==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOTIN-BINDING PROTEIN 27-JAN-98 1SWQ . COMPND 2 MOLECULE: CORE-STREPTAVIDIN; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES AVIDINII; . AUTHOR S.FREITAG,I.LE TRONG,A.CHILKOTI,L.A.KLUMB,P.S.STAYTON, . 453 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19095.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 325 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 242 53.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 2.0 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-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 . 46 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 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 PARALLEL BRIDGES PER LADDER . 4 2 0 4 6 4 2 0 8 4 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 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 16 A G 0 0 69 0, 0.0 80,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -59.0 14.1 27.0 12.4 2 17 A I + 0 0 11 73,-0.1 14,-0.2 16,-0.1 81,-0.0 0.897 360.0 95.3 -75.0 -38.8 15.3 23.8 14.0 3 18 A T + 0 0 63 15,-0.1 2,-0.3 12,-0.1 14,-0.2 -0.256 68.6 65.3 -52.0 131.4 17.2 25.7 16.6 4 19 A G E S-A 16 0A 23 12,-2.5 12,-3.1 2,-0.0 2,-0.4 -0.919 89.7 -51.8 147.3-174.1 15.0 26.0 19.7 5 20 A T E -A 15 0A 54 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.899 53.7-169.8-105.7 121.4 13.3 24.1 22.5 6 21 A W E -A 14 0A 0 8,-2.8 8,-2.6 -2,-0.4 2,-0.4 -0.874 10.4-155.0-122.2 152.3 11.1 21.2 21.4 7 22 A Y E -AB 13 110A 50 103,-2.8 103,-2.0 -2,-0.3 6,-0.2 -0.981 6.9-147.5-130.3 137.9 8.6 19.0 23.1 8 23 A N E > - B 0 109A 4 4,-1.9 3,-1.8 -2,-0.4 101,-0.2 -0.437 40.5 -92.9 -94.0 177.2 7.4 15.5 22.3 9 24 A Q T 3 S+ 0 0 84 99,-0.5 100,-0.1 1,-0.3 -1,-0.1 0.574 124.5 53.4 -66.6 -9.5 3.9 14.1 22.9 10 25 A L T 3 S- 0 0 121 2,-0.1 -1,-0.3 104,-0.0 97,-0.0 0.190 122.0-100.1-111.7 17.7 5.0 12.8 26.3 11 26 A G S < S+ 0 0 37 -3,-1.8 2,-0.2 1,-0.2 -2,-0.1 0.707 72.1 147.8 72.9 20.9 6.3 16.1 27.6 12 27 A S - 0 0 36 16,-0.0 -4,-1.9 2,-0.0 2,-0.5 -0.601 40.8-133.8 -79.9 154.5 10.0 15.3 27.0 13 28 A T E -A 7 0A 16 16,-2.4 16,-2.9 -6,-0.2 2,-0.5 -0.964 17.7-169.6-120.1 134.5 12.1 18.4 26.2 14 29 A F E -AC 6 28A 0 -8,-2.6 -8,-2.8 -2,-0.5 2,-0.7 -0.958 3.4-171.9-119.2 105.4 14.6 18.6 23.3 15 30 A I E +AC 5 27A 60 12,-3.0 12,-1.9 -2,-0.5 2,-0.4 -0.892 20.8 170.9-103.9 114.2 16.8 21.7 23.4 16 31 A V E -AC 4 26A 2 -12,-3.1 -12,-2.5 -2,-0.7 2,-0.5 -0.952 31.2-155.0-130.0 150.4 18.9 21.9 20.3 17 32 A T E - C 0 25A 75 8,-3.4 8,-1.7 -2,-0.4 2,-1.0 -0.957 16.1-147.4-113.9 124.2 21.2 24.2 18.3 18 33 A A E - C 0 24A 21 -2,-0.5 6,-0.2 6,-0.2 -15,-0.1 -0.757 20.9-149.1 -90.9 103.1 21.5 23.7 14.5 19 34 A G > - 0 0 21 4,-3.2 3,-1.5 -2,-1.0 20,-0.1 -0.200 20.9-117.3 -66.3 154.8 25.1 24.6 13.6 20 35 A A T 3 S+ 0 0 97 1,-0.3 -1,-0.1 2,-0.1 21,-0.0 0.823 111.9 59.3 -65.7 -31.3 25.9 26.1 10.2 21 36 A D T 3 S- 0 0 106 1,-0.1 -1,-0.3 2,-0.0 20,-0.1 0.515 128.5 -89.2 -70.0 -14.5 28.1 23.1 9.3 22 37 A G S < S+ 0 0 1 -3,-1.5 17,-1.4 1,-0.3 2,-0.3 0.392 83.3 141.0 112.0 -0.2 25.2 20.5 9.6 23 38 A A E - D 0 38A 20 15,-0.2 -4,-3.2 -5,-0.1 2,-0.5 -0.587 37.6-159.6 -90.7 143.4 25.8 19.9 13.3 24 39 A L E +CD 18 37A 0 13,-2.6 13,-2.0 -2,-0.3 2,-0.4 -0.971 16.8 173.9-115.3 124.3 23.1 19.4 15.9 25 40 A T E +CD 17 36A 74 -8,-1.7 -8,-3.4 -2,-0.5 2,-0.3 -0.988 20.3 94.4-133.2 144.6 24.0 19.9 19.5 26 41 A G E -CD 16 35A 22 9,-1.4 9,-2.0 -2,-0.4 2,-0.3 -0.973 56.1 -74.6 174.6-160.0 21.9 19.9 22.6 27 42 A T E -CD 15 34A 44 -12,-1.9 -12,-3.0 -2,-0.3 2,-0.4 -0.981 22.2-150.4-140.1 139.0 20.3 18.3 25.6 28 43 A Y E CD 14 33A 8 5,-2.9 5,-3.7 -2,-0.3 -14,-0.2 -0.975 360.0 360.0-116.0 129.6 17.4 15.9 26.1 29 44 A E 0 0 91 -16,-2.9 -16,-2.4 -2,-0.4 3,-0.2 -0.972 360.0 360.0-119.5 360.0 15.4 16.1 29.3 30 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 31 52 A S 0 0 82 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-157.2 17.2 13.7 33.9 32 53 A R - 0 0 127 -3,-0.2 2,-0.3 -5,-0.0 -3,-0.2 -0.796 360.0-172.7-100.7 138.5 19.2 15.6 31.3 33 54 A Y E -D 28 0A 21 -5,-3.7 -5,-2.9 -2,-0.4 2,-0.2 -0.946 26.5-110.6-132.8 150.2 21.3 14.0 28.6 34 55 A V E -D 27 0A 66 -2,-0.3 23,-0.5 25,-0.3 2,-0.4 -0.504 35.5-168.4 -76.2 136.1 23.8 15.1 25.9 35 56 A L E +DE 26 56A 3 -9,-2.0 -9,-1.4 -2,-0.2 2,-0.3 -0.958 8.8 178.1-124.5 151.0 22.6 14.8 22.4 36 57 A T E +DE 25 55A 20 19,-1.8 19,-2.4 -2,-0.4 2,-0.3 -0.996 15.4 125.4-148.7 148.1 24.4 15.0 19.1 37 58 A G E -DE 24 54A 0 -13,-2.0 -13,-2.6 -2,-0.3 2,-0.3 -0.938 40.3 -98.7-167.6-160.4 23.5 14.7 15.4 38 59 A R E -DE 23 53A 31 15,-1.5 15,-2.0 -2,-0.3 2,-0.3 -0.927 22.2-171.7-138.0 157.8 23.4 16.1 11.9 39 60 A Y E - E 0 52A 32 -17,-1.4 2,-0.8 -2,-0.3 13,-0.2 -0.944 40.0 -92.1-147.2 162.1 20.9 17.7 9.6 40 61 A D - 0 0 2 11,-2.2 -18,-0.1 -2,-0.3 146,-0.0 -0.731 34.6-170.1 -76.6 102.2 20.6 18.8 6.0 41 62 A S S S+ 0 0 44 -2,-0.8 -1,-0.1 1,-0.3 -19,-0.1 0.397 81.7 42.5 -82.2 3.7 21.9 22.4 6.1 42 63 A A S S- 0 0 44 -20,-0.0 -1,-0.3 0, 0.0 3,-0.1 -0.491 80.6-178.5-143.6 72.2 20.8 22.9 2.5 43 64 A P - 0 0 51 0, 0.0 7,-0.1 0, 0.0 6,-0.1 -0.173 36.3 -88.1 -69.0 161.8 17.3 21.3 2.0 44 65 A A - 0 0 34 5,-0.3 3,-0.1 1,-0.1 140,-0.0 -0.153 25.7-137.3 -58.3 163.5 15.4 21.3 -1.3 45 66 A T S S+ 0 0 145 1,-0.1 -1,-0.1 2,-0.1 0, 0.0 0.419 81.2 95.5-104.3 -6.1 13.2 24.3 -2.1 46 67 A D S S- 0 0 103 1,-0.1 -1,-0.1 3,-0.1 3,-0.1 0.074 112.4 -89.7 -75.4 15.7 10.3 22.2 -3.4 47 68 A G S S+ 0 0 47 1,-0.3 166,-0.3 -3,-0.1 2,-0.2 0.545 82.8 144.4 84.6 3.8 8.4 22.1 -0.1 48 69 A S - 0 0 23 164,-0.1 -1,-0.3 162,-0.1 164,-0.3 -0.483 50.9-109.1 -75.3 150.3 10.2 19.0 1.0 49 70 A G - 0 0 7 162,-2.5 2,-0.6 -2,-0.2 -5,-0.3 -0.033 32.9 -97.6 -67.5 176.6 11.0 18.7 4.7 50 71 A T E - F 0 75A 18 25,-2.8 25,-2.6 -7,-0.1 -1,-0.1 -0.913 33.3-134.3-108.3 110.8 14.5 18.8 6.2 51 72 A A E + F 0 74A 0 -2,-0.6 -11,-2.2 23,-0.2 2,-0.3 -0.247 39.9 144.1 -62.5 135.5 16.2 15.5 7.0 52 73 A L E -EF 39 73A 0 21,-2.4 21,-2.9 -13,-0.2 2,-0.3 -0.989 21.2-177.6-164.1 168.6 17.9 15.1 10.3 53 74 A G E -EF 38 72A 0 -15,-2.0 -15,-1.5 -2,-0.3 2,-0.3 -0.974 2.5-174.9-166.8 162.6 18.8 12.7 13.2 54 75 A W E -EF 37 71A 0 17,-1.7 17,-3.1 -2,-0.3 2,-0.4 -0.976 14.2-133.5-159.2 169.8 20.5 12.6 16.5 55 76 A T E -EF 36 70A 0 -19,-2.4 -19,-1.8 -2,-0.3 2,-0.4 -0.994 7.0-167.4-133.2 137.6 21.5 10.2 19.3 56 77 A V E -EF 35 69A 0 13,-2.5 13,-2.5 -2,-0.4 2,-0.6 -0.996 9.5-157.3-118.7 124.6 21.3 10.2 23.0 57 78 A A E - F 0 68A 4 -23,-0.5 2,-2.7 -2,-0.4 11,-0.3 -0.910 26.9-127.9 -93.0 122.5 23.3 7.7 25.0 58 79 A W E S+ 0 0 44 9,-2.4 7,-2.3 -2,-0.6 2,-0.4 -0.239 71.4 107.7 -79.5 59.1 21.4 7.3 28.3 59 80 A K E + F 0 64A 63 -2,-2.7 -25,-0.3 5,-0.2 5,-0.2 -0.999 33.6 152.4-130.6 126.5 24.3 7.9 30.6 60 81 A N - 0 0 25 3,-2.9 -27,-0.1 -2,-0.4 -2,-0.0 -0.641 63.7 -77.1-130.5-164.8 24.7 11.1 32.7 61 82 A N S S+ 0 0 156 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.613 128.3 42.0 -69.9 -13.7 26.4 11.9 36.0 62 83 A Y S S+ 0 0 183 1,-0.3 2,-0.3 0, 0.0 -1,-0.2 0.735 120.3 7.5-105.6 -36.5 23.5 10.4 37.9 63 84 A R - 0 0 161 2,-0.0 -3,-2.9 0, 0.0 2,-0.3 -0.975 47.1-153.3-147.0 166.0 22.5 7.2 36.1 64 85 A N E +F 59 0A 43 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.0 -0.963 9.8 177.1-140.1 113.6 23.4 4.8 33.3 65 86 A A E - 0 0 59 -7,-2.3 27,-0.2 -2,-0.3 -6,-0.1 0.315 43.9-128.3 -97.6 3.0 20.7 2.7 31.5 66 87 A H E S+ 0 0 57 -8,-0.3 26,-2.7 1,-0.2 2,-0.3 0.906 71.8 104.2 46.3 55.1 23.4 1.2 29.2 67 88 A S E - G 0 91A 10 24,-0.2 -9,-2.4 102,-0.1 2,-0.3 -0.966 53.6-152.3-152.6 164.9 21.3 2.1 26.1 68 89 A A E -FG 57 90A 0 22,-2.3 22,-2.9 -2,-0.3 2,-0.4 -0.984 5.4-154.6-146.0 138.6 21.2 4.6 23.3 69 90 A T E -FG 56 89A 6 -13,-2.5 -13,-2.5 -2,-0.3 2,-0.4 -0.940 6.2-162.5-110.9 135.9 18.3 6.0 21.2 70 91 A T E -FG 55 88A 0 18,-2.3 18,-1.7 -2,-0.4 2,-0.5 -0.973 5.5-155.1-115.9 133.0 18.6 7.4 17.8 71 92 A W E -FG 54 87A 6 -17,-3.1 -17,-1.7 -2,-0.4 2,-0.4 -0.891 8.9-173.6-108.3 132.6 16.0 9.6 16.2 72 93 A S E +FG 53 86A 0 14,-3.4 14,-2.6 -2,-0.5 2,-0.3 -0.988 31.7 100.8-125.0 130.4 15.6 9.8 12.4 73 94 A G E -FG 52 85A 1 -21,-2.9 -21,-2.4 -2,-0.4 2,-0.3 -0.890 55.1 -87.1-173.2-161.3 13.2 12.3 10.9 74 95 A Q E -FG 51 84A 5 10,-1.8 10,-2.3 -2,-0.3 2,-0.4 -0.999 22.1-132.6-144.2 144.0 12.4 15.5 9.1 75 96 A Y E -FG 50 83A 38 -25,-2.6 -25,-2.8 -2,-0.3 2,-0.5 -0.791 17.3-165.5 -93.8 134.2 11.7 19.0 10.2 76 97 A V E - 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