==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER AMINO-ACID BINDING PROTEIN 25-FEB-93 1LST . COMPND 2 MOLECULE: LYSINE, ARGININE, ORNITHINE-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR S.-H.KIM,B.-H.OH . 239 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10787.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 172 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 10.9 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 0.8 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-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 . 15 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 26.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 4.2 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 2 0 2 2 0 2 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 0 1 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 PARALLEL BRIDGES PER LADDER . 5 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 1 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 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 A 0 0 113 0, 0.0 205,-0.1 0, 0.0 204,-0.1 0.000 360.0 360.0 360.0 64.2 20.3 87.8 51.6 2 2 A L - 0 0 52 1,-0.1 4,-0.1 203,-0.1 201,-0.0 -0.642 360.0 -95.4 -80.7 149.6 22.0 84.7 50.4 3 3 A P - 0 0 51 0, 0.0 41,-0.2 0, 0.0 3,-0.2 -0.203 23.0-124.6 -59.5 155.1 25.1 83.6 52.4 4 4 A Q S S+ 0 0 83 1,-0.3 40,-2.0 39,-0.1 2,-0.4 0.873 104.7 29.7 -66.9 -36.1 28.6 84.6 51.2 5 5 A T E S-a 44 0A 60 38,-0.2 2,-0.5 40,-0.0 -1,-0.3 -0.998 76.0-153.5-125.9 124.6 29.5 80.9 51.3 6 6 A V E -a 45 0A 0 38,-2.8 40,-2.5 -2,-0.4 2,-0.6 -0.899 15.2-145.0 -96.6 124.6 26.9 78.2 50.7 7 7 A R E -a 46 0A 99 -2,-0.5 58,-2.9 38,-0.2 59,-1.7 -0.831 16.6-165.7 -94.1 117.1 28.0 75.0 52.5 8 8 A I E -ab 47 66A 0 38,-3.2 40,-2.8 -2,-0.6 2,-0.3 -0.941 5.2-151.9-113.3 121.4 27.0 72.0 50.4 9 9 A G E +ab 48 67A 0 57,-2.8 59,-2.0 -2,-0.5 2,-0.3 -0.735 21.3 166.1 -91.1 142.6 27.0 68.5 51.9 10 10 A T E -a 49 0A 0 38,-2.0 40,-1.9 -2,-0.3 2,-0.7 -0.982 36.9-125.5-150.7 155.3 27.6 65.4 49.8 11 11 A D - 0 0 2 -2,-0.3 2,-0.9 38,-0.2 3,-0.3 -0.905 21.9-154.2-106.5 111.4 28.4 61.7 50.4 12 12 A T S S+ 0 0 25 -2,-0.7 8,-0.4 1,-0.2 3,-0.1 -0.052 74.0 82.1 -82.5 34.3 31.4 61.0 48.2 13 13 A T + 0 0 20 -2,-0.9 130,-0.3 6,-0.2 -1,-0.2 -0.172 68.0 84.9-125.9 40.2 30.9 57.2 47.8 14 14 A Y B >> S-E 18 0B 3 4,-2.9 3,-2.0 -3,-0.3 4,-1.8 -0.477 74.7-144.5-140.0 65.0 28.4 57.3 44.9 15 15 A A T 34 S+ 0 0 35 1,-0.3 153,-0.4 2,-0.3 13,-0.1 -0.413 77.0 27.3 -67.6 147.6 30.3 57.5 41.6 16 16 A P T 34 S+ 0 0 20 0, 0.0 13,-2.4 0, 0.0 -1,-0.3 -0.922 129.6 44.2 -89.9 15.3 29.7 58.9 39.0 17 17 A F T <4 S- 0 0 3 -3,-2.0 13,-1.8 1,-0.3 14,-0.9 0.914 129.4 -1.2 -87.4 -42.4 27.6 61.4 40.9 18 18 A S B < S+E 14 0B 1 -4,-1.8 -4,-2.9 12,-0.2 -1,-0.3 -0.912 80.8 121.1-152.6 117.9 29.9 62.1 43.9 19 19 A S E -F 27 0C 23 8,-2.4 8,-2.7 -2,-0.3 2,-0.4 -0.879 50.3-101.8-156.5-171.9 33.3 60.6 44.7 20 20 A K E -F 26 0C 93 -8,-0.4 6,-0.2 -2,-0.3 2,-0.1 -0.933 25.1-138.8-122.5 145.7 36.8 61.7 45.3 21 21 A D > - 0 0 48 4,-2.3 3,-2.0 -2,-0.4 6,-0.0 -0.297 44.9 -78.6 -87.0-168.3 39.8 61.4 43.0 22 22 A A T 3 S+ 0 0 113 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.744 132.4 48.0 -65.5 -27.2 43.4 60.4 43.9 23 23 A K T 3 S- 0 0 166 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.419 120.8-107.2 -87.6 -4.9 44.3 63.7 45.4 24 24 A G < + 0 0 35 -3,-2.0 2,-0.2 1,-0.3 -2,-0.1 0.623 70.0 146.5 86.5 9.7 41.0 63.7 47.5 25 25 A E - 0 0 120 1,-0.1 -4,-2.3 -5,-0.0 -1,-0.3 -0.583 56.4-106.2 -73.7 149.0 39.3 66.4 45.3 26 26 A F E +F 20 0C 49 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.551 47.9 174.8 -77.5 131.9 35.5 66.1 45.0 27 27 A I E +F 19 0C 70 -8,-2.7 -8,-2.4 -2,-0.3 2,-0.2 -0.974 18.7 76.2-139.5 153.2 34.4 64.8 41.5 28 28 A G S > S- 0 0 3 -2,-0.3 4,-2.6 -10,-0.2 3,-0.3 -0.585 82.9 -66.2 134.4 171.2 31.3 63.8 39.7 29 29 A F H > S+ 0 0 0 -13,-2.4 4,-2.6 1,-0.2 -12,-0.2 0.862 127.4 53.4 -62.4 -36.7 28.1 65.0 38.1 30 30 A D H > S+ 0 0 0 -13,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.890 110.5 47.9 -63.9 -36.5 26.6 66.3 41.4 31 31 A I H > S+ 0 0 7 -14,-0.9 4,-2.8 -3,-0.3 5,-0.3 0.931 111.8 49.9 -70.9 -43.7 29.8 68.3 42.0 32 32 A D H X S+ 0 0 32 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.920 113.5 45.1 -61.4 -44.6 29.7 69.7 38.4 33 33 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.933 113.9 49.2 -64.7 -46.1 26.0 70.7 38.7 34 34 A G H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.933 113.4 46.8 -59.7 -47.4 26.6 72.3 42.2 35 35 A N H X S+ 0 0 75 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.906 112.3 48.8 -65.4 -37.3 29.6 74.3 41.0 36 36 A E H X S+ 0 0 38 -4,-2.1 4,-2.5 -5,-0.3 -2,-0.2 0.946 113.1 48.0 -67.6 -45.3 27.9 75.6 37.8 37 37 A M H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.940 110.8 51.2 -59.6 -44.4 24.8 76.6 39.8 38 38 A a H X>S+ 0 0 6 -4,-2.8 5,-2.0 1,-0.2 4,-0.8 0.902 109.2 51.9 -59.3 -40.1 27.1 78.4 42.4 39 39 A K H ><5S+ 0 0 147 -4,-2.1 3,-0.7 1,-0.2 -1,-0.2 0.924 112.4 44.4 -61.7 -49.4 28.8 80.2 39.6 40 40 A R H 3<5S+ 0 0 56 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.819 112.8 51.5 -67.0 -28.4 25.5 81.4 38.1 41 41 A M H 3<5S- 0 0 21 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.620 105.7-132.0 -78.1 -15.3 24.2 82.4 41.6 42 42 A Q T <<5 + 0 0 175 -4,-0.8 2,-0.3 -3,-0.7 -3,-0.2 0.832 64.3 125.4 61.4 39.5 27.4 84.4 42.1 43 43 A V < - 0 0 22 -5,-2.0 2,-0.4 -37,-0.0 -1,-0.3 -0.771 64.2-117.2-115.0 161.4 27.9 82.8 45.6 44 44 A K E -a 5 0A 158 -40,-2.0 -38,-2.8 -2,-0.3 2,-0.4 -0.814 33.2-159.1 -92.8 144.7 31.0 81.0 46.9 45 45 A a E -a 6 0A 29 -2,-0.4 2,-0.4 -40,-0.3 -38,-0.2 -0.977 10.4-159.8-129.8 139.4 30.3 77.3 47.8 46 46 A T E -a 7 0A 62 -40,-2.5 -38,-3.2 -2,-0.4 2,-0.4 -0.965 16.1-139.2-113.3 136.2 32.2 75.0 50.0 47 47 A W E -a 8 0A 36 -2,-0.4 2,-0.4 -40,-0.2 -38,-0.2 -0.808 16.5-168.0 -94.8 138.6 31.8 71.2 49.7 48 48 A V E -a 9 0A 39 -40,-2.8 -38,-2.0 -2,-0.4 2,-0.2 -0.990 14.0-139.7-127.9 120.1 31.5 69.2 52.9 49 49 A A E +a 10 0A 44 -2,-0.4 2,-0.3 -40,-0.2 -38,-0.2 -0.543 32.5 160.9 -82.4 142.2 31.8 65.3 52.8 50 50 A S - 0 0 29 -40,-1.9 -38,-0.2 -2,-0.2 2,-0.2 -0.983 47.0 -92.4-151.8 153.0 29.4 63.4 55.1 51 51 A D >> - 0 0 84 -2,-0.3 3,-1.6 -40,-0.1 4,-0.5 -0.567 47.5-113.6 -59.7 143.4 28.0 59.9 55.5 52 52 A F G >4 S+ 0 0 9 89,-0.5 3,-1.3 1,-0.3 4,-0.5 0.865 113.6 53.2 -51.4 -43.3 24.6 59.9 53.7 53 53 A D G 34 S+ 0 0 70 88,-0.3 -1,-0.3 65,-0.3 66,-0.1 0.625 104.7 56.5 -74.4 -9.6 22.5 59.4 56.8 54 54 A A G <> S+ 0 0 33 -3,-1.6 4,-2.5 2,-0.1 -1,-0.3 0.578 87.8 83.7 -91.0 -7.7 24.1 62.4 58.5 55 55 A L H S+ 0 0 23 -4,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.930 116.3 51.9 -66.8 -40.5 19.6 65.8 56.5 57 57 A P H > S+ 0 0 71 0, 0.0 4,-2.3 0, 0.0 -2,-0.2 0.928 111.2 48.5 -50.6 -49.4 20.5 66.1 60.3 58 58 A S H <>S+ 0 0 19 -4,-2.5 5,-2.7 2,-0.2 6,-0.9 0.873 111.4 49.5 -60.5 -39.6 23.4 68.4 59.4 59 59 A L H ><5S+ 0 0 0 -4,-2.3 3,-1.5 3,-0.2 -1,-0.2 0.925 111.1 48.3 -62.0 -48.7 21.2 70.5 57.2 60 60 A K H 3<5S+ 0 0 111 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.869 112.2 49.7 -63.8 -33.6 18.6 70.8 59.9 61 61 A A T 3<5S- 0 0 64 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.412 114.2-119.0 -82.8 2.2 21.3 71.8 62.4 62 62 A K T < 5S+ 0 0 132 -3,-1.5 -3,-0.2 2,-0.2 -2,-0.1 0.694 77.9 127.0 63.7 26.3 22.7 74.4 59.9 63 63 A K S - 0 0 9 -2,-0.8 4,-2.1 118,-0.2 5,-0.2 -0.909 49.9-115.4-121.9 161.7 10.0 62.0 48.3 75 75 A D H > S+ 0 0 128 -2,-0.3 4,-0.7 1,-0.2 -1,-0.1 0.907 115.7 51.5 -58.4 -46.8 6.8 62.7 50.1 76 76 A K H >> S+ 0 0 163 113,-0.3 3,-1.1 1,-0.2 4,-0.5 0.939 109.4 47.6 -58.3 -49.5 8.4 61.8 53.4 77 77 A R H >> S+ 0 0 19 1,-0.2 4,-2.9 2,-0.2 3,-1.4 0.854 103.3 63.0 -62.0 -32.5 11.4 64.0 53.0 78 78 A Q H 3< S+ 0 0 90 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.680 93.4 63.8 -67.4 -16.4 9.2 67.0 51.9 79 79 A Q H << S+ 0 0 124 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.786 117.9 27.0 -72.8 -25.0 7.6 66.9 55.4 80 80 A E H << S+ 0 0 81 -3,-1.4 121,-0.4 -4,-0.5 2,-0.2 0.782 127.5 15.5-105.7 -39.2 11.0 67.8 56.8 81 81 A I < - 0 0 2 -4,-2.9 2,-0.3 119,-0.1 119,-0.2 -0.757 68.3-116.6-131.4 176.8 13.0 69.7 54.1 82 82 A A E -D 199 0A 20 117,-3.1 117,-2.9 -2,-0.2 2,-0.4 -0.789 25.6-148.4-112.3 159.4 12.4 71.6 50.9 83 83 A F E -D 198 0A 9 -2,-0.3 115,-0.2 115,-0.2 3,-0.1 -0.956 11.3-127.7-129.6 145.9 13.9 70.7 47.5 84 84 A S - 0 0 4 113,-2.0 3,-0.1 -2,-0.4 124,-0.1 -0.243 56.2 -73.0 -63.1 177.1 15.0 72.6 44.4 85 85 A D S S- 0 0 82 122,-0.2 112,-0.4 1,-0.2 -1,-0.2 -0.259 77.5 -60.2 -61.5 165.8 13.4 71.4 41.0 86 86 A K - 0 0 39 1,-0.1 110,-0.2 110,-0.1 -1,-0.2 -0.230 41.2-173.1 -59.5 130.2 14.6 68.1 39.7 87 87 A L S S- 0 0 1 108,-3.0 2,-0.3 1,-0.4 109,-0.2 0.819 70.2 -30.9 -88.0 -42.5 18.3 67.7 38.9 88 88 A Y B -H 195 0D 1 107,-0.7 107,-2.5 148,-0.1 -1,-0.4 -0.959 68.8 -90.2-167.3 167.8 18.0 64.2 37.2 89 89 A A - 0 0 31 146,-2.2 2,-0.3 -2,-0.3 148,-0.1 -0.435 33.6-167.6 -84.2 157.6 15.9 61.0 37.4 90 90 A A - 0 0 14 -2,-0.1 104,-0.4 102,-0.1 2,-0.3 -0.833 6.2-179.7-151.7 109.7 16.9 58.1 39.7 91 91 A D - 0 0 61 -2,-0.3 71,-3.0 102,-0.1 2,-0.3 -0.734 25.1-123.9-100.5 160.0 15.4 54.6 39.6 92 92 A S E +IJ 161 185E 2 93,-0.7 93,-2.7 69,-0.3 2,-0.3 -0.816 31.5 170.7-102.3 146.6 16.3 51.7 41.9 93 93 A R E -I 160 0E 60 67,-2.2 67,-1.2 -2,-0.3 2,-0.2 -0.994 29.3-118.3-155.0 145.5 17.6 48.3 40.7 94 94 A L E -I 159 0E 0 87,-0.5 87,-2.7 89,-0.4 2,-0.4 -0.581 22.8-161.9 -81.8 145.5 19.1 45.1 42.2 95 95 A I E +IK 158 180E 0 63,-2.0 63,-1.7 85,-0.3 2,-0.3 -0.956 19.8 152.5-123.7 148.5 22.5 43.9 41.3 96 96 A A E -IK 157 179E 2 83,-2.5 83,-2.6 -2,-0.4 61,-0.1 -0.878 51.8 -52.6-156.1 177.9 23.9 40.3 41.9 97 97 A A E > - K 0 178E 48 59,-0.5 3,-2.3 -2,-0.3 81,-0.3 -0.352 69.6 -91.4 -60.1 143.8 26.4 37.9 40.4 98 98 A K T 3 S+ 0 0 122 79,-2.6 -1,-0.1 1,-0.3 83,-0.1 -0.302 116.2 23.5 -54.9 135.7 26.1 37.2 36.6 99 99 A G T 3 S+ 0 0 85 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.407 87.8 150.3 85.1 -8.8 23.8 34.3 36.1 100 100 A S < - 0 0 37 -3,-2.3 -1,-0.3 1,-0.1 -4,-0.1 -0.330 47.0-144.9 -55.0 134.0 22.1 34.7 39.4 101 101 A P + 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.589 58.9 131.2 -69.3 -10.6 18.5 33.6 39.5 102 102 A I + 0 0 6 -5,-0.1 -6,-0.1 54,-0.1 7,-0.1 -0.113 32.2 178.5 -56.4 133.7 17.8 36.5 41.9 103 103 A Q - 0 0 86 2,-0.2 2,-2.7 79,-0.0 79,-0.2 -0.928 46.6 -99.0-126.2 155.6 14.8 38.6 41.1 104 104 A P S S+ 0 0 28 0, 0.0 2,-0.3 0, 0.0 3,-0.1 -0.252 87.8 111.6 -71.2 55.4 13.6 41.6 43.2 105 105 A T S > S- 0 0 52 -2,-2.7 4,-2.2 1,-0.1 -2,-0.2 -0.951 76.4-122.9-132.1 160.1 10.9 39.4 44.9 106 106 A L H > S+ 0 0 53 -2,-0.3 4,-2.3 1,-0.2 -1,-0.1 0.914 112.8 54.3 -65.8 -40.5 10.3 38.1 48.3 107 107 A E H 4 S+ 0 0 153 1,-0.2 -1,-0.2 2,-0.2 0, 0.0 0.848 113.1 42.4 -63.3 -36.9 10.3 34.5 47.1 108 108 A S H 4 S+ 0 0 32 -3,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.842 121.6 39.4 -76.3 -37.2 13.7 35.0 45.4 109 109 A L H >< S+ 0 0 0 -4,-2.2 3,-2.9 -6,-0.1 27,-0.4 0.574 76.8 121.7 -95.3 -14.5 15.3 36.9 48.2 110 110 A K T 3< S+ 0 0 54 -4,-2.3 25,-0.2 1,-0.3 24,-0.1 -0.316 90.1 12.2 -57.4 131.4 14.0 35.2 51.4 111 111 A G T 3 S+ 0 0 58 23,-1.7 -1,-0.3 1,-0.3 2,-0.2 0.455 104.1 117.4 78.8 -0.3 17.1 34.0 53.2 112 112 A K < - 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