==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 10-NOV-10 3PJL . COMPND 2 MOLECULE: 34 KDA MEMBRANE ANTIGEN; . SOURCE 2 ORGANISM_SCIENTIFIC: TREPONEMA PALLIDUM; . AUTHOR C.A.BRAUTIGAM,R.K.DEKA,D.R.TOMCHICK,M.MACHIUS,M.V.NORGARD . 314 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15007.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 192 61.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 36.3 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 . 4 1.3 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 . 29 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 1.9 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+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 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 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 PARALLEL BRIDGES PER LADDER . 2 4 2 2 4 0 0 6 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 2 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 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 29 A D 0 0 161 0, 0.0 2,-0.4 0, 0.0 21,-0.2 0.000 360.0 360.0 360.0 124.4 8.1 39.4 79.7 2 30 A E - 0 0 113 19,-0.1 19,-0.2 17,-0.0 17,-0.0 -0.963 360.0-149.9-123.9 144.0 7.9 41.3 76.4 3 31 A F E -A 20 0A 54 17,-2.8 17,-2.8 -2,-0.4 2,-0.2 -0.870 25.0-112.1-113.7 142.4 8.0 45.0 75.7 4 32 A P E -A 19 0A 94 0, 0.0 15,-0.3 0, 0.0 3,-0.1 -0.474 14.3-163.3 -78.5 143.2 6.3 46.7 72.8 5 33 A I S S- 0 0 9 13,-2.5 2,-0.3 1,-0.4 146,-0.2 0.844 70.8 -62.2 -82.5 -35.6 8.2 48.4 69.9 6 34 A G S S- 0 0 28 12,-0.7 12,-0.4 144,-0.1 -1,-0.4 -0.962 81.4 -29.2 172.9-172.3 5.0 50.2 69.0 7 35 A E S S- 0 0 153 -2,-0.3 0, 0.0 -3,-0.1 0, 0.0 -0.359 71.3 -99.9 -64.2 139.4 1.4 49.6 67.8 8 36 A D - 0 0 87 9,-0.1 2,-0.3 -2,-0.1 9,-0.2 -0.264 41.3-145.0 -55.5 147.7 0.8 46.5 65.7 9 37 A R E -B 16 0A 82 7,-2.9 7,-3.3 -3,-0.1 2,-0.5 -0.860 11.6-151.9-116.9 145.4 0.7 47.1 61.9 10 38 A D E +B 15 0A 103 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.992 24.9 168.8-114.1 126.8 -1.4 45.6 59.1 11 39 A V E > -B 14 0A 30 3,-2.6 3,-2.5 -2,-0.5 39,-0.1 -0.986 58.5 -44.4-141.5 120.9 0.4 45.7 55.8 12 40 A G T 3 S- 0 0 46 -2,-0.4 40,-0.3 1,-0.3 41,-0.2 -0.319 124.8 -20.2 51.5-132.4 -0.7 43.9 52.7 13 41 A P T 3 S+ 0 0 18 0, 0.0 37,-2.2 0, 0.0 2,-0.4 0.250 121.5 92.4 -86.3 12.9 -1.6 40.3 53.8 14 42 A L E < -BC 11 49A 0 -3,-2.5 -3,-2.6 35,-0.2 2,-0.5 -0.901 57.9-155.3-116.9 139.4 0.5 40.5 57.0 15 43 A H E -BC 10 48A 56 33,-3.1 33,-2.1 -2,-0.4 2,-0.5 -0.943 28.2-166.0 -98.5 126.5 -0.3 41.5 60.6 16 44 A V E -BC 9 47A 0 -7,-3.3 -7,-2.9 -2,-0.5 2,-0.3 -0.955 13.1-179.6-125.1 124.8 3.1 42.6 62.0 17 45 A G E - C 0 46A 6 29,-2.4 29,-2.5 -2,-0.5 2,-0.4 -0.867 10.9-155.9-115.5 152.2 3.9 43.1 65.7 18 46 A G E + C 0 45A 4 -12,-0.4 -13,-2.5 -2,-0.3 -12,-0.7 -0.998 19.4 163.0-130.8 129.4 7.3 44.2 67.1 19 47 A V E -AC 4 44A 30 25,-1.7 25,-2.6 -2,-0.4 2,-0.3 -0.947 14.6-161.8-135.9 163.2 8.5 43.5 70.7 20 48 A Y E +AC 3 43A 6 -17,-2.8 -17,-2.8 -2,-0.3 2,-0.3 -0.973 16.9 150.0-142.4 160.6 11.8 43.6 72.5 21 49 A F E - C 0 42A 5 21,-2.0 21,-2.8 -2,-0.3 -19,-0.1 -0.888 53.5 -30.3-168.0-168.9 13.3 42.1 75.7 22 50 A Q S S- 0 0 33 -2,-0.3 19,-0.2 -21,-0.2 18,-0.1 -0.209 75.3 -89.5 -61.7 149.1 16.6 40.9 77.1 23 51 A P - 0 0 14 0, 0.0 2,-0.3 0, 0.0 19,-0.2 -0.219 48.7-150.6 -51.8 148.7 19.2 39.4 74.8 24 52 A V - 0 0 0 17,-0.1 2,-0.5 -3,-0.1 15,-0.1 -0.811 14.5-116.9-124.0 157.9 18.8 35.7 74.4 25 53 A E - 0 0 99 -2,-0.3 261,-3.2 10,-0.1 262,-0.8 -0.872 35.6-165.8 -91.6 129.6 21.1 32.8 73.7 26 54 A M E -D 285 0A 12 -2,-0.5 259,-0.2 259,-0.2 10,-0.1 -0.880 18.3-114.0-117.5 148.1 20.2 31.0 70.4 27 55 A H E S+D 284 0A 75 257,-2.6 257,-2.0 -2,-0.4 2,-0.2 -0.983 106.1 15.6-125.0 123.5 21.3 27.7 69.0 28 56 A P S S- 0 0 25 0, 0.0 -1,-0.2 0, 0.0 256,-0.1 0.739 101.8-118.5 -69.3 169.5 22.9 27.9 66.6 29 57 A A - 0 0 82 -2,-0.2 2,-0.2 254,-0.1 -2,-0.1 -0.643 40.5-122.2 -74.1 124.2 23.8 31.6 67.0 30 58 A P > - 0 0 11 0, 0.0 3,-1.9 0, 0.0 250,-0.1 -0.506 46.3 -53.4 -79.9 133.6 22.3 33.1 63.7 31 59 A G T 3 S- 0 0 86 -2,-0.2 55,-0.0 1,-0.2 -2,-0.0 -0.062 107.9 -29.6 47.1-135.4 24.3 34.9 61.1 32 60 A A T 3 S+ 0 0 106 53,-0.1 -1,-0.2 2,-0.0 -3,-0.0 0.017 92.2 139.2-105.6 25.5 26.4 37.9 62.4 33 61 A Q < - 0 0 33 -3,-1.9 68,-0.1 1,-0.1 6,-0.1 -0.338 58.8 -98.3 -73.1 151.4 24.1 38.8 65.4 34 62 A P - 0 0 32 0, 0.0 66,-0.2 0, 0.0 -1,-0.1 -0.300 40.7-105.1 -66.2 153.1 25.7 39.8 68.7 35 63 A S > - 0 0 58 1,-0.1 4,-2.4 -6,-0.1 -10,-0.1 -0.173 37.3 -96.9 -65.3 167.9 26.0 37.3 71.5 36 64 A K T 4 S+ 0 0 78 1,-0.2 -1,-0.1 2,-0.2 -11,-0.1 0.899 127.8 44.8 -54.1 -41.8 23.7 37.4 74.5 37 65 A E T 4 S+ 0 0 163 1,-0.2 -1,-0.2 -13,-0.0 -12,-0.0 0.845 115.8 45.3 -71.6 -36.3 26.5 39.3 76.4 38 66 A E T 4 S+ 0 0 109 64,-0.0 -2,-0.2 62,-0.0 -1,-0.2 0.764 98.8 87.2 -79.5 -28.6 27.3 41.7 73.5 39 67 A A < - 0 0 12 -4,-2.4 63,-0.3 1,-0.1 3,-0.1 -0.268 63.4-149.8 -75.8 158.5 23.7 42.6 72.6 40 68 A D S S- 0 0 53 61,-2.6 2,-0.3 1,-0.3 62,-0.2 0.788 75.8 -25.9 -87.9 -37.9 21.5 45.3 74.1 41 69 A C E - E 0 101A 0 60,-1.9 60,-2.7 -19,-0.2 2,-0.4 -0.933 59.0-106.7-160.4 174.6 18.2 43.4 73.5 42 70 A H E -CE 21 100A 0 -21,-2.8 -21,-2.0 -2,-0.3 2,-0.4 -0.976 32.2-161.7-111.9 134.9 16.4 40.8 71.4 43 71 A I E -CE 20 99A 2 56,-2.9 56,-2.4 -2,-0.4 2,-0.4 -0.962 5.2-164.4-118.4 136.2 13.9 42.2 68.9 44 72 A E E -CE 19 98A 10 -25,-2.6 -25,-1.7 -2,-0.4 2,-0.6 -0.946 15.0-151.2-119.3 144.9 11.2 40.0 67.4 45 73 A A E -CE 18 97A 0 52,-3.2 52,-2.0 -2,-0.4 2,-0.7 -0.972 14.4-157.6-107.9 122.3 8.9 40.5 64.4 46 74 A D E -C 17 0A 75 -29,-2.5 -29,-2.4 -2,-0.6 2,-0.5 -0.885 18.0-178.9-100.7 112.2 5.7 38.6 65.0 47 75 A I E +C 16 0A 0 -2,-0.7 17,-1.5 -31,-0.2 2,-0.3 -0.952 9.7 158.5-126.0 120.9 4.2 38.0 61.5 48 76 A H E -CF 15 63A 44 -33,-2.1 -33,-3.1 -2,-0.5 15,-0.2 -0.914 44.5 -94.1-134.4 158.3 0.9 36.3 60.8 49 77 A A E -C 14 0A 3 13,-2.4 12,-2.8 10,-0.4 -35,-0.2 -0.514 36.6-158.9 -72.6 139.5 -1.5 36.3 57.9 50 78 A N > - 0 0 24 -37,-2.2 3,-1.3 -2,-0.2 4,-0.4 -0.331 46.7 -74.0 -98.7-170.0 -4.4 38.7 58.1 51 79 A E G > S+ 0 0 127 1,-0.3 3,-1.3 2,-0.2 4,-0.3 0.846 133.2 57.1 -55.8 -36.2 -7.7 38.4 56.2 52 80 A A G > S+ 0 0 53 -40,-0.3 3,-0.9 1,-0.3 -1,-0.3 0.730 95.7 69.0 -68.4 -19.7 -6.0 39.5 52.9 53 81 A G G X >S+ 0 0 0 -3,-1.3 5,-1.6 -40,-0.3 3,-1.4 0.674 78.0 77.1 -68.3 -19.4 -3.6 36.6 53.4 54 82 A K G X 5S+ 0 0 107 -3,-1.3 3,-1.7 -4,-0.4 -1,-0.2 0.861 85.5 63.6 -65.5 -28.8 -6.3 34.0 52.8 55 83 A D G < 5S+ 0 0 94 -3,-0.9 81,-2.2 -4,-0.3 80,-0.4 0.713 100.4 51.8 -66.1 -20.6 -5.9 34.8 49.0 56 84 A L G < 5S- 0 0 5 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.379 126.2-104.0 -89.5 -1.4 -2.3 33.5 49.2 57 85 A G T < 5S+ 0 0 3 -3,-1.7 192,-0.2 1,-0.3 -3,-0.2 0.433 75.4 138.3 93.0 -0.8 -3.6 30.3 50.8 58 86 A Y < - 0 0 5 -5,-1.6 -1,-0.3 194,-0.2 2,-0.3 -0.523 60.3-114.1 -76.6 146.4 -2.6 31.0 54.4 59 87 A G > - 0 0 29 -2,-0.2 3,-2.3 4,-0.2 -10,-0.4 -0.602 45.3-101.8 -66.2 135.0 -4.9 30.2 57.3 60 88 A V T 3 S+ 0 0 67 -2,-0.3 -10,-0.2 1,-0.3 3,-0.1 -0.484 111.7 20.7 -65.2 133.0 -5.8 33.6 58.8 61 89 A G T 3 S+ 0 0 48 -12,-2.8 -1,-0.3 1,-0.3 2,-0.1 0.303 94.7 135.4 85.5 -6.7 -3.6 34.0 61.9 62 90 A D < - 0 0 62 -3,-2.3 -13,-2.4 -12,-0.1 -1,-0.3 -0.465 65.6-105.7 -69.0 143.5 -1.1 31.5 60.7 63 91 A F B -F 48 0A 32 -15,-0.2 -15,-0.2 -2,-0.1 -4,-0.2 -0.409 32.6-133.1 -56.3 143.2 2.6 32.3 61.0 64 92 A V - 0 0 0 -17,-1.5 3,-0.5 -6,-0.1 -1,-0.1 -0.890 27.9-163.2-108.9 104.1 4.0 33.2 57.6 65 93 A P + 0 0 2 0, 0.0 32,-0.0 0, 0.0 -17,-0.0 -0.288 58.2 36.8 -83.3 167.6 7.3 31.3 57.0 66 94 A Y S S+ 0 0 15 1,-0.2 54,-0.4 52,-0.1 2,-0.1 0.514 77.0 140.2 69.8 13.9 10.1 31.8 54.5 67 95 A L - 0 0 10 -3,-0.5 2,-0.6 52,-0.1 -1,-0.2 -0.400 52.7-129.7 -77.5 163.8 10.0 35.6 54.5 68 96 A R E -I 117 0B 125 49,-2.2 49,-3.2 -2,-0.1 2,-0.5 -0.952 29.5-172.7-117.7 109.3 13.1 37.7 54.4 69 97 A V E +I 116 0B 5 -2,-0.6 17,-2.4 17,-0.3 2,-0.4 -0.908 7.6 178.0-113.2 126.1 12.9 40.3 57.2 70 98 A V E -IJ 115 85B 28 45,-2.3 45,-3.1 -2,-0.5 2,-0.4 -0.996 14.1-151.2-128.5 133.5 15.4 43.1 57.7 71 99 A A E -IJ 114 84B 1 13,-3.1 13,-3.2 -2,-0.4 2,-0.4 -0.841 4.2-161.5-105.1 141.9 15.2 45.8 60.3 72 100 A F E -IJ 113 83B 43 41,-2.6 41,-2.6 -2,-0.4 2,-0.4 -0.993 6.4-168.1-120.0 132.2 16.6 49.2 59.9 73 101 A L E +IJ 112 82B 2 9,-2.0 9,-2.9 -2,-0.4 2,-0.4 -0.976 7.9 175.9-122.6 131.6 17.3 51.3 63.0 74 102 A Q E -I 111 0B 60 37,-2.2 37,-3.1 -2,-0.4 7,-0.1 -0.955 25.2-134.0-141.2 117.4 18.1 55.0 62.8 75 103 A K E > -I 110 0B 55 5,-0.5 3,-2.0 -2,-0.4 35,-0.3 -0.420 38.8 -97.0 -70.7 140.6 18.5 57.3 65.8 76 104 A H T 3 S+ 0 0 81 33,-3.0 -1,-0.1 1,-0.3 33,-0.1 -0.354 110.6 18.6 -54.6 134.8 16.7 60.6 65.6 77 105 A G T 3 S+ 0 0 95 1,-0.3 2,-0.3 -3,-0.1 -1,-0.3 0.483 106.6 106.2 83.0 2.1 19.0 63.4 64.3 78 106 A S < - 0 0 23 -3,-2.0 -1,-0.3 2,-0.1 27,-0.0 -0.859 59.4-154.3-114.0 150.6 21.5 60.9 63.0 79 107 A E + 0 0 187 -2,-0.3 2,-0.3 -3,-0.1 -1,-0.1 0.507 67.2 105.0 -95.1 -5.8 22.3 59.9 59.4 80 108 A K - 0 0 148 -5,-0.1 -5,-0.5 25,-0.0 2,-0.5 -0.583 51.6-167.6 -79.3 132.1 23.6 56.5 60.4 81 109 A V - 0 0 76 -2,-0.3 2,-0.4 -7,-0.1 -7,-0.2 -0.984 9.6-147.8-120.3 128.8 21.3 53.6 59.7 82 110 A Q E -J 73 0B 19 -9,-2.9 -9,-2.0 -2,-0.5 2,-0.5 -0.784 9.1-154.9 -91.8 139.1 21.8 50.1 61.1 83 111 A K E -J 72 0B 146 -2,-0.4 2,-0.5 -11,-0.2 -11,-0.2 -0.968 13.1-177.6-115.4 123.5 20.8 47.2 59.0 84 112 A V E -J 71 0B 21 -13,-3.2 -13,-3.1 -2,-0.5 2,-0.6 -0.970 19.0-144.5-125.2 121.7 19.9 44.0 60.8 85 113 A M E -J 70 0B 131 -2,-0.5 -15,-0.2 -15,-0.2 2,-0.1 -0.707 20.7-143.8 -84.6 122.4 18.9 40.7 59.1 86 114 A F - 0 0 16 -17,-2.4 -17,-0.3 -2,-0.6 13,-0.2 -0.439 11.2-147.4 -80.6 158.2 16.4 38.9 61.2 87 115 A A E -G 98 0A 15 11,-2.5 11,-2.1 -2,-0.1 2,-0.2 -0.947 18.3-111.7-124.3 148.6 16.5 35.1 61.4 88 116 A P E +G 97 0A 22 0, 0.0 195,-1.1 0, 0.0 2,-0.3 -0.601 53.3 145.7 -77.4 145.0 13.6 32.7 61.7 89 117 A M E -Gh 96 283A 0 7,-2.4 7,-2.2 -2,-0.2 2,-0.4 -0.978 41.4-114.4-165.0 164.3 13.6 30.9 65.1 90 118 A N E +Gh 95 284A 0 193,-1.8 195,-2.9 -2,-0.3 2,-0.2 -0.919 25.4 174.9-108.6 145.2 11.4 29.4 67.8 91 119 A A E > -G 94 0A 9 3,-1.5 3,-2.3 -2,-0.4 200,-0.2 -0.620 59.2 -75.7-121.1-164.3 11.0 30.5 71.3 92 120 A G T 3 S+ 0 0 49 198,-2.0 123,-0.1 1,-0.3 199,-0.1 0.743 133.4 54.6 -67.5 -17.5 8.6 29.2 73.9 93 121 A D T 3 S- 0 0 149 1,-0.3 -1,-0.3 197,-0.3 124,-0.1 0.255 117.6-103.1-100.6 8.0 5.8 31.1 72.1 94 122 A G E < - 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