==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN 05-MAY-05 1X3G . COMPND 2 MOLECULE: SINGLE-STRAND BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM SMEGMATIS; . AUTHOR K.SAIKRISHNAN,G.P.MANJUNATH,P.SINGH,J.JEYAKANTHAN,Z.DAUTER, . 229 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13832.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 149 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 77 33.6 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 . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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-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 . 27 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 6.6 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 1 1 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 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 PARALLEL BRIDGES PER LADDER . 0 3 0 2 0 0 3 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 3 A G 0 0 131 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 53.4 11.5 45.4 42.7 2 4 A D - 0 0 107 1,-0.0 2,-0.5 75,-0.0 75,-0.0 -0.656 360.0-121.5 -85.9 143.2 12.7 42.6 40.5 3 5 A T - 0 0 101 -2,-0.3 75,-2.3 75,-0.3 2,-0.3 -0.692 36.4-171.7 -82.6 117.4 15.6 40.3 41.3 4 6 A T E -A 77 0A 86 -2,-0.5 2,-0.3 73,-0.2 73,-0.2 -0.797 6.3-169.6-113.3 158.3 18.1 40.5 38.5 5 7 A I E -A 76 0A 47 71,-1.3 71,-1.8 -2,-0.3 2,-0.4 -0.997 17.9-141.2-143.9 153.3 21.3 38.5 37.8 6 8 A T E -A 75 0A 51 -2,-0.3 2,-0.4 69,-0.2 69,-0.2 -0.921 25.0-173.0-106.9 140.1 24.3 38.6 35.5 7 9 A V E -A 74 0A 18 67,-3.3 67,-3.1 -2,-0.4 2,-0.4 -0.990 12.6-167.0-140.3 130.0 25.5 35.2 34.2 8 10 A V E +A 73 0A 31 -2,-0.4 2,-0.3 65,-0.2 65,-0.2 -0.926 39.4 99.8-110.6 136.2 28.5 34.2 32.3 9 11 A G E -A 72 0A 2 63,-1.8 63,-2.6 -2,-0.4 2,-0.3 -0.981 64.1 -71.0 173.0-173.2 28.8 30.9 30.7 10 12 A N E -AB 71 32A 63 22,-2.2 22,-2.6 -2,-0.3 61,-0.2 -0.786 42.9-110.2-109.2 148.4 28.4 28.8 27.5 11 13 A L E - B 0 31A 4 59,-1.8 58,-2.6 56,-0.3 20,-0.2 -0.500 19.3-151.9 -74.4 143.4 25.3 27.9 25.7 12 14 A T S S+ 0 0 55 18,-2.0 2,-0.3 1,-0.3 56,-0.1 0.546 75.3 7.8 -91.5 -7.3 24.5 24.2 25.9 13 15 A A S S- 0 0 49 17,-0.3 -1,-0.3 54,-0.2 17,-0.3 -0.873 93.8 -77.2-173.6 139.3 22.7 24.0 22.7 14 16 A D - 0 0 92 -2,-0.3 53,-0.2 -3,-0.1 49,-0.1 0.163 63.3 -91.3 -35.9 142.8 22.0 26.1 19.6 15 17 A P - 0 0 23 0, 0.0 2,-0.7 0, 0.0 14,-0.2 -0.327 32.9-134.7 -63.2 156.1 19.3 28.7 20.2 16 18 A E - 0 0 110 12,-1.7 12,-0.5 -3,-0.1 2,-0.1 -0.763 20.7-164.9-115.8 81.5 15.7 27.7 19.4 17 19 A L + 0 0 50 -2,-0.7 2,-0.3 10,-0.2 10,-0.2 -0.464 15.1 169.6 -66.5 140.4 14.1 30.5 17.4 18 20 A R E -C 26 0A 157 8,-1.6 8,-2.6 -2,-0.1 2,-0.4 -0.972 25.9-133.5-145.6 155.5 10.3 30.2 17.1 19 21 A F E -C 25 0A 119 -2,-0.3 6,-0.2 6,-0.2 -2,-0.0 -0.945 12.9-136.6-114.2 132.0 7.6 32.5 16.0 20 22 A T > - 0 0 32 4,-3.3 3,-2.0 -2,-0.4 4,-0.1 -0.623 29.3-117.6 -74.5 145.6 4.3 33.2 17.8 21 23 A P T 3 S+ 0 0 142 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.569 115.3 71.4 -61.9 -6.8 1.3 33.2 15.3 22 24 A S T 3 S- 0 0 105 2,-0.1 3,-0.1 0, 0.0 -2,-0.0 0.205 122.5-106.7 -89.0 8.7 1.0 36.9 16.4 23 25 A G S < S+ 0 0 60 -3,-2.0 2,-0.2 1,-0.3 -4,-0.0 0.411 78.5 130.7 79.4 1.8 4.2 37.5 14.4 24 26 A A - 0 0 19 -4,-0.1 -4,-3.3 1,-0.0 2,-0.3 -0.615 50.1-133.5 -88.7 147.8 6.5 38.0 17.5 25 27 A A E -C 19 0A 3 -2,-0.2 31,-1.9 -6,-0.2 2,-0.3 -0.794 19.9-169.3-106.2 145.8 9.8 36.1 17.6 26 28 A V E -CD 18 55A 12 -8,-2.6 -8,-1.6 -2,-0.3 2,-0.4 -0.993 8.8-158.3-137.7 137.2 11.3 34.2 20.6 27 29 A A E - D 0 54A 0 27,-2.6 27,-1.7 -2,-0.3 2,-0.4 -0.933 5.8-171.4-118.5 134.6 14.6 32.6 21.5 28 30 A N E + D 0 53A 60 -12,-0.5 -12,-1.7 -2,-0.4 2,-0.3 -0.979 20.3 145.2-122.7 132.0 15.2 29.9 24.1 29 31 A F E - D 0 52A 7 23,-1.9 23,-2.1 -2,-0.4 2,-0.5 -0.956 35.9-133.8-157.6 147.0 18.6 28.8 25.2 30 32 A T E - D 0 51A 44 -17,-0.3 -18,-2.0 -2,-0.3 2,-0.4 -0.944 15.2-143.4-112.8 135.9 20.1 27.6 28.4 31 33 A V E -BD 11 50A 1 19,-1.9 19,-2.2 -2,-0.5 2,-0.5 -0.768 4.7-157.1 -92.4 135.4 23.3 28.8 29.8 32 34 A A E -BD 10 49A 15 -22,-2.6 -22,-2.2 -2,-0.4 2,-0.5 -0.957 12.5-169.5-109.4 122.2 25.8 26.6 31.7 33 35 A S E - D 0 48A 30 15,-2.2 15,-1.3 -2,-0.5 -24,-0.2 -0.959 5.1-177.7-116.3 130.3 28.0 28.5 34.0 34 36 A T - 0 0 67 -2,-0.5 13,-0.1 13,-0.2 12,-0.1 -0.892 20.1-137.5-138.8 113.9 31.0 26.8 35.6 35 37 A P - 0 0 64 0, 0.0 10,-0.1 0, 0.0 2,-0.1 -0.055 21.3-173.2 -52.2 161.5 33.5 28.1 38.1 36 38 A R + 0 0 72 8,-0.1 9,-0.1 7,-0.1 2,-0.1 -0.414 9.8 171.8-166.4 84.9 37.2 27.2 37.5 37 39 A M - 0 0 145 7,-0.6 7,-0.3 1,-0.1 2,-0.2 -0.404 29.4-124.2 -84.0 171.6 40.1 28.0 39.9 38 40 A F + 0 0 67 5,-0.2 5,-0.3 -2,-0.1 -1,-0.1 -0.638 47.7 31.3-120.7 172.1 43.6 26.5 39.2 39 41 A D 0 0 142 3,-1.6 4,-0.1 -2,-0.2 -1,-0.1 0.873 360.0 360.0 61.7 127.7 46.6 24.4 40.3 40 42 A R 0 0 138 2,-0.2 3,-0.1 0, 0.0 -2,-0.0 0.986 360.0 360.0 70.1 360.0 47.0 21.3 42.7 41 ! 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 42 47 A W 0 0 50 0, 0.0 -3,-1.6 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 117.5 43.4 22.4 40.7 43 48 A K + 0 0 84 -5,-0.3 -5,-0.2 1,-0.2 -7,-0.1 -0.883 360.0 9.9-177.7 151.2 40.8 23.0 38.0 44 49 A D + 0 0 124 -7,-0.3 -7,-0.6 -2,-0.2 -1,-0.2 -0.000 50.1 178.1 70.0-174.7 37.0 23.0 37.5 45 50 A G - 0 0 31 1,-0.4 -1,-0.1 -10,-0.1 0, 0.0 -0.026 40.7 -17.7 138.5 120.8 34.2 22.9 40.1 46 51 A E - 0 0 84 -12,-0.1 -1,-0.4 1,-0.1 2,-0.3 0.282 57.0-139.6 57.2 177.5 30.4 23.0 40.3 47 52 A A - 0 0 52 -13,-0.1 2,-0.4 2,-0.0 -13,-0.2 -0.975 8.2-151.7-171.3 161.3 27.9 24.2 37.5 48 53 A L E -D 33 0A 89 -15,-1.3 -15,-2.2 -2,-0.3 2,-0.5 -0.979 5.0-163.7-149.0 124.2 24.6 26.2 36.9 49 54 A F E -D 32 0A 136 -2,-0.4 2,-0.5 -17,-0.2 -17,-0.2 -0.969 10.3-175.1-117.5 121.3 22.1 25.7 34.2 50 55 A L E -D 31 0A 20 -19,-2.2 -19,-1.9 -2,-0.5 2,-0.4 -0.963 22.2-137.2-120.6 120.1 19.6 28.5 33.6 51 56 A R E -De 30 95A 112 43,-0.6 45,-1.8 -2,-0.5 2,-0.3 -0.615 33.7-170.4 -70.9 125.8 16.8 28.3 31.1 52 57 A C E -De 29 96A 4 -23,-2.1 -23,-1.9 -2,-0.4 2,-0.3 -0.888 15.3-174.0-122.0 151.8 16.7 31.6 29.4 53 58 A N E -De 28 97A 15 43,-1.7 45,-1.6 -2,-0.3 2,-0.3 -0.988 1.3-173.4-145.5 139.2 14.4 33.4 27.0 54 59 A I E -D 27 0A 6 -27,-1.7 -27,-2.6 -2,-0.3 2,-0.2 -0.953 14.4-145.5-129.6 147.2 14.5 36.6 25.0 55 60 A W E -D 26 0A 129 -2,-0.3 4,-0.4 43,-0.3 3,-0.4 -0.688 46.5 -3.1-116.3 165.5 11.8 38.3 22.9 56 61 A R S > S- 0 0 162 -31,-1.9 4,-1.1 -2,-0.2 3,-0.5 -0.240 116.0 -7.4 68.7-140.4 11.4 40.4 19.7 57 62 A E H >> S+ 0 0 132 1,-0.2 4,-1.7 2,-0.2 3,-1.2 0.961 130.7 57.5 -56.1 -56.2 14.3 41.7 17.5 58 63 A A H 3> S+ 0 0 9 -3,-0.4 4,-2.8 1,-0.3 -1,-0.2 0.776 99.7 60.3 -44.2 -38.3 17.1 40.5 19.9 59 64 A A H 3> S+ 0 0 0 -3,-0.5 4,-2.4 -4,-0.4 -1,-0.3 0.928 105.1 47.8 -62.6 -43.7 15.8 37.0 19.7 60 65 A E H X S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.3 3,-1.0 0.985 107.8 47.8 -59.2 -56.5 20.6 35.9 19.0 63 68 A A H 3< S+ 0 0 34 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.711 116.2 46.1 -60.3 -21.0 19.6 32.9 16.8 64 69 A E H 3< S+ 0 0 150 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.726 119.5 36.4 -88.9 -24.3 21.7 34.2 14.1 65 70 A S H << S+ 0 0 10 -4,-1.7 164,-0.4 -3,-1.0 2,-0.3 0.747 108.2 60.3-101.7 -31.1 24.9 35.1 16.1 66 71 A L < + 0 0 4 -4,-2.7 2,-0.2 -5,-0.2 3,-0.0 -0.783 51.6 172.7-113.7 153.6 25.2 32.4 18.7 67 72 A T > - 0 0 67 -2,-0.3 3,-1.6 -53,-0.2 -56,-0.3 -0.737 48.3 -52.3-135.9-174.9 25.6 28.6 18.7 68 73 A R T 3 S+ 0 0 160 1,-0.2 -56,-0.2 -2,-0.2 3,-0.1 -0.453 123.6 19.1 -61.7 133.5 26.2 25.7 21.1 69 74 A G T 3 S+ 0 0 21 -58,-2.6 -1,-0.2 1,-0.3 2,-0.1 0.227 85.4 144.6 88.6 -12.3 29.2 26.4 23.2 70 75 A S < - 0 0 12 -3,-1.6 -59,-1.8 -60,-0.1 2,-0.8 -0.374 51.6-127.8 -59.8 130.7 29.3 30.1 22.7 71 76 A R E +A 10 0A 62 -61,-0.2 33,-3.6 33,-0.2 2,-0.3 -0.727 39.5 176.7 -81.9 112.5 30.5 32.0 25.8 72 77 A V E -AF 9 103A 0 -63,-2.6 -63,-1.8 -2,-0.8 2,-0.5 -0.796 31.0-137.7-116.4 154.9 27.8 34.7 26.4 73 78 A I E -AF 8 102A 0 29,-3.1 29,-2.0 -2,-0.3 2,-0.4 -0.986 28.8-169.9-108.9 124.5 27.2 37.3 29.0 74 79 A V E -AF 7 101A 4 -67,-3.1 -67,-3.3 -2,-0.5 2,-0.4 -0.952 12.0-176.8-120.0 132.7 23.6 37.4 30.1 75 80 A T E +AF 6 100A 17 25,-2.2 24,-2.8 -2,-0.4 25,-1.2 -0.985 32.0 100.5-124.9 139.1 21.8 39.9 32.2 76 81 A G E -AF 5 98A 0 -71,-1.8 -71,-1.3 -2,-0.4 2,-0.4 -0.891 59.7 -46.0-177.3-152.2 18.1 39.6 33.2 77 82 A R E -AF 4 97A 75 20,-1.5 20,-2.1 -2,-0.3 2,-0.8 -0.938 39.2-126.9-121.7 137.7 15.3 38.8 35.6 78 83 A L E - F 0 96A 62 -75,-2.3 2,-0.3 -2,-0.4 -75,-0.3 -0.703 30.6-174.8 -86.8 108.1 14.9 35.7 37.7 79 84 A K E - F 0 95A 78 16,-2.9 16,-2.9 -2,-0.8 2,-0.3 -0.780 1.2-170.2-104.5 144.8 11.5 34.2 37.1 80 85 A Q E - F 0 94A 133 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.995 7.7-169.1-141.4 135.9 10.2 31.2 39.1 81 86 A R E - F 0 93A 180 12,-2.1 12,-2.4 -2,-0.3 2,-0.9 -0.981 16.5-146.3-124.2 137.9 7.2 28.9 38.8 82 87 A S - 0 0 102 -2,-0.4 10,-0.2 10,-0.2 2,-0.1 -0.762 31.0-176.8 -96.9 88.6 5.8 26.2 41.3 83 88 A F + 0 0 48 -2,-0.9 8,-0.9 7,-0.1 7,-0.1 -0.357 34.7 11.4 -83.4 162.6 4.4 23.4 39.1 84 89 A E + 0 0 57 6,-0.2 7,-0.2 -2,-0.1 0, 0.0 0.715 33.9 150.3 49.7 156.0 2.5 20.2 40.1 85 90 A T > + 0 0 109 5,-0.1 3,-1.3 4,-0.0 -1,-0.1 0.129 69.3 81.6 176.1 -30.6 0.9 18.8 43.2 86 91 A R T 3 S+ 0 0 116 1,-0.2 -2,-0.0 2,-0.0 3,-0.0 0.371 93.4 55.2 -69.6 -3.0 -1.8 16.7 41.6 87 92 A E T 3 S- 0 0 88 0, 0.0 2,-0.5 0, 0.0 -1,-0.2 0.329 118.8-114.2-104.1 -1.1 1.0 14.1 41.2 88 93 A G S < S+ 0 0 62 -3,-1.3 -2,-0.0 1,-0.1 0, 0.0 -0.432 88.4 97.2 97.8 -54.0 1.8 14.2 45.0 89 94 A E S S- 0 0 76 -2,-0.5 -1,-0.1 1,-0.1 -5,-0.1 0.824 70.6-132.6 -37.1-131.6 5.2 15.8 44.5 90 95 A K - 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