==== 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 14-JAN-11 3QC2 . COMPND 2 MOLECULE: GLYCOSYL HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES OVATUS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 717 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28455.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 467 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 247 34.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 7 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 15 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 85 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 5 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 RESIDUES PER ALPHA HELIX . 2 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 0 0 0 PARALLEL BRIDGES PER LADDER . 12 5 12 5 2 0 4 9 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 0 0 4 0 0 2 1 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 27 A N 0 0 132 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -66.7 34.7 -65.2 6.9 2 28 A H + 0 0 172 1,-0.1 357,-0.0 357,-0.1 0, 0.0 0.228 360.0 84.0-112.9 8.4 31.2 -64.0 6.1 3 29 A K + 0 0 100 355,-0.1 356,-2.3 2,-0.1 2,-0.4 0.299 54.2 123.5 -96.2 7.0 31.2 -61.6 9.2 4 30 A E - 0 0 75 354,-0.2 2,-0.9 -3,-0.1 353,-0.1 -0.581 49.6-155.0 -73.5 125.1 33.0 -58.6 7.6 5 31 A N - 0 0 18 -2,-0.4 351,-0.6 351,-0.3 2,-0.1 -0.685 14.9-166.7-104.3 76.8 30.8 -55.5 7.8 6 32 A K - 0 0 134 -2,-0.9 349,-0.0 349,-0.1 -2,-0.0 -0.428 7.5-145.8 -68.0 134.1 32.1 -53.4 4.9 7 33 A L - 0 0 46 -2,-0.1 6,-0.1 4,-0.1 2,-0.1 -0.779 16.8-114.1-100.6 144.7 30.9 -49.8 5.0 8 34 A P > - 0 0 48 0, 0.0 3,-1.3 0, 0.0 -1,-0.0 -0.383 36.6-103.9 -69.8 159.3 30.1 -47.8 1.8 9 35 A D T 3 S+ 0 0 144 1,-0.2 246,-0.1 -2,-0.1 -2,-0.0 0.581 117.6 57.3 -63.6 -11.7 32.5 -44.8 1.2 10 36 A W T 3 S+ 0 0 30 245,-0.1 -1,-0.2 2,-0.1 245,-0.1 0.697 90.5 89.0 -89.9 -21.7 29.9 -42.2 2.4 11 37 A A S < S- 0 0 12 -3,-1.3 2,-0.3 1,-0.1 -4,-0.1 -0.366 77.3-117.8 -80.3 155.3 29.4 -43.6 5.9 12 38 A F - 0 0 16 -2,-0.1 2,-0.2 341,-0.0 3,-0.2 -0.732 52.5-111.7 -87.5 139.2 31.4 -42.8 9.1 13 39 A G - 0 0 9 -2,-0.3 343,-0.1 1,-0.3 2,-0.1 -0.652 29.4 -40.1 139.8 167.2 33.3 -45.7 10.6 14 40 A G - 0 0 1 341,-0.4 2,-0.7 -2,-0.2 340,-0.7 0.468 49.3-160.5 -83.2 156.2 34.5 -47.9 12.1 15 41 A F - 0 0 4 287,-0.3 2,-0.4 -3,-0.2 333,-0.3 -0.886 13.4-156.4 -99.4 108.9 34.3 -46.5 15.6 16 42 A E B -A 347 0A 124 331,-2.6 331,-2.9 -2,-0.7 340,-0.0 -0.739 13.1-129.7 -94.4 132.8 36.8 -48.4 17.7 17 43 A R - 0 0 29 -2,-0.4 329,-0.2 329,-0.3 3,-0.1 -0.685 29.3-125.3 -78.8 117.3 36.3 -48.6 21.5 18 44 A P >> - 0 0 39 0, 0.0 3,-1.1 0, 0.0 4,-0.6 -0.389 33.7 -95.7 -66.3 143.2 39.6 -47.6 23.2 19 45 A K T 34 S- 0 0 154 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.289 97.9 -2.7 -60.1 137.2 41.1 -50.2 25.6 20 46 A N T 34 S+ 0 0 174 1,-0.1 -1,-0.2 2,-0.1 -3,-0.0 0.640 106.3 97.8 56.7 24.4 40.3 -49.8 29.4 21 47 A V T <4 + 0 0 24 -3,-1.1 -2,-0.1 324,-0.1 -1,-0.1 0.754 56.1 125.2-105.8 -36.2 38.4 -46.6 29.0 22 48 A N < + 0 0 27 -4,-0.6 322,-0.1 323,-0.1 2,-0.1 -0.566 56.8 37.3 -89.1 146.1 34.7 -47.8 28.9 23 49 A P - 0 0 43 0, 0.0 321,-0.2 0, 0.0 3,-0.2 0.523 69.3-175.3 -76.6 143.9 32.3 -47.1 30.5 24 50 A V S S+ 0 0 22 319,-1.5 69,-0.4 1,-0.2 2,-0.4 0.782 74.1 26.8 -77.1 -29.1 33.4 -43.4 30.6 25 51 A I B S+B 343 0A 1 318,-1.2 318,-2.4 24,-0.1 -1,-0.2 -0.975 71.2 170.0-139.6 122.1 30.5 -42.4 32.9 26 52 A S - 0 0 34 -2,-0.4 316,-0.1 316,-0.2 22,-0.1 -0.835 43.5 -75.2-125.6 163.7 28.7 -44.7 35.4 27 53 A P - 0 0 38 0, 0.0 2,-0.4 0, 0.0 19,-0.2 -0.277 40.8-151.5 -60.3 144.4 26.1 -44.1 38.2 28 54 A I - 0 0 43 17,-2.2 17,-0.4 1,-0.1 19,-0.1 -0.983 8.4-163.8-121.4 129.0 27.4 -42.6 41.5 29 55 A E S S+ 0 0 128 -2,-0.4 17,-0.1 1,-0.1 -1,-0.1 0.919 82.3 51.2 -76.1 -48.5 25.7 -43.3 44.8 30 56 A N S S+ 0 0 120 15,-0.1 2,-0.4 16,-0.1 -1,-0.1 0.660 78.9 102.8 -69.4 -24.4 27.1 -40.5 47.1 31 57 A T - 0 0 8 12,-0.1 14,-0.5 14,-0.1 2,-0.3 -0.496 54.0-165.8 -72.0 123.5 26.4 -37.3 45.0 32 58 A K - 0 0 82 -2,-0.4 2,-0.3 11,-0.2 11,-0.2 -0.787 11.1-171.1-112.4 152.7 23.4 -35.4 46.3 33 59 A F E -E 42 0B 18 9,-1.7 9,-2.4 -2,-0.3 2,-1.0 -0.998 26.2-126.1-141.8 134.9 21.3 -32.5 44.8 34 60 A Y E -E 41 0B 129 -2,-0.3 7,-0.2 7,-0.2 -2,-0.0 -0.739 27.2-151.2 -84.0 103.2 18.6 -30.4 46.4 35 61 A C E >> -E 40 0B 0 5,-1.9 4,-2.2 -2,-1.0 5,-0.9 -0.659 4.0-153.0 -77.2 118.5 15.6 -30.8 44.0 36 62 A P T 45S+ 0 0 34 0, 0.0 -1,-0.1 0, 0.0 68,-0.1 0.726 95.4 45.1 -65.3 -23.3 13.5 -27.6 44.2 37 63 A L T 45S+ 0 0 31 66,-0.3 67,-0.1 1,-0.1 -2,-0.0 0.840 117.0 42.1 -87.1 -39.7 10.3 -29.5 43.2 38 64 A T T 45S- 0 0 64 2,-0.2 -1,-0.1 4,-0.0 3,-0.1 0.751 98.3-141.4 -75.3 -24.6 10.8 -32.5 45.6 39 65 A K T <5 + 0 0 153 -4,-2.2 2,-0.3 1,-0.2 -5,-0.1 0.818 69.6 79.4 65.0 33.7 12.0 -30.0 48.4 40 66 A D E - 0 0 17 -2,-0.3 3,-1.7 -11,-0.2 27,-0.3 -0.539 41.0-177.9 -80.4 74.6 21.0 -39.1 44.8 44 70 A W T 3 S+ 0 0 0 -2,-2.2 37,-0.3 1,-0.3 -1,-0.2 0.534 74.5 31.4 -55.0 -16.8 20.2 -37.7 41.3 45 71 A E T 3 S+ 0 0 1 -14,-0.5 -17,-2.2 -17,-0.4 -1,-0.3 -0.018 84.8 108.9-134.8 32.8 22.6 -40.0 39.4 46 72 A S S < S+ 0 0 9 -3,-1.7 23,-0.2 -19,-0.2 -2,-0.1 0.687 84.0 33.5 -85.4 -21.1 22.7 -43.2 41.6 47 73 A N S S+ 0 0 47 21,-2.1 2,-0.3 1,-0.3 22,-0.2 0.857 122.9 4.9-102.8 -47.4 20.8 -45.5 39.3 48 74 A D E -F 68 0C 17 20,-1.4 20,-2.2 -22,-0.1 2,-0.4 -0.999 41.5-177.7-148.0 139.1 21.6 -44.7 35.6 49 75 A T E +F 67 0C 0 292,-2.1 289,-0.3 -2,-0.3 18,-0.2 -0.917 46.4 106.8-134.6 106.1 23.9 -42.3 33.6 50 76 A F E +F 66 0C 5 16,-2.6 16,-2.2 -2,-0.4 293,-0.2 -0.616 31.3 68.5-153.4-156.1 23.3 -42.7 29.9 51 77 A N E S- 0 0 7 291,-0.3 15,-0.4 14,-0.2 2,-0.2 0.741 70.5-170.0 24.5 75.2 21.9 -41.2 26.6 52 78 A P E - 0 0 0 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.556 26.7-143.8 -98.7 155.4 24.4 -38.3 26.3 53 79 A A E -F 64 0C 0 11,-2.8 11,-1.5 -2,-0.2 2,-0.3 -0.722 23.1-164.6-101.6 159.1 24.8 -35.2 24.2 54 80 A A E +F 63 0C 5 269,-0.3 271,-0.6 -2,-0.3 68,-0.3 -0.997 15.9 150.9-149.5 143.4 28.3 -34.1 23.2 55 81 A T E -F 62 0C 11 7,-2.1 7,-2.3 -2,-0.3 2,-0.4 -0.936 41.7 -93.0-158.8 177.6 29.8 -31.0 21.9 56 82 A L E +F 61 0C 45 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.884 40.6 162.7-105.5 134.6 33.0 -28.8 21.7 57 83 A Y E > -F 60 0C 61 3,-2.7 3,-1.3 -2,-0.4 -2,-0.1 -0.918 66.8 -14.0-154.1 122.8 33.6 -25.9 24.2 58 84 A N T 3 S- 0 0 137 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.872 125.7 -52.9 52.9 46.2 36.9 -24.1 25.0 59 85 A G T 3 S+ 0 0 57 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.690 122.2 99.2 65.6 19.5 39.1 -26.7 23.3 60 86 A E E < S-F 57 0C 63 -3,-1.3 -3,-2.7 29,-0.0 2,-0.6 -0.952 76.7-114.0-135.4 154.3 37.4 -29.5 25.3 61 87 A I E -FG 56 87C 0 26,-2.4 26,-2.0 -2,-0.3 2,-0.4 -0.794 32.0-163.4 -88.8 122.4 34.7 -32.1 24.8 62 88 A V E -FG 55 86C 0 -7,-2.3 -7,-2.1 -2,-0.6 2,-0.4 -0.908 3.1-166.4-108.2 134.1 31.7 -31.4 27.0 63 89 A V E -FG 54 85C 0 22,-3.2 22,-2.2 -2,-0.4 2,-0.6 -0.968 11.1-161.5-120.8 133.9 29.1 -34.1 27.7 64 90 A L E -FG 53 84C 1 -11,-1.5 -11,-2.8 -2,-0.4 2,-0.4 -0.983 22.1-163.6-110.0 117.8 25.7 -33.7 29.2 65 91 A Y E - G 0 83C 0 18,-1.4 18,-3.2 -2,-0.6 2,-0.5 -0.835 22.9-117.1-109.9 141.1 24.4 -37.1 30.4 66 92 A R E -FG 50 82C 21 -16,-2.2 -16,-2.6 -15,-0.4 2,-0.4 -0.623 39.2-171.4 -71.0 121.8 20.9 -38.2 31.3 67 93 A A E -FG 49 81C 0 14,-3.2 14,-2.4 -2,-0.5 2,-0.4 -0.948 6.3-167.8-121.9 140.8 21.0 -39.2 35.0 68 94 A E E -FG 48 80C 7 -20,-2.2 -21,-2.1 -2,-0.4 -20,-1.4 -0.976 11.5-143.4-132.2 143.7 18.3 -40.9 37.0 69 95 A D - 0 0 27 10,-0.7 3,-0.4 -2,-0.4 -25,-0.1 -0.322 37.0-105.1 -88.0 174.2 17.6 -41.5 40.7 70 96 A K S S+ 0 0 111 -27,-0.3 -26,-0.1 1,-0.2 -1,-0.0 0.116 82.2 123.3 -87.8 21.9 16.1 -44.7 42.2 71 97 A S S S+ 0 0 69 8,-0.1 2,-0.2 -27,-0.0 -1,-0.2 0.586 74.5 30.4 -58.3 -13.1 12.8 -42.6 42.7 72 98 A G S S- 0 0 26 -3,-0.4 6,-0.1 1,-0.2 4,-0.1 -0.832 75.7-119.1-139.7 178.5 10.9 -45.2 40.6 73 99 A V S S- 0 0 132 -2,-0.2 -1,-0.2 4,-0.1 3,-0.1 0.935 73.4 -21.9 -83.8 -84.1 10.8 -48.9 39.5 74 100 A G S > S+ 0 0 27 1,-0.2 3,-1.5 2,-0.0 4,-0.2 -0.141 100.6 7.8-114.8-154.8 11.2 -49.4 35.7 75 101 A I T 3 S- 0 0 145 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.128 125.0 -14.6 -29.9 117.6 10.9 -47.7 32.3 76 102 A G T 3 S+ 0 0 19 1,-0.1 -1,-0.2 -3,-0.1 63,-0.1 0.744 103.5 107.5 54.3 33.8 10.3 -43.9 32.5 77 103 A H < + 0 0 109 -3,-1.5 2,-0.2 2,-0.1 -2,-0.1 0.274 62.9 75.1-118.6 6.0 9.2 -43.8 36.3 78 104 A R S S- 0 0 13 -4,-0.2 2,-0.6 -6,-0.1 -8,-0.1 -0.516 90.4-101.5-106.0 175.7 12.4 -42.1 37.6 79 105 A T - 0 0 11 -2,-0.2 -10,-0.7 -10,-0.1 2,-0.4 -0.926 31.8-145.6-109.1 122.0 13.2 -38.4 37.2 80 106 A S E +Gh 68 116C 0 35,-2.4 37,-2.5 -2,-0.6 2,-0.3 -0.721 23.3 168.4 -90.8 129.0 15.8 -37.5 34.5 81 107 A R E -G 67 0C 1 -14,-2.4 -14,-3.2 -2,-0.4 2,-0.6 -0.934 34.8-111.8-132.2 154.5 18.2 -34.6 35.0 82 108 A L E -GI 66 101C 0 19,-3.0 18,-2.3 -2,-0.3 19,-1.1 -0.812 25.1-156.2 -99.1 121.9 21.3 -33.7 32.9 83 109 A G E -G 65 0C 0 -18,-3.2 -18,-1.4 -2,-0.6 2,-0.4 -0.509 12.3-134.3 -85.9 159.5 24.7 -34.1 34.4 84 110 A Y E +G 64 0C 18 14,-0.4 12,-2.3 12,-0.2 2,-0.3 -0.963 27.0 167.9-121.8 133.5 27.7 -32.1 33.1 85 111 A A E -GJ 63 95C 0 -22,-2.2 -22,-3.2 -2,-0.4 2,-0.3 -0.995 14.5-158.4-145.4 144.5 31.2 -33.5 32.3 86 112 A T E -GJ 62 94C 19 8,-1.7 8,-2.7 -2,-0.3 2,-0.3 -0.908 7.5-171.0-124.8 151.4 34.3 -32.2 30.5 87 113 A S E -G 61 0C 0 -26,-2.0 -26,-2.4 -2,-0.3 6,-0.1 -1.000 24.0-162.4-144.7 144.7 37.2 -33.9 28.9 88 114 A T S S+ 0 0 74 4,-0.5 5,-0.1 -2,-0.3 -1,-0.1 0.567 100.5 28.4 -96.4 -13.8 40.6 -32.9 27.4 89 115 A D S S- 0 0 51 3,-0.5 -1,-0.1 -28,-0.1 4,-0.1 0.388 102.6-116.0-127.7 -1.3 41.1 -36.2 25.5 90 116 A G S S+ 0 0 0 2,-0.3 3,-0.1 -29,-0.1 236,-0.1 0.348 104.6 64.4 80.7 -5.2 37.5 -37.5 24.7 91 117 A T S S+ 0 0 21 1,-0.2 2,-0.5 254,-0.0 -1,-0.1 0.603 92.2 55.3-121.9 -24.2 37.9 -40.6 26.9 92 118 A H S S- 0 0 112 2,-0.0 -4,-0.5 -67,-0.0 -3,-0.5 -0.974 71.4-162.3-118.9 120.9 38.4 -39.4 30.5 93 119 A F - 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