==== 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 1SWK . 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, . 468 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18378.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 330 70.5 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 . 244 52.1 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 . 8 1.7 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 . 54 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 5.6 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 . 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 . 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 . 2 4 0 5 3 6 2 2 6 3 1 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 73 0, 0.0 86,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -64.0 31.3 -5.2 36.4 2 17 A I + 0 0 13 79,-0.1 14,-0.2 16,-0.0 80,-0.0 0.922 360.0 94.3 -67.0 -38.3 28.5 -2.7 35.8 3 18 A T + 0 0 69 15,-0.1 2,-0.3 12,-0.1 14,-0.2 -0.304 67.4 67.9 -55.5 128.8 28.8 -1.6 39.4 4 19 A G E S-A 16 0A 23 12,-1.9 12,-2.6 2,-0.0 2,-0.5 -0.956 87.3 -55.4 154.2-172.2 31.1 1.4 39.6 5 20 A T E -A 15 0A 54 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.909 52.5-175.4-104.8 128.5 31.7 5.1 38.7 6 21 A W E -A 14 0A 0 8,-3.6 8,-3.3 -2,-0.5 2,-0.4 -0.933 11.2-159.5-127.4 154.0 31.3 5.9 35.0 7 22 A Y E -AB 13 116A 111 109,-2.8 109,-2.1 -2,-0.3 6,-0.2 -0.975 7.7-149.1-132.4 144.8 31.9 9.1 33.0 8 23 A N E > - B 0 115A 10 4,-2.0 3,-2.0 -2,-0.4 107,-0.2 -0.581 38.1 -91.1-106.5-179.2 30.6 10.1 29.6 9 24 A Q T 3 S+ 0 0 107 105,-0.6 106,-0.1 1,-0.3 -1,-0.1 0.547 125.2 54.4 -64.3 -18.6 31.9 12.2 26.8 10 25 A L T 3 S- 0 0 57 2,-0.1 -1,-0.3 22,-0.0 103,-0.0 0.520 120.9-106.9 -91.2 -9.3 30.3 15.3 28.2 11 26 A G < + 0 0 46 -3,-2.0 -2,-0.2 1,-0.3 2,-0.1 0.519 67.6 151.0 92.6 7.7 31.9 14.7 31.6 12 27 A S - 0 0 2 1,-0.1 -4,-2.0 18,-0.1 2,-0.5 -0.397 39.7-132.1 -72.2 155.2 28.8 13.6 33.4 13 28 A T E -AC 7 29A 29 16,-2.4 16,-2.2 -6,-0.2 2,-0.5 -0.927 19.1-172.8-116.7 122.2 29.2 11.2 36.2 14 29 A F E -AC 6 28A 0 -8,-3.3 -8,-3.6 -2,-0.5 2,-0.5 -0.944 3.0-177.7-116.6 119.4 27.2 8.0 36.6 15 30 A I E +AC 5 27A 52 12,-2.2 12,-1.9 -2,-0.5 2,-0.4 -0.965 18.2 166.7-117.1 118.8 27.6 6.1 39.9 16 31 A V E -AC 4 26A 1 -12,-2.6 -12,-1.9 -2,-0.5 2,-0.5 -0.945 33.2-148.8-138.4 155.5 25.6 2.9 40.0 17 32 A T E - C 0 25A 76 8,-4.3 8,-2.3 -2,-0.4 2,-0.6 -0.986 16.7-148.8-118.5 124.7 25.1 -0.3 41.9 18 33 A A E - C 0 24A 22 -2,-0.5 6,-0.2 6,-0.2 -15,-0.1 -0.830 22.9-152.6 -87.9 115.3 23.9 -3.4 39.9 19 34 A G > - 0 0 24 4,-4.2 3,-1.4 -2,-0.6 -16,-0.0 -0.334 26.1-108.6 -92.3 169.3 21.8 -5.5 42.2 20 35 A A T 3 S+ 0 0 103 1,-0.3 -1,-0.1 2,-0.1 27,-0.0 0.876 114.8 60.5 -65.5 -33.3 21.0 -9.3 42.3 21 36 A D T 3 S- 0 0 102 1,-0.1 -1,-0.3 2,-0.0 26,-0.1 0.500 127.2 -94.1 -66.9 -10.6 17.4 -8.7 41.1 22 37 A G S < S+ 0 0 1 -3,-1.4 23,-2.0 1,-0.3 2,-0.3 0.527 82.3 148.8 95.7 10.8 18.5 -7.1 37.9 23 38 A A E - D 0 44A 15 21,-0.2 -4,-4.2 24,-0.0 2,-0.4 -0.547 35.2-161.0 -85.4 140.8 18.2 -3.7 39.7 24 39 A L E +CD 18 43A 0 19,-1.9 19,-1.7 -2,-0.3 2,-0.3 -0.969 17.9 169.3-115.0 129.3 20.3 -0.7 38.9 25 40 A T E +CD 17 42A 74 -8,-2.3 -8,-4.3 -2,-0.4 2,-0.3 -0.990 18.4 90.7-138.8 154.1 20.5 2.0 41.5 26 41 A G E -CD 16 41A 27 15,-1.3 15,-2.0 -2,-0.3 2,-0.3 -0.992 60.1 -68.9 166.6-147.8 22.6 5.1 42.0 27 42 A T E -CD 15 40A 28 -12,-1.9 -12,-2.2 -2,-0.3 2,-0.4 -0.974 29.2-149.3-142.0 148.9 23.0 8.8 41.3 28 43 A Y E -CD 14 39A 2 11,-3.1 11,-2.3 -2,-0.3 2,-0.4 -0.965 5.5-168.0-127.0 142.5 23.6 10.9 38.2 29 44 A E E -C 13 0A 83 -16,-2.2 -16,-2.4 -2,-0.4 2,-0.3 -0.958 11.6-152.9-130.1 116.3 25.4 14.2 37.8 30 45 A S - 0 0 24 7,-0.5 7,-0.1 -2,-0.4 5,-0.1 -0.708 12.9-162.6 -89.1 141.0 25.1 16.1 34.5 31 46 A A S S+ 0 0 63 -2,-0.3 2,-0.3 5,-0.1 -1,-0.1 0.328 80.0 42.6 -92.0 -7.7 27.8 18.5 33.3 32 47 A V S S+ 0 0 33 427,-0.0 -2,-0.1 425,-0.0 2,-0.0 -0.894 91.6 29.4-142.6 157.7 25.3 20.2 30.9 33 48 A G S S- 0 0 46 -2,-0.3 2,-2.1 1,-0.1 427,-0.0 -0.159 107.4 -31.1 83.0-166.7 21.7 21.4 30.9 34 49 A N S S+ 0 0 83 37,-0.1 2,-0.3 -2,-0.0 -1,-0.1 -0.435 101.1 115.0 -87.5 74.4 19.5 22.7 33.6 35 50 A A + 0 0 25 -2,-2.1 2,-0.3 35,-0.1 3,-0.0 -0.995 36.6 176.0-147.6 135.3 21.2 20.6 36.4 36 51 A E - 0 0 82 -2,-0.3 32,-0.2 2,-0.1 33,-0.2 -0.994 58.6 -4.1-129.2 140.7 23.2 21.0 39.6 37 52 A S S S- 0 0 40 -2,-0.3 -7,-0.5 -7,-0.1 2,-0.1 -0.065 98.6 -38.7 71.3 179.3 24.3 18.3 42.0 38 53 A R - 0 0 141 -9,-0.2 2,-0.3 -3,-0.0 -9,-0.2 -0.445 52.5-154.3 -80.4 151.6 23.5 14.6 41.9 39 54 A Y E -D 28 0A 3 -11,-2.3 -11,-3.1 -2,-0.1 2,-0.2 -0.954 23.2-103.0-128.3 149.5 20.2 13.1 40.9 40 55 A V E -D 27 0A 71 -2,-0.3 23,-0.5 25,-0.3 2,-0.4 -0.441 39.5-172.5 -69.0 134.9 18.5 9.8 41.8 41 56 A L E -D 26 0A 4 -15,-2.0 -15,-1.3 -2,-0.2 2,-0.3 -0.980 10.1-178.2-126.4 149.2 18.5 7.2 39.2 42 57 A T E +DE 25 61A 24 19,-1.8 19,-2.8 -2,-0.4 2,-0.2 -0.998 17.1 136.6-141.3 149.2 16.8 3.8 38.8 43 58 A G E -DE 24 60A 0 -19,-1.7 -19,-1.9 -2,-0.3 2,-0.3 -0.823 34.7-115.9-159.5-165.5 17.0 1.1 36.1 44 59 A R E -DE 23 59A 32 15,-2.1 15,-2.0 -21,-0.2 2,-0.3 -0.969 18.0-166.6-146.2 160.7 17.2 -2.5 35.2 45 60 A Y E - E 0 58A 33 -23,-2.0 2,-0.9 -2,-0.3 13,-0.2 -0.996 37.6 -92.4-152.8 156.5 19.6 -4.9 33.5 46 61 A D - 0 0 3 11,-2.9 -24,-0.1 -2,-0.3 146,-0.1 -0.542 34.5-168.2 -68.2 105.3 19.8 -8.3 32.0 47 62 A S S S+ 0 0 42 -2,-0.9 -1,-0.2 1,-0.3 -25,-0.1 0.386 82.3 38.4 -79.7 7.1 21.2 -10.3 34.9 48 63 A A S S- 0 0 46 -26,-0.0 -1,-0.3 0, 0.0 3,-0.1 -0.375 82.3-175.1-154.8 68.5 21.9 -13.3 32.7 49 64 A P - 0 0 52 0, 0.0 7,-0.1 0, 0.0 6,-0.0 -0.047 39.4 -79.1 -66.5 161.9 23.1 -12.2 29.3 50 65 A A - 0 0 25 5,-0.3 3,-0.4 1,-0.1 4,-0.1 -0.195 34.4-138.1 -57.3 156.3 23.9 -14.4 26.4 51 66 A T S S+ 0 0 145 1,-0.2 -1,-0.1 2,-0.1 0, 0.0 0.504 82.9 94.9-100.2 0.0 27.2 -16.2 26.7 52 67 A D S S- 0 0 108 1,-0.1 -1,-0.2 3,-0.1 3,-0.1 0.405 112.9 -91.1 -70.9 0.9 28.1 -15.6 23.1 53 68 A G S S+ 0 0 54 -3,-0.4 166,-0.2 1,-0.3 2,-0.2 0.646 82.0 143.8 92.4 12.8 30.0 -12.5 23.9 54 69 A S - 0 0 26 164,-0.1 -1,-0.3 1,-0.1 164,-0.3 -0.522 52.7-105.7 -75.5 158.2 27.1 -10.3 23.4 55 70 A G - 0 0 6 162,-2.5 2,-0.6 -2,-0.2 -5,-0.3 -0.138 34.3 -96.5 -79.2 179.0 26.8 -7.3 25.7 56 71 A T E - F 0 81A 19 25,-2.6 25,-2.3 -7,-0.1 2,-0.1 -0.875 34.3-130.2-100.0 121.4 24.4 -6.9 28.6 57 72 A A E + F 0 80A 1 -2,-0.6 -11,-2.9 23,-0.2 2,-0.3 -0.419 39.9 151.3 -74.6 140.8 21.2 -5.0 28.0 58 73 A L E -EF 45 79A 0 21,-2.2 21,-2.7 -13,-0.2 2,-0.3 -0.984 20.9-176.4-157.3 165.8 20.3 -2.2 30.4 59 74 A G E -EF 44 78A 0 -15,-2.0 -15,-2.1 -2,-0.3 2,-0.3 -0.968 4.5-173.8-159.7 158.7 18.4 1.1 30.9 60 75 A W E -EF 43 77A 0 17,-1.5 17,-2.3 -2,-0.3 2,-0.3 -0.960 12.4-138.2-151.8 163.9 17.9 3.7 33.6 61 76 A T E -EF 42 76A 0 -19,-2.8 -19,-1.8 -2,-0.3 2,-0.3 -0.943 8.6-170.1-125.6 148.4 15.9 6.8 34.2 62 77 A V E - F 0 75A 0 13,-2.1 13,-2.3 -2,-0.3 2,-0.6 -0.972 10.8-157.5-136.0 120.4 16.5 10.2 35.8 63 78 A A E - F 0 74A 2 -23,-0.5 2,-2.3 -2,-0.3 11,-0.3 -0.884 27.8-131.7 -87.0 119.4 13.9 12.8 36.6 64 79 A F E + 0 0 15 9,-2.7 7,-3.3 -2,-0.6 2,-0.4 -0.364 68.0 112.7 -81.0 63.4 15.9 16.0 36.8 65 80 A K E + F 0 70A 65 -2,-2.3 -25,-0.3 5,-0.3 5,-0.2 -0.999 29.7 139.3-134.5 128.2 14.5 17.2 40.1 66 81 A N - 0 0 24 3,-2.7 -27,-0.1 -2,-0.4 3,-0.1 -0.800 67.1 -76.2-147.9-168.4 16.3 17.6 43.4 67 82 A N S S+ 0 0 166 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.751 127.4 51.1 -73.6 -18.3 16.5 20.0 46.3 68 83 A Y S S- 0 0 141 1,-0.2 2,-0.3 -32,-0.2 -1,-0.2 0.851 124.2 -24.2 -82.3 -39.2 18.5 22.4 44.3 69 84 A R - 0 0 101 -33,-0.2 -3,-2.7 -3,-0.1 2,-0.4 -0.990 45.8-133.9-167.4 167.8 16.4 22.6 41.2 70 85 A N E -F 65 0A 37 -2,-0.3 -5,-0.3 -5,-0.2 -35,-0.1 -0.913 9.6-176.5-139.3 110.9 13.7 21.0 38.9 71 86 A A E - 0 0 24 -7,-3.3 27,-0.2 -2,-0.4 -6,-0.1 0.576 39.7-129.2 -83.1 -8.0 14.1 21.0 35.2 72 87 A H E S+ 0 0 56 -8,-0.4 26,-2.4 1,-0.3 2,-0.3 0.956 72.7 109.8 55.8 50.9 10.7 19.4 34.7 73 88 A S E - G 0 97A 11 24,-0.2 -9,-2.7 102,-0.1 2,-0.3 -0.977 50.9-160.7-153.0 159.1 12.4 16.8 32.5 74 89 A A E -FG 63 96A 0 22,-1.8 22,-2.9 -2,-0.3 2,-0.4 -0.987 6.4-158.7-147.7 137.0 13.3 13.2 32.5 75 90 A T E -FG 62 95A 5 -13,-2.3 -13,-2.1 -2,-0.3 2,-0.4 -0.916 0.6-161.0-116.9 145.2 15.8 11.2 30.5 76 91 A T E -FG 61 94A 0 18,-2.4 18,-2.1 -2,-0.4 2,-0.5 -0.998 6.2-156.7-125.7 132.3 16.0 7.5 29.8 77 92 A W E -FG 60 93A 8 -17,-2.3 -17,-1.5 -2,-0.4 2,-0.4 -0.936 9.2-171.6-107.3 129.1 19.2 5.9 28.6 78 93 A S E +FG 59 92A 0 14,-3.6 14,-2.6 -2,-0.5 2,-0.3 -0.980 32.6 91.7-124.1 125.8 19.0 2.6 26.7 79 94 A G E -FG 58 91A 2 -21,-2.7 -21,-2.2 -2,-0.4 2,-0.3 -0.863 57.9 -76.5-172.9-153.6 22.0 0.5 25.8 80 95 A Q E -FG 57 90A 6 10,-1.9 10,-2.2 -2,-0.3 2,-0.4 -0.999 22.8-131.1-142.1 147.7 24.4 -2.2 26.6 81 96 A Y E -FG 56 89A 37 -25,-2.3 -25,-2.6 -2,-0.3 2,-0.4 -0.763 18.5-168.2 -92.4 134.9 27.4 -2.9 28.8 82 97 A V E - 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