==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-FEB-02 1GVY . COMPND 2 MOLECULE: MANNAN ENDO-1,4-BETA-MANNOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS CELLULOSA; . AUTHOR V.DUCROS,D.L.ZECHEL,H.J.GILBERT,L.SZABO,D.STOLL,S.G.WITHERS, . 376 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14706.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 239 63.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 12.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.3 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 18 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.3 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 3 1 0 0 1 1 1 0 1 0 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 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 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 ANTIPARALLEL BRIDGES PER LADDER . 2 1 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 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 43 A K 0 0 129 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 138.2 56.3 32.8 -20.5 2 44 A P - 0 0 84 0, 0.0 2,-0.3 0, 0.0 373,-0.2 -0.360 360.0-162.1 -69.1 143.4 57.0 36.2 -18.9 3 45 A V E -a 375 0A 69 371,-1.2 373,-2.5 -2,-0.1 2,-0.4 -0.930 19.5-117.4-125.3 153.4 56.8 36.4 -15.2 4 46 A T E -a 376 0A 98 -2,-0.3 2,-0.4 371,-0.2 373,-0.2 -0.736 33.5-172.6 -92.1 133.7 56.4 39.6 -13.1 5 47 A V - 0 0 9 371,-3.2 2,-0.6 -2,-0.4 12,-0.0 -0.972 18.0-156.8-129.7 145.7 59.2 40.3 -10.7 6 48 A K + 0 0 118 -2,-0.4 2,-0.2 265,-0.2 4,-0.1 -0.920 23.3 178.0-123.5 106.1 59.6 42.9 -8.0 7 49 A L - 0 0 15 -2,-0.6 229,-0.1 2,-0.2 202,-0.1 -0.690 43.3-115.9-103.9 158.8 63.3 43.7 -7.2 8 50 A V S S+ 0 0 8 -2,-0.2 2,-1.0 1,-0.2 -1,-0.1 0.900 113.6 56.5 -53.8 -43.2 64.9 46.1 -4.8 9 51 A D S > S- 0 0 4 199,-0.3 3,-1.7 1,-0.1 -1,-0.2 -0.822 71.9-168.7 -94.0 104.7 66.3 47.9 -7.9 10 52 A S T 3 S+ 0 0 84 -2,-1.0 -1,-0.1 1,-0.3 -2,-0.1 0.543 88.4 49.2 -71.2 -6.6 63.3 48.7 -10.0 11 53 A Q T 3 S+ 0 0 125 -3,-0.0 -1,-0.3 2,-0.0 3,-0.1 0.097 81.0 144.7-115.5 18.9 65.7 49.6 -12.9 12 54 A A < - 0 0 6 -3,-1.7 195,-0.2 1,-0.1 194,-0.1 -0.201 56.8 -93.2 -59.1 155.2 67.7 46.4 -12.7 13 55 A T > - 0 0 22 193,-2.5 4,-2.5 1,-0.1 3,-0.4 -0.067 32.5-111.2 -67.2 159.4 69.0 45.0 -16.0 14 56 A M H > S+ 0 0 102 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.892 118.8 52.8 -63.5 -33.8 67.1 42.4 -17.8 15 57 A E H > S+ 0 0 29 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.826 109.4 51.3 -65.8 -33.4 69.6 39.7 -17.1 16 58 A T H > S+ 0 0 0 -3,-0.4 4,-1.8 2,-0.2 -2,-0.2 0.916 111.3 46.6 -69.7 -44.0 69.4 40.6 -13.3 17 59 A R H X S+ 0 0 26 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.895 111.3 52.9 -62.9 -42.9 65.7 40.3 -13.5 18 60 A S H X S+ 0 0 1 -4,-2.6 4,-3.0 353,-0.3 -2,-0.2 0.900 104.8 54.9 -59.0 -40.9 66.0 37.0 -15.3 19 61 A L H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.908 108.8 48.0 -57.8 -46.8 68.3 35.7 -12.6 20 62 A F H X S+ 0 0 5 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.949 113.9 46.4 -57.6 -50.2 65.7 36.4 -10.0 21 63 A A H X S+ 0 0 4 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.873 109.0 55.8 -61.2 -38.3 63.0 34.8 -12.1 22 64 A F H X S+ 0 0 14 -4,-3.0 4,-3.0 348,-0.4 5,-0.2 0.940 109.8 45.1 -60.4 -49.3 65.2 31.8 -12.8 23 65 A M H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.870 106.5 60.3 -66.6 -34.2 65.7 31.1 -9.1 24 66 A Q H < S+ 0 0 48 -4,-2.1 -1,-0.2 -5,-0.2 4,-0.2 0.900 116.9 32.2 -59.1 -42.3 62.0 31.6 -8.3 25 67 A E H >< S+ 0 0 99 -4,-1.8 3,-1.6 -3,-0.2 -2,-0.2 0.953 118.8 50.5 -77.3 -53.5 61.2 28.7 -10.6 26 68 A Q H >X S+ 0 0 13 -4,-3.0 3,-2.4 1,-0.3 4,-1.2 0.782 94.5 73.2 -56.0 -35.6 64.3 26.5 -10.1 27 69 A R T 3< S+ 0 0 0 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.1 0.672 94.2 52.3 -61.8 -20.7 64.1 26.5 -6.3 28 70 A R T <4 S+ 0 0 93 -3,-1.6 -1,-0.3 -4,-0.2 -2,-0.2 0.299 114.6 42.9 -95.4 12.7 61.1 24.2 -6.2 29 71 A H T <4 S- 0 0 116 -3,-2.4 2,-0.3 1,-0.4 -2,-0.2 0.493 124.7 -8.8-129.3 -14.3 62.9 21.7 -8.5 30 72 A S < - 0 0 16 -4,-1.2 2,-0.4 282,-0.2 -1,-0.4 -0.957 57.8-117.0-166.1 174.0 66.4 21.5 -7.1 31 73 A I E -b 361 0B 1 329,-2.3 331,-2.1 -2,-0.3 283,-0.3 -0.981 34.3-136.1-125.8 119.3 68.9 23.0 -4.7 32 74 A M E -bc 362 314B 1 281,-2.8 283,-1.9 -2,-0.4 2,-0.5 -0.471 14.4-124.9 -71.2 144.8 71.9 24.5 -6.4 33 75 A F E - c 0 315B 0 329,-2.6 32,-2.0 281,-0.2 31,-1.7 -0.835 28.4-171.5 -93.4 127.0 75.4 23.9 -5.0 34 76 A G E -dc 65 316B 0 281,-2.5 283,-2.2 -2,-0.5 2,-0.3 -0.884 6.2-172.6-114.8 154.4 77.5 27.0 -4.2 35 77 A H E > -dc 66 317B 0 30,-2.1 32,-2.1 -2,-0.3 3,-1.1 -0.983 24.0-124.5-150.9 127.4 81.1 27.3 -3.2 36 78 A Q E 3 S+d 67 0B 1 281,-2.5 284,-0.5 -2,-0.3 32,-0.2 -0.515 99.3 4.9 -68.4 140.2 83.2 30.3 -2.1 37 79 A H T >> S+ 0 0 0 30,-3.1 4,-2.1 -2,-0.2 3,-0.9 0.813 83.8 169.1 54.5 36.6 86.3 30.8 -4.2 38 80 A E T <4 S+ 0 0 0 -3,-1.1 16,-0.5 29,-0.4 17,-0.3 0.869 75.5 16.4 -50.3 -50.3 85.1 28.0 -6.4 39 81 A T T 34 S+ 0 0 0 -4,-0.1 11,-1.1 14,-0.1 13,-0.4 0.330 124.9 57.6-109.7 11.7 87.6 28.6 -9.3 40 82 A T T <4 S+ 0 0 19 -3,-0.9 2,-0.4 1,-0.3 -2,-0.2 0.576 108.4 35.6-113.3 -16.0 90.2 30.8 -7.5 41 83 A Q < + 0 0 26 -4,-2.1 279,-0.5 11,-0.1 13,-0.4 -0.988 66.4 138.7-141.4 131.2 91.2 28.5 -4.5 42 84 A G - 0 0 5 -2,-0.4 3,-0.2 3,-0.2 279,-0.1 -0.958 50.5-131.0-167.6 151.7 91.6 24.8 -4.3 43 85 A L S S+ 0 0 47 -2,-0.3 -1,-0.1 1,-0.2 278,-0.0 0.702 111.9 33.0 -71.0 -24.0 93.7 22.0 -2.9 44 86 A T S S+ 0 0 34 -3,-0.1 2,-0.3 296,-0.0 -1,-0.2 0.283 92.2 105.5-118.3 7.4 93.8 20.2 -6.3 45 87 A I - 0 0 23 -3,-0.2 -3,-0.2 1,-0.1 3,-0.1 -0.676 44.6-167.2 -94.5 147.7 93.8 23.0 -8.9 46 88 A T S S+ 0 0 124 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.426 76.9 44.1-108.3 -3.8 96.9 24.1 -10.8 47 89 A R - 0 0 69 -8,-0.0 5,-0.3 1,-0.0 3,-0.2 -0.991 55.7-164.8-138.6 137.3 95.5 27.4 -12.3 48 90 A T + 0 0 84 -2,-0.3 37,-0.1 1,-0.1 -9,-0.1 -0.010 62.7 109.9-107.2 25.6 93.5 30.0 -10.3 49 91 A D S S- 0 0 59 35,-0.1 -1,-0.1 36,-0.0 -9,-0.1 0.334 100.5 -93.7 -84.6 4.4 92.5 31.7 -13.5 50 92 A G S S+ 0 0 0 -11,-1.1 -10,-0.1 -3,-0.2 -2,-0.1 0.535 104.2 97.7 100.3 3.0 88.9 30.6 -13.2 51 93 A T S S+ 0 0 53 -12,-0.2 2,-0.3 -4,-0.1 -3,-0.1 0.459 78.2 46.2-102.9 -8.1 89.0 27.4 -15.3 52 94 A Q + 0 0 41 -13,-0.4 2,-0.3 -5,-0.3 -2,-0.2 -0.942 54.3 177.4-132.2 157.6 89.4 24.8 -12.5 53 95 A S > - 0 0 0 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.991 40.6-122.0-154.2 158.8 87.9 23.9 -9.2 54 96 A D H > S+ 0 0 0 -16,-0.5 4,-1.5 -13,-0.4 285,-0.3 0.853 116.6 57.5 -65.6 -32.7 88.2 21.2 -6.5 55 97 A T H > S+ 0 0 0 -17,-0.3 4,-2.8 2,-0.2 5,-0.5 0.953 106.1 47.2 -61.2 -46.5 84.5 20.6 -7.1 56 98 A F H > S+ 0 0 77 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.910 111.7 50.5 -62.1 -43.3 85.1 19.9 -10.8 57 99 A N H < S+ 0 0 58 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.743 115.5 44.6 -69.0 -23.1 88.1 17.6 -9.9 58 100 A A H < S+ 0 0 6 -4,-1.5 -2,-0.2 -3,-0.4 -1,-0.2 0.837 134.9 6.8 -84.8 -41.5 85.8 15.7 -7.4 59 101 A V H < S- 0 0 23 -4,-2.8 -3,-0.2 2,-0.3 -2,-0.2 0.487 96.6-106.4-129.1 -6.4 82.6 15.3 -9.4 60 102 A G S < S+ 0 0 29 -4,-2.5 2,-0.3 -5,-0.5 -4,-0.2 0.512 90.8 70.2 89.9 6.7 83.1 16.4 -13.0 61 103 A D S S- 0 0 3 -6,-0.5 -2,-0.3 303,-0.0 -1,-0.2 -0.979 77.0-112.3-147.3 156.8 81.2 19.7 -12.8 62 104 A F - 0 0 18 -2,-0.3 302,-2.8 1,-0.2 303,-0.3 -0.453 44.2 -89.0 -79.7 158.7 81.6 23.1 -11.3 63 105 A A - 0 0 0 300,-0.2 -29,-0.2 -2,-0.2 -1,-0.2 -0.300 30.9-134.1 -55.1 150.4 79.4 24.5 -8.5 64 106 A A S S+ 0 0 0 -31,-1.7 31,-2.6 298,-0.5 2,-0.5 0.810 92.2 50.4 -76.3 -33.5 76.3 26.3 -9.9 65 107 A V E S-de 34 95B 0 -32,-2.0 -30,-2.1 29,-0.2 2,-0.6 -0.944 73.8-156.9-115.3 126.5 76.8 29.3 -7.6 66 108 A Y E -de 35 96B 0 29,-3.1 31,-2.8 -2,-0.5 2,-0.4 -0.936 9.4-158.4-108.4 114.3 80.2 31.0 -7.3 67 109 A G E +de 36 97B 0 -32,-2.1 -30,-3.1 -2,-0.6 -29,-0.4 -0.784 21.6 152.2 -98.0 138.0 80.9 32.9 -4.2 68 110 A W E - e 0 98B 0 29,-2.2 31,-2.6 -2,-0.4 2,-0.3 -0.767 25.8-133.4-141.6-170.7 83.5 35.7 -3.8 69 111 A D E > - e 0 99B 1 29,-0.3 3,-2.4 -2,-0.2 31,-0.2 -0.950 31.3 -99.8-147.3 166.5 83.8 38.7 -1.5 70 112 A T G >> S+ 0 0 2 29,-2.3 4,-2.7 -2,-0.3 3,-1.9 0.651 108.8 82.7 -66.5 -12.7 84.6 42.4 -1.4 71 113 A L G 34 S+ 0 0 33 1,-0.3 8,-2.4 2,-0.2 9,-0.5 0.608 95.2 47.3 -61.0 -12.1 88.1 41.3 -0.2 72 114 A S G <4 S+ 0 0 1 -3,-2.4 10,-0.4 7,-0.2 -1,-0.3 0.293 121.5 35.1-107.3 7.9 88.6 40.9 -4.0 73 115 A I T <4 S+ 0 0 11 -3,-1.9 2,-0.4 1,-0.2 -2,-0.2 0.710 101.7 65.2-127.8 -48.7 87.1 44.3 -4.9 74 116 A V S >< S- 0 0 12 -4,-2.7 3,-2.5 1,-0.1 4,-0.3 -0.700 97.4 -65.3 -92.8 132.7 87.8 47.0 -2.3 75 117 A A T 3 S+ 0 0 54 -2,-0.4 -1,-0.1 1,-0.4 -3,-0.1 -0.265 123.4 32.7 -54.7 140.3 91.4 48.1 -1.8 76 118 A P T 3 S- 0 0 88 0, 0.0 -1,-0.4 0, 0.0 4,-0.1 -0.959 83.6-157.0 -88.4 15.3 93.7 46.5 -0.8 77 119 A K X + 0 0 82 -3,-2.5 3,-2.2 -7,-0.2 -2,-0.1 0.929 15.3 179.9 50.6 52.6 92.0 43.5 -2.5 78 120 A A T 3 S+ 0 0 86 -4,-0.3 -6,-0.2 1,-0.3 -1,-0.1 0.785 78.4 50.7 -52.2 -33.9 93.7 41.0 -0.3 79 121 A E T 3 S- 0 0 55 -8,-2.4 -1,-0.3 1,-0.2 -7,-0.2 0.444 115.0-118.3 -89.6 1.7 92.0 38.1 -2.0 80 122 A G < - 0 0 30 -3,-2.2 -1,-0.2 -9,-0.5 -2,-0.1 0.260 39.8 -50.3 82.2 155.9 92.9 39.4 -5.5 81 123 A D - 0 0 96 1,-0.1 -8,-0.1 -4,-0.1 4,-0.1 -0.238 41.9-175.9 -58.9 152.3 90.9 40.5 -8.4 82 124 A I > + 0 0 1 -10,-0.4 4,-2.9 2,-0.1 5,-0.3 0.250 50.2 108.1-131.9 6.1 88.1 38.3 -9.7 83 125 A V H > S+ 0 0 57 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.935 85.0 45.4 -53.9 -49.6 86.8 40.0 -12.8 84 126 A A H > S+ 0 0 55 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.900 115.1 46.5 -62.5 -42.1 88.2 37.4 -15.1 85 127 A Q H > S+ 0 0 25 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.859 111.5 50.9 -73.5 -35.9 87.0 34.5 -13.1 86 128 A V H X S+ 0 0 0 -4,-2.9 4,-2.9 2,-0.2 5,-0.2 0.933 109.8 51.8 -63.5 -44.3 83.5 35.9 -12.6 87 129 A K H X S+ 0 0 86 -4,-2.6 4,-2.4 -5,-0.3 -2,-0.2 0.908 109.6 48.6 -59.9 -40.9 83.4 36.4 -16.4 88 130 A K H X S+ 0 0 84 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.893 112.1 49.6 -65.3 -42.1 84.4 32.8 -17.0 89 131 A A H <>S+ 0 0 0 -4,-2.4 5,-2.8 1,-0.2 3,-0.5 0.918 111.9 47.1 -61.8 -44.2 81.8 31.6 -14.5 90 132 A Y H ><5S+ 0 0 26 -4,-2.9 3,-1.9 1,-0.2 -2,-0.2 0.895 106.7 58.0 -65.3 -40.0 79.1 33.7 -16.2 91 133 A A H 3<5S+ 0 0 77 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.766 105.8 50.4 -62.1 -27.1 80.1 32.5 -19.6 92 134 A R T 3<5S- 0 0 77 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.330 126.6-103.3 -93.2 9.6 79.5 28.9 -18.5 93 135 A G T < 5S+ 0 0 22 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.621 70.9 150.5 83.8 14.3 76.0 30.0 -17.2 94 136 A G < - 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