==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 31-JAN-08 2VN6 . COMPND 2 MOLECULE: SCAFFOLDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM CELLULOLYTICUM; . AUTHOR B.A.PINHEIRO,J.A.M.PRATES,M.R.PROCTOR,H.J.GILBERT, . 215 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10666.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 142 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 57 26.5 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 22 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 1 0 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 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 0 0 1 1 2 2 1 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 1 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 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 T 0 0 195 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 121.2 3.5 62.4 21.2 2 3 A V - 0 0 95 5,-0.0 0, 0.0 3,-0.0 0, 0.0 -0.940 360.0-149.8-130.3 154.8 5.8 59.9 19.6 3 4 A L >> - 0 0 110 -2,-0.3 3,-1.8 1,-0.0 4,-0.5 -0.661 40.2 -95.0-114.1 169.3 6.8 58.9 16.0 4 5 A P G >4 S+ 0 0 110 0, 0.0 3,-1.6 0, 0.0 -1,-0.0 0.868 121.9 62.7 -57.9 -33.8 8.0 55.5 14.7 5 6 A K G 34 S+ 0 0 170 1,-0.3 -3,-0.0 3,-0.0 0, 0.0 0.741 102.4 53.2 -59.2 -23.4 11.7 56.5 15.1 6 7 A D G <4 S+ 0 0 70 -3,-1.8 -1,-0.3 1,-0.2 -4,-0.0 0.575 107.2 53.5 -86.7 -13.9 11.0 56.7 18.8 7 8 A I << - 0 0 109 -3,-1.6 -1,-0.2 -4,-0.5 2,-0.1 -0.852 68.4-170.7-130.2 90.6 9.5 53.2 19.2 8 9 A P - 0 0 63 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.453 8.2-168.7 -74.1 158.6 11.5 50.3 17.9 9 10 A G S S+ 0 0 68 1,-0.4 2,-0.4 -2,-0.1 130,-0.0 0.672 77.1 36.0-101.6 -79.4 9.9 46.9 17.7 10 11 A D S S+ 0 0 103 28,-0.1 -1,-0.4 130,-0.0 2,-0.3 -0.598 77.9 150.9 -74.7 128.2 12.8 44.5 17.0 11 12 A S - 0 0 2 -2,-0.4 2,-0.4 -3,-0.1 129,-0.2 -0.985 49.0-113.3-155.7 147.8 16.0 45.5 18.8 12 13 A L E -a 140 0A 0 127,-2.3 129,-2.9 -2,-0.3 2,-0.6 -0.714 36.8-140.7 -74.9 129.5 19.2 43.9 20.2 13 14 A K E -aB 141 34A 55 21,-2.4 21,-2.2 -2,-0.4 2,-0.5 -0.861 21.6-179.3 -98.2 123.8 19.1 44.4 24.0 14 15 A V E -aB 142 33A 0 127,-2.8 129,-2.4 -2,-0.6 2,-0.5 -0.978 12.3-177.8-123.1 116.5 22.4 45.3 25.6 15 16 A T E -aB 143 32A 51 17,-2.5 17,-2.5 -2,-0.5 2,-0.5 -0.952 24.9-147.9-128.2 123.8 22.1 45.7 29.4 16 17 A V E - B 0 31A 3 127,-2.8 15,-0.2 -2,-0.5 105,-0.1 -0.769 30.9-144.4 -82.6 128.9 24.5 46.6 32.1 17 18 A G - 0 0 16 13,-2.9 129,-1.4 -2,-0.5 2,-0.3 0.145 9.1-111.0 -80.3-162.3 23.5 44.8 35.3 18 19 A T E +e 146 0B 100 127,-0.2 2,-0.3 10,-0.1 129,-0.2 -0.905 26.1 178.7-134.5 159.6 23.6 45.8 39.0 19 20 A A E -e 147 0B 14 127,-1.3 129,-2.4 -2,-0.3 2,-0.3 -0.978 6.5-162.7-154.7 159.8 25.5 44.8 42.1 20 21 A N E +e 148 0B 123 -2,-0.3 2,-0.3 127,-0.2 129,-0.2 -0.985 23.2 125.3-145.9 156.0 25.8 45.7 45.7 21 22 A G E -e 149 0B 12 127,-2.0 129,-2.7 -2,-0.3 3,-0.1 -0.966 50.1 -80.8 178.7-172.3 28.2 45.2 48.6 22 23 A K > - 0 0 126 -2,-0.3 3,-2.4 127,-0.2 88,-0.3 -0.728 64.0 -67.8-108.1 159.6 30.2 47.0 51.3 23 24 A P T 3 S+ 0 0 41 0, 0.0 88,-0.2 0, 0.0 -1,-0.1 -0.184 123.7 28.0 -45.7 131.6 33.6 48.7 50.9 24 25 A G T 3 S+ 0 0 44 86,-3.2 87,-0.1 1,-0.4 2,-0.1 0.138 92.4 120.8 98.8 -19.1 36.3 46.1 50.2 25 26 A D < - 0 0 54 -3,-2.4 85,-3.0 86,-0.1 2,-0.5 -0.378 57.2-138.7 -67.6 151.7 34.0 43.6 48.5 26 27 A T E - C 0 109A 80 83,-0.2 2,-0.3 -3,-0.1 83,-0.2 -0.988 27.7-177.8-109.8 126.6 34.6 42.5 44.9 27 28 A V E - C 0 108A 17 81,-2.8 81,-2.5 -2,-0.5 2,-0.4 -0.831 22.0-127.0-120.9 160.7 31.3 42.3 42.9 28 29 A T E - C 0 107A 64 -2,-0.3 79,-0.2 79,-0.2 -10,-0.1 -0.921 15.1-167.9-110.1 131.3 30.5 41.2 39.4 29 30 A V E - C 0 106A 0 77,-3.1 77,-2.7 -2,-0.4 2,-0.1 -0.974 16.4-151.7-117.2 113.5 28.5 43.4 37.0 30 31 A P E - C 0 105A 30 0, 0.0 -13,-2.9 0, 0.0 2,-0.5 -0.474 10.6-147.6 -81.9 153.5 27.4 41.5 33.8 31 32 A V E -BC 16 104A 0 73,-2.6 72,-2.7 -15,-0.2 73,-1.6 -0.994 29.2-164.1-114.4 117.7 26.8 43.0 30.4 32 33 A T E -BC 15 102A 47 -17,-2.5 -17,-2.5 -2,-0.5 2,-0.4 -0.827 13.7-152.1-113.8 138.0 23.9 40.9 28.9 33 34 A F E -BC 14 101A 1 68,-3.0 68,-2.1 -2,-0.4 2,-0.3 -0.890 16.2-179.2-103.4 140.3 22.7 40.5 25.3 34 35 A A E +B 13 0A 31 -21,-2.2 -21,-2.4 -2,-0.4 65,-0.0 -0.960 60.7 28.7-135.3 158.7 19.1 39.6 24.5 35 36 A D S > S+ 0 0 42 -2,-0.3 4,-1.7 -23,-0.2 6,-0.1 0.759 70.6 147.6 64.3 31.6 17.2 39.0 21.2 36 37 A V T 4> + 0 0 0 2,-0.2 5,-2.4 1,-0.2 3,-0.2 0.945 69.8 42.7 -61.7 -52.2 20.4 37.8 19.5 37 38 A A T >45S+ 0 0 64 1,-0.2 3,-1.9 3,-0.2 -1,-0.2 0.911 110.9 56.7 -64.5 -40.4 18.8 35.3 17.1 38 39 A K T 345S+ 0 0 105 1,-0.3 -1,-0.2 2,-0.1 -2,-0.2 0.868 107.1 49.6 -53.1 -42.1 15.9 37.7 16.3 39 40 A M T 3<5S- 0 0 23 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.221 126.1-101.6 -87.7 12.0 18.4 40.3 15.2 40 41 A K T < 5 - 0 0 147 -3,-1.9 92,-2.5 91,-0.1 -3,-0.2 0.822 68.3 -70.5 73.1 36.7 20.2 37.7 13.0 41 42 A N < - 0 0 45 -5,-2.4 2,-0.5 90,-0.2 91,-0.4 0.146 54.9 -88.1 71.5 169.1 23.2 37.1 15.4 42 43 A V B +G 97 0C 0 55,-2.3 55,-2.7 89,-0.2 89,-0.3 -0.977 40.7 166.5-117.8 121.3 26.1 39.3 16.4 43 44 A G + 0 0 0 87,-2.1 46,-2.2 -2,-0.5 2,-0.3 0.671 69.0 1.0-102.7 -25.8 29.2 39.2 14.3 44 45 A T E +HI 88 130D 0 86,-1.5 86,-3.4 44,-0.2 -1,-0.3 -0.974 61.1 164.1-159.2 147.3 31.0 42.3 15.6 45 46 A C E -HI 87 129D 0 42,-2.5 42,-2.9 -2,-0.3 2,-0.3 -0.975 11.6-172.2-158.4 156.5 30.6 45.1 18.1 46 47 A N E +HI 86 128D 2 82,-2.3 82,-2.2 -2,-0.3 2,-0.3 -0.967 21.5 147.1-146.3 139.2 32.5 47.8 20.0 47 48 A F E -H 85 0D 2 38,-1.6 38,-2.5 -2,-0.3 2,-0.4 -0.952 31.1-128.3-159.4 175.7 31.2 50.1 22.8 48 49 A Y E -HI 84 124D 5 76,-0.6 76,-2.3 78,-0.4 2,-0.4 -0.993 9.3-158.2-139.8 137.6 32.3 51.9 25.9 49 50 A L E -HI 83 123D 0 34,-2.5 34,-3.0 -2,-0.4 2,-0.3 -0.967 11.7-145.9-118.1 136.4 31.1 52.1 29.6 50 51 A G E +HI 82 122D 6 72,-3.3 72,-2.0 -2,-0.4 2,-0.3 -0.772 21.7 171.0 -98.9 142.8 31.8 54.9 32.0 51 52 A Y - 0 0 35 30,-2.1 2,-0.9 -2,-0.3 70,-0.1 -0.955 40.4-101.7-143.6 164.6 32.2 54.4 35.7 52 53 A D >> - 0 0 64 68,-0.3 4,-2.0 -2,-0.3 3,-1.9 -0.777 27.5-168.6 -91.9 102.6 33.3 56.4 38.8 53 54 A A T 34 S+ 0 0 46 -2,-0.9 -1,-0.1 1,-0.3 28,-0.1 0.619 83.6 66.2 -70.8 -13.1 36.9 55.4 39.5 54 55 A S T 34 S+ 0 0 73 1,-0.1 -1,-0.3 57,-0.0 3,-0.1 0.635 115.9 28.7 -77.4 -14.6 36.8 57.2 42.9 55 56 A L T <4 S+ 0 0 28 -3,-1.9 56,-2.4 1,-0.2 2,-0.4 0.618 123.4 41.8-116.8 -26.0 34.2 54.6 44.0 56 57 A L E < -D 110 0A 1 -4,-2.0 2,-0.5 54,-0.2 -1,-0.2 -0.984 58.3-155.2-130.6 139.9 35.1 51.5 42.0 57 58 A E E -D 109 0A 98 52,-2.4 52,-2.8 -2,-0.4 2,-0.6 -0.961 23.2-130.8-107.8 126.6 38.3 49.7 41.0 58 59 A V E +D 108 0A 31 -2,-0.5 50,-0.2 50,-0.2 3,-0.1 -0.687 30.1 173.2 -75.7 119.7 38.2 47.6 37.9 59 60 A V E - 0 0 73 48,-2.9 2,-0.3 -2,-0.6 -1,-0.2 0.824 63.1 -19.3 -93.5 -44.7 39.8 44.2 38.9 60 61 A S E -D 107 0A 31 47,-1.2 47,-3.0 2,-0.0 2,-0.4 -0.982 45.7-152.4-160.1 155.8 39.1 42.3 35.7 61 62 A V E +D 106 0A 20 -2,-0.3 2,-0.3 45,-0.2 45,-0.2 -0.986 26.9 176.0-131.7 122.3 36.9 42.3 32.6 62 63 A D E -D 105 0A 84 43,-2.3 43,-2.8 -2,-0.4 13,-0.1 -0.945 33.3-103.9-126.6 149.8 36.3 38.9 31.0 63 64 A A E -D 104 0A 31 -2,-0.3 41,-0.3 41,-0.2 40,-0.1 -0.351 38.6-125.6 -63.9 149.8 34.2 37.6 28.1 64 65 A G > - 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0 0 113 -9,-0.1 2,-0.5 -10,-0.1 -2,-0.4 -0.964 65.0-143.5-134.9 153.2 33.3 56.8 11.7 196 45 B V + 0 0 5 -2,-0.3 2,-0.2 -14,-0.1 -7,-0.1 -0.974 54.1 116.3-112.8 112.0 36.2 54.4 12.5 197 46 B N S >> S- 0 0 11 -2,-0.5 4,-1.6 -9,-0.2 3,-1.1 -0.793 77.7 -50.7-156.6-167.0 34.7 51.4 14.4 198 47 B A H 3> S+ 0 0 0 1,-0.3 4,-2.4 -2,-0.2 5,-0.2 0.784 122.9 62.5 -54.7 -31.2 34.1 47.7 14.4 199 48 B F H 3> S+ 0 0 18 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.901 105.3 47.2 -61.0 -39.4 32.4 47.8 10.9 200 49 B D H <> S+ 0 0 1 -3,-1.1 4,-2.4 1,-0.2 -1,-0.2 0.900 111.1 51.8 -66.6 -41.5 35.7 49.0 9.4 201 50 B L H X S+ 0 0 1 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.891 108.9 50.3 -59.6 -42.0 37.6 46.3 11.3 202 51 B A H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.900 110.3 48.9 -67.7 -40.7 35.3 43.6 10.0 203 52 B I H X S+ 0 0 34 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.924 110.7 51.3 -64.8 -44.1 35.7 44.7 6.4 204 53 B L H X S+ 0 0 2 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.926 110.8 48.2 -58.0 -44.5 39.5 44.8 6.8 205 54 B K H X S+ 0 0 42 -4,-2.3 4,-2.2 1,-0.2 6,-0.2 0.925 109.8 52.1 -64.8 -42.4 39.5 41.2 8.2 206 55 B K H <>S+ 0 0 56 -4,-2.4 5,-2.7 1,-0.2 6,-0.9 0.903 111.2 48.6 -56.8 -41.5 37.3 40.0 5.3 207 56 B Y H ><5S+ 0 0 88 -4,-2.3 3,-1.2 4,-0.2 -2,-0.2 0.928 110.4 49.1 -66.0 -45.6 39.7 41.5 2.9 208 57 B L H 3<5S+ 0 0 56 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.842 111.2 51.6 -63.2 -30.6 42.8 39.9 4.5 209 58 B L T 3<5S- 0 0 78 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.507 115.8-115.5 -81.7 -8.1 40.9 36.5 4.5 210 59 B G T < 5S+ 0 0 65 -3,-1.2 -3,-0.2 -4,-0.4 -2,-0.1 0.643 82.4 122.2 79.0 18.4 40.2 36.8 0.8 211 60 B M S