==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-SEP-00 1E8R . COMPND 2 MOLECULE: ENDO-1,4-BETA-XYLANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS FLUORESCENS; . AUTHOR S.RAGHOTHAMA,P.J.SIMPSON,H.J.GILBERT,M.P.WILLIAMSON . 50 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3542.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 28 56.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 24.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 4.0 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 . 1 2.0 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 . 5 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 4.0 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 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 . 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 PARALLEL BRIDGES PER LADDER . 1 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 20 A M 0 0 235 0, 0.0 49,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 128.3 -4.1 -11.3 -5.9 2 21 A G + 0 0 70 48,-0.1 2,-0.2 2,-0.0 46,-0.0 -0.347 360.0 147.1-164.4 73.8 -1.3 -9.0 -7.1 3 22 A N - 0 0 124 1,-0.0 2,-0.2 43,-0.0 47,-0.1 -0.646 44.0-110.7-108.6 169.1 -1.6 -5.4 -5.9 4 23 A Q - 0 0 56 -2,-0.2 11,-1.3 11,-0.1 2,-0.2 -0.652 29.4-147.0 -97.5 156.8 1.2 -2.9 -5.1 5 24 A Q E -A 14 0A 69 42,-0.8 2,-0.5 -2,-0.2 7,-0.0 -0.696 12.0-124.5-121.3 172.4 2.0 -1.7 -1.6 6 25 A a E -A 13 0A 0 7,-1.9 2,-1.6 -2,-0.2 7,-0.5 -0.702 9.6-162.6-118.6 85.1 3.3 1.5 0.0 7 26 A N E -AB 12 45A 37 38,-2.7 2,-1.4 -2,-0.5 38,-0.8 -0.435 25.0-156.9 -62.1 92.1 6.4 1.0 2.2 8 27 A W E > -A 11 0A 36 3,-1.7 3,-2.4 -2,-1.6 -1,-0.1 -0.629 57.3 -60.9 -81.5 95.6 5.6 4.4 3.7 9 28 A Y T 3 S- 0 0 127 -2,-1.4 -1,-0.2 1,-0.3 35,-0.1 0.770 123.3 -28.6 37.7 26.0 9.0 5.6 5.1 10 29 A G T 3 S+ 0 0 56 1,-0.6 -1,-0.3 33,-0.1 -2,-0.1 -0.242 126.4 84.0 133.7 -50.3 8.7 2.4 7.2 11 30 A T E < S-A 8 0A 86 -3,-2.4 -3,-1.7 -4,-0.1 -1,-0.6 -0.066 73.8-119.7 -74.8-176.6 5.0 1.7 7.7 12 31 A L E +A 7 0A 87 -5,-0.2 -5,-0.2 -3,-0.1 -1,-0.1 -0.988 28.8 175.1-131.1 137.3 2.8 -0.2 5.2 13 32 A Y E -A 6 0A 59 -7,-0.5 -7,-1.9 -2,-0.4 2,-0.2 -1.000 32.7-115.7-141.9 142.6 -0.3 1.1 3.3 14 33 A P E -A 5 0A 35 0, 0.0 18,-1.9 0, 0.0 2,-0.3 -0.508 41.1-111.8 -74.0 137.5 -2.4 -0.5 0.6 15 34 A L B -c 32 0B 4 -11,-1.3 2,-1.0 16,-0.3 18,-0.2 -0.564 16.9-147.7 -78.8 135.6 -2.3 1.4 -2.7 16 35 A b + 0 0 4 16,-1.3 18,-0.5 -2,-0.3 6,-0.2 -0.794 20.4 175.2 -97.1 93.9 -5.3 3.3 -3.8 17 36 A V S > S+ 0 0 61 -2,-1.0 3,-1.5 16,-0.2 17,-0.2 0.904 82.7 48.8 -72.4 -36.0 -5.1 3.1 -7.6 18 37 A T T 3 S+ 0 0 134 1,-0.3 3,-0.5 -3,-0.2 -1,-0.2 0.919 119.3 40.0 -69.3 -34.6 -8.5 4.7 -8.2 19 38 A T T 3 S+ 0 0 46 1,-0.2 3,-0.3 13,-0.1 14,-0.3 0.084 79.1 122.2 -97.7 28.2 -7.3 7.3 -5.7 20 39 A T < + 0 0 59 -3,-1.5 2,-0.9 1,-0.3 16,-0.3 0.711 56.9 83.1 -59.7 -14.8 -3.9 7.1 -7.4 21 40 A N S S- 0 0 154 -3,-0.5 -1,-0.3 -4,-0.1 2,-0.3 -0.152 119.4 -49.4 -82.7 41.5 -4.6 10.8 -7.9 22 41 A G S S- 0 0 26 -2,-0.9 11,-0.9 -3,-0.3 2,-0.2 -0.842 103.0 -17.7 123.4-162.1 -3.4 11.6 -4.3 23 42 A W E +D 32 0B 125 -2,-0.3 2,-0.2 9,-0.2 9,-0.2 -0.573 68.3 169.0 -79.7 141.2 -4.2 10.0 -1.0 24 43 A G E -D 31 0B 17 7,-2.3 7,-1.6 -2,-0.2 2,-0.4 -0.713 27.9-119.4-136.7-171.0 -7.4 7.8 -0.9 25 44 A W E +D 30 0B 166 5,-0.3 2,-0.3 -2,-0.2 5,-0.2 -0.996 40.8 133.7-139.6 135.1 -9.1 5.4 1.5 26 45 A E E > +D 29 0B 60 3,-1.8 3,-1.4 -2,-0.4 -2,-0.0 -0.987 49.0 50.5-168.9 165.3 -10.1 1.7 0.8 27 46 A D T 3 S- 0 0 116 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.867 125.0 -68.7 66.1 31.9 -10.0 -1.8 2.4 28 47 A Q T 3 S+ 0 0 185 1,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.727 126.9 71.6 59.4 16.3 -11.6 -0.3 5.6 29 48 A R E < S- D 0 26B 164 -3,-1.4 -3,-1.8 -15,-0.0 2,-0.4 -0.746 98.0 -71.3-142.8-169.1 -8.2 1.5 5.9 30 49 A S E - D 0 25B 21 -5,-0.2 2,-0.4 -2,-0.2 -5,-0.3 -0.783 43.1-162.7 -95.7 134.2 -6.2 4.3 4.3 31 50 A b E - D 0 24B 0 -7,-1.6 -7,-2.3 -2,-0.4 2,-0.5 -0.875 10.2-138.9-114.6 147.6 -4.7 3.7 0.8 32 51 A I E -cD 15 23B 0 -18,-1.9 -16,-1.3 -2,-0.4 -9,-0.2 -0.894 30.4-103.7-108.9 131.8 -2.0 5.7 -0.8 33 52 A A > - 0 0 0 -11,-0.9 4,-1.4 -2,-0.5 -13,-0.2 0.176 44.0 -93.7 -41.1 168.0 -2.2 6.6 -4.6 34 53 A R H >>S+ 0 0 125 -18,-0.5 4,-2.4 2,-0.2 5,-0.8 0.987 119.1 22.2 -56.3 -79.1 -0.0 4.6 -7.0 35 54 A S H 4>S+ 0 0 71 1,-0.3 5,-1.4 2,-0.2 -1,-0.1 0.974 123.3 55.9 -59.5 -48.5 3.2 6.6 -7.3 36 55 A T H 45S+ 0 0 41 -16,-0.3 -1,-0.3 3,-0.2 -2,-0.2 0.876 114.2 47.3 -50.4 -29.2 2.6 8.4 -4.0 37 56 A a H <5S- 0 0 0 -4,-1.4 8,-0.5 -3,-0.4 -2,-0.2 0.985 140.9 -7.7 -72.7 -76.7 2.5 4.8 -2.8 38 57 A A T <5S+ 0 0 6 -4,-2.4 8,-0.2 -5,-0.2 -3,-0.2 0.823 115.9 80.3 -94.8 -39.3 5.5 3.2 -4.4 39 58 A A T - 0 0 89 0, 0.0 3,-1.0 0, 0.0 -32,-0.2 -0.101 64.8 -33.0 -74.0 175.2 12.1 6.9 -3.1 42 61 A A T 3 S+ 0 0 83 1,-0.4 3,-0.1 -33,-0.0 -4,-0.0 -0.479 126.3 19.7 -81.2 155.6 13.7 4.0 -1.1 43 62 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.4 0, 0.0 -33,-0.1 -0.960 121.0 75.5 -78.5 15.1 13.2 2.5 1.2 44 63 A F S < S+ 0 0 47 -3,-1.0 2,-0.3 -35,-0.1 -36,-0.2 -0.354 70.3 83.3 -73.4 162.6 9.7 3.8 0.3 45 64 A G B S-B 7 0A 9 -38,-0.8 -38,-2.7 -8,-0.5 2,-0.3 -0.926 79.0 -11.5 142.3-169.5 8.0 2.2 -2.7 46 65 A I - 0 0 106 -2,-0.3 -40,-0.2 -8,-0.2 2,-0.2 -0.522 61.4-169.6 -69.6 125.9 5.9 -0.8 -3.9 47 66 A V + 0 0 35 -2,-0.3 -42,-0.8 -34,-0.2 2,-0.2 -0.633 33.3 84.6-109.8 172.2 5.7 -3.5 -1.1 48 67 A G - 0 0 55 -2,-0.2 -44,-0.1 -44,-0.1 -43,-0.0 -0.553 63.5-117.2 122.8 169.7 4.4 -7.1 -1.4 49 68 A S 0 0 133 -2,-0.2 -1,-0.1 1,-0.0 -47,-0.0 0.752 360.0 360.0-112.9 -47.4 5.8 -10.4 -2.5 50 69 A G 0 0 126 -47,-0.1 -48,-0.1 -49,-0.0 -2,-0.0 -0.271 360.0 360.0 115.0 360.0 3.7 -11.5 -5.5