==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 17-MAY-11 3S38 . COMPND 2 MOLECULE: CYTOCHROME C OXIDASE SUBUNIT 1; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR V.M.LUNA,J.A.FEE,A.A.DENIZ,C.D.STOUT . 753 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26795.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 608 80.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 4.5 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 . 36 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 103 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 380 50.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 2.5 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 2 2 1 2 2 1 0 0 0 2 1 1 0 0 1 1 1 1 0 1 1 0 1 1 0 2 3 RESIDUES PER ALPHA HELIX . 1 1 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 . 1 2 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 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 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 75 0, 0.0 3,-0.4 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 130.6 -59.8 42.1 -26.5 2 10 A R >> + 0 0 223 1,-0.2 3,-1.3 2,-0.1 4,-1.0 0.812 360.0 74.0 -53.3 -29.0 -59.6 46.1 -26.2 3 11 A V H >> S+ 0 0 8 1,-0.2 4,-2.6 2,-0.2 3,-0.8 0.913 93.9 46.0 -43.7 -60.7 -57.1 45.3 -23.1 4 12 A Y H 34 S+ 0 0 43 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.297 107.7 57.6 -82.3 8.3 -54.1 44.2 -25.2 5 13 A E H <4 S+ 0 0 142 -3,-1.3 -1,-0.2 2,-0.2 -2,-0.2 0.624 120.5 25.8-110.2 -22.1 -54.3 47.1 -27.7 6 14 A A H << S+ 0 0 50 -4,-1.0 -2,-0.2 -3,-0.8 -3,-0.1 0.536 143.6 25.5-106.2 -22.4 -54.0 49.9 -25.1 7 15 A Y >< + 0 0 77 -4,-2.6 3,-1.8 -5,-0.3 4,-0.2 -0.513 67.4 151.6-136.7 68.9 -52.1 47.6 -22.7 8 16 A P T >> + 0 0 18 0, 0.0 4,-2.1 0, 0.0 3,-0.8 0.622 69.1 79.7 -67.6 -16.7 -50.5 44.9 -24.9 9 17 A E H 3> S+ 0 0 2 1,-0.3 4,-0.7 2,-0.2 -5,-0.1 0.643 86.2 58.9 -59.9 -18.0 -48.0 44.9 -22.1 10 18 A K H <> S+ 0 0 6 -3,-1.8 4,-0.9 -7,-0.2 -1,-0.3 0.759 104.4 49.3 -80.4 -26.9 -50.7 42.8 -20.6 11 19 A K H <> S+ 0 0 86 -3,-0.8 4,-1.8 -4,-0.2 3,-0.2 0.933 113.0 43.3 -75.2 -50.0 -50.4 40.3 -23.5 12 20 A A H X S+ 0 0 0 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.770 112.6 55.8 -66.0 -26.6 -46.5 39.9 -23.4 13 21 A T H X S+ 0 0 3 -4,-0.7 4,-0.9 -5,-0.3 -1,-0.2 0.826 106.4 51.2 -72.5 -32.2 -46.8 39.7 -19.5 14 22 A L H >X S+ 0 0 29 -4,-0.9 4,-2.1 -3,-0.2 3,-0.5 0.948 108.4 47.9 -71.3 -50.2 -49.2 36.8 -19.8 15 23 A Y H 3X S+ 0 0 101 -4,-1.8 4,-2.3 1,-0.2 5,-0.3 0.911 106.9 57.8 -54.9 -49.3 -47.1 34.6 -22.2 16 24 A F H 3X S+ 0 0 5 -4,-1.4 4,-1.1 1,-0.2 -1,-0.2 0.831 110.7 45.3 -49.3 -37.5 -44.0 35.1 -20.1 17 25 A L H < S+ 0 0 62 -4,-2.6 3,-1.3 1,-0.2 4,-0.4 0.949 116.4 43.7 -50.9 -56.7 -42.8 19.8 -15.9 27 35 A G H >< S+ 0 0 0 -4,-3.2 3,-0.9 1,-0.3 4,-0.3 0.770 106.5 61.5 -63.4 -29.2 -39.8 20.2 -13.6 28 36 A S H >< S+ 0 0 9 -4,-2.0 3,-0.9 -5,-0.4 -1,-0.3 0.673 86.7 74.9 -73.4 -18.7 -41.9 19.7 -10.4 29 37 A L T S+ 0 0 2 -3,-0.9 4,-1.4 -4,-0.4 -1,-0.2 0.583 92.8 81.5 -82.8 -12.9 -39.3 15.0 -10.6 31 39 A G H X> S+ 0 0 21 -3,-0.9 4,-2.0 -4,-0.3 3,-0.7 0.962 89.9 44.9 -55.1 -62.7 -39.6 16.6 -7.2 32 40 A P H 3> S+ 0 0 7 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.899 111.8 53.1 -51.0 -48.6 -41.7 13.9 -5.4 33 41 A F H 3X S+ 0 0 22 -4,-0.6 4,-2.4 1,-0.3 10,-0.4 0.786 111.0 46.9 -61.0 -32.0 -39.5 11.1 -6.8 34 42 A Q H <>S+ 0 0 30 -4,-2.4 3,-2.8 -5,-0.2 5,-1.9 0.922 106.6 57.8 -71.0 -47.3 -38.7 9.6 -2.2 37 45 A N H ><5S+ 0 0 0 -4,-2.4 3,-1.1 1,-0.3 -2,-0.2 0.879 107.2 50.2 -49.4 -39.5 -35.1 8.9 -3.2 38 46 A Y T 3<5S+ 0 0 20 -4,-1.7 -1,-0.3 1,-0.3 424,-0.3 0.288 104.0 57.5 -88.5 10.7 -34.0 10.7 -0.1 39 47 A G T < 5S- 0 0 7 -3,-2.8 -1,-0.3 2,-0.3 -2,-0.2 -0.003 123.7-105.5-114.6 22.7 -36.4 8.7 2.0 40 48 A N T < 5S+ 0 0 52 -3,-1.1 2,-0.5 1,-0.2 -3,-0.2 0.398 83.6 130.4 65.8 2.7 -34.6 5.5 0.7 41 49 A V < - 0 0 61 -5,-1.9 2,-0.9 418,-0.2 -2,-0.3 -0.731 49.5-151.3 -88.1 125.8 -37.6 4.8 -1.5 42 50 A D + 0 0 61 -2,-0.5 4,-0.2 404,-0.2 -8,-0.1 -0.817 31.7 154.6-100.9 97.8 -36.8 4.1 -5.2 43 51 A A > + 0 0 15 -2,-0.9 4,-1.5 -10,-0.4 3,-0.4 0.378 44.4 97.0-103.6 3.6 -39.8 5.1 -7.2 44 52 A Y H > S+ 0 0 14 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.825 74.0 59.8 -68.5 -39.6 -38.0 5.8 -10.5 45 53 A P H > S+ 0 0 86 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.899 109.8 48.5 -51.9 -37.9 -38.6 2.5 -12.3 46 54 A L H > S+ 0 0 68 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.884 112.1 47.6 -64.8 -42.3 -42.3 3.6 -11.8 47 55 A L H X S+ 0 0 3 -4,-1.5 4,-3.9 1,-0.2 -1,-0.2 0.839 107.1 56.8 -66.5 -35.6 -41.4 7.0 -13.2 48 56 A K H < S+ 0 0 103 -4,-3.4 -1,-0.2 2,-0.2 -2,-0.2 0.765 107.8 47.5 -69.2 -29.7 -39.5 5.4 -16.1 49 57 A R H < S+ 0 0 198 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.889 115.9 46.2 -72.1 -44.3 -42.8 3.5 -17.0 50 58 A L H < S+ 0 0 107 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.2 0.978 127.1 25.5 -59.7 -61.5 -44.7 6.8 -16.7 51 59 A L S >< S- 0 0 49 -4,-3.9 3,-1.5 1,-0.1 -1,-0.3 -0.858 72.3-173.2-111.9 97.2 -42.2 8.9 -18.7 52 60 A P T 3 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.780 79.0 62.0 -60.9 -34.7 -40.4 6.6 -21.1 53 61 A F T 3 S+ 0 0 77 2,-0.0 2,-0.4 0, 0.0 -5,-0.1 0.614 78.8 103.9 -70.2 -16.0 -37.8 9.2 -22.4 54 62 A V < + 0 0 3 -3,-1.5 3,-0.1 -7,-0.2 63,-0.1 -0.586 44.6 176.0 -72.5 123.3 -36.4 9.6 -18.9 55 63 A Q + 0 0 110 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.790 53.7 7.5-102.7 -36.0 -33.0 7.8 -18.7 56 64 A S >> - 0 0 17 1,-0.1 4,-1.9 -8,-0.0 3,-0.9 -0.982 64.4-111.1-151.2 160.1 -31.5 8.5 -15.2 57 65 A Y H 3> S+ 0 0 7 -2,-0.3 4,-1.6 1,-0.3 5,-0.1 0.843 120.4 53.1 -54.1 -38.8 -32.0 10.0 -11.8 58 66 A Y H 3> S+ 0 0 2 2,-0.2 4,-1.4 1,-0.2 66,-0.3 0.683 104.4 53.7 -78.4 -19.8 -29.5 12.6 -12.7 59 67 A Q H <> S+ 0 0 1 -3,-0.9 4,-2.3 2,-0.2 -1,-0.2 0.833 110.1 49.4 -76.4 -34.2 -31.4 13.5 -15.9 60 68 A G H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.812 111.7 47.4 -71.1 -32.9 -34.5 14.0 -13.8 61 69 A L H X S+ 0 0 27 -4,-1.6 4,-3.5 2,-0.2 5,-0.2 0.851 110.3 52.8 -74.7 -38.0 -32.7 16.2 -11.3 62 70 A T H X S+ 0 0 0 -4,-1.4 4,-3.2 2,-0.2 5,-0.3 0.955 113.3 42.9 -61.1 -51.8 -31.2 18.2 -14.2 63 71 A L H X S+ 0 0 4 -4,-2.3 4,-2.0 1,-0.2 5,-0.4 0.888 115.9 50.4 -61.6 -38.0 -34.6 18.8 -15.7 64 72 A H H X S+ 0 0 27 -4,-1.7 4,-1.4 2,-0.2 5,-0.4 0.930 116.0 41.4 -64.1 -47.5 -35.9 19.5 -12.1 65 73 A G H X S+ 0 0 13 -4,-3.5 4,-2.7 3,-0.2 5,-0.5 0.965 119.2 42.6 -63.4 -54.9 -33.1 22.0 -11.4 66 74 A V H X>S+ 0 0 14 -4,-3.2 4,-2.6 3,-0.2 5,-1.9 0.936 116.3 44.1 -61.8 -53.2 -33.1 23.7 -14.8 67 75 A L H <>S+ 0 0 18 -4,-2.0 5,-2.7 -5,-0.3 6,-0.2 0.932 124.4 33.5 -65.6 -47.0 -36.8 24.1 -15.4 68 76 A N H <>S+ 0 0 29 -4,-1.4 5,-0.9 -5,-0.4 -2,-0.2 0.956 128.9 34.0 -68.5 -51.4 -37.7 25.2 -11.9 69 77 A A H <5S+ 0 0 16 -4,-2.7 -3,-0.2 -5,-0.4 -2,-0.2 0.750 130.6 22.9 -84.8 -27.5 -34.6 27.2 -11.0 70 78 A I T X5S+ 0 0 44 -4,-2.6 4,-2.0 -5,-0.5 5,-0.2 0.862 128.4 30.3-103.1 -56.5 -33.6 28.7 -14.4 71 79 A V H >X S+ 0 0 2 -4,-1.3 4,-2.6 -5,-0.2 3,-1.6 0.982 118.3 37.0 -78.0 -63.5 -42.6 39.3 -15.9 80 88 A I H 3X S+ 0 0 2 -4,-2.7 4,-1.7 1,-0.3 -2,-0.2 0.902 117.6 52.2 -56.5 -44.9 -42.9 40.8 -12.4 81 89 A M H 3< S+ 0 0 0 -4,-3.0 -1,-0.3 -5,-0.3 -2,-0.1 0.033 118.3 34.2 -91.3 29.4 -40.0 43.2 -12.9 82 90 A V H <> S+ 0 0 3 -3,-1.6 4,-2.0 -73,-0.1 -2,-0.2 0.384 118.8 45.8-133.6 -45.4 -41.2 44.6 -16.2 83 91 A Y H X S+ 0 0 1 -4,-2.6 4,-2.6 -5,-0.2 5,-0.2 0.917 110.3 53.2 -67.4 -44.5 -45.0 44.7 -15.9 84 92 A L H X S+ 0 0 0 -4,-1.7 4,-2.0 -5,-0.4 -1,-0.2 0.866 112.3 43.6 -63.7 -41.1 -45.0 46.2 -12.3 85 93 A P H > S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.953 112.7 54.0 -62.6 -48.3 -42.8 49.2 -13.3 86 94 A A H X>S+ 0 0 0 -4,-2.0 5,-2.3 1,-0.2 4,-0.6 0.879 112.8 43.3 -51.0 -44.6 -44.8 49.6 -16.5 87 95 A R H <5S+ 0 0 42 -4,-2.6 -1,-0.2 3,-0.2 -3,-0.2 0.838 110.5 54.0 -75.1 -33.9 -48.0 49.8 -14.5 88 96 A E H <5S+ 0 0 62 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.949 120.7 33.5 -61.4 -45.1 -46.6 52.0 -11.7 89 97 A L H <5S- 0 0 20 -4,-2.8 -1,-0.2 2,-0.1 -2,-0.2 0.542 102.4-133.3 -83.6 -9.2 -45.6 54.5 -14.4 90 98 A N T <5 + 0 0 93 -4,-0.6 2,-0.4 -5,-0.3 -3,-0.2 0.937 60.9 138.3 44.5 51.5 -48.5 53.8 -16.7 91 99 A M < - 0 0 39 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.1 -0.987 57.5-124.3-125.2 135.1 -46.0 53.6 -19.5 92 100 A R - 0 0 110 -2,-0.4 3,-0.1 -3,-0.1 -85,-0.0 -0.662 29.6-128.8 -74.8 126.4 -46.0 51.0 -22.3 93 101 A P - 0 0 3 0, 0.0 2,-1.4 0, 0.0 3,-0.1 -0.250 45.8 -74.9 -62.8 161.4 -42.6 49.2 -22.4 94 102 A N > - 0 0 61 60,-0.2 4,-2.7 1,-0.2 3,-0.2 -0.467 51.6-165.3 -61.8 93.3 -40.9 49.0 -25.8 95 103 A M H > S+ 0 0 31 -2,-1.4 4,-2.1 1,-0.2 5,-0.2 0.767 82.9 57.4 -59.0 -31.2 -43.2 46.4 -27.3 96 104 A G H > S+ 0 0 57 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.979 115.4 35.7 -58.4 -57.4 -40.8 45.6 -30.1 97 105 A L H > S+ 0 0 43 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.759 112.4 61.9 -70.5 -26.5 -38.0 44.8 -27.7 98 106 A M H X S+ 0 0 4 -4,-2.7 4,-1.1 1,-0.2 -1,-0.2 0.946 108.4 41.5 -65.5 -44.7 -40.4 43.2 -25.2 99 107 A W H X S+ 0 0 67 -4,-2.1 4,-2.8 1,-0.2 3,-0.3 0.892 109.5 59.4 -69.0 -38.8 -41.5 40.6 -27.8 100 108 A L H X S+ 0 0 90 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.912 104.3 50.2 -54.5 -47.2 -37.9 40.0 -29.0 101 109 A S H X S+ 0 0 1 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.801 111.3 49.6 -65.0 -30.3 -36.8 39.0 -25.5 102 110 A W H X S+ 0 0 21 -4,-1.1 4,-3.3 -3,-0.3 5,-0.2 0.928 110.0 48.4 -71.7 -47.8 -39.7 36.5 -25.2 103 111 A W H X S+ 0 0 138 -4,-2.8 4,-3.1 1,-0.3 5,-0.3 0.920 112.1 50.6 -58.4 -42.9 -39.0 34.9 -28.6 104 112 A M H X S+ 0 0 44 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.3 0.904 112.5 48.7 -52.9 -43.5 -35.4 34.7 -27.5 105 113 A A H X S+ 0 0 0 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.906 114.9 41.7 -67.5 -45.9 -36.8 33.1 -24.3 106 114 A F H X S+ 0 0 74 -4,-3.3 4,-2.4 2,-0.2 -2,-0.2 0.940 119.9 43.3 -68.4 -47.3 -39.1 30.6 -26.0 107 115 A I H X S+ 0 0 84 -4,-3.1 4,-2.7 -5,-0.2 5,-0.2 0.858 113.3 52.6 -68.7 -35.2 -36.5 29.7 -28.7 108 116 A G H X S+ 0 0 1 -4,-2.6 4,-1.4 -5,-0.3 36,-0.2 0.807 111.5 47.2 -65.6 -32.2 -33.7 29.5 -26.1 109 117 A L H X S+ 0 0 29 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.888 113.4 47.5 -73.7 -42.7 -35.9 27.1 -24.1 110 118 A V H X S+ 0 0 65 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.942 112.6 48.3 -63.5 -51.4 -36.7 25.0 -27.1 111 119 A V H < S+ 0 0 43 -4,-2.7 3,-0.3 1,-0.2 -1,-0.2 0.926 117.8 41.3 -53.5 -50.1 -33.0 24.8 -28.3 112 120 A A H X S+ 0 0 14 -4,-1.4 4,-1.0 1,-0.2 -1,-0.2 0.849 108.4 60.1 -69.5 -36.4 -31.8 23.8 -24.8 113 121 A A H X S+ 0 0 25 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.815 91.0 70.4 -65.3 -31.9 -34.7 21.4 -24.0 114 122 A L H X S+ 0 0 121 -4,-1.4 4,-1.2 -3,-0.3 -1,-0.2 0.917 103.8 37.0 -54.8 -55.8 -33.9 19.1 -26.9 115 123 A P H 4>S+ 0 0 10 0, 0.0 5,-3.7 0, 0.0 6,-0.7 0.732 115.0 56.0 -73.0 -21.4 -30.6 17.6 -25.6 116 124 A L H ><5S+ 0 0 5 -4,-1.0 3,-0.7 3,-0.2 -2,-0.2 0.914 111.4 42.9 -70.9 -42.8 -31.9 17.6 -22.0 117 125 A L H 3<5S+ 0 0 72 -4,-2.5 -1,-0.2 1,-0.2 -3,-0.1 0.693 117.3 47.2 -75.5 -21.3 -34.9 15.5 -22.9 118 126 A A T 3<5S- 0 0 63 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.347 115.2-117.1 -98.6 3.8 -32.8 13.3 -25.2 119 127 A N T < 5S+ 0 0 13 -3,-0.7 -3,-0.2 -4,-0.2 3,-0.2 0.869 78.6 123.6 62.4 43.9 -30.1 12.9 -22.4 120 128 A E S S- 0 0 2 -2,-2.1 5,-0.5 1,-0.3 4,-0.5 0.139 72.2-120.9-130.4 14.8 -24.9 17.8 -16.4 124 132 A L T > 5 - 0 0 5 -66,-0.3 3,-0.8 -3,-0.2 -1,-0.3 0.033 44.7 -64.5 61.0-177.6 -27.3 19.3 -13.9 125 133 A Y T 3 5S+ 0 0 58 1,-0.2 -1,-0.2 -64,-0.1 -63,-0.0 0.613 134.0 56.8 -81.5 -11.1 -28.1 23.0 -13.7 126 134 A T T 3 5S- 0 0 3 -3,-0.3 -1,-0.2 2,-0.1 -2,-0.2 0.479 85.1-157.7 -94.4 -4.4 -24.6 24.0 -12.8 127 135 A F T < 5 - 0 0 10 -3,-0.8 -3,-0.1 -4,-0.5 6,-0.1 0.765 14.7-163.8 21.7 58.8 -23.1 22.3 -15.9 128 136 A Y > < - 0 0 12 -5,-0.5 3,-1.2 538,-0.0 -1,-0.2 -0.522 20.9-103.8 -63.8 117.8 -19.7 22.1 -14.2 129 137 A P T 3 S+ 0 0 0 0, 0.0 537,-0.1 0, 0.0 421,-0.1 -0.447 102.0 48.6 -66.7 156.6 -16.9 21.3 -16.7 130 138 A P T 3 S+ 0 0 0 0, 0.0 421,-2.8 0, 0.0 2,-0.5 -0.990 93.7 95.2 -78.2 -2.1 -15.2 18.9 -17.6 131 139 A L B < S-a 551 0A 3 -3,-1.2 2,-0.8 419,-0.2 421,-0.2 -0.387 73.9-148.9 -57.1 107.4 -18.7 17.3 -17.7 132 140 A K - 0 0 52 419,-5.0 -10,-0.1 -2,-0.5 -1,-0.1 -0.743 19.5-178.4 -99.0 106.4 -19.4 17.9 -21.4 133 141 A G - 0 0 8 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4,-3.6 -4,-0.3 -2,-0.2 0.889 111.2 55.5 -79.0 -43.3 -40.9 38.5 -4.6 236 244 A Y H X S+ 0 0 3 -4,-1.9 4,-3.1 2,-0.2 5,-0.2 0.891 106.5 51.4 -54.7 -44.8 -39.4 41.2 -2.4 237 245 A A H X S+ 0 0 0 -4,-3.5 4,-2.8 2,-0.2 5,-0.4 0.973 114.7 42.7 -51.2 -56.4 -41.0 43.8 -4.7 238 246 A I H X>S+ 0 0 6 -4,-1.2 5,-2.0 -5,-0.2 4,-1.4 0.848 115.2 49.9 -62.5 -37.1 -44.3 42.0 -4.3 239 247 A I H <5S+ 0 0 1 -4,-3.6 -1,-0.2 3,-0.2 -2,-0.2 0.896 116.7 41.7 -68.1 -40.5 -43.8 41.5 -0.6 240 248 A Y H <5S+ 0 0 0 -4,-3.1 -2,-0.2 -5,-0.2 -3,-0.2 0.937 128.5 21.4 -71.1 -50.0 -43.0 45.2 -0.0 241 249 A T H <5S+ 0 0 5 -4,-2.8 260,-3.2 -5,-0.2 -3,-0.2 0.528 131.5 30.6-108.7 -10.9 -45.5 47.0 -2.2 242 250 A I T X5S+ 0 0 2 -4,-1.4 4,-2.3 -5,-0.4 3,-0.3 0.703 109.0 61.7-116.0 -37.7 -48.4 44.6 -2.8 243 251 A L H >>S+ 0 0 2 0, 0.0 5,-3.3 0, 0.0 4,-0.7 0.871 111.2 47.0 -54.6 -33.5 -49.2 45.2 2.9 245 253 A K H >45S+ 0 0 113 -3,-0.3 3,-1.3 254,-0.2 -2,-0.2 0.956 109.8 51.2 -65.1 -51.1 -52.3 46.0 0.8 246 254 A Q H 3<5S+ 0 0 25 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