==== 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 14-NOV-94 1ENX . COMPND 2 MOLECULE: ENDO-1,4-BETA-XYLANASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HYPOCREA JECORINA; . AUTHOR J.ROUVINEN,A.TORRONEN . 380 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15704.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 278 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 186 48.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 . 2 0.5 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 . 33 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 0 0 0 2 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 0 0 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 PARALLEL BRIDGES PER LADDER . 0 2 0 2 4 4 2 6 4 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 0 0 0 2 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 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 X 0 0 97 0, 0.0 28,-2.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 161.3 48.8 15.1 15.3 2 2 A T E +A 28 0A 88 26,-0.3 2,-0.3 24,-0.0 26,-0.2 -0.660 360.0 178.5 -78.8 127.2 48.9 18.2 17.4 3 3 A I E -A 27 0A 45 24,-1.9 24,-0.5 -2,-0.4 3,-0.1 -0.877 31.5-116.4-132.5 163.8 50.3 21.0 15.3 4 4 A Q - 0 0 49 294,-0.3 294,-0.1 -2,-0.3 13,-0.1 -0.444 67.9 -55.4 -86.2 168.6 51.1 24.7 15.4 5 5 A P S S+ 0 0 40 0, 0.0 295,-0.3 0, 0.0 2,-0.3 -0.104 87.8 102.0 -50.0 137.5 49.2 27.1 13.0 6 6 A G E -F 17 0B 13 11,-1.8 11,-2.5 -3,-0.1 2,-0.3 -0.977 55.5-108.9 169.9-176.2 49.3 26.2 9.4 7 7 A T E +F 16 0B 63 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.915 45.6 109.7-137.3 164.2 47.5 24.6 6.4 8 8 A G E -F 15 0B 16 7,-1.6 7,-2.4 -2,-0.3 2,-0.4 -0.986 61.1 -62.1 161.3-165.6 47.8 21.4 4.4 9 9 A Y E -F 14 0B 149 -2,-0.3 2,-0.4 5,-0.3 5,-0.2 -0.966 41.0-178.0-117.4 138.6 46.2 18.1 3.7 10 10 A N E > -F 13 0B 22 3,-3.1 3,-2.0 -2,-0.4 20,-0.1 -0.964 67.3 -22.2-142.6 119.6 45.7 15.4 6.3 11 11 A N T 3 S- 0 0 99 -2,-0.4 3,-0.1 1,-0.3 23,-0.1 0.733 132.3 -41.0 54.4 26.7 44.2 12.0 5.8 12 12 A G T 3 S+ 0 0 67 1,-0.2 2,-0.4 21,-0.0 -1,-0.3 0.175 121.4 94.0 110.2 -10.0 42.4 13.1 2.7 13 13 A Y E < S-F 10 0B 48 -3,-2.0 -3,-3.1 19,-0.3 -1,-0.2 -0.894 70.6-121.7-124.7 145.1 41.2 16.5 3.8 14 14 A F E -FG 9 50B 12 36,-1.9 36,-2.8 -2,-0.4 2,-0.3 -0.428 34.5-170.7 -72.2 148.1 42.4 20.1 3.7 15 15 A Y E -FG 8 49B 26 -7,-2.4 -7,-1.6 34,-0.2 2,-0.4 -0.976 12.6-168.6-139.7 153.0 42.9 21.7 7.2 16 16 A S E -FG 7 48B 15 32,-2.1 32,-1.8 -2,-0.3 2,-0.4 -0.980 4.7-178.8-143.2 130.4 43.6 25.2 8.3 17 17 A Y E +FG 6 47B 8 -11,-2.5 -11,-1.8 -2,-0.4 2,-0.3 -0.982 10.2 165.9-134.1 122.4 44.5 26.2 11.8 18 18 A W E + G 0 46B 121 28,-2.7 28,-2.6 -2,-0.4 2,-0.3 -0.983 5.6 173.2-136.4 144.3 45.1 29.8 12.8 19 19 A N E - G 0 45B 36 -2,-0.3 26,-0.2 26,-0.2 -2,-0.0 -0.955 39.7-118.8-145.4 163.3 45.4 31.7 16.1 20 20 A D - 0 0 67 24,-2.0 25,-0.1 -2,-0.3 -2,-0.0 0.306 57.3-104.8 -84.0 6.1 46.3 35.1 17.3 21 21 A G S S+ 0 0 62 23,-0.2 24,-0.1 22,-0.0 -1,-0.0 0.355 86.3 123.6 86.9 -4.4 49.3 34.0 19.3 22 22 A H - 0 0 101 22,-0.2 2,-0.1 1,-0.1 23,-0.0 0.861 62.7-134.1 -56.5 -45.4 47.5 34.3 22.7 23 23 A G + 0 0 38 2,-0.0 20,-0.2 1,-0.0 -1,-0.1 -0.220 69.3 95.7 103.7 160.2 48.0 30.8 23.9 24 24 A G + 0 0 40 1,-0.3 16,-3.0 18,-0.2 2,-0.4 0.636 64.3 105.2 96.4 14.4 45.5 28.3 25.5 25 25 A V E - B 0 39A 20 14,-0.2 2,-0.5 16,-0.1 -1,-0.3 -0.995 44.8-169.0-131.3 136.5 44.5 26.4 22.4 26 26 A T E - B 0 38A 66 12,-2.6 12,-2.3 -2,-0.4 2,-0.5 -0.988 7.0-170.0-126.7 120.4 45.4 22.9 21.3 27 27 A Y E -AB 3 37A 1 -24,-0.5 -24,-1.9 -2,-0.5 2,-0.4 -0.949 5.2-176.9-113.7 129.1 44.6 21.8 17.7 28 28 A T E -AB 2 36A 41 8,-2.8 8,-2.4 -2,-0.5 2,-0.4 -0.981 21.4-138.7-131.2 128.0 45.0 18.2 16.7 29 29 A N E - B 0 35A 6 -28,-2.7 6,-0.2 -2,-0.4 3,-0.1 -0.677 31.0-169.5 -81.3 131.4 44.4 16.5 13.3 30 30 A G - 0 0 9 4,-2.7 4,-0.1 -2,-0.4 -1,-0.0 -0.472 31.8 -55.4-112.4-175.7 42.7 13.2 13.6 31 31 A P S > S- 0 0 90 0, 0.0 3,-2.1 0, 0.0 -1,-0.2 -0.237 102.9 -19.3 -60.5 146.7 41.8 10.2 11.5 32 32 A G T 3 S- 0 0 35 1,-0.3 -19,-0.3 -3,-0.1 -2,-0.1 -0.252 134.4 -18.4 56.5-131.1 39.9 10.8 8.3 33 33 A G T 3 S+ 0 0 4 156,-0.3 156,-2.0 -21,-0.1 2,-0.3 0.125 105.9 123.6 -96.3 26.7 38.1 14.1 8.4 34 34 A Q E < + C 0 188A 54 -3,-2.1 -4,-2.7 154,-0.3 2,-0.3 -0.610 30.5 170.4 -94.0 141.5 38.3 14.5 12.1 35 35 A F E -BC 29 187A 0 152,-2.4 152,-2.6 -2,-0.3 2,-0.4 -0.970 14.5-155.3-141.5 151.7 39.9 17.3 14.0 36 36 A S E -BC 28 186A 35 -8,-2.4 -8,-2.8 -2,-0.3 2,-0.4 -0.983 6.2-171.7-130.9 142.6 39.8 18.1 17.7 37 37 A V E -BC 27 185A 2 148,-2.4 148,-2.0 -2,-0.4 2,-0.4 -0.996 3.4-179.7-136.4 128.9 40.3 21.5 19.5 38 38 A N E +BC 26 184A 94 -12,-2.3 -12,-2.6 -2,-0.4 2,-0.3 -0.999 13.5 174.4-129.0 126.7 40.6 21.9 23.2 39 39 A W E -BC 25 183A 3 144,-2.7 144,-2.7 -2,-0.4 2,-0.3 -0.969 18.4-173.1-138.0 153.9 41.0 25.4 24.6 40 40 A S S S- 0 0 70 -16,-3.0 142,-0.2 -2,-0.3 140,-0.0 -0.920 79.2 -19.1-150.0 114.7 41.2 27.2 27.9 41 41 A N S S+ 0 0 122 -2,-0.3 141,-0.2 1,-0.1 -16,-0.1 0.915 94.6 170.2 49.8 51.3 41.2 31.0 28.3 42 42 A S - 0 0 1 139,-2.6 -18,-0.2 -18,-0.2 2,-0.1 0.022 33.8-130.3 -78.1-177.8 42.3 31.3 24.7 43 43 A G - 0 0 1 -20,-0.2 137,-2.3 137,-0.1 138,-0.5 0.061 61.9 -44.1-104.9-133.3 42.6 34.2 22.5 44 44 A N E S+ H 0 179B 38 135,-0.2 -24,-2.0 136,-0.1 2,-0.3 -0.868 71.0 156.3-105.4 129.8 41.1 34.2 19.0 45 45 A F E -GH 19 178B 0 133,-1.9 133,-1.9 -2,-0.5 2,-0.3 -0.987 25.5-162.8-150.2 161.0 41.5 31.1 16.8 46 46 A V E +GH 18 177B 24 -28,-2.6 -28,-2.7 -2,-0.3 2,-0.3 -0.976 19.1 162.9-148.1 127.7 39.9 29.2 13.9 47 47 A G E +GH 17 176B 0 129,-2.3 129,-2.9 -2,-0.3 2,-0.3 -0.998 10.1 115.8-149.5 147.8 40.5 25.6 13.0 48 48 A G E -GH 16 175B 0 -32,-1.8 -32,-2.1 -2,-0.3 2,-0.3 -0.980 42.3-100.5 174.4 179.8 38.9 22.9 10.9 49 49 A K E +GH 15 174B 0 125,-1.0 125,-2.6 -2,-0.3 -34,-0.2 -0.840 50.3 101.0-125.0 156.9 38.9 20.4 8.0 50 50 A G E -GH 14 173B 0 -36,-2.8 -36,-1.9 -2,-0.3 2,-0.3 -0.796 62.3 -32.5 173.4-125.6 37.4 20.3 4.5 51 51 A W E - H 0 172B 52 121,-2.7 121,-2.6 -2,-0.2 3,-0.2 -0.923 34.6-135.6-135.0 153.2 38.4 21.0 1.0 52 52 A Q S S+ 0 0 51 1,-0.5 119,-0.1 -2,-0.3 2,-0.1 -0.857 101.7 22.4-149.5 105.4 40.8 23.2 -1.0 53 53 A P S S- 0 0 90 0, 0.0 -1,-0.5 0, 0.0 118,-0.2 0.593 91.4-161.9 -82.5 163.5 39.4 24.2 -3.4 54 54 A G - 0 0 8 116,-2.6 2,-0.3 -3,-0.2 115,-0.2 -0.252 10.0-131.0 -91.9-172.8 35.7 23.9 -2.4 55 55 A T - 0 0 50 -2,-0.1 3,-0.4 113,-0.1 115,-0.1 -0.857 16.9-116.9-135.9 171.7 32.7 24.0 -4.7 56 56 A K S S+ 0 0 105 -2,-0.3 100,-0.2 1,-0.2 110,-0.0 0.442 111.1 38.5 -91.6 -1.1 29.3 25.8 -5.0 57 57 A N S S+ 0 0 119 95,-0.1 -1,-0.2 96,-0.1 2,-0.2 0.108 78.7 139.1-135.8 24.8 27.2 22.7 -4.6 58 58 A K - 0 0 40 -3,-0.4 94,-1.9 93,-0.1 2,-0.7 -0.464 43.2-146.4 -73.1 139.8 29.0 20.6 -2.0 59 59 A V E -D 151 0A 67 92,-0.2 2,-0.4 -2,-0.2 92,-0.2 -0.958 20.7-157.5-107.2 111.9 26.9 18.8 0.5 60 60 A I E -D 150 0A 0 90,-2.6 90,-3.0 -2,-0.7 2,-0.4 -0.811 6.5-161.6 -98.2 130.5 29.0 18.8 3.7 61 61 A N E +D 149 0A 64 129,-2.6 129,-2.0 -2,-0.4 2,-0.3 -0.879 14.4 171.2-109.6 140.7 28.4 16.3 6.5 62 62 A F E +DE 148 189A 6 86,-2.4 86,-2.8 -2,-0.4 2,-0.3 -0.995 4.9 163.4-148.7 145.8 29.7 16.8 10.0 63 63 A S E + E 0 188A 61 125,-1.5 125,-2.9 -2,-0.3 2,-0.3 -0.970 25.5 87.8-153.5 164.9 29.2 15.1 13.4 64 64 A G E S- E 0 187A 45 -2,-0.3 2,-0.4 123,-0.2 123,-0.2 -0.930 72.8 -46.3 140.5-161.6 30.9 15.0 16.7 65 65 A S E - E 0 186A 55 121,-2.0 121,-2.7 -2,-0.3 2,-0.5 -0.909 38.6-173.7-115.1 137.5 30.9 16.8 20.0 66 66 A Y E + E 0 185A 14 -2,-0.4 119,-0.2 119,-0.2 8,-0.1 -0.958 10.3 168.2-132.6 109.2 30.9 20.6 20.3 67 67 A N E - E 0 184A 86 117,-2.9 117,-1.3 -2,-0.5 2,-0.1 -0.647 9.2-178.1-126.0 74.6 31.2 21.9 23.9 68 68 A P E - E 0 183A 40 0, 0.0 2,-0.4 0, 0.0 115,-0.3 -0.433 15.8-161.1 -73.8 146.5 31.9 25.6 24.0 69 69 A N E S- E 0 182A 119 113,-2.8 113,-1.4 -2,-0.1 2,-0.3 -0.705 71.5 -28.4-124.6 74.2 32.3 27.3 27.3 70 70 A G S S+ 0 0 19 -2,-0.4 25,-0.9 111,-0.2 2,-0.5 -0.879 119.4 15.6 120.0-151.1 31.7 30.9 26.3 71 71 A N S S+ 0 0 30 108,-0.3 108,-2.5 -2,-0.3 2,-0.3 -0.479 83.2 111.6 -69.3 114.4 32.2 32.7 23.0 72 72 A S E -I 178 0B 0 -2,-0.5 22,-3.0 106,-0.2 2,-0.3 -0.969 40.6-153.8-171.8 159.4 32.7 30.3 20.1 73 73 A Y E -IJ 177 93B 18 104,-2.1 104,-2.6 -2,-0.3 2,-0.5 -0.992 10.8-145.5-149.7 154.7 31.0 29.0 17.0 74 74 A L E +IJ 176 92B 1 18,-2.9 17,-2.3 -2,-0.3 18,-1.6 -0.989 41.6 140.9-117.3 122.4 30.8 26.0 14.7 75 75 A S E -IJ 175 90B 1 100,-2.5 100,-3.4 -2,-0.5 2,-0.5 -0.975 58.6 -98.6-158.6 165.9 30.3 26.7 11.1 76 76 A V E -IJ 174 89B 1 13,-2.6 13,-2.6 -2,-0.3 2,-0.4 -0.825 53.7-175.1 -84.5 130.0 31.0 26.0 7.4 77 77 A Y E +IJ 173 88B 18 96,-3.1 96,-2.9 -2,-0.5 2,-0.3 -0.989 14.3 127.8-136.4 140.1 33.6 28.6 6.6 78 78 A G E -IJ 172 87B 0 9,-1.9 9,-2.7 -2,-0.4 2,-0.3 -0.970 37.3-111.1-170.3-175.3 35.3 29.6 3.4 79 79 A W E - J 0 86B 9 92,-1.4 91,-2.7 -2,-0.3 2,-0.3 -0.916 11.1-160.1-135.0 161.7 36.4 32.2 0.9 80 80 A S E > -IJ 169 85B 0 5,-1.9 5,-1.9 -2,-0.3 2,-0.4 -0.929 10.7-149.2-136.7 151.7 35.7 33.3 -2.7 81 81 A R E 5S+I 168 0B 90 87,-2.2 87,-2.7 -2,-0.3 3,-0.3 -0.943 71.6 46.9-121.5 147.5 37.8 35.4 -5.0 82 82 A N T 5S+ 0 0 140 -2,-0.4 -1,-0.2 85,-0.2 2,-0.1 0.925 129.7 32.7 48.7 67.3 36.4 37.7 -7.7 83 83 A P T 5S- 0 0 47 0, 0.0 2,-0.7 0, 0.0 84,-0.5 0.371 106.6-138.6 -80.8 156.9 34.5 38.7 -5.7 84 84 A L T 5 + 0 0 28 -3,-0.3 51,-0.9 49,-0.2 2,-0.4 -0.716 38.6 162.3 -78.6 114.6 36.6 38.5 -2.5 85 85 A I E < -Jk 80 135B 4 -5,-1.9 -5,-1.9 -2,-0.7 2,-0.5 -1.000 32.5-155.9-139.8 138.4 34.1 37.2 0.1 86 86 A E E -Jk 79 136B 16 49,-1.9 51,-2.5 -2,-0.4 2,-0.3 -0.958 29.1-170.1-109.3 127.2 34.6 35.6 3.5 87 87 A Y E -Jk 78 137B 0 -9,-2.7 -9,-1.9 -2,-0.5 2,-0.3 -0.931 18.6-168.7-129.0 157.2 31.5 33.4 4.4 88 88 A Y E -Jk 77 138B 14 49,-2.2 51,-2.3 -2,-0.3 2,-0.7 -1.000 12.5-169.2-140.2 132.4 30.0 31.5 7.3 89 89 A I E -Jk 76 139B 0 -13,-2.6 -13,-2.6 -2,-0.3 2,-0.6 -0.937 30.2-153.2-119.7 93.7 27.1 29.1 7.5 90 90 A V E +Jk 75 140B 1 49,-2.9 51,-2.9 -2,-0.7 -15,-0.3 -0.689 25.4 172.6 -80.8 118.7 26.8 28.9 11.3 91 91 A E E - 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