==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 25-DEC-08 3FNK . COMPND 2 MOLECULE: CELLULOSOMAL SCAFFOLDIN ADAPTOR PROTEIN B; . SOURCE 2 ORGANISM_SCIENTIFIC: ACETIVIBRIO CELLULOLYTICUS; . AUTHOR I.NOACH,F.FROLOW,E.A.BAYER . 517 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24314.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 318 61.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 174 33.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 37 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 0 0 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 RESIDUES PER ALPHA HELIX . 0 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 13 7 0 5 4 3 3 3 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 0 0 0 0 4 2 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 3 A N 0 0 189 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 95.1 23.4 67.1 -17.9 2 4 A L - 0 0 138 1,-0.1 2,-0.1 2,-0.0 0, 0.0 -0.765 360.0-106.1-118.9 168.1 21.4 64.8 -15.5 3 5 A D S S+ 0 0 53 -2,-0.3 -1,-0.1 1,-0.1 0, 0.0 -0.325 70.1 103.0 -93.2 177.0 22.3 61.7 -13.4 4 6 A M + 0 0 188 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.580 67.4 155.0 106.8 49.5 21.5 57.9 -13.8 5 7 A I - 0 0 58 2,-0.1 -1,-0.1 1,-0.1 -2,-0.1 -0.733 56.1-144.3-131.4 144.0 25.1 57.4 -14.9 6 8 A K S S+ 0 0 182 -2,-0.3 -1,-0.1 2,-0.1 2,-0.0 0.737 72.6 92.3 -85.9 -22.2 27.9 54.7 -15.1 7 9 A A S S- 0 0 44 1,-0.1 2,-0.4 155,-0.0 -2,-0.1 -0.321 81.2-110.1 -73.6 151.5 31.0 56.9 -14.4 8 10 A S + 0 0 34 153,-0.3 155,-2.3 25,-0.1 2,-0.3 -0.678 54.6 146.3 -79.3 133.8 32.3 57.4 -10.8 9 11 A Y E -Ab 32 163A 17 23,-1.8 23,-2.5 -2,-0.4 2,-0.4 -0.972 44.6-135.5-153.6 172.5 31.8 60.9 -9.4 10 12 A I E +Ab 31 164A 0 153,-2.1 155,-2.4 -2,-0.3 2,-0.3 -0.994 38.8 158.9-125.6 137.4 31.1 63.2 -6.5 11 13 A T E -Ab 30 165A 5 19,-3.1 19,-2.5 -2,-0.4 2,-0.4 -0.897 38.2-121.1-144.0 175.4 28.7 65.9 -7.0 12 14 A M E -A 29 0A 6 153,-0.8 2,-0.3 -2,-0.3 17,-0.2 -0.999 26.2-168.3-115.9 127.5 26.3 68.5 -5.4 13 15 A G E -A 28 0A 19 15,-2.4 15,-2.8 -2,-0.4 2,-0.3 -0.893 10.1-143.1-109.5 146.8 22.5 68.4 -6.2 14 16 A Y E -A 27 0A 45 -2,-0.3 13,-0.2 13,-0.2 3,-0.1 -0.829 15.2-142.2-101.5 144.3 19.9 71.2 -5.3 15 17 A D S S+ 0 0 84 11,-1.5 2,-0.3 -2,-0.3 -1,-0.1 0.734 95.4 13.2 -74.3 -17.5 16.4 70.5 -4.3 16 18 A K - 0 0 68 10,-0.2 -1,-0.3 1,-0.1 3,-0.1 -0.974 55.9-152.4-155.6 150.6 15.7 73.7 -6.4 17 19 A N S S+ 0 0 121 -2,-0.3 154,-3.5 -3,-0.1 2,-0.4 0.603 85.9 43.0 -90.2 -21.0 17.6 75.9 -9.0 18 20 A A + 0 0 53 152,-0.2 2,-0.3 153,-0.1 -1,-0.1 -0.990 61.8 159.2-135.9 140.3 15.6 79.1 -8.1 19 21 A A - 0 0 3 -2,-0.4 3,-0.1 4,-0.1 2,-0.1 -0.990 34.2-109.3-159.4 152.7 14.5 80.8 -4.9 20 22 A E > - 0 0 108 -2,-0.3 3,-2.6 1,-0.2 105,-0.4 -0.377 54.9 -77.4 -76.6 156.1 13.4 84.1 -3.4 21 23 A V T 3 S+ 0 0 89 1,-0.3 105,-0.2 105,-0.1 -1,-0.2 -0.310 124.6 24.7 -49.2 131.3 15.4 86.2 -0.9 22 24 A G T 3 S+ 0 0 42 103,-4.3 -1,-0.3 1,-0.3 2,-0.2 0.154 96.1 117.1 94.0 -18.7 15.0 84.5 2.4 23 25 A E < - 0 0 80 -3,-2.6 102,-3.2 102,-0.1 2,-0.4 -0.534 59.6-130.2 -79.3 151.8 14.2 81.0 1.0 24 26 A I E - C 0 124A 43 100,-0.3 2,-0.5 -2,-0.2 100,-0.3 -0.888 13.6-163.0-107.4 130.4 16.6 78.0 1.6 25 27 A I E - C 0 123A 0 98,-2.8 98,-2.4 -2,-0.4 2,-0.6 -0.941 18.9-136.8-102.5 129.5 17.9 75.7 -1.0 26 28 A K E - C 0 122A 66 -2,-0.5 -11,-1.5 96,-0.2 2,-0.5 -0.826 14.2-159.8 -90.1 123.3 19.3 72.4 0.2 27 29 A A E -AC 14 121A 2 94,-2.7 94,-2.7 -2,-0.6 2,-0.5 -0.899 6.8-160.3-101.6 124.0 22.6 71.3 -1.4 28 30 A T E -AC 13 120A 29 -15,-2.8 -15,-2.4 -2,-0.5 2,-0.4 -0.944 8.7-148.9-113.0 122.9 23.4 67.6 -1.1 29 31 A V E +AC 12 119A 2 90,-3.3 89,-3.2 -2,-0.5 90,-1.3 -0.788 33.9 164.6 -87.8 132.7 26.9 66.2 -1.6 30 32 A K E -AC 11 117A 63 -19,-2.5 -19,-3.1 -2,-0.4 2,-0.3 -0.984 23.6-145.2-154.1 156.6 26.6 62.7 -3.0 31 33 A I E -AC 10 116A 5 85,-2.8 85,-2.0 -2,-0.3 2,-0.4 -0.849 1.9-150.3-131.0 161.1 28.8 60.1 -4.7 32 34 A N E S-A 9 0A 21 -23,-2.5 -23,-1.8 -2,-0.3 83,-0.2 -0.989 72.5 -19.9-138.0 121.4 28.5 57.4 -7.3 33 35 A K + 0 0 88 -2,-0.4 2,-0.7 -25,-0.2 82,-0.2 0.857 69.4 167.3 51.4 55.1 30.5 54.2 -7.5 34 36 A I > - 0 0 4 80,-2.4 3,-1.4 -26,-0.1 -1,-0.2 -0.885 40.5-118.7 -97.1 116.0 33.4 55.1 -5.3 35 37 A T T 3 S- 0 0 92 -2,-0.7 78,-0.1 1,-0.3 79,-0.0 -0.344 82.8 -18.0 -65.1 122.0 35.2 51.8 -4.6 36 38 A N T 3 S- 0 0 32 -2,-0.2 117,-1.6 1,-0.2 -1,-0.3 0.792 88.2-167.6 56.2 33.7 35.4 50.9 -0.9 37 39 A F E < +G 152 0B 0 -3,-1.4 76,-0.6 115,-0.2 115,-0.3 -0.188 23.4 163.8 -57.4 136.2 34.6 54.5 0.1 38 40 A S E - 0 0 3 113,-3.1 62,-2.6 1,-0.4 2,-0.3 0.419 57.4 -11.5-134.2 0.3 35.1 55.3 3.8 39 41 A G E -GH 151 99B 0 112,-0.9 112,-2.3 60,-0.2 -1,-0.4 -0.908 51.7-142.9 170.6 162.5 35.2 59.1 4.2 40 42 A Y E -GH 150 98B 2 58,-2.4 58,-1.9 -2,-0.3 2,-0.4 -0.979 7.3-164.2-141.2 150.8 35.4 62.5 2.5 41 43 A Q E +GH 149 97B 45 108,-2.6 108,-2.8 -2,-0.3 2,-0.4 -0.987 22.3 178.3-127.6 133.0 36.8 65.9 2.8 42 44 A V E -GH 148 96B 0 54,-2.4 54,-1.9 -2,-0.4 2,-0.5 -0.997 20.8-152.1-135.4 145.1 35.3 68.7 0.6 43 45 A N E - H 0 95B 7 104,-2.6 93,-2.1 -2,-0.4 2,-0.4 -0.953 19.1-165.1-115.9 123.0 36.0 72.4 0.2 44 46 A I E -IH 135 94B 1 50,-3.3 50,-2.4 -2,-0.5 2,-0.4 -0.916 5.6-158.9-118.7 133.2 33.0 74.4 -1.0 45 47 A K E +IH 134 93B 54 89,-3.3 89,-2.1 -2,-0.4 2,-0.3 -0.942 20.8 158.7-114.6 131.5 33.0 78.0 -2.3 46 48 A Y - 0 0 4 46,-2.4 87,-0.1 -2,-0.4 3,-0.1 -0.931 47.7 -97.4-144.0 169.3 30.0 80.3 -2.4 47 49 A D >> - 0 0 57 -2,-0.3 4,-4.3 1,-0.2 3,-1.1 -0.808 30.5-171.3 -93.8 102.4 29.1 84.0 -2.6 48 50 A P T 34 S+ 0 0 35 0, 0.0 -1,-0.2 0, 0.0 43,-0.1 0.834 86.3 58.0 -66.2 -33.4 28.5 85.0 1.1 49 51 A T T 34 S+ 0 0 88 1,-0.2 3,-0.1 -3,-0.1 -2,-0.1 0.744 122.9 27.3 -62.2 -23.3 27.1 88.5 -0.1 50 52 A V T <4 S+ 0 0 2 -3,-1.1 76,-2.8 1,-0.3 77,-1.0 0.707 127.5 34.6-111.9 -36.6 24.5 86.5 -2.1 51 53 A L E < -D 125 0A 1 -4,-4.3 2,-0.5 74,-0.2 -1,-0.3 -0.974 63.6-152.3-125.0 144.1 24.1 83.1 -0.3 52 54 A Q E -D 124 0A 68 72,-2.3 72,-2.8 -2,-0.4 2,-0.4 -0.964 19.6-128.8-116.1 121.5 24.1 82.3 3.5 53 55 A A E +D 123 0A 1 -2,-0.5 9,-2.8 70,-0.2 2,-0.3 -0.514 44.0 159.0 -67.0 120.9 25.2 78.9 4.8 54 56 A V E -DE 122 61A 0 68,-1.8 68,-2.1 -2,-0.4 7,-0.3 -0.885 51.6 -80.3-134.9 165.5 22.5 77.7 7.2 55 57 A N > - 0 0 33 5,-3.0 4,-1.5 -2,-0.3 3,-0.2 -0.586 41.6-141.9 -63.0 130.8 21.3 74.4 8.7 56 58 A P T 4 S+ 0 0 6 0, 0.0 -1,-0.1 0, 0.0 65,-0.1 0.771 95.4 39.2 -72.5 -30.0 19.0 73.0 5.9 57 59 A K T 4 S+ 0 0 162 3,-0.1 -2,-0.0 65,-0.1 -31,-0.0 0.503 130.8 24.7-101.5 -3.4 16.3 71.6 8.2 58 60 A T T 4 S- 0 0 93 -3,-0.2 -1,-0.0 2,-0.1 0, 0.0 0.639 90.4-130.5-121.4 -41.2 16.2 74.5 10.8 59 61 A G < + 0 0 18 -4,-1.5 2,-0.2 1,-0.3 3,-0.1 0.331 53.0 147.1 105.5 -5.6 17.4 77.6 8.9 60 62 A V - 0 0 96 -6,-0.1 -5,-3.0 1,-0.1 -1,-0.3 -0.475 55.7-101.8 -74.0 132.6 19.9 78.6 11.6 61 63 A A B -E 54 0A 47 -7,-0.3 -7,-0.3 -2,-0.2 2,-0.2 -0.155 34.2-120.2 -50.0 133.8 23.1 80.3 10.4 62 64 A Y - 0 0 14 -9,-2.8 2,-0.2 60,-0.1 -1,-0.1 -0.547 24.0-153.0 -70.0 146.1 26.2 78.1 10.2 63 65 A T > - 0 0 77 -2,-0.2 3,-1.5 4,-0.0 24,-0.1 -0.533 42.3 -84.6-101.7-179.7 29.3 79.3 12.3 64 66 A N T 3 S+ 0 0 83 1,-0.3 23,-2.4 -2,-0.2 -2,-0.0 0.488 131.1 39.2 -67.7 2.0 32.9 78.5 11.4 65 67 A S T 3 S+ 0 0 77 21,-0.2 20,-0.5 2,-0.1 -1,-0.3 0.311 81.7 139.2-130.9 5.7 32.5 75.1 13.2 66 68 A S < - 0 0 25 -3,-1.5 -4,-0.1 18,-0.1 18,-0.1 -0.208 49.2-124.8 -59.2 141.0 28.9 74.0 12.2 67 69 A L - 0 0 66 1,-0.1 -1,-0.1 17,-0.1 2,-0.1 -0.639 20.3-116.7 -81.7 143.7 28.4 70.4 11.3 68 70 A P - 0 0 9 0, 0.0 2,-0.3 0, 0.0 53,-0.2 -0.412 36.4-104.1 -68.1 153.4 26.9 69.3 7.9 69 71 A T E -F 120 0A 29 51,-2.7 51,-2.8 1,-0.1 2,-0.0 -0.654 48.4-105.2 -77.4 142.3 23.6 67.4 8.2 70 72 A S E -F 119 0A 53 -2,-0.3 49,-0.3 49,-0.2 48,-0.1 -0.297 30.7-153.8 -72.8 153.0 24.2 63.7 7.6 71 73 A G - 0 0 16 47,-0.8 47,-0.2 2,-0.5 -1,-0.1 -0.052 42.5 -79.4 -99.4-156.5 23.4 61.6 4.5 72 74 A E S S+ 0 0 129 45,-0.5 3,-0.4 -2,-0.1 2,-0.2 0.692 109.9 65.4 -80.5 -26.6 22.6 58.0 3.9 73 75 A L S S+ 0 0 15 44,-2.4 -2,-0.5 1,-0.2 -35,-0.0 -0.658 94.3 27.1 -99.0 160.7 26.3 57.0 4.0 74 76 A L S S+ 0 0 0 -2,-0.2 -1,-0.2 -4,-0.1 25,-0.1 0.720 88.5 105.7 68.2 21.5 28.8 57.2 6.9 75 77 A V + 0 0 61 -3,-0.4 2,-0.8 5,-0.0 -2,-0.1 0.266 35.8 117.0-113.7 10.9 26.1 56.8 9.6 76 78 A S > - 0 0 37 1,-0.2 3,-1.8 2,-0.1 4,-0.2 -0.705 53.4-155.9 -80.5 114.8 26.7 53.2 10.7 77 79 A E G > S+ 0 0 140 -2,-0.8 3,-1.9 1,-0.3 -1,-0.2 0.833 85.9 69.3 -65.4 -33.2 27.6 53.6 14.4 78 80 A D G 3 S+ 0 0 115 1,-0.3 -1,-0.3 2,-0.1 27,-0.1 0.684 97.1 53.2 -49.5 -25.8 29.5 50.3 14.4 79 81 A Y G < S- 0 0 31 -3,-1.8 23,-2.6 26,-0.1 22,-1.6 0.386 110.8-121.2-101.2 4.3 32.2 51.8 12.2 80 82 A G < - 0 0 21 -3,-1.9 21,-0.9 20,-0.2 -3,-0.1 0.973 30.5-157.3 62.2 62.9 32.8 54.9 14.4 81 83 A P E -J 100 0B 17 0, 0.0 2,-0.4 0, 0.0 19,-0.2 -0.449 7.7-167.3 -70.0 139.9 32.1 57.9 12.2 82 84 A I E -J 99 0B 2 17,-2.4 17,-2.1 -2,-0.1 2,-0.4 -0.988 4.8-169.7-124.8 140.9 33.6 61.2 13.1 83 85 A V E +J 98 0B 6 -2,-0.4 2,-0.3 15,-0.2 15,-0.2 -0.985 7.6 172.9-132.7 143.0 32.5 64.5 11.5 84 86 A Q E -J 97 0B 34 13,-2.7 13,-2.5 -2,-0.4 2,-0.4 -0.992 16.9-155.8-148.2 145.3 33.9 68.1 11.6 85 87 A G E +J 96 0B 3 -20,-0.5 2,-0.4 -2,-0.3 11,-0.2 -0.994 10.5 177.2-121.3 127.0 33.3 71.5 9.9 86 88 A V + 0 0 86 9,-3.0 -21,-0.2 -2,-0.4 2,-0.1 -0.856 23.8 169.8-128.1 96.1 36.0 74.1 9.6 87 89 A H - 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