==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN TRANSPORT 24-SEP-97 1WLA . COMPND 2 MOLECULE: MYOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS; . AUTHOR R.MAURUS,G.D.BRAYER . 153 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8190.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 78.4 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 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.0 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 1 1 0 0 0 0 0 0 0 1 0 2 0 0 2 0 0 0 0 0 0 1 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 96 0, 0.0 2,-0.3 0, 0.0 79,-0.1 0.000 360.0 360.0 360.0 -37.3 -2.9 16.8 15.2 2 2 A L - 0 0 20 77,-0.1 2,-0.1 132,-0.0 128,-0.0 -0.884 360.0-125.3-115.1 155.7 -0.6 15.1 17.7 3 3 A S > - 0 0 61 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.321 33.6-108.3 -86.2 168.9 -1.3 13.6 21.1 4 4 A D H > S+ 0 0 90 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.885 121.8 58.1 -69.0 -33.3 0.7 14.8 24.2 5 5 A G H > S+ 0 0 41 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.950 108.8 45.9 -57.1 -44.7 2.5 11.5 24.2 6 6 A E H > S+ 0 0 65 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.899 112.1 48.8 -67.0 -41.2 3.7 12.3 20.7 7 7 A W H X S+ 0 0 16 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.904 107.8 56.9 -62.6 -38.5 4.6 15.9 21.5 8 8 A Q H X S+ 0 0 137 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.924 108.2 47.1 -55.2 -49.3 6.5 14.5 24.4 9 9 A Q H X S+ 0 0 54 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.897 109.4 53.0 -58.1 -49.0 8.5 12.4 22.0 10 10 A V H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.903 112.1 44.2 -56.4 -48.0 9.1 15.2 19.6 11 11 A L H X S+ 0 0 55 -4,-2.8 4,-1.3 2,-0.2 -1,-0.2 0.829 110.1 57.2 -73.9 -24.0 10.6 17.5 22.4 12 12 A N H < S+ 0 0 101 -4,-1.9 3,-0.5 -5,-0.3 4,-0.5 0.951 111.1 42.1 -66.2 -47.3 12.6 14.5 23.7 13 13 A V H >X S+ 0 0 1 -4,-2.6 3,-1.1 1,-0.2 4,-1.0 0.815 108.5 60.0 -65.6 -35.2 14.2 14.1 20.2 14 14 A W H 3X S+ 0 0 6 -4,-1.8 4,-2.7 1,-0.3 -1,-0.2 0.799 92.3 66.7 -67.1 -28.0 14.7 17.9 19.9 15 15 A G H 3X S+ 0 0 40 -4,-1.3 4,-1.0 -3,-0.5 -1,-0.3 0.801 98.2 54.7 -61.6 -27.2 16.8 17.9 23.1 16 16 A K H <4 S+ 0 0 46 -3,-1.1 3,-0.4 -4,-0.5 4,-0.4 0.925 108.7 47.1 -67.9 -43.6 19.3 15.9 20.9 17 17 A V H >< S+ 0 0 5 -4,-1.0 3,-1.4 1,-0.2 7,-0.3 0.856 107.4 56.9 -65.1 -41.0 19.4 18.6 18.3 18 18 A E H >< S+ 0 0 95 -4,-2.7 3,-0.7 1,-0.3 -1,-0.2 0.799 92.2 68.5 -65.9 -26.9 19.8 21.3 20.9 19 19 A A T 3< S+ 0 0 94 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.765 125.7 8.4 -63.8 -24.2 23.0 19.7 22.2 20 20 A D T <> S+ 0 0 73 -3,-1.4 4,-2.5 -4,-0.4 -1,-0.3 -0.529 70.2 164.3-157.1 78.3 24.6 20.7 18.8 21 21 A I H <> S+ 0 0 61 -3,-0.7 4,-3.1 1,-0.2 5,-0.2 0.883 79.3 51.8 -65.1 -40.7 22.4 23.0 16.7 22 22 A A H > S+ 0 0 24 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.897 111.1 44.8 -65.6 -47.5 25.1 24.1 14.5 23 23 A G H > S+ 0 0 12 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.905 117.6 46.5 -61.8 -42.6 26.4 20.6 13.5 24 24 A H H X S+ 0 0 9 -4,-2.5 4,-2.1 -7,-0.3 -2,-0.2 0.913 114.0 46.4 -68.5 -45.3 22.8 19.4 13.0 25 25 A G H X S+ 0 0 1 -4,-3.1 4,-2.1 2,-0.2 -1,-0.2 0.827 111.9 53.5 -61.3 -40.1 21.8 22.5 10.9 26 26 A Q H X S+ 0 0 28 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.931 110.9 43.3 -61.4 -51.3 24.9 22.2 8.9 27 27 A E H X S+ 0 0 55 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.818 110.7 57.1 -68.5 -35.0 24.3 18.5 8.0 28 28 A V H X S+ 0 0 5 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.976 111.9 40.9 -57.6 -54.4 20.6 19.2 7.3 29 29 A L H X S+ 0 0 2 -4,-2.1 4,-3.1 1,-0.2 -2,-0.2 0.859 114.7 51.1 -63.2 -40.3 21.4 21.9 4.6 30 30 A I H X S+ 0 0 5 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.861 111.0 49.2 -61.2 -43.4 24.3 19.9 3.1 31 31 A R H X S+ 0 0 111 -4,-2.3 4,-2.6 2,-0.2 5,-0.3 0.928 114.1 47.1 -59.6 -46.8 21.9 16.9 2.8 32 32 A L H X S+ 0 0 10 -4,-2.5 4,-2.5 -5,-0.2 7,-0.2 0.950 115.0 43.7 -60.0 -54.5 19.4 19.2 1.2 33 33 A F H < S+ 0 0 5 -4,-3.1 7,-0.2 2,-0.2 -1,-0.2 0.777 117.6 43.8 -64.7 -31.9 21.8 20.8 -1.3 34 34 A T H < S+ 0 0 67 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.887 117.9 44.3 -84.9 -37.3 23.6 17.6 -2.3 35 35 A G H < S+ 0 0 46 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.826 130.5 23.4 -71.0 -38.1 20.5 15.6 -2.7 36 36 A H >X - 0 0 61 -4,-2.5 3,-2.3 -5,-0.3 4,-0.6 -0.695 68.1-178.5-128.2 80.7 18.5 18.4 -4.5 37 37 A P H 3> S+ 0 0 81 0, 0.0 4,-0.7 0, 0.0 3,-0.5 0.699 77.2 69.7 -56.1 -24.5 21.0 20.8 -6.2 38 38 A E H 34 S+ 0 0 84 1,-0.2 3,-0.4 2,-0.2 4,-0.3 0.787 90.8 63.2 -65.8 -23.0 18.2 23.0 -7.6 39 39 A T H X4 S+ 0 0 3 -3,-2.3 3,-2.2 1,-0.2 4,-0.3 0.900 93.1 62.7 -68.6 -35.4 17.6 24.1 -3.9 40 40 A L H >< S+ 0 0 20 -4,-0.6 3,-2.0 -3,-0.5 6,-0.3 0.847 91.7 66.5 -58.1 -32.2 21.0 25.6 -3.8 41 41 A E T 3< S+ 0 0 114 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.638 86.8 68.9 -66.2 -10.5 20.0 28.0 -6.5 42 42 A K T < S+ 0 0 81 -3,-2.2 2,-0.6 -4,-0.3 -1,-0.3 0.646 91.6 68.1 -80.4 -14.4 17.6 29.7 -4.2 43 43 A F X> - 0 0 52 -3,-2.0 4,-1.4 -4,-0.3 3,-1.3 -0.896 55.8-173.1-110.0 102.2 20.4 31.1 -2.1 44 44 A D T 34 S+ 0 0 129 -2,-0.6 4,-0.3 1,-0.2 3,-0.2 0.838 90.3 61.7 -58.6 -31.1 22.6 33.7 -3.7 45 45 A K T 34 S+ 0 0 99 1,-0.2 -1,-0.2 2,-0.1 15,-0.1 0.692 117.2 25.6 -65.3 -27.8 24.8 33.4 -0.5 46 46 A F T X4 S+ 0 0 1 -3,-1.3 3,-2.2 -6,-0.3 -1,-0.2 0.478 87.6 98.6-119.8 -1.1 25.5 29.8 -1.2 47 47 A K T 3< S+ 0 0 64 -4,-1.4 -2,-0.1 1,-0.3 -3,-0.1 0.645 77.4 69.6 -62.3 -14.1 25.3 29.3 -5.0 48 48 A H T 3 S+ 0 0 107 -4,-0.3 -1,-0.3 -3,-0.1 2,-0.2 0.639 77.4 93.7 -79.1 -15.9 29.1 29.6 -5.1 49 49 A L < + 0 0 6 -3,-2.2 3,-0.1 1,-0.2 -3,-0.0 -0.547 40.3 163.2 -76.7 146.8 29.6 26.3 -3.3 50 50 A K + 0 0 149 1,-0.3 2,-0.3 -2,-0.2 -1,-0.2 0.481 59.1 53.2-128.0 -34.8 30.1 23.4 -5.8 51 51 A T S > S- 0 0 70 1,-0.1 4,-1.7 0, 0.0 -1,-0.3 -0.791 75.2-128.5-108.2 155.1 31.5 20.7 -3.6 52 52 A E H > S+ 0 0 91 -2,-0.3 4,-2.8 2,-0.2 5,-0.1 0.729 112.2 54.9 -64.8 -33.5 30.4 19.2 -0.3 53 53 A A H > S+ 0 0 71 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.898 108.0 49.4 -65.9 -44.7 33.9 19.9 1.2 54 54 A E H 4 S+ 0 0 76 2,-0.2 4,-0.5 1,-0.2 -2,-0.2 0.893 112.8 47.3 -56.9 -47.0 33.4 23.5 0.2 55 55 A M H >< S+ 0 0 6 -4,-1.7 3,-0.9 2,-0.2 -2,-0.2 0.880 111.4 51.1 -57.4 -48.4 30.0 23.4 1.9 56 56 A K H 3< S+ 0 0 84 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.840 108.9 51.3 -61.0 -36.6 31.5 21.7 5.0 57 57 A A T 3< S+ 0 0 77 -4,-2.3 2,-0.6 -5,-0.1 -1,-0.2 0.557 86.6 104.9 -85.2 -1.5 34.2 24.4 5.2 58 58 A S <> - 0 0 18 -3,-0.9 4,-1.2 -4,-0.5 5,-0.1 -0.609 46.5-173.6 -86.8 121.1 31.6 27.3 5.0 59 59 A E H > S+ 0 0 128 -2,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.857 86.4 59.4 -79.6 -28.2 31.0 29.0 8.4 60 60 A D H > S+ 0 0 63 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.813 103.4 52.9 -66.2 -33.5 28.2 31.1 6.9 61 61 A L H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.864 108.3 48.7 -68.3 -40.7 26.4 27.9 6.0 62 62 A K H X S+ 0 0 71 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.935 110.3 54.4 -62.9 -38.5 26.7 26.7 9.6 63 63 A K H X S+ 0 0 140 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.959 108.9 45.2 -59.1 -53.1 25.4 30.1 10.6 64 64 A H H X S+ 0 0 44 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.881 107.8 59.6 -60.5 -38.6 22.2 29.8 8.4 65 65 A G H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.930 105.8 49.7 -54.7 -43.3 21.8 26.1 9.8 66 66 A T H X S+ 0 0 38 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.917 109.0 49.8 -63.8 -46.5 21.5 27.6 13.3 67 67 A V H X S+ 0 0 87 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.914 113.2 48.2 -57.9 -46.9 18.9 30.3 12.2 68 68 A V H X S+ 0 0 42 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.960 115.2 41.4 -60.4 -53.1 16.8 27.6 10.5 69 69 A L H X S+ 0 0 6 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.753 112.2 56.7 -69.8 -24.1 16.8 25.1 13.4 70 70 A T H X S+ 0 0 86 -4,-2.2 4,-1.7 -5,-0.2 -1,-0.2 0.885 109.8 45.0 -65.4 -43.7 16.3 27.9 15.9 71 71 A A H X S+ 0 0 43 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.947 114.5 48.1 -70.0 -39.9 13.2 29.0 14.2 72 72 A L H X S+ 0 0 12 -4,-2.5 4,-3.2 1,-0.2 5,-0.2 0.902 109.4 51.9 -65.5 -45.5 11.8 25.4 13.8 73 73 A G H X S+ 0 0 2 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.922 106.8 55.7 -58.9 -36.3 12.5 24.5 17.5 74 74 A G H < S+ 0 0 34 -4,-1.7 4,-0.4 1,-0.2 -1,-0.2 0.918 111.4 43.7 -63.3 -39.8 10.6 27.7 18.5 75 75 A I H >< S+ 0 0 5 -4,-1.7 3,-1.6 1,-0.2 5,-0.5 0.930 111.1 53.6 -71.2 -44.6 7.6 26.4 16.5 76 76 A L H >< S+ 0 0 4 -4,-3.2 3,-1.8 1,-0.3 -1,-0.2 0.853 101.6 59.9 -59.0 -37.0 7.9 22.8 17.7 77 77 A K T 3< S+ 0 0 98 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.660 94.4 63.9 -66.5 -16.9 7.8 24.0 21.3 78 78 A K T X S- 0 0 94 -3,-1.6 3,-1.6 -4,-0.4 -1,-0.3 0.559 100.1-138.7 -81.0 -9.1 4.4 25.6 20.7 79 79 A K T < S- 0 0 79 -3,-1.8 -77,-0.1 -4,-0.3 -3,-0.1 0.890 73.6 -37.3 47.6 59.5 3.0 22.1 20.1 80 80 A G T 3 S+ 0 0 17 -5,-0.5 2,-0.5 1,-0.1 -1,-0.3 0.364 118.0 106.3 79.7 -6.2 0.8 23.1 17.2 81 81 A H < + 0 0 140 -3,-1.6 3,-0.2 -6,-0.2 4,-0.1 -0.368 46.5 116.9 -98.0 55.1 -0.2 26.5 18.7 82 82 A H > + 0 0 4 -2,-0.5 4,-2.6 1,-0.1 5,-0.3 0.072 16.5 119.2-112.6 22.1 2.1 28.3 16.2 83 83 A E H > S+ 0 0 118 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.957 81.4 52.3 -50.6 -47.3 -0.0 30.5 14.0 84 84 A A H 4 S+ 0 0 76 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.908 115.6 37.7 -58.6 -46.7 1.9 33.6 15.3 85 85 A E H > S+ 0 0 58 -3,-0.1 4,-0.6 2,-0.1 -1,-0.2 0.794 118.4 49.4 -76.3 -30.4 5.4 32.2 14.5 86 86 A L H >X S+ 0 0 2 -4,-2.6 4,-2.7 2,-0.2 3,-0.8 0.943 95.1 67.3 -79.6 -48.0 4.4 30.4 11.3 87 87 A K H 3X S+ 0 0 130 -4,-2.2 4,-2.7 1,-0.3 5,-0.2 0.852 103.1 47.0 -37.3 -55.5 2.5 33.2 9.4 88 88 A P H 3> S+ 0 0 63 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.870 113.6 49.1 -59.5 -40.7 5.7 35.4 9.0 89 89 A L H S+ 0 0 84 -4,-2.7 4,-2.9 -5,-0.3 5,-0.6 0.928 112.5 43.3 -74.0 -42.1 4.9 34.8 3.9 92 92 A S H X>S+ 0 0 36 -4,-2.3 5,-2.7 1,-0.2 4,-1.1 0.865 114.5 49.8 -72.1 -32.4 8.6 35.4 3.4 93 93 A H H <5S+ 0 0 56 -4,-2.6 6,-3.2 3,-0.2 5,-0.3 0.812 118.6 40.1 -74.5 -23.9 9.2 32.0 1.9 94 94 A A H <5S+ 0 0 1 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.942 128.3 24.9 -85.4 -51.4 6.3 32.4 -0.5 95 95 A T H <5S+ 0 0 84 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.811 133.5 26.6 -89.7 -31.8 6.6 36.1 -1.5 96 96 A K T <> - 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