==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 20-JUL-12 4G7Q . COMPND 2 MOLECULE: CYTOCHROME C OXIDASE SUBUNIT 1; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR Y.LI,Y.CHEN,C.D.STOUT . 752 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25371.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 606 80.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 1 0.1 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 . 42 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 87 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 383 50.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 22 2.9 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 5 1 1 2 1 1 0 0 0 1 2 0 0 0 0 1 1 0 0 2 0 1 1 1 0 3 3 RESIDUES PER ALPHA HELIX . 3 0 0 1 0 0 1 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 . 3 2 1 2 0 2 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 . 1 0 0 1 1 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 9 A S 0 0 107 0, 0.0 4,-0.2 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 121.5 36.9 9.7 43.4 2 10 A R > + 0 0 85 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.519 360.0 76.7 -88.6 -10.2 38.8 11.7 40.8 3 11 A V H > S+ 0 0 9 1,-0.2 4,-1.9 2,-0.2 7,-0.2 0.796 92.7 53.2 -68.5 -32.0 37.0 9.8 38.0 4 12 A Y H 4 S+ 0 0 47 2,-0.2 -1,-0.2 -3,-0.2 -2,-0.2 0.703 101.6 59.3 -73.1 -24.3 33.9 11.9 38.7 5 13 A E H 4 S+ 0 0 74 -4,-0.2 -2,-0.2 1,-0.1 -1,-0.2 0.927 116.2 33.2 -66.3 -44.0 36.1 15.1 38.3 6 14 A A H < S+ 0 0 50 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.1 0.747 134.0 28.7 -82.7 -26.6 37.0 14.0 34.7 7 15 A Y >< + 0 0 65 -4,-1.9 3,-1.0 -5,-0.1 4,-0.5 -0.667 61.3 160.0-135.7 75.5 33.6 12.4 33.9 8 16 A P T >> S+ 0 0 22 0, 0.0 4,-1.7 0, 0.0 3,-0.6 0.721 70.5 75.9 -67.4 -21.2 30.9 14.0 35.9 9 17 A E H 3> S+ 0 0 3 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.810 86.3 61.5 -58.4 -31.9 28.5 12.6 33.4 10 18 A K H <> S+ 0 0 4 -3,-1.0 4,-2.7 2,-0.2 -1,-0.2 0.896 103.6 48.2 -58.2 -42.5 28.9 9.2 35.0 11 19 A K H <> S+ 0 0 86 -3,-0.6 4,-2.4 -4,-0.5 -2,-0.2 0.911 112.2 46.9 -70.5 -44.2 27.5 10.5 38.3 12 20 A A H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.942 113.1 50.2 -60.5 -46.6 24.5 12.2 36.7 13 21 A T H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 3,-0.2 0.938 108.4 53.4 -58.2 -46.4 23.8 9.0 34.8 14 22 A L H X S+ 0 0 27 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.920 106.9 51.3 -53.2 -49.6 24.2 7.0 38.0 15 23 A Y H X S+ 0 0 95 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.822 109.0 51.0 -59.9 -36.7 21.5 9.2 39.6 16 24 A F H X S+ 0 0 1 -4,-2.1 4,-1.6 -3,-0.2 -1,-0.2 0.925 112.7 46.5 -64.7 -44.8 19.1 8.6 36.7 17 25 A L H X S+ 0 0 4 -4,-2.5 4,-3.2 2,-0.2 -2,-0.2 0.925 113.1 45.9 -62.7 -47.8 19.6 4.9 36.9 18 26 A V H X S+ 0 0 41 -4,-2.7 4,-3.2 2,-0.2 5,-0.2 0.935 114.4 47.4 -66.9 -46.6 19.2 4.5 40.7 19 27 A L H X S+ 0 0 19 -4,-1.7 4,-2.1 -5,-0.2 -1,-0.2 0.864 113.8 50.9 -59.3 -35.2 16.1 6.7 40.9 20 28 A G H X S+ 0 0 1 -4,-1.6 4,-1.4 2,-0.2 -2,-0.2 0.957 112.3 43.9 -65.9 -53.7 14.8 4.8 37.9 21 29 A F H X S+ 0 0 5 -4,-3.2 4,-2.7 2,-0.2 -2,-0.2 0.864 111.3 54.3 -61.6 -38.7 15.4 1.4 39.6 22 30 A L H X S+ 0 0 70 -4,-3.2 4,-2.3 1,-0.2 5,-0.2 0.932 109.7 48.3 -59.2 -46.2 13.9 2.7 42.9 23 31 A A H X S+ 0 0 6 -4,-2.1 4,-1.9 -5,-0.2 -1,-0.2 0.796 110.8 52.0 -62.9 -29.1 10.8 3.7 41.1 24 32 A L H X S+ 0 0 2 -4,-1.4 4,-3.1 2,-0.2 -2,-0.2 0.939 109.3 48.5 -72.4 -47.1 10.8 0.2 39.4 25 33 A I H X S+ 0 0 15 -4,-2.7 4,-0.8 2,-0.2 -2,-0.2 0.907 114.5 44.4 -58.7 -45.2 11.0 -1.6 42.8 26 34 A V H >X S+ 0 0 68 -4,-2.3 3,-0.7 1,-0.2 4,-0.5 0.928 117.1 45.7 -69.0 -45.5 8.2 0.5 44.4 27 35 A G H >< S+ 0 0 0 -4,-1.9 3,-0.9 1,-0.2 4,-0.3 0.893 109.6 55.9 -59.7 -43.4 6.0 0.2 41.3 28 36 A S H >< S+ 0 0 8 -4,-3.1 3,-1.0 1,-0.2 -1,-0.2 0.676 87.8 76.8 -66.4 -18.7 6.7 -3.5 41.0 29 37 A L H S+ 0 0 17 -3,-1.0 4,-2.5 -4,-0.3 -1,-0.2 0.908 87.9 45.2 -58.5 -55.4 2.6 -6.4 40.5 32 40 A P H > S+ 0 0 9 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.854 113.6 54.2 -61.1 -34.7 2.3 -9.9 42.2 33 41 A F H X S+ 0 0 29 -4,-0.5 4,-1.7 2,-0.2 10,-0.3 0.881 109.8 45.0 -64.2 -41.1 -0.8 -8.6 43.9 34 42 A Q H X S+ 0 0 18 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.848 112.6 52.6 -69.7 -35.0 -2.3 -7.6 40.6 35 43 A A H < S+ 0 0 5 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.892 110.1 47.1 -67.4 -40.4 -1.2 -11.0 39.1 36 44 A L H ><>S+ 0 0 29 -4,-2.5 5,-3.1 1,-0.2 3,-0.8 0.843 108.4 57.4 -71.5 -33.4 -2.9 -12.9 41.9 37 45 A N H ><5S+ 0 0 0 -4,-1.7 3,-2.1 1,-0.2 -2,-0.2 0.931 105.6 47.9 -56.5 -49.7 -6.0 -10.7 41.4 38 46 A Y T 3<5S+ 0 0 16 -4,-2.1 -1,-0.2 1,-0.3 424,-0.2 0.469 107.7 58.0 -72.5 -1.5 -6.2 -11.8 37.7 39 47 A G T < 5S- 0 0 7 -3,-0.8 -1,-0.3 2,-0.2 -2,-0.2 0.258 123.7-111.4-103.2 5.5 -5.8 -15.3 39.1 40 48 A N T < 5S+ 0 0 49 -3,-2.1 2,-0.4 1,-0.2 -3,-0.2 0.765 78.7 127.9 71.0 28.7 -8.9 -14.7 41.2 41 49 A V < - 0 0 66 -5,-3.1 2,-0.9 -8,-0.1 -1,-0.2 -0.978 51.8-145.9-116.4 128.3 -7.0 -14.6 44.5 42 50 A D + 0 0 55 -2,-0.4 4,-0.1 404,-0.2 -8,-0.1 -0.763 34.3 153.8 -99.2 96.3 -7.4 -11.6 46.8 43 51 A A > + 0 0 19 -2,-0.9 4,-1.5 -10,-0.3 -1,-0.1 0.108 45.3 104.1-104.1 18.4 -4.1 -10.8 48.6 44 52 A Y H > S+ 0 0 1 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.849 70.6 59.0 -73.7 -34.7 -5.0 -7.2 49.0 45 53 A P H > S+ 0 0 82 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.880 107.8 50.4 -60.4 -34.6 -5.9 -7.4 52.7 46 54 A L H >> S+ 0 0 96 1,-0.2 4,-1.6 2,-0.2 3,-0.6 0.905 109.3 50.3 -65.1 -42.6 -2.3 -8.6 53.2 47 55 A L H 3X S+ 0 0 4 -4,-1.5 4,-2.9 1,-0.2 7,-0.2 0.831 105.2 56.4 -67.5 -32.2 -0.9 -5.7 51.2 48 56 A K H 3< S+ 0 0 78 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.751 105.4 52.2 -73.5 -21.4 -2.9 -3.1 53.2 49 57 A R H << S+ 0 0 95 -4,-0.8 -2,-0.2 -3,-0.6 -1,-0.2 0.915 115.6 39.7 -75.6 -45.2 -1.3 -4.4 56.4 50 58 A L H < S+ 0 0 116 -4,-1.6 -2,-0.2 1,-0.3 -3,-0.1 0.879 132.3 26.9 -70.6 -39.5 2.2 -4.1 55.0 51 59 A L S >< S- 0 0 46 -4,-2.9 3,-1.4 -5,-0.2 -1,-0.3 -0.816 70.4-179.2-127.2 91.7 1.4 -0.8 53.3 52 60 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.609 74.5 67.9 -71.7 -15.3 -1.4 1.0 55.2 53 61 A F T 3 S+ 0 0 75 2,-0.0 2,-0.7 1,-0.0 -5,-0.1 0.654 76.0 102.5 -74.2 -15.6 -1.6 4.1 52.9 54 62 A V < + 0 0 2 -3,-1.4 -3,-0.1 -7,-0.2 3,-0.1 -0.608 44.9 173.3 -74.0 108.4 -3.0 1.7 50.1 55 63 A Q + 0 0 107 -2,-0.7 2,-0.3 1,-0.2 -1,-0.2 0.687 58.0 1.1 -92.1 -22.2 -6.7 2.3 50.0 56 64 A S > - 0 0 13 1,-0.1 4,-1.7 -12,-0.0 -1,-0.2 -0.990 68.4-103.3-159.4 164.8 -7.7 0.3 47.0 57 65 A Y H > S+ 0 0 4 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.856 120.2 55.1 -54.0 -38.5 -6.6 -2.0 44.2 58 66 A Y H > S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.842 102.2 52.6 -75.8 -33.4 -6.9 1.1 41.9 59 67 A Q H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.896 112.6 48.1 -59.7 -42.5 -4.6 3.3 43.9 60 68 A G H X S+ 0 0 0 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.927 110.3 50.4 -62.6 -46.6 -2.0 0.4 43.6 61 69 A L H X S+ 0 0 29 -4,-2.5 4,-2.7 1,-0.2 64,-0.2 0.869 109.7 51.9 -61.3 -37.6 -2.6 0.0 39.9 62 70 A T H X S+ 0 0 1 -4,-2.1 4,-3.2 2,-0.2 5,-0.3 0.951 112.4 44.2 -62.2 -50.0 -2.1 3.8 39.5 63 71 A L H X S+ 0 0 6 -4,-2.2 4,-2.7 1,-0.2 5,-0.4 0.880 113.1 52.8 -63.2 -40.1 1.2 3.7 41.4 64 72 A H H X>S+ 0 0 21 -4,-2.9 4,-2.0 3,-0.2 5,-0.6 0.928 114.6 40.8 -61.1 -47.9 2.2 0.6 39.5 65 73 A G H X>S+ 0 0 11 -4,-2.7 4,-1.8 3,-0.2 5,-0.9 0.972 119.5 42.7 -65.8 -56.2 1.6 2.2 36.1 66 74 A V H X>S+ 0 0 10 -4,-3.2 5,-2.6 3,-0.2 4,-1.4 0.951 120.6 41.7 -56.5 -52.3 3.0 5.7 36.8 67 75 A L H <>S+ 0 0 16 -4,-2.7 5,-2.2 -5,-0.3 -1,-0.2 0.901 125.8 30.5 -69.5 -44.1 6.1 4.3 38.7 68 76 A N H <>S+ 0 0 25 -4,-2.0 5,-0.9 -5,-0.4 -3,-0.2 0.961 129.5 31.6 -75.4 -53.9 7.0 1.4 36.3 69 77 A A H <X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.3 3,-0.7 0.987 120.9 34.8 -57.3 -58.5 20.3 7.7 31.4 80 88 A I H 3X S+ 0 0 1 -4,-3.5 4,-2.3 1,-0.2 -2,-0.2 0.949 117.2 47.8 -66.6 -52.5 21.0 5.6 28.3 81 89 A M H 3< S+ 0 0 1 -4,-2.8 -1,-0.2 -5,-0.3 -3,-0.1 0.365 119.4 40.2 -83.5 8.9 20.4 8.0 25.4 82 90 A V H <> S+ 0 0 2 -3,-0.7 4,-1.5 -4,-0.4 -1,-0.2 0.681 118.9 40.9-107.1 -51.4 22.4 10.8 26.9 83 91 A Y H X S+ 0 0 2 -4,-2.1 4,-2.1 -5,-0.4 -2,-0.2 0.828 110.7 55.4 -69.1 -36.5 25.4 8.9 28.4 84 92 A L H X S+ 0 0 1 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.941 111.0 42.8 -67.1 -48.9 26.0 6.4 25.5 85 93 A P H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 6,-0.2 0.868 111.4 59.4 -58.8 -36.1 26.3 9.2 22.7 86 94 A A H X>S+ 0 0 0 -4,-1.5 5,-1.9 1,-0.2 4,-0.7 0.930 109.7 40.6 -58.0 -47.4 28.5 11.1 25.2 87 95 A R H <5S+ 0 0 52 -4,-2.1 3,-0.3 3,-0.2 -1,-0.2 0.900 112.4 54.7 -69.2 -42.0 31.0 8.2 25.4 88 96 A E H <5S+ 0 0 58 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.908 116.7 37.5 -58.2 -42.9 30.9 7.4 21.7 89 97 A L H <5S- 0 0 15 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.601 103.7-134.9 -80.8 -11.9 31.8 11.1 20.8 90 98 A N T <5 + 0 0 108 -4,-0.7 2,-0.3 -3,-0.3 -3,-0.2 0.876 61.9 129.3 56.2 39.1 34.2 11.2 23.9 91 99 A M < - 0 0 35 -5,-1.9 -1,-0.2 -6,-0.2 -2,-0.1 -0.877 62.9-111.3-122.8 154.0 32.7 14.6 24.7 92 100 A R - 0 0 116 -2,-0.3 2,-0.1 -3,-0.1 3,-0.1 -0.728 28.2-134.4 -84.2 129.1 31.2 16.1 27.9 93 101 A P - 0 0 3 0, 0.0 2,-0.6 0, 0.0 62,-0.1 -0.394 45.6 -80.0 -67.2 157.4 27.4 16.8 28.0 94 102 A N > - 0 0 67 1,-0.2 4,-2.8 60,-0.2 5,-0.1 -0.505 48.0-161.8 -59.1 111.0 26.4 20.2 29.4 95 103 A M H > S+ 0 0 30 -2,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.798 84.1 54.6 -76.4 -30.0 26.7 19.3 33.0 96 104 A G H > S+ 0 0 54 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.912 114.5 43.1 -65.3 -44.2 24.5 22.3 34.4 97 105 A L H > S+ 0 0 42 2,-0.2 4,-3.2 1,-0.2 -2,-0.2 0.943 110.7 53.6 -67.5 -48.8 21.7 21.1 32.0 98 106 A M H X S+ 0 0 2 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.931 113.3 44.4 -53.9 -48.4 22.2 17.4 32.8 99 107 A W H X S+ 0 0 68 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.861 110.8 53.6 -61.8 -36.2 21.8 18.2 36.5 100 108 A L H X S+ 0 0 85 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.919 107.1 53.2 -65.6 -41.7 18.9 20.5 35.9 101 109 A S H X S+ 0 0 1 -4,-3.2 4,-2.2 1,-0.2 -1,-0.2 0.882 109.1 48.9 -59.3 -39.1 17.2 17.6 34.0 102 110 A W H X S+ 0 0 20 -4,-1.7 4,-2.9 -5,-0.2 -2,-0.2 0.942 112.0 46.7 -66.4 -47.9 17.7 15.3 37.0 103 111 A W H X S+ 0 0 135 -4,-2.3 4,-3.7 2,-0.2 5,-0.3 0.895 109.7 54.1 -62.6 -41.7 16.3 17.7 39.6 104 112 A M H X S+ 0 0 45 -4,-2.4 4,-3.0 -5,-0.2 5,-0.2 0.953 112.3 44.4 -55.6 -51.8 13.3 18.4 37.4 105 113 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.937 116.9 45.6 -54.9 -51.9 12.6 14.7 37.2 106 114 A F H X S+ 0 0 69 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.898 117.2 43.3 -60.9 -46.6 13.2 14.2 41.0 107 115 A I H X S+ 0 0 86 -4,-3.7 4,-2.5 2,-0.2 5,-0.2 0.923 114.6 50.1 -65.0 -49.0 11.1 17.3 41.9 108 116 A G H X S+ 0 0 1 -4,-3.0 4,-1.8 -5,-0.3 -2,-0.2 0.872 112.9 48.2 -57.1 -40.5 8.3 16.4 39.4 109 117 A L H X S+ 0 0 24 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.918 111.1 48.6 -67.6 -47.2 8.2 12.9 40.8 110 118 A V H X S+ 0 0 61 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.953 112.5 47.9 -59.2 -51.0 8.1 13.9 44.5 111 119 A V H < S+ 0 0 47 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.872 115.7 44.4 -58.9 -41.2 5.3 16.4 43.8 112 120 A F H X S+ 0 0 6 -4,-1.8 4,-1.4 -5,-0.2 -1,-0.2 0.831 108.8 59.6 -69.6 -33.1 3.3 13.9 41.8 113 121 A A H X S+ 0 0 23 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.851 94.2 65.1 -66.5 -34.7 4.0 11.2 44.5 114 122 A L H X S+ 0 0 120 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.936 107.7 35.9 -59.4 -54.8 2.4 13.2 47.2 115 123 A P H 4>S+ 0 0 6 0, 0.0 5,-3.4 0, 0.0 6,-0.6 0.825 116.8 56.6 -64.7 -30.8 -1.3 13.1 45.9 116 124 A L H ><5S+ 0 0 7 -4,-1.4 3,-0.9 1,-0.2 5,-0.2 0.918 110.4 42.8 -65.8 -43.4 -0.7 9.5 44.6 117 125 A L H 3<5S+ 0 0 77 -4,-2.9 -1,-0.2 1,-0.2 -3,-0.2 0.748 112.9 53.5 -75.8 -24.3 0.3 8.3 48.0 118 126 A A T 3<5S- 0 0 59 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.225 115.6-112.5 -97.6 13.0 -2.5 10.2 49.7 119 127 A N T < 5S+ 0 0 20 -3,-0.9 3,-0.3 1,-0.1 -3,-0.2 0.824 83.1 122.4 65.0 35.4 -5.2 8.7 47.4 120 128 A E S S- 0 0 2 -2,-2.2 5,-0.6 1,-0.1 3,-0.2 0.482 74.3-117.7-119.3 -12.7 -6.9 8.0 37.9 124 132 A L T > 5 - 0 0 3 -3,-0.5 3,-1.8 -66,-0.2 -62,-0.1 0.124 40.4 -69.2 82.3 166.3 -4.4 5.5 36.4 125 133 A Y T 3 5S+ 0 0 37 1,-0.3 -1,-0.2 -64,-0.2 -63,-0.0 0.531 135.9 53.9 -69.1 -3.6 -1.4 6.3 34.3 126 134 A T T 3 5S- 0 0 2 -3,-0.2 -1,-0.3 2,-0.1 -2,-0.2 0.537 86.7-161.3 -99.7 -14.9 -3.7 7.4 31.5 127 135 A F T < 5 - 0 0 13 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.839 13.8-166.7 31.9 63.3 -5.6 9.9 33.7 128 136 A Y > < - 0 0 17 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-0.625 45.4 23.9-117.3 173.7 27.7 -25.3 14.1 323 331 A G T 4 S- 0 0 43 -2,-0.2 404,-0.2 1,-0.2 403,-0.1 -0.408 106.0 -65.0 68.5-148.5 24.4 -26.4 12.4 324 332 A L T 4 S+ 0 0 91 402,-0.1 -1,-0.2 -2,-0.1 406,-0.1 0.354 135.0 36.3-117.0 1.0 21.4 -24.2 12.9 325 333 A F T >> S+ 0 0 159 -3,-0.5 3,-1.2 2,-0.1 4,-1.1 0.531 99.5 76.3-117.8 -20.1 20.9 -24.6 16.6 326 334 A G H 3X S+ 0 0 19 -4,-1.3 4,-1.4 1,-0.3 -3,-0.2 0.743 85.5 62.2 -74.0 -24.1 24.6 -24.8 17.7 327 335 A W H 34 S+ 0 0 12 -6,-0.3 -1,-0.3 -5,-0.2 4,-0.3 0.725 99.7 58.2 -70.7 -22.9 25.2 -21.1 17.4 328 336 A I H X4 S+ 0 0 65 -3,-1.2 3,-1.1 2,-0.2 -2,-0.2 0.919 108.6 41.7 -72.5 -45.9 22.6 -20.6 20.1 329 337 A R H 3< S+ 0 0 98 -4,-1.1 4,-0.3 1,-0.3 -2,-0.2 0.778 105.4 66.9 -74.5 -21.2 24.4 -22.7 22.7 330 338 A A T 3< S+ 0 0 16 -4,-1.4 -1,-0.3 -8,-0.1 -2,-0.2 0.625 83.0 99.6 -71.4 -13.6 27.7 -21.2 21.7 331 339 A L S < S- 0 0 7 -3,-1.1 2,-2.6 -4,-0.3 -83,-0.1 -0.340 94.5 -91.9 -78.3 158.5 26.6 -17.8 23.0 332 340 A P > + 0 0 9 0, 0.0 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4,-1.6 2,-0.2 -2,-0.2 0.932 110.3 45.7 -66.9 -44.3 18.2 -11.9 24.5 343 351 A L H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 5,-0.2 0.925 112.4 52.1 -60.3 -43.5 15.4 -13.4 26.7 344 352 A G H X S+ 0 0 0 -4,-2.1 4,-0.8 -5,-0.3 40,-0.4 0.872 107.7 52.0 -61.1 -38.5 13.5 -10.1 26.3 345 353 A L H < S+ 0 0 30 -4,-2.3 -1,-0.2 2,-0.2 4,-0.2 0.810 106.4 55.8 -64.4 -32.7 13.9 -10.3 22.5 346 354 A L H >< S+ 0 0 84 -4,-1.6 3,-1.7 1,-0.2 -2,-0.2 0.960 108.2 44.7 -64.8 -51.1 12.5 -13.8 22.7 347 355 A G H 3X S+ 0 0 1 -4,-2.1 4,-1.6 1,-0.3 -1,-0.2 0.665 99.9 73.7 -67.8 -16.9 9.3 -12.7 24.4 348 356 A F H 3X S+ 0 0 27 -4,-0.8 4,-2.5 -5,-0.2 -1,-0.3 0.585 82.9 70.8 -71.0 -12.9 9.1 -9.8 21.9 349 357 A I H <> S+ 0 0 24 -3,-1.7 4,-1.6 -4,-0.2 -1,-0.2 0.985 108.3 30.4 -71.6 -58.6 8.1 -12.3 19.2 350 358 A P H > S+ 0 0 33 0, 0.0 4,-2.3 0, 0.0 -2,-0.2 0.821 119.2 60.5 -64.8 -29.1 4.6 -13.0 20.7 351 359 A G H X S+ 0 0 0 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.961 108.9 39.0 -63.1 -53.4 4.6 -9.4 22.0 352 360 A G H X S+ 0 0 21 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