==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELLULOSE-BINDING PROTEIN 30-MAY-12 4FER . COMPND 2 MOLECULE: EXPANSIN-YOAJ; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS SUBSP. SUBTILIS; . AUTHOR N.GEORGELIS,N.H.YENNAWAR,D.J.COSGROVE . 414 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19877.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 60.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 120 29.0 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 . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.4 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 . 31 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 2.9 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+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 2 0 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 RESIDUES PER ALPHA HELIX . 0 0 2 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 PARALLEL BRIDGES PER LADDER . 0 2 2 7 8 3 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 . 0 0 2 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 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 2 A A 0 0 15 0, 0.0 3,-0.2 0, 0.0 105,-0.2 0.000 360.0 360.0 360.0 144.0 3.3 66.2 15.4 2 3 A Y + 0 0 128 1,-0.4 2,-0.3 103,-0.1 104,-0.1 0.937 360.0 3.9 -77.8 -55.4 2.4 69.7 14.4 3 4 A D S S+ 0 0 135 102,-0.1 -1,-0.4 2,-0.0 2,-0.3 -0.955 77.7 148.9-125.7 154.4 1.2 70.5 17.9 4 5 A D - 0 0 49 -2,-0.3 2,-0.3 -3,-0.2 0, 0.0 -0.948 19.4-160.8-170.7 162.1 1.3 68.2 21.0 5 6 A L + 0 0 110 -2,-0.3 2,-0.3 98,-0.0 98,-0.2 -0.898 10.2 170.7-164.5 131.3 1.7 68.6 24.8 6 7 A H E -A 102 0A 44 96,-1.9 96,-2.6 -2,-0.3 2,-0.3 -0.995 13.7-156.0-138.9 150.0 2.6 66.5 27.9 7 8 A E E +A 101 0A 127 -2,-0.3 2,-0.3 94,-0.2 94,-0.2 -0.917 38.7 103.8-119.8 149.7 3.3 67.2 31.5 8 9 A G E -A 100 0A 11 92,-2.0 92,-2.7 -2,-0.3 2,-0.3 -0.941 60.1 -67.1 176.1-151.5 5.4 65.1 33.9 9 10 A Y E -A 99 0A 113 -2,-0.3 71,-1.9 90,-0.2 2,-0.4 -0.921 31.0-151.9-130.4 152.1 8.8 64.9 35.6 10 11 A A E +Ab 98 80A 2 88,-2.4 88,-2.1 -2,-0.3 71,-0.2 -0.958 13.1 174.0-122.1 144.5 12.3 64.4 34.4 11 12 A T E - b 0 81A 37 69,-1.8 71,-2.1 -2,-0.4 2,-0.3 -0.578 29.6-113.5-121.4-166.6 15.4 63.0 36.1 12 13 A Y E + b 0 82A 78 84,-0.3 2,-0.3 69,-0.2 71,-0.2 -0.958 27.9 174.6-139.3 161.3 18.8 62.4 34.5 13 14 A T - 0 0 32 69,-2.2 68,-0.0 -2,-0.3 22,-0.0 -0.977 34.7-136.9-157.5 155.8 21.0 59.5 33.5 14 15 A G S S+ 0 0 62 -2,-0.3 3,-0.5 69,-0.1 69,-0.1 0.461 78.8 95.6 -97.3 -5.0 24.3 58.6 31.7 15 16 A S + 0 0 62 1,-0.2 -2,-0.1 2,-0.1 4,-0.1 -0.112 54.5 60.3 -77.3 177.6 22.7 55.7 29.9 16 17 A G S S+ 0 0 4 2,-0.5 4,-0.2 53,-0.1 -1,-0.2 0.229 75.4 92.3 93.7 -14.7 21.3 55.7 26.4 17 18 A Y S S+ 0 0 43 -3,-0.5 10,-0.8 1,-0.3 2,-0.4 0.812 99.4 20.0 -80.9 -30.7 24.4 56.7 24.4 18 19 A S S S+ 0 0 98 8,-0.1 -2,-0.5 7,-0.1 -1,-0.3 -1.000 130.3 10.6-140.0 137.2 25.4 53.2 23.8 19 20 A G S S+ 0 0 64 -2,-0.4 -2,-0.1 1,-0.2 -1,-0.1 0.647 77.7 164.8 72.6 16.3 23.3 50.0 24.0 20 21 A G > - 0 0 3 -4,-0.2 3,-1.6 1,-0.1 5,-0.2 -0.197 50.7-108.4 -59.0 158.4 20.0 51.8 24.2 21 22 A A T 3 S+ 0 0 40 1,-0.3 49,-0.2 50,-0.1 -1,-0.1 0.741 113.8 61.8 -66.9 -22.1 16.9 49.6 23.6 22 23 A F T 3 S- 0 0 2 47,-1.2 -1,-0.3 135,-0.1 48,-0.1 0.397 99.3-131.2 -90.8 6.7 16.1 51.3 20.3 23 24 A L < + 0 0 55 -3,-1.6 -2,-0.1 46,-0.2 47,-0.1 0.890 59.6 141.3 50.5 45.8 19.4 50.1 18.6 24 25 A L + 0 0 5 45,-0.3 -1,-0.1 -4,-0.1 -3,-0.1 0.355 36.5 170.7 -98.6 3.6 20.0 53.7 17.3 25 26 A D + 0 0 55 -5,-0.2 2,-0.1 44,-0.1 -7,-0.1 -0.180 43.7 62.4 -56.5 151.8 23.8 53.5 18.0 26 27 A P + 0 0 114 0, 0.0 -8,-0.1 0, 0.0 -9,-0.0 0.502 64.4 177.1 -82.7 144.5 26.2 55.2 17.4 27 28 A I - 0 0 15 -10,-0.8 -2,-0.1 -2,-0.1 6,-0.0 -0.966 33.5-120.9-111.7 116.3 25.0 58.2 19.3 28 29 A P > - 0 0 86 0, 0.0 3,-2.1 0, 0.0 -3,-0.0 -0.307 23.2-124.7 -54.9 135.8 27.6 61.1 19.3 29 30 A S T 3 S+ 0 0 91 1,-0.3 -12,-0.0 3,-0.0 -2,-0.0 0.707 106.8 54.0 -62.8 -22.7 28.5 61.9 23.0 30 31 A D T 3 S+ 0 0 147 2,-0.1 -1,-0.3 55,-0.0 2,-0.2 0.339 82.2 111.3 -98.0 9.4 27.5 65.5 22.7 31 32 A M S < S- 0 0 52 -3,-2.1 2,-0.6 1,-0.0 54,-0.2 -0.545 72.5-123.1 -71.6 144.6 24.0 64.9 21.4 32 33 A E + 0 0 34 -2,-0.2 35,-2.3 33,-0.2 2,-0.2 -0.838 46.1 166.4 -88.9 125.9 21.2 65.7 23.8 33 34 A I E -c 67 0A 2 -2,-0.6 50,-2.2 33,-0.3 2,-0.3 -0.761 21.5-157.2-134.3 175.4 19.1 62.6 24.4 34 35 A T E -cD 68 82A 2 33,-2.1 35,-2.1 -2,-0.2 36,-1.2 -0.995 17.2-134.0-153.1 153.0 16.5 61.0 26.5 35 36 A A E -cD 70 81A 5 46,-2.4 46,-2.4 -2,-0.3 2,-0.4 -0.785 33.4-145.7 -95.6 152.2 15.0 57.8 27.7 36 37 A I E -cD 71 80A 0 34,-2.1 36,-2.9 -2,-0.3 44,-0.2 -0.966 14.9-106.2-130.6 139.6 11.2 57.7 27.6 37 38 A N > - 0 0 0 42,-1.7 4,-2.4 -2,-0.4 5,-0.2 -0.234 33.4-118.6 -59.4 147.9 8.5 56.1 29.8 38 39 A P H > S+ 0 0 43 0, 0.0 4,-2.2 0, 0.0 10,-0.2 0.824 107.8 57.4 -63.2 -36.5 6.8 53.0 28.2 39 40 A A H 4 S+ 0 0 39 36,-0.4 38,-0.1 1,-0.2 37,-0.1 0.950 115.8 35.3 -62.8 -47.1 3.2 54.5 28.2 40 41 A D H >4 S+ 0 0 9 1,-0.2 3,-1.0 36,-0.1 -1,-0.2 0.848 114.1 59.5 -74.3 -32.8 4.2 57.5 26.0 41 42 A L H 3< S+ 0 0 6 -4,-2.4 9,-2.0 1,-0.3 2,-0.5 0.914 104.7 50.2 -56.7 -46.0 6.8 55.4 24.1 42 43 A N T >< S+ 0 0 51 -4,-2.2 3,-1.5 6,-0.2 -1,-0.3 -0.223 83.9 171.2 -93.1 43.2 4.1 53.0 22.9 43 44 A Y G X + 0 0 124 -3,-1.0 3,-1.7 -2,-0.5 6,-0.1 -0.202 64.1 11.0 -52.3 139.6 1.7 55.8 21.6 44 45 A G G 3 S- 0 0 62 1,-0.3 -1,-0.2 5,-0.0 3,-0.1 0.660 129.9 -68.0 66.9 16.8 -1.3 54.6 19.7 45 46 A G G < S+ 0 0 76 -3,-1.5 2,-0.6 1,-0.2 -1,-0.3 0.656 102.7 130.4 75.8 15.3 -0.7 51.0 20.6 46 47 A V X - 0 0 33 -3,-1.7 3,-1.8 -4,-0.2 -1,-0.2 -0.907 60.7-125.2-104.8 117.0 2.5 50.9 18.5 47 48 A K T 3 S+ 0 0 62 -2,-0.6 -5,-0.1 106,-0.5 109,-0.0 -0.406 94.7 2.5 -59.9 132.7 5.6 49.5 20.2 48 49 A A T > S+ 0 0 0 -10,-0.2 3,-1.4 -2,-0.1 -1,-0.3 0.772 82.5 153.0 59.8 28.0 8.4 52.0 20.1 49 50 A A T < S+ 0 0 0 -3,-1.8 88,-0.3 -8,-0.4 -7,-0.2 0.906 75.7 40.5 -50.6 -42.6 6.2 54.5 18.3 50 51 A L T > S+ 0 0 5 -9,-2.0 3,-2.0 -4,-0.2 -1,-0.3 0.370 83.1 126.3 -95.3 6.2 8.3 57.4 19.7 51 52 A A T < S+ 0 0 0 -3,-1.4 86,-0.4 -10,-0.3 18,-0.2 -0.453 82.7 13.2 -63.2 130.6 11.7 55.8 19.3 52 53 A G T 3 S+ 0 0 2 16,-2.5 81,-0.3 1,-0.3 -1,-0.3 0.617 99.2 131.2 77.6 9.6 14.0 58.1 17.3 53 54 A S < - 0 0 2 -3,-2.0 15,-2.9 15,-0.2 2,-0.4 -0.404 54.7-127.7 -78.5 167.7 11.6 61.0 17.8 54 55 A Y E -EF 67 105A 28 51,-0.6 51,-2.4 13,-0.2 2,-0.4 -0.977 21.4-162.9-115.9 138.1 12.7 64.4 19.0 55 56 A L E -EF 66 104A 0 11,-2.4 11,-2.9 -2,-0.4 2,-0.6 -0.944 16.0-141.4-119.1 139.5 11.1 66.2 21.9 56 57 A E E -EF 65 103A 47 47,-2.6 47,-1.6 -2,-0.4 2,-0.5 -0.895 28.4-163.7 -92.2 127.5 11.2 69.8 22.9 57 58 A V E -EF 64 102A 0 7,-3.4 7,-2.0 -2,-0.6 2,-0.5 -0.947 10.4-162.6-122.4 129.7 11.4 69.8 26.7 58 59 A E E +EF 63 101A 76 43,-3.5 43,-2.1 -2,-0.5 5,-0.2 -0.937 17.0 165.0-111.6 126.7 10.7 72.7 29.0 59 60 A G - 0 0 11 3,-2.8 3,-0.5 -2,-0.5 32,-0.2 -0.534 56.3 -73.4-120.4-167.0 11.8 72.8 32.6 60 61 A P S S+ 0 0 85 0, 0.0 31,-0.2 0, 0.0 3,-0.1 0.777 128.6 38.7 -59.9 -31.1 12.2 75.5 35.3 61 62 A K S S- 0 0 156 29,-3.5 2,-0.3 1,-0.2 30,-0.2 0.554 123.4 -58.8-102.1 -11.1 15.3 77.1 33.7 62 63 A G - 0 0 27 28,-0.7 -3,-2.8 -3,-0.5 2,-0.3 -0.994 54.9 -72.1 163.4-166.3 14.5 76.9 29.9 63 64 A K E + E 0 58A 122 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.923 38.3 166.3-124.3 153.0 13.8 74.7 26.9 64 65 A T E - E 0 57A 17 -7,-2.0 -7,-3.4 -2,-0.3 2,-0.4 -0.970 30.6-114.3-156.0 167.9 15.9 72.3 24.9 65 66 A T E - E 0 56A 53 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.917 28.6-169.1-114.4 136.8 15.5 69.5 22.3 66 67 A V E - E 0 55A 0 -11,-2.9 -11,-2.4 -2,-0.4 2,-0.4 -0.926 20.6-131.3-126.5 149.2 16.3 65.8 22.8 67 68 A Y E -cE 33 54A 25 -35,-2.3 -33,-2.1 -2,-0.3 2,-0.8 -0.832 27.8-129.1 -94.0 130.7 16.6 62.7 20.7 68 69 A V E +c 34 0A 0 -15,-2.9 -16,-2.5 -2,-0.4 -15,-0.2 -0.716 45.3 150.5 -89.1 110.0 14.7 59.7 22.0 69 70 A T E + 0 0 3 -35,-2.1 -47,-1.2 -2,-0.8 -45,-0.3 0.516 52.5 30.6-118.2 -11.9 17.1 56.8 22.2 70 71 A D E S-c 35 0A 27 -36,-1.2 -34,-2.1 -50,-0.2 2,-0.3 -0.964 71.8-102.6-150.2 162.2 16.1 54.5 25.0 71 72 A L E -c 36 0A 56 -2,-0.3 -34,-0.2 -36,-0.3 -50,-0.1 -0.703 19.3-150.1 -82.9 139.3 13.3 53.1 27.1 72 73 A Y > - 0 0 32 -36,-2.9 3,-2.1 -2,-0.3 -31,-0.1 -0.812 18.5-174.4-106.4 86.0 12.8 54.5 30.7 73 74 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.2 0, 0.0 -36,-0.0 0.825 78.2 45.4 -59.3 -39.3 11.3 51.3 32.3 74 75 A E T 3 S+ 0 0 143 -3,-0.1 2,-0.3 -37,-0.1 -37,-0.1 0.283 89.7 122.0 -88.5 12.1 10.5 52.7 35.7 75 76 A G < - 0 0 12 -3,-2.1 -36,-0.4 -39,-0.1 3,-0.1 -0.581 51.4-145.0 -85.1 133.7 8.8 55.9 34.2 76 77 A A > - 0 0 71 -2,-0.3 3,-2.1 1,-0.2 -39,-0.2 -0.290 51.5 -58.9 -73.6 170.7 5.3 57.0 34.8 77 78 A R T 3 S+ 0 0 171 1,-0.3 -68,-0.2 -38,-0.1 -1,-0.2 -0.237 129.1 15.3 -46.4 138.4 3.2 58.7 32.2 78 79 A G T 3 S+ 0 0 3 1,-0.2 -1,-0.3 -70,-0.1 2,-0.2 0.259 95.6 136.2 76.8 -12.7 4.9 62.0 31.1 79 80 A A < - 0 0 11 -3,-2.1 -42,-1.7 -71,-0.2 2,-0.3 -0.489 29.7-176.9 -78.0 137.6 8.2 60.9 32.7 80 81 A L E -bD 10 36A 0 -71,-1.9 -69,-1.8 -2,-0.2 2,-0.5 -0.932 20.9-149.0-127.8 150.8 11.5 61.4 30.8 81 82 A D E -bD 11 35A 14 -46,-2.4 -46,-2.4 -2,-0.3 -69,-0.2 -0.876 29.4-163.4-123.7 97.8 15.1 60.5 31.7 82 83 A L E -bD 12 34A 0 -71,-2.1 -69,-2.2 -2,-0.5 -48,-0.2 -0.335 21.7-108.5 -84.7 156.0 17.4 63.1 30.1 83 84 A S >> - 0 0 1 -50,-2.2 4,-2.7 -71,-0.2 3,-1.0 -0.480 37.5-111.2 -72.2 154.6 21.1 63.2 29.4 84 85 A P H 3> S+ 0 0 40 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.878 116.8 57.6 -57.7 -41.8 23.1 65.6 31.7 85 86 A N H 34 S+ 0 0 41 1,-0.2 4,-0.1 2,-0.2 -53,-0.1 0.709 114.1 40.1 -63.9 -20.8 23.9 68.0 28.8 86 87 A A H X> S+ 0 0 0 -3,-1.0 3,-1.3 -53,-0.2 4,-0.8 0.879 113.5 51.9 -87.2 -49.7 20.1 68.4 28.2 87 88 A F H >X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.3 3,-1.1 0.886 104.7 56.4 -54.5 -44.1 19.0 68.5 31.9 88 89 A R H 3< S+ 0 0 151 -4,-2.5 -1,-0.3 1,-0.3 -3,-0.1 0.689 102.0 58.4 -67.8 -16.8 21.4 71.2 32.9 89 90 A K H <4 S+ 0 0 118 -3,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.758 119.0 27.1 -78.8 -25.8 19.9 73.5 30.1 90 91 A I H << S+ 0 0 0 -3,-1.1 -29,-3.5 -4,-0.8 -28,-0.7 0.498 129.1 9.8-117.1 -7.1 16.4 73.3 31.6 91 92 A G S < S- 0 0 5 -4,-1.9 2,-0.5 -31,-0.2 -1,-0.1 -0.952 81.3 -79.7-159.9 178.7 17.1 72.7 35.3 92 93 A N > - 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