==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-MAR-10 2X8F . COMPND 2 MOLECULE: ENDO-ALPHA-1,5-L-ARABINANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR D.DE SANCTIS,J.M.INACIO,P.F.LINDLEY,I.DE SA-NOGUEIRA,I.BENTO . 886 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33183.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 540 60.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 324 36.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 18 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 60 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 5 0 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 RESIDUES PER ALPHA HELIX . 6 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 . 12 4 10 8 8 6 8 2 2 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 2 8 0 0 2 0 2 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 28 A K 0 0 173 0, 0.0 421,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 156.6 2.6 36.5 9.3 2 29 A P - 0 0 40 0, 0.0 2,-0.5 0, 0.0 340,-0.0 -0.222 360.0-150.2 -58.4 136.5 3.1 34.3 12.4 3 30 A I - 0 0 82 338,-0.0 2,-0.3 2,-0.0 416,-0.0 -0.935 12.0-172.5-108.9 131.8 5.3 31.2 12.0 4 31 A F - 0 0 36 -2,-0.5 2,-0.4 34,-0.1 34,-0.3 -0.903 9.7-171.0-116.8 145.3 4.8 28.0 14.0 5 32 A K B -a 38 0A 105 32,-1.8 34,-2.2 -2,-0.3 2,-0.1 -0.979 26.0-139.3-134.1 120.2 7.1 25.0 14.1 6 33 A E - 0 0 73 -2,-0.4 2,-0.3 32,-0.1 35,-0.2 -0.461 20.2-177.0 -91.8 155.6 5.5 22.1 16.0 7 34 A V - 0 0 4 313,-0.2 313,-2.0 -2,-0.1 2,-0.6 -0.941 23.1-130.2-139.9 158.6 6.9 19.5 18.5 8 35 A S + 0 0 54 -2,-0.3 2,-0.4 311,-0.2 22,-0.2 -0.949 39.1 149.2-114.8 109.8 5.5 16.5 20.3 9 36 A V - 0 0 0 -2,-0.6 2,-0.2 20,-0.1 18,-0.1 -0.919 35.5-143.9-138.0 108.5 6.2 16.5 24.1 10 37 A H S S+ 0 0 18 -2,-0.4 16,-2.6 16,-0.3 19,-0.2 -0.557 81.8 6.5 -75.3 137.4 3.6 14.8 26.2 11 38 A D S S- 0 0 13 14,-0.2 -1,-0.2 -2,-0.2 280,-0.1 0.921 89.5-154.2 60.1 53.1 3.0 16.4 29.7 12 39 A P - 0 0 1 0, 0.0 2,-0.5 0, 0.0 13,-0.2 -0.319 13.4-161.9 -69.3 135.2 5.3 19.4 29.0 13 40 A S E -B 24 0B 7 11,-1.8 11,-1.5 280,-0.1 2,-0.1 -0.968 20.3-141.1-116.3 112.5 6.9 21.2 32.1 14 41 A I E +B 23 0B 7 -2,-0.5 2,-0.3 9,-0.2 9,-0.2 -0.435 24.9 172.0 -79.7 143.4 8.1 24.7 31.0 15 42 A I E -B 22 0B 19 7,-2.3 7,-2.7 -2,-0.1 2,-0.5 -0.949 18.5-150.8-149.8 134.2 11.3 26.3 32.2 16 43 A E E +B 21 0B 71 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.879 32.7 141.5-102.4 130.5 12.9 29.5 31.1 17 44 A T E > +B 20 0B 9 3,-2.8 3,-3.1 -2,-0.5 -2,-0.1 -0.983 58.6 17.3-155.6 160.1 16.7 29.8 31.3 18 45 A N T 3 S- 0 0 113 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.830 128.9 -61.4 51.3 31.0 19.6 31.3 29.3 19 46 A G T 3 S+ 0 0 53 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.593 119.0 98.3 71.5 13.0 17.0 33.4 27.4 20 47 A T E < -B 17 0B 23 -3,-3.1 -3,-2.8 15,-0.0 2,-0.4 -0.930 67.9-127.6-136.4 149.6 15.3 30.3 26.0 21 48 A F E -BC 16 33B 27 12,-2.7 12,-2.0 -2,-0.3 2,-0.4 -0.827 24.4-173.6 -98.7 138.2 12.2 28.3 26.9 22 49 A Y E -BC 15 32B 11 -7,-2.7 -7,-2.3 -2,-0.4 2,-0.4 -0.961 11.1-158.2-122.6 146.7 12.4 24.5 27.4 23 50 A V E -BC 14 31B 0 8,-2.4 8,-1.6 -2,-0.4 2,-0.4 -0.995 6.2-169.8-117.8 138.1 9.7 21.9 27.9 24 51 A F E +BC 13 30B 3 -11,-1.5 -11,-1.8 -2,-0.4 6,-0.2 -0.992 20.3 158.0-120.7 126.5 10.5 18.5 29.5 25 52 A G - 0 0 1 4,-2.3 50,-1.4 -2,-0.4 3,-0.5 -0.289 42.6 -43.4-123.3-150.0 7.7 15.9 29.4 26 53 A S S > S+ 0 0 4 -16,-2.6 3,-1.5 48,-0.2 -16,-0.3 -0.381 112.8 35.9 -78.5 165.2 7.2 12.1 29.6 27 54 A H T 3 S- 0 0 74 45,-2.9 -1,-0.2 1,-0.3 46,-0.1 0.760 127.1 -76.2 62.6 26.5 9.5 9.6 27.8 28 55 A L T 3 S+ 0 0 7 -3,-0.5 17,-0.3 45,-0.4 -1,-0.3 0.798 91.1 154.8 52.8 32.4 12.5 11.8 28.5 29 56 A A < + 0 0 6 -3,-1.5 -4,-2.3 15,-0.3 2,-0.3 -0.578 14.7 167.8 -89.2 152.6 11.2 14.0 25.6 30 57 A S E -CD 24 43B 0 13,-1.8 12,-2.6 -6,-0.2 13,-1.7 -0.985 15.0-176.2-161.8 157.0 12.1 17.7 25.4 31 58 A A E -CD 23 41B 0 -8,-1.6 -8,-2.4 -2,-0.3 2,-0.3 -0.960 11.1-148.7-155.0 158.4 12.0 20.7 23.0 32 59 A K E +CD 22 40B 54 8,-2.1 8,-3.1 -2,-0.3 2,-0.3 -0.947 13.5 173.5-134.7 160.3 13.2 24.4 23.1 33 60 A S E -C 21 0B 6 -12,-2.0 -12,-2.7 -2,-0.3 6,-0.1 -0.967 27.5-151.2-161.7 144.8 12.0 27.8 21.6 34 61 A N S S+ 0 0 120 4,-0.5 5,-0.1 -2,-0.3 -1,-0.1 0.654 101.5 26.0 -89.7 -18.7 13.0 31.4 21.8 35 62 A D S S- 0 0 62 3,-0.4 -1,-0.1 -14,-0.1 4,-0.1 0.337 99.9-114.8-131.5 5.2 9.5 32.8 21.2 36 63 A L S S+ 0 0 12 2,-0.3 3,-0.1 1,-0.1 304,-0.1 0.552 105.8 71.9 67.3 10.9 7.0 30.1 22.3 37 64 A M S S+ 0 0 20 1,-0.3 -32,-1.8 304,-0.1 2,-0.7 0.689 89.1 49.0-119.9 -46.7 5.9 29.7 18.6 38 65 A Q B S-a 5 0A 74 -34,-0.3 -4,-0.5 -32,-0.0 -3,-0.4 -0.904 73.4-172.4-103.6 112.6 8.8 28.0 16.8 39 66 A W - 0 0 12 -34,-2.2 2,-0.5 -2,-0.7 -6,-0.2 -0.779 15.3-150.4-103.5 144.4 9.9 24.9 18.7 40 67 A Q E -D 32 0B 110 -8,-3.1 -8,-2.1 -2,-0.3 2,-0.3 -0.981 20.9-129.7-111.8 123.2 12.9 22.6 18.0 41 68 A Q E +D 31 0B 65 -2,-0.5 -10,-0.3 -35,-0.2 3,-0.1 -0.528 30.5 172.5 -68.4 128.3 12.5 19.0 19.1 42 69 A L E - 0 0 47 -12,-2.6 2,-0.3 1,-0.4 -11,-0.2 0.815 62.1 -0.1-104.0 -46.5 15.5 17.8 21.2 43 70 A T E +D 30 0B 12 -13,-1.7 -13,-1.8 1,-0.1 -1,-0.4 -0.951 49.0 178.1-142.7 159.7 14.6 14.3 22.4 44 71 A T + 0 0 89 1,-0.3 2,-0.3 -2,-0.3 -15,-0.3 0.526 59.9 24.8-142.1 -18.2 11.7 12.0 22.0 45 72 A S S S- 0 0 59 -17,-0.3 2,-0.8 2,-0.1 -1,-0.3 -0.989 75.2 -95.6-150.7 165.8 12.2 8.7 23.8 46 73 A V + 0 0 12 -2,-0.3 2,-0.3 24,-0.1 -18,-0.1 -0.690 64.7 128.8 -83.5 109.7 14.0 6.8 26.5 47 74 A S S > S- 0 0 36 -2,-0.8 3,-1.9 6,-0.1 9,-0.4 -0.978 73.2-102.8-152.6 166.8 17.1 5.1 25.0 48 75 A N T 3 S+ 0 0 81 -2,-0.3 7,-1.2 1,-0.3 -2,-0.0 0.651 120.2 61.6 -68.0 -11.8 20.8 4.8 25.7 49 76 A D T 3 S+ 0 0 148 5,-0.1 -1,-0.3 6,-0.1 -3,-0.1 0.514 73.8 112.9 -84.2 -13.3 21.2 7.3 22.8 50 77 A N X - 0 0 7 -3,-1.9 3,-0.7 3,-0.2 6,-0.2 -0.509 57.8-153.9 -68.9 118.9 19.2 10.1 24.7 51 78 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.2 0, 0.0 62,-0.1 0.707 84.9 72.9 -72.9 -15.5 21.7 12.9 25.5 52 79 A L T 3 S+ 0 0 6 1,-0.3 61,-3.0 -24,-0.2 -2,-0.0 0.900 120.9 9.4 -61.2 -41.8 19.8 14.2 28.5 53 80 A I S X S- 0 0 0 -3,-0.7 3,-1.0 59,-0.2 -1,-0.3 -0.803 86.6-144.8-138.3 93.0 20.9 11.1 30.5 54 81 A P T 3 S+ 0 0 66 0, 0.0 5,-0.2 0, 0.0 -5,-0.1 -0.307 85.3 8.1 -63.5 143.9 23.5 9.0 28.7 55 82 A N T >> S+ 0 0 84 -7,-1.2 4,-2.4 1,-0.1 3,-1.6 0.899 82.2 176.1 54.5 41.6 23.1 5.3 29.3 56 83 A V H <> + 0 0 0 -3,-1.0 4,-2.9 -9,-0.4 -1,-0.1 0.786 68.3 61.3 -49.6 -37.4 19.9 6.0 31.0 57 84 A Y H 34 S+ 0 0 82 1,-0.2 -1,-0.3 2,-0.2 7,-0.1 0.772 114.6 35.7 -69.9 -25.2 19.0 2.3 31.5 58 85 A E H X4 S+ 0 0 102 -3,-1.6 3,-1.9 2,-0.1 4,-0.2 0.879 115.9 54.1 -84.0 -47.6 22.1 1.9 33.7 59 86 A E H 3< S+ 0 0 69 -4,-2.4 3,-0.2 1,-0.3 -2,-0.2 0.890 123.0 27.9 -54.9 -45.3 22.0 5.4 35.3 60 87 A L T >X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 3,-0.8 -0.098 81.9 137.0-107.4 34.8 18.4 5.0 36.5 61 88 A K H <> + 0 0 69 -3,-1.9 4,-2.1 1,-0.3 -1,-0.2 0.850 68.1 53.7 -49.4 -41.2 18.6 1.2 36.8 62 89 A E H 3> S+ 0 0 90 -3,-0.2 4,-2.3 -4,-0.2 -1,-0.3 0.859 107.2 51.0 -70.4 -32.9 16.8 1.1 40.2 63 90 A T H <> S+ 0 0 0 -3,-0.8 4,-2.7 2,-0.2 5,-0.2 0.937 110.8 46.2 -70.3 -45.7 13.8 3.1 39.0 64 91 A F H X>S+ 0 0 17 -4,-1.8 5,-1.3 1,-0.2 4,-1.1 0.875 114.3 50.5 -62.2 -36.9 13.2 0.9 35.9 65 92 A E H <5S+ 0 0 136 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.916 113.9 42.9 -67.3 -45.9 13.6 -2.2 38.1 66 93 A W H <5S+ 0 0 48 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.938 120.7 41.1 -61.3 -50.5 11.1 -1.0 40.8 67 94 A A H <5S- 0 0 0 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.623 98.1-137.6 -78.9 -12.9 8.6 0.3 38.3 68 95 A Q T <5 + 0 0 97 -4,-1.1 2,-0.3 -5,-0.2 -3,-0.2 0.937 61.7 123.7 53.4 51.2 9.0 -2.6 35.9 69 96 A S < - 0 0 26 -5,-1.3 -1,-0.2 -6,-0.1 -2,-0.1 -0.903 63.5-147.0-137.1 159.3 8.9 -0.2 33.0 70 97 A D S S+ 0 0 114 -2,-0.3 2,-0.2 -3,-0.1 -24,-0.1 0.185 84.0 51.4-108.5 9.5 11.1 0.7 29.9 71 98 A T S S- 0 0 21 21,-0.1 2,-0.3 -7,-0.1 21,-0.2 -0.821 72.4-124.2-135.8 180.0 10.0 4.4 30.1 72 99 A L - 0 0 5 -2,-0.2 -45,-2.9 19,-0.1 19,-0.3 -0.932 21.2-140.7-123.4 147.1 9.7 7.4 32.3 73 100 A W - 0 0 70 17,-2.8 2,-0.6 -2,-0.3 -45,-0.4 0.033 58.7 -22.5 -94.6-152.8 6.5 9.6 33.0 74 101 A A - 0 0 1 -48,-0.1 -48,-0.2 15,-0.1 70,-0.2 -0.360 66.4-161.3 -74.4 105.6 6.1 13.3 33.4 75 102 A A - 0 0 10 -50,-1.4 2,-0.3 -2,-0.6 14,-0.2 -0.209 8.6-156.8 -74.6 163.0 9.4 15.0 34.4 76 103 A D E -E 88 0C 1 12,-1.3 12,-3.1 -53,-0.1 2,-0.4 -0.983 3.9-164.6-130.3 141.8 9.9 18.4 36.0 77 104 A V E +E 87 0C 3 -2,-0.3 2,-0.4 10,-0.3 10,-0.2 -0.999 14.2 173.6-120.9 129.7 13.2 20.3 35.7 78 105 A T E -E 86 0C 19 8,-2.3 8,-2.8 -2,-0.4 2,-0.4 -0.996 28.4-129.0-137.2 138.7 13.8 23.3 38.0 79 106 A Q E -E 85 0C 80 -2,-0.4 6,-0.2 6,-0.2 2,-0.1 -0.735 26.8-158.8 -86.8 132.0 16.8 25.4 38.6 80 107 A L > - 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