==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 14-FEB-13 4J8Q . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES FRAGILIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 194 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11059.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 126 64.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 64 33.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.5 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 . 22 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 2.1 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 . 1 0 1 1 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 PARALLEL BRIDGES PER LADDER . 0 0 1 0 0 5 0 1 0 0 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 1 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 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 26 A D 0 0 151 0, 0.0 2,-0.9 0, 0.0 59,-0.0 0.000 360.0 360.0 360.0-171.1 -3.2 53.4 22.9 2 27 A G + 0 0 78 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.760 360.0 145.5 -96.2 81.1 -6.2 54.8 24.9 3 28 A Y - 0 0 56 -2,-0.9 2,-0.3 55,-0.2 55,-0.1 -0.836 35.2-151.6-111.3 154.4 -4.3 56.4 27.9 4 29 A S > - 0 0 72 -2,-0.3 3,-0.9 53,-0.1 -2,-0.0 -0.882 25.7-124.6-115.0 157.8 -5.0 59.5 29.9 5 30 A L T 3 S+ 0 0 149 -2,-0.3 -1,-0.1 1,-0.2 53,-0.0 0.736 112.8 59.1 -70.6 -23.1 -2.5 61.7 31.6 6 31 A G T 3 S+ 0 0 74 2,-0.0 -1,-0.2 50,-0.0 2,-0.1 0.664 85.5 105.7 -73.3 -17.5 -4.4 61.1 34.8 7 32 A D < - 0 0 78 -3,-0.9 2,-0.3 50,-0.1 -4,-0.0 -0.358 49.9-165.4 -76.5 143.1 -4.0 57.4 34.7 8 33 A I - 0 0 104 48,-0.1 2,-0.3 -2,-0.1 48,-0.2 -0.931 5.9-177.2-121.3 150.1 -1.6 55.4 36.9 9 34 A A E -A 55 0A 15 46,-2.0 46,-2.3 -2,-0.3 2,-0.3 -0.942 8.2-153.5-138.3 161.8 -0.3 51.8 36.6 10 35 A V E +A 54 0A 53 -2,-0.3 2,-0.3 44,-0.2 44,-0.2 -0.963 18.9 153.5-134.7 153.0 1.9 49.5 38.6 11 36 A D E -A 53 0A 4 42,-1.5 42,-2.4 -2,-0.3 2,-0.4 -0.939 42.1-106.9-158.7 170.1 4.1 46.5 37.9 12 37 A W E +A 52 0A 21 -2,-0.3 16,-2.6 40,-0.2 2,-0.3 -0.889 49.2 171.6 -98.6 143.1 7.2 44.7 39.3 13 38 A A E -AB 51 27A 0 38,-2.6 38,-2.4 -2,-0.4 2,-0.5 -0.942 35.8-119.7-151.2 166.7 10.3 45.3 37.3 14 39 A T E -AB 50 26A 20 12,-1.7 12,-2.9 -2,-0.3 2,-0.3 -0.945 33.8-125.3-114.6 127.4 14.0 44.9 37.0 15 40 A V E - B 0 25A 1 34,-3.1 33,-2.9 -2,-0.5 2,-0.5 -0.559 22.3-167.4 -75.4 133.2 16.2 48.0 36.6 16 41 A R E - B 0 24A 156 8,-2.8 8,-2.9 -2,-0.3 2,-0.5 -0.992 15.6-138.7-121.0 122.0 18.5 48.1 33.6 17 42 A V E + B 0 23A 36 -2,-0.5 6,-0.3 6,-0.2 3,-0.1 -0.716 22.8 176.1 -88.7 128.0 21.1 50.8 33.6 18 43 A V E - 0 0 80 4,-2.4 2,-0.2 -2,-0.5 5,-0.2 0.913 68.7 -13.5 -91.6 -59.8 21.8 52.6 30.3 19 44 A G E > S- B 0 22A 46 3,-1.4 3,-1.6 1,-0.0 2,-0.9 -0.731 105.1 -58.3-156.5 100.5 24.3 55.3 31.0 20 45 A G T 3 S+ 0 0 65 1,-0.3 -2,-0.0 -2,-0.2 -1,-0.0 -0.546 129.6 0.0 66.6-103.0 25.4 56.5 34.5 21 46 A D T 3 S+ 0 0 105 -2,-0.9 2,-0.4 23,-0.1 -1,-0.3 0.412 110.8 100.0 -99.8 -0.9 22.0 57.7 36.0 22 47 A T E < +B 19 0A 68 -3,-1.6 -4,-2.4 22,-0.1 -3,-1.4 -0.743 50.7 165.1 -89.2 135.9 19.8 56.9 33.0 23 48 A Y E -B 17 0A 17 -2,-0.4 2,-0.3 -6,-0.3 -6,-0.2 -0.921 28.7-146.5-146.4 160.7 17.9 53.6 33.2 24 49 A S E -B 16 0A 9 -8,-2.9 -8,-2.8 -2,-0.3 2,-0.4 -0.848 20.9-128.9-123.2 167.3 15.0 51.6 31.8 25 50 A L E -BC 15 33A 0 8,-2.0 8,-3.1 -2,-0.3 2,-0.8 -0.974 4.4-150.7-120.6 132.7 12.7 49.2 33.6 26 51 A N E -BC 14 32A 87 -12,-2.9 -12,-1.7 -2,-0.4 2,-0.3 -0.838 25.7-159.8-103.4 95.7 12.0 45.7 32.5 27 52 A A E > -BC 13 31A 4 4,-2.2 4,-1.6 -2,-0.8 -14,-0.2 -0.566 20.1-134.0 -88.7 139.3 8.4 45.1 33.7 28 53 A D T 4 S+ 0 0 41 -16,-2.6 81,-0.3 -2,-0.3 -1,-0.1 0.822 102.1 12.6 -59.3 -39.3 6.9 41.6 34.2 29 54 A R T 4 S+ 0 0 168 -17,-0.3 -1,-0.2 2,-0.1 -18,-0.1 0.749 132.1 45.2-107.5 -38.0 3.6 42.4 32.5 30 55 A W T 4 S- 0 0 60 1,-0.3 -2,-0.2 37,-0.0 2,-0.1 0.603 94.6-144.9 -87.2 -15.4 4.1 45.7 30.7 31 56 A G E < +C 27 0A 16 -4,-1.6 -4,-2.2 35,-0.1 -1,-0.3 -0.450 56.4 2.7 80.3-155.6 7.5 44.8 29.2 32 57 A T E -C 26 0A 38 -6,-0.2 35,-1.7 -2,-0.1 2,-0.5 -0.456 66.1-160.2 -76.4 133.1 10.3 47.4 28.7 33 58 A L E -Cd 25 67A 0 -8,-3.1 -8,-2.0 -2,-0.2 35,-0.2 -0.959 5.3-157.7-118.3 119.7 9.6 50.9 30.0 34 59 A W E - d 0 68A 53 33,-2.8 35,-2.5 -2,-0.5 2,-1.5 -0.840 20.7-131.5 -90.5 124.6 11.5 54.0 28.9 35 60 A P E + d 0 69A 25 0, 0.0 35,-0.2 0, 0.0 -12,-0.1 -0.577 34.5 166.8 -76.9 87.7 11.3 57.0 31.3 36 61 A A E S+ 0 0 54 -2,-1.5 2,-0.3 33,-1.4 34,-0.2 0.807 76.6 3.2 -66.7 -29.8 10.4 59.9 29.0 37 62 A A E S- d 0 70A 43 32,-1.5 34,-1.9 -3,-0.2 2,-0.3 -0.927 72.0-164.9-146.3 172.4 9.6 61.8 32.2 38 63 A T E - d 0 71A 53 -2,-0.3 34,-0.2 32,-0.3 17,-0.0 -0.993 30.8-150.6-161.4 148.8 9.9 61.3 36.0 39 64 A A S S+ 0 0 49 32,-2.2 33,-0.1 -2,-0.3 -1,-0.1 0.273 100.7 55.1 -96.5 5.3 8.8 62.6 39.4 40 65 A I > + 0 0 45 31,-0.3 3,-1.4 1,-0.1 -1,-0.2 -0.565 56.4 159.9-138.5 70.3 12.1 61.3 40.9 41 66 A P T 3 S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.711 75.1 57.4 -68.9 -18.5 15.0 62.7 38.9 42 67 A F T 3 S+ 0 0 177 2,-0.1 2,-0.2 0, 0.0 -2,-0.0 0.215 75.2 130.2 -96.9 15.1 17.6 62.0 41.8 43 68 A Y < - 0 0 35 -3,-1.4 -3,-0.0 1,-0.1 0, 0.0 -0.516 53.1-141.5 -67.2 130.4 16.8 58.3 41.8 44 69 A K - 0 0 147 -2,-0.2 2,-0.2 2,-0.0 -23,-0.1 -0.845 17.0-148.2 -99.7 106.6 20.0 56.2 41.7 45 70 A P - 0 0 12 0, 0.0 2,-0.4 0, 0.0 -23,-0.0 -0.501 9.6-163.2 -76.5 143.0 19.5 53.1 39.5 46 71 A I > - 0 0 103 -2,-0.2 3,-2.2 3,-0.1 -31,-0.3 -0.994 29.0-114.1-122.9 124.2 21.3 49.7 40.2 47 72 A D T 3 S+ 0 0 93 -2,-0.4 -31,-0.2 1,-0.3 3,-0.1 -0.293 101.5 15.2 -55.1 131.8 21.4 47.2 37.4 48 73 A G T 3 S+ 0 0 29 -33,-2.9 -1,-0.3 1,-0.3 2,-0.2 0.256 87.9 141.8 86.1 -11.6 19.4 44.1 38.4 49 74 A Q < - 0 0 41 -3,-2.2 -34,-3.1 -34,-0.2 2,-0.3 -0.456 45.8-138.1 -62.8 130.2 17.6 45.8 41.2 50 75 A R E +AE 14 77A 1 27,-0.6 27,-3.0 -36,-0.2 2,-0.3 -0.737 30.0 172.8 -88.1 142.7 14.0 44.7 41.5 51 76 A V E -AE 13 76A 0 -38,-2.4 -38,-2.6 -2,-0.3 2,-0.6 -0.962 40.9-122.7-144.9 154.8 11.4 47.3 42.2 52 77 A I E -AE 12 75A 12 23,-2.6 23,-2.5 -2,-0.3 2,-0.5 -0.958 43.0-161.0 -93.8 118.5 7.7 48.0 42.4 53 78 A T E -AE 11 74A 0 -42,-2.4 -42,-1.5 -2,-0.6 2,-0.4 -0.905 15.2-163.6-112.9 128.5 7.3 50.8 39.9 54 79 A Y E +AE 10 73A 84 19,-2.6 18,-3.4 -2,-0.5 19,-1.6 -0.928 27.7 155.4-107.3 132.7 4.3 53.2 39.7 55 80 A F E -AE 9 71A 0 -46,-2.3 -46,-2.0 -2,-0.4 16,-0.2 -0.995 45.2-120.6-159.0 153.7 4.1 55.1 36.4 56 81 A N E - E 0 70A 16 14,-2.9 14,-2.3 -2,-0.3 2,-0.2 -0.904 36.0-133.2-100.8 114.0 1.8 56.9 34.0 57 82 A P E + E 0 69A 5 0, 0.0 12,-0.2 0, 0.0 -50,-0.1 -0.494 33.1 166.2 -70.2 136.4 1.9 55.2 30.6 58 83 A L E + 0 0 43 10,-2.6 2,-0.3 1,-0.3 11,-0.2 0.784 54.3 2.9-113.3 -56.8 2.3 57.7 27.6 59 84 A Y E - E 0 68A 147 9,-1.8 9,-1.5 3,-0.0 2,-0.4 -0.845 57.0-129.4-132.9 168.2 3.2 55.9 24.3 60 85 A D E S+ E 0 67A 46 -2,-0.3 7,-0.3 7,-0.2 6,-0.1 -0.925 84.5 13.3-117.9 148.6 3.7 52.4 22.8 61 86 A N E S+ 0 0 134 5,-1.9 2,-0.7 -2,-0.4 -1,-0.2 0.960 76.6 175.1 54.0 59.2 6.7 51.3 20.8 62 87 A Y E > - E 0 65A 85 3,-1.5 3,-2.2 -3,-0.2 -1,-0.2 -0.885 64.9 -35.5-102.2 107.1 8.9 54.2 21.6 63 88 A E T 3 S- 0 0 137 -2,-0.7 -1,-0.2 1,-0.3 3,-0.1 0.840 125.6 -40.3 52.9 45.9 12.5 53.9 20.2 64 89 A G T 3 S+ 0 0 79 1,-0.3 2,-0.3 -3,-0.1 -1,-0.3 0.346 116.6 112.1 86.6 -5.5 12.7 50.1 20.7 65 90 A Y E < S- E 0 62A 58 -3,-2.2 -3,-1.5 1,-0.1 -1,-0.3 -0.766 72.5-129.2 -98.3 147.2 11.0 50.2 24.1 66 91 A D E S+ 0 0 71 -2,-0.3 -5,-1.9 -34,-0.3 2,-0.3 0.838 89.9 3.0 -63.8 -33.5 7.5 48.6 24.6 67 92 A H E -dE 33 60A 26 -35,-1.7 -33,-2.8 -7,-0.3 2,-0.4 -0.992 58.8-140.2-146.5 152.2 6.3 51.8 26.2 68 93 A A E +dE 34 59A 0 -9,-1.5 -10,-2.6 -2,-0.3 -9,-1.8 -0.954 39.0 167.4-104.9 138.4 7.4 55.3 27.2 69 94 A V E -dE 35 57A 0 -35,-2.5 -32,-1.5 -2,-0.4 -33,-1.4 -0.882 42.1-113.3-139.9 166.2 6.1 56.4 30.6 70 95 A K E -dE 37 56A 75 -14,-2.3 -14,-2.9 -2,-0.3 2,-0.3 -0.974 37.3-137.9-100.3 120.5 6.4 59.0 33.4 71 96 A V E +dE 38 55A 0 -34,-1.9 -32,-2.2 -2,-0.6 -16,-0.3 -0.620 26.8 174.2 -75.9 133.1 7.8 57.2 36.4 72 97 A E E - 0 0 41 -18,-3.4 2,-0.3 1,-0.4 -17,-0.2 0.799 65.0 -1.5-104.3 -48.4 6.1 58.2 39.7 73 98 A H E - E 0 54A 81 -19,-1.6 -19,-2.6 2,-0.0 2,-0.4 -0.995 47.0-164.7-145.0 142.1 7.7 55.9 42.3 74 99 A N E - E 0 53A 15 -2,-0.3 2,-0.6 -21,-0.2 -21,-0.2 -0.812 14.9-167.0-125.3 92.7 10.3 53.1 42.3 75 100 A Y E - E 0 52A 87 -23,-2.5 -23,-2.6 -2,-0.4 2,-0.1 -0.680 24.3-126.1 -81.7 117.1 10.1 51.2 45.6 76 101 A N E - E 0 51A 81 -2,-0.6 2,-0.4 -25,-0.2 -25,-0.3 -0.418 22.0-155.1 -68.8 134.2 13.1 49.0 45.9 77 102 A V E - E 0 50A 2 -27,-3.0 -27,-0.6 -2,-0.1 85,-0.2 -0.931 29.6-100.3-110.2 136.1 12.4 45.3 46.5 78 103 A L E -f 162 0B 84 83,-1.2 85,-3.2 -2,-0.4 2,-0.5 -0.364 41.4-154.9 -56.0 123.6 14.9 43.0 48.2 79 104 A T E +f 163 0B 43 83,-0.2 2,-0.3 -2,-0.2 85,-0.2 -0.916 23.2 157.6-116.8 123.2 16.5 41.1 45.4 80 105 A K E -f 164 0B 40 83,-2.7 85,-3.1 -2,-0.5 2,-0.2 -0.859 32.1-119.7-143.1 167.0 18.1 37.7 46.1 81 106 A Q E -f 165 0B 102 -2,-0.3 46,-0.5 83,-0.2 2,-0.4 -0.595 39.8 -93.7-101.3 166.9 19.2 34.3 44.6 82 107 A V - 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