==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 13-JUL-08 3DSM . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN BACUNI_02894; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES UNIFORMIS; . AUTHOR F.FOROUHAR,S.LEW,J.SEETHARAMAN,L.MAO,H.JANJUA,R.XIAO,E.L.FOO . 327 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14248.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 198 60.6 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 . 140 42.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 19 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 1 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 . 5 1 3 1 7 8 0 0 0 0 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 7 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 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 15 A A 0 0 82 0, 0.0 2,-0.0 0, 0.0 319,-0.0 0.000 360.0 360.0 360.0 154.4 14.3 19.6 31.7 2 16 A S + 0 0 51 320,-0.1 23,-0.3 21,-0.0 2,-0.3 -0.307 360.0 162.7 -66.1 148.7 15.4 20.4 28.2 3 17 A G E -A 320 0A 1 317,-2.2 317,-2.9 20,-0.1 2,-0.4 -0.948 32.7-121.8-157.2 176.9 15.5 24.0 27.1 4 18 A L E -AB 319 22A 0 18,-2.5 18,-3.2 -2,-0.3 2,-0.3 -0.987 15.0-153.3-135.0 125.2 16.7 26.6 24.7 5 19 A F E -AB 318 21A 0 313,-3.2 313,-1.9 -2,-0.4 2,-0.4 -0.730 8.5-165.7 -94.2 146.7 18.8 29.7 25.3 6 20 A I E -AB 317 20A 0 14,-2.3 14,-2.4 -2,-0.3 2,-0.3 -0.976 8.0-151.0-133.7 116.1 18.5 32.7 23.0 7 21 A T E -AB 316 19A 2 309,-2.2 308,-1.6 -2,-0.4 309,-1.1 -0.660 8.1-153.3 -86.4 146.0 21.1 35.5 23.2 8 22 A N E -AB 314 18A 0 10,-2.3 10,-1.3 -2,-0.3 38,-0.8 -0.967 8.1-157.3-124.3 115.9 20.0 39.0 22.2 9 23 A E - 0 0 30 304,-2.3 36,-1.3 -2,-0.5 7,-0.2 0.850 24.4-167.2 -57.6 -37.8 22.6 41.5 20.8 10 24 A G - 0 0 3 302,-2.6 2,-0.4 303,-0.2 -1,-0.1 -0.447 45.4 -40.9 74.6-159.7 20.6 44.5 21.8 11 25 A N > - 0 0 39 -2,-0.1 3,-2.2 1,-0.1 4,-0.5 -0.840 67.4 -96.8-107.6 140.4 21.9 47.7 20.2 12 26 A F T 3 S+ 0 0 137 -2,-0.4 -2,-0.1 1,-0.3 -1,-0.1 -0.274 108.3 2.7 -55.7 128.4 25.5 48.6 19.8 13 27 A Q T 3 S+ 0 0 155 1,-0.1 -1,-0.3 49,-0.1 31,-0.1 0.645 109.5 95.7 68.9 16.6 26.7 51.0 22.6 14 28 A Y S < S- 0 0 165 -3,-2.2 -2,-0.2 29,-0.0 -1,-0.1 0.481 78.1-145.2-109.1 -9.0 23.2 50.7 24.2 15 29 A S + 0 0 56 -4,-0.5 28,-0.2 1,-0.1 29,-0.2 0.876 59.2 127.2 41.9 50.5 24.3 48.0 26.6 16 30 A N + 0 0 30 -5,-0.5 296,-0.4 -7,-0.2 28,-0.2 0.029 25.1 137.8-121.4 25.4 20.8 46.4 26.3 17 31 A A B -D 43 0B 3 26,-1.7 25,-0.5 -8,-0.2 26,-0.5 -0.418 30.2-178.4 -69.5 147.6 21.8 42.9 25.4 18 32 A T E -B 8 0A 22 -10,-1.3 -10,-2.3 294,-0.2 2,-0.4 -0.938 25.0-125.5-145.6 168.4 19.8 40.2 27.2 19 33 A L E -B 7 0A 0 -2,-0.3 14,-2.3 -12,-0.2 15,-0.4 -0.955 21.9-167.6-119.9 134.6 19.5 36.4 27.6 20 34 A S E -B 6 0A 0 -14,-2.4 -14,-2.3 -2,-0.4 2,-0.4 -0.862 6.4-156.5-119.2 155.6 16.2 34.5 27.1 21 35 A Y E -BC 5 30A 33 9,-2.4 9,-2.3 -2,-0.3 2,-0.4 -0.981 9.7-167.4-136.0 122.1 15.3 30.9 28.0 22 36 A Y E -BC 4 29A 0 -18,-3.2 -18,-2.5 -2,-0.4 7,-0.2 -0.885 13.6-150.9-113.9 139.9 12.6 29.0 26.3 23 37 A D E >>> - C 0 28A 37 5,-2.4 4,-2.5 -2,-0.4 5,-1.0 -0.916 5.1-164.4-108.6 105.5 10.9 25.7 27.3 24 38 A P T 345S+ 0 0 21 0, 0.0 -1,-0.1 0, 0.0 -21,-0.1 0.761 87.9 58.0 -60.4 -26.3 9.7 23.8 24.2 25 39 A A T 345S+ 0 0 93 -23,-0.3 -22,-0.1 1,-0.2 -2,-0.0 0.832 120.7 25.3 -74.6 -32.5 7.6 21.5 26.3 26 40 A T T <45S- 0 0 76 -3,-0.7 -1,-0.2 2,-0.2 3,-0.1 0.585 97.2-132.3-105.2 -14.4 5.5 24.4 27.8 27 41 A C T <5 + 0 0 47 -4,-2.5 2,-0.4 1,-0.3 280,-0.1 0.813 61.0 138.4 63.9 31.9 6.1 26.9 25.0 28 42 A E E < -C 23 0A 133 -5,-1.0 -5,-2.4 280,-0.0 2,-0.4 -0.902 36.9-161.6-111.8 135.9 7.0 29.5 27.7 29 43 A V E -C 22 0A 41 -2,-0.4 2,-0.4 -7,-0.2 -7,-0.2 -0.908 4.8-157.0-118.3 144.9 9.8 32.0 27.4 30 44 A E E -C 21 0A 72 -9,-2.3 -9,-2.4 -2,-0.4 3,-0.3 -0.976 14.1-154.3-119.5 132.8 11.5 34.0 30.1 31 45 A N + 0 0 46 -2,-0.4 -11,-0.2 -11,-0.2 5,-0.1 -0.741 69.3 17.4-108.8 156.2 13.3 37.2 29.2 32 46 A E S > S+ 0 0 102 -13,-0.3 4,-2.3 -2,-0.3 -1,-0.2 0.868 72.9 155.6 54.8 41.2 16.2 39.0 30.9 33 47 A V H > + 0 0 1 -14,-2.3 4,-1.4 -3,-0.3 5,-0.1 0.804 65.7 54.2 -69.0 -29.8 17.1 35.8 32.7 34 48 A F H > S+ 0 0 1 -15,-0.4 4,-2.2 2,-0.2 5,-0.3 0.966 113.0 41.9 -68.3 -50.6 20.7 36.7 33.3 35 49 A Y H > S+ 0 0 118 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.896 112.9 53.5 -63.0 -41.6 19.9 40.0 34.9 36 50 A R H < S+ 0 0 141 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.830 116.4 39.5 -64.5 -29.5 17.0 38.6 36.9 37 51 A A H < S+ 0 0 28 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.757 128.4 29.3 -90.3 -26.5 19.4 35.9 38.3 38 52 A N H < S- 0 0 33 -4,-2.2 -3,-0.2 2,-0.2 -2,-0.2 0.690 91.2-129.4-108.0 -26.0 22.5 38.1 38.8 39 53 A G S < S+ 0 0 55 -4,-2.9 2,-0.3 -5,-0.3 -4,-0.1 0.458 79.0 80.2 89.8 -3.2 21.3 41.6 39.5 40 54 A F S S- 0 0 71 -6,-0.3 -1,-0.2 -5,-0.1 -2,-0.2 -0.965 85.9 -88.9-136.9 155.5 23.5 43.2 36.8 41 55 A K - 0 0 120 -2,-0.3 3,-0.1 1,-0.1 -23,-0.1 -0.252 22.3-131.8 -64.7 146.3 23.3 43.6 33.1 42 56 A L - 0 0 4 -25,-0.5 2,-0.4 1,-0.2 -24,-0.1 0.868 53.8-130.2 -64.1 -38.5 24.6 41.1 30.6 43 57 A G B -D 17 0B 12 -26,-0.5 -26,-1.7 -28,-0.2 2,-0.5 -0.966 40.0 -21.2 133.0-144.4 26.4 43.9 28.7 44 58 A D S S- 0 0 9 -2,-0.4 18,-1.8 1,-0.2 19,-0.2 -0.966 112.5 -11.2-120.1 122.8 26.7 45.2 25.1 45 59 A V - 0 0 12 -36,-1.3 16,-1.2 -2,-0.5 17,-0.5 0.985 67.4-146.2 52.7 77.7 26.0 42.9 22.1 46 60 A A E -E 60 0C 0 -38,-0.8 14,-0.3 14,-0.3 -1,-0.1 -0.565 22.0-177.1 -66.2 131.2 25.7 39.4 23.5 47 61 A Q E - 0 0 15 12,-3.1 2,-0.3 1,-0.3 13,-0.2 0.823 43.6 -20.8-105.1 -44.9 27.2 37.3 20.6 48 62 A S E -E 59 0C 5 11,-1.1 11,-2.7 268,-0.1 2,-0.3 -0.967 47.9-146.5-160.1 174.7 27.0 33.5 21.2 49 63 A X E -E 58 0C 11 268,-0.4 2,-0.3 -2,-0.3 9,-0.2 -0.985 6.3-172.9-157.5 142.5 26.8 30.8 23.8 50 64 A V E -E 57 0C 50 7,-2.1 7,-3.8 -2,-0.3 2,-0.5 -0.964 14.4-145.5-133.2 148.9 28.0 27.2 24.5 51 65 A I E +E 56 0C 38 -2,-0.3 2,-0.4 5,-0.3 5,-0.2 -0.970 17.8 175.8-119.1 129.7 27.1 24.8 27.2 52 66 A R E > -E 55 0C 77 3,-3.2 3,-1.2 -2,-0.5 -2,-0.0 -0.966 65.8 -29.7-137.1 117.7 29.6 22.3 28.6 53 67 A D T 3 S- 0 0 70 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.900 127.2 -36.1 41.3 69.9 28.8 20.0 31.5 54 68 A G T 3 S+ 0 0 14 1,-0.1 17,-1.3 16,-0.1 2,-0.4 0.534 120.5 103.1 68.8 5.8 26.2 22.0 33.4 55 69 A I E < -EF 52 70C 53 -3,-1.2 -3,-3.2 15,-0.2 2,-0.5 -0.979 56.2-153.8-126.0 130.9 27.9 25.3 32.6 56 70 A G E -EF 51 69C 0 13,-2.9 13,-2.6 -2,-0.4 2,-0.6 -0.875 5.3-155.6-104.6 131.3 26.9 27.9 30.0 57 71 A W E -EF 50 68C 7 -7,-3.8 -7,-2.1 -2,-0.5 2,-0.6 -0.923 9.5-165.7-108.9 116.3 29.5 30.2 28.5 58 72 A I E -EF 49 67C 0 9,-2.9 9,-2.4 -2,-0.6 2,-0.5 -0.891 8.5-149.4-105.8 120.4 28.0 33.5 27.1 59 73 A V E -EF 48 66C 0 -11,-2.7 -12,-3.1 -2,-0.6 -11,-1.1 -0.768 7.1-165.9 -90.4 123.5 30.2 35.6 24.9 60 74 A V E > > -EF 46 65C 0 5,-2.4 3,-1.7 -2,-0.5 5,-1.2 -0.852 5.0-164.2-113.0 94.3 29.5 39.3 25.1 61 75 A N G > 5S+ 0 0 14 -16,-1.2 3,-0.7 -2,-0.8 -16,-0.2 0.832 82.8 34.8 -44.4 -54.6 31.2 40.9 22.1 62 76 A N G 3 5S+ 0 0 43 -18,-1.8 -1,-0.3 -17,-0.5 -17,-0.2 0.171 111.8 61.9 -96.0 20.7 31.2 44.6 23.0 63 77 A S G < 5S- 0 0 37 -3,-1.7 -1,-0.2 -18,-0.2 -2,-0.2 0.272 99.5-129.1-120.7 2.1 31.7 44.0 26.8 64 78 A H T < 5S+ 0 0 87 -3,-0.7 19,-1.1 -4,-0.4 18,-1.0 0.832 71.0 98.9 53.6 39.8 35.1 42.2 26.3 65 79 A V E < -FG 60 81C 9 -5,-1.2 -5,-2.4 16,-0.2 2,-0.4 -0.983 59.9-145.5-154.2 159.7 34.0 39.3 28.5 66 80 A I E -FG 59 80C 0 14,-1.9 14,-2.4 -2,-0.3 2,-0.4 -0.999 22.6-150.0-129.2 126.2 32.7 35.8 28.7 67 81 A F E -FG 58 79C 10 -9,-2.4 -9,-2.9 -2,-0.4 2,-0.6 -0.803 2.0-153.8 -99.7 137.1 30.3 34.8 31.5 68 82 A A E +FG 57 78C 0 10,-2.9 9,-3.3 -2,-0.4 10,-1.6 -0.953 25.4 174.9-109.3 120.4 30.1 31.3 32.9 69 83 A I E -FG 56 76C 0 -13,-2.6 -13,-2.9 -2,-0.6 2,-0.5 -0.895 39.9-101.9-128.1 157.9 26.7 30.6 34.4 70 84 A D E > -F 55 0C 50 5,-2.6 4,-2.8 -2,-0.3 -15,-0.2 -0.656 31.4-140.5 -75.0 121.5 24.8 27.7 36.0 71 85 A I T 4 S+ 0 0 15 -17,-1.3 -1,-0.1 -2,-0.5 -16,-0.1 0.562 97.8 42.2 -62.7 -8.1 22.5 26.4 33.2 72 86 A N T 4 S+ 0 0 104 -18,-0.3 -1,-0.2 3,-0.1 -17,-0.0 0.808 127.1 24.9-104.5 -45.6 19.7 25.9 35.8 73 87 A T T 4 S- 0 0 77 2,-0.1 -2,-0.2 -36,-0.0 3,-0.1 0.593 90.3-137.8 -95.4 -13.5 19.8 28.9 38.1 74 88 A F < + 0 0 24 -4,-2.8 2,-0.2 1,-0.2 -37,-0.1 0.486 54.5 144.9 68.4 2.3 21.4 31.2 35.5 75 89 A K - 0 0 118 -5,-0.2 -5,-2.6 -6,-0.1 -1,-0.2 -0.493 57.0-105.0 -75.1 140.6 23.6 32.5 38.3 76 90 A E E +G 69 0C 49 -7,-0.2 -7,-0.3 -2,-0.2 3,-0.1 -0.408 35.4 175.8 -66.3 134.0 27.2 33.4 37.4 77 91 A V E - 0 0 75 -9,-3.3 2,-0.3 1,-0.4 -8,-0.2 0.516 67.9 -26.7-111.6 -14.7 29.9 31.0 38.5 78 92 A G E -G 68 0C 10 -10,-1.6 -10,-2.9 2,-0.0 -1,-0.4 -0.971 54.7-150.4 178.5 174.0 32.8 32.8 36.9 79 93 A R E -G 67 0C 110 -2,-0.3 2,-0.4 -12,-0.2 -12,-0.2 -0.984 8.3-145.0-161.2 155.1 33.9 35.2 34.1 80 94 A I E -G 66 0C 4 -14,-2.4 -14,-1.9 -2,-0.3 3,-0.2 -0.987 22.0-179.8-129.3 122.1 36.9 36.0 31.9 81 95 A T E +G 65 0C 89 -2,-0.4 -16,-0.2 34,-0.2 36,-0.2 -0.568 48.0 75.0-111.2 177.1 37.6 39.6 30.9 82 96 A G + 0 0 52 -18,-1.0 2,-0.2 1,-0.3 -17,-0.2 0.383 57.4 142.2 102.0 -4.3 40.3 41.1 28.7 83 97 A F - 0 0 1 -19,-1.1 -1,-0.3 -3,-0.2 18,-0.0 -0.515 50.1-139.7 -74.4 138.6 39.1 40.0 25.3 84 98 A T S S- 0 0 39 -2,-0.2 -1,-0.1 1,-0.2 -20,-0.1 0.941 85.4 -33.0 -60.2 -51.7 39.5 42.6 22.4 85 99 A S S S- 0 0 5 15,-0.1 17,-1.7 -22,-0.1 -1,-0.2 -0.341 78.3-145.1-174.4 77.3 36.0 41.8 21.0 86 100 A P E +H 101 0D 0 0, 0.0 15,-0.2 0, 0.0 -22,-0.1 -0.104 24.3 170.7 -55.1 142.8 35.1 38.1 21.5 87 101 A R E - 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