==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN STORAGE/TRANSPORT 01-AUG-01 1JP8 . COMPND 2 MOLECULE: MYOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSETER CATODON; . AUTHOR P.URAYAMA,S.M.GRUNER,G.N.PHILLIPS JR. . 152 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8236.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 79.6 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 . 4 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 63.2 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 V 0 0 166 0, 0.0 2,-0.3 0, 0.0 79,-0.1 0.000 360.0 360.0 360.0 162.0 -3.2 15.8 15.0 2 2 A L - 0 0 15 77,-0.1 2,-0.1 1,-0.1 128,-0.0 -0.727 360.0-120.8 -98.7 149.2 -0.6 13.9 17.1 3 3 A S > - 0 0 61 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.336 31.1-103.0 -79.5 169.5 -1.5 12.3 20.4 4 4 A E H > S+ 0 0 114 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.892 124.7 53.1 -61.5 -36.0 0.4 13.2 23.6 5 5 A G H > S+ 0 0 39 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.887 108.0 48.6 -65.9 -40.0 2.3 10.0 23.3 6 6 A E H > S+ 0 0 54 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.912 110.1 51.3 -67.9 -40.4 3.4 10.7 19.7 7 7 A W H X S+ 0 0 16 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.879 105.6 57.7 -62.7 -37.3 4.5 14.2 20.6 8 8 A Q H X S+ 0 0 128 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.937 105.7 47.9 -58.4 -49.7 6.6 12.7 23.5 9 9 A L H X S+ 0 0 64 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.823 113.4 50.0 -60.6 -34.7 8.5 10.5 21.1 10 10 A V H X S+ 0 0 0 -4,-1.5 4,-1.5 2,-0.2 -2,-0.2 0.943 115.5 39.4 -69.1 -51.9 9.1 13.5 18.8 11 11 A L H X S+ 0 0 49 -4,-2.9 4,-1.3 2,-0.2 -2,-0.2 0.795 109.6 61.2 -71.4 -29.4 10.4 15.9 21.6 12 12 A H H X S+ 0 0 98 -4,-2.6 4,-0.6 -5,-0.3 -1,-0.2 0.932 112.4 37.5 -63.4 -45.1 12.4 13.1 23.3 13 13 A V H X S+ 0 0 0 -4,-1.3 4,-1.1 1,-0.2 3,-0.2 0.777 111.1 60.1 -78.1 -25.7 14.5 12.6 20.2 14 14 A W H X S+ 0 0 5 -4,-1.5 4,-1.6 1,-0.2 -1,-0.2 0.772 97.5 60.3 -72.9 -22.2 14.6 16.4 19.4 15 15 A A H X S+ 0 0 55 -4,-1.3 4,-0.6 1,-0.2 -1,-0.2 0.848 102.6 52.4 -70.4 -32.7 16.2 17.0 22.8 16 16 A K H < S+ 0 0 82 -4,-0.6 3,-0.4 -3,-0.2 4,-0.2 0.818 106.8 53.3 -69.7 -34.0 19.1 14.7 21.6 17 17 A V H >< S+ 0 0 1 -4,-1.1 3,-1.5 1,-0.2 7,-0.3 0.856 101.8 58.7 -69.0 -35.9 19.4 16.9 18.5 18 18 A E H >< S+ 0 0 80 -4,-1.6 3,-0.7 1,-0.3 -1,-0.2 0.694 90.0 70.7 -68.3 -19.0 19.7 20.0 20.6 19 19 A A T 3< S+ 0 0 90 -4,-0.6 -1,-0.3 -3,-0.4 -2,-0.2 0.673 120.0 17.3 -69.9 -16.0 22.8 18.6 22.3 20 20 A D T <> S+ 0 0 70 -3,-1.5 4,-2.0 -4,-0.2 -1,-0.3 -0.438 71.9 161.8-155.9 70.2 24.5 19.2 18.9 21 21 A V H <> S+ 0 0 37 -3,-0.7 4,-2.2 1,-0.2 48,-0.1 0.878 78.2 50.3 -59.6 -44.2 22.4 21.6 16.8 22 22 A A H > S+ 0 0 25 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.886 109.8 48.8 -64.7 -43.6 25.3 22.4 14.4 23 23 A G H > S+ 0 0 13 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.930 116.2 41.9 -64.1 -46.8 26.3 18.8 13.7 24 24 A H H X S+ 0 0 2 -4,-2.0 4,-2.3 -7,-0.3 -2,-0.2 0.894 113.8 55.9 -66.4 -39.0 22.7 17.7 12.9 25 25 A G H X S+ 0 0 1 -4,-2.2 4,-1.8 -5,-0.3 -2,-0.2 0.878 107.9 44.8 -61.5 -43.3 22.2 20.9 11.0 26 26 A Q H X S+ 0 0 26 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.901 113.4 51.3 -70.5 -37.9 25.1 20.4 8.6 27 27 A D H X S+ 0 0 53 -4,-1.8 4,-2.3 -5,-0.2 -2,-0.2 0.888 109.7 49.8 -64.5 -42.8 24.2 16.8 8.0 28 28 A I H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.943 112.8 44.6 -64.1 -47.7 20.6 17.6 7.2 29 29 A L H X S+ 0 0 2 -4,-1.8 4,-2.8 1,-0.2 -2,-0.2 0.895 114.1 50.7 -65.3 -37.8 21.4 20.3 4.6 30 30 A I H X S+ 0 0 8 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.906 109.6 50.3 -66.2 -40.4 24.1 18.2 3.1 31 31 A R H X S+ 0 0 108 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.955 112.2 48.6 -60.5 -48.2 21.7 15.3 2.7 32 32 A L H X S+ 0 0 10 -4,-2.5 4,-2.3 1,-0.2 7,-0.3 0.924 113.3 46.3 -57.3 -48.4 19.2 17.6 1.1 33 33 A F H < S+ 0 0 4 -4,-2.8 7,-0.2 2,-0.2 -1,-0.2 0.837 116.5 43.2 -66.3 -36.5 21.8 19.1 -1.3 34 34 A K H < S+ 0 0 107 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.915 118.1 44.1 -75.6 -43.6 23.2 15.7 -2.4 35 35 A S H < S+ 0 0 59 -4,-2.8 -2,-0.2 -5,-0.3 -3,-0.2 0.827 129.2 23.7 -70.8 -36.2 19.9 13.9 -2.7 36 36 A H >X - 0 0 34 -4,-2.3 3,-2.6 -5,-0.3 4,-0.6 -0.691 65.8-174.9-137.2 84.1 18.1 16.8 -4.5 37 37 A P H 3> S+ 0 0 85 0, 0.0 4,-1.0 0, 0.0 3,-0.4 0.674 80.2 69.7 -48.7 -28.1 20.6 19.0 -6.4 38 38 A E H 34 S+ 0 0 79 1,-0.2 4,-0.4 2,-0.2 -5,-0.1 0.665 91.2 59.0 -69.5 -18.5 17.8 21.4 -7.4 39 39 A T H X4 S+ 0 0 4 -3,-2.6 3,-0.8 -7,-0.3 4,-0.4 0.815 99.7 57.6 -77.7 -31.7 17.4 22.6 -3.7 40 40 A L H >< S+ 0 0 20 -4,-0.6 3,-1.7 -3,-0.4 6,-0.3 0.880 97.2 61.7 -63.8 -38.3 21.0 23.7 -3.7 41 41 A E T 3< S+ 0 0 123 -4,-1.0 -1,-0.2 1,-0.3 -2,-0.2 0.726 93.6 65.1 -61.3 -23.9 20.3 26.0 -6.7 42 42 A K T < S+ 0 0 84 -3,-0.8 2,-0.7 -4,-0.4 -1,-0.3 0.684 90.2 74.7 -71.6 -22.5 17.8 27.9 -4.5 43 43 A F <> - 0 0 51 -3,-1.7 4,-0.9 -4,-0.4 3,-0.4 -0.857 56.4-174.3 -98.3 107.8 20.5 29.1 -2.2 44 44 A D T 4 S+ 0 0 131 -2,-0.7 3,-0.5 1,-0.2 4,-0.3 0.877 88.0 60.7 -63.3 -35.8 22.7 31.9 -3.7 45 45 A R T 4 S+ 0 0 110 1,-0.2 -1,-0.2 -3,-0.1 3,-0.2 0.799 116.8 26.0 -60.1 -36.5 24.9 31.5 -0.6 46 46 A F T >4 S+ 0 0 0 -3,-0.4 3,-1.6 -6,-0.3 -1,-0.2 0.309 86.3 108.5-115.5 10.0 25.8 27.8 -1.2 47 47 A K T 3< S+ 0 0 89 -4,-0.9 -1,-0.1 -3,-0.5 -2,-0.1 0.752 76.7 58.7 -57.9 -27.2 25.4 27.6 -5.0 48 48 A H T 3 S+ 0 0 121 -4,-0.3 2,-0.5 -3,-0.2 -1,-0.3 0.663 76.9 104.8 -78.1 -21.1 29.2 27.4 -5.4 49 49 A L < + 0 0 11 -3,-1.6 -3,-0.0 1,-0.2 3,-0.0 -0.535 38.6 166.5 -67.9 115.2 29.6 24.2 -3.3 50 50 A K + 0 0 178 -2,-0.5 2,-0.2 0, 0.0 -1,-0.2 0.776 55.0 44.1-100.5 -35.0 30.3 21.4 -5.8 51 51 A T S > S- 0 0 64 1,-0.1 4,-1.3 0, 0.0 5,-0.1 -0.636 77.7-119.7-110.4 168.3 31.5 18.5 -3.6 52 52 A E H > S+ 0 0 84 -2,-0.2 4,-2.4 2,-0.2 5,-0.2 0.881 115.4 56.3 -71.0 -38.4 30.4 17.0 -0.3 53 53 A A H > S+ 0 0 72 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.917 105.6 50.1 -58.3 -47.3 33.9 17.8 1.1 54 54 A E H 4 S+ 0 0 86 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.870 110.7 52.0 -59.5 -36.8 33.4 21.5 0.3 55 55 A M H >< S+ 0 0 5 -4,-1.3 3,-1.1 1,-0.2 -2,-0.2 0.921 108.3 47.9 -67.1 -45.6 30.0 21.4 2.0 56 56 A K H 3< S+ 0 0 101 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.847 110.9 54.4 -63.7 -33.2 31.3 19.9 5.2 57 57 A A T 3< S+ 0 0 87 -4,-1.9 2,-0.5 -5,-0.2 -1,-0.2 0.496 84.4 102.6 -79.9 -8.2 34.1 22.5 5.3 58 58 A S <> - 0 0 22 -3,-1.1 4,-1.5 -4,-0.4 5,-0.1 -0.707 50.1-167.4 -85.1 123.3 31.8 25.6 5.0 59 59 A E H > S+ 0 0 134 -2,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.848 89.8 55.0 -74.4 -34.4 31.2 27.5 8.2 60 60 A D H > S+ 0 0 55 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.884 106.4 50.8 -66.7 -38.2 28.3 29.5 6.6 61 61 A L H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.926 112.2 47.7 -64.0 -42.5 26.5 26.3 5.6 62 62 A K H X S+ 0 0 73 -4,-1.5 4,-1.5 1,-0.2 -2,-0.2 0.877 108.7 54.5 -65.2 -38.6 26.9 25.0 9.2 63 63 A K H X S+ 0 0 127 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.874 108.6 48.7 -64.1 -37.8 25.7 28.4 10.5 64 64 A H H X S+ 0 0 35 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.828 103.2 61.0 -71.9 -31.3 22.5 28.1 8.4 65 65 A G H X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 5,-0.2 0.896 103.5 51.4 -60.5 -39.4 21.9 24.5 9.6 66 66 A V H X S+ 0 0 51 -4,-1.5 4,-2.6 1,-0.2 5,-0.3 0.935 108.8 50.9 -62.7 -45.0 21.7 26.0 13.1 67 67 A T H X S+ 0 0 75 -4,-1.5 4,-1.7 1,-0.2 -2,-0.2 0.870 111.3 47.2 -61.5 -40.4 19.1 28.5 12.0 68 68 A V H X S+ 0 0 38 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.951 116.0 43.0 -67.9 -49.2 16.9 25.9 10.3 69 69 A L H X S+ 0 0 4 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.868 112.9 50.8 -67.3 -38.4 16.9 23.5 13.2 70 70 A T H X S+ 0 0 71 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.923 113.2 47.0 -66.1 -40.1 16.4 26.1 15.9 71 71 A A H X S+ 0 0 41 -4,-1.7 4,-1.1 -5,-0.3 -2,-0.2 0.865 114.0 47.7 -67.4 -37.0 13.4 27.5 14.0 72 72 A L H X S+ 0 0 12 -4,-2.1 4,-2.9 2,-0.2 3,-0.2 0.915 109.2 54.4 -69.5 -41.6 12.1 24.0 13.5 73 73 A G H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.887 103.7 54.1 -59.4 -41.5 12.6 23.2 17.2 74 74 A A H < S+ 0 0 49 -4,-2.0 4,-0.5 2,-0.2 -1,-0.2 0.862 112.2 46.3 -61.3 -36.0 10.5 26.2 18.2 75 75 A I H >< S+ 0 0 5 -4,-1.1 3,-1.4 -3,-0.2 5,-0.5 0.965 112.4 48.4 -70.4 -52.5 7.7 24.9 16.0 76 76 A L H >< S+ 0 0 3 -4,-2.9 3,-2.2 1,-0.3 -2,-0.2 0.897 106.2 56.9 -55.3 -45.0 8.0 21.3 17.3 77 77 A K T 3< S+ 0 0 101 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.696 96.3 65.4 -63.0 -18.4 8.0 22.3 20.9 78 78 A K T X S- 0 0 80 -3,-1.4 3,-1.8 -4,-0.5 -1,-0.3 0.549 95.8-145.1 -80.2 -8.8 4.7 24.1 20.4 79 79 A K T < S- 0 0 67 -3,-2.2 -3,-0.1 1,-0.3 -2,-0.1 0.859 72.6 -33.6 46.3 51.7 3.0 20.7 19.7 80 80 A G T 3 S+ 0 0 24 -5,-0.5 2,-2.1 54,-0.1 -1,-0.3 -0.157 121.2 95.1 102.7 -42.4 0.6 22.0 17.0 81 81 A H < + 0 0 129 -3,-1.8 3,-0.2 1,-0.2 4,-0.1 -0.334 50.7 119.7 -80.7 57.5 -0.1 25.4 18.5 82 82 A H >> + 0 0 4 -2,-2.1 4,-2.6 1,-0.2 3,-0.6 0.164 22.5 119.6-109.2 15.8 2.7 26.8 16.2 83 83 A E H 3> S+ 0 0 126 1,-0.3 4,-2.2 -3,-0.2 -1,-0.2 0.864 78.8 46.2 -49.3 -45.3 0.6 29.3 14.2 84 84 A A H 34 S+ 0 0 69 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.782 117.3 43.8 -70.3 -30.9 2.7 32.3 15.3 85 85 A E H <4 S+ 0 0 66 -3,-0.6 4,-0.5 2,-0.1 -2,-0.2 0.737 117.4 45.7 -85.8 -23.6 6.0 30.5 14.6 86 86 A L H X S+ 0 0 8 -4,-2.6 4,-2.1 2,-0.1 5,-0.2 0.862 99.0 65.4 -89.3 -36.7 4.9 29.0 11.3 87 87 A K H X S+ 0 0 103 -4,-2.2 4,-2.4 -5,-0.3 5,-0.2 0.909 101.1 48.1 -53.7 -53.6 3.2 32.0 9.5 88 88 A P H > S+ 0 0 71 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.879 112.0 52.5 -56.4 -38.8 6.4 34.2 9.1 89 89 A L H > S+ 0 0 39 -4,-0.5 4,-2.1 1,-0.2 -2,-0.2 0.903 110.7 45.1 -63.9 -45.5 8.3 31.2 7.8 90 90 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 5,-0.3 0.884 110.4 55.2 -67.9 -38.4 5.7 30.4 5.1 91 91 A Q H X>S+ 0 0 78 -4,-2.4 4,-2.3 -5,-0.2 5,-0.5 0.942 114.0 39.2 -60.1 -48.8 5.3 34.0 4.1 92 92 A S H X>S+ 0 0 35 -4,-2.0 5,-3.0 1,-0.2 4,-1.2 0.857 116.3 50.3 -70.9 -38.0 9.1 34.4 3.4 93 93 A H H <5S+ 0 0 49 -4,-2.1 6,-3.3 3,-0.2 5,-0.3 0.801 116.7 41.7 -71.8 -26.8 9.5 30.9 1.8 94 94 A A H <5S+ 0 0 1 -4,-2.0 -2,-0.2 4,-0.2 -3,-0.2 0.933 130.0 20.7 -84.7 -50.9 6.6 31.4 -0.5 95 95 A T H <5S+ 0 0 64 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.1 0.810 134.2 29.5 -91.9 -33.9 7.1 35.0 -1.7 96 96 A K T <> - 0 0 54 0, 0.0 3,-1.5 0, 0.0 4,-1.0 -0.415 23.0-113.6 -70.8 152.7 7.9 24.9 -3.5 101 101 A I H 3> S+ 0 0 41 1,-0.3 4,-1.4 2,-0.2 3,-0.4 0.822 113.8 67.2 -51.7 -34.1 6.2 22.6 -0.9 102 102 A K H 3> S+ 0 0 111 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.831 96.4 54.2 -57.7 -36.2 7.9 19.6 -2.5 103 103 A Y H <> S+ 0 0 50 -3,-1.5 4,-2.4 2,-0.2 -1,-0.3 0.869 103.7 54.8 -68.3 -35.2 11.3 20.9 -1.3 104 104 A L H X S+ 0 0 14 -4,-1.0 4,-1.1 -3,-0.4 -1,-0.2 0.835 108.5 50.4 -65.7 -29.9 9.9 21.1 2.3 105 105 A E H X S+ 0 0 59 -4,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.908 108.0 52.3 -71.4 -43.5 9.1 17.4 1.8 106 106 A F H X S+ 0 0 24 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.897 110.1 47.7 -59.5 -43.4 12.6 16.7 0.6 107 107 A I H X S+ 0 0 24 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.776 107.3 57.5 -71.1 -24.8 14.1 18.3 3.7 108 108 A S H X S+ 0 0 4 -4,-1.1 4,-2.1 2,-0.2 -1,-0.2 0.890 106.9 47.8 -70.5 -37.4 11.7 16.4 5.9 109 109 A E H X S+ 0 0 98 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.887 110.5 52.6 -68.9 -36.7 13.1 13.1 4.5 110 110 A A H X S+ 0 0 4 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.851 108.9 50.0 -66.5 -35.7 16.6 14.4 5.1 111 111 A I H X S+ 0 0 4 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.916 110.3 48.9 -69.4 -44.1 15.7 15.1 8.7 112 112 A I H X S+ 0 0 21 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.865 111.6 51.0 -63.9 -35.2 14.3 11.7 9.3 113 113 A H H X S+ 0 0 77 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.938 111.2 46.0 -67.9 -48.7 17.3 10.1 7.7 114 114 A V H X S+ 0 0 7 -4,-2.1 4,-2.2 1,-0.2 5,-0.2 0.866 110.4 53.1 -64.3 -38.0 19.8 12.0 9.9 115 115 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.886 108.8 51.4 -66.0 -35.2 17.9 11.3 13.1 116 116 A H H < S+ 0 0 95 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.904 111.6 45.9 -67.1 -42.9 18.0 7.6 12.3 117 117 A S H < S+ 0 0 79 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.863 119.7 39.5 -67.2 -39.0 21.8 7.6 11.7 118 118 A R H < S+ 0 0 90 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.713 128.5 24.6 -86.1 -25.4 22.6 9.6 14.9 119 119 A H >< + 0 0 30 -4,-2.0 3,-0.6 -5,-0.2 4,-0.3 -0.386 61.8 155.4-140.2 62.4 20.1 8.2 17.4 120 120 A P G > S+ 0 0 84 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.876 76.8 56.1 -56.6 -38.0 19.1 4.6 16.4 121 121 A G G 3 S+ 0 0 73 1,-0.2 3,-0.2 -3,-0.1 -2,-0.1 0.814 117.2 32.4 -65.5 -34.6 18.2 3.7 20.0 122 122 A D G < S+ 0 0 67 -3,-0.6 -1,-0.2 1,-0.2 -109,-0.1 0.165 114.7 63.1-108.1 16.7 15.7 6.6 20.4 123 123 A F < + 0 0 1 -3,-0.9 -1,-0.2 -4,-0.3 2,-0.1 -0.451 66.3 145.0-138.2 61.7 14.5 6.6 16.8 124 124 A G S >> S- 0 0 30 -3,-0.2 4,-2.9 4,-0.0 3,-0.5 -0.301 70.3 -74.5 -86.9-178.8 12.9 3.3 16.1 125 125 A A H 3> S+ 0 0 83 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.873 132.3 50.5 -42.0 -54.4 9.9 2.7 13.8 126 126 A D H 3> S+ 0 0 111 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.885 114.4 43.0 -54.6 -45.7 7.4 4.2 16.4 127 127 A A H <> S+ 0 0 1 -3,-0.5 4,-2.3 2,-0.2 -1,-0.2 0.855 113.0 53.5 -70.6 -35.5 9.5 7.4 16.9 128 128 A Q H X S+ 0 0 78 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.903 108.4 50.5 -65.5 -39.9 10.1 7.6 13.1 129 129 A G H X S+ 0 0 34 -4,-2.9 4,-2.0 -5,-0.3 -2,-0.2 0.905 110.4 48.7 -64.4 -42.5 6.3 7.4 12.6 130 130 A A H X S+ 0 0 2 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.920 111.8 48.5 -63.1 -46.2 5.6 10.2 15.1 131 131 A M H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.859 108.5 55.0 -62.6 -38.5 8.3 12.5 13.6 132 132 A N H X S+ 0 0 67 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.931 109.0 47.4 -60.1 -46.7 6.9 11.9 10.1 133 133 A K H X S+ 0 0 71 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.868 110.7 51.4 -63.3 -38.3 3.5 13.0 11.3 134 134 A A H X S+ 0 0 3 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.845 111.4 47.9 -68.2 -33.4 4.9 16.1 13.0 135 135 A L H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.749 110.9 51.4 -77.9 -25.5 6.7 17.0 9.8 136 136 A E H X S+ 0 0 90 -4,-1.5 4,-3.1 2,-0.2 -2,-0.2 0.898 108.1 51.0 -74.5 -44.2 3.5 16.4 7.8 137 137 A L H X S+ 0 0 21 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.921 109.7 52.9 -57.1 -41.4 1.6 18.7 10.1 138 138 A F H X S+ 0 0 17 -4,-1.6 4,-1.7 1,-0.2 -2,-0.2 0.958 113.9 40.2 -57.3 -54.4 4.4 21.2 9.5 139 139 A R H X S+ 0 0 39 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.825 111.1 58.3 -64.6 -38.3 4.0 21.0 5.7 140 140 A K H X S+ 0 0 131 -4,-3.1 4,-1.9 1,-0.2 -1,-0.2 0.954 109.5 43.2 -58.5 -50.8 0.2 20.9 5.8 141 141 A D H X S+ 0 0 48 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.834 114.3 50.2 -66.8 -34.1 0.0 24.2 7.6 142 142 A I H >X S+ 0 0 1 -4,-1.7 4,-2.5 -5,-0.2 3,-0.6 0.939 108.8 52.0 -69.3 -44.3 2.6 25.8 5.4 143 143 A A H 3X S+ 0 0 15 -4,-2.8 4,-2.8 1,-0.3 -2,-0.2 0.885 105.8 55.2 -58.4 -40.3 0.8 24.7 2.2 144 144 A A H 3X S+ 0 0 60 -4,-1.9 4,-1.6 1,-0.2 -1,-0.3 0.824 110.6 45.5 -63.1 -32.0 -2.4 26.2 3.6 145 145 A K H S+ 0 0 4 -4,-2.5 5,-2.9 2,-0.2 4,-1.4 0.907 108.9 50.6 -61.0 -44.9 1.0 29.1 0.4 147 147 A K H ><5S+ 0 0 144 -4,-2.8 3,-0.8 3,-0.2 -2,-0.2 0.954 107.5 53.6 -58.6 -49.8 -2.5 28.5 -1.0 148 148 A E H 3<5S+ 0 0 136 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.885 113.4 42.5 -50.6 -47.7 -3.8 31.6 0.7 149 149 A L H 3<5S- 0 0 71 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.649 121.1-108.1 -76.5 -18.1 -1.0 33.7 -0.9 150 150 A G T <<5S+ 0 0 63 -4,-1.4 -3,-0.2 -3,-0.8 -2,-0.1 0.795 87.2 112.0 94.6 34.3 -1.4 32.0 -4.3 151 151 A Y < 0 0 105 -5,-2.9 -4,-0.2 -8,-0.2 -5,-0.1 0.426 360.0 360.0-115.5 -2.3 1.8 29.9 -4.4 152 152 A Q 0 0 135 -6,-0.5 -5,-0.0 -9,-0.1 -9,-0.0 -0.287 360.0 360.0 -57.8 360.0 0.3 26.4 -4.2