==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOTIN BINDING PROTEIN 07-AUG-12 4GGZ . COMPND 2 MOLECULE: BRADAVIDIN 2; . SOURCE 2 ORGANISM_SCIENTIFIC: BRADYRHIZOBIUM JAPONICUM; . AUTHOR O.LIVNAH,A.MEIR . 424 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19909.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 323 76.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 242 57.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.9 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 . 38 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 9.4 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+4), SAME NUMBER PER 100 RESIDUES . 4 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 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 . 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 0 0 PARALLEL BRIDGES PER LADDER . 4 0 4 4 4 6 10 0 0 0 4 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 0 0 0 0 0 0 4 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 7 A L 0 0 57 0, 0.0 2,-0.1 0, 0.0 22,-0.1 0.000 360.0 360.0 360.0 113.0 44.1 10.1 12.2 2 8 A P - 0 0 48 0, 0.0 15,-0.1 0, 0.0 3,-0.1 -0.393 360.0-130.1 -66.3 138.4 41.3 12.4 11.2 3 9 A A S S+ 0 0 45 1,-0.3 2,-0.2 -2,-0.1 15,-0.2 -0.979 84.8 28.2-144.9 133.8 37.8 11.1 12.2 4 10 A P S S+ 0 0 60 0, 0.0 2,-0.3 0, 0.0 -1,-0.3 0.582 92.1 140.7 -72.4 155.3 35.4 10.9 10.6 5 11 A S E -A 17 0A 0 12,-2.1 12,-2.9 -2,-0.2 2,-0.4 -0.961 38.8-139.8-155.6 168.2 37.3 10.4 7.3 6 12 A Y E +A 16 0A 6 -2,-0.3 99,-3.4 10,-0.2 100,-1.3 -0.997 19.4 178.0-144.2 133.1 37.0 8.3 4.2 7 13 A W E -AB 15 104A 0 8,-2.6 8,-3.1 -2,-0.4 2,-0.3 -0.958 12.3-160.3-137.5 152.1 39.7 6.6 2.3 8 14 A K E -AB 14 103A 92 95,-2.1 95,-2.8 -2,-0.3 6,-0.2 -0.977 15.2-140.2-132.1 149.0 39.9 4.4 -0.8 9 15 A N E > - B 0 102A 9 4,-2.2 3,-1.5 -2,-0.3 93,-0.2 -0.439 34.2 -94.9-104.4-178.6 42.8 2.1 -1.7 10 16 A E T 3 S+ 0 0 152 91,-0.7 92,-0.1 1,-0.3 -1,-0.1 0.653 123.0 57.8 -70.0 -14.6 44.3 1.3 -5.1 11 17 A R T 3 S- 0 0 96 90,-0.1 23,-0.4 2,-0.1 -1,-0.3 0.558 121.8-104.7 -90.1 -10.6 42.1 -1.8 -5.6 12 18 A G S < S+ 0 0 23 -3,-1.5 -2,-0.1 1,-0.3 2,-0.1 0.421 72.0 144.4 105.2 -1.3 39.0 0.4 -5.2 13 19 A S - 0 0 1 18,-0.1 -4,-2.2 19,-0.1 2,-0.4 -0.425 40.7-135.0 -74.6 158.9 38.1 -0.7 -1.6 14 20 A E E -AC 8 30A 6 16,-2.4 16,-2.5 -6,-0.2 2,-0.4 -0.906 16.6-171.6-124.1 134.3 36.6 1.8 0.8 15 21 A L E -AC 7 29A 3 -8,-3.1 -8,-2.6 -2,-0.4 2,-0.6 -0.983 4.3-167.5-127.1 120.2 37.5 2.5 4.4 16 22 A L E -AC 6 28A 8 12,-3.2 12,-2.4 -2,-0.4 2,-0.7 -0.930 6.6-158.6-108.1 120.1 35.3 4.8 6.5 17 23 A I E +AC 5 27A 2 -12,-2.9 -12,-2.1 -2,-0.6 10,-0.2 -0.913 14.5 175.5 -98.9 113.2 36.8 5.9 9.8 18 24 A W E - 0 0 79 8,-2.2 2,-0.3 -2,-0.7 9,-0.2 0.912 61.9 -8.3 -88.0 -42.8 34.0 7.0 12.0 19 25 A S E - C 0 26A 12 7,-2.0 7,-2.5 -16,-0.1 -1,-0.3 -0.964 38.2-163.8-148.3 163.1 35.9 7.7 15.2 20 26 A A > + 0 0 23 -2,-0.3 3,-2.0 5,-0.2 5,-0.2 -0.189 31.1 170.9-137.6 40.9 39.3 7.3 16.8 21 27 A N G > S- 0 0 53 3,-0.3 3,-1.9 1,-0.3 -2,-0.1 -0.331 72.5 -5.7 -62.6 128.0 38.3 7.8 20.4 22 28 A S G 3 S- 0 0 57 1,-0.3 -1,-0.3 -2,-0.1 3,-0.1 0.713 130.8 -62.2 58.1 23.3 41.1 7.0 23.0 23 29 A G G < S+ 0 0 21 -3,-2.0 26,-3.1 1,-0.2 2,-0.6 0.426 106.5 128.1 85.2 -1.3 43.1 5.8 20.0 24 30 A T E < - D 0 48A 1 -3,-1.9 2,-0.3 24,-0.2 -3,-0.3 -0.805 53.4-140.5 -93.5 117.8 40.7 3.0 19.1 25 31 A I E - D 0 47A 2 22,-1.5 22,-1.8 -2,-0.6 2,-0.4 -0.606 20.8-177.4 -79.5 132.0 39.6 3.1 15.5 26 32 A Q E +CD 19 46A 9 -7,-2.5 -8,-2.2 -2,-0.3 -7,-2.0 -0.995 27.6 105.5-130.7 126.1 36.0 2.4 14.7 27 33 A G E -CD 17 45A 12 18,-2.3 18,-2.1 -2,-0.4 2,-0.3 -0.837 56.9 -85.1-166.1-154.2 34.7 2.3 11.2 28 34 A T E -CD 16 44A 40 -12,-2.4 -12,-3.2 16,-0.3 2,-0.4 -0.996 25.1-164.3-144.6 138.5 33.5 0.3 8.2 29 35 A F E -CD 15 43A 3 14,-3.0 14,-3.1 -2,-0.3 2,-0.4 -0.981 1.8-170.6-123.6 139.1 35.3 -1.4 5.3 30 36 A T E -CD 14 42A 3 -16,-2.5 -16,-2.4 -2,-0.4 2,-0.2 -0.983 18.9-134.8-131.9 125.2 33.9 -2.6 2.0 31 37 A N B +j 39 0B 12 7,-0.6 9,-2.6 10,-0.5 10,-0.2 -0.523 34.8 157.9 -72.3 140.8 36.0 -4.7 -0.4 32 38 A H + 0 0 43 -2,-0.2 2,-0.3 7,-0.2 -1,-0.1 0.122 33.7 137.6-137.7 17.1 36.0 -3.9 -4.1 33 39 A A > - 0 0 3 4,-0.2 3,-1.4 1,-0.1 2,-0.2 -0.434 55.7-122.7 -73.5 128.0 39.3 -5.7 -4.8 34 40 A Q T 3 S+ 0 0 183 -23,-0.4 3,-0.1 -2,-0.3 -1,-0.1 -0.447 97.9 32.3 -66.4 136.4 39.5 -7.8 -7.9 35 41 A G T 3 S+ 0 0 75 1,-0.4 2,-0.3 -2,-0.2 -1,-0.2 0.496 106.1 87.6 97.0 5.4 40.5 -11.4 -7.0 36 42 A F < - 0 0 61 -3,-1.4 -1,-0.4 1,-0.0 3,-0.2 -0.890 66.6-130.0-132.4 161.7 38.7 -11.4 -3.6 37 43 A A S S+ 0 0 62 -2,-0.3 -4,-0.2 1,-0.2 26,-0.1 -0.187 76.7 63.1-101.5-169.6 35.2 -12.2 -2.4 38 44 A a S > S- 0 0 13 1,-0.2 3,-1.4 24,-0.1 -7,-0.6 0.846 71.0-176.6 58.0 34.1 32.6 -10.4 -0.2 39 45 A Q B 3 +j 31 0B 56 1,-0.2 -7,-0.2 -3,-0.2 -1,-0.2 -0.445 63.2 5.6 -64.3 127.8 32.5 -7.5 -2.8 40 46 A G T 3 S+ 0 0 3 -9,-2.6 -1,-0.2 1,-0.2 -8,-0.1 0.478 92.6 128.6 83.6 1.7 30.3 -4.6 -1.8 41 47 A I < - 0 0 13 -3,-1.4 -10,-0.5 -10,-0.2 2,-0.4 -0.828 54.1-139.8 -96.4 111.3 29.5 -5.9 1.7 42 48 A P E -D 30 0A 26 0, 0.0 -12,-0.2 0, 0.0 -3,-0.0 -0.552 26.4-178.4 -71.2 126.1 30.2 -3.3 4.4 43 49 A Y E -D 29 0A 16 -14,-3.1 -14,-3.0 -2,-0.4 17,-0.1 -0.933 31.8 -97.1-122.1 150.5 31.9 -4.8 7.4 44 50 A P E -D 28 0A 82 0, 0.0 15,-0.7 0, 0.0 2,-0.4 -0.346 34.6-155.5 -65.4 144.7 32.9 -3.3 10.7 45 51 A A E +DE 27 58A 3 -18,-2.1 -18,-2.3 -29,-0.2 2,-0.3 -0.953 14.0 177.1-118.4 143.0 36.6 -2.3 11.1 46 52 A A E +DE 26 57A 3 11,-2.2 11,-3.5 -2,-0.4 2,-0.3 -0.999 17.7 110.7-147.6 139.9 38.4 -1.9 14.4 47 53 A G E -DE 25 56A 5 -22,-1.8 -22,-1.5 -2,-0.3 2,-0.3 -0.869 49.2 -78.5-173.1-147.1 41.9 -1.1 15.4 48 54 A S E -DE 24 55A 20 7,-2.1 7,-2.1 -24,-0.3 2,-0.4 -0.998 19.6-163.2-145.7 141.9 44.3 1.3 17.1 49 55 A V E + E 0 54A 27 -26,-3.1 5,-0.2 -2,-0.3 23,-0.0 -0.986 16.1 164.7-125.5 137.6 46.1 4.5 16.2 50 56 A S E > - E 0 53A 57 3,-2.5 3,-0.7 -2,-0.4 -27,-0.0 -0.858 56.4 -88.7-134.2 174.0 49.1 6.0 18.1 51 57 A P T 3 S+ 0 0 143 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 0.782 125.6 49.8 -51.7 -28.8 51.6 8.7 17.2 52 58 A T T 3 S- 0 0 125 1,-0.2 2,-0.3 20,-0.1 -3,-0.0 0.652 122.5 -52.9 -94.0 -19.6 53.8 5.9 15.7 53 59 A G E < -E 50 0A 14 -3,-0.7 -3,-2.5 19,-0.1 2,-0.3 -0.992 48.4-112.2 175.2-165.9 51.4 4.1 13.4 54 60 A L E -EF 49 71A 7 17,-2.8 17,-2.6 -2,-0.3 2,-0.3 -0.976 14.8-172.7-147.8 159.8 48.1 2.3 13.1 55 61 A Y E -EF 48 70A 44 -7,-2.1 -7,-2.1 -2,-0.3 2,-0.3 -0.964 7.9-175.5-140.6 160.9 46.6 -1.1 12.5 56 62 A F E -EF 47 69A 2 13,-1.9 13,-3.0 -2,-0.3 2,-0.4 -0.983 12.2-145.1-152.8 155.9 43.0 -2.3 11.9 57 63 A V E -EF 46 68A 0 -11,-3.5 -11,-2.2 -2,-0.3 2,-0.4 -0.922 7.5-169.8-121.9 142.0 41.1 -5.5 11.5 58 64 A V E -EF 45 67A 0 9,-2.1 9,-2.6 -2,-0.4 2,-0.6 -0.988 11.3-151.7-131.0 126.6 38.1 -6.4 9.3 59 65 A T E - F 0 66A 26 -15,-0.7 2,-1.1 -2,-0.4 7,-0.3 -0.858 2.1-158.7 -98.1 118.5 36.2 -9.7 9.7 60 66 A F E >>> - F 0 65A 14 5,-2.4 3,-1.6 -2,-0.6 5,-1.5 -0.761 13.0-177.4 -98.2 84.6 34.6 -10.9 6.5 61 67 A A G >45S+ 0 0 51 -2,-1.1 3,-1.5 1,-0.3 -1,-0.2 0.893 77.0 53.2 -56.4 -43.0 32.0 -13.2 8.0 62 68 A Q G 345S+ 0 0 107 1,-0.3 -1,-0.3 -3,-0.1 -24,-0.1 0.682 113.2 45.5 -70.3 -13.0 30.5 -14.4 4.8 63 69 A a G <45S- 0 0 42 -3,-1.6 -1,-0.3 2,-0.2 24,-0.2 0.326 105.1-124.0-109.5 2.6 34.0 -15.4 3.5 64 70 A N T <<5S+ 0 0 97 -3,-1.5 23,-2.3 -4,-0.5 2,-0.3 0.888 77.3 103.9 54.9 39.4 35.2 -17.1 6.7 65 71 A S E < -FG 60 86A 15 -5,-1.5 -5,-2.4 21,-0.2 2,-0.3 -0.917 51.3-162.1-143.4 161.4 38.2 -14.8 6.7 66 72 A F E -FG 59 85A 31 19,-2.2 19,-3.1 -2,-0.3 2,-0.4 -0.980 10.2-147.9-142.3 156.3 39.6 -11.7 8.4 67 73 A T E -FG 58 84A 7 -9,-2.6 -9,-2.1 -2,-0.3 2,-0.5 -0.968 0.9-158.1-124.2 139.3 42.4 -9.2 7.4 68 74 A R E -FG 57 83A 75 15,-2.4 15,-1.9 -2,-0.4 2,-0.4 -0.984 11.2-163.6-113.0 118.3 44.8 -7.2 9.6 69 75 A W E -FG 56 82A 7 -13,-3.0 -13,-1.9 -2,-0.5 2,-0.4 -0.811 5.0-172.5 -95.1 141.2 46.4 -4.0 8.1 70 76 A V E +FG 55 81A 75 11,-2.9 11,-2.6 -2,-0.4 2,-0.3 -0.995 29.2 102.1-129.9 136.2 49.4 -2.4 9.6 71 77 A G E -FG 54 80A 15 -17,-2.6 -17,-2.8 -2,-0.4 2,-0.3 -0.938 52.3 -95.8-174.5-156.4 50.9 0.9 8.5 72 78 A T - 0 0 69 7,-1.6 2,-0.5 -2,-0.3 -19,-0.1 -0.877 25.4-120.2-140.0 172.3 51.3 4.6 9.1 73 79 A I - 0 0 50 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.986 19.3-179.2-120.6 123.1 49.7 7.9 7.9 74 80 A K B > -H 77 0A 176 3,-2.9 3,-1.8 -2,-0.5 2,-0.6 -0.859 66.2 -69.9-116.5 92.2 51.6 10.5 6.1 75 81 A G T 3 S- 0 0 61 -2,-0.5 0, 0.0 1,-0.3 0, 0.0 -0.491 118.9 -5.2 66.9-109.8 49.0 13.3 5.5 76 82 A S T 3 S+ 0 0 66 -2,-0.6 28,-2.5 -3,-0.1 2,-0.4 0.350 123.1 82.8 -98.4 2.9 46.5 12.0 2.9 77 83 A Q E < -HI 74 103A 73 -3,-1.8 -3,-2.9 26,-0.2 26,-0.2 -0.913 51.3-176.1-108.9 137.5 48.4 8.8 2.3 78 84 A M E - I 0 102A 0 24,-2.8 24,-2.4 -2,-0.4 2,-0.2 -0.798 10.9-167.4-130.8 87.5 48.2 5.7 4.4 79 85 A P E + I 0 101A 55 0, 0.0 -7,-1.6 0, 0.0 2,-0.3 -0.571 19.5 168.8 -76.7 139.6 50.6 3.0 3.2 80 86 A T E -GI 71 100A 15 20,-2.7 20,-2.1 -2,-0.2 2,-0.4 -0.939 33.9-142.1-145.4 163.8 50.0 -0.4 4.7 81 87 A S E -GI 70 99A 74 -11,-2.6 -11,-2.9 -2,-0.3 2,-0.3 -0.959 27.2-165.9-121.8 151.5 50.7 -4.1 4.6 82 88 A W E -GI 69 98A 21 16,-3.1 16,-2.1 -2,-0.4 2,-0.4 -0.955 18.4-154.5-138.6 155.4 48.1 -6.7 5.3 83 89 A T E -GI 68 97A 19 -15,-1.9 -15,-2.4 -2,-0.3 2,-0.6 -1.000 12.5-154.2-126.8 131.4 47.6 -10.4 6.1 84 90 A L E -GI 67 96A 18 12,-3.1 12,-2.0 -2,-0.4 2,-0.5 -0.940 8.9-162.5-108.1 116.0 44.4 -12.2 5.3 85 91 A F E +GI 66 95A 43 -19,-3.1 -19,-2.2 -2,-0.6 2,-0.3 -0.899 17.4 174.8 -99.8 123.0 43.7 -15.2 7.5 86 92 A Y E -GI 65 94A 75 8,-2.5 8,-3.5 -2,-0.5 2,-0.7 -0.953 34.7-137.1-133.0 149.7 41.1 -17.6 6.1 87 93 A V E - I 0 93A 58 -23,-2.3 5,-0.1 -2,-0.3 -2,-0.0 -0.938 39.0-142.1 -97.8 115.2 39.6 -20.9 7.0 88 94 A D > - 0 0 40 4,-2.6 3,-2.3 -2,-0.7 -1,-0.0 -0.011 29.1 -85.2 -75.9-178.7 39.5 -22.8 3.6 89 95 A N T 3 S+ 0 0 143 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.624 129.5 48.9 -67.6 -10.4 36.8 -25.1 2.3 90 96 A K T 3 S- 0 0 173 2,-0.2 -1,-0.3 0, 0.0 -2,-0.1 0.205 123.3-102.2-108.3 10.1 38.4 -28.1 4.0 91 97 A G S < S+ 0 0 48 -3,-2.3 -2,-0.1 1,-0.3 0, 0.0 0.482 75.5 142.3 85.7 4.0 38.6 -26.3 7.4 92 98 A K - 0 0 117 -5,-0.1 -4,-2.6 1,-0.0 -1,-0.3 -0.683 52.0-127.6 -82.7 122.3 42.4 -25.6 7.1 93 99 A P E + I 0 87A 101 0, 0.0 -6,-0.3 0, 0.0 2,-0.2 -0.503 41.2 166.3 -63.3 130.4 43.6 -22.1 8.4 94 100 A S E - I 0 86A 17 -8,-3.5 -8,-2.5 -2,-0.2 2,-0.3 -0.799 20.0-146.1-138.9 174.4 45.6 -20.4 5.6 95 101 A R E - I 0 85A 174 -2,-0.2 2,-0.3 -10,-0.2 -10,-0.2 -0.987 9.1-168.1-144.4 156.6 46.9 -16.9 5.0 96 102 A L E - I 0 84A 77 -12,-2.0 -12,-3.1 -2,-0.3 2,-0.3 -0.930 14.7-160.5-136.2 157.7 47.7 -14.5 2.1 97 103 A K E + I 0 83A 162 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.2 -0.986 21.7 131.9-141.3 150.7 49.7 -11.2 2.4 98 104 A G E - 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