==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-MAY-08 3D60 . COMPND 2 MOLECULE: INTRACELLULAR ARABINANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR A.ALHASSID,A.BEN DAVID,Y.SHOHAM,G.SHOHAM . 314 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13703.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 192 61.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 36.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.6 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 . 31 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 1 4 2 2 2 3 2 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 . 3 0 4 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 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 V > 0 0 71 0, 0.0 3,-1.3 0, 0.0 274,-0.1 0.000 360.0 360.0 360.0 141.5 -22.8 5.9 34.7 2 3 A H T 3 + 0 0 109 1,-0.3 87,-0.0 2,-0.1 86,-0.0 0.796 360.0 51.2 -60.6 -29.0 -20.0 7.9 36.3 3 4 A F T 3 S+ 0 0 13 1,-0.3 86,-2.2 148,-0.1 -1,-0.3 0.544 116.0 39.1 -88.7 -6.4 -18.5 8.9 33.0 4 5 A H S < S+ 0 0 13 -3,-1.3 271,-0.4 84,-0.2 -1,-0.3 -0.552 85.8 179.9-136.0 64.5 -21.7 10.2 31.5 5 6 A P + 0 0 50 0, 0.0 26,-0.7 0, 0.0 -3,-0.1 -0.469 20.7 165.3 -74.5 138.4 -23.3 11.9 34.6 6 7 A F > - 0 0 7 1,-0.3 3,-0.8 -2,-0.2 2,-0.3 0.323 38.4-134.7-131.0 2.9 -26.6 13.7 34.4 7 8 A G T 3 - 0 0 59 1,-0.2 -1,-0.3 24,-0.1 270,-0.2 -0.562 60.4 -33.4 81.2-140.1 -27.6 14.1 38.0 8 9 A N T 3 S+ 0 0 164 -2,-0.3 -1,-0.2 268,-0.1 268,-0.1 0.041 90.2 137.4-109.2 25.2 -31.1 13.3 39.2 9 10 A V < - 0 0 34 -3,-0.8 2,-0.6 1,-0.1 270,-0.2 -0.348 49.6-137.2 -69.3 151.9 -32.9 14.4 36.1 10 11 A N >> - 0 0 46 1,-0.1 3,-1.6 268,-0.1 4,-0.8 -0.849 14.4-170.8-117.6 94.9 -35.7 12.1 34.9 11 12 A F T 34 S+ 0 0 0 -2,-0.6 3,-0.3 265,-0.3 -1,-0.1 0.761 85.0 59.1 -51.6 -32.7 -35.5 11.7 31.1 12 13 A Y T 34 S+ 0 0 57 1,-0.2 -1,-0.3 -3,-0.1 291,-0.0 0.751 104.8 48.7 -72.1 -25.2 -38.9 9.9 31.0 13 14 A E T <4 S+ 0 0 158 -3,-1.6 -1,-0.2 2,-0.1 -2,-0.2 0.599 95.8 95.2 -89.6 -13.4 -40.7 12.9 32.6 14 15 A M S < S- 0 0 46 -4,-0.8 2,-0.6 -3,-0.3 -3,-0.0 -0.421 75.4-123.4 -82.2 153.6 -39.2 15.4 30.2 15 16 A D - 0 0 104 -2,-0.1 -2,-0.1 1,-0.1 -1,-0.1 -0.852 19.8-166.8 -94.8 120.9 -40.6 16.7 27.0 16 17 A W + 0 0 31 -2,-0.6 2,-1.4 2,-0.1 283,-0.3 -0.173 42.3 129.4-103.8 41.8 -38.2 16.1 24.1 17 18 A S - 0 0 70 283,-0.0 -2,-0.1 38,-0.0 37,-0.1 -0.728 52.6-153.3 -93.2 84.1 -39.8 18.4 21.5 18 19 A L + 0 0 29 -2,-1.4 2,-0.3 281,-0.2 37,-0.2 -0.142 19.6 177.4 -62.0 153.6 -36.6 20.1 20.7 19 20 A K E +a 55 0A 108 35,-2.1 37,-2.7 2,-0.1 2,-0.4 -0.963 38.1 43.5-151.2 162.4 -36.3 23.6 19.3 20 21 A G E S+a 56 0A 56 -2,-0.3 2,-1.0 35,-0.2 37,-0.2 -0.812 108.5 0.9 104.6-143.1 -33.6 26.1 18.3 21 22 A D + 0 0 64 35,-2.6 -2,-0.1 -2,-0.4 0, 0.0 -0.758 69.7 156.9 -87.7 102.7 -30.5 25.2 16.3 22 23 A L + 0 0 37 -2,-1.0 275,-3.1 -4,-0.1 2,-0.3 0.343 22.5 123.1-111.3 4.3 -30.9 21.5 15.7 23 24 A W B +B 296 0B 107 273,-0.2 2,-0.3 262,-0.1 273,-0.3 -0.536 39.6 143.0 -67.7 127.6 -28.7 20.8 12.6 24 25 A A - 0 0 0 271,-2.4 2,-0.4 -2,-0.3 262,-0.2 -0.928 40.5-155.1-170.1 142.8 -26.3 18.1 13.6 25 26 A H S S- 0 0 28 16,-0.4 16,-2.6 -2,-0.3 59,-0.1 -0.988 84.2 -7.4-122.4 130.1 -24.5 15.0 12.4 26 27 A A S S- 0 0 4 -2,-0.4 -1,-0.2 243,-0.2 2,-0.2 0.928 85.0-170.1 50.9 59.0 -23.3 12.4 15.0 27 28 A P - 0 0 1 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.497 12.3-172.3 -81.7 147.8 -24.2 14.4 18.1 28 29 A V E -E 39 0C 8 11,-2.0 11,-2.2 -2,-0.2 2,-0.3 -0.932 12.7-141.7-131.9 155.9 -23.1 13.4 21.7 29 30 A I E +E 38 0C 2 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.914 19.3 172.8-127.5 150.7 -24.3 15.0 24.9 30 31 A A E -E 37 0C 12 7,-1.9 7,-2.8 -2,-0.3 2,-0.4 -0.981 15.9-150.4-149.1 148.3 -22.8 15.9 28.3 31 32 A K E +E 36 0C 48 -26,-0.7 2,-0.4 -2,-0.3 5,-0.2 -0.989 12.2 178.9-127.9 132.7 -24.2 17.9 31.2 32 33 A E E > -E 35 0C 44 3,-2.3 3,-1.8 -2,-0.4 2,-0.2 -0.968 66.5 -41.4-133.5 114.2 -22.1 19.9 33.7 33 34 A G T 3 S- 0 0 61 -2,-0.4 0, 0.0 1,-0.3 0, 0.0 -0.485 123.4 -24.2 67.1-133.3 -24.1 21.7 36.4 34 35 A S T 3 S+ 0 0 82 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.363 119.1 95.3 -93.4 4.1 -27.2 23.2 34.9 35 36 A R E < -E 32 0C 62 -3,-1.8 -3,-2.3 17,-0.1 2,-0.3 -0.821 57.7-155.9-103.9 137.0 -25.8 23.4 31.4 36 37 A W E -EF 31 50C 8 14,-3.2 14,-2.1 -2,-0.4 2,-0.4 -0.829 13.1-163.0-105.0 145.5 -26.3 20.8 28.6 37 38 A Y E -EF 30 49C 11 -7,-2.8 -7,-1.9 -2,-0.3 2,-0.4 -0.989 10.4-163.3-134.9 139.7 -23.8 20.5 25.8 38 39 A V E -EF 29 48C 0 10,-2.8 10,-2.4 -2,-0.4 2,-0.4 -0.977 5.0-168.1-120.6 132.0 -23.9 18.8 22.4 39 40 A F E +EF 28 47C 2 -11,-2.2 -11,-2.0 -2,-0.4 2,-0.3 -0.972 21.5 159.8-116.6 133.2 -20.7 18.1 20.4 40 41 A H E - F 0 46C 4 6,-2.1 6,-1.8 -2,-0.4 -14,-0.2 -0.938 42.7 -62.7-148.6 173.3 -21.1 17.1 16.8 41 42 A T S S+ 0 0 12 -16,-2.6 -16,-0.4 -2,-0.3 2,-0.3 -0.223 78.3 86.7 -57.3 140.2 -19.5 16.8 13.4 42 43 A G E > S-H 82 0D 4 40,-2.1 40,-2.6 -18,-0.1 3,-2.2 -0.912 79.5 -16.9 154.2-179.8 -18.3 20.1 11.8 43 44 A S E 3 S-H 81 0D 38 1,-0.3 38,-0.3 -2,-0.3 19,-0.1 -0.308 130.3 -18.1 -54.3 117.9 -15.5 22.6 11.5 44 45 A G T 3 S- 0 0 1 36,-2.6 19,-2.1 -2,-0.1 18,-0.9 0.645 130.0 -57.2 56.5 19.4 -13.1 22.0 14.4 45 46 A I < - 0 0 0 -3,-2.2 17,-1.8 37,-0.2 18,-0.2 0.775 68.4-120.3 74.9 111.6 -15.9 20.1 16.2 46 47 A Q E -FG 40 61C 40 -6,-1.8 -6,-2.1 36,-0.2 2,-0.4 -0.524 23.2-153.0 -83.4 148.2 -19.1 22.1 16.6 47 48 A I E -F 39 0C 9 13,-2.0 12,-3.0 -8,-0.2 2,-0.3 -0.955 11.9-177.4-125.7 140.7 -20.7 22.8 20.0 48 49 A K E -FG 38 58C 3 -10,-2.4 -10,-2.8 -2,-0.4 2,-0.3 -0.941 10.2-160.7-128.9 151.4 -24.3 23.5 21.0 49 50 A T E -FG 37 57C 14 8,-2.4 8,-2.1 -2,-0.3 2,-0.3 -0.939 7.4-176.3-133.7 158.2 -25.5 24.4 24.5 50 51 A S E -F 36 0C 3 -14,-2.1 -14,-3.2 -2,-0.3 6,-0.1 -0.993 26.9-147.8-153.4 149.6 -28.9 24.3 26.3 51 52 A E S S+ 0 0 112 4,-0.5 -1,-0.1 -2,-0.3 5,-0.1 0.825 105.6 16.4 -84.3 -36.8 -30.4 25.2 29.7 52 53 A D S S- 0 0 65 3,-0.3 4,-0.1 -16,-0.1 -1,-0.1 0.463 102.7-111.7-116.5 -7.3 -32.9 22.4 29.7 53 54 A G S S+ 0 0 0 2,-0.4 3,-0.1 -17,-0.1 -35,-0.1 0.473 106.8 74.5 86.9 1.6 -31.7 20.1 27.0 54 55 A V S S+ 0 0 17 1,-0.2 -35,-2.1 -36,-0.1 2,-0.7 0.740 85.3 56.2-111.7 -43.8 -34.7 21.0 24.9 55 56 A H E S-a 19 0A 101 -37,-0.2 -4,-0.5 -35,-0.1 -2,-0.4 -0.856 75.4-166.9 -96.1 114.3 -33.9 24.4 23.5 56 57 A W E -a 20 0A 5 -37,-2.7 -35,-2.6 -2,-0.7 2,-0.4 -0.812 11.7-174.1-108.6 144.3 -30.5 24.4 21.7 57 58 A E E -G 49 0C 121 -8,-2.1 -8,-2.4 -2,-0.4 2,-0.1 -0.997 29.2-114.7-135.1 135.6 -28.3 27.2 20.6 58 59 A N E +G 48 0C 68 -2,-0.4 -10,-0.3 -10,-0.2 2,-0.1 -0.455 37.7 173.9 -69.8 138.5 -25.1 27.0 18.5 59 60 A M E - 0 0 85 -12,-3.0 -1,-0.1 1,-0.3 -12,-0.1 -0.027 38.1 -65.9-116.1-136.6 -22.0 28.1 20.4 60 61 A G E - 0 0 35 -2,-0.1 -13,-2.0 -14,-0.1 -1,-0.3 0.388 50.2-101.8 -93.8-132.2 -18.4 27.9 19.2 61 62 A W E -G 46 0C 129 -15,-0.2 -15,-0.2 1,-0.1 -16,-0.2 -0.964 17.8-116.0-154.3 164.6 -16.1 25.0 18.4 62 63 A V S S+ 0 0 9 -17,-1.8 65,-0.2 -18,-0.9 -17,-0.2 0.939 100.6 35.4 -72.6 -50.5 -13.2 23.1 20.0 63 64 A F - 0 0 16 -19,-2.1 -1,-0.2 -18,-0.2 3,-0.1 -0.870 53.8-176.2-113.9 102.9 -10.4 23.8 17.5 64 65 A P S S+ 0 0 108 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.846 89.0 21.5 -61.9 -30.4 -10.3 27.3 15.9 65 66 A S S S- 0 0 91 -3,-0.1 15,-0.0 -21,-0.1 0, 0.0 -0.999 94.2-112.9-138.6 133.7 -7.4 26.0 13.9 66 67 A L - 0 0 46 -2,-0.4 14,-0.0 -3,-0.1 -3,-0.0 -0.430 35.1-105.9 -71.5 135.9 -6.5 22.3 13.3 67 68 A P > - 0 0 20 0, 0.0 3,-1.3 0, 0.0 4,-0.3 -0.253 24.2-126.3 -57.1 143.0 -3.4 20.8 14.9 68 69 A D T > S+ 0 0 156 1,-0.2 3,-1.4 2,-0.2 4,-0.4 0.791 100.5 74.5 -63.9 -28.0 -0.5 20.2 12.4 69 70 A W T >> S+ 0 0 48 1,-0.3 3,-1.4 2,-0.2 4,-0.7 0.712 77.5 76.2 -61.8 -18.2 -0.2 16.5 13.3 70 71 A Y H X> S+ 0 0 11 -3,-1.3 4,-2.9 1,-0.3 3,-1.6 0.906 87.7 61.4 -55.9 -41.5 -3.3 15.7 11.4 71 72 A K H <4 S+ 0 0 152 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.721 92.8 63.9 -58.7 -24.2 -1.3 16.0 8.2 72 73 A Q H <4 S+ 0 0 163 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.794 117.7 26.8 -71.5 -26.3 1.0 13.2 9.3 73 74 A Y H << S+ 0 0 66 -3,-1.6 -2,-0.2 -4,-0.7 -1,-0.2 0.760 136.4 25.2-105.2 -33.1 -2.0 10.8 9.2 74 75 A V >< + 0 0 4 -4,-2.9 3,-1.4 -5,-0.1 -1,-0.2 -0.610 63.1 163.9-133.9 70.5 -4.3 12.4 6.6 75 76 A P T 3 S+ 0 0 74 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.802 74.6 61.1 -58.9 -29.7 -2.1 14.5 4.3 76 77 A E T 3 S+ 0 0 152 -3,-0.1 2,-0.2 31,-0.1 -5,-0.1 0.657 74.1 114.4 -73.8 -17.1 -4.9 14.6 1.7 77 78 A K < + 0 0 30 -3,-1.4 25,-0.1 1,-0.2 -3,-0.1 -0.371 34.5 171.6 -60.8 124.5 -7.4 16.4 4.0 78 79 A D + 0 0 149 -2,-0.2 2,-0.2 0, 0.0 -1,-0.2 0.539 55.3 56.2-111.7 -11.6 -8.1 19.9 2.6 79 80 A E S S- 0 0 68 2,-0.1 0, 0.0 1,-0.0 0, 0.0 -0.665 77.9-119.8-116.7 175.3 -11.0 21.1 4.8 80 81 A D + 0 0 71 -2,-0.2 -36,-2.6 2,-0.1 2,-0.5 0.142 60.4 128.7-105.0 21.0 -11.5 21.5 8.6 81 82 A H E -H 43 0D 78 -38,-0.3 2,-0.4 -37,-0.1 20,-0.4 -0.652 38.1-163.8 -81.4 124.3 -14.4 19.2 9.4 82 83 A L E -H 42 0D 0 -40,-2.6 -40,-2.1 -2,-0.5 2,-0.3 -0.878 19.9-131.0-104.5 139.6 -13.8 16.8 12.3 83 84 A W E -I 99 0E 47 16,-2.4 16,-2.4 -2,-0.4 63,-0.2 -0.669 51.5 -17.4-106.1 154.6 -16.2 13.9 12.6 84 85 A A E - 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