==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-NOV-03 1RH9 . COMPND 2 MOLECULE: ENDO-BETA-MANNANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SOLANUM LYCOPERSICUM; . AUTHOR A.J.OAKLEY,R.BOURGAULT,J.D.BEWLEY,M.C.J.WILCE . 370 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14810.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 253 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 11.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 . 15 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.4 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 1 1 0 0 0 1 0 1 0 1 0 2 1 0 0 1 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 2 3 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 PARALLEL BRIDGES PER LADDER . 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 2 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 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 30 A N 0 0 177 0, 0.0 2,-0.6 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 72.7 6.5 -4.1 5.7 2 31 A N + 0 0 95 1,-0.1 2,-0.3 162,-0.0 162,-0.0 0.384 360.0 130.7 20.4 12.0 9.8 -5.3 7.1 3 32 A F - 0 0 28 -2,-0.6 11,-0.4 1,-0.1 2,-0.2 -0.639 63.6-116.4 -83.2 138.1 11.9 -2.3 5.7 4 33 A V + 0 0 4 161,-0.3 202,-0.2 -2,-0.3 2,-0.2 -0.500 46.7 168.3 -65.5 138.3 14.2 -0.4 8.1 5 34 A Y E -A 12 0A 93 7,-2.8 7,-2.3 -2,-0.2 2,-0.4 -0.742 31.4-101.1-138.8-176.9 12.9 3.2 8.4 6 35 A T E -A 11 0A 44 5,-0.2 2,-0.4 -2,-0.2 5,-0.2 -0.947 17.7-171.3-115.6 142.0 13.6 6.2 10.6 7 36 A D E > S-A 10 0A 114 3,-2.6 3,-1.5 -2,-0.4 2,-0.2 -0.900 70.1 -58.2-124.6 101.2 11.6 7.6 13.5 8 37 A G T 3 S- 0 0 42 -2,-0.4 -1,-0.0 1,-0.2 271,-0.0 -0.483 121.8 -12.0 61.5-124.3 13.1 10.9 14.4 9 38 A T T 3 S+ 0 0 23 -2,-0.2 276,-0.4 274,-0.2 2,-0.3 0.224 124.6 75.2 -97.1 15.7 16.7 10.4 15.2 10 39 A H E < S-A 7 0A 42 -3,-1.5 -3,-2.6 274,-0.1 2,-0.2 -0.890 75.2-122.7-123.2 153.8 16.6 6.6 15.4 11 40 A F E -AB 6 18A 0 7,-0.7 7,-1.6 -2,-0.3 2,-0.3 -0.534 34.7-170.6 -76.1 160.3 16.4 3.8 13.0 12 41 A A E -AB 5 17A 5 -7,-2.3 -7,-2.8 5,-0.3 2,-0.3 -0.989 18.4-170.4-155.6 157.6 13.5 1.4 13.4 13 42 A L E > S- B 0 16A 36 3,-2.5 3,-1.8 -2,-0.3 -9,-0.1 -0.952 77.4 -7.5-153.7 121.6 12.2 -1.9 12.1 14 43 A N T 3 S- 0 0 95 -11,-0.4 3,-0.1 -2,-0.3 -10,-0.1 0.915 130.4 -52.3 55.0 47.1 8.8 -3.4 12.7 15 44 A G T 3 S+ 0 0 64 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.284 118.9 101.7 78.4 -10.3 7.9 -0.7 15.2 16 45 A K E < S-B 13 0A 158 -3,-1.8 -3,-2.5 1,-0.1 -1,-0.2 -0.817 77.1-102.0-111.6 147.8 11.0 -1.1 17.4 17 46 A S E -B 12 0A 40 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.3 -0.256 33.8-154.9 -61.9 152.5 14.2 0.9 17.6 18 47 A L E -B 11 0A 32 -7,-1.6 -7,-0.7 352,-0.1 2,-0.4 -0.999 7.2-164.4-135.7 128.3 17.3 -0.5 15.8 19 48 A Y - 0 0 19 -2,-0.4 2,-0.4 -9,-0.1 308,-0.2 -0.970 20.1-132.7-117.1 132.8 20.9 0.2 16.6 20 49 A I E +c 327 0B 0 306,-3.2 308,-1.8 -2,-0.4 2,-0.3 -0.679 29.3 167.2 -91.4 130.0 23.6 -0.7 14.1 21 50 A N E +c 328 0B 2 -2,-0.4 33,-1.7 306,-0.2 34,-0.4 -0.839 36.7 114.1-136.8 103.1 26.8 -2.5 15.0 22 51 A G E -c 329 0B 0 306,-2.6 308,-1.8 -2,-0.3 2,-0.3 -0.585 47.6-107.0-149.4-156.8 28.5 -3.7 11.9 23 52 A F E -cd 330 56B 0 32,-1.9 34,-2.3 306,-0.3 2,-0.4 -0.932 20.1-113.8-148.3 159.2 31.3 -3.7 9.4 24 53 A N E + d 0 57B 0 306,-2.3 309,-2.6 -2,-0.3 308,-0.5 -0.857 29.9 163.9 -95.0 139.4 32.6 -2.7 6.0 25 54 A A > + 0 0 0 32,-2.4 3,-1.3 -2,-0.4 34,-0.2 -0.611 3.5 173.7-151.2 83.6 33.4 -5.4 3.5 26 55 A Y T 3 S+ 0 0 39 1,-0.3 33,-0.9 32,-0.2 3,-0.4 0.788 73.1 64.8 -64.2 -25.1 33.6 -3.7 0.1 27 56 A W T 3> + 0 0 0 1,-0.2 4,-2.4 2,-0.1 5,-0.3 0.320 65.9 105.2 -85.3 1.3 34.9 -6.9 -1.6 28 57 A L H <> S+ 0 0 0 -3,-1.3 4,-2.0 1,-0.2 -1,-0.2 0.892 84.6 41.0 -58.8 -49.3 31.8 -9.1 -1.1 29 58 A M H > S+ 0 0 5 -3,-0.4 4,-1.5 30,-0.3 -1,-0.2 0.905 112.9 55.8 -63.2 -45.3 30.5 -9.1 -4.7 30 59 A Y H > S+ 0 0 46 -4,-0.3 4,-0.6 1,-0.2 3,-0.3 0.917 113.3 40.6 -52.8 -47.8 34.1 -9.3 -6.1 31 60 A I H < S+ 0 0 8 -4,-2.4 3,-0.4 1,-0.2 6,-0.3 0.799 109.6 59.0 -74.4 -32.0 34.7 -12.5 -4.1 32 61 A A H < S+ 0 0 0 -4,-2.0 -1,-0.2 -5,-0.3 6,-0.2 0.779 91.7 72.9 -65.4 -27.2 31.2 -13.9 -4.8 33 62 A Y H < S+ 0 0 57 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.889 89.0 62.9 -54.0 -49.1 32.0 -13.8 -8.6 34 63 A D S >X S- 0 0 49 -4,-0.6 3,-1.5 -3,-0.4 4,-1.4 -0.734 76.7-148.3 -82.9 118.7 34.4 -16.7 -8.5 35 64 A P T 34 S+ 0 0 104 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 0.794 97.9 57.8 -56.6 -26.3 32.6 -20.0 -7.4 36 65 A S T 34 S+ 0 0 91 1,-0.2 -4,-0.1 2,-0.1 -3,-0.0 0.633 114.9 34.8 -81.7 -15.6 35.9 -21.1 -5.7 37 66 A T T X4 S+ 0 0 30 -3,-1.5 3,-2.0 -6,-0.3 4,-0.4 0.491 89.7 94.6-109.4 -6.1 36.0 -18.1 -3.4 38 67 A R T >X S+ 0 0 65 -4,-1.4 4,-1.4 1,-0.3 3,-1.3 0.795 72.3 71.1 -57.9 -29.2 32.3 -17.5 -2.8 39 68 A I H 3> S+ 0 0 93 -4,-0.3 4,-3.1 1,-0.3 -1,-0.3 0.798 86.6 66.6 -57.5 -28.0 32.5 -19.6 0.4 40 69 A K H <> S+ 0 0 53 -3,-2.0 4,-1.8 2,-0.2 -1,-0.3 0.822 99.5 50.0 -64.5 -32.4 34.4 -16.6 1.9 41 70 A V H <> S+ 0 0 0 -3,-1.3 4,-2.2 -4,-0.4 5,-0.2 0.941 112.3 46.7 -67.4 -50.4 31.3 -14.5 1.7 42 71 A T H X S+ 0 0 13 -4,-1.4 4,-2.3 1,-0.2 -2,-0.2 0.937 113.7 48.8 -54.1 -49.0 29.2 -17.2 3.4 43 72 A N H X S+ 0 0 55 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.869 109.3 52.8 -62.9 -38.7 31.9 -17.7 6.1 44 73 A T H X S+ 0 0 3 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.905 111.0 45.2 -64.3 -44.1 32.1 -13.9 6.7 45 74 A F H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.855 111.1 54.3 -70.0 -36.0 28.3 -13.6 7.2 46 75 A Q H X S+ 0 0 75 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.923 112.7 43.3 -59.1 -46.1 28.4 -16.7 9.5 47 76 A Q H X S+ 0 0 33 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.912 112.3 52.7 -67.2 -43.8 31.0 -15.1 11.6 48 77 A A H <>S+ 0 0 0 -4,-2.7 5,-2.8 1,-0.2 -2,-0.2 0.929 110.1 48.5 -56.3 -46.4 29.3 -11.7 11.6 49 78 A S H ><5S+ 0 0 52 -4,-2.6 3,-1.6 3,-0.2 -1,-0.2 0.908 108.0 55.0 -62.8 -41.5 26.1 -13.3 12.8 50 79 A K H 3<5S+ 0 0 123 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.878 111.1 44.2 -58.8 -41.6 28.0 -15.2 15.6 51 80 A Y T 3<5S- 0 0 36 -4,-1.9 -1,-0.3 -5,-0.1 312,-0.2 0.265 118.6-115.2 -88.4 13.1 29.4 -11.9 16.9 52 81 A K T < 5 + 0 0 121 -3,-1.6 2,-0.4 1,-0.2 -3,-0.2 0.813 57.4 159.0 57.3 39.0 25.9 -10.3 16.5 53 82 A M < - 0 0 4 -5,-2.8 -31,-0.2 -6,-0.2 -1,-0.2 -0.769 20.3-170.3 -85.9 134.5 26.9 -7.8 13.9 54 83 A N + 0 0 39 -33,-1.7 43,-2.3 -2,-0.4 2,-0.3 0.508 56.5 45.4-111.4 -5.0 23.7 -6.7 12.1 55 84 A V E - e 0 97B 1 -34,-0.4 -32,-1.9 41,-0.2 2,-0.4 -0.999 50.8-166.5-143.2 137.4 24.9 -4.7 9.0 56 85 A A E -de 23 98B 0 41,-2.3 43,-2.4 -2,-0.3 2,-0.4 -0.988 12.5-153.1-115.8 132.3 27.5 -4.9 6.3 57 86 A R E +de 24 99B 0 -34,-2.3 -32,-2.4 -2,-0.4 2,-0.3 -0.883 30.2 157.6 -99.5 137.2 28.3 -1.9 4.1 58 87 A T E - e 0 100B 1 41,-2.6 43,-2.7 -2,-0.4 2,-0.4 -0.940 40.5 -89.1-155.8 167.9 29.6 -2.8 0.7 59 88 A W E - e 0 101B 10 -33,-0.9 -30,-0.3 -2,-0.3 43,-0.2 -0.746 12.7-165.1 -91.5 133.1 30.1 -1.7 -2.9 60 89 A A S S+ 0 0 0 41,-2.9 2,-0.3 -2,-0.4 -1,-0.1 -0.200 78.6 63.3 -99.5 36.3 27.5 -2.2 -5.6 61 90 A F S S- 0 0 16 8,-0.1 2,-0.3 42,-0.0 -32,-0.1 -0.961 90.4 -99.9-154.5 149.4 30.3 -1.4 -8.1 62 91 A S - 0 0 6 -2,-0.3 -2,-0.1 1,-0.1 8,-0.1 -0.647 17.8-165.7 -71.3 140.6 33.6 -2.9 -9.2 63 92 A H S S+ 0 0 53 -2,-0.3 2,-0.4 4,-0.2 46,-0.4 0.424 71.9 61.7-102.4 -4.7 36.9 -1.6 -7.9 64 93 A G S S- 0 0 15 3,-0.4 3,-0.2 1,-0.1 46,-0.0 -0.958 70.2-140.8-125.6 145.9 39.1 -3.4 -10.5 65 94 A G S S+ 0 0 40 -2,-0.4 -1,-0.1 1,-0.2 45,-0.0 0.775 100.1 58.1 -70.0 -28.5 39.3 -3.1 -14.3 66 95 A S S S+ 0 0 112 1,-0.3 -1,-0.2 2,-0.0 0, 0.0 0.810 114.8 34.1 -74.4 -30.3 39.8 -6.9 -14.8 67 96 A R S S+ 0 0 48 -3,-0.2 -3,-0.4 13,-0.0 -1,-0.3 -0.679 85.6 174.8-126.6 73.7 36.6 -7.9 -13.0 68 97 A P - 0 0 25 0, 0.0 12,-0.2 0, 0.0 3,-0.2 -0.368 31.6-168.0 -79.7 155.6 34.0 -5.2 -13.8 69 98 A L S S+ 0 0 2 1,-0.3 8,-2.4 11,-0.1 2,-0.9 0.725 98.5 28.9 -93.6 -64.7 30.3 -5.0 -12.9 70 99 A Q E S+J 76 0C 15 6,-0.2 -1,-0.3 1,-0.2 6,-0.2 -0.841 74.1 174.3 -93.4 101.8 29.7 -2.0 -15.2 71 100 A S E S- 0 0 56 4,-1.6 -1,-0.2 -2,-0.9 5,-0.1 0.762 70.9 -3.0 -81.2 -27.9 32.3 -2.6 -17.9 72 101 A A E > S-J 75 0C 24 3,-1.1 3,-2.6 -3,-0.1 -1,-0.2 -0.931 109.7 -53.1-152.6 166.3 31.1 0.3 -20.1 73 102 A P T 3 S- 0 0 23 0, 0.0 3,-0.1 0, 0.0 69,-0.0 -0.251 125.8 -8.4 -51.2 118.1 28.1 2.7 -19.7 74 103 A G T 3 S+ 0 0 48 1,-0.2 2,-0.5 67,-0.2 -4,-0.0 0.546 108.0 116.6 72.9 8.7 25.0 0.6 -19.3 75 104 A V E < -J 72 0C 77 -3,-2.6 -4,-1.6 2,-0.0 -3,-1.1 -0.955 44.8-171.5-114.8 123.5 26.9 -2.6 -20.0 76 105 A Y E -J 70 0C 46 -2,-0.5 2,-0.8 -6,-0.2 -6,-0.2 -0.863 29.2-125.4-122.0 144.8 27.0 -5.2 -17.1 77 106 A N > - 0 0 50 -8,-2.4 4,-2.3 -2,-0.3 5,-0.2 -0.817 22.1-157.2 -82.5 111.9 28.8 -8.4 -16.4 78 107 A E H > S+ 0 0 83 -2,-0.8 4,-2.1 1,-0.2 -1,-0.1 0.780 90.3 55.4 -65.1 -29.7 25.9 -10.8 -15.5 79 108 A Q H > S+ 0 0 84 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.910 110.1 46.4 -70.1 -40.5 28.2 -13.2 -13.5 80 109 A M H > S+ 0 0 1 -12,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.918 112.3 50.5 -63.3 -44.9 29.3 -10.2 -11.4 81 110 A F H X S+ 0 0 5 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.884 107.7 53.0 -60.6 -39.1 25.7 -9.1 -11.0 82 111 A Q H X S+ 0 0 74 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.816 104.5 57.1 -68.2 -28.3 24.7 -12.6 -9.9 83 112 A G H X S+ 0 0 0 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.894 106.2 48.3 -65.5 -40.6 27.5 -12.4 -7.3 84 113 A L H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.873 107.0 57.3 -64.8 -37.3 25.8 -9.3 -5.9 85 114 A D H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.898 107.9 48.0 -56.1 -42.8 22.5 -11.3 -6.0 86 115 A F H X S+ 0 0 24 -4,-1.6 4,-3.0 2,-0.2 5,-0.4 0.846 104.2 58.4 -69.5 -36.3 24.2 -13.8 -3.8 87 116 A V H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.938 111.8 43.0 -58.6 -42.5 25.6 -11.2 -1.4 88 117 A I H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.930 116.3 45.5 -70.3 -45.9 22.0 -10.2 -0.7 89 118 A S H X S+ 0 0 15 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.919 116.5 45.9 -65.6 -40.3 20.5 -13.7 -0.5 90 119 A E H X S+ 0 0 18 -4,-3.0 4,-1.4 2,-0.2 -2,-0.2 0.899 109.6 53.7 -73.1 -37.3 23.3 -14.9 1.8 91 120 A A H ><>S+ 0 0 0 -4,-2.2 5,-2.6 -5,-0.4 3,-0.6 0.958 109.6 49.9 -57.9 -45.7 23.1 -11.8 4.0 92 121 A K H ><5S+ 0 0 133 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.904 104.8 58.1 -59.5 -41.5 19.4 -12.5 4.4 93 122 A K H 3<5S+ 0 0 145 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.829 112.5 39.5 -58.9 -36.0 20.1 -16.1 5.3 94 123 A Y T <<5S- 0 0 55 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.214 117.5-107.3-103.6 13.6 22.3 -15.0 8.3 95 124 A G T < 5S+ 0 0 56 -3,-1.5 2,-0.4 -4,-0.3 -3,-0.2 0.803 72.2 139.9 72.1 28.1 20.1 -12.1 9.4 96 125 A I < - 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