==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-MAY-00 1E1F . COMPND 2 MOLECULE: BETA-GLUCOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ZEA MAYS; . AUTHOR M.CZJZEK,M.CICEK,D.R.BEVAN,B.HENRISSAT,A.ESEN . 980 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35319.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 687 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 102 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 1 0.1 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 . 53 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 108 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 305 31.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 22 2.2 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 3 3 2 4 2 4 1 1 1 1 4 0 2 2 0 2 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 8 4 4 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 PARALLEL BRIDGES PER LADDER . 6 2 0 4 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 3 0 0 0 0 0 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 12 A M 0 0 213 0, 0.0 420,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 124.7 -12.7 14.1 102.0 2 13 A L - 0 0 30 1,-0.1 5,-0.1 2,-0.1 419,-0.0 -0.259 360.0-127.2 -63.4 144.9 -9.2 15.6 102.5 3 14 A S >> - 0 0 38 1,-0.1 3,-0.9 2,-0.0 4,-0.8 -0.363 28.3-105.7 -83.0 170.1 -8.6 18.5 105.0 4 15 A P G >4 S+ 0 0 113 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.934 119.9 54.5 -66.0 -44.3 -6.9 21.6 103.8 5 16 A S G 34 S+ 0 0 102 1,-0.2 -3,-0.0 3,-0.0 -2,-0.0 0.583 110.1 53.9 -64.9 -6.0 -3.6 21.0 105.5 6 17 A E G <4 S+ 0 0 99 -3,-0.9 -1,-0.2 2,-0.1 3,-0.1 0.636 76.3 106.2-103.2 -18.5 -3.7 17.6 103.7 7 18 A I S << S- 0 0 50 -3,-1.1 418,-0.0 -4,-0.8 417,-0.0 -0.493 82.2-105.0 -67.0 121.5 -4.1 18.6 100.1 8 19 A P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.098 35.6-156.2 -46.8 140.4 -0.8 18.1 98.2 9 20 A Q > - 0 0 87 1,-0.1 3,-1.4 -3,-0.1 478,-0.1 -0.906 21.0-127.0-119.9 147.5 1.1 21.3 97.5 10 21 A R T 3 S+ 0 0 51 -2,-0.3 -1,-0.1 477,-0.3 477,-0.1 0.843 105.5 67.3 -66.5 -31.9 3.7 21.7 94.7 11 22 A D T 3 S+ 0 0 134 -3,-0.0 -1,-0.3 4,-0.0 2,-0.2 0.586 86.2 79.8 -67.4 -5.0 6.4 23.1 97.1 12 23 A W S < S+ 0 0 69 -3,-1.4 419,-0.0 2,-0.1 0, 0.0 -0.477 89.7 43.6 -80.2 171.4 6.4 19.6 98.6 13 24 A F S S- 0 0 18 -2,-0.2 418,-0.0 418,-0.1 417,-0.0 0.582 99.9 -93.5 61.3 134.0 8.5 17.6 96.0 14 25 A P - 0 0 73 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.110 36.8 -98.6 -68.0-172.5 11.7 19.2 94.6 15 26 A S S S+ 0 0 114 1,-0.2 -4,-0.0 -4,-0.1 -2,-0.0 0.738 119.5 61.5 -82.2 -25.5 12.1 21.2 91.4 16 27 A D S S+ 0 0 141 2,-0.1 -1,-0.2 426,-0.0 425,-0.0 0.876 78.4 108.7 -65.7 -40.9 13.3 18.2 89.5 17 28 A F - 0 0 6 1,-0.1 2,-0.4 423,-0.1 425,-0.2 -0.039 62.0-145.5 -41.8 132.5 10.1 16.3 90.1 18 29 A T E -a 442 0A 16 423,-1.9 425,-2.0 64,-0.1 2,-0.4 -0.892 13.4-167.9-113.0 137.2 8.1 16.0 86.9 19 30 A F E +a 443 0A 2 -2,-0.4 63,-4.2 423,-0.2 64,-1.6 -0.973 25.9 128.3-121.8 135.2 4.3 16.1 86.7 20 31 A G E -ab 444 83A 2 423,-2.3 425,-2.5 -2,-0.4 2,-0.3 -0.894 45.0-103.4-162.3-167.9 2.3 15.2 83.6 21 32 A A E -ab 445 84A 0 62,-1.0 64,-2.5 423,-0.3 2,-0.3 -0.876 27.8-143.1-130.1 163.7 -0.4 13.1 81.9 22 33 A A E +ab 446 85A 0 423,-1.7 425,-1.6 -2,-0.3 426,-1.1 -0.928 19.2 165.2-134.3 157.3 -0.4 10.0 79.7 23 34 A T - 0 0 0 62,-2.1 2,-0.3 -2,-0.3 428,-0.0 -0.863 25.6-128.3-151.1 177.8 -2.2 8.5 76.7 24 35 A S >> - 0 0 0 -2,-0.3 4,-1.2 62,-0.2 3,-0.6 -0.997 24.1-117.1-141.3 137.4 -1.6 5.6 74.3 25 36 A A H >> S+ 0 0 2 -2,-0.3 4,-3.5 1,-0.2 3,-1.4 0.847 109.6 40.7 -36.2 -70.9 -1.8 5.8 70.4 26 37 A Y H 34 S+ 0 0 16 1,-0.3 4,-0.3 105,-0.2 -1,-0.2 0.820 112.0 59.4 -55.5 -32.5 -4.6 3.4 69.6 27 38 A Q H <4 S+ 0 0 1 -3,-0.6 425,-1.8 1,-0.1 -1,-0.3 0.775 127.2 7.6 -69.9 -24.0 -6.6 4.7 72.5 28 39 A I H << S+ 0 0 6 -3,-1.4 37,-2.9 -4,-1.2 35,-0.4 0.648 107.4 78.4-131.6 -20.1 -6.7 8.3 71.2 29 40 A E < + 0 0 9 -4,-3.5 37,-2.0 -5,-0.3 38,-0.4 0.905 57.5 178.9 -64.2 -47.6 -5.2 8.8 67.7 30 41 A G + 0 0 4 29,-0.4 31,-0.3 -5,-0.3 4,-0.1 -0.433 46.1 100.9 74.0-157.7 -8.0 7.6 65.5 31 42 A A > + 0 0 1 29,-1.0 3,-1.1 1,-0.1 6,-0.2 0.897 48.1 173.8 41.0 52.9 -7.4 7.8 61.7 32 43 A W T 3 S+ 0 0 61 28,-0.9 -1,-0.1 1,-0.3 29,-0.1 0.637 74.8 26.4 -63.5 -20.0 -6.7 4.1 61.8 33 44 A N T 3 S+ 0 0 96 27,-0.2 3,-0.3 6,-0.1 -1,-0.3 0.029 97.5 112.6-134.4 27.7 -6.3 3.9 58.0 34 45 A E S X S+ 0 0 70 -3,-1.1 3,-2.2 1,-0.2 -4,-0.0 -0.658 73.6 10.6-102.7 159.2 -5.2 7.4 57.0 35 46 A D T 3 S- 0 0 73 1,-0.3 -1,-0.2 -2,-0.2 71,-0.2 0.833 130.9 -54.2 44.6 45.4 -1.9 8.6 55.6 36 47 A G T 3 S+ 0 0 52 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.369 86.4 159.5 78.7 -5.7 -0.6 5.1 54.9 37 48 A K < - 0 0 21 -3,-2.2 55,-0.3 -6,-0.2 -1,-0.2 -0.235 35.8-130.5 -54.2 133.7 -1.0 3.7 58.4 38 49 A G - 0 0 9 53,-2.5 58,-0.1 1,-0.1 -4,-0.1 -0.495 28.6 -92.9 -85.2 157.2 -1.0 -0.1 58.4 39 50 A E - 0 0 66 -2,-0.2 97,-1.6 56,-0.2 98,-0.5 -0.328 42.4-150.9 -66.3 149.2 -3.7 -2.1 60.2 40 51 A S B > -J 135 0B 1 95,-0.3 4,-2.4 96,-0.1 5,-0.1 -0.627 30.0 -99.1-115.3 177.0 -3.0 -3.2 63.8 41 52 A N H > S+ 0 0 5 93,-1.9 4,-2.9 1,-0.2 5,-0.1 0.864 124.6 46.5 -63.2 -37.3 -4.0 -6.1 65.9 42 53 A W H > S+ 0 0 1 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.853 107.9 54.3 -76.3 -34.2 -6.7 -4.0 67.6 43 54 A D H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.980 115.5 43.1 -57.5 -51.3 -8.0 -2.6 64.3 44 55 A H H X S+ 0 0 53 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.910 115.0 48.0 -58.5 -49.7 -8.3 -6.2 63.3 45 56 A F H X S+ 0 0 6 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.919 114.7 43.6 -62.0 -47.8 -9.8 -7.4 66.6 46 57 A C H < S+ 0 0 3 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.874 114.6 49.7 -67.3 -38.6 -12.4 -4.6 67.0 47 58 A H H < S+ 0 0 59 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.839 119.5 35.8 -70.4 -34.3 -13.5 -4.8 63.4 48 59 A N H < S+ 0 0 83 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.587 129.1 30.1 -96.3 -11.3 -14.0 -8.6 63.3 49 60 A H >< + 0 0 35 -4,-1.5 3,-3.0 -5,-0.2 4,-0.3 -0.196 56.8 153.1-144.9 52.2 -15.3 -9.1 66.9 50 61 A P G > S+ 0 0 54 0, 0.0 3,-0.9 0, 0.0 6,-0.6 0.675 74.0 70.6 -55.9 -16.1 -17.3 -6.1 68.2 51 62 A E G 3 S+ 0 0 118 1,-0.2 -5,-0.1 5,-0.1 5,-0.1 0.743 91.6 60.7 -72.6 -19.6 -19.2 -8.5 70.4 52 63 A R G < S+ 0 0 82 -3,-3.0 2,-0.5 -7,-0.2 -1,-0.2 0.563 93.1 70.8 -83.4 -10.6 -15.9 -8.8 72.4 53 64 A I S X S- 0 0 2 -3,-0.9 3,-2.4 -4,-0.3 403,-0.2 -0.940 92.9-120.3-109.1 128.4 -15.8 -5.1 73.3 54 65 A L T 3 S+ 0 0 122 401,-3.5 402,-0.1 -2,-0.5 -1,-0.1 0.741 105.9 26.1 -34.3 -48.3 -18.5 -4.1 75.8 55 66 A D T 3 S- 0 0 45 400,-0.1 -1,-0.3 2,-0.0 3,-0.1 -0.019 106.4-111.4-115.0 34.0 -20.3 -1.5 73.7 56 67 A G S < S+ 0 0 46 -3,-2.4 2,-0.2 -6,-0.6 -2,-0.1 0.773 74.4 130.6 45.0 37.6 -19.5 -2.8 70.2 57 68 A S - 0 0 22 -7,-0.1 2,-0.3 -6,-0.0 -1,-0.1 -0.510 39.0-159.7-109.7 178.5 -17.3 0.2 69.4 58 69 A N - 0 0 49 -2,-0.2 4,-0.3 -3,-0.1 3,-0.3 -0.832 30.3-110.9-144.0-177.3 -13.8 0.7 68.0 59 70 A S + 0 0 1 -2,-0.3 -29,-0.4 1,-0.2 4,-0.1 -0.274 67.2 127.2-116.6 46.3 -11.1 3.4 67.9 60 71 A D S S+ 0 0 34 1,-0.1 -29,-1.0 -30,-0.1 -28,-0.9 0.773 100.0 11.6 -68.6 -24.3 -11.3 4.3 64.3 61 72 A I S > S+ 0 0 81 -31,-0.3 3,-2.6 -3,-0.3 5,-0.2 0.656 87.6 164.5-119.5 -38.9 -11.7 7.8 65.6 62 73 A G T 3 S- 0 0 1 -4,-0.3 -34,-0.2 1,-0.3 -33,-0.1 -0.279 81.6 -28.3 53.8-130.7 -10.8 7.5 69.3 63 74 A A T 3 S- 0 0 0 -35,-0.4 -1,-0.3 -4,-0.1 -34,-0.1 0.309 86.4-124.3 -95.7 5.4 -10.2 11.0 70.7 64 75 A N X> + 0 0 34 -3,-2.6 4,-1.6 1,-0.1 3,-0.6 0.836 58.0 152.1 55.6 39.0 -9.1 12.0 67.2 65 76 A S H 3> + 0 0 0 -37,-2.9 4,-0.8 1,-0.2 -36,-0.2 0.579 57.5 75.3 -75.8 -9.4 -5.7 13.2 68.5 66 77 A Y H 34 S+ 0 0 18 -37,-2.0 -1,-0.2 -38,-0.3 3,-0.1 0.929 113.9 24.0 -66.4 -39.7 -4.1 12.4 65.1 67 78 A H H <4 S+ 0 0 99 -3,-0.6 3,-0.2 -38,-0.4 -2,-0.2 0.688 129.6 46.0 -95.4 -22.1 -5.8 15.5 63.8 68 79 A M H >X + 0 0 36 -4,-1.6 4,-1.5 -39,-0.2 3,-1.3 0.188 69.6 118.0-108.4 18.2 -6.2 17.4 67.1 69 80 A Y H 3X S+ 0 0 35 -4,-0.8 4,-2.1 1,-0.3 5,-0.2 0.862 70.8 63.0 -53.2 -38.6 -2.8 16.9 68.6 70 81 A K H 3> S+ 0 0 138 -3,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.863 103.4 49.6 -55.6 -36.0 -2.2 20.7 68.7 71 82 A T H <> S+ 0 0 40 -3,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.905 105.7 56.4 -70.0 -40.8 -5.2 21.0 71.0 72 83 A D H X S+ 0 0 4 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.911 107.9 47.9 -57.1 -43.4 -3.8 18.3 73.3 73 84 A V H X S+ 0 0 4 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.911 108.2 55.9 -64.7 -40.4 -0.5 20.2 73.7 74 85 A R H X S+ 0 0 124 -4,-1.7 4,-3.0 -5,-0.2 5,-0.2 0.955 108.2 47.1 -56.1 -52.0 -2.5 23.4 74.4 75 86 A L H X S+ 0 0 4 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.896 111.5 51.9 -56.9 -41.1 -4.3 21.7 77.3 76 87 A L H <>S+ 0 0 0 -4,-2.0 5,-2.2 -5,-0.2 4,-0.5 0.896 111.6 46.4 -62.8 -41.0 -1.1 20.3 78.6 77 88 A K H ><5S+ 0 0 112 -4,-2.7 3,-1.7 1,-0.2 -2,-0.2 0.948 110.1 53.2 -66.4 -48.3 0.5 23.8 78.6 78 89 A E H 3<5S+ 0 0 74 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.817 108.5 50.3 -57.1 -32.8 -2.5 25.4 80.2 79 90 A M T 3<5S- 0 0 0 -4,-1.8 409,-0.4 -5,-0.2 -1,-0.3 0.575 111.8-123.4 -82.6 -9.9 -2.3 22.8 83.1 80 91 A G T < 5 + 0 0 26 -3,-1.7 -3,-0.2 -4,-0.5 -61,-0.1 0.852 45.3 176.3 71.6 35.2 1.4 23.6 83.5 81 92 A M < - 0 0 12 -5,-2.2 -61,-0.2 1,-0.1 -1,-0.2 -0.342 29.8-151.0 -71.7 155.6 2.5 20.0 83.0 82 93 A D S S+ 0 0 54 -63,-4.2 42,-2.9 1,-0.2 2,-0.3 0.824 75.7 7.0 -91.9 -40.7 6.2 19.1 83.0 83 94 A A E -bc 20 124A 0 -64,-1.6 -62,-1.0 40,-0.3 2,-0.4 -0.895 56.2-146.0-141.2 169.5 5.9 16.1 80.7 84 95 A Y E -bc 21 125A 5 40,-1.8 42,-2.2 -2,-0.3 2,-0.6 -0.978 11.7-154.5-141.2 121.0 3.5 14.2 78.5 85 96 A R E +bc 22 126A 0 -64,-2.5 -62,-2.1 -2,-0.4 2,-0.3 -0.873 28.5 152.1-100.5 123.6 3.7 10.4 78.1 86 97 A F E - c 0 127A 5 40,-1.5 42,-2.7 -2,-0.6 2,-0.3 -0.927 33.5-123.7-141.6 163.5 2.3 9.1 74.8 87 98 A S E - c 0 128A 1 -2,-0.3 2,-0.4 40,-0.2 42,-0.2 -0.782 16.2-123.5-114.3 159.7 3.0 6.0 72.6 88 99 A I - 0 0 0 40,-1.9 2,-0.9 -2,-0.3 43,-0.4 -0.778 24.2-120.6 -99.9 141.6 4.0 5.6 69.0 89 100 A S >> - 0 0 4 -2,-0.4 4,-1.2 1,-0.2 3,-0.7 -0.731 16.7-159.0 -86.0 108.6 1.9 3.5 66.6 90 101 A W H >> S+ 0 0 0 -2,-0.9 4,-2.8 43,-0.5 3,-0.6 0.904 93.8 44.7 -52.6 -47.4 4.2 0.7 65.2 91 102 A P H 34 S+ 0 0 0 0, 0.0 -53,-2.5 0, 0.0 -1,-0.3 0.726 107.3 58.3 -74.7 -16.9 2.0 0.2 62.2 92 103 A R H <4 S+ 0 0 2 -3,-0.7 15,-0.3 -55,-0.3 -2,-0.2 0.707 116.4 36.5 -80.7 -18.6 1.6 3.9 61.5 93 104 A I H << S+ 0 0 0 -4,-1.2 11,-2.7 -3,-0.6 -3,-0.2 0.823 133.7 24.3 -96.7 -42.3 5.4 4.0 61.2 94 105 A L S >< S- 0 0 0 -4,-2.8 3,-2.7 -5,-0.2 -1,-0.2 -0.779 70.7-168.9-127.6 84.4 6.0 0.6 59.5 95 106 A P T 3 S+ 0 0 35 0, 0.0 42,-0.3 0, 0.0 -56,-0.2 0.765 93.5 34.4 -41.3 -39.5 2.8 -0.3 57.7 96 107 A K T 3 S- 0 0 130 6,-0.4 3,-0.1 2,-0.3 4,-0.1 0.389 109.8-124.9-100.3 0.9 4.0 -3.8 57.1 97 108 A G S < S+ 0 0 0 -3,-2.7 2,-0.2 1,-0.2 63,-0.2 0.252 77.6 92.7 76.9 -13.2 5.8 -3.9 60.4 98 109 A T S > S- 0 0 9 1,-0.1 4,-0.7 4,-0.1 -2,-0.3 -0.613 85.6-116.4-110.9 170.3 9.1 -4.8 58.8 99 110 A K T >4 S+ 0 0 131 -2,-0.2 3,-0.7 1,-0.2 -1,-0.1 0.866 117.3 59.4 -67.3 -35.6 12.1 -3.0 57.5 100 111 A E T 34 S+ 0 0 134 1,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.928 97.0 58.3 -57.2 -50.6 11.2 -4.4 54.1 101 112 A G T 34 S- 0 0 28 1,-0.1 -1,-0.2 -7,-0.1 -2,-0.2 0.744 108.5-131.6 -53.6 -28.5 7.8 -2.7 54.1 102 113 A G << - 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