==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-OCT-98 1PVX . COMPND 2 MOLECULE: PROTEIN (ENDO-1,4-BETA-XYLANASE); . SOURCE 2 ORGANISM_SCIENTIFIC: PAECILOMYCES VARIOTII; . AUTHOR P.RAJESHKUMAR,S.ESWARAMOORTHY,P.J.VITHAYATHIL,M.A.VISWAMITRA . 194 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8240.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 136 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 93 47.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.5 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 . 14 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 1 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 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 PARALLEL BRIDGES PER LADDER . 0 0 0 1 2 2 1 2 2 0 1 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 1 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 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 G 0 0 102 0, 0.0 23,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 59.2 -1.7 19.5 28.2 2 2 A T - 0 0 47 1,-0.1 24,-0.2 21,-0.1 22,-0.1 0.395 360.0-114.2 -26.2 125.1 0.7 16.6 27.9 3 3 A T - 0 0 35 22,-2.2 -1,-0.1 1,-0.1 3,-0.1 -0.475 38.8-112.7 -66.0 130.2 4.4 17.4 27.3 4 4 A P - 0 0 104 0, 0.0 -1,-0.1 0, 0.0 23,-0.1 -0.284 40.8 -84.1 -62.7 151.7 5.5 16.1 23.9 5 5 A N + 0 0 89 14,-0.1 2,-0.3 11,-0.0 13,-0.2 -0.165 59.0 167.3 -53.9 142.7 7.9 13.2 23.6 6 6 A S E +A 17 0A 47 11,-1.9 11,-2.4 -3,-0.1 2,-0.3 -0.997 18.8 176.8-158.6 151.3 11.6 14.2 23.8 7 7 A E E +A 16 0A 82 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.977 37.6 75.3-151.5 150.7 15.1 12.8 24.2 8 8 A G E S-A 15 0A 16 7,-2.0 7,-2.4 -2,-0.3 2,-0.4 -0.998 75.1 -20.8 148.4-149.7 18.6 14.3 24.3 9 9 A W E +A 14 0A 162 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.791 41.7 170.1-107.5 140.3 20.8 16.4 26.6 10 10 A H E > S-A 13 0A 56 3,-2.5 3,-2.1 -2,-0.4 20,-0.1 -0.915 74.7 -21.8-146.3 118.7 20.0 18.6 29.6 11 11 A D T 3 S- 0 0 95 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.807 126.1 -50.1 51.4 37.9 22.6 20.1 32.0 12 12 A G T 3 S+ 0 0 67 1,-0.3 2,-0.4 21,-0.0 -1,-0.3 0.392 119.9 101.8 82.1 2.7 25.2 17.4 31.1 13 13 A Y E < -A 10 0A 56 -3,-2.1 -3,-2.5 19,-0.2 -1,-0.3 -0.866 69.9-125.8-115.2 148.3 22.8 14.5 31.6 14 14 A Y E -AB 9 50A 17 36,-2.3 36,-2.8 -2,-0.4 2,-0.3 -0.583 32.8-174.8 -82.1 153.7 21.0 12.4 29.0 15 15 A Y E -AB 8 49A 28 -7,-2.4 -7,-2.0 34,-0.3 2,-0.3 -0.994 15.7-164.9-144.2 156.3 17.2 12.2 29.4 16 16 A S E +AB 7 48A 13 32,-2.1 32,-2.1 -2,-0.3 2,-0.4 -0.993 7.4 178.9-137.9 137.9 14.3 10.4 27.7 17 17 A W E +AB 6 47A 4 -11,-2.4 -11,-1.9 -2,-0.3 2,-0.3 -0.991 10.7 161.4-139.3 125.1 10.6 11.1 28.1 18 18 A W E + B 0 46A 108 28,-2.2 28,-2.5 -2,-0.4 2,-0.3 -0.992 7.4 171.6-141.0 144.0 7.8 9.2 26.2 19 19 A S E - B 0 45A 9 -2,-0.3 26,-0.2 26,-0.2 -14,-0.1 -0.965 39.7-123.9-142.2 166.1 4.1 8.7 26.7 20 20 A D - 0 0 76 24,-2.1 25,-0.1 -2,-0.3 -1,-0.0 0.405 51.3-116.4 -87.5 1.5 1.3 7.1 24.6 21 21 A G S S+ 0 0 54 23,-0.3 -19,-0.1 -18,-0.1 22,-0.1 0.303 90.6 104.0 84.9 -4.2 -0.6 10.4 24.7 22 22 A G + 0 0 49 22,-0.2 2,-0.3 2,-0.1 21,-0.1 0.600 70.0 60.0 -80.7 -23.1 -3.6 9.0 26.6 23 23 A G S S- 0 0 5 21,-0.2 2,-0.4 19,-0.1 19,-0.2 -0.828 84.0-118.3-106.7 149.4 -2.8 10.5 30.0 24 24 A D + 0 0 94 17,-0.6 16,-2.9 -2,-0.3 2,-0.3 -0.763 54.2 149.4 -73.4 134.2 -2.5 14.1 31.0 25 25 A S E -I 39 0B 1 -2,-0.4 -22,-2.2 14,-0.2 2,-0.4 -0.944 39.2-144.9-170.8 153.2 1.1 14.7 32.2 26 26 A T E -I 38 0B 65 12,-2.4 12,-2.3 -2,-0.3 2,-0.5 -0.983 9.9-169.9-122.4 125.3 4.0 17.1 32.6 27 27 A Y E -I 37 0B 14 -2,-0.4 2,-0.4 10,-0.2 10,-0.2 -0.976 12.4-177.4-111.7 125.9 7.6 16.1 32.4 28 28 A T E -I 36 0B 52 8,-2.6 8,-2.4 -2,-0.5 2,-0.5 -0.984 22.3-143.0-128.4 132.5 10.1 18.8 33.4 29 29 A N E -I 35 0B 34 -2,-0.4 6,-0.2 6,-0.2 2,-0.2 -0.755 28.3-169.9 -86.9 122.3 13.9 18.7 33.4 30 30 A N - 0 0 47 4,-2.5 4,-0.3 -2,-0.5 -1,-0.0 -0.455 37.4 -49.1-102.9-175.7 15.2 20.6 36.4 31 31 A S S > S- 0 0 99 -2,-0.2 3,-1.5 2,-0.1 -1,-0.2 -0.165 100.2 -29.0 -62.9 139.5 18.7 21.8 37.3 32 32 A G T 3 S- 0 0 26 1,-0.3 -19,-0.2 -3,-0.1 -2,-0.1 -0.330 131.7 -5.6 62.2-123.5 21.6 19.3 37.2 33 33 A G T 3 S+ 0 0 6 -2,-0.1 157,-2.1 157,-0.1 2,-0.3 0.207 108.2 109.8 -88.1 12.7 20.6 15.7 37.7 34 34 A T E < + J 0 189B 14 -3,-1.5 -4,-2.5 -4,-0.3 2,-0.3 -0.688 34.9 167.5-100.3 142.8 16.9 16.4 38.6 35 35 A Y E -IJ 29 188B 0 153,-2.2 153,-2.0 -2,-0.3 2,-0.3 -0.975 15.5-153.7-141.6 157.0 13.7 15.8 36.8 36 36 A E E -IJ 28 187B 47 -8,-2.4 -8,-2.6 -2,-0.3 2,-0.4 -0.992 6.2-171.1-135.1 140.8 10.0 15.9 37.8 37 37 A I E -IJ 27 186B 0 149,-2.6 149,-2.0 -2,-0.3 2,-0.4 -0.984 4.4-177.6-133.5 129.8 6.9 14.1 36.5 38 38 A T E +IJ 26 185B 65 -12,-2.3 -12,-2.4 -2,-0.4 2,-0.4 -0.995 21.2 174.7-121.3 123.7 3.2 14.7 37.4 39 39 A W E -IJ 25 184B 8 145,-2.4 145,-2.4 -2,-0.4 -14,-0.2 -0.969 22.0-154.6-138.8 152.6 0.8 12.4 35.7 40 40 A G - 0 0 18 -16,-2.9 142,-0.4 -2,-0.4 3,-0.4 -0.408 40.2 -77.6-103.5-173.8 -2.9 11.4 35.6 41 41 A N S S+ 0 0 111 1,-0.2 -17,-0.6 140,-0.2 -1,-0.2 -0.320 89.1 72.9 -77.2 162.7 -4.7 8.2 34.6 42 42 A G S S+ 0 0 34 1,-0.2 2,-0.3 -19,-0.2 -1,-0.2 0.383 87.8 22.6 123.5 -13.3 -5.2 7.1 31.1 43 43 A G S S- 0 0 1 -3,-0.4 138,-2.9 139,-0.2 139,-0.4 -0.928 72.6 -82.0-166.2-172.3 -2.0 5.8 29.6 44 44 A N E + C 0 180A 42 -2,-0.3 -24,-2.1 136,-0.2 2,-0.3 -0.915 44.7 163.1-112.0 134.8 1.5 4.5 29.7 45 45 A L E -BC 19 179A 2 134,-1.9 134,-2.2 -2,-0.4 2,-0.3 -0.993 14.4-178.4-153.3 150.0 4.5 6.8 30.2 46 46 A V E +BC 18 178A 22 -28,-2.5 -28,-2.2 -2,-0.3 2,-0.3 -0.978 13.5 156.7-152.1 134.3 8.2 6.6 31.2 47 47 A G E +BC 17 177A 0 130,-2.0 130,-2.7 -2,-0.3 2,-0.3 -0.991 5.1 129.8-156.9 154.2 10.9 9.3 31.7 48 48 A G E -BC 16 176A 0 -32,-2.1 -32,-2.1 -2,-0.3 2,-0.3 -0.932 39.6 -96.8 175.9 178.6 14.2 10.1 33.5 49 49 A K E +BC 15 175A 0 126,-0.7 126,-2.4 -2,-0.3 -34,-0.3 -0.800 52.1 101.9-116.4 156.2 17.8 11.3 33.5 50 50 A G E -BC 14 174A 0 -36,-2.8 -36,-2.3 -2,-0.3 2,-0.3 -0.718 57.6 -41.2 174.2-132.5 21.1 9.5 33.2 51 51 A W E - C 0 173A 33 122,-2.7 122,-2.2 -38,-0.2 3,-0.2 -0.911 34.0-126.9-130.3 159.8 23.9 8.8 30.7 52 52 A N S S+ 0 0 45 1,-0.4 120,-0.2 -2,-0.3 2,-0.1 -0.834 96.3 33.0-154.4 114.1 24.6 7.8 27.1 53 53 A P S S- 0 0 78 0, 0.0 -1,-0.4 0, 0.0 119,-0.2 0.401 88.5-146.3 -86.1 160.1 26.3 5.5 26.7 54 54 A G - 0 0 3 117,-2.5 2,-0.3 25,-0.2 116,-0.2 -0.328 11.2-140.6 -72.6 168.0 25.5 3.3 29.6 55 55 A L - 0 0 81 1,-0.1 3,-0.3 -2,-0.1 97,-0.0 -0.941 17.9-126.0-127.2 152.1 28.2 1.1 31.2 56 56 A N S S+ 0 0 55 -2,-0.3 2,-0.5 1,-0.2 100,-0.4 0.886 108.8 35.7 -63.3 -31.8 28.0 -2.5 32.6 57 57 A A S S+ 0 0 73 95,-0.2 2,-0.4 96,-0.1 -1,-0.2 -0.890 75.0 141.4-129.6 91.3 29.4 -1.2 35.8 58 58 A R - 0 0 24 -2,-0.5 94,-2.5 -3,-0.3 2,-0.7 -0.997 44.4-135.3-120.6 142.7 28.4 2.3 36.9 59 59 A A E -K 151 0B 21 -2,-0.4 134,-2.0 92,-0.2 135,-0.6 -0.871 30.1-171.2 -99.4 113.0 27.7 3.3 40.5 60 60 A I E -KL 150 192B 0 90,-2.9 90,-2.8 -2,-0.7 2,-0.4 -0.939 9.9-162.9-111.5 124.6 24.4 5.4 40.3 61 61 A H E +KL 149 191B 67 130,-2.8 130,-1.8 -2,-0.5 2,-0.3 -0.794 13.4 176.2-100.9 143.8 23.0 7.3 43.3 62 62 A F E +KL 148 190B 2 86,-2.2 86,-2.4 -2,-0.4 2,-0.3 -0.992 5.5 162.1-141.0 153.7 19.4 8.5 43.3 63 63 A T E + L 0 189B 62 126,-1.5 126,-2.7 -2,-0.3 2,-0.3 -0.983 22.3 85.2-157.1 165.7 17.1 10.3 45.8 64 64 A G E S- L 0 188B 32 -2,-0.3 2,-0.4 124,-0.2 124,-0.2 -0.994 71.1 -33.9 145.5-150.6 13.9 12.2 45.9 65 65 A V E + L 0 187B 63 122,-2.3 122,-2.5 -2,-0.3 2,-0.4 -0.950 43.2 179.1-119.8 126.7 10.1 11.9 46.1 66 66 A Y E + L 0 186B 21 -2,-0.4 120,-0.2 120,-0.2 -2,-0.1 -0.937 8.1 164.5-134.5 107.2 8.2 8.9 44.6 67 67 A Q E + L 0 185B 120 118,-3.0 118,-1.3 -2,-0.4 2,-0.2 -0.649 6.6 176.5-131.2 77.6 4.4 8.8 45.0 68 68 A P E - L 0 184B 36 0, 0.0 116,-0.2 0, 0.0 4,-0.1 -0.564 19.0-161.6 -74.2 140.6 2.6 6.4 42.7 69 69 A N S S- 0 0 127 114,-2.5 115,-0.2 -2,-0.2 2,-0.1 0.596 76.5 -16.2 -95.1 -13.8 -1.2 6.0 43.2 70 70 A G S S+ 0 0 14 113,-0.6 25,-1.1 1,-0.1 2,-0.4 -0.289 116.6 5.8-153.9-131.2 -1.3 2.7 41.3 71 71 A T S S+ 0 0 44 109,-0.5 109,-2.5 23,-0.2 2,-0.3 -0.632 79.6 120.4 -75.0 123.8 0.8 0.6 38.9 72 72 A S E -D 179 0A 3 -2,-0.4 22,-2.0 24,-0.3 2,-0.3 -0.959 39.8-150.9-169.0 164.9 4.3 2.3 38.4 73 73 A Y E -DE 178 93A 17 105,-1.3 105,-2.4 -2,-0.3 2,-0.4 -0.982 10.4-148.6-147.7 161.4 8.0 1.5 38.9 74 74 A L E +DE 177 92A 1 18,-2.3 17,-2.5 -2,-0.3 18,-1.4 -1.000 42.3 147.0-124.7 116.6 11.3 3.3 39.7 75 75 A S E -DE 176 90A 1 101,-2.4 101,-3.0 -2,-0.4 2,-0.5 -0.999 58.5-103.5-152.7 157.2 14.3 1.6 38.1 76 76 A V E -DE 175 89A 1 13,-2.3 13,-2.8 -2,-0.3 2,-0.4 -0.728 57.5-179.1 -75.5 124.4 17.7 1.8 36.5 77 77 A Y E +DE 174 88A 13 97,-2.9 97,-3.1 -2,-0.5 2,-0.3 -0.988 14.0 122.3-136.5 141.3 16.6 1.3 32.8 78 78 A G E -DE 173 87A 0 9,-1.7 9,-2.5 -2,-0.4 2,-0.3 -0.982 37.8-109.4-176.8-170.1 18.3 1.1 29.5 79 79 A W E - 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