==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 10-SEP-11 2LJB . COMPND 2 MOLECULE: M2 PROTEIN, BM2 PROTEIN CHIMERA; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS, INFLUENZA B VIRUS; . AUTHOR R.M.PIELAK,K.OXENOID,J.J.CHOU . 116 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9131.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 111 95.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 1 0.9 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 . 2 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 31.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 62.1 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 2 1 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 23 A S 0 0 166 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 140.5 75.2 3.3 6.5 2 24 A D > + 0 0 119 2,-0.0 3,-0.7 0, 0.0 4,-0.4 -0.135 360.0 151.9-172.0 61.0 77.6 4.5 3.8 3 25 A P T 3> + 0 0 93 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.323 54.2 97.8 -80.0 8.7 77.8 2.0 0.8 4 26 A L H 3> S+ 0 0 105 1,-0.2 4,-1.0 2,-0.2 -2,-0.0 0.914 84.8 43.4 -63.5 -44.6 78.6 5.0 -1.4 5 27 A V H <> S+ 0 0 44 -3,-0.7 4,-0.8 1,-0.2 -1,-0.2 0.869 114.0 50.7 -70.2 -37.8 82.4 4.3 -1.2 6 28 A V H >> S+ 0 0 53 -4,-0.4 4,-1.2 1,-0.2 3,-1.1 0.904 100.4 63.5 -67.1 -42.1 82.0 0.6 -1.7 7 29 A A H 3X S+ 0 0 47 -4,-2.4 4,-1.0 1,-0.3 3,-0.4 0.884 97.3 57.4 -49.6 -43.8 79.8 1.0 -4.7 8 30 A A H 3X S+ 0 0 32 -4,-1.0 4,-1.1 1,-0.2 3,-0.4 0.845 99.0 60.4 -58.3 -35.1 82.7 2.6 -6.6 9 31 A S H XX S+ 0 0 37 -3,-1.1 4,-1.5 -4,-0.8 3,-0.8 0.908 95.7 60.3 -60.6 -43.2 84.8 -0.4 -6.0 10 32 A I H 3X S+ 0 0 118 -4,-1.2 4,-0.8 -3,-0.4 -1,-0.2 0.860 103.2 51.8 -53.4 -37.9 82.4 -2.6 -7.9 11 33 A I H 3X S+ 0 0 69 -4,-1.0 4,-1.2 -3,-0.4 -1,-0.3 0.811 101.7 63.0 -69.9 -29.8 83.0 -0.5 -11.0 12 34 A G H X S+ 0 0 20 -4,-1.3 3,-2.1 1,-0.2 4,-1.1 0.879 96.8 70.1 -70.6 -38.8 88.0 -5.4 -20.3 19 41 A W H 3X S+ 0 0 77 -4,-2.1 4,-1.0 1,-0.3 -1,-0.2 0.835 87.3 69.5 -48.6 -32.4 91.7 -4.5 -20.0 20 42 A T H >< S+ 0 0 80 -4,-1.0 3,-0.8 -3,-0.4 -1,-0.3 0.895 95.9 52.3 -53.2 -42.5 92.2 -8.1 -21.3 21 43 A I H X4 S+ 0 0 83 -3,-2.1 3,-3.1 -4,-0.4 -1,-0.2 0.934 97.4 64.4 -61.0 -47.9 90.9 -7.0 -24.7 22 44 A G H >< S+ 0 0 32 -4,-1.1 3,-1.9 1,-0.3 4,-0.4 0.791 83.2 80.0 -47.6 -29.3 93.3 -4.1 -24.9 23 45 A H T XX + 0 0 89 -4,-1.0 4,-2.1 -3,-0.8 3,-1.5 0.756 68.7 86.6 -49.7 -27.9 96.1 -6.6 -24.9 24 46 A L H <> S+ 0 0 49 -3,-3.1 4,-1.2 1,-0.3 5,-0.4 0.861 77.6 63.8 -45.0 -42.0 95.3 -7.1 -28.6 25 47 A N H <> S+ 0 0 26 -3,-1.9 4,-2.4 -4,-0.2 -1,-0.3 0.906 112.0 35.5 -50.2 -45.5 97.7 -4.2 -29.4 26 48 A Q H <4 S+ 0 0 83 -3,-1.5 -2,-0.2 -4,-0.4 -1,-0.2 0.971 110.2 58.6 -73.3 -57.9 100.6 -6.3 -28.0 27 49 A I H < S+ 0 0 116 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.648 121.7 31.0 -48.7 -14.5 99.5 -9.7 -29.1 28 50 A K H < 0 0 115 -4,-1.2 -2,-0.2 -5,-0.3 -1,-0.2 0.792 360.0 360.0-109.5 -59.5 99.5 -8.3 -32.7 29 51 A R < 0 0 111 -4,-2.4 -1,-0.2 -5,-0.4 85,-0.0 -0.702 360.0 360.0 -84.0 360.0 102.2 -5.6 -32.8 30 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 31 23 B S 0 0 156 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 40.7 80.5 16.2 4.5 32 24 B D > - 0 0 141 1,-0.2 3,-0.9 2,-0.1 4,-0.3 0.960 360.0-175.1 52.6 58.0 84.1 15.8 3.4 33 25 B P T 3> + 0 0 90 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.135 53.0 109.5 -71.4 24.9 83.1 14.9 -0.2 34 26 B L H 3> S+ 0 0 98 -2,-0.3 4,-0.9 2,-0.2 -2,-0.1 0.913 78.1 44.0 -68.0 -44.0 86.8 14.2 -0.8 35 27 B V H <> S+ 0 0 70 -3,-0.9 4,-0.7 1,-0.2 3,-0.2 0.857 113.4 51.8 -70.0 -35.8 86.3 10.5 -1.1 36 28 B V H >> S+ 0 0 52 -4,-0.3 3,-1.5 1,-0.2 4,-1.2 0.915 99.2 63.2 -67.3 -44.0 83.3 10.8 -3.2 37 29 B A H 3X S+ 0 0 54 -4,-2.1 4,-0.6 1,-0.3 3,-0.3 0.854 97.4 59.0 -49.5 -37.6 85.0 13.1 -5.7 38 30 B A H >X S+ 0 0 38 -4,-0.9 3,-1.0 1,-0.2 4,-0.7 0.846 96.9 61.3 -62.4 -34.0 87.3 10.2 -6.5 39 31 B S H XX S+ 0 0 33 -3,-1.5 3,-2.0 -4,-0.7 4,-1.4 0.906 91.5 65.4 -60.0 -42.7 84.3 8.1 -7.5 40 32 B I H 3X S+ 0 0 97 -4,-1.2 4,-1.2 -3,-0.3 -1,-0.3 0.816 96.6 58.5 -50.0 -31.8 83.5 10.6 -10.3 41 33 B I H X S+ 0 0 22 -4,-2.0 3,-1.7 1,-0.2 4,-1.2 0.857 105.8 72.6 -72.1 -36.9 85.8 7.0 -22.6 49 41 B W H 3X S+ 0 0 81 -4,-3.4 4,-0.8 -5,-0.3 -1,-0.2 0.794 90.8 58.2 -49.4 -34.6 86.6 3.3 -22.5 50 42 B T H 3< S+ 0 0 80 -4,-1.1 4,-0.3 -3,-0.4 3,-0.3 0.825 98.7 60.3 -69.3 -29.3 83.9 2.6 -25.1 51 43 B I H X4 S+ 0 0 74 -3,-1.7 3,-2.9 -4,-0.4 -2,-0.2 0.962 97.9 56.1 -62.0 -51.4 85.6 4.9 -27.5 52 44 B G H >< S+ 0 0 32 -4,-1.2 3,-1.9 1,-0.3 4,-0.3 0.798 91.8 75.4 -50.6 -29.8 88.9 2.9 -27.5 53 45 B H G >X + 0 0 80 -4,-0.8 4,-1.4 -3,-0.3 3,-1.1 0.751 69.2 88.5 -54.4 -27.5 86.7 -0.0 -28.5 54 46 B L G <4 S+ 0 0 47 -3,-2.9 4,-0.4 -4,-0.3 -1,-0.3 0.780 75.8 68.9 -45.7 -29.8 86.5 1.5 -32.0 55 47 B N G <4 S+ 0 0 48 -3,-1.9 -1,-0.2 -4,-0.2 3,-0.2 0.936 111.2 25.3 -58.3 -51.7 89.7 -0.5 -32.8 56 48 B Q T <4 S+ 0 0 67 -3,-1.1 -2,-0.2 -4,-0.3 -1,-0.1 0.967 114.9 59.6 -79.2 -58.9 88.2 -3.9 -32.8 57 49 B I S < S+ 0 0 123 -4,-1.4 2,-0.3 1,-0.1 -1,-0.2 0.548 127.2 6.5 -49.6 -2.9 84.6 -3.3 -33.6 58 50 B K 0 0 137 -4,-0.4 -1,-0.1 -5,-0.3 0, 0.0 -0.904 360.0 360.0-176.4 147.9 86.0 -1.8 -36.8 59 51 B R 0 0 179 -2,-0.3 -4,-0.1 -3,-0.0 -3,-0.0 -0.723 360.0 360.0-155.5 360.0 89.2 -1.5 -38.7 60 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 61 23 C S 0 0 176 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 27.8 94.9 9.9 10.5 62 24 C D >> + 0 0 100 2,-0.0 3,-0.7 0, 0.0 4,-0.5 -0.109 360.0 152.6-173.2 59.0 94.3 8.0 7.3 63 25 C P H 3> + 0 0 98 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.337 56.4 94.8 -77.8 8.2 95.8 9.7 4.2 64 26 C L H 3> S+ 0 0 82 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.931 87.2 40.6 -65.8 -47.3 96.0 6.2 2.6 65 27 C V H <> S+ 0 0 46 -3,-0.7 4,-0.8 2,-0.2 -1,-0.2 0.896 119.3 46.0 -69.4 -40.9 92.7 6.5 0.8 66 28 C V H >X S+ 0 0 67 -4,-0.5 3,-1.3 1,-0.2 4,-0.7 0.933 106.5 58.2 -67.4 -47.6 93.3 10.1 -0.2 67 29 C A H >< S+ 0 0 58 -4,-2.8 3,-1.0 1,-0.3 4,-0.4 0.880 101.7 55.9 -50.4 -43.0 96.9 9.5 -1.3 68 30 C A H >X S+ 0 0 29 -4,-1.4 3,-2.0 1,-0.2 4,-0.6 0.807 91.3 75.0 -61.4 -29.7 95.7 7.0 -3.8 69 31 C S H XX S+ 0 0 40 -3,-1.3 3,-2.0 -4,-0.8 4,-1.2 0.882 81.9 66.8 -50.5 -43.9 93.4 9.6 -5.3 70 32 C I H S+ 0 0 54 -3,-2.0 4,-1.7 -4,-0.4 -1,-0.3 0.814 98.8 56.5 -70.0 -31.7 96.6 8.2 -9.1 72 34 C G H X S+ 0 0 88 -4,-1.4 3,-0.9 -5,-0.3 4,-0.9 0.937 97.3 52.8 -62.0 -50.8 97.1 11.2 -13.1 75 37 C H H 3X S+ 0 0 31 -4,-1.7 4,-2.2 1,-0.2 3,-0.3 0.807 98.1 69.0 -57.8 -29.0 95.9 8.5 -15.6 76 38 C F H 3X S+ 0 0 92 -4,-0.8 4,-1.1 1,-0.2 -1,-0.2 0.909 92.2 57.3 -57.0 -44.2 93.6 11.1 -17.1 77 39 C I H X S+ 0 0 28 -4,-0.9 4,-1.4 -3,-0.3 3,-1.3 0.875 100.1 69.8 -70.3 -38.2 97.8 10.0 -20.4 79 41 C W H 3X S+ 0 0 68 -4,-2.2 4,-0.8 1,-0.3 -1,-0.2 0.816 93.3 59.4 -49.6 -32.8 94.3 9.1 -21.6 80 42 C T H >< S+ 0 0 71 -4,-1.1 3,-0.6 -3,-0.5 -1,-0.3 0.879 100.2 55.3 -65.6 -38.3 94.5 12.2 -23.8 81 43 C I H X< S+ 0 0 86 -3,-1.3 3,-2.6 -4,-0.6 -2,-0.2 0.943 98.8 59.3 -60.6 -50.4 97.6 10.8 -25.6 82 44 C G H >< S+ 0 0 25 -4,-1.4 3,-2.2 1,-0.3 4,-0.3 0.783 86.3 80.6 -50.2 -29.5 95.9 7.6 -26.6 83 45 C H G X< + 0 0 98 -4,-0.8 3,-1.7 -3,-0.6 -1,-0.3 0.758 67.1 86.7 -50.2 -28.2 93.4 9.6 -28.4 84 46 C L G <> S+ 0 0 56 -3,-2.6 4,-0.7 1,-0.3 -1,-0.3 0.811 80.2 62.9 -45.9 -32.6 95.9 9.9 -31.3 85 47 C N G <4 S+ 0 0 55 -3,-2.2 2,-1.5 1,-0.2 -1,-0.3 0.908 94.8 61.6 -60.9 -42.7 94.5 6.7 -32.6 86 48 C Q T <4 S+ 0 0 83 -3,-1.7 -1,-0.2 -4,-0.3 3,-0.1 -0.520 111.3 27.5 -87.1 72.1 91.0 8.2 -33.1 87 49 C I T 4 S+ 0 0 128 -2,-1.5 -2,-0.1 1,-0.6 -1,-0.1 -0.245 93.9 73.9 178.8 -79.4 91.8 10.9 -35.7 88 50 C K < 0 0 141 -4,-0.7 -1,-0.6 1,-0.3 0, 0.0 -0.344 360.0 360.0 -60.2 134.6 94.8 10.5 -38.1 89 51 C R 0 0 258 -3,-0.1 -1,-0.3 -2,-0.0 -4,-0.1 0.438 360.0 360.0 63.2 360.0 94.1 7.9 -40.8 90 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 91 23 D S 0 0 174 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -33.9 87.2 -1.3 9.9 92 24 D D > - 0 0 131 1,-0.1 2,-1.8 4,-0.0 3,-0.6 -0.503 360.0-112.0 -80.2 149.9 87.9 -3.8 7.2 93 25 D P T 3> S+ 0 0 90 0, 0.0 4,-2.7 0, 0.0 5,-0.1 -0.078 77.6 125.7 -74.0 41.5 90.5 -3.0 4.5 94 26 D L H 3> S+ 0 0 93 -2,-1.8 4,-0.9 2,-0.2 0, 0.0 0.942 75.8 39.6 -65.5 -48.7 87.7 -3.0 2.0 95 27 D V H <> S+ 0 0 57 -3,-0.6 4,-0.6 1,-0.2 -1,-0.2 0.846 117.6 50.4 -70.3 -34.4 88.6 0.4 0.6 96 28 D V H >> S+ 0 0 54 -4,-0.2 3,-1.9 1,-0.2 4,-0.8 0.922 100.1 62.5 -69.8 -45.6 92.3 -0.2 0.9 97 29 D A H >< S+ 0 0 53 -4,-2.7 3,-0.5 1,-0.3 4,-0.5 0.831 98.5 58.5 -49.4 -34.9 92.1 -3.5 -1.0 98 30 D A H >X S+ 0 0 32 -4,-0.9 3,-1.2 1,-0.2 4,-0.9 0.805 91.2 70.5 -66.7 -29.7 90.8 -1.5 -4.0 99 31 D S H XX S+ 0 0 38 -3,-1.9 4,-1.4 -4,-0.6 3,-1.3 0.891 87.9 62.8 -55.0 -42.1 94.0 0.6 -4.0 100 32 D I H S+ 0 0 46 -3,-1.2 4,-0.9 -4,-0.5 -1,-0.3 0.805 100.7 59.9 -71.0 -29.7 93.9 -2.3 -8.3 102 34 D G H X S+ 0 0 89 -4,-1.4 4,-1.4 1,-0.2 3,-1.1 0.882 100.6 67.7 -65.8 -38.4 98.6 0.7 -9.1 104 36 D L H 3X S+ 0 0 74 -4,-1.3 4,-1.8 1,-0.3 5,-0.2 0.865 94.5 58.6 -49.5 -40.3 98.0 -2.2 -11.5 105 37 D H H 3X S+ 0 0 34 -4,-0.9 4,-2.7 -3,-0.5 -1,-0.3 0.877 100.5 56.6 -59.8 -39.2 96.8 0.3 -14.1 106 38 D F H X S+ 0 0 17 -4,-1.8 3,-2.7 1,-0.2 4,-1.2 0.905 100.6 67.1 -70.5 -41.3 100.1 -2.0 -17.6 109 41 D W H 3X S+ 0 0 61 -4,-2.7 4,-1.3 1,-0.3 -1,-0.2 0.805 92.1 65.0 -49.0 -29.5 99.6 1.5 -19.1 110 42 D T H 3< S+ 0 0 75 -4,-0.8 4,-0.4 -3,-0.4 -1,-0.3 0.816 98.0 53.7 -65.3 -30.3 103.3 1.3 -20.0 111 43 D I H X4 S+ 0 0 72 -3,-2.7 3,-2.1 -4,-0.4 4,-0.3 0.958 104.5 51.4 -70.2 -51.5 102.5 -1.6 -22.4 112 44 D G H >X S+ 0 0 18 -4,-1.2 3,-1.7 1,-0.3 4,-0.6 0.807 95.9 73.0 -55.8 -30.0 99.8 0.2 -24.3 113 45 D H H 3X S+ 0 0 89 -4,-1.3 4,-2.4 1,-0.3 3,-0.5 0.778 75.0 81.5 -56.3 -28.3 102.3 3.1 -24.8 114 46 D L H <> S+ 0 0 43 -3,-2.1 4,-1.5 -4,-0.4 -1,-0.3 0.845 90.1 52.7 -48.4 -36.6 104.2 0.9 -27.2 115 47 D N H <4 S+ 0 0 48 -3,-1.7 4,-0.4 -4,-0.3 -1,-0.3 0.916 110.5 45.5 -67.2 -44.2 101.7 2.0 -29.9 116 48 D Q H < S+ 0 0 40 -4,-0.6 -2,-0.2 -3,-0.5 3,-0.2 0.961 118.4 40.6 -63.9 -55.2 102.1 5.7 -29.3 117 49 D I H < S- 0 0 105 -4,-2.4 2,-0.3 1,-0.2 -2,-0.2 0.994 135.2 -38.0 -59.1 -68.6 105.9 5.7 -29.2 118 50 D K < 0 0 154 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 -0.823 360.0 360.0-166.7 122.0 106.6 3.3 -32.0 119 51 D R 0 0 183 -4,-0.4 -4,-0.1 -2,-0.3 -5,-0.1 0.386 360.0 360.0 -80.3 360.0 104.9 0.1 -33.1