.5 57.8 26.2 11.6 58 58 A R T 3< S+ 0 0 128 -4,-2.3 -1,-0.2 1,-0.3 -3,-0.1 0.367 88.6 77.1 -80.1 15.7 57.4 29.8 12.4 59 59 A K T < S+ 0 0 156 -3,-0.7 -1,-0.3 -5,-0.2 2,-0.2 0.403 93.4 75.5 -80.6 -8.0 60.9 30.6 10.9 60 60 A E S < S- 0 0 58 -3,-2.7 2,-2.2 2,-0.0 15,-0.2 -0.629 103.5-101.1-101.4 161.3 58.7 30.1 7.8 61 61 A R S S+ 0 0 204 -2,-0.2 16,-1.5 13,-0.1 15,-0.5 -0.456 80.3 124.5 -83.9 71.5 56.2 32.5 6.1 62 62 A V E -b 77 0B 0 -2,-2.2 13,-1.2 13,-0.3 2,-0.6 -0.903 63.0-136.0-133.7 153.2 53.3 30.6 7.6 63 63 A T E -b 78 0B 10 14,-1.8 16,-1.8 -2,-0.3 2,-0.4 -0.970 34.6-146.4 -97.7 112.5 50.1 30.9 9.7 64 64 A V E -bC 79 72B 0 8,-3.9 8,-2.7 -2,-0.6 2,-0.5 -0.658 9.8-161.2 -87.9 139.4 50.2 27.8 12.0 65 65 A V E +bC 80 71B 6 14,-2.4 16,-2.6 -2,-0.4 2,-0.3 -0.951 25.8 151.6-118.6 114.3 46.9 26.2 13.0 66 66 A T E > - C 0 70B 4 4,-1.8 4,-0.7 -2,-0.5 16,-0.1 -0.944 46.2-137.0-137.6 155.3 47.1 24.0 16.2 67 67 A E T 4 S+ 0 0 22 14,-0.3 -30,-1.9 -2,-0.3 -29,-0.2 0.910 104.5 50.8 -75.2 -43.1 44.6 22.9 18.9 68 68 A E T 4 S+ 0 0 28 -32,-0.2 -31,-0.5 1,-0.2 -1,-0.1 0.949 130.1 14.5 -57.9 -61.2 47.2 23.4 21.7 69 69 A S T 4 S- 0 0 45 1,-0.3 -1,-0.2 -33,-0.1 -2,-0.2 0.321 98.1-142.3-105.4 6.3 48.3 27.0 20.8 70 70 A G E < -C 66 0B 14 -4,-0.7 -4,-1.8 2,-0.1 2,-0.6 -0.333 59.7 -7.7 72.4-151.6 45.5 28.0 18.3 71 71 A V E S-C 65 0B 83 -6,-0.2 2,-0.4 -4,-0.1 -6,-0.2 -0.729 70.6-170.4 -87.1 120.2 46.3 30.1 15.2 72 72 A L E -C 64 0B 32 -8,-2.7 -8,-3.9 -2,-0.6 -2,-0.1 -0.925 38.2 -9.3-112.8 134.0 49.9 31.4 15.2 73 73 A G - 0 0 42 -2,-0.4 -10,-0.2 -10,-0.3 -12,-0.1 -0.093 60.1-102.7 86.1-175.2 51.4 34.0 12.8 74 74 A E + 0 0 154 -12,-0.4 -11,-0.3 -11,-0.1 -1,-0.1 0.272 64.3 122.9-139.6 6.0 50.6 35.8 9.6 75 75 A G - 0 0 3 -13,-1.2 -13,-0.3 -15,-0.2 -12,-0.1 -0.186 63.1-121.9 -69.2 173.5 52.4 34.3 6.7 76 76 A D S S+ 0 0 121 -15,-0.5 2,-0.6 -14,-0.1 -14,-0.2 0.471 85.8 88.5-110.8 5.4 50.3 33.1 3.7 77 77 A V E S-b 62 0B 16 -16,-1.5 -14,-1.8 30,-0.0 2,-0.6 -0.841 74.3-144.1 -85.2 124.8 51.1 29.4 3.5 78 78 A F E -bD 63 104B 32 26,-1.9 26,-3.1 -2,-0.6 2,-0.5 -0.859 15.8-168.3-100.1 126.6 48.6 27.8 5.8 79 79 A V E -bD 64 103B 0 -16,-1.8 -14,-2.4 -2,-0.6 2,-0.8 -0.952 12.5-154.3-117.4 107.6 49.9 24.7 7.8 80 80 A A E -bD 65 102B 1 22,-2.8 22,-1.8 -2,-0.5 2,-0.5 -0.727 28.6-174.9 -77.7 108.2 47.4 22.5 9.7 81 81 A L E + D 0 101B 0 -16,-2.6 -14,-0.3 -2,-0.8 20,-0.2 -0.950 28.6 170.6-117.5 127.0 49.6 21.1 12.5 82 82 A D E > - D 0 100B 18 18,-2.2 18,-2.7 -2,-0.5 3,-0.5 -0.940 16.1-164.9-128.1 107.9 48.9 18.5 15.2 83 83 A P E 3 S+ 0 0 3 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 0.645 81.7 18.5 -71.7 -19.1 52.3 17.7 16.7 84 84 A L E 3 + 0 0 1 16,-0.1 2,-0.4 15,-0.1 3,-0.4 -0.544 66.4 178.8-156.6 87.8 51.0 14.6 18.4 85 85 A D E < S+ D 0 98B 19 13,-2.6 13,-1.9 -3,-0.5 89,-0.1 -0.780 77.8 41.7 -81.0 126.0 47.8 13.0 17.1 86 86 A G > + 0 0 6 -2,-0.4 4,-2.9 11,-0.2 -1,-0.2 0.688 67.0 155.9 100.7 31.4 47.2 9.8 19.3 87 87 A T H > S+ 0 0 30 -3,-0.4 4,-2.2 1,-0.2 5,-0.2 0.929 71.1 55.7 -59.4 -40.2 48.2 11.4 22.6 88 88 A F H 4 S+ 0 0 22 1,-0.2 4,-0.4 82,-0.2 -1,-0.2 0.933 111.6 44.9 -61.6 -39.5 46.1 8.9 24.5 89 89 A N H >4>S+ 0 0 0 81,-0.4 5,-2.1 7,-0.2 3,-1.5 0.924 110.7 53.7 -65.2 -43.1 48.1 6.1 22.8 90 90 A A H ><5S+ 0 0 0 -4,-2.9 3,-1.1 1,-0.3 -1,-0.2 0.856 102.4 56.5 -63.5 -32.8 51.4 7.8 23.3 91 91 A T T 3<5S+ 0 0 7 -4,-2.2 -1,-0.3 1,-0.3 -61,-0.3 0.588 112.1 43.2 -78.9 -6.9 51.0 8.3 27.1 92 92 A R T < 5S- 0 0 58 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.205 115.8-106.6-118.6 14.5 50.5 4.5 27.5 93 93 A G T < 5 + 0 0 18 -3,-1.1 -3,-0.2 -4,-0.2 -2,-0.1 0.671 69.4 145.7 68.0 18.2 53.2 3.2 25.2 94 94 A I < - 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