==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 26-JUL-12 2LWA . COMPND 2 MOLECULE: HEMAGGLUTININ FUSION PEPTIDE G8A MUTANT; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; . AUTHOR J.L.LORIEAU,J.M.LOUIS,C.D.SCHWIETERS,A.BAX . 72 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6661.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 53 73.6 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 . 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 . 3 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 45 62.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.4 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 0 0 0 0 0 3 3 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 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 1 A G > 0 0 49 0, 0.0 4,-2.0 0, 0.0 22,-0.2 0.000 360.0 360.0 360.0 -66.0 18.6 -4.5 5.8 2 2 A L H > + 0 0 108 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.981 360.0 32.8 -63.0 -58.4 15.0 -5.5 5.2 3 3 A F H > S+ 0 0 161 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.887 116.2 58.9 -66.5 -38.5 13.4 -2.3 6.5 4 4 A G H > S+ 0 0 29 1,-0.2 4,-3.1 16,-0.2 5,-0.2 0.877 103.9 52.3 -58.0 -38.2 16.3 -0.3 5.3 5 5 A A H X S+ 0 0 9 -4,-2.0 4,-1.6 15,-0.4 -1,-0.2 0.910 112.8 43.6 -64.9 -43.2 15.7 -1.5 1.8 6 6 A I H X S+ 0 0 93 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.923 118.4 43.8 -68.5 -45.0 12.0 -0.5 1.9 7 7 A A H X S+ 0 0 49 -4,-3.1 4,-1.4 1,-0.2 -2,-0.2 0.924 116.6 46.1 -66.1 -45.0 12.8 2.9 3.6 8 8 A A H X S+ 0 0 23 -4,-3.1 4,-3.7 -5,-0.3 9,-0.3 0.799 107.2 60.8 -68.0 -27.7 15.7 3.6 1.3 9 9 A F H < S+ 0 0 105 -4,-1.6 4,-0.5 7,-0.3 -1,-0.2 0.909 106.5 44.2 -65.9 -42.1 13.5 2.5 -1.7 10 10 A I H < S+ 0 0 116 -4,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.792 125.1 35.1 -72.1 -29.3 11.0 5.3 -1.0 11 11 A E H < S+ 0 0 139 -4,-1.4 -2,-0.2 2,-0.2 -3,-0.2 0.899 133.8 22.9 -90.7 -51.3 13.8 7.8 -0.4 12 12 A G S X S- 0 0 36 -4,-3.7 4,-4.0 1,-0.3 5,-0.3 -0.059 97.0-142.4-108.0 32.0 16.5 6.8 -2.9 13 13 A G H > - 0 0 32 -4,-0.5 4,-1.6 2,-0.2 -1,-0.3 -0.007 68.5 -19.5 42.2-145.3 14.2 4.9 -5.3 14 14 A W H >> S+ 0 0 175 1,-0.2 4,-1.7 2,-0.2 3,-0.6 0.937 143.5 53.4 -55.2 -50.4 15.7 1.8 -6.8 15 15 A T H 3> S+ 0 0 112 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.876 106.9 53.6 -53.1 -39.5 19.3 2.9 -6.0 16 16 A G H 3X S+ 0 0 8 -4,-4.0 4,-3.1 -8,-0.3 -7,-0.3 0.854 102.0 58.9 -65.1 -35.0 18.2 3.4 -2.4 17 17 A M H 0 0 97 0, 0.0 4,-3.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 155.3 38.2 -4.7 6.3 27 2 B L H > + 0 0 125 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.918 360.0 50.7 -49.2 -49.8 34.7 -5.3 5.0 28 3 B F H > S+ 0 0 166 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.934 113.8 44.2 -55.5 -48.7 33.4 -2.2 6.8 29 4 B G H > S+ 0 0 39 2,-0.2 4,-4.3 1,-0.2 5,-0.3 0.918 109.8 56.8 -63.0 -44.2 36.2 -0.1 5.3 30 5 B A H X S+ 0 0 49 -4,-3.5 4,-1.6 1,-0.2 -2,-0.2 0.943 113.5 38.6 -52.1 -54.2 35.7 -1.6 1.8 31 6 B I H X S+ 0 0 79 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.907 119.0 48.5 -64.4 -42.9 32.1 -0.6 1.7 32 7 B A H X>S+ 0 0 41 -4,-2.6 4,-2.7 -5,-0.3 5,-1.1 0.904 111.5 49.3 -64.5 -41.8 32.8 2.7 3.5 33 8 B A H <5S+ 0 0 42 -4,-4.3 -1,-0.2 3,-0.3 -2,-0.2 0.806 104.8 60.8 -67.4 -29.1 35.7 3.5 1.1 34 9 B F H <5S+ 0 0 99 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.934 119.5 24.5 -63.6 -46.7 33.4 2.6 -1.8 35 10 B I H ><5S+ 0 0 91 -4,-1.6 3,-0.5 3,-0.2 4,-0.3 0.949 141.9 22.6 -82.7 -57.5 30.9 5.4 -1.0 36 11 B E T 3<5S+ 0 0 135 -4,-2.7 -3,-0.3 1,-0.2 -2,-0.1 0.936 124.6 51.8 -76.0 -49.3 33.1 7.8 1.0 37 12 B G T 3 - 0 0 25 -3,-0.5 4,-0.9 -6,-0.3 -3,-0.2 0.551 16.6-124.2 69.9 136.2 34.9 7.2 -3.8 39 14 B W H > S+ 0 0 157 -4,-0.3 4,-0.8 2,-0.2 -4,-0.1 0.818 113.3 42.7 -80.4 -32.3 33.6 4.3 -5.9 40 15 B T H > S+ 0 0 61 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.762 102.0 69.9 -82.9 -28.0 35.7 5.3 -8.9 41 16 B G H > S+ 0 0 46 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.920 100.0 47.0 -55.9 -46.4 38.8 6.0 -6.8 42 17 B M H X S+ 0 0 110 -4,-0.9 4,-1.9 1,-0.2 -1,-0.2 0.899 113.0 49.9 -62.8 -40.7 39.3 2.3 -6.0 43 18 B I H X S+ 0 0 75 -4,-0.8 4,-2.3 1,-0.2 5,-0.2 0.911 106.4 54.7 -64.5 -43.5 38.8 1.5 -9.7 44 19 B D H X S+ 0 0 111 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.882 107.7 51.4 -58.2 -38.4 41.4 4.1 -10.7 45 20 B G H < S+ 0 0 48 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.934 107.8 50.6 -64.4 -47.5 43.9 2.5 -8.4 46 21 B W H < S+ 0 0 227 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.901 114.5 44.7 -57.8 -42.2 43.3 -1.0 -9.8 47 22 B Y H < S+ 0 0 187 -4,-2.3 2,-1.8 1,-0.1 -1,-0.2 0.881 95.8 82.5 -70.0 -38.7 43.8 0.3 -13.3 48 23 B G < 0 0 55 -4,-2.4 -1,-0.1 -5,-0.2 -4,-0.0 -0.498 360.0 360.0 -70.8 88.2 46.9 2.4 -12.3 49 24 B S 0 0 166 -2,-1.8 -2,-0.1 0, 0.0 -3,-0.1 -0.472 360.0 360.0 -73.4 360.0 49.5 -0.4 -12.4 50 !* 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 51 1 C G > 0 0 97 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-172.3 3.2 -5.0 5.8 52 2 C L H > + 0 0 129 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.951 360.0 43.8 -62.5 -51.3 -0.4 -5.4 4.7 53 3 C F H > S+ 0 0 179 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.929 117.7 45.4 -60.4 -47.0 -1.7 -2.4 6.7 54 4 C G H > S+ 0 0 44 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.877 111.5 53.8 -64.6 -38.4 1.2 -0.3 5.5 55 5 C A H X S+ 0 0 58 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.929 108.9 47.5 -62.9 -46.4 0.8 -1.5 2.0 56 6 C I H X S+ 0 0 90 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.921 114.6 46.9 -61.5 -43.8 -2.9 -0.6 1.8 57 7 C A H X S+ 0 0 43 -4,-2.1 4,-3.1 1,-0.2 5,-0.2 0.926 108.9 54.0 -64.1 -45.3 -2.1 2.9 3.3 58 8 C A H X S+ 0 0 64 -4,-3.0 4,-1.0 1,-0.2 -1,-0.2 0.870 106.2 54.2 -57.2 -36.9 0.8 3.4 0.9 59 9 C F H < S+ 0 0 134 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.899 112.3 42.6 -64.4 -41.2 -1.6 2.7 -2.0 60 10 C I H >< S+ 0 0 106 -4,-1.6 3,-2.3 1,-0.2 -2,-0.2 0.899 106.6 60.7 -71.5 -42.1 -4.1 5.4 -0.7 61 11 C E H 3< S+ 0 0 144 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.770 88.8 73.5 -56.6 -25.8 -1.3 7.9 0.0 62 12 C G T 3< S- 0 0 58 -4,-1.0 -1,-0.3 -5,-0.2 4,-0.2 0.462 119.4-103.2 -69.3 3.0 -0.4 7.7 -3.7 63 13 C G X> - 0 0 33 -3,-2.3 3,-1.0 2,-0.1 4,-1.0 0.629 14.1-118.6 78.3 124.0 -3.6 9.7 -4.1 64 14 C W H 3> S+ 0 0 180 1,-0.3 4,-1.0 2,-0.2 -1,-0.1 0.781 116.7 56.3 -62.5 -27.5 -6.8 8.2 -5.4 65 15 C T H 3> S+ 0 0 106 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.711 95.0 68.0 -77.6 -20.4 -6.7 10.6 -8.4 66 16 C G H <> S+ 0 0 39 -3,-1.0 4,-2.9 2,-0.2 5,-0.3 0.920 97.1 51.2 -64.3 -44.9 -3.2 9.2 -9.2 67 17 C M H X S+ 0 0 63 -4,-1.0 4,-2.0 2,-0.2 -1,-0.2 0.927 113.6 44.0 -59.0 -47.2 -4.6 5.8 -10.2 68 18 C I H X S+ 0 0 67 -4,-1.0 4,-2.0 2,-0.2 5,-0.3 0.921 113.7 51.1 -64.5 -44.1 -7.2 7.3 -12.5 69 19 C D H X S+ 0 0 111 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.920 112.8 45.1 -59.1 -46.3 -4.7 9.7 -14.0 70 20 C G H < S+ 0 0 46 -4,-2.9 -1,-0.2 2,-0.2 -2,-0.2 0.832 106.8 61.1 -67.9 -32.3 -2.2 6.9 -14.7 71 21 C W H < S+ 0 0 193 -4,-2.0 3,-0.2 -5,-0.3 -2,-0.2 0.952 114.5 32.9 -59.3 -50.6 -5.0 4.8 -16.1 72 22 C Y H < S+ 0 0 201 -4,-2.0 2,-3.1 1,-0.2 -2,-0.2 0.889 106.7 72.3 -72.9 -40.3 -5.7 7.3 -18.9 73 23 C G < 0 0 51 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.1 -0.223 360.0 360.0 -72.2 53.5 -2.1 8.4 -19.1 74 24 C S 0 0 155 -2,-3.1 -1,-0.1 -3,-0.2 -2,-0.1 0.878 360.0 360.0 -56.7 360.0 -1.3 5.1 -20.8