==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 17-JUN-13 4L8J . COMPND 2 MOLECULE: PUTATIVE EFFLUX TRANSPORTER; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES EGGERTHII; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 326 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23213.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 198 60.7 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 . 82 25.2 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 0.6 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 . 26 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 16.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 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 . 0 6 2 0 3 2 1 0 1 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 . 2 2 1 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 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 25 A D 0 0 150 0, 0.0 3,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-160.7 45.2 43.5 80.4 2 26 A T + 0 0 150 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.754 360.0 61.6 -75.1 -26.4 42.7 42.0 77.8 3 27 A A S S+ 0 0 71 2,-0.1 2,-0.7 0, 0.0 -1,-0.2 0.695 80.2 98.1 -72.6 -19.9 45.7 41.2 75.5 4 28 A L S S- 0 0 104 -3,-0.4 2,-0.5 1,-0.0 0, 0.0 -0.614 76.8-140.0 -72.7 110.1 47.2 38.9 78.3 5 29 A V - 0 0 136 -2,-0.7 -2,-0.1 1,-0.0 -1,-0.0 -0.682 18.1-162.6 -80.4 123.2 46.0 35.5 77.1 6 30 A R - 0 0 177 -2,-0.5 2,-0.2 2,-0.0 -2,-0.0 -0.923 17.7-126.7-109.5 129.0 44.9 33.4 80.0 7 31 A P + 0 0 122 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.532 38.1 178.0 -72.3 136.8 44.5 29.5 79.8 8 32 A V - 0 0 95 -2,-0.2 2,-0.3 2,-0.0 -2,-0.0 -0.997 30.2-130.7-140.0 147.6 41.0 28.5 80.9 9 33 A K - 0 0 210 -2,-0.3 2,-0.3 2,-0.0 0, 0.0 -0.717 36.3-174.4 -91.8 144.3 39.0 25.3 81.2 10 34 A T - 0 0 103 -2,-0.3 2,-0.3 2,-0.0 250,-0.0 -0.903 16.4-161.3-134.1 169.3 35.5 25.5 79.6 11 35 A A - 0 0 69 -2,-0.3 2,-0.4 246,-0.0 -2,-0.0 -0.960 26.0-112.1-147.1 158.4 32.3 23.6 79.2 12 36 A T - 0 0 134 -2,-0.3 2,-0.2 1,-0.0 243,-0.1 -0.775 35.3-114.3 -91.0 137.0 29.3 23.7 76.9 13 37 A V - 0 0 80 -2,-0.4 2,-0.3 243,-0.1 243,-0.2 -0.538 39.8-161.8 -68.5 130.3 25.9 24.7 78.4 14 38 A S E -A 255 0A 47 241,-1.3 241,-3.2 -2,-0.2 2,-0.3 -0.917 21.8-112.9-122.3 145.5 23.6 21.7 78.2 15 39 A S E > -A 254 0A 32 -2,-0.3 3,-1.1 239,-0.2 239,-0.2 -0.603 31.9-125.1 -71.6 132.1 19.8 21.4 78.4 16 40 A Q T 3 S+ 0 0 92 237,-2.9 -1,-0.1 -2,-0.3 238,-0.1 0.877 103.6 32.0 -46.9 -49.4 18.8 19.5 81.6 17 41 A S T 3 S+ 0 0 11 236,-0.2 228,-2.3 229,-0.1 2,-0.7 0.335 90.6 104.1 -99.1 4.0 16.7 16.8 80.0 18 42 A V E < -B 244 0B 47 -3,-1.1 2,-0.4 226,-0.2 226,-0.3 -0.817 57.7-155.7 -88.8 116.8 18.5 16.4 76.6 19 43 A I E -B 243 0B 46 224,-3.1 224,-2.5 -2,-0.7 2,-0.4 -0.824 6.8-162.2 -94.0 130.9 20.6 13.2 76.6 20 44 A L E +B 242 0B 83 -2,-0.4 2,-0.3 222,-0.2 222,-0.2 -0.944 10.9 176.1-116.0 134.4 23.5 13.0 74.2 21 45 A K E -B 241 0B 60 220,-2.1 220,-3.2 -2,-0.4 2,-0.4 -0.997 16.9-148.4-137.1 142.1 25.3 9.8 73.1 22 46 A D E -B 240 0B 76 -2,-0.3 2,-0.3 218,-0.2 218,-0.2 -0.902 17.2-177.8-111.7 134.4 28.1 9.2 70.6 23 47 A F E -B 239 0B 19 216,-2.3 216,-3.5 -2,-0.4 2,-0.4 -0.962 24.7-127.0-129.8 146.8 28.4 6.0 68.6 24 48 A S E +B 238 0B 107 -2,-0.3 144,-0.5 214,-0.2 2,-0.2 -0.799 39.2 168.2 -90.4 134.4 31.0 4.8 66.1 25 49 A G E -B 237 0B 9 212,-2.2 212,-1.8 -2,-0.4 2,-0.4 -0.800 24.2-132.8-139.1 178.9 29.5 3.7 62.8 26 50 A X E -BC 236 166B 102 140,-2.4 140,-2.8 -2,-0.2 2,-0.3 -0.995 25.9-108.0-143.1 143.5 30.4 2.7 59.3 27 51 A V E - C 0 165B 10 208,-2.7 207,-2.7 -2,-0.4 138,-0.2 -0.563 47.5-117.7 -69.8 126.8 29.3 3.5 55.8 28 52 A E - 0 0 74 136,-2.1 136,-0.2 -2,-0.3 207,-0.1 -0.400 25.5-104.9 -70.4 146.0 27.5 0.4 54.5 29 53 A A - 0 0 87 204,-0.1 2,-0.4 -2,-0.1 -1,-0.1 -0.338 33.0-142.5 -65.9 147.8 28.7 -1.5 51.4 30 54 A V - 0 0 65 -2,-0.0 2,-0.4 203,-0.0 -1,-0.0 -0.941 15.5-117.2-116.8 141.9 26.7 -0.9 48.2 31 55 A E - 0 0 82 -2,-0.4 128,-0.5 1,-0.0 2,-0.4 -0.668 26.4-131.2 -77.8 123.9 26.0 -3.7 45.7 32 56 A Y E -H 158 0C 112 -2,-0.4 2,-0.5 126,-0.1 126,-0.2 -0.641 17.5-141.7 -77.7 129.0 27.5 -2.9 42.3 33 57 A V E -H 157 0C 57 124,-2.5 124,-2.7 -2,-0.4 2,-0.5 -0.848 9.5-137.4 -93.5 123.1 24.9 -3.4 39.5 34 58 A K E -H 156 0C 114 -2,-0.5 2,-0.4 122,-0.2 122,-0.2 -0.755 19.6-150.7 -81.8 118.8 26.4 -5.0 36.3 35 59 A L E +H 155 0C 13 120,-3.0 119,-3.2 -2,-0.5 120,-0.8 -0.819 22.7 168.2 -95.0 135.8 24.9 -3.1 33.3 36 60 A A E -H 153 0C 24 -2,-0.4 117,-0.1 117,-0.2 114,-0.1 -0.989 36.3-106.0-146.7 153.8 24.5 -5.0 30.1 37 61 A F - 0 0 5 115,-0.6 114,-2.2 112,-0.4 115,-0.2 -0.406 16.9-144.1 -71.3 152.4 22.9 -4.6 26.6 38 62 A R S S+ 0 0 180 88,-0.4 2,-0.3 112,-0.2 112,-0.2 0.420 87.4 51.0 -95.3 -1.6 19.7 -6.7 26.0 39 63 A V S S- 0 0 11 87,-0.4 2,-0.3 110,-0.2 -2,-0.1 -0.837 86.6-115.1-127.6 162.9 20.9 -7.1 22.3 40 64 A S + 0 0 63 -2,-0.3 2,-0.3 110,-0.1 109,-0.2 -0.760 54.9 104.3-101.0 147.4 24.2 -8.2 20.7 41 65 A G E -K 148 0D 24 107,-2.6 107,-3.2 -2,-0.3 2,-0.6 -0.988 66.3 -57.8 170.3-173.3 26.4 -5.8 18.7 42 66 A Q E -K 147 0D 44 -2,-0.3 22,-2.4 22,-0.3 105,-0.3 -0.890 47.3-125.5 -99.9 121.3 29.4 -3.6 18.3 43 67 A I E +L 63 0E 0 103,-2.8 102,-1.2 -2,-0.6 20,-0.3 -0.398 34.2 169.1 -60.9 129.3 29.9 -0.7 20.8 44 68 A I E + 0 0 58 18,-3.0 2,-0.3 1,-0.3 19,-0.2 0.363 66.7 38.7-120.3 -9.0 30.2 2.5 18.8 45 69 A N E +L 62 0E 65 17,-1.5 17,-2.3 19,-0.0 -1,-0.3 -0.959 46.1 164.7-148.2 128.1 29.9 4.9 21.7 46 70 A L + 0 0 12 -2,-0.3 15,-0.2 15,-0.2 98,-0.1 -0.743 14.8 166.5-135.5 73.3 31.2 4.7 25.3 47 71 A P + 0 0 60 0, 0.0 2,-0.2 0, 0.0 14,-0.1 0.530 48.6 80.5 -79.7 -4.6 30.8 8.3 26.5 48 72 A V - 0 0 1 12,-0.7 2,-0.3 4,-0.0 12,-0.0 -0.684 59.9-157.1-101.8 155.4 31.3 7.6 30.3 49 73 A V > - 0 0 85 -2,-0.2 3,-1.7 1,-0.0 88,-0.3 -0.844 36.3 -79.4-123.6 162.5 34.5 7.2 32.3 50 74 A E T 3 S+ 0 0 114 -2,-0.3 88,-0.2 1,-0.2 3,-0.1 -0.411 117.6 23.2 -63.8 132.0 35.3 5.5 35.7 51 75 A G T 3 S+ 0 0 48 86,-3.4 -1,-0.2 1,-0.3 2,-0.1 0.198 90.1 137.5 94.5 -12.4 34.4 7.7 38.6 52 76 A Q < - 0 0 58 -3,-1.7 85,-2.5 85,-0.2 2,-0.5 -0.420 51.8-133.1 -68.9 139.1 31.8 9.7 36.6 53 77 A R E -I 136 0C 122 83,-0.2 2,-0.3 -2,-0.1 83,-0.2 -0.834 29.4-173.1 -95.2 122.5 28.5 10.5 38.3 54 78 A V E -I 135 0C 4 81,-3.2 81,-2.4 -2,-0.5 2,-0.3 -0.827 15.9-133.3-117.8 158.1 25.6 9.7 36.0 55 79 A K > - 0 0 131 -2,-0.3 3,-2.1 79,-0.3 76,-0.4 -0.761 41.6 -81.1-106.0 155.3 21.8 10.3 36.3 56 80 A K T 3 S+ 0 0 153 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 -0.295 119.5 21.6 -54.6 133.4 19.0 7.8 35.6 57 81 A G T 3 S+ 0 0 40 74,-3.2 -1,-0.3 1,-0.3 3,-0.1 0.179 90.0 136.4 90.6 -16.1 18.3 7.7 31.8 58 82 A Q < - 0 0 68 -3,-2.1 73,-2.3 73,-0.1 -1,-0.3 -0.363 64.5 -99.2 -64.6 143.9 21.8 9.0 30.9 59 83 A L E + M 0 130E 45 71,-0.2 71,-0.2 1,-0.2 -1,-0.1 -0.447 42.3 170.4 -68.0 130.5 23.6 7.2 28.0 60 84 A I E - 0 0 0 69,-3.0 -12,-0.7 1,-0.5 2,-0.3 0.746 66.8 -21.1-102.0 -46.7 26.2 4.6 29.2 61 85 A A E - M 0 129E 0 68,-1.3 68,-3.2 -15,-0.2 -1,-0.5 -0.977 54.0-150.6-161.8 156.6 27.0 3.0 25.8 62 86 A A E -LM 45 128E 7 -17,-2.3 -18,-3.0 -2,-0.3 -17,-1.5 -0.998 9.1-146.6-137.2 141.6 25.5 2.4 22.3 63 87 A I E -L 43 0E 3 64,-2.3 -20,-0.3 -2,-0.3 84,-0.1 -0.696 44.0 -84.0 -99.6 157.9 25.9 -0.4 19.8 64 88 A D - 0 0 75 -22,-2.4 3,-0.3 -2,-0.2 4,-0.3 -0.489 39.8-160.7 -60.0 114.1 25.9 0.1 16.0 65 89 A P > + 0 0 50 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.431 59.7 107.3 -82.3 0.2 22.1 0.1 15.2 66 90 A R H > S+ 0 0 46 2,-0.2 4,-1.4 1,-0.2 -2,-0.0 0.853 82.5 36.1 -43.9 -61.9 22.6 -0.7 11.4 67 91 A D H > S+ 0 0 131 -3,-0.3 4,-1.9 2,-0.2 3,-0.3 0.915 119.8 47.8 -64.6 -46.8 21.4 -4.4 11.3 68 92 A I H > S+ 0 0 25 -4,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.882 109.3 55.8 -61.8 -39.2 18.6 -3.9 13.9 69 93 A S H X S+ 0 0 50 -4,-3.1 4,-2.2 2,-0.2 -1,-0.2 0.849 106.7 50.2 -60.8 -38.4 17.5 -0.8 12.0 70 94 A L H X S+ 0 0 123 -4,-1.4 4,-1.5 -3,-0.3 -2,-0.2 0.924 112.6 45.6 -66.4 -46.6 17.2 -2.9 8.8 71 95 A Q H X S+ 0 0 106 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.900 111.5 54.2 -62.4 -42.0 15.1 -5.6 10.6 72 96 A Y H X S+ 0 0 59 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.928 109.3 45.8 -56.0 -55.3 13.0 -2.8 12.2 73 97 A A H X S+ 0 0 60 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.777 116.0 47.2 -60.9 -33.5 12.1 -1.1 8.8 74 98 A A H X S+ 0 0 54 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.882 114.8 44.9 -74.9 -41.7 11.2 -4.6 7.3 75 99 A D H X S+ 0 0 26 -4,-2.8 4,-2.3 2,-0.2 42,-0.2 0.871 112.4 54.0 -70.2 -34.3 9.1 -5.6 10.3 76 100 A K H X S+ 0 0 76 -4,-2.9 4,-2.4 -5,-0.2 -2,-0.2 0.942 111.2 43.8 -61.8 -52.5 7.5 -2.1 10.2 77 101 A A H X S+ 0 0 49 -4,-1.8 4,-2.4 2,-0.2 5,-0.2 0.936 114.1 50.4 -59.5 -48.1 6.5 -2.5 6.6 78 102 A A H X S+ 0 0 51 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.869 112.4 48.1 -59.7 -37.9 5.3 -6.2 7.1 79 103 A Y H X S+ 0 0 49 -4,-2.3 4,-2.7 34,-0.2 -1,-0.2 0.912 110.7 50.1 -67.4 -46.9 3.2 -5.0 10.1 80 104 A E H X S+ 0 0 97 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.872 113.2 46.1 -61.0 -40.7 1.6 -2.1 8.2 81 105 A T H X S+ 0 0 96 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.911 114.8 47.2 -67.4 -45.5 0.7 -4.5 5.2 82 106 A A H X S+ 0 0 17 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.894 112.5 50.0 -64.7 -38.6 -0.8 -7.1 7.7 83 107 A A H X S+ 0 0 24 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.911 112.6 46.3 -64.9 -43.7 -2.7 -4.4 9.6 84 108 A A H X S+ 0 0 40 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.893 111.7 52.0 -65.0 -41.9 -4.2 -3.0 6.3 85 109 A Q H X S+ 0 0 78 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.901 110.0 48.3 -64.8 -39.7 -5.1 -6.5 5.1 86 110 A V H X S+ 0 0 8 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.857 110.4 51.2 -67.8 -37.4 -7.0 -7.4 8.4 87 111 A E H X S+ 0 0 98 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.902 111.7 48.1 -66.2 -38.3 -9.0 -4.1 8.4 88 112 A R H X S+ 0 0 108 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.911 112.1 48.6 -61.9 -49.2 -10.0 -4.8 4.8 89 113 A N H X S+ 0 0 2 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.794 105.1 58.8 -67.4 -28.2 -11.0 -8.4 5.7 90 114 A K H X S+ 0 0 93 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.935 110.6 43.0 -63.6 -43.6 -13.0 -7.1 8.7 91 115 A R H < S+ 0 0 161 -4,-1.6 4,-0.4 1,-0.2 -2,-0.2 0.903 116.0 48.2 -66.9 -43.4 -15.1 -5.0 6.2 92 116 A L H <>S+ 0 0 46 -4,-2.2 5,-3.5 1,-0.2 6,-0.6 0.818 114.6 44.8 -64.5 -41.9 -15.3 -8.0 3.7 93 117 A L H ><5S+ 0 0 29 -4,-2.7 3,-2.2 3,-0.2 -2,-0.2 0.894 104.0 64.5 -70.3 -40.2 -16.4 -10.5 6.4 94 118 A G T 3<5S+ 0 0 70 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.613 113.9 33.2 -55.3 -19.6 -18.9 -8.0 7.8 95 119 A R T 3 5S- 0 0 169 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.2 0.131 117.5-114.3-120.7 11.0 -20.8 -8.2 4.5 96 120 A Q T < 5S+ 0 0 153 -3,-2.2 -3,-0.2 1,-0.1 -2,-0.1 0.728 75.0 134.1 58.3 34.5 -19.9 -11.9 4.1 97 121 A A < + 0 0 61 -5,-3.5 2,-0.3 -6,-0.2 -4,-0.2 0.602 67.6 40.7 -83.5 -13.5 -17.7 -11.2 0.9 98 122 A I S S- 0 0 34 -6,-0.6 2,-0.1 -9,-0.1 -2,-0.1 -0.910 91.8 -97.9-132.7 157.0 -14.8 -13.5 2.2 99 123 A S > - 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