==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN STORAGE/TRANSPORT 31-OCT-05 2EVK . COMPND 2 MOLECULE: MYOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSETER CATODON; . AUTHOR J.QIN,R.PERERA,L.L.LOVELACE,J.H.DAWSON,L.LEBIODA . 153 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8266.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 129 84.3 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 . 5 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 13.7 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 . 4 2.6 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 0 1 0 0 0 0 0 0 1 1 1 0 0 2 0 0 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 1 A V 0 0 166 0, 0.0 2,-0.3 0, 0.0 79,-0.1 0.000 360.0 360.0 360.0 143.2 -7.8 16.9 11.3 2 2 A L - 0 0 14 77,-0.1 2,-0.0 131,-0.1 128,-0.0 -0.826 360.0-116.1-105.1 147.1 -4.0 17.1 11.9 3 3 A S > - 0 0 61 -2,-0.3 4,-3.1 1,-0.1 5,-0.2 -0.306 33.0-108.0 -68.9 161.1 -2.1 16.7 15.2 4 4 A E H > S+ 0 0 98 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.922 122.4 51.5 -60.2 -39.7 -0.2 19.6 16.7 5 5 A G H > S+ 0 0 42 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.892 107.2 53.5 -65.3 -34.7 3.1 17.9 15.7 6 6 A E H > S+ 0 0 42 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.949 108.2 49.7 -62.4 -46.4 1.9 17.4 12.2 7 7 A W H X S+ 0 0 14 -4,-3.1 4,-2.6 1,-0.2 5,-0.2 0.917 107.2 55.4 -58.2 -38.5 1.1 21.1 11.9 8 8 A Q H X S+ 0 0 115 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.882 106.7 49.7 -65.0 -34.4 4.6 22.0 13.2 9 9 A L H X S+ 0 0 62 -4,-2.0 4,-2.0 2,-0.2 5,-0.3 0.894 111.1 50.3 -67.3 -39.8 6.1 19.9 10.4 10 10 A V H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.939 114.5 41.8 -60.2 -48.5 4.0 21.7 7.8 11 11 A L H X S+ 0 0 50 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.765 109.2 61.0 -73.6 -24.6 4.9 25.1 9.1 12 12 A H H X S+ 0 0 88 -4,-1.9 4,-1.0 -5,-0.2 -1,-0.2 0.953 111.3 37.2 -66.5 -46.2 8.5 24.2 9.5 13 13 A V H >X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 3,-0.6 0.898 112.1 60.9 -72.0 -27.8 9.0 23.4 5.8 14 14 A W H 3X S+ 0 0 8 -4,-2.0 4,-2.0 1,-0.3 -1,-0.2 0.927 97.8 58.2 -65.7 -33.6 6.7 26.3 4.9 15 15 A A H 3< S+ 0 0 58 -4,-2.0 4,-0.3 1,-0.2 -1,-0.3 0.879 104.3 52.3 -61.0 -32.2 9.2 28.6 6.6 16 16 A K H X< S+ 0 0 84 -4,-1.0 3,-1.4 -3,-0.6 4,-0.3 0.913 104.3 55.8 -70.0 -40.5 11.8 27.3 4.2 17 17 A V H >< S+ 0 0 3 -4,-2.0 3,-2.1 1,-0.2 7,-0.3 0.869 99.9 60.8 -54.0 -40.5 9.5 28.1 1.3 18 18 A E G >< S+ 0 0 85 -4,-2.0 3,-0.5 1,-0.3 -1,-0.2 0.630 85.1 75.4 -71.2 -8.9 9.2 31.7 2.4 19 19 A A G < S+ 0 0 89 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.731 120.9 9.9 -68.8 -19.7 13.0 32.2 2.0 20 20 A D G <> S+ 0 0 66 -3,-2.1 4,-2.4 -4,-0.3 -1,-0.3 -0.400 71.8 163.6-156.1 67.8 12.2 32.3 -1.8 21 21 A V H <> S+ 0 0 36 -3,-0.5 4,-3.0 1,-0.2 5,-0.3 0.925 78.6 52.8 -59.1 -45.5 8.5 32.5 -2.4 22 22 A A H > S+ 0 0 30 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.896 110.5 44.9 -57.6 -47.3 9.0 33.6 -6.0 23 23 A G H > S+ 0 0 4 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.903 115.0 47.1 -70.7 -35.0 11.3 30.8 -7.0 24 24 A H H X S+ 0 0 4 -4,-2.4 4,-2.3 -7,-0.3 -1,-0.2 0.920 111.1 53.6 -65.4 -40.0 9.2 28.2 -5.3 25 25 A G H X S+ 0 0 2 -4,-3.0 4,-2.7 1,-0.2 5,-0.3 0.854 110.8 46.5 -59.4 -45.1 6.1 29.7 -7.0 26 26 A Q H X S+ 0 0 28 -4,-2.5 4,-2.8 -5,-0.3 5,-0.2 0.964 112.4 48.3 -64.3 -47.3 7.8 29.5 -10.4 27 27 A D H X S+ 0 0 43 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.849 112.4 49.9 -63.9 -35.8 9.0 25.9 -10.0 28 28 A I H X S+ 0 0 5 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.929 113.1 44.5 -68.6 -46.8 5.5 24.8 -8.8 29 29 A L H X S+ 0 0 4 -4,-2.7 4,-2.7 2,-0.2 5,-0.3 0.902 115.3 48.4 -62.3 -43.1 3.6 26.4 -11.7 30 30 A I H X S+ 0 0 15 -4,-2.8 4,-2.2 -5,-0.3 5,-0.3 0.960 111.3 49.5 -67.2 -40.4 6.1 25.1 -14.2 31 31 A R H X S+ 0 0 79 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.867 111.8 50.7 -62.2 -37.3 6.0 21.6 -12.8 32 32 A L H X S+ 0 0 10 -4,-2.1 4,-1.8 2,-0.2 7,-0.2 0.925 110.8 46.7 -63.7 -48.5 2.2 21.7 -12.9 33 33 A F H < S+ 0 0 7 -4,-2.7 7,-0.2 1,-0.2 -2,-0.2 0.838 116.1 45.2 -66.9 -34.9 2.0 22.8 -16.5 34 34 A K H < S+ 0 0 146 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.873 116.2 43.3 -75.4 -40.2 4.5 20.3 -17.7 35 35 A S H < S+ 0 0 50 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.801 133.5 19.3 -76.7 -26.2 3.1 17.3 -15.8 36 36 A H >X - 0 0 39 -4,-1.8 3,-1.7 -5,-0.1 4,-0.6 -0.774 69.6-179.1-146.8 73.7 -0.5 18.1 -16.6 37 37 A P H >> S+ 0 0 81 0, 0.0 3,-0.6 0, 0.0 4,-0.6 0.748 74.6 73.8 -59.2 -19.0 -0.6 20.5 -19.7 38 38 A E H >4 S+ 0 0 68 1,-0.3 3,-1.1 2,-0.2 4,-0.4 0.808 88.3 63.2 -63.9 -27.5 -4.4 20.7 -19.7 39 39 A T H X4 S+ 0 0 4 -3,-1.7 3,-2.0 1,-0.3 4,-0.4 0.891 90.0 65.5 -66.9 -30.0 -4.0 22.9 -16.6 40 40 A L H X< S+ 0 0 32 -4,-0.6 3,-1.8 -3,-0.6 6,-0.3 0.891 85.6 74.0 -63.2 -23.2 -2.1 25.6 -18.6 41 41 A E T << S+ 0 0 134 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.735 84.0 66.7 -61.7 -19.0 -5.3 26.2 -20.6 42 42 A K T < S+ 0 0 76 -3,-2.0 2,-0.8 -4,-0.4 -1,-0.3 0.632 89.8 73.2 -74.9 -7.3 -6.8 28.0 -17.6 43 43 A F X> - 0 0 52 -3,-1.8 3,-2.2 -4,-0.4 4,-1.2 -0.781 58.3-175.5-119.5 96.2 -4.3 30.8 -18.0 44 44 A D T 34 S+ 0 0 123 -2,-0.8 3,-0.3 1,-0.3 -1,-0.2 0.795 86.2 44.8 -61.3 -37.4 -4.9 33.1 -20.9 45 45 A R T 34 S+ 0 0 162 1,-0.2 -1,-0.3 2,-0.1 16,-0.1 0.295 113.7 52.1 -89.2 3.3 -1.8 35.2 -20.5 46 46 A F T X4 S+ 0 0 4 -3,-2.2 3,-2.0 -6,-0.3 -1,-0.2 0.191 83.0 81.3-112.3 -10.9 0.5 32.2 -19.9 47 47 A K T 3< S+ 0 0 104 -4,-1.2 -2,-0.1 -3,-0.3 -3,-0.1 0.616 81.4 67.8 -82.1 0.0 -0.3 29.9 -22.8 48 48 A H T 3 S+ 0 0 123 -4,-0.1 2,-0.9 2,-0.0 -1,-0.3 0.524 77.1 100.2 -80.8 -1.8 2.1 31.9 -25.1 49 49 A L < + 0 0 15 -3,-2.0 -3,-0.0 1,-0.1 3,-0.0 -0.886 46.8 172.4 -87.5 112.3 4.9 30.6 -22.9 50 50 A K + 0 0 162 -2,-0.9 2,-0.3 2,-0.0 -1,-0.1 0.542 54.9 42.6 -93.9 -20.2 6.4 27.7 -24.9 51 51 A T S > S- 0 0 69 1,-0.1 4,-2.5 0, 0.0 5,-0.2 -0.887 77.5-116.2-131.8 157.9 9.5 26.9 -22.9 52 52 A E H > S+ 0 0 112 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.889 118.2 51.9 -53.7 -44.8 10.7 26.4 -19.3 53 53 A A H > S+ 0 0 71 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.933 107.7 50.9 -63.2 -36.7 13.0 29.4 -19.8 54 54 A E H > S+ 0 0 87 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.946 108.5 52.8 -67.7 -37.4 10.2 31.6 -21.1 55 55 A M H >< S+ 0 0 16 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.911 109.5 48.9 -64.7 -37.9 8.1 30.6 -18.1 56 56 A K H 3< S+ 0 0 89 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.813 109.6 51.6 -70.5 -28.7 10.9 31.6 -15.7 57 57 A A H 3< S+ 0 0 84 -4,-1.8 2,-0.8 -5,-0.2 -1,-0.2 0.571 85.1 104.1 -81.4 -7.7 11.4 35.0 -17.5 58 58 A S S+ 0 0 118 -2,-0.8 4,-3.0 1,-0.2 5,-0.2 0.891 88.1 56.3 -60.6 -40.7 7.3 38.4 -14.5 60 60 A D H > S+ 0 0 70 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.924 107.7 47.1 -63.0 -39.5 3.6 37.9 -14.6 61 61 A L H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.958 112.7 49.8 -64.0 -43.1 3.9 34.2 -14.0 62 62 A K H X S+ 0 0 81 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.921 111.0 48.9 -61.6 -42.9 6.3 34.8 -11.1 63 63 A K H X S+ 0 0 108 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.928 110.3 52.4 -60.9 -43.5 3.9 37.4 -9.6 64 64 A H H X S+ 0 0 54 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.920 106.3 52.6 -63.5 -38.9 1.1 34.9 -9.9 65 65 A G H X S+ 0 0 2 -4,-2.4 4,-2.9 -5,-0.2 -1,-0.2 0.914 108.5 50.6 -65.2 -33.7 3.0 32.1 -8.1 66 66 A V H X S+ 0 0 47 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.895 109.6 51.1 -70.8 -39.2 3.7 34.5 -5.2 67 67 A T H X S+ 0 0 96 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.936 112.6 46.3 -59.0 -44.6 -0.0 35.3 -5.1 68 68 A V H X S+ 0 0 43 -4,-3.1 4,-2.3 1,-0.2 5,-0.2 0.954 115.5 44.5 -63.1 -49.0 -0.9 31.5 -5.0 69 69 A L H X S+ 0 0 5 -4,-2.9 4,-2.6 -5,-0.3 -1,-0.2 0.841 110.1 55.2 -70.8 -30.7 1.7 30.6 -2.4 70 70 A T H X S+ 0 0 85 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.903 110.6 45.5 -64.2 -43.1 0.9 33.6 -0.2 71 71 A A H X S+ 0 0 36 -4,-2.0 4,-1.8 -5,-0.2 -2,-0.2 0.921 114.5 48.0 -66.1 -44.9 -2.8 32.6 -0.1 72 72 A L H X S+ 0 0 14 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.913 110.6 51.7 -63.3 -42.2 -1.9 28.9 0.6 73 73 A G H X S+ 0 0 3 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.928 106.6 53.6 -60.1 -42.1 0.6 29.9 3.3 74 74 A A H < S+ 0 0 38 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.891 111.1 47.1 -64.5 -36.7 -2.1 32.0 5.1 75 75 A I H ><>S+ 0 0 4 -4,-1.8 3,-1.3 2,-0.2 5,-0.6 0.903 110.9 50.1 -65.4 -45.5 -4.4 29.0 5.1 76 76 A L H ><5S+ 0 0 3 -4,-2.8 3,-2.1 1,-0.3 -2,-0.2 0.882 103.8 59.6 -63.9 -37.4 -1.8 26.6 6.4 77 77 A K T 3<5S+ 0 0 100 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.663 95.3 64.2 -64.8 -17.7 -0.8 28.9 9.2 78 78 A K T X 5S- 0 0 72 -3,-1.3 3,-2.5 -4,-0.4 -1,-0.3 0.456 98.6-140.9 -82.3 -1.9 -4.4 28.7 10.5 79 79 A K T < 5S- 0 0 64 -3,-2.1 -77,-0.1 1,-0.3 -3,-0.1 0.897 74.6 -34.5 42.6 51.9 -3.9 25.0 11.1 80 80 A G T 3 + 0 0 9 -2,-1.5 4,-2.6 1,-0.1 3,-0.3 0.078 16.7 118.0-122.6 17.2 -9.3 28.6 7.7 83 83 A E H > S+ 0 0 114 1,-0.2 4,-2.3 2,-0.2 -1,-0.1 0.919 82.5 49.4 -54.3 -44.1 -12.9 29.0 6.7 84 84 A A H 4 S+ 0 0 75 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.818 117.0 41.7 -63.8 -33.5 -12.6 32.8 6.4 85 85 A E H > S+ 0 0 71 -3,-0.3 4,-0.5 2,-0.1 -1,-0.2 0.788 115.9 49.0 -84.3 -30.2 -9.4 32.5 4.3 86 86 A L H >X S+ 0 0 1 -4,-2.6 4,-2.2 2,-0.2 3,-0.6 0.824 93.9 73.1 -77.6 -36.2 -10.7 29.6 2.2 87 87 A K H 3X S+ 0 0 110 -4,-2.3 4,-2.6 -5,-0.3 5,-0.3 0.923 94.7 50.3 -55.6 -48.7 -14.1 31.1 1.2 88 88 A P H 3> S+ 0 0 86 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.868 111.1 50.6 -62.1 -29.9 -12.8 33.7 -1.3 89 89 A L H S+ 0 0 36 -4,-2.1 5,-2.5 -5,-0.3 4,-2.2 0.974 116.9 51.0 -71.1 -36.1 -13.4 32.4 -7.5 93 93 A G H <>S+ 0 0 4 -4,-2.5 6,-1.9 -5,-0.2 5,-1.1 0.880 120.1 35.3 -61.2 -36.4 -12.7 28.7 -8.2 94 94 A A H <5S+ 0 0 2 -4,-2.8 -1,-0.2 4,-0.2 -2,-0.2 0.721 129.5 29.1 -90.2 -23.3 -16.3 27.8 -8.4 95 95 A T H <5S+ 0 0 75 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.1 0.598 131.6 17.6-120.2 -7.3 -17.8 30.9 -10.0 96 96 A K T <5S+ 0 0 156 -4,-2.2 -3,-0.2 -5,-0.3 -4,-0.1 0.681 128.6 25.6-129.7 -67.8 -15.0 32.3 -12.2 97 97 A H T > - 0 0 27 0, 0.0 4,-1.5 0, 0.0 3,-1.0 -0.253 22.4-113.9 -68.2 154.5 -11.9 21.2 -10.5 101 101 A I H 3> S+ 0 0 28 52,-2.0 4,-1.7 1,-0.3 3,-0.2 0.853 116.7 64.5 -57.2 -33.0 -10.6 19.4 -7.4 102 102 A K H 3> S+ 0 0 50 51,-0.6 4,-2.4 1,-0.3 -1,-0.3 0.857 99.9 52.3 -59.3 -35.8 -8.6 17.2 -9.7 103 103 A Y H <> S+ 0 0 47 -3,-1.0 4,-2.7 1,-0.3 -1,-0.3 0.815 106.5 52.7 -69.4 -31.5 -6.6 20.3 -10.8 104 104 A L H X S+ 0 0 22 -4,-1.5 4,-1.9 -3,-0.2 -1,-0.3 0.840 106.9 52.5 -70.1 -29.6 -6.0 21.0 -7.1 105 105 A E H X S+ 0 0 82 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.918 108.2 53.0 -63.5 -45.9 -4.7 17.5 -6.7 106 106 A F H X S+ 0 0 36 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.896 112.5 41.5 -54.0 -50.7 -2.4 18.3 -9.7 107 107 A I H X S+ 0 0 28 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.835 111.3 57.8 -74.1 -27.5 -1.0 21.4 -8.1 108 108 A S H X S+ 0 0 3 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.915 106.7 48.7 -59.5 -41.6 -0.8 19.6 -4.7 109 109 A E H X S+ 0 0 99 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.932 110.2 51.4 -64.4 -41.8 1.4 17.0 -6.4 110 110 A A H X S+ 0 0 4 -4,-2.1 4,-2.7 1,-0.2 5,-0.3 0.870 108.6 51.6 -62.9 -39.8 3.6 19.8 -7.8 111 111 A I H X S+ 0 0 5 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.955 111.2 46.3 -62.1 -47.3 4.0 21.4 -4.4 112 112 A I H X S+ 0 0 33 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.940 112.3 52.3 -61.6 -42.9 5.1 18.2 -2.8 113 113 A H H X S+ 0 0 69 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.936 113.0 42.3 -58.6 -49.8 7.5 17.5 -5.7 114 114 A V H X S+ 0 0 6 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.911 112.5 53.3 -70.9 -38.9 9.2 20.9 -5.4 115 115 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 -5,-0.3 -1,-0.2 0.911 113.1 44.6 -57.4 -42.3 9.3 20.9 -1.6 116 116 A H H < S+ 0 0 86 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.877 112.5 51.9 -71.7 -36.8 11.1 17.5 -1.7 117 117 A S H < S+ 0 0 76 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.804 121.8 31.2 -63.9 -38.1 13.4 18.7 -4.5 118 118 A R H < S+ 0 0 93 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.796 131.7 27.4 -93.2 -28.5 14.5 21.8 -2.6 119 119 A H >< + 0 0 29 -4,-2.5 3,-2.0 -5,-0.3 -1,-0.2 -0.302 61.6 148.7-133.6 48.8 14.3 20.7 1.1 120 120 A P G > S+ 0 0 74 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.912 77.4 56.8 -58.7 -36.8 14.8 16.9 1.3 121 121 A G G 3 S+ 0 0 73 1,-0.3 3,-0.2 -3,-0.1 -2,-0.1 0.671 116.1 35.3 -67.9 -15.8 16.5 17.4 4.7 122 122 A D G < S+ 0 0 61 -3,-2.0 -1,-0.3 -7,-0.2 -106,-0.1 0.080 115.5 58.4-122.1 22.7 13.3 19.1 6.1 123 123 A F < + 0 0 0 -3,-1.5 -1,-0.1 -4,-0.2 -2,-0.1 -0.313 67.6 142.3-150.8 53.3 10.8 17.1 4.1 124 124 A G S > S- 0 0 36 -3,-0.2 4,-3.1 4,-0.0 5,-0.3 -0.009 70.6 -66.5 -82.7-164.5 11.2 13.4 5.0 125 125 A A H > S+ 0 0 76 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.879 132.2 47.4 -59.9 -44.0 8.4 10.9 5.3 126 126 A D H > S+ 0 0 131 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.927 115.7 44.5 -68.7 -41.3 6.8 12.3 8.4 127 127 A A H > S+ 0 0 7 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.869 112.7 52.0 -67.7 -37.0 6.8 15.9 7.0 128 128 A Q H X S+ 0 0 65 -4,-3.1 4,-3.2 1,-0.2 -2,-0.2 0.918 110.1 50.5 -62.3 -44.5 5.6 14.6 3.6 129 129 A G H X S+ 0 0 35 -4,-2.7 4,-2.9 -5,-0.3 -2,-0.2 0.934 111.3 47.8 -55.9 -50.7 2.8 12.8 5.4 130 130 A A H X S+ 0 0 1 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.928 112.9 47.1 -61.8 -45.9 1.8 16.0 7.4 131 131 A M H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.931 110.4 53.6 -65.4 -40.7 1.9 18.2 4.2 132 132 A N H X S+ 0 0 57 -4,-3.2 4,-2.6 1,-0.2 -1,-0.2 0.909 110.0 47.9 -55.6 -45.8 -0.2 15.6 2.4 133 133 A K H X S+ 0 0 89 -4,-2.9 4,-2.7 2,-0.2 5,-0.3 0.908 111.1 50.6 -64.8 -40.9 -2.8 15.7 5.2 134 134 A A H X S+ 0 0 3 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.927 113.6 43.4 -64.3 -43.5 -2.9 19.5 5.2 135 135 A L H X S+ 0 0 1 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.861 111.2 55.6 -70.5 -35.1 -3.4 19.7 1.4 136 136 A E H X S+ 0 0 98 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.879 109.4 46.8 -59.7 -41.9 -6.0 16.9 1.6 137 137 A L H X S+ 0 0 28 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.908 110.1 53.8 -68.0 -42.6 -7.9 19.0 4.2 138 138 A F H X S+ 0 0 19 -4,-2.2 4,-2.5 -5,-0.3 -2,-0.2 0.958 112.4 43.3 -50.8 -51.4 -7.6 22.1 2.0 139 139 A R H X S+ 0 0 32 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.881 112.6 53.1 -68.9 -37.5 -9.1 20.2 -1.0 140 140 A K H X S+ 0 0 138 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.951 112.7 43.2 -64.0 -47.7 -11.8 18.6 1.2 141 141 A D H X S+ 0 0 40 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.897 113.8 49.9 -69.9 -38.5 -13.0 21.9 2.6 142 142 A I H X S+ 0 0 4 -4,-2.5 4,-3.0 -5,-0.3 -1,-0.2 0.886 108.0 54.9 -68.8 -34.7 -12.9 23.8 -0.7 143 143 A A H X S+ 0 0 15 -4,-2.4 4,-2.5 1,-0.3 -2,-0.2 0.908 108.4 48.4 -60.2 -45.3 -14.9 20.9 -2.4 144 144 A A H X S+ 0 0 50 -4,-2.2 4,-2.0 1,-0.2 -1,-0.3 0.892 113.4 46.5 -62.2 -40.3 -17.6 21.4 0.3 145 145 A K H X S+ 0 0 35 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.880 108.7 57.1 -66.3 -40.5 -17.6 25.2 -0.3 146 146 A Y H ><>S+ 0 0 4 -4,-3.0 5,-2.4 1,-0.2 3,-0.8 0.943 107.7 47.4 -52.6 -49.2 -17.7 24.6 -4.1 147 147 A K H ><5S+ 0 0 107 -4,-2.5 3,-2.2 1,-0.3 -1,-0.2 0.881 105.5 57.3 -68.9 -37.0 -20.8 22.6 -3.7 148 148 A E H 3<5S+ 0 0 145 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.768 109.0 47.9 -60.3 -26.3 -22.5 25.2 -1.5 149 149 A L T <<5S- 0 0 69 -4,-1.3 -1,-0.3 -3,-0.8 -2,-0.2 0.383 126.5-105.4 -91.7 0.5 -21.9 27.6 -4.4 150 150 A G T < 5S+ 0 0 64 -3,-2.2 2,-0.6 1,-0.2 -3,-0.2 0.645 78.7 129.4 82.1 26.7 -23.4 25.0 -6.8 151 151 A Y < - 0 0 35 -5,-2.4 -1,-0.2 -6,-0.2 -2,-0.2 -0.950 36.9-170.7-110.1 121.5 -20.1 23.9 -8.5 152 152 A Q 0 0 141 -2,-0.6 -1,-0.1 1,-0.2 -5,-0.1 0.083 360.0 360.0 -95.7 24.7 -19.6 20.1 -8.6 153 153 A G 0 0 32 -53,-0.1 -52,-2.0 -10,-0.1 -51,-0.6 0.763 360.0 360.0 -81.5 360.0 -15.9 20.3 -9.8