==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-OCT-04 1XNK . COMPND 2 MOLECULE: ENDOXYLANASE 11A; . SOURCE 2 ORGANISM_SCIENTIFIC: CHAETOMIUM THERMOPHILUM; . AUTHOR J.HAKANPAA,N.HAKULINEN,J.ROUVINEN . 382 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15796.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 288 75.4 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 . 193 50.5 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 1.0 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 . 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 . 40 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 4.5 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 1.0 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 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 . 4 0 0 0 4 7 1 4 2 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 1 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 33 0, 0.0 29,-2.8 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 81.9 -1.4 21.8 15.4 2 2 A T B -AB 29 194A 33 192,-2.7 192,-2.9 27,-0.2 27,-0.2 -0.821 360.0-129.2 -96.4 129.9 1.1 24.6 14.6 3 3 A L - 0 0 9 25,-2.8 25,-0.4 -2,-0.4 3,-0.1 -0.523 17.9-170.3 -79.1 148.8 4.6 24.2 16.1 4 4 A T - 0 0 114 1,-0.2 2,-0.3 -2,-0.2 -1,-0.1 0.394 69.7 -0.9-117.5 -0.2 6.0 27.2 18.0 5 5 A S S S- 0 0 76 13,-0.0 -1,-0.2 16,-0.0 16,-0.1 -0.947 104.8 -43.6-170.0 177.5 9.6 25.9 18.3 6 6 A S S S+ 0 0 49 -2,-0.3 2,-0.3 14,-0.2 13,-0.2 -0.311 73.2 164.0 -54.1 142.4 11.8 23.0 17.5 7 7 A A E -C 18 0A 19 11,-2.2 11,-2.4 -4,-0.1 2,-0.3 -0.996 27.7-167.4-162.9 157.4 9.9 19.8 18.3 8 8 A T E +C 17 0A 83 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.936 31.9 104.4-142.9 165.3 9.5 16.1 17.9 9 9 A G E -C 16 0A 12 7,-1.5 7,-2.9 -2,-0.3 2,-0.4 -0.971 64.3 -69.2 155.1-161.9 6.9 13.5 18.5 10 10 A T E -C 15 0A 39 -2,-0.3 194,-2.5 5,-0.3 2,-0.4 -0.981 36.8-172.2-127.6 142.8 4.4 11.4 16.5 11 11 A H E > S-CD 14 203A 1 3,-3.4 3,-2.0 -2,-0.4 192,-0.2 -0.978 71.9 -16.2-139.0 121.5 1.3 12.7 14.7 12 12 A N T 3 S- 0 0 35 190,-2.3 191,-0.1 -2,-0.4 3,-0.1 0.839 131.6 -47.9 53.4 38.2 -1.3 10.5 13.1 13 13 A G T 3 S+ 0 0 58 1,-0.2 2,-0.5 189,-0.1 -1,-0.3 0.348 119.6 107.4 88.6 -5.6 1.0 7.6 13.2 14 14 A Y E < -C 11 0A 52 -3,-2.0 -3,-3.4 19,-0.3 38,-0.2 -0.905 67.6-128.1-112.9 132.7 4.0 9.5 11.7 15 15 A Y E -CE 10 51A 34 36,-2.0 36,-2.9 -2,-0.5 2,-0.4 -0.412 29.0-162.1 -68.2 147.7 7.1 10.6 13.6 16 16 A Y E -CE 9 50A 2 -7,-2.9 -7,-1.5 34,-0.2 2,-0.4 -0.994 13.4-176.3-135.9 143.4 7.8 14.3 13.1 17 17 A S E +CE 8 49A 7 32,-1.9 32,-2.2 -2,-0.4 2,-0.4 -0.995 2.8 178.0-137.6 132.8 10.9 16.3 13.7 18 18 A F E -CE 7 48A 8 -11,-2.4 -11,-2.2 -2,-0.4 2,-0.4 -0.987 2.8-178.5-137.1 123.0 11.3 20.0 13.3 19 19 A W E + E 0 47A 94 28,-2.6 28,-2.3 -2,-0.4 2,-0.3 -0.991 7.9 167.1-124.7 133.4 14.5 21.9 14.0 20 20 A T E - E 0 46A 17 -2,-0.4 -14,-0.2 26,-0.2 26,-0.2 -0.993 40.6-140.0-143.8 146.9 14.8 25.6 13.7 21 21 A D - 0 0 58 24,-2.0 25,-0.1 -2,-0.3 3,-0.1 0.258 54.8-114.5 -88.7 14.1 17.5 28.1 14.8 22 22 A G S S+ 0 0 55 23,-0.2 2,-0.2 1,-0.2 4,-0.1 0.430 75.4 125.4 71.2 1.5 14.5 30.3 15.7 23 23 A Q + 0 0 107 22,-0.2 -1,-0.2 20,-0.1 22,-0.2 -0.504 54.1 7.9 -94.8 161.5 15.3 32.9 13.0 24 24 A G S S- 0 0 35 19,-0.3 2,-0.4 -2,-0.2 18,-0.3 -0.186 100.8 -49.9 70.0-166.4 13.3 34.4 10.2 25 25 A N E + F 0 41A 102 16,-2.9 16,-2.3 19,-0.1 2,-0.3 -0.896 64.9 155.8-109.2 133.7 9.6 33.7 9.8 26 26 A I E - F 0 40A 42 -2,-0.4 2,-0.4 14,-0.2 14,-0.2 -0.963 25.3-172.9-160.9 140.3 8.2 30.2 9.8 27 27 A R E - F 0 39A 146 12,-1.9 12,-1.7 -2,-0.3 2,-0.6 -0.943 11.8-170.5-134.8 107.1 5.0 28.3 10.5 28 28 A F E - F 0 38A 1 -25,-0.4 -25,-2.8 -2,-0.4 2,-0.5 -0.913 11.5-166.2-102.5 116.9 5.3 24.5 10.5 29 29 A N E -AF 2 37A 37 8,-3.5 8,-2.4 -2,-0.6 2,-0.4 -0.907 15.2-143.9-113.7 126.9 1.9 22.9 10.6 30 30 A L E + F 0 36A 2 -29,-2.8 6,-0.2 -2,-0.5 2,-0.2 -0.688 32.1 178.4 -83.1 133.3 1.1 19.2 11.3 31 31 A E - 0 0 61 4,-2.3 4,-0.3 -2,-0.4 -1,-0.0 -0.614 33.0 -43.1-127.8-173.4 -1.8 18.0 9.2 32 32 A S S > S- 0 0 103 -2,-0.2 3,-1.9 2,-0.1 -1,-0.2 -0.134 101.6 -25.4 -54.2 143.6 -4.0 14.9 8.5 33 33 A G T 3 S- 0 0 27 1,-0.3 -19,-0.3 -3,-0.1 -2,-0.1 -0.246 130.8 -16.9 55.3-131.3 -2.2 11.6 8.1 34 34 A G T 3 S+ 0 0 3 156,-0.3 156,-2.6 -21,-0.1 2,-0.3 0.061 110.1 116.6 -94.8 26.7 1.4 11.8 7.0 35 35 A Q E < + G 0 189A 58 -3,-1.9 -4,-2.3 154,-0.3 2,-0.3 -0.651 33.1 167.1-101.0 151.9 0.9 15.4 5.8 36 36 A Y E -FG 30 188A 0 152,-2.1 152,-2.6 -2,-0.3 2,-0.4 -0.973 16.2-153.6-152.3 153.4 2.5 18.7 6.9 37 37 A S E -FG 29 187A 15 -8,-2.4 -8,-3.5 -2,-0.3 2,-0.4 -0.978 10.4-173.6-131.3 145.8 2.6 22.2 5.5 38 38 A V E -FG 28 186A 0 148,-2.7 148,-1.9 -2,-0.4 2,-0.4 -0.999 8.8-172.3-144.2 137.0 5.2 24.9 6.0 39 39 A T E +FG 27 185A 59 -12,-1.7 -12,-1.9 -2,-0.4 2,-0.3 -0.999 22.2 164.8-127.7 129.3 5.4 28.5 5.0 40 40 A W E +FG 26 184A 9 144,-2.8 144,-2.7 -2,-0.4 2,-0.3 -0.948 14.3 156.9-146.2 165.1 8.6 30.5 5.6 41 41 A S E +F 25 0A 47 -16,-2.3 -16,-2.9 -2,-0.3 3,-0.2 -0.951 42.2 51.3-169.4 175.0 10.6 33.6 4.8 42 42 A G S S- 0 0 33 -2,-0.3 2,-0.5 -18,-0.3 -19,-0.1 -0.407 102.5 -34.9 85.2-161.0 13.4 35.7 6.2 43 43 A N S S+ 0 0 91 138,-0.1 -19,-0.3 -2,-0.1 -1,-0.2 -0.324 85.2 141.8-100.7 51.8 16.8 34.6 7.5 44 44 A G - 0 0 7 -2,-0.5 137,-3.1 138,-0.4 2,-0.4 -0.449 41.0-152.8 -94.1 165.0 16.0 31.3 9.1 45 45 A N E + H 0 180A 39 135,-0.2 -24,-2.0 -22,-0.2 2,-0.3 -0.963 39.7 137.4-133.8 111.5 17.8 27.9 9.3 46 46 A W E -EH 20 179A 6 133,-2.4 133,-2.5 -2,-0.4 2,-0.3 -0.991 31.6-171.4-156.4 162.5 15.5 24.9 9.6 47 47 A V E +EH 19 178A 10 -28,-2.3 -28,-2.6 -2,-0.3 2,-0.3 -0.948 23.1 150.0-156.0 132.9 14.6 21.4 8.6 48 48 A G E +EH 18 177A 0 129,-2.3 129,-2.4 -2,-0.3 2,-0.3 -0.995 1.8 132.2-162.5 160.3 11.5 19.4 9.4 49 49 A G E -EH 17 176A 0 -32,-2.2 -32,-1.9 -2,-0.3 2,-0.3 -0.987 42.7 -83.1 175.8-173.7 9.1 16.7 8.2 50 50 A K E +EH 16 175A 0 125,-1.0 125,-2.7 -2,-0.3 -34,-0.2 -0.883 59.7 97.1-119.0 149.7 7.2 13.5 8.9 51 51 A G E -EH 15 174A 0 -36,-2.9 -36,-2.0 -2,-0.3 2,-0.3 -0.716 63.3 -40.2 178.7-122.5 8.3 9.9 8.7 52 52 A W E - H 0 173A 61 121,-3.2 121,-2.9 -2,-0.2 3,-0.2 -0.924 34.4-129.9-139.6 159.8 9.5 7.2 11.1 53 53 A N S S+ 0 0 74 1,-0.4 119,-0.2 -2,-0.3 2,-0.1 -0.828 98.1 30.5-155.4 113.4 11.7 6.7 14.1 54 54 A P S S- 0 0 80 0, 0.0 -1,-0.4 0, 0.0 118,-0.2 0.483 90.1-146.5 -79.2 159.2 13.6 4.5 13.9 55 55 A G - 0 0 4 116,-2.8 2,-0.3 25,-0.3 115,-0.2 -0.317 17.3-138.7 -77.1 171.1 14.2 4.5 10.2 56 56 A T > - 0 0 54 1,-0.1 3,-0.7 -2,-0.1 115,-0.0 -0.922 16.9-120.3-133.3 161.3 14.9 1.1 8.6 57 57 A D T 3 S+ 0 0 63 -2,-0.3 100,-0.2 1,-0.2 101,-0.2 0.752 110.8 35.8 -69.4 -26.5 17.3 -0.3 5.9 58 58 A N T 3 S+ 0 0 121 95,-0.1 -1,-0.2 96,-0.1 2,-0.1 0.129 77.6 139.2-118.6 23.2 14.5 -1.4 3.6 59 59 A R < - 0 0 48 -3,-0.7 94,-1.5 93,-0.1 2,-0.6 -0.430 39.0-152.3 -69.6 140.3 11.8 1.2 3.9 60 60 A V E -I 152 0A 83 92,-0.2 2,-0.3 93,-0.1 92,-0.2 -0.955 16.1-155.0-115.2 108.0 10.1 2.1 0.7 61 61 A I E -I 151 0A 1 90,-2.5 90,-2.8 -2,-0.6 2,-0.5 -0.689 12.5-170.1 -91.4 135.3 8.8 5.6 0.9 62 62 A N E +I 150 0A 82 -2,-0.3 129,-3.5 88,-0.2 2,-0.3 -0.993 21.4 158.9-121.6 124.4 5.9 7.0 -1.2 63 63 A Y E -IJ 149 190A 7 86,-2.4 86,-2.5 -2,-0.5 2,-0.3 -0.948 26.4-158.7-143.4 163.9 5.3 10.8 -1.0 64 64 A T E -IJ 148 189A 83 125,-1.8 125,-2.6 -2,-0.3 2,-0.3 -0.957 18.6-176.1-137.2 153.0 3.7 13.7 -2.8 65 65 A A E - J 0 188A 19 82,-1.3 2,-0.8 -2,-0.3 123,-0.2 -0.977 33.6-152.3-159.4 143.4 4.6 17.4 -2.5 66 66 A D E - 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