==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 29-JUN-10 2L02 . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR A.ELETSKY,H.LEE,D.WANG,C.CICCOSANTI,K.HAMILTON,T.B.ACTON,R.X . 164 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10355.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 111 67.7 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 . 19 11.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 . 13 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 38.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.4 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 1 1 0 0 0 2 0 0 0 0 1 1 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 . 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 A M 0 0 156 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 115.3 0.2 18.0 3.0 2 2 A D > + 0 0 47 3,-0.1 4,-2.5 136,-0.0 5,-0.3 0.492 360.0 65.4-143.5 -44.3 -0.1 14.1 2.7 3 3 A K H > S+ 0 0 93 1,-0.2 4,-0.8 2,-0.2 5,-0.0 0.707 102.9 53.4 -66.9 -22.9 -0.2 12.5 6.3 4 4 A K H > S+ 0 0 159 2,-0.2 4,-1.5 3,-0.2 -1,-0.2 0.841 111.5 45.5 -75.9 -38.7 -3.6 14.3 6.9 5 5 A I H > S+ 0 0 44 -3,-0.2 4,-2.2 2,-0.2 5,-0.2 0.966 118.6 40.2 -65.6 -55.9 -5.1 12.8 3.6 6 6 A V H X S+ 0 0 12 -4,-2.5 4,-0.9 1,-0.2 -3,-0.2 0.737 113.4 57.3 -69.3 -26.2 -3.7 9.2 4.3 7 7 A G H X S+ 0 0 29 -4,-0.8 4,-0.6 -5,-0.3 -1,-0.2 0.872 109.9 44.6 -65.8 -40.2 -4.7 9.6 8.0 8 8 A A H >X S+ 0 0 72 -4,-1.5 3,-0.9 -3,-0.2 4,-0.6 0.955 115.7 42.5 -70.0 -54.5 -8.3 10.3 7.0 9 9 A N H 3X S+ 0 0 24 -4,-2.2 4,-1.6 1,-0.2 5,-0.2 0.708 103.6 68.1 -71.8 -21.0 -8.9 7.5 4.3 10 10 A A H 3X S+ 0 0 2 -4,-0.9 4,-1.8 -5,-0.2 -1,-0.2 0.793 95.2 57.2 -66.9 -30.4 -7.1 4.9 6.5 11 11 A G H - 0 0 37 -2,-0.2 4,-2.0 38,-0.2 3,-0.3 -0.372 31.7-106.1 -76.5 160.0 -7.8 -8.3 -1.0 25 25 A I H > S+ 0 0 2 36,-0.2 4,-2.2 1,-0.2 -1,-0.1 0.909 113.4 42.4 -55.8 -56.6 -7.1 -4.7 -2.1 26 26 A P H > S+ 0 0 35 0, 0.0 4,-0.7 0, 0.0 -1,-0.2 0.767 115.3 50.8 -70.8 -22.5 -9.6 -4.1 -5.1 27 27 A E H > S+ 0 0 86 -3,-0.3 4,-0.9 2,-0.2 3,-0.5 0.912 113.5 43.9 -75.9 -47.9 -12.5 -5.9 -3.2 28 28 A L H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 3,-0.4 0.864 108.4 61.2 -57.5 -40.5 -12.0 -3.8 -0.1 29 29 A A H X>S+ 0 0 7 -4,-2.2 5,-1.1 1,-0.2 4,-0.9 0.745 98.9 56.2 -62.5 -29.1 -11.7 -0.7 -2.5 30 30 A R H <5S+ 0 0 122 -4,-0.7 52,-1.6 -3,-0.5 -1,-0.2 0.831 109.0 45.4 -73.6 -35.9 -15.3 -1.3 -3.8 31 31 A K H <5S+ 0 0 14 -4,-0.9 -2,-0.2 -3,-0.4 -1,-0.1 0.902 122.3 36.1 -71.8 -44.0 -16.8 -1.1 -0.2 32 32 A V H <5S- 0 0 9 -4,-2.0 -2,-0.2 2,-0.1 -1,-0.2 0.562 104.1-132.8 -86.9 -11.6 -14.8 2.1 0.7 33 33 A N T <5 + 0 0 91 -4,-0.9 2,-0.3 -5,-0.2 -3,-0.2 0.812 58.0 135.2 60.7 37.8 -15.0 3.5 -2.9 34 34 A L < - 0 0 35 -5,-1.1 -1,-0.2 -6,-0.1 -2,-0.1 -0.753 62.2 -94.3-106.8 157.3 -11.2 4.4 -3.1 35 35 A S > - 0 0 73 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.355 37.2-113.4 -61.0 150.2 -8.7 3.8 -6.0 36 36 A V H > S+ 0 0 62 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.914 120.3 45.3 -54.9 -48.9 -6.6 0.5 -5.8 37 37 A E H > S+ 0 0 37 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.882 115.4 49.1 -59.8 -39.8 -3.3 2.5 -5.3 38 38 A S H > S+ 0 0 18 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.839 111.3 48.4 -68.8 -37.3 -5.2 4.7 -2.7 39 39 A T H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.930 113.0 46.0 -71.6 -47.9 -6.7 1.7 -0.7 40 40 A A H X S+ 0 0 2 -4,-2.1 4,-1.0 1,-0.2 -2,-0.2 0.873 116.1 46.4 -60.2 -41.8 -3.3 -0.2 -0.4 41 41 A L H X S+ 0 0 11 -4,-1.6 4,-1.0 2,-0.2 -1,-0.2 0.826 108.7 54.7 -73.8 -35.3 -1.5 3.0 0.6 42 42 A A H X S+ 0 0 0 -4,-1.7 4,-0.8 1,-0.2 3,-0.4 0.895 108.4 49.8 -62.6 -41.3 -4.2 4.0 3.2 43 43 A V H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.799 102.0 63.3 -64.4 -31.5 -3.7 0.5 4.7 44 44 A G H X S+ 0 0 0 -4,-1.0 4,-0.8 1,-0.2 -1,-0.2 0.813 98.7 54.0 -62.3 -32.4 0.1 1.3 4.7 45 45 A W H < S+ 0 0 44 -4,-1.0 4,-0.5 -3,-0.4 -1,-0.2 0.795 109.4 48.1 -68.6 -32.7 -0.7 4.2 7.2 46 46 A L H >X>S+ 0 0 5 -4,-0.8 5,-2.7 1,-0.2 3,-1.1 0.872 103.9 60.0 -71.5 -41.0 -2.4 1.5 9.4 47 47 A A H 3<5S+ 0 0 13 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.727 92.7 69.6 -58.6 -26.9 0.7 -0.8 9.0 48 48 A R T 3<5S+ 0 0 82 -4,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.893 114.7 24.6 -52.9 -45.1 2.7 2.1 10.7 49 49 A E T <45S- 0 0 89 -3,-1.1 -2,-0.2 -4,-0.5 -1,-0.2 0.318 114.3-111.4-103.9 3.8 0.9 1.4 14.0 50 50 A N T <5S+ 0 0 46 -4,-0.5 -3,-0.2 -3,-0.2 -4,-0.1 0.796 71.4 143.0 54.7 36.6 0.1 -2.4 13.2 51 51 A K S S-B 60 0A 82 3,-0.8 3,-1.8 -2,-0.5 -2,-0.0 -0.961 75.5 -10.6-111.3 126.8 -1.9 -17.5 1.2 58 58 A N T 3 S- 0 0 163 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.762 128.3 -59.6 56.9 31.1 -1.3 -19.1 -2.3 59 59 A G T 3 S+ 0 0 47 1,-0.3 -1,-0.3 -3,-0.1 2,-0.1 0.193 109.3 129.1 84.3 -15.6 0.6 -15.8 -3.3 60 60 A L E < - B 0 57A 118 -3,-1.8 -3,-0.8 1,-0.1 2,-0.6 -0.361 61.4-120.0 -74.2 151.7 -2.6 -13.7 -2.6 61 61 A I E - B 0 56A 8 -5,-0.2 2,-0.4 -3,-0.1 -36,-0.2 -0.844 29.0-170.2 -99.9 112.0 -2.4 -10.6 -0.3 62 62 A E E - B 0 55A 39 -7,-2.5 -7,-1.1 -2,-0.6 2,-0.5 -0.825 10.0-153.2 -98.4 141.1 -4.7 -10.7 2.8 63 63 A I E -AB 23 54A 2 -40,-0.9 -41,-2.8 -2,-0.4 -40,-1.0 -0.951 14.5-167.2-116.0 113.3 -5.3 -7.6 5.1 64 64 A Y E - B 0 53A 52 -11,-2.1 -11,-1.3 -2,-0.5 2,-0.3 -0.667 18.1-124.3 -97.3 150.2 -6.1 -8.5 8.7 65 65 A N E > - B 0 52A 2 -2,-0.3 3,-1.4 -48,-0.2 -13,-0.2 -0.748 16.4-128.4 -92.7 141.6 -7.5 -6.1 11.4 66 66 A E G >> S+ 0 0 64 -15,-2.1 3,-1.5 -2,-0.3 4,-1.0 0.665 98.8 82.1 -60.0 -18.6 -5.7 -5.6 14.8 67 67 A G G 34 S+ 0 0 6 -16,-0.3 -1,-0.2 1,-0.3 5,-0.1 0.783 73.8 69.0 -59.7 -32.3 -9.0 -6.3 16.5 68 68 A H G <4 S+ 0 0 89 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.1 0.578 101.8 50.3 -68.7 -8.8 -8.7 -10.2 16.2 69 69 A F T <4 S- 0 0 129 -3,-1.5 -1,-0.2 -4,-0.1 -2,-0.2 0.876 135.5 -1.9 -84.4 -54.2 -5.8 -9.9 18.8 70 70 A D S < S- 0 0 142 -4,-1.0 2,-0.4 1,-0.2 -3,-0.1 0.848 128.5 -12.3-103.0 -76.1 -7.7 -7.7 21.5 71 71 A F + 0 0 159 -5,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.983 58.0 161.8-143.4 122.3 -11.3 -6.7 20.6 72 72 A S - 0 0 58 -2,-0.4 2,-0.3 -4,-0.1 -53,-0.0 -0.994 9.3-175.6-138.4 147.1 -13.3 -6.9 17.2 73 73 A F - 0 0 115 -2,-0.3 3,-0.4 -55,-0.1 2,-0.3 -0.933 22.0-164.0-149.7 113.8 -17.1 -6.8 16.6 74 74 A G + 0 0 51 -2,-0.3 4,-0.2 1,-0.2 -55,-0.1 -0.189 48.7 134.6 -84.8 41.6 -19.0 -7.2 13.3 75 75 A L + 0 0 150 -2,-0.3 2,-0.7 2,-0.1 -1,-0.2 0.826 51.5 80.5 -62.4 -36.7 -22.0 -5.7 15.0 76 76 A E S S- 0 0 99 -3,-0.4 2,-1.7 1,-0.1 3,-0.2 -0.683 98.1-122.7 -69.1 109.4 -22.6 -3.5 11.9 77 77 A H - 0 0 180 -2,-0.7 -2,-0.1 1,-0.2 -1,-0.1 -0.441 60.3 -58.2 -71.8 84.4 -24.4 -6.0 9.7 78 78 A H - 0 0 114 -2,-1.7 2,-0.6 -4,-0.2 -1,-0.2 0.923 50.4-127.6 50.3 99.9 -22.2 -6.2 6.6 79 79 A H - 0 0 101 -3,-0.2 -1,-0.2 -63,-0.1 2,-0.1 -0.647 30.3-134.4 -70.0 112.1 -21.5 -2.9 4.6 80 80 A H - 0 0 139 -2,-0.6 -1,-0.0 1,-0.1 -2,-0.0 -0.365 20.9-117.5 -67.9 151.8 -22.5 -3.7 0.9 81 81 A H 0 0 118 1,-0.1 -50,-0.3 -2,-0.1 -1,-0.1 -0.116 360.0 360.0 -83.4 177.9 -20.0 -2.6 -1.9 82 82 A H 0 0 172 -52,-1.6 -1,-0.1 -2,-0.0 -50,-0.1 -0.430 360.0 360.0-137.3 360.0 -20.5 -0.2 -4.8 83 !* 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 84 1 B M >> 0 0 159 0, 0.0 4,-2.2 0, 0.0 3,-0.8 0.000 360.0 360.0 360.0 45.8 6.6 -12.3 10.4 85 2 B D H 3> + 0 0 37 1,-0.3 4,-2.5 2,-0.2 5,-0.3 0.859 360.0 45.7 -48.7 -51.1 4.6 -9.6 8.5 86 3 B K H 3> S+ 0 0 92 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.770 111.6 53.6 -67.9 -28.1 7.0 -6.6 9.3 87 4 B K H <> S+ 0 0 153 -3,-0.8 4,-1.5 2,-0.2 -2,-0.2 0.913 113.1 43.2 -69.0 -45.8 10.1 -8.8 8.4 88 5 B I H X S+ 0 0 61 -4,-2.2 4,-2.3 2,-0.2 3,-0.3 0.958 117.9 42.7 -63.0 -56.7 8.6 -9.7 4.9 89 6 B V H X S+ 0 0 11 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.775 110.7 59.0 -66.1 -27.6 7.3 -6.1 4.1 90 7 B G H X S+ 0 0 27 -4,-1.2 4,-1.0 -5,-0.3 -1,-0.2 0.879 109.5 42.9 -65.0 -41.0 10.7 -4.7 5.4 91 8 B A H X S+ 0 0 65 -4,-1.5 4,-1.2 -3,-0.3 3,-0.3 0.936 116.7 45.9 -67.1 -50.3 12.6 -6.8 2.9 92 9 B N H X S+ 0 0 37 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.761 108.9 56.9 -68.2 -27.5 10.2 -6.0 -0.1 93 10 B A H X S+ 0 0 1 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.825 102.8 54.2 -72.8 -34.4 10.2 -2.3 0.8 94 11 B G H X S+ 0 0 44 -4,-1.0 4,-1.4 -3,-0.3 -2,-0.2 0.840 109.8 49.0 -64.6 -35.2 14.0 -2.2 0.5 95 12 B K H X S+ 0 0 101 -4,-1.2 4,-1.3 2,-0.2 -2,-0.2 0.926 114.5 42.0 -68.1 -50.3 13.6 -3.6 -3.0 96 13 B V H X S+ 0 0 0 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.860 115.9 50.1 -69.1 -34.8 10.8 -1.1 -4.2 97 14 B W H X S+ 0 0 75 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.821 104.4 58.4 -71.9 -35.0 12.7 1.9 -2.5 98 15 B H H X S+ 0 0 115 -4,-1.4 4,-0.9 1,-0.2 -1,-0.2 0.894 105.6 50.2 -57.0 -41.6 16.0 0.8 -4.3 99 16 B A H X S+ 0 0 7 -4,-1.3 4,-1.7 1,-0.2 -2,-0.2 0.810 109.9 50.5 -65.5 -32.7 14.0 1.2 -7.6 100 17 B L H < S+ 0 0 0 -4,-1.0 4,-0.5 2,-0.2 -2,-0.2 0.817 100.8 63.3 -71.7 -34.0 12.9 4.8 -6.3 101 18 B N H < S+ 0 0 104 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.806 118.4 26.4 -61.0 -31.5 16.6 5.7 -5.5 102 19 B E H < S+ 0 0 121 -4,-0.9 -2,-0.2 1,-0.2 -1,-0.2 0.664 144.3 9.0-105.1 -25.8 17.5 5.3 -9.3 103 20 B A S < S+ 0 0 50 -4,-1.7 3,-0.2 -5,-0.2 -2,-0.2 -0.581 76.5 162.5-162.0 87.9 13.9 6.1 -10.8 104 21 B D + 0 0 40 -4,-0.5 43,-0.3 1,-0.1 3,-0.1 -0.407 49.5 64.2-101.2-179.0 11.1 7.5 -8.5 105 22 B G S S+ 0 0 12 41,-2.2 42,-0.2 1,-0.3 2,-0.2 0.661 77.5 139.6 74.3 18.2 7.7 9.3 -9.3 106 23 B I E -C 146 0B 39 40,-0.6 40,-1.4 -3,-0.2 -1,-0.3 -0.550 59.5-100.1 -93.7 152.4 6.7 6.1 -11.1 107 24 B S E > -C 145 0B 40 -2,-0.2 4,-2.2 38,-0.2 3,-0.4 -0.476 33.3-115.3 -69.0 148.3 3.2 4.4 -11.0 108 25 B I H > S+ 0 0 5 36,-0.5 4,-2.2 1,-0.2 5,-0.1 0.865 111.9 48.3 -54.7 -48.4 2.7 1.3 -8.7 109 26 B P H > S+ 0 0 54 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.839 113.6 48.1 -65.4 -31.2 2.0 -1.4 -11.6 110 27 B E H > S+ 0 0 81 -3,-0.4 4,-1.4 2,-0.2 -2,-0.2 0.918 114.7 45.0 -71.6 -46.7 5.1 -0.2 -13.6 111 28 B L H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 6,-0.2 0.837 109.7 57.8 -59.7 -38.7 7.3 -0.3 -10.5 112 29 B A H <>S+ 0 0 3 -4,-2.2 5,-1.5 -5,-0.2 4,-0.3 0.892 104.5 49.6 -62.3 -43.8 5.7 -3.7 -9.6 113 30 B R H <5S+ 0 0 168 -4,-1.7 3,-0.5 1,-0.2 -1,-0.2 0.848 112.6 49.5 -64.4 -35.8 6.9 -5.2 -13.0 114 31 B K H <5S+ 0 0 98 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.912 113.1 44.1 -66.6 -45.9 10.4 -3.8 -12.2 115 32 B V T <5S- 0 0 6 -4,-2.3 -1,-0.2 2,-0.1 -2,-0.2 0.269 110.2-118.3 -90.5 10.7 10.6 -5.2 -8.6 116 33 B N T 5S+ 0 0 148 -3,-0.5 2,-0.2 -4,-0.3 -3,-0.2 0.613 78.6 114.7 62.7 16.8 9.2 -8.7 -9.7 117 34 B L < - 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