==== 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 1SWR . 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, . 471 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18552.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 329 69.9 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 . 243 51.6 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 0.8 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 . 59 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 4.9 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+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 . 3 3 0 4 4 6 2 2 6 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 78 0, 0.0 81,-0.1 0, 0.0 86,-0.0 0.000 360.0 360.0 360.0 -44.2 35.9 -14.6 24.8 2 17 A I + 0 0 12 79,-0.1 14,-0.2 16,-0.1 87,-0.0 0.859 360.0 98.2 -79.5 -38.8 32.3 -15.8 24.4 3 18 A T S S+ 0 0 80 15,-0.1 2,-0.3 12,-0.1 14,-0.2 -0.228 70.0 45.8 -55.3 130.6 32.0 -17.8 27.5 4 19 A G E S-A 16 0A 25 12,-3.1 12,-2.1 2,-0.0 2,-0.4 -0.981 92.4 -29.2 141.9-158.6 30.3 -15.8 30.2 5 20 A T E -A 15 0A 53 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.883 50.2-179.7-109.9 132.1 27.4 -13.6 31.0 6 21 A W E -A 14 0A 2 8,-2.3 8,-3.0 -2,-0.4 2,-0.4 -0.958 11.2-157.9-131.6 148.5 25.8 -11.3 28.4 7 22 A Y E -AB 13 116A 105 109,-2.7 109,-2.2 -2,-0.3 6,-0.2 -0.974 8.0-151.7-127.0 138.6 22.9 -8.9 28.5 8 23 A N E > - B 0 115A 12 4,-1.7 3,-1.8 -2,-0.4 107,-0.2 -0.506 39.3 -90.9-101.9-176.7 20.8 -7.6 25.6 9 24 A Q T 3 S+ 0 0 108 105,-0.6 106,-0.1 1,-0.3 -1,-0.1 0.613 122.5 59.6 -68.0 -10.3 19.0 -4.3 25.3 10 25 A L T 3 S- 0 0 58 2,-0.1 -1,-0.3 22,-0.0 21,-0.0 0.488 118.8-104.9 -94.1 -5.2 15.9 -5.7 26.8 11 26 A G S < S+ 0 0 50 -3,-1.8 -2,-0.1 1,-0.3 2,-0.1 0.543 72.2 144.2 91.7 5.0 17.5 -6.6 30.1 12 27 A S - 0 0 0 18,-0.1 -4,-1.7 1,-0.0 2,-0.5 -0.452 43.8-132.0 -78.1 159.1 17.6 -10.4 29.4 13 28 A T E -AC 7 29A 21 16,-2.4 16,-2.3 -6,-0.2 2,-0.6 -0.943 15.1-168.0-120.1 121.3 20.5 -12.5 30.5 14 29 A F E -AC 6 28A 0 -8,-3.0 -8,-2.3 -2,-0.5 2,-0.6 -0.953 5.6-174.8-112.3 110.7 22.4 -14.9 28.3 15 30 A I E +AC 5 27A 50 12,-2.9 12,-3.4 -2,-0.6 2,-0.4 -0.942 19.6 158.7-110.8 112.3 24.7 -17.3 30.2 16 31 A V E -AC 4 26A 1 -12,-2.1 -12,-3.1 -2,-0.6 2,-0.4 -0.970 32.7-154.4-137.8 144.8 26.8 -19.5 27.9 17 32 A T E - C 0 25A 74 8,-2.9 8,-2.2 -2,-0.4 2,-0.7 -0.994 17.9-143.1-120.6 134.9 29.9 -21.6 27.8 18 33 A A E - C 0 24A 22 -2,-0.4 6,-0.2 6,-0.2 -15,-0.1 -0.875 17.0-148.7 -93.3 109.4 31.6 -22.2 24.4 19 34 A G > - 0 0 21 4,-3.1 3,-1.0 -2,-0.7 -16,-0.0 -0.334 23.3-116.2 -75.6 160.5 33.1 -25.7 24.3 20 35 A A T 3 S+ 0 0 96 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.684 114.2 63.9 -79.8 -16.0 36.2 -26.3 22.3 21 36 A D T 3 S- 0 0 103 2,-0.1 -1,-0.3 1,-0.0 26,-0.2 0.645 126.5 -97.8 -70.9 -22.6 34.3 -28.5 19.9 22 37 A G S < S+ 0 0 0 -3,-1.0 23,-1.8 1,-0.4 2,-0.3 0.520 78.0 142.9 107.4 9.3 32.1 -25.5 18.9 23 38 A A E - D 0 44A 19 21,-0.2 -4,-3.1 24,-0.0 2,-0.5 -0.605 36.7-156.6 -80.2 139.8 29.3 -26.3 21.2 24 39 A L E +CD 18 43A 0 19,-2.3 19,-2.0 -2,-0.3 2,-0.3 -0.977 19.9 170.7-112.5 126.7 27.4 -23.5 22.9 25 40 A T E +CD 17 42A 68 -8,-2.2 -8,-2.9 -2,-0.5 2,-0.3 -0.992 18.9 86.5-135.1 151.2 25.6 -24.5 26.1 26 41 A G E -CD 16 41A 25 15,-1.6 15,-2.4 -2,-0.3 2,-0.4 -0.970 58.6 -59.1 165.5-150.0 23.9 -22.4 28.7 27 42 A T E -CD 15 40A 36 -12,-3.4 -12,-2.9 -2,-0.3 2,-0.4 -0.990 27.4-157.5-145.5 138.0 20.9 -20.6 30.1 28 43 A Y E -CD 14 39A 1 11,-2.2 11,-2.1 -2,-0.4 2,-0.4 -0.987 4.7-173.2-126.3 133.9 18.6 -17.8 29.0 29 44 A E E -C 13 0A 72 -16,-2.3 -16,-2.4 -2,-0.4 2,-0.4 -0.955 15.0-152.5-125.9 109.2 16.4 -15.5 31.0 30 45 A S - 0 0 23 -2,-0.4 7,-0.1 7,-0.3 -18,-0.1 -0.726 11.7-157.6 -87.3 134.0 14.1 -13.2 29.1 31 46 A A S S+ 0 0 54 -2,-0.4 2,-0.3 5,-0.1 -1,-0.1 0.350 80.8 37.7 -71.7 -20.9 13.0 -9.8 30.6 32 47 A V S S+ 0 0 49 429,-0.0 -2,-0.1 427,-0.0 2,-0.1 -0.968 91.5 29.4-143.2 156.3 9.9 -9.8 28.3 33 48 A G S S- 0 0 45 -2,-0.3 2,-2.7 1,-0.1 429,-0.0 -0.265 104.4 -25.8 89.2-177.1 7.3 -12.1 26.8 34 49 A N S S+ 0 0 85 37,-0.1 2,-0.3 -2,-0.1 37,-0.2 -0.441 105.0 103.5 -77.7 70.7 5.7 -15.4 27.9 35 50 A A + 0 0 16 -2,-2.7 2,-0.3 35,-0.1 3,-0.1 -0.984 39.1 172.9-152.1 157.7 8.6 -16.3 30.0 36 51 A E - 0 0 76 -2,-0.3 33,-0.3 33,-0.1 32,-0.2 -0.904 57.9 -0.7-165.3 138.7 9.9 -16.6 33.6 37 52 A S S S- 0 0 52 -2,-0.3 -7,-0.3 -7,-0.1 2,-0.3 -0.330 101.4 -30.9 76.0-158.3 13.0 -18.1 35.2 38 53 A R - 0 0 103 -9,-0.1 2,-0.4 -2,-0.1 -9,-0.2 -0.688 50.0-162.3 -96.2 145.7 15.8 -19.8 33.2 39 54 A Y E -D 28 0A 1 -11,-2.1 -11,-2.2 -2,-0.3 2,-0.2 -0.974 26.9-108.5-124.3 143.3 15.5 -21.8 30.0 40 55 A V E -D 27 0A 75 -2,-0.4 23,-0.5 25,-0.4 2,-0.4 -0.416 36.4-167.6 -69.7 135.2 18.0 -24.3 28.5 41 56 A L E +DE 26 62A 4 -15,-2.4 -15,-1.6 -2,-0.2 2,-0.3 -0.940 10.6 179.8-119.7 156.8 19.8 -23.2 25.5 42 57 A T E +DE 25 61A 23 19,-1.7 19,-2.9 -2,-0.4 2,-0.3 -0.990 16.6 133.3-149.0 149.3 22.0 -24.9 23.0 43 58 A G E -DE 24 60A 0 -19,-2.0 -19,-2.3 -2,-0.3 2,-0.3 -0.912 37.3-105.4-167.4-166.6 23.9 -23.8 19.9 44 59 A R E -DE 23 59A 28 15,-1.9 15,-2.7 -2,-0.3 2,-0.3 -0.957 20.6-172.3-144.3 154.0 27.0 -23.8 17.8 45 60 A Y E - E 0 58A 32 -23,-1.8 2,-0.9 -2,-0.3 13,-0.2 -0.960 39.5 -94.3-148.8 155.3 29.9 -21.4 16.9 46 61 A D - 0 0 3 11,-2.2 -24,-0.1 -2,-0.3 146,-0.0 -0.618 34.1-170.5 -70.5 100.9 32.9 -21.3 14.6 47 62 A S S S+ 0 0 35 -2,-0.9 -1,-0.2 1,-0.3 -25,-0.1 0.342 82.3 40.9 -83.4 13.1 35.6 -22.6 16.9 48 63 A A S S+ 0 0 46 -26,-0.0 -1,-0.3 0, 0.0 142,-0.1 -0.462 81.7 176.6-153.0 68.9 38.2 -21.5 14.3 49 64 A P - 0 0 55 0, 0.0 7,-0.1 0, 0.0 6,-0.0 -0.278 38.6 -75.6 -77.0 167.2 37.3 -18.2 12.9 50 65 A A - 0 0 31 5,-0.3 3,-0.4 1,-0.1 140,-0.0 -0.174 28.3-136.2 -59.4 157.5 39.2 -16.1 10.3 51 66 A T S S+ 0 0 150 1,-0.2 -1,-0.1 2,-0.1 0, 0.0 0.345 87.0 87.3 -92.9 -7.1 42.4 -14.2 11.3 52 67 A D S S- 0 0 101 3,-0.1 -1,-0.2 1,-0.1 3,-0.1 0.380 112.8 -96.1 -82.1 3.3 41.4 -11.0 9.4 53 68 A G S S+ 0 0 64 -3,-0.4 166,-0.2 1,-0.2 -2,-0.1 0.519 76.4 146.1 94.0 4.0 39.4 -9.5 12.2 54 69 A S - 0 0 24 1,-0.1 164,-0.3 164,-0.1 -1,-0.2 -0.203 52.5-104.0 -61.2 164.2 36.0 -10.8 11.0 55 70 A G - 0 0 5 162,-2.0 2,-0.8 160,-0.1 -5,-0.3 -0.329 34.0 -93.9 -88.7-178.3 33.7 -11.7 13.8 56 71 A T E - F 0 81A 18 25,-3.2 25,-2.4 -7,-0.1 -1,-0.1 -0.800 34.2-136.1 -98.0 115.8 32.8 -15.2 15.0 57 72 A A E + F 0 80A 0 -2,-0.8 -11,-2.2 23,-0.2 2,-0.3 -0.292 38.3 152.5 -64.9 140.8 29.7 -16.7 13.6 58 73 A L E -EF 45 79A 0 21,-2.4 21,-2.5 -13,-0.2 2,-0.3 -0.996 22.1-170.9-161.5 165.7 27.4 -18.4 16.0 59 74 A G E -EF 44 78A 0 -15,-2.7 -15,-1.9 -2,-0.3 2,-0.3 -0.996 2.6-174.5-159.6 155.0 23.8 -19.4 16.8 60 75 A W E -EF 43 77A 0 17,-2.0 17,-2.1 -2,-0.3 2,-0.4 -0.989 11.9-142.7-152.1 160.5 21.6 -20.8 19.6 61 76 A T E -EF 42 76A 0 -19,-2.9 -19,-1.7 -2,-0.3 2,-0.4 -0.952 8.5-172.9-126.2 144.5 18.1 -22.0 20.2 62 77 A V E -EF 41 75A 0 13,-2.5 13,-2.6 -2,-0.4 2,-0.4 -0.983 9.9-158.4-131.8 123.3 15.7 -21.8 23.2 63 78 A A E - F 0 74A 7 -23,-0.5 2,-1.8 -2,-0.4 11,-0.3 -0.848 30.0-123.6 -94.3 136.9 12.4 -23.6 23.3 64 79 A W E S+ 0 0 14 9,-4.0 7,-2.7 -2,-0.4 8,-0.5 -0.302 72.4 105.6 -92.6 69.4 10.2 -21.7 25.8 65 80 A K E + F 0 70A 68 -2,-1.8 -25,-0.4 5,-0.3 5,-0.2 -0.999 30.4 143.5-140.5 127.0 9.4 -24.5 28.1 66 81 A N - 0 0 26 3,-2.9 -27,-0.1 -2,-0.4 -29,-0.0 -0.784 69.2 -72.2-141.4-165.1 10.7 -25.1 31.6 67 82 A N S S+ 0 0 162 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.729 129.4 46.8 -67.2 -14.9 9.2 -26.4 34.8 68 83 A Y S S- 0 0 155 1,-0.3 2,-0.3 -32,-0.2 -1,-0.2 0.931 120.5 -6.2 -94.4 -56.7 7.3 -23.1 35.2 69 84 A R - 0 0 86 -33,-0.3 -3,-2.9 -35,-0.0 2,-0.3 -0.862 44.3-148.0-135.3 173.2 5.7 -22.4 31.8 70 85 A N E -F 65 0A 38 -2,-0.3 -5,-0.3 -5,-0.2 -35,-0.1 -0.871 8.6-178.4-142.0 101.1 5.5 -23.4 28.2 71 86 A A E - 0 0 20 -7,-2.7 27,-0.2 -2,-0.3 -6,-0.1 0.528 43.3-127.5 -72.3 -8.1 4.9 -20.6 25.7 72 87 A H E S+ 0 0 56 -8,-0.5 26,-2.4 1,-0.2 2,-0.3 0.967 72.9 100.4 53.7 53.8 4.9 -23.3 23.0 73 88 A S E - G 0 97A 9 24,-0.2 -9,-4.0 102,-0.1 2,-0.3 -0.976 56.6-146.4-155.7 171.2 7.5 -21.5 21.0 74 89 A A E -FG 63 96A 0 22,-2.1 22,-2.8 -2,-0.3 2,-0.4 -0.992 5.8-154.4-146.1 142.4 11.1 -21.4 20.2 75 90 A T E -FG 62 95A 4 -13,-2.6 -13,-2.5 -2,-0.3 2,-0.4 -0.921 5.0-165.0-115.0 141.0 13.6 -18.6 19.4 76 91 A T E -FG 61 94A 0 18,-2.5 18,-2.3 -2,-0.4 2,-0.4 -0.999 5.1-159.0-124.3 128.6 16.8 -18.9 17.3 77 92 A W E -FG 60 93A 6 -17,-2.1 -17,-2.0 -2,-0.4 2,-0.4 -0.910 7.3-172.8-105.8 132.1 19.4 -16.2 17.4 78 93 A S E +FG 59 92A 0 14,-2.6 14,-2.2 -2,-0.4 2,-0.3 -1.000 33.3 105.0-127.6 118.5 21.9 -16.1 14.5 79 94 A G E -FG 58 91A 2 -21,-2.5 -21,-2.4 -2,-0.4 2,-0.4 -0.847 55.5 -92.4-163.8-158.0 24.8 -13.7 14.8 80 95 A Q E -FG 57 90A 11 10,-1.9 10,-2.3 -2,-0.3 2,-0.4 -0.999 22.2-129.4-146.5 146.3 28.4 -13.1 15.4 81 96 A Y E -FG 56 89A 37 -25,-2.4 -25,-3.2 -2,-0.4 2,-0.4 -0.764 21.1-166.9 -90.3 138.8 30.6 -12.3 18.3 82 97 A V E - 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