==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 08-SEP-11 4A0E . COMPND 2 MOLECULE: TYPE III SECRETION PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: YERSINIA PESTIS; . AUTHOR G.T.LOUNTOS,J.E.TROPEA,D.S.WAUGH . 216 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11075.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 132 61.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 33.8 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 . 6 2.8 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 . 20 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 0.9 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+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 5 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 2 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 1 A G 0 0 48 0, 0.0 3,-0.1 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 15.6 14.2 -21.5 -33.5 2 2 A S + 0 0 27 17,-0.4 94,-2.8 1,-0.1 2,-0.3 0.752 360.0 43.4 -91.8 -28.0 16.8 -19.3 -31.8 3 3 A W E -AB 19 95A 34 16,-0.5 16,-3.0 92,-0.2 2,-0.4 -0.918 55.4-165.6-128.9 148.6 16.0 -15.9 -33.4 4 4 A V E -AB 18 94A 26 90,-2.4 90,-2.2 -2,-0.3 2,-0.2 -0.996 10.8-162.0-129.0 129.7 12.9 -13.8 -34.2 5 5 A C E -AB 17 93A 0 12,-2.9 12,-2.4 -2,-0.4 2,-0.3 -0.703 0.8-158.9-106.3 166.3 12.8 -10.8 -36.4 6 6 A R E -AB 16 92A 51 86,-2.0 86,-1.5 -2,-0.2 2,-0.3 -0.989 10.9-138.0-141.5 144.0 10.2 -8.0 -36.8 7 7 A F E - B 0 91A 8 8,-1.5 7,-2.5 5,-0.5 84,-0.2 -0.739 11.7-172.1-102.6 154.2 9.5 -5.6 -39.7 8 8 A Y + 0 0 17 82,-2.0 2,-0.3 -2,-0.3 83,-0.1 0.411 61.3 50.1-127.9 1.8 8.8 -1.9 -39.3 9 9 A Q S > S- 0 0 81 81,-0.4 3,-0.6 79,-0.1 81,-0.2 -0.985 91.8 -0.4-141.2 150.2 7.8 -0.5 -42.7 10 10 A G G > S- 0 0 40 -2,-0.3 3,-1.6 1,-0.2 -3,-0.0 -0.257 110.3 -19.0 76.7-158.5 5.4 -1.4 -45.5 11 11 A K G 3 S+ 0 0 148 1,-0.3 -1,-0.2 3,-0.0 26,-0.0 0.694 135.5 46.7 -61.4 -24.8 2.9 -4.3 -45.8 12 12 A H G X S+ 0 0 39 -3,-0.6 3,-2.2 3,-0.1 -5,-0.5 0.217 76.0 143.2-107.7 11.7 4.6 -6.5 -43.2 13 13 A R T < S+ 0 0 144 -3,-1.6 -5,-0.2 1,-0.3 3,-0.1 -0.284 72.8 16.6 -56.3 133.0 5.0 -3.9 -40.5 14 14 A G T 3 S+ 0 0 28 -7,-2.5 -1,-0.3 1,-0.3 2,-0.2 0.196 94.2 127.1 91.5 -17.3 4.4 -5.4 -37.1 15 15 A V < - 0 0 66 -3,-2.2 -8,-1.5 -8,-0.0 2,-0.4 -0.533 45.5-153.8 -75.4 136.7 4.8 -9.0 -38.2 16 16 A E E -A 6 0A 97 -2,-0.2 2,-0.4 -10,-0.2 -10,-0.2 -0.882 9.5-167.0-110.8 147.8 7.3 -11.2 -36.4 17 17 A V E -A 5 0A 36 -12,-2.4 -12,-2.9 -2,-0.4 2,-0.4 -0.996 20.9-128.2-139.7 133.8 9.0 -14.1 -38.0 18 18 A E E -A 4 0A 131 -2,-0.4 -14,-0.3 -14,-0.2 -2,-0.0 -0.640 31.7-127.4 -80.5 130.4 11.0 -17.0 -36.5 19 19 A L E -A 3 0A 0 -16,-3.0 -16,-0.5 -2,-0.4 -17,-0.4 -0.697 17.9-137.2 -83.5 126.9 14.3 -17.3 -38.4 20 20 A P - 0 0 53 0, 0.0 2,-0.2 0, 0.0 31,-0.1 -0.368 27.2-105.2 -74.4 161.6 15.1 -20.8 -39.7 21 21 A H S S+ 0 0 82 -2,-0.1 2,-0.2 29,-0.1 31,-0.2 -0.574 82.8 25.2 -93.7 156.0 18.6 -22.1 -39.3 22 22 A G E S+F 51 0B 29 29,-3.1 29,-2.5 -2,-0.2 2,-0.3 -0.651 118.3 2.9 91.1-155.1 21.1 -22.3 -42.1 23 23 A R E S-F 50 0B 118 -2,-0.2 2,-0.5 27,-0.2 27,-0.2 -0.507 70.5-166.8 -70.7 125.4 20.9 -20.0 -45.2 24 24 A C E -F 49 0B 0 25,-3.4 25,-3.1 -2,-0.3 2,-0.5 -0.964 2.0-166.7-122.3 117.6 18.0 -17.6 -44.7 25 25 A V E -F 48 0B 5 -2,-0.5 10,-2.9 23,-0.2 9,-1.6 -0.908 8.0-165.9-111.3 124.0 16.7 -15.5 -47.7 26 26 A F E +Fg 47 35B 0 21,-3.2 20,-2.4 -2,-0.5 21,-2.1 -0.903 38.3 121.8 -98.4 134.4 14.4 -12.5 -47.5 27 27 A G E - g 0 36B 0 8,-2.0 10,-2.7 -2,-0.5 18,-0.2 -0.980 68.9-107.4-177.7 175.1 13.0 -11.6 -50.9 28 28 A S S S+ 0 0 43 15,-1.8 17,-0.1 -2,-0.3 8,-0.1 0.555 93.6 85.1 -97.1 -9.9 9.9 -11.1 -53.0 29 29 A D >> - 0 0 41 15,-1.6 3,-1.7 14,-0.3 4,-1.5 -0.826 62.0-160.6-100.1 107.6 10.4 -14.2 -55.1 30 30 A P T 34 S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 6,-0.0 0.748 89.7 62.5 -58.6 -24.6 8.9 -17.4 -53.4 31 31 A L T 34 S+ 0 0 161 1,-0.2 -2,-0.0 3,-0.0 3,-0.0 0.762 119.0 24.2 -72.1 -22.9 11.1 -19.6 -55.5 32 32 A Q T <4 S+ 0 0 108 -3,-1.7 2,-0.4 12,-0.2 -1,-0.2 0.546 111.8 77.4-116.2 -7.4 14.3 -18.2 -54.1 33 33 A S < - 0 0 12 -4,-1.5 3,-0.2 1,-0.1 -7,-0.2 -0.865 47.0-166.9-116.4 139.3 13.2 -16.8 -50.6 34 34 A D S S+ 0 0 97 -9,-1.6 2,-0.7 -2,-0.4 -8,-0.2 0.822 94.8 42.6 -84.1 -38.2 12.4 -18.4 -47.3 35 35 A I E S-g 26 0B 14 -10,-2.9 -8,-2.0 -18,-0.0 2,-0.6 -0.933 86.0-153.9-113.1 108.4 10.8 -15.2 -45.9 36 36 A V E -g 27 0B 60 -2,-0.7 2,-0.4 -10,-0.2 -8,-0.2 -0.739 10.3-170.9 -93.2 116.9 8.6 -13.8 -48.7 37 37 A L - 0 0 3 -10,-2.7 5,-0.1 -2,-0.6 -2,-0.0 -0.881 11.3-159.2-107.9 139.7 8.0 -10.0 -48.6 38 38 A S + 0 0 71 -2,-0.4 2,-0.2 3,-0.0 -1,-0.1 0.323 48.8 119.5-104.8 3.4 5.4 -8.5 -50.9 39 39 A D > - 0 0 14 1,-0.1 3,-1.9 4,-0.1 -2,-0.1 -0.506 67.2-130.5 -67.0 139.5 6.4 -4.8 -51.0 40 40 A S T 3 S+ 0 0 109 1,-0.3 -1,-0.1 -2,-0.2 -12,-0.1 0.751 105.5 66.5 -62.0 -19.4 7.3 -3.7 -54.5 41 41 A E T 3 S+ 0 0 103 2,-0.1 2,-0.5 47,-0.1 47,-0.4 0.541 82.9 90.9 -79.6 -6.1 10.5 -2.2 -53.1 42 42 A I S < S- 0 0 7 -3,-1.9 -15,-0.1 46,-0.1 4,-0.1 -0.796 75.1-131.6 -96.7 128.5 11.9 -5.6 -52.2 43 43 A A - 0 0 30 -2,-0.5 -15,-1.8 1,-0.1 3,-0.3 -0.276 29.5-102.1 -72.5 160.5 14.1 -7.5 -54.8 44 44 A P S S+ 0 0 71 0, 0.0 -15,-1.6 0, 0.0 2,-0.5 0.917 123.7 19.5 -44.8 -51.9 13.5 -11.1 -55.8 45 45 A V S S+ 0 0 46 -18,-0.2 -18,-0.2 -17,-0.1 3,-0.1 -0.966 81.0 158.5-119.1 114.8 16.5 -11.9 -53.5 46 46 A H + 0 0 7 -20,-2.4 16,-2.7 -2,-0.5 17,-0.4 0.775 61.4 11.8-110.2 -36.3 16.9 -9.0 -51.1 47 47 A L E -FH 26 61B 0 -21,-2.1 -21,-3.2 14,-0.3 2,-0.5 -0.956 56.7-164.6-151.6 128.1 18.9 -10.2 -48.1 48 48 A V E +FH 25 60B 2 12,-3.4 11,-2.7 -2,-0.3 12,-1.7 -0.969 15.3 178.6-116.9 124.1 20.8 -13.5 -47.4 49 49 A L E -FH 24 58B 0 -25,-3.1 -25,-3.4 -2,-0.5 2,-0.5 -0.854 27.3-139.4-119.6 157.1 21.7 -14.5 -43.9 50 50 A M E -FH 23 57B 40 7,-2.3 7,-2.7 -2,-0.3 2,-0.4 -0.985 31.8-168.3-112.1 116.8 23.5 -17.4 -42.3 51 51 A V E +FH 22 56B 2 -29,-2.5 -29,-3.1 -2,-0.5 2,-0.3 -0.895 18.6 143.4-114.7 134.6 21.7 -18.3 -39.1 52 52 A D E > - H 0 55B 64 3,-2.2 3,-1.0 -2,-0.4 -2,-0.0 -0.918 62.9 -79.1-153.1-176.4 22.7 -20.6 -36.3 53 53 A E T 3 S+ 0 0 141 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.823 124.4 52.4 -58.8 -36.0 22.5 -20.8 -32.5 54 54 A E T 3 S- 0 0 149 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.736 121.8 -74.9 -71.6 -27.7 25.4 -18.4 -31.9 55 55 A G E < -H 52 0B 6 -3,-1.0 -3,-2.2 24,-0.0 2,-0.4 -0.992 50.8 -63.2 157.2-164.6 24.0 -15.6 -34.1 56 56 A I E -H 51 0B 0 22,-0.4 22,-2.9 -2,-0.3 2,-0.4 -0.974 35.7-162.4-130.0 128.5 23.3 -14.3 -37.5 57 57 A R E -HI 50 77B 85 -7,-2.7 -7,-2.3 -2,-0.4 2,-0.3 -0.921 23.9-116.8-116.4 138.6 25.8 -13.4 -40.2 58 58 A L E +H 49 0B 2 18,-2.1 17,-2.8 -2,-0.4 -9,-0.2 -0.513 35.3 167.4 -66.9 126.8 25.4 -11.3 -43.4 59 59 A T E - 0 0 15 -11,-2.7 2,-0.3 1,-0.4 -10,-0.2 0.757 62.2 -31.2-105.8 -43.9 25.9 -13.3 -46.5 60 60 A D E -H 48 0B 63 -12,-1.7 -12,-3.4 124,-0.1 -1,-0.4 -0.970 54.1-168.4-168.6 159.1 24.7 -11.0 -49.2 61 61 A S E -H 47 0B 24 -2,-0.3 -14,-0.3 -14,-0.2 -15,-0.1 -0.990 36.7-114.9-156.6 160.6 22.1 -8.3 -49.9 62 62 A A S S+ 0 0 57 -16,-2.7 -15,-0.1 -2,-0.3 -16,-0.1 0.727 105.5 1.3 -72.1 -22.0 20.5 -6.3 -52.8 63 63 A E S S- 0 0 99 -17,-0.4 -1,-0.1 -3,-0.0 -3,-0.0 -0.928 110.1 -55.1-151.4 172.2 22.2 -3.2 -51.5 64 64 A P - 0 0 85 0, 0.0 2,-0.5 0, 0.0 23,-0.4 -0.192 50.1-128.1 -57.6 137.1 24.4 -2.5 -48.5 65 65 A L - 0 0 1 7,-0.4 7,-2.3 21,-0.1 2,-0.5 -0.729 23.5-156.4 -78.3 127.6 23.1 -3.6 -45.1 66 66 A L E -CD 71 85A 53 19,-2.8 19,-2.3 -2,-0.5 2,-0.5 -0.929 8.2-167.2-108.4 131.0 23.3 -0.7 -42.6 67 67 A Q E > S-CD 70 84A 22 3,-2.7 3,-2.0 -2,-0.5 17,-0.2 -0.980 83.3 -17.6-116.4 120.3 23.4 -1.4 -38.9 68 68 A E T 3 S- 0 0 76 15,-2.8 -1,-0.2 -2,-0.5 16,-0.1 0.828 132.3 -52.9 46.2 35.4 22.8 1.7 -36.8 69 69 A G T 3 S+ 0 0 30 14,-0.4 -1,-0.3 1,-0.2 15,-0.1 0.398 116.9 111.6 91.1 -1.7 23.5 3.6 -40.0 70 70 A L E < S-C 67 0A 124 -3,-2.0 -3,-2.7 1,-0.0 -1,-0.2 -0.907 72.6-112.0-113.2 129.8 26.9 1.9 -40.7 71 71 A P E -C 66 0A 93 0, 0.0 -5,-0.2 0, 0.0 -1,-0.0 -0.266 30.2-138.0 -58.8 139.2 27.5 -0.4 -43.7 72 72 A V - 0 0 18 -7,-2.3 -7,-0.4 4,-0.0 2,-0.1 -0.882 12.9-128.5-105.0 126.4 28.2 -4.0 -42.6 73 73 A P > - 0 0 79 0, 0.0 3,-1.8 0, 0.0 -15,-0.2 -0.431 39.2 -88.8 -70.2 147.7 30.9 -6.0 -44.3 74 74 A L T 3 S+ 0 0 31 1,-0.2 -15,-0.2 -2,-0.1 3,-0.1 -0.253 113.3 27.0 -53.3 140.1 30.0 -9.5 -45.6 75 75 A G T 3 S+ 0 0 4 -17,-2.8 -1,-0.2 1,-0.3 -16,-0.1 0.207 88.6 140.9 91.5 -11.8 30.4 -12.3 -43.1 76 76 A T < - 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