==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 06-APR-11 3RFS . COMPND 2 MOLECULE: INTERNALIN B, REPEAT MODULES, VARIABLE LYMPHOCYTE . SOURCE 2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES, SYNTHETIC, EPT . AUTHOR H.J.KIM,H.K.CHEONG,Y.H.JEON . 526 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22159.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 331 62.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 40 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 93 17.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 46 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 4 0 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 14 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 . 4 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 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 2 A T 0 0 132 0, 0.0 2,-0.5 0, 0.0 59,-0.1 0.000 360.0 360.0 360.0 155.9 -11.2 -7.0 49.5 2 3 A I - 0 0 21 58,-0.2 34,-0.5 1,-0.1 35,-0.1 -0.801 360.0-175.2 -84.0 121.6 -9.7 -5.6 52.7 3 4 A T + 0 0 127 -2,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.662 67.6 32.0 -98.9 -22.4 -11.9 -7.0 55.5 4 5 A V S S- 0 0 102 30,-0.1 -1,-0.2 31,-0.0 30,-0.1 -0.993 100.4 -88.5-136.8 142.4 -10.3 -5.1 58.4 5 6 A S + 0 0 63 -2,-0.3 30,-0.2 28,-0.1 28,-0.1 -0.176 53.8 178.2 -56.3 140.4 -8.7 -1.7 58.5 6 7 A T E -A 34 0A 26 28,-2.1 28,-2.3 26,-0.1 5,-0.1 -0.996 34.9 -87.9-148.8 138.2 -5.0 -2.0 57.6 7 8 A P E >> -A 33 0A 47 0, 0.0 4,-1.8 0, 0.0 3,-1.3 -0.158 32.6-126.6 -48.1 129.1 -2.0 0.5 57.1 8 9 A I H 3> S+ 0 0 0 24,-2.3 4,-2.8 21,-0.3 23,-0.2 0.883 110.7 55.4 -37.6 -50.3 -1.7 1.9 53.6 9 10 A K H 34 S+ 0 0 66 21,-2.6 -1,-0.2 1,-0.2 22,-0.1 0.704 104.7 52.6 -70.2 -20.8 2.1 0.7 53.6 10 11 A Q H <4 S+ 0 0 141 -3,-1.3 -1,-0.2 20,-0.3 -2,-0.2 0.916 115.6 39.7 -75.4 -42.9 1.1 -2.9 54.5 11 12 A I H < S+ 0 0 15 -4,-1.8 -2,-0.2 1,-0.3 -3,-0.1 0.881 126.5 36.7 -68.8 -42.3 -1.4 -3.1 51.5 12 13 A F S < S+ 0 0 0 -4,-2.8 -1,-0.3 -5,-0.2 6,-0.2 -0.830 70.9 179.5-114.3 87.3 0.9 -1.1 49.2 13 14 A P + 0 0 66 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.711 54.7 93.4 -74.8 -15.6 4.4 -2.3 50.0 14 15 A D S > S- 0 0 22 42,-0.3 4,-2.8 40,-0.2 5,-0.2 -0.623 73.4-142.5 -76.6 123.7 6.2 -0.1 47.4 15 16 A D H > S+ 0 0 104 -2,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.916 97.6 46.0 -55.3 -44.7 7.2 3.1 49.3 16 17 A A H > S+ 0 0 29 35,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.893 114.7 46.5 -68.3 -40.2 6.4 5.4 46.3 17 18 A F H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.915 108.4 55.5 -69.5 -38.5 3.1 3.8 45.5 18 19 A A H X S+ 0 0 0 -4,-2.8 4,-2.8 -6,-0.2 -2,-0.2 0.908 107.4 50.7 -58.1 -41.6 2.0 3.8 49.1 19 20 A E H X S+ 0 0 89 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.872 108.0 53.4 -63.0 -38.8 2.7 7.7 49.1 20 21 A T H X S+ 0 0 26 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.928 111.3 45.5 -56.5 -46.5 0.5 7.9 45.9 21 22 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.935 111.3 52.3 -67.5 -44.3 -2.4 6.2 47.6 22 23 A K H X>S+ 0 0 45 -4,-2.8 5,-2.6 1,-0.2 4,-0.8 0.942 112.1 45.3 -55.9 -49.2 -2.0 8.3 50.8 23 24 A A H ><5S+ 0 0 58 -4,-2.4 3,-0.6 2,-0.2 -1,-0.2 0.895 112.1 51.3 -63.4 -42.6 -2.1 11.5 48.8 24 25 A N H 3<5S+ 0 0 35 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.895 115.0 43.8 -61.6 -38.3 -5.1 10.3 46.7 25 26 A L H 3<5S- 0 0 16 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.583 109.1-125.6 -80.9 -6.8 -7.0 9.4 50.0 26 27 A K T <<5 + 0 0 46 -4,-0.8 -3,-0.2 -3,-0.6 2,-0.2 0.861 57.3 154.2 53.1 40.1 -6.0 12.6 51.7 27 28 A K < - 0 0 33 -5,-2.6 -1,-0.2 -6,-0.2 3,-0.1 -0.500 47.3-133.0 -86.4 163.0 -4.5 10.6 54.5 28 29 A K S S+ 0 0 73 1,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.739 79.0 12.4 -96.2 -18.0 -1.7 12.0 56.6 29 30 A S > - 0 0 32 -7,-0.1 3,-1.7 1,-0.0 -21,-0.3 -0.995 65.1-122.0-154.4 149.0 0.7 9.1 56.7 30 31 A V T 3 S+ 0 0 18 -2,-0.3 -21,-2.6 1,-0.3 -20,-0.3 0.607 112.8 65.5 -71.3 -4.0 1.3 5.7 54.9 31 32 A T T 3 S+ 0 0 102 -23,-0.2 -1,-0.3 -24,-0.1 2,-0.1 0.625 76.6 113.0 -84.8 -14.2 1.1 4.2 58.4 32 33 A D S < S- 0 0 25 -3,-1.7 -24,-2.3 -25,-0.1 2,-0.2 -0.394 72.6-122.0 -60.1 134.0 -2.6 5.2 58.6 33 34 A A E -A 7 0A 44 -26,-0.3 2,-0.3 -28,-0.1 -28,-0.1 -0.543 32.5-163.4 -77.1 134.4 -5.0 2.3 58.6 34 35 A V E -A 6 0A 0 -28,-2.3 -28,-2.1 -2,-0.2 2,-0.2 -0.902 9.7-136.8-122.8 157.2 -7.5 2.3 55.8 35 36 A T > - 0 0 49 -2,-0.3 4,-2.0 -30,-0.2 5,-0.2 -0.617 29.6-111.2-104.3 162.6 -10.8 0.5 55.0 36 37 A Q H > S+ 0 0 20 -34,-0.5 4,-2.0 -2,-0.2 5,-0.2 0.875 118.7 59.2 -58.4 -38.2 -12.1 -1.1 51.8 37 38 A N H 4 S+ 0 0 128 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.903 105.7 47.9 -60.2 -41.6 -14.7 1.8 51.7 38 39 A E H >4 S+ 0 0 41 1,-0.2 3,-1.6 2,-0.2 4,-0.2 0.944 110.6 49.9 -58.1 -46.5 -11.9 4.3 51.6 39 40 A L H >< S+ 0 0 0 -4,-2.0 3,-1.6 1,-0.3 24,-0.3 0.833 101.7 64.3 -65.2 -27.2 -10.1 2.4 48.8 40 41 A N T 3< S+ 0 0 50 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.678 90.7 69.2 -69.9 -15.6 -13.4 2.3 46.9 41 42 A S T < S+ 0 0 59 -3,-1.6 2,-0.6 -4,-0.4 -1,-0.3 0.553 72.2 104.9 -80.7 -11.7 -13.2 6.1 46.7 42 43 A I < + 0 0 0 -3,-1.6 21,-0.3 -4,-0.2 3,-0.1 -0.645 36.5 167.4 -79.2 119.7 -10.2 6.0 44.3 43 44 A D + 0 0 19 -2,-0.6 22,-2.9 1,-0.3 23,-1.1 0.624 65.3 5.4-109.7 -18.6 -11.3 6.9 40.8 44 45 A Q E -b 66 0B 7 20,-0.2 2,-0.4 21,-0.2 -1,-0.3 -0.982 54.9-149.2-159.1 161.5 -7.9 7.5 39.2 45 46 A I E -b 67 0B 1 21,-2.4 23,-2.7 -2,-0.3 2,-0.5 -0.997 9.3-174.6-133.1 127.9 -4.2 7.2 39.9 46 47 A I E +b 68 0B 61 -2,-0.4 23,-0.2 21,-0.2 21,-0.1 -0.965 25.0 145.6-129.0 98.6 -1.7 9.6 38.3 47 48 A A > + 0 0 3 21,-2.7 3,-0.5 -2,-0.5 5,-0.2 -0.420 14.9 160.5-140.0 55.1 1.7 8.4 39.3 48 49 A N T 3 + 0 0 61 1,-0.2 23,-0.2 21,-0.1 21,-0.1 -0.509 68.7 6.9 -76.7 154.1 4.1 9.1 36.4 49 50 A N T 3 S+ 0 0 128 21,-2.9 -1,-0.2 -2,-0.2 23,-0.1 0.800 86.8 131.9 43.3 49.9 7.9 9.2 36.9 50 51 A S S < S- 0 0 42 -3,-0.5 -1,-0.1 20,-0.3 22,-0.1 0.217 74.6-112.5-117.3 12.7 7.6 8.1 40.6 51 52 A D + 0 0 107 20,-0.5 2,-0.4 1,-0.2 -35,-0.3 0.807 55.3 169.5 59.6 31.7 10.2 5.4 40.9 52 53 A I + 0 0 0 -5,-0.2 21,-2.8 1,-0.2 -1,-0.2 -0.626 17.9 174.8 -81.8 126.3 7.4 2.8 41.4 53 54 A K + 0 0 146 -2,-0.4 22,-0.6 1,-0.3 2,-0.3 0.669 67.9 21.6 -98.9 -22.5 8.8 -0.8 41.2 54 55 A S - 0 0 46 20,-0.1 -1,-0.3 2,-0.1 -40,-0.2 -0.984 47.6-161.4-148.7 135.4 5.6 -2.6 42.2 55 56 A V > + 0 0 3 21,-0.4 3,-2.6 -2,-0.3 4,-0.3 0.100 40.3 151.4-102.0 23.5 1.8 -1.9 42.1 56 57 A Q T 3 + 0 0 82 1,-0.3 -42,-0.3 2,-0.1 -2,-0.1 -0.285 64.9 36.8 -49.6 131.7 1.0 -4.7 44.6 57 58 A G T > S+ 0 0 0 -45,-0.1 3,-2.2 -44,-0.1 -1,-0.3 0.060 84.4 104.2 109.4 -28.6 -2.1 -3.6 46.4 58 59 A I G X + 0 0 0 -3,-2.6 3,-1.9 1,-0.3 -2,-0.1 0.752 63.7 76.1 -60.2 -19.2 -3.7 -2.0 43.4 59 60 A Q G 3 S+ 0 0 48 1,-0.3 -1,-0.3 -4,-0.3 -3,-0.1 0.678 85.5 63.5 -64.6 -15.0 -6.0 -4.9 43.1 60 61 A Y G < S+ 0 0 73 -3,-2.2 -1,-0.3 1,-0.2 -58,-0.2 0.176 83.3 83.7 -92.0 14.4 -8.0 -3.5 46.1 61 62 A L X + 0 0 0 -3,-1.9 3,-1.4 1,-0.1 -1,-0.2 -0.629 51.5 166.3-112.9 72.6 -8.9 -0.4 44.0 62 63 A P T 3 + 0 0 47 0, 0.0 23,-0.6 0, 0.0 -1,-0.1 0.677 69.7 53.8 -69.7 -20.3 -12.0 -1.7 42.1 63 64 A N T 3 S+ 0 0 62 -24,-0.3 2,-0.1 -21,-0.3 -23,-0.1 0.368 71.0 130.6 -95.8 2.7 -13.2 1.8 40.9 64 65 A V < + 0 0 0 -3,-1.4 -20,-0.2 1,-0.2 21,-0.2 -0.393 22.5 168.4 -62.7 125.3 -10.1 3.1 39.2 65 66 A R + 0 0 52 -22,-2.9 22,-3.3 1,-0.3 23,-2.0 0.715 64.3 39.7-106.0 -43.5 -10.9 4.4 35.8 66 67 A Y E +bc 44 88B 34 -23,-1.1 -21,-2.4 21,-0.2 2,-0.5 -0.956 64.6 179.4-116.8 126.1 -7.8 6.3 34.7 67 68 A L E -bc 45 89B 0 21,-2.4 23,-2.6 -2,-0.5 2,-0.6 -0.955 3.8-179.5-129.5 113.4 -4.3 4.8 35.6 68 69 A A E +bc 46 90B 0 -23,-2.7 -21,-2.7 -2,-0.5 23,-0.2 -0.952 15.9 155.4-120.2 116.1 -1.1 6.5 34.5 69 70 A L > + 0 0 0 21,-2.9 3,-0.8 -2,-0.6 5,-0.2 -0.088 22.0 155.1-127.2 28.2 2.1 4.8 35.5 70 71 A G T 3 + 0 0 7 1,-0.2 -21,-2.9 3,-0.1 -20,-0.3 -0.268 60.2 17.1 -61.4 145.6 4.5 6.1 32.8 71 72 A G T 3 S+ 0 0 31 21,-2.8 -20,-0.5 -23,-0.2 -1,-0.2 0.764 93.7 119.2 71.3 27.3 8.2 6.3 33.5 72 73 A N S < S- 0 0 4 -3,-0.8 -19,-0.2 20,-0.5 -1,-0.1 -0.189 73.9-104.6-104.7-156.3 8.4 3.9 36.4 73 74 A K + 0 0 85 -21,-2.8 2,-0.3 21,-0.1 21,-0.1 -0.221 56.5 155.6-125.1 38.7 10.3 0.5 36.8 74 75 A L + 0 0 0 -5,-0.2 21,-2.6 1,-0.1 -20,-0.1 -0.502 15.4 163.7 -74.7 135.4 7.4 -1.9 36.5 75 76 A H + 0 0 131 -22,-0.6 22,-0.4 1,-0.3 2,-0.4 0.397 68.1 45.6-124.5 -6.3 8.1 -5.4 35.3 76 77 A D + 0 0 88 -23,-0.3 -21,-0.4 20,-0.1 -1,-0.3 -0.997 44.5 174.0-139.9 134.6 4.9 -7.1 36.4 77 78 A I > + 0 0 3 -2,-0.4 3,-2.3 -3,-0.1 4,-0.2 0.129 44.8 120.6-126.3 21.6 1.3 -6.0 35.9 78 79 A S G > S+ 0 0 47 1,-0.3 3,-1.7 2,-0.2 4,-0.2 0.808 70.1 64.2 -43.1 -42.3 -0.5 -9.2 37.3 79 80 A A G 3 S+ 0 0 15 1,-0.3 3,-0.4 2,-0.1 -1,-0.3 0.637 92.3 62.9 -71.2 -12.8 -2.1 -7.0 39.9 80 81 A L G X S+ 0 0 1 -3,-2.3 3,-1.9 1,-0.2 -1,-0.3 0.568 73.2 94.1 -82.4 -5.4 -4.1 -5.0 37.3 81 82 A K T < S+ 0 0 79 -3,-1.7 25,-0.4 1,-0.3 -1,-0.2 0.770 84.9 48.0 -67.2 -24.7 -6.1 -7.9 36.0 82 83 A E T 3 S+ 0 0 81 -3,-0.4 2,-2.3 -4,-0.2 -1,-0.3 0.385 76.4 108.5 -90.4 -3.6 -9.1 -7.3 38.3 83 84 A L X + 0 0 0 -3,-1.9 3,-1.8 1,-0.2 -1,-0.1 -0.455 39.9 167.5 -83.3 73.0 -9.5 -3.5 37.6 84 85 A T T 3 + 0 0 58 -2,-2.3 25,-0.5 1,-0.3 -1,-0.2 0.627 66.0 59.4 -68.2 -15.3 -12.6 -3.9 35.5 85 86 A N T 3 S+ 0 0 67 -23,-0.6 -1,-0.3 -21,-0.2 -2,-0.1 0.490 74.0 128.4 -94.3 2.2 -13.5 -0.2 35.5 86 87 A L < + 0 0 0 -3,-1.8 23,-0.2 1,-0.2 -21,-0.2 -0.274 22.5 164.7 -62.1 131.0 -10.3 0.9 33.8 87 88 A T + 0 0 9 -22,-3.3 24,-3.0 1,-0.4 25,-1.5 0.599 69.5 34.0-116.4 -22.5 -10.8 3.1 30.7 88 89 A Y E +cd 66 112B 16 -23,-2.0 -21,-2.4 23,-0.2 2,-0.4 -0.994 60.8 179.3-136.3 125.8 -7.2 4.5 30.3 89 90 A L E -cd 67 113B 0 23,-2.0 25,-2.6 -2,-0.4 2,-0.6 -0.959 3.4-174.8-132.5 117.9 -4.0 2.6 31.1 90 91 A I E +cd 68 114B 29 -23,-2.6 -21,-2.9 -2,-0.4 25,-0.1 -0.933 16.4 158.9-119.0 107.6 -0.8 4.3 30.4 91 92 A L > + 0 0 0 23,-3.0 3,-0.7 -2,-0.6 5,-0.2 0.160 21.1 155.7-117.9 21.9 2.3 2.1 31.0 92 93 A T T 3 + 0 0 33 1,-0.2 -21,-2.8 22,-0.2 -20,-0.5 -0.098 61.5 11.5 -49.2 137.6 4.9 4.0 28.9 93 94 A G T 3 S+ 0 0 17 23,-2.4 -1,-0.2 -23,-0.2 25,-0.2 0.828 91.7 123.0 68.5 34.0 8.5 3.7 29.7 94 95 A N S < S- 0 0 4 -3,-0.7 -1,-0.2 22,-0.3 -19,-0.1 -0.327 70.8-104.5-106.5-160.3 8.5 0.7 32.1 95 96 A Q + 0 0 78 -21,-2.6 2,-0.4 -2,-0.2 23,-0.1 -0.200 54.3 153.4-128.8 36.2 10.3 -2.6 31.8 96 97 A L + 0 0 1 -5,-0.2 23,-2.7 1,-0.2 -21,-0.1 -0.589 15.1 176.7 -67.9 126.6 7.6 -5.0 30.7 97 98 A Q + 0 0 107 -22,-0.4 24,-1.5 -2,-0.4 25,-0.5 0.615 66.4 9.8-103.2 -19.4 9.2 -7.9 28.8 98 99 A S - 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