==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOTIN-BINDING PROTEIN 19-JUL-11 3SZJ . COMPND 2 MOLECULE: AVIDIN/STREPTAVIDIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SHEWANELLA DENITRIFICANS; . AUTHOR O.LIVNAH,A.MEIR . 239 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9969.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 167 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 127 53.1 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 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 2.5 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 . 20 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 6.3 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+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 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 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 2 2 0 4 2 4 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 0 140 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 92.7 27.5 17.1 15.4 2 3 A M - 0 0 127 1,-0.1 88,-0.1 85,-0.0 83,-0.0 -0.653 360.0 -81.9 -88.3 154.6 26.5 13.4 15.1 3 4 A A - 0 0 11 -2,-0.3 2,-0.2 86,-0.2 86,-0.2 -0.073 33.3-115.6 -58.4 141.5 23.1 12.3 13.8 4 5 A Q - 0 0 47 84,-0.2 2,-0.2 86,-0.1 114,-0.1 -0.585 43.1-160.2 -63.0 140.0 19.8 12.2 15.7 5 6 A E - 0 0 106 -2,-0.2 2,-1.8 85,-0.1 85,-0.1 -0.527 36.6 -66.3-117.0-174.7 18.9 8.4 15.7 6 7 A L S S+ 0 0 25 -2,-0.2 2,-0.3 51,-0.1 51,-0.1 -0.598 83.1 138.7 -79.1 83.8 15.7 6.5 16.3 7 8 A T - 0 0 67 -2,-1.8 3,-0.3 15,-0.1 15,-0.1 -0.824 60.8 -85.8-125.7 162.2 15.2 7.5 19.9 8 9 A A S S+ 0 0 46 -2,-0.3 15,-0.2 1,-0.2 16,-0.2 -0.372 111.3 27.7 -63.5 149.5 12.4 8.5 22.1 9 10 A M S S+ 0 0 140 13,-1.1 2,-0.4 1,-0.2 -1,-0.2 0.967 87.9 138.3 51.9 62.0 11.6 12.3 22.0 10 11 A S E -A 22 0A 5 12,-1.6 12,-3.0 -3,-0.3 2,-0.3 -0.987 38.9-150.0-130.4 143.0 12.9 12.9 18.5 11 12 A A E -A 21 0A 13 108,-0.5 108,-1.9 -2,-0.4 2,-0.3 -0.907 11.9-174.5-116.6 147.6 11.2 15.0 15.8 12 13 A W E -AB 20 118A 0 8,-2.1 8,-2.8 -2,-0.3 2,-0.4 -0.998 8.3-157.6-145.9 135.5 11.3 14.6 12.0 13 14 A V E -AB 19 117A 42 104,-2.6 104,-2.7 -2,-0.3 6,-0.2 -0.956 11.7-147.9-122.9 133.4 10.0 16.7 9.1 14 15 A N E > - B 0 116A 11 4,-2.4 3,-1.9 -2,-0.4 102,-0.2 -0.274 37.7 -88.7 -94.1-176.7 9.2 15.5 5.6 15 16 A Q T 3 S+ 0 0 98 100,-0.6 101,-0.1 1,-0.3 -1,-0.1 0.623 126.8 51.6 -68.6 -14.4 9.4 17.1 2.2 16 17 A D T 3 S- 0 0 76 2,-0.1 -1,-0.3 23,-0.0 24,-0.1 0.392 121.2-104.7 -98.8 1.3 5.9 18.5 2.6 17 18 A G S < S+ 0 0 26 -3,-1.9 2,-0.2 1,-0.3 -2,-0.1 0.495 71.4 145.3 89.6 3.3 6.6 20.0 6.0 18 19 A S - 0 0 1 19,-0.1 -4,-2.4 1,-0.0 2,-0.5 -0.489 38.6-139.7 -76.2 147.3 4.7 17.4 8.0 19 20 A T E -AC 13 36A 12 17,-2.3 17,-2.7 -6,-0.2 2,-0.5 -0.926 12.2-162.0-117.1 130.9 6.2 16.5 11.4 20 21 A L E -AC 12 35A 0 -8,-2.8 -8,-2.1 -2,-0.5 2,-0.6 -0.948 8.8-163.9-100.7 125.2 6.5 13.2 13.2 21 22 A Y E -AC 11 34A 90 13,-3.1 13,-2.0 -2,-0.5 2,-0.8 -0.946 5.0-157.8-107.2 112.5 7.1 13.4 16.9 22 23 A I E +AC 10 33A 1 -12,-3.0 -12,-1.6 -2,-0.6 -13,-1.1 -0.835 18.0 173.0 -87.2 111.9 8.3 10.1 18.4 23 24 A N E + 0 0 68 9,-1.9 2,-0.3 -2,-0.8 10,-0.2 0.827 57.6 10.5 -89.2 -38.4 7.4 10.4 22.0 24 25 A S E - C 0 32A 45 8,-1.9 8,-1.9 -16,-0.2 2,-0.3 -0.996 45.9-179.0-143.4 144.3 8.2 7.0 23.5 25 26 A I E - C 0 31A 41 -2,-0.3 6,-0.2 6,-0.2 -17,-0.2 -0.925 24.3-151.6-135.9 119.2 10.1 3.8 22.4 26 27 A N > - 0 0 68 4,-2.1 3,-2.0 -2,-0.3 -2,-0.0 -0.241 36.5 -89.6 -83.9 178.0 10.0 1.1 25.0 27 28 A A T 3 S+ 0 0 100 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 0.671 128.5 53.0 -65.8 -14.6 12.7 -1.6 25.5 28 29 A Q T 3 S- 0 0 124 2,-0.1 -1,-0.3 28,-0.0 27,-0.1 0.461 121.0-107.6 -93.6 -4.2 10.8 -3.9 23.1 29 30 A G < + 0 0 7 -3,-2.0 26,-2.2 1,-0.3 2,-0.4 0.578 65.6 151.9 89.7 9.9 10.8 -1.2 20.4 30 31 A E E - D 0 54A 60 24,-0.2 -4,-2.1 22,-0.0 2,-0.3 -0.633 30.9-153.5 -73.8 132.5 7.1 -0.3 20.6 31 32 A L E -CD 25 53A 0 22,-2.3 22,-1.3 -2,-0.4 2,-0.3 -0.788 19.7-179.8-111.9 145.1 6.6 3.4 19.6 32 33 A T E +CD 24 52A 59 -8,-1.9 -8,-1.9 -2,-0.3 -9,-1.9 -0.970 24.0 123.0-132.2 154.6 4.1 6.1 20.4 33 34 A G E -CD 22 51A 9 18,-1.8 18,-2.3 -2,-0.3 2,-0.3 -0.931 46.9 -95.4-173.5-160.4 4.0 9.7 19.1 34 35 A S E -CD 21 50A 25 -13,-2.0 -13,-3.1 -2,-0.3 2,-0.4 -0.953 23.0-151.1-141.6 160.3 2.0 12.3 17.3 35 36 A Y E -CD 20 49A 3 14,-2.1 14,-2.3 -2,-0.3 2,-0.5 -0.998 4.3-161.4-137.4 137.5 1.9 13.6 13.7 36 37 A I E -CD 19 48A 25 -17,-2.7 -17,-2.3 -2,-0.4 2,-0.4 -0.977 17.3-148.8-120.7 117.0 1.1 16.9 12.1 37 38 A N B +i 45 0B 14 7,-0.6 9,-2.3 10,-0.5 10,-0.2 -0.696 27.8 162.5 -85.5 134.4 0.2 16.9 8.4 38 39 A R + 0 0 90 -2,-0.4 2,-0.5 7,-0.2 -1,-0.1 0.108 30.6 131.9-131.9 17.9 1.1 19.9 6.3 39 40 A A > - 0 0 9 4,-0.1 3,-1.2 1,-0.1 -22,-0.1 -0.638 57.2-124.4 -81.6 124.2 0.8 18.3 2.8 40 41 A A T 3 S+ 0 0 83 -2,-0.5 3,-0.1 1,-0.2 -2,-0.1 -0.355 96.4 39.1 -58.7 140.5 -1.1 20.2 0.2 41 42 A G T 3 S+ 0 0 79 1,-0.3 2,-0.3 -2,-0.0 -1,-0.2 0.466 102.2 87.1 93.8 2.8 -3.9 18.0 -1.3 42 43 A F < - 0 0 84 -3,-1.2 -1,-0.3 1,-0.0 3,-0.1 -0.978 65.4-141.4-130.9 145.2 -4.8 16.4 2.0 43 44 A A S S+ 0 0 59 -2,-0.3 -4,-0.1 1,-0.1 30,-0.1 -0.037 75.7 68.0 -84.7-165.9 -7.2 17.5 4.7 44 45 A a S S+ 0 0 2 1,-0.2 -7,-0.6 28,-0.1 3,-0.3 0.907 73.2 160.6 53.8 48.0 -6.5 17.0 8.5 45 46 A Q B +i 37 0B 64 1,-0.2 -7,-0.2 -9,-0.1 -1,-0.2 -0.654 45.9 15.9 -96.4 152.9 -3.7 19.6 8.4 46 47 A N S S+ 0 0 112 -9,-2.3 -1,-0.2 -2,-0.3 -8,-0.1 0.705 99.2 90.8 65.1 27.1 -2.2 21.6 11.3 47 48 A S S S- 0 0 8 -3,-0.3 -10,-0.5 -10,-0.2 2,-0.3 -0.984 79.4 -99.6-144.9 152.4 -3.4 19.6 14.2 48 49 A P E -D 36 0A 76 0, 0.0 -12,-0.2 0, 0.0 -3,-0.0 -0.567 32.9-170.1 -81.6 134.7 -1.8 16.6 16.1 49 50 A Y E -D 35 0A 2 -14,-2.3 -14,-2.1 -2,-0.3 2,-0.1 -0.885 29.4-101.4-117.7 149.3 -2.9 13.0 15.4 50 51 A P E -D 34 0A 35 0, 0.0 15,-1.2 0, 0.0 2,-0.4 -0.446 35.2-162.8 -78.9 146.3 -1.9 9.9 17.4 51 52 A V E +DE 33 64A 4 -18,-2.3 -18,-1.8 13,-0.2 2,-0.3 -0.964 13.0 173.3-127.5 139.2 0.8 7.5 16.3 52 53 A N E +DE 32 63A 1 11,-2.0 11,-2.5 -2,-0.4 2,-0.3 -0.875 22.0 116.1-131.6 171.5 1.8 4.0 17.2 53 54 A G E -DE 31 62A 1 -22,-1.3 -22,-2.3 -2,-0.3 2,-0.3 -0.993 47.6 -81.6 167.2-158.9 4.4 1.6 15.6 54 55 A W E -DE 30 61A 10 7,-1.9 7,-2.7 -2,-0.3 2,-0.4 -0.989 16.5-155.6-144.3 144.9 7.6 -0.4 16.0 55 56 A V E + E 0 60A 13 -26,-2.2 2,-0.3 -2,-0.3 5,-0.2 -0.968 12.6 174.7-117.0 141.8 11.4 0.2 15.8 56 57 A F E > - E 0 59A 21 3,-2.8 3,-2.4 -2,-0.4 2,-0.4 -0.768 66.6 -61.7-146.5 92.0 13.8 -2.7 15.0 57 58 A G T 3 S- 0 0 48 1,-0.3 -51,-0.1 -2,-0.3 -1,-0.1 -0.546 121.8 -16.9 66.5-120.9 17.4 -1.5 14.6 58 59 A T T 3 S+ 0 0 41 -2,-0.4 25,-2.6 -3,-0.1 -1,-0.3 0.540 119.9 97.8 -90.9 -6.9 17.2 0.9 11.6 59 60 A A E < +EF 56 82A 0 -3,-2.4 -3,-2.8 23,-0.2 2,-0.3 -0.571 52.2 177.7 -79.9 142.6 13.8 -0.5 10.5 60 61 A I E -EF 55 81A 0 21,-2.5 21,-2.6 -5,-0.2 2,-0.4 -0.998 17.3-173.4-145.0 140.5 10.7 1.5 11.6 61 62 A S E +EF 54 80A 2 -7,-2.7 -7,-1.9 -2,-0.3 2,-0.3 -0.990 12.5 172.2-124.6 143.7 6.9 1.3 11.1 62 63 A F E -EF 53 79A 2 17,-2.0 17,-3.4 -2,-0.4 2,-0.4 -0.990 10.4-165.5-147.6 149.8 4.4 3.9 12.3 63 64 A S E -EF 52 78A 7 -11,-2.5 -11,-2.0 -2,-0.3 2,-0.4 -0.999 3.7-158.9-138.5 138.5 0.7 4.5 11.7 64 65 A T E -EF 51 77A 0 13,-2.3 13,-2.3 -2,-0.4 2,-0.6 -0.959 10.0-147.3-119.6 132.8 -1.6 7.5 12.3 65 66 A K E - F 0 76A 19 -15,-1.2 2,-2.1 -2,-0.4 11,-0.2 -0.910 20.6-135.1 -96.8 124.4 -5.4 7.4 12.8 66 67 A W E + 0 0 17 9,-2.5 7,-2.7 -2,-0.6 8,-0.6 -0.342 67.9 103.3 -86.7 60.3 -6.8 10.6 11.3 67 68 A L E + F 0 72A 77 -2,-2.1 2,-0.3 5,-0.2 5,-0.2 -0.974 32.5 137.9-136.7 126.9 -9.3 11.4 14.1 68 69 A N - 0 0 34 3,-1.0 -19,-0.1 -2,-0.4 -2,-0.0 -0.842 67.1 -84.4-145.4-171.4 -8.9 14.0 16.8 69 70 A S S S+ 0 0 130 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 0.561 123.4 48.8 -77.9 -4.3 -11.2 16.6 18.5 70 71 A V S S- 0 0 98 1,-0.3 2,-0.3 -26,-0.0 -1,-0.2 0.854 121.0 -5.2 -99.1 -41.8 -10.5 19.1 15.7 71 72 A E - 0 0 74 -27,-0.1 -3,-1.0 -28,-0.0 2,-0.4 -0.991 51.9-149.8-159.3 143.1 -11.1 17.2 12.4 72 73 A S E +F 67 0A 63 -2,-0.3 -5,-0.2 -5,-0.2 -28,-0.1 -0.963 11.2 178.8-117.6 134.1 -11.8 13.7 11.1 73 74 A a E - 0 0 35 -7,-2.7 -6,-0.1 -2,-0.4 3,-0.1 0.304 41.1-127.9-115.0 9.9 -10.6 12.3 7.8 74 75 A N E S+ 0 0 69 -8,-0.6 27,-3.0 1,-0.2 2,-0.3 0.804 72.9 95.7 60.1 35.1 -12.1 8.8 8.2 75 76 A S E - G 0 100A 10 -9,-0.3 -9,-2.5 25,-0.2 2,-0.3 -0.911 60.6-139.5-154.2 167.9 -8.7 7.1 7.4 76 77 A I E -FG 65 99A 0 23,-2.1 23,-2.5 -2,-0.3 2,-0.4 -0.998 13.4-155.7-137.6 129.4 -5.5 5.6 8.6 77 78 A T E -FG 64 98A 7 -13,-2.3 -13,-2.3 -2,-0.3 2,-0.4 -0.912 6.6-166.1-106.2 139.7 -1.9 6.0 7.2 78 79 A S E -FG 63 97A 3 19,-2.6 19,-2.2 -2,-0.4 2,-0.4 -0.995 2.6-165.2-121.3 129.5 0.8 3.4 7.6 79 80 A W E -FG 62 96A 6 -17,-3.4 -17,-2.0 -2,-0.4 2,-0.4 -0.925 4.8-172.5-111.5 140.7 4.5 4.1 6.9 80 81 A S E +FG 61 95A 0 15,-2.5 15,-2.5 -2,-0.4 2,-0.3 -0.997 30.7 121.1-124.3 135.5 7.3 1.5 6.6 81 82 A G E -FG 60 94A 0 -21,-2.6 -21,-2.5 -2,-0.4 2,-0.3 -0.930 45.7-106.5-171.4-165.5 10.9 2.7 6.3 82 83 A F E -FG 59 93A 2 11,-2.1 11,-2.6 -2,-0.3 2,-0.3 -0.992 24.7-116.5-148.3 147.0 14.4 2.8 7.5 83 84 A Y E - 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