==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 16-APR-98 2CPS . COMPND 2 MOLECULE: M13 MAJOR COAT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE M13; . AUTHOR C.H.M.PAPAVOINE,B.E.C.CHRISTIAANS,R.H.A.FOLMER, . 50 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5146.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 38 76.0 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 . 4 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 54.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 4.0 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 A 0 0 148 0, 0.0 2,-3.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 127.5 19.4 -2.2 29.8 2 2 A E + 0 0 203 2,-0.1 2,-0.7 1,-0.0 0, 0.0 -0.302 360.0 149.1 -67.9 63.6 17.9 -2.3 26.3 3 3 A G + 0 0 65 -2,-3.5 -1,-0.0 1,-0.1 0, 0.0 -0.896 18.8 164.2-106.4 112.8 18.8 1.3 25.7 4 4 A D - 0 0 146 -2,-0.7 6,-0.1 3,-0.0 -1,-0.1 0.120 55.0-112.5-110.8 18.6 19.6 2.1 22.1 5 5 A D > - 0 0 83 1,-0.2 5,-0.8 4,-0.1 4,-0.3 0.928 27.1-160.0 47.8 94.2 19.4 5.9 22.5 6 6 A P T 5S+ 0 0 121 0, 0.0 -1,-0.2 0, 0.0 5,-0.0 0.226 74.8 76.0 -86.4 14.2 16.3 7.0 20.5 7 7 A A T >5S- 0 0 63 3,-0.1 4,-0.8 4,-0.0 -2,-0.1 0.901 117.4 -7.8 -86.8 -85.9 17.5 10.6 20.3 8 8 A K H >5S+ 0 0 136 2,-0.2 4,-2.7 3,-0.1 5,-0.2 0.834 131.2 63.5 -83.2 -36.0 20.3 11.0 17.8 9 9 A A H >5S+ 0 0 29 -4,-0.3 4,-2.7 2,-0.2 3,-0.3 0.964 101.9 48.3 -51.4 -62.3 20.7 7.3 17.1 10 10 A A H >X S+ 0 0 158 -4,-0.8 4,-0.9 1,-0.2 3,-0.8 0.886 113.6 46.2 -63.4 -39.6 17.8 9.9 13.5 12 12 A N H 3X S+ 0 0 109 -4,-2.7 4,-2.0 -3,-0.3 -2,-0.2 0.772 98.2 72.2 -73.5 -26.7 21.2 8.6 12.3 13 13 A S H 3< S+ 0 0 71 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.715 98.3 50.0 -60.7 -20.9 19.6 5.2 11.7 14 14 A L H X< S+ 0 0 120 -3,-0.8 3,-1.3 -4,-0.5 -1,-0.2 0.881 109.7 46.8 -84.2 -43.3 17.9 6.7 8.7 15 15 A Q H 3< S+ 0 0 154 -4,-0.9 3,-0.3 1,-0.3 -2,-0.2 0.753 101.4 67.8 -69.7 -25.2 21.0 8.3 7.2 16 16 A A T 3< S+ 0 0 79 -4,-2.0 2,-0.3 1,-0.2 -1,-0.3 0.488 78.4 85.1 -73.8 -2.0 22.8 5.0 7.7 17 17 A S < + 0 0 99 -3,-1.3 2,-1.0 -5,-0.1 -1,-0.2 -0.191 52.1 126.1 -93.2 42.4 20.6 3.5 5.0 18 18 A A >> + 0 0 38 -3,-0.3 3,-2.1 -2,-0.3 4,-0.8 -0.597 22.5 162.3-100.4 69.6 22.8 4.7 2.3 19 19 A T T 34 S+ 0 0 124 -2,-1.0 -1,-0.2 1,-0.3 -2,-0.0 0.557 70.1 67.6 -65.6 -6.9 23.3 1.4 0.5 20 20 A E T 34 S+ 0 0 121 1,-0.2 -1,-0.3 -3,-0.1 4,-0.2 0.544 104.3 41.6 -89.6 -8.4 24.5 3.4 -2.5 21 21 A Y T <> S+ 0 0 185 -3,-2.1 2,-1.5 1,-0.1 4,-0.9 0.519 92.3 87.1-112.0 -12.7 27.6 4.5 -0.7 22 22 A I T < S+ 0 0 128 -4,-0.8 -1,-0.1 1,-0.2 -3,-0.0 -0.618 94.0 35.0 -91.3 78.2 28.5 1.2 1.0 23 23 A G T > S+ 0 0 40 -2,-1.5 4,-1.1 -3,-0.1 3,-0.4 -0.077 107.7 54.3 176.7 -58.1 30.6 -0.3 -1.7 24 24 A Y H > S+ 0 0 154 1,-0.2 4,-1.3 -4,-0.2 -2,-0.1 0.772 103.9 61.6 -69.0 -26.0 32.6 2.3 -3.6 25 25 A A H X S+ 0 0 57 -4,-0.9 4,-1.6 1,-0.2 -1,-0.2 0.824 98.5 56.3 -69.3 -31.7 34.1 3.4 -0.3 26 26 A W H > S+ 0 0 190 -3,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.901 104.3 52.1 -66.5 -41.1 35.6 0.0 0.2 27 27 A A H X S+ 0 0 60 -4,-1.1 4,-1.2 1,-0.2 -1,-0.2 0.863 107.4 53.4 -62.5 -36.1 37.5 0.2 -3.1 28 28 A M H X S+ 0 0 123 -4,-1.3 4,-0.6 1,-0.2 -1,-0.2 0.866 102.9 57.4 -66.6 -37.5 38.8 3.6 -1.9 29 29 A V H >X S+ 0 0 73 -4,-1.6 4,-2.2 1,-0.2 3,-1.5 0.917 103.6 52.3 -59.6 -44.9 40.1 2.0 1.3 30 30 A V H 3X>S+ 0 0 86 -4,-1.6 4,-1.3 1,-0.3 5,-0.5 0.846 104.9 56.5 -60.1 -34.3 42.2 -0.5 -0.7 31 31 A V H 3<5S+ 0 0 94 -4,-1.2 -1,-0.3 3,-0.2 -2,-0.2 0.632 109.0 48.4 -72.6 -13.4 43.7 2.5 -2.6 32 32 A I H <<5S+ 0 0 118 -3,-1.5 -2,-0.2 -4,-0.6 4,-0.2 0.880 125.5 23.9 -91.2 -48.0 44.8 3.9 0.7 33 33 A V H >X5S+ 0 0 86 -4,-2.2 3,-3.5 2,-0.2 4,-1.5 0.959 123.7 49.8 -81.5 -61.4 46.4 0.8 2.2 34 34 A G H 3X5S+ 0 0 36 -4,-1.3 4,-1.1 1,-0.3 -3,-0.2 0.773 104.7 64.4 -48.7 -26.4 47.3 -1.1 -0.9 35 35 A A H 3> S+ 0 0 69 -3,-3.5 4,-3.8 -4,-0.2 5,-0.3 0.919 102.0 59.9 -82.1 -48.6 51.3 1.9 0.8 37 37 A I H X S+ 0 0 94 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.822 105.6 54.4 -48.2 -34.3 52.4 -1.7 0.3 38 38 A G H X S+ 0 0 45 -4,-1.1 4,-1.2 2,-0.2 -1,-0.2 0.991 115.0 33.7 -64.6 -64.2 53.5 -0.6 -3.2 39 39 A I H X S+ 0 0 104 -4,-1.1 4,-1.7 1,-0.2 -2,-0.2 0.841 118.6 56.5 -62.0 -33.6 55.8 2.2 -2.2 40 40 A K H X S+ 0 0 120 -4,-3.8 4,-1.7 1,-0.2 3,-0.3 0.946 103.9 51.1 -63.0 -49.6 56.7 0.2 0.9 41 41 A L H X S+ 0 0 95 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.781 107.5 57.0 -58.4 -27.7 57.9 -2.8 -1.1 42 42 A F H X S+ 0 0 135 -4,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.902 103.0 51.0 -71.1 -43.6 60.0 -0.3 -3.1 43 43 A K H X S+ 0 0 97 -4,-1.7 4,-1.2 -3,-0.3 -2,-0.2 0.873 107.2 55.1 -62.2 -38.8 61.9 1.0 -0.1 44 44 A K H < S+ 0 0 88 -4,-1.7 3,-0.4 2,-0.2 4,-0.2 0.943 113.5 39.2 -60.5 -50.6 62.8 -2.5 1.0 45 45 A F H < S+ 0 0 147 -4,-1.5 4,-0.3 1,-0.2 3,-0.2 0.757 122.4 44.6 -71.1 -25.8 64.3 -3.5 -2.4 46 46 A T H < S+ 0 0 76 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.495 112.1 52.0 -96.2 -6.1 65.9 -0.0 -2.6 47 47 A S S < S+ 0 0 84 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.254 80.7 96.2-111.5 9.8 67.1 0.1 1.0 48 48 A K + 0 0 134 -3,-0.2 -2,-0.1 -4,-0.2 -1,-0.1 0.977 49.0 175.6 -62.5 -57.9 68.9 -3.3 0.9 49 49 A A 0 0 94 -4,-0.3 -3,-0.1 1,-0.2 -1,-0.0 0.925 360.0 360.0 48.9 52.1 72.4 -1.8 0.2 50 50 A S 0 0 177 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.326 360.0 360.0 -68.7 360.0 73.9 -5.3 0.5