==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 18-JAN-06 2FQW . COMPND 2 MOLECULE: MEMBRANE LIPOPROTEIN TMPC; . SOURCE 2 ORGANISM_SCIENTIFIC: TREPONEMA PALLIDUM; . AUTHOR C.A.BRAUTIGAM,R.K.DEKA,D.R.TOMCHICK,M.MACHIUS,M.V.NORGARD . 316 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13569.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 239 75.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 15.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.6 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 . 1 0.3 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-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 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 34.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.5 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 2 0 0 2 2 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 5 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 18 A G 0 0 125 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -23.7 64.9 72.3 10.6 2 19 A D - 0 0 77 34,-0.0 2,-0.5 35,-0.0 34,-0.1 -0.980 360.0 -98.8-150.8 162.0 62.2 70.6 12.6 3 20 A F - 0 0 46 -2,-0.3 34,-2.5 32,-0.2 2,-0.4 -0.728 52.4-160.3 -77.9 128.4 60.4 67.3 13.3 4 21 A V E -a 37 0A 33 -2,-0.5 58,-1.6 56,-0.2 59,-1.6 -0.950 19.9-160.6-123.4 135.8 57.2 67.8 11.2 5 22 A V E -ab 38 63A 0 32,-2.2 34,-1.9 -2,-0.4 2,-0.5 -0.958 14.0-163.3-109.9 126.4 53.8 66.1 11.4 6 23 A G E -ab 39 64A 0 57,-2.4 59,-2.9 -2,-0.5 2,-0.4 -0.945 2.7-155.3-116.2 125.7 51.7 66.4 8.3 7 24 A M E -ab 40 65A 0 32,-2.7 34,-2.4 -2,-0.5 2,-0.5 -0.794 6.1-169.4-101.4 132.8 47.9 65.7 8.3 8 25 A V E +ab 41 66A 0 57,-2.9 59,-2.0 -2,-0.4 2,-0.3 -0.988 13.6 176.7-119.3 123.1 46.0 64.7 5.1 9 26 A T E -a 42 0A 0 32,-2.0 34,-3.5 -2,-0.5 59,-0.1 -0.869 38.7-136.8-124.5 161.0 42.2 64.6 5.3 10 27 A D S S+ 0 0 39 57,-0.4 2,-0.3 -2,-0.3 32,-0.1 0.543 85.3 88.8 -87.8 -8.3 39.4 64.0 2.9 11 28 A S S S- 0 0 17 1,-0.1 -2,-0.2 56,-0.1 32,-0.2 -0.653 71.5-146.0 -92.7 144.4 37.6 67.0 4.4 12 29 A G S S+ 0 0 46 -2,-0.3 2,-0.4 1,-0.1 -1,-0.1 0.363 83.6 71.6 -85.0 9.3 38.0 70.6 3.2 13 30 A D > + 0 0 76 1,-0.1 3,-0.6 3,-0.0 7,-0.2 -0.897 40.7 171.5-137.2 115.1 37.5 71.6 6.9 14 31 A I T 3 S+ 0 0 31 -2,-0.4 3,-0.1 1,-0.2 10,-0.1 0.480 87.8 62.5 -89.8 -2.3 39.7 71.3 10.0 15 32 A D T 3 + 0 0 91 1,-0.1 -1,-0.2 2,-0.1 4,-0.0 -0.205 60.8 129.9-113.1 40.8 37.2 73.5 12.0 16 33 A D S < S- 0 0 11 -3,-0.6 3,-0.2 1,-0.1 -1,-0.1 0.327 74.1-122.5 -75.8 7.8 34.3 71.1 11.6 17 34 A K S S+ 0 0 83 1,-0.2 205,-0.3 -3,-0.1 -1,-0.1 0.667 90.4 42.5 58.1 18.9 33.7 71.3 15.4 18 35 A S S > S+ 0 0 0 203,-0.1 4,-2.0 201,-0.0 -1,-0.2 -0.166 112.3 0.2-150.5-116.5 34.2 67.5 15.5 19 36 A F H > S+ 0 0 25 2,-0.2 4,-2.3 -3,-0.2 5,-0.2 0.911 126.6 39.8 -62.3 -56.4 36.5 64.9 14.1 20 37 A N H > S+ 0 0 10 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.881 115.7 54.7 -64.5 -34.4 39.0 66.7 11.9 21 38 A Q H > S+ 0 0 29 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.898 107.7 49.6 -63.4 -41.0 39.1 69.5 14.5 22 39 A Q H X S+ 0 0 14 -4,-2.0 4,-2.1 2,-0.2 5,-0.2 0.942 111.9 48.0 -64.8 -45.0 40.1 66.9 17.2 23 40 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.946 113.8 45.6 -62.2 -46.7 42.8 65.4 15.1 24 41 A W H X S+ 0 0 50 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.895 110.9 54.3 -63.5 -39.3 44.4 68.7 14.2 25 42 A E H X S+ 0 0 78 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.888 108.8 48.2 -64.2 -36.0 44.2 69.9 17.8 26 43 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.910 112.8 47.1 -68.5 -41.4 46.1 66.8 19.0 27 44 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.917 112.4 51.6 -65.2 -40.3 48.8 67.2 16.3 28 45 A S H X S+ 0 0 38 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.883 108.4 50.2 -64.3 -40.7 49.0 70.9 17.2 29 46 A R H X S+ 0 0 74 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.929 108.9 51.9 -65.0 -43.4 49.4 70.2 20.9 30 47 A F H X S+ 0 0 0 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.954 113.1 45.6 -56.3 -49.4 52.2 67.7 20.2 31 48 A A H X>S+ 0 0 7 -4,-2.4 5,-2.6 1,-0.2 4,-0.5 0.921 113.3 47.7 -59.7 -49.1 54.0 70.3 18.1 32 49 A Q H ><5S+ 0 0 154 -4,-2.7 3,-0.7 1,-0.2 -1,-0.2 0.916 115.1 45.7 -59.6 -44.5 53.6 73.1 20.6 33 50 A E H 3<5S+ 0 0 123 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.645 119.0 40.5 -75.5 -16.6 54.7 71.0 23.5 34 51 A N H 3<5S- 0 0 30 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.227 108.0-113.1-117.8 15.2 57.7 69.5 21.8 35 52 A N T <<5S+ 0 0 142 -3,-0.7 -32,-0.2 -4,-0.5 -3,-0.2 0.909 77.9 124.3 55.9 44.8 59.1 72.5 19.9 36 53 A A < - 0 0 14 -5,-2.6 2,-0.3 -6,-0.2 -32,-0.2 -0.529 53.7-115.5-121.8-171.5 58.1 70.8 16.6 37 54 A K E -a 4 0A 121 -34,-2.5 -32,-2.2 -2,-0.2 2,-0.3 -0.895 20.9-173.3-132.6 160.9 56.0 71.7 13.6 38 55 A C E +a 5 0A 37 -2,-0.3 2,-0.3 -34,-0.2 -32,-0.2 -0.986 6.2 170.6-150.6 158.3 52.9 70.7 11.8 39 56 A K E -a 6 0A 82 -34,-1.9 -32,-2.7 -2,-0.3 2,-0.3 -0.975 13.9-148.5-158.2 165.0 50.8 71.3 8.7 40 57 A Y E -a 7 0A 98 -2,-0.3 2,-0.3 -34,-0.2 -32,-0.2 -0.941 3.0-160.6-140.5 164.9 47.8 69.8 6.9 41 58 A V E -a 8 0A 44 -34,-2.4 -32,-2.0 -2,-0.3 2,-0.4 -0.990 18.5-129.6-143.5 146.3 46.4 69.4 3.4 42 59 A T E -a 9 0A 31 -2,-0.3 2,-0.5 -34,-0.2 -32,-0.2 -0.836 8.7-164.5-100.9 133.7 42.9 68.6 2.1 43 60 A A + 0 0 0 -34,-3.5 6,-0.1 -2,-0.4 -31,-0.1 -0.662 14.5 174.1-115.1 71.5 42.3 65.8 -0.4 44 61 A S + 0 0 86 -2,-0.5 2,-0.3 -33,-0.1 -1,-0.2 0.878 68.9 31.2 -41.6 -53.7 38.8 66.8 -1.5 45 62 A T S > S- 0 0 61 -3,-0.2 3,-1.6 1,-0.1 4,-0.4 -0.753 85.2-116.9-110.0 159.1 38.8 64.1 -4.2 46 63 A D T 3> S+ 0 0 109 -2,-0.3 4,-0.6 1,-0.3 3,-0.5 0.650 107.6 74.4 -69.6 -13.3 40.4 60.7 -4.3 47 64 A A T 34 S+ 0 0 76 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.731 99.7 49.2 -69.1 -18.1 42.6 61.7 -7.3 48 65 A E T <> S+ 0 0 70 -3,-1.6 4,-2.4 2,-0.1 5,-0.3 0.632 88.5 84.7 -93.5 -17.2 44.5 63.7 -4.7 49 66 A Y H > S+ 0 0 22 -3,-0.5 4,-2.0 -4,-0.4 5,-0.2 0.930 94.7 38.6 -53.0 -57.0 45.0 61.0 -2.1 50 67 A V H X S+ 0 0 45 -4,-0.6 4,-2.6 1,-0.2 5,-0.2 0.950 118.0 46.8 -64.2 -49.9 48.1 59.3 -3.5 51 68 A P H > S+ 0 0 73 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.857 111.8 52.9 -63.5 -29.6 49.9 62.5 -4.6 52 69 A S H X S+ 0 0 18 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.923 112.4 42.4 -69.4 -45.7 49.2 64.2 -1.3 53 70 A L H X S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.3 5,-0.2 0.908 114.5 54.1 -66.0 -40.3 50.6 61.4 0.8 54 71 A S H X S+ 0 0 12 -4,-2.6 4,-2.8 -5,-0.2 -2,-0.2 0.907 104.4 52.4 -61.0 -44.0 53.5 61.1 -1.6 55 72 A A H X S+ 0 0 46 -4,-2.2 4,-1.0 2,-0.2 -1,-0.2 0.917 111.3 47.0 -59.3 -44.6 54.5 64.8 -1.4 56 73 A F H ><>S+ 0 0 15 -4,-1.5 5,-1.1 1,-0.2 3,-0.7 0.909 111.5 50.7 -64.2 -43.0 54.6 64.6 2.4 57 74 A A H ><5S+ 0 0 5 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.906 106.8 56.3 -61.8 -38.0 56.7 61.4 2.2 58 75 A D H 3<5S+ 0 0 104 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.748 101.6 56.0 -66.7 -20.6 59.0 63.2 -0.3 59 76 A E T <<5S- 0 0 105 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.311 111.4-122.7 -91.0 9.1 59.6 65.9 2.3 60 77 A N T < 5 - 0 0 139 -3,-1.7 -56,-0.2 1,-0.1 -3,-0.2 0.929 40.1-168.8 48.7 56.8 60.8 63.3 4.8 61 78 A M < - 0 0 12 -5,-1.1 25,-0.4 1,-0.1 3,-0.2 -0.345 31.3-123.0 -72.1 156.0 58.3 64.2 7.5 62 79 A G S S- 0 0 16 -58,-1.6 2,-0.3 1,-0.3 24,-0.3 0.906 94.1 -3.1 -64.8 -39.7 58.5 62.9 10.9 63 80 A L E -b 5 0A 0 -59,-1.6 -57,-2.4 22,-0.1 2,-0.5 -0.970 59.5-149.4-155.3 136.3 55.0 61.4 10.6 64 81 A V E -bc 6 87A 0 22,-2.1 24,-2.9 -2,-0.3 2,-0.5 -0.934 18.6-158.7-106.6 125.1 52.3 61.5 8.0 65 82 A V E -bc 7 88A 0 -59,-2.9 -57,-2.9 -2,-0.5 2,-0.5 -0.934 5.5-168.2-110.4 120.9 48.7 61.3 9.5 66 83 A A E -bc 8 89A 2 22,-3.0 24,-2.5 -2,-0.5 2,-0.5 -0.925 11.4-147.2-110.1 122.1 45.8 60.1 7.3 67 84 A C E - c 0 90A 0 -59,-2.0 -57,-0.4 -2,-0.5 4,-0.3 -0.742 48.8 -8.1 -95.0 124.2 42.3 60.6 8.6 68 85 A G S > S- 0 0 8 22,-3.2 3,-1.1 -2,-0.5 4,-0.4 0.154 82.3 -67.3 89.0 160.2 39.4 58.1 7.8 69 86 A S G > S+ 0 0 40 22,-0.3 3,-0.8 1,-0.2 4,-0.4 0.706 116.5 68.6 -59.3 -27.7 38.5 55.1 5.8 70 87 A F G 3 S+ 0 0 77 1,-0.2 4,-0.3 -3,-0.2 3,-0.3 0.835 100.4 47.4 -67.1 -30.2 38.6 56.9 2.4 71 88 A L G <> S+ 0 0 1 -3,-1.1 4,-2.3 -4,-0.3 -1,-0.2 0.499 86.0 93.3 -89.1 -4.5 42.4 57.3 2.5 72 89 A V H <> S+ 0 0 25 -3,-0.8 4,-2.9 -4,-0.4 5,-0.2 0.917 81.6 51.2 -55.5 -51.1 43.1 53.7 3.5 73 90 A E H > S+ 0 0 167 -4,-0.4 4,-1.8 -3,-0.3 -1,-0.2 0.931 113.0 48.0 -56.3 -44.0 43.7 52.3 0.0 74 91 A A H > S+ 0 0 6 -4,-0.3 4,-2.6 1,-0.2 5,-0.2 0.874 111.7 49.3 -64.8 -39.0 46.1 55.2 -0.7 75 92 A V H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 5,-0.3 0.928 106.6 55.8 -66.9 -42.2 48.0 54.6 2.6 76 93 A I H X S+ 0 0 62 -4,-2.9 4,-0.8 1,-0.2 -2,-0.2 0.933 116.4 37.0 -54.1 -45.2 48.3 50.9 2.0 77 94 A E H X S+ 0 0 104 -4,-1.8 4,-1.2 -5,-0.2 3,-0.3 0.929 118.1 47.6 -74.4 -46.5 50.0 51.5 -1.4 78 95 A T H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 3,-0.2 0.860 105.4 58.4 -65.3 -37.9 52.1 54.6 -0.5 79 96 A S H < S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.2 6,-0.2 0.850 105.5 51.3 -62.9 -30.9 53.4 53.0 2.7 80 97 A A H < S+ 0 0 57 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.825 109.3 51.1 -72.9 -31.7 54.9 50.2 0.6 81 98 A R H < S+ 0 0 134 -4,-1.2 -2,-0.2 1,-0.3 -1,-0.2 0.790 118.0 37.3 -75.3 -29.8 56.5 52.7 -1.7 82 99 A F >< + 0 0 39 -4,-1.8 3,-2.2 1,-0.1 -1,-0.3 -0.623 68.6 169.6-122.6 70.2 58.1 54.6 1.2 83 100 A P T 3 S+ 0 0 97 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.684 77.4 53.6 -55.8 -19.5 59.1 51.9 3.6 84 101 A K T 3 S+ 0 0 210 -3,-0.1 2,-0.4 2,-0.1 -5,-0.1 0.474 89.9 90.6 -95.1 -4.8 61.2 54.4 5.7 85 102 A Q S < S- 0 0 15 -3,-2.2 2,-0.4 -6,-0.2 -3,-0.1 -0.764 73.4-133.3 -93.4 136.8 58.4 56.9 6.2 86 103 A K - 0 0 65 -25,-0.4 -22,-2.1 -2,-0.4 2,-0.4 -0.745 23.9-171.0 -90.3 138.5 56.1 56.5 9.2 87 104 A F E -cd 64 100A 1 12,-2.5 14,-2.3 -2,-0.4 2,-0.5 -0.970 13.0-159.4-128.9 144.3 52.3 56.8 8.7 88 105 A L E -cd 65 101A 0 -24,-2.9 -22,-3.0 -2,-0.4 2,-0.5 -0.993 7.7-162.1-122.6 125.6 49.5 56.9 11.2 89 106 A V E -cd 66 102A 1 12,-2.8 14,-3.2 -2,-0.5 2,-0.5 -0.917 6.6-159.0-106.0 127.6 46.0 56.0 10.0 90 107 A I E S+cd 67 103A 0 -24,-2.5 -22,-3.2 -2,-0.5 14,-0.2 -0.946 71.8 7.0-111.5 129.4 43.1 57.2 12.2 91 108 A D S S+ 0 0 18 12,-2.7 49,-0.5 -2,-0.5 -22,-0.3 0.620 117.9 65.2 82.1 16.7 39.7 55.5 12.0 92 109 A A S S- 0 0 6 11,-0.5 2,-0.4 -3,-0.2 -1,-0.2 -0.968 75.1-113.0-159.1 168.7 40.7 52.6 9.7 93 110 A V - 0 0 56 -2,-0.3 2,-0.4 9,-0.1 173,-0.1 -0.922 18.7-173.1-119.8 135.1 43.0 49.5 9.7 94 111 A V - 0 0 8 -2,-0.4 2,-0.3 -5,-0.1 3,-0.2 -0.984 10.8-165.6-123.1 132.4 46.1 48.7 7.7 95 112 A Q + 0 0 125 -2,-0.4 170,-0.1 1,-0.2 3,-0.1 -0.762 61.8 25.2-113.4 162.4 47.7 45.3 7.8 96 113 A D S S+ 0 0 148 -2,-0.3 2,-0.4 168,-0.2 -1,-0.2 0.749 86.6 112.1 61.3 29.4 51.2 44.1 6.6 97 114 A R > - 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0 0 0 -2,-0.3 3,-1.7 -169,-0.2 4,-0.4 -0.302 34.0-102.6 -73.2 161.7 22.9 46.5 14.4 312 329 A A G > S+ 0 0 63 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.870 121.6 54.0 -49.3 -45.4 20.1 44.0 14.2 313 330 A R G 3 S+ 0 0 139 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.696 109.6 48.5 -68.1 -16.6 18.9 45.3 10.9 314 331 A M G < S+ 0 0 64 -3,-1.7 -1,-0.3 -172,-0.1 2,-0.2 0.336 99.0 86.6-102.4 4.2 22.4 44.8 9.4 315 332 A M < 0 0 99 -3,-1.4 -4,-0.0 -4,-0.4 -3,-0.0 -0.691 360.0 360.0-103.4 158.5 22.8 41.3 10.7 316 333 A N 0 0 239 -2,-0.2 -1,-0.1 0, 0.0 -4,-0.0 0.872 360.0 360.0 -81.9 360.0 21.8 38.0 9.1