==== 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 ION TRANSPORT 28-AUG-01 1JV7 . COMPND 2 MOLECULE: BACTERIORHODOPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HALOBACTERIUM SALINARUM; . AUTHOR S.ROUHANI,J.-P.CARTAILLER,M.T.FACCIOTTI,P.WALIAN, . 210 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10088.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 85.2 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 . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 149 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 3.3 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 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 1 1 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 9 A E > 0 0 88 0, 0.0 4,-1.7 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 -34.1 44.9 44.3 -14.2 2 10 A W H > + 0 0 169 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.838 360.0 59.0 -59.5 -32.1 41.9 43.7 -16.5 3 11 A I H > S+ 0 0 102 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.875 102.2 51.0 -64.3 -41.0 44.1 41.0 -18.1 4 12 A W H > S+ 0 0 67 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.906 113.0 45.1 -64.8 -43.6 44.5 39.1 -14.8 5 13 A L H X S+ 0 0 12 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.874 117.4 45.0 -67.3 -38.6 40.8 39.0 -14.2 6 14 A A H X S+ 0 0 30 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.932 114.7 46.9 -70.4 -48.4 40.1 38.0 -17.8 7 15 A L H X S+ 0 0 89 -4,-3.3 4,-2.4 1,-0.2 -2,-0.2 0.909 114.5 48.5 -60.6 -42.3 42.8 35.4 -17.9 8 16 A G H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.3 5,-0.3 0.914 109.5 51.7 -64.6 -43.1 41.6 34.1 -14.5 9 17 A T H X S+ 0 0 12 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.924 112.2 46.8 -59.5 -44.4 38.0 34.0 -15.7 10 18 A A H X S+ 0 0 50 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.914 111.8 49.0 -66.0 -43.4 39.0 32.0 -18.8 11 19 A L H X S+ 0 0 69 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.888 113.8 46.1 -65.2 -39.2 41.2 29.5 -17.0 12 20 A M H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.907 113.7 50.6 -68.5 -41.1 38.6 28.8 -14.3 13 21 A G H X S+ 0 0 20 -4,-2.2 4,-2.6 -5,-0.3 -2,-0.2 0.929 112.2 44.6 -61.7 -48.5 35.9 28.5 -17.0 14 22 A L H X S+ 0 0 111 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.840 113.7 51.1 -65.6 -36.4 37.9 26.0 -19.1 15 23 A G H X S+ 0 0 7 -4,-1.8 4,-3.0 -5,-0.2 5,-0.3 0.947 110.5 47.8 -66.0 -48.7 38.9 24.0 -16.1 16 24 A T H X S+ 0 0 24 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.942 113.3 50.5 -54.9 -48.0 35.2 23.8 -15.0 17 25 A L H X S+ 0 0 97 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.920 111.5 45.9 -57.2 -49.6 34.3 22.8 -18.5 18 26 A Y H X S+ 0 0 96 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.957 114.6 46.6 -60.4 -52.1 37.0 20.1 -18.7 19 27 A F H X S+ 0 0 1 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.908 113.7 51.1 -56.4 -42.7 36.2 18.6 -15.3 20 28 A L H X S+ 0 0 75 -4,-2.9 4,-0.6 -5,-0.3 -2,-0.2 0.949 114.8 40.0 -62.4 -50.6 32.5 18.7 -16.2 21 29 A V H >< S+ 0 0 85 -4,-2.9 3,-0.8 1,-0.2 -2,-0.2 0.874 113.0 56.4 -68.6 -35.5 32.8 16.9 -19.6 22 30 A K H 3< S+ 0 0 69 -4,-3.0 4,-0.2 -5,-0.3 -1,-0.2 0.878 103.7 53.3 -64.2 -38.2 35.4 14.4 -18.2 23 31 A G H >< S+ 0 0 1 -4,-1.9 3,-0.6 -5,-0.2 -1,-0.2 0.624 84.3 104.0 -74.8 -12.7 33.1 13.2 -15.4 24 32 A M T << S+ 0 0 121 -3,-0.8 3,-0.1 -4,-0.6 -3,-0.0 -0.479 87.4 17.6 -73.1 139.0 30.2 12.4 -17.7 25 33 A G T 3 S+ 0 0 79 1,-0.3 2,-0.4 -2,-0.2 -1,-0.2 -0.047 90.3 126.8 91.2 -33.9 29.7 8.7 -18.4 26 34 A V < - 0 0 30 -3,-0.6 -1,-0.3 -4,-0.2 -3,-0.0 -0.444 36.4-179.4 -58.4 112.7 31.9 7.9 -15.4 27 35 A S + 0 0 109 -2,-0.4 -1,-0.2 -3,-0.1 -3,-0.0 0.596 36.5 119.1 -96.5 -11.4 29.6 5.6 -13.5 28 36 A D > - 0 0 39 1,-0.1 4,-2.6 2,-0.1 5,-0.2 -0.368 56.8-147.0 -59.5 122.8 31.7 4.8 -10.4 29 37 A P H > S+ 0 0 96 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 0.929 98.0 46.7 -54.0 -52.5 29.8 6.0 -7.3 30 38 A D H >> S+ 0 0 79 1,-0.2 4,-1.0 2,-0.2 3,-0.6 0.928 114.0 48.0 -57.0 -50.2 32.9 6.9 -5.5 31 39 A A H >> S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 3,-0.5 0.878 102.7 61.9 -61.2 -42.0 34.4 8.7 -8.4 32 40 A K H 3X S+ 0 0 79 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.816 99.6 56.5 -55.5 -33.9 31.3 10.7 -9.2 33 41 A K H S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.739 113.4 60.5 -68.8 -19.6 36.2 26.2 -10.3 43 51 A A H X S+ 0 0 29 -4,-1.2 4,-1.5 2,-0.2 -2,-0.2 0.910 107.5 44.4 -70.8 -41.5 32.6 26.8 -11.2 44 52 A I H X S+ 0 0 36 -4,-2.6 4,-1.5 -3,-0.2 -1,-0.2 0.911 114.7 48.4 -67.2 -43.7 32.2 29.0 -8.1 45 53 A A H X S+ 0 0 0 -4,-1.9 4,-2.5 -5,-0.2 5,-0.2 0.890 108.5 54.9 -63.9 -40.5 35.5 30.8 -8.7 46 54 A F H X S+ 0 0 66 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.897 104.8 53.3 -59.5 -41.9 34.6 31.4 -12.4 47 55 A T H X S+ 0 0 73 -4,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.883 111.3 46.3 -61.8 -39.4 31.4 33.1 -11.4 48 56 A M H X S+ 0 0 43 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.909 113.1 46.7 -72.4 -43.0 33.3 35.5 -9.1 49 57 A Y H X S+ 0 0 1 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.932 111.9 51.3 -65.9 -42.4 36.0 36.4 -11.5 50 58 A L H X S+ 0 0 60 -4,-2.7 4,-1.4 -5,-0.2 -1,-0.2 0.910 109.0 53.0 -59.7 -39.3 33.5 36.9 -14.3 51 59 A S H X S+ 0 0 58 -4,-1.7 4,-0.8 -5,-0.2 -1,-0.2 0.868 106.4 51.9 -62.7 -37.7 31.6 39.2 -11.8 52 60 A M H < S+ 0 0 18 -4,-1.9 3,-0.4 1,-0.2 -1,-0.2 0.871 103.7 57.6 -66.8 -37.1 34.8 41.2 -11.2 53 61 A L H < S+ 0 0 27 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.870 111.3 43.2 -60.3 -35.1 35.3 41.7 -14.9 54 62 A L H < 0 0 135 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.610 360.0 360.0 -84.6 -15.0 31.8 43.3 -15.0 55 63 A G < 0 0 97 -4,-0.8 -3,-0.0 -3,-0.4 0, 0.0 -0.462 360.0 360.0 -81.5 360.0 32.5 45.3 -11.9 56 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 57 78 A I 0 0 170 0, 0.0 3,-0.5 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 -81.6 35.6 45.2 -5.2 58 79 A Y >> + 0 0 33 1,-0.2 4,-1.4 2,-0.1 3,-0.6 0.386 360.0 92.9 -96.8 2.4 37.9 42.2 -4.5 59 80 A W H 3> S+ 0 0 96 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.634 75.8 69.4 -67.8 -11.1 35.7 41.0 -1.7 60 81 A A H 3> S+ 0 0 26 -3,-0.5 4,-1.6 2,-0.2 -1,-0.2 0.924 98.6 45.8 -70.1 -46.1 34.1 39.0 -4.5 61 82 A R H <> S+ 0 0 7 -3,-0.6 4,-1.5 1,-0.2 -2,-0.2 0.841 110.7 55.5 -65.0 -33.1 37.2 36.8 -4.7 62 83 A Y H X S+ 0 0 21 -4,-1.4 4,-1.6 1,-0.2 -1,-0.2 0.872 104.5 52.4 -67.4 -37.3 37.2 36.7 -0.9 63 84 A A H X S+ 0 0 38 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.855 106.3 54.6 -67.1 -33.4 33.6 35.3 -1.0 64 85 A S H X S+ 0 0 0 -4,-1.6 4,-2.6 1,-0.2 5,-0.2 0.856 103.0 55.1 -69.5 -32.3 34.8 32.6 -3.4 65 86 A W H X S+ 0 0 17 -4,-1.5 4,-2.6 1,-0.2 -1,-0.2 0.915 102.9 58.9 -63.7 -40.8 37.5 31.5 -0.9 66 87 A L H < S+ 0 0 79 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.859 114.1 34.2 -54.1 -43.9 34.7 31.1 1.6 67 88 A F H X S+ 0 0 121 -4,-1.2 4,-0.8 2,-0.1 -1,-0.2 0.853 122.2 45.3 -82.4 -37.7 32.9 28.5 -0.5 68 89 A T H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.871 100.1 60.5 -79.8 -40.9 35.8 26.8 -2.1 69 90 A T H X S+ 0 0 15 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.892 106.1 50.4 -56.5 -40.3 38.3 26.2 0.6 70 91 A P H > S+ 0 0 33 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.873 111.2 49.2 -64.5 -36.8 35.8 24.0 2.6 71 92 A L H X S+ 0 0 32 -4,-0.8 4,-2.3 2,-0.2 -2,-0.2 0.891 109.2 51.4 -68.8 -40.8 35.1 22.0 -0.6 72 93 A L H X S+ 0 0 4 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.904 111.6 48.1 -62.6 -39.9 38.8 21.5 -1.3 73 94 A L H X S+ 0 0 1 -4,-2.1 4,-2.8 -5,-0.2 -2,-0.2 0.908 108.5 53.7 -67.3 -38.6 39.2 20.2 2.2 74 95 A L H X S+ 0 0 56 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.877 106.3 54.0 -60.6 -39.8 36.2 17.9 1.7 75 96 A D H X S+ 0 0 1 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.957 110.3 45.6 -59.0 -52.8 37.9 16.5 -1.3 76 97 A L H X S+ 0 0 1 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.910 111.7 52.0 -58.0 -45.0 41.0 15.7 0.7 77 98 A A H <>S+ 0 0 0 -4,-2.8 5,-2.6 1,-0.2 -1,-0.2 0.874 108.9 49.4 -62.6 -38.7 39.0 14.2 3.5 78 99 A L H ><5S+ 0 0 61 -4,-2.2 3,-1.1 3,-0.2 -1,-0.2 0.879 105.3 60.1 -67.6 -36.0 37.1 11.9 1.2 79 100 A L H 3<5S+ 0 0 6 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.922 115.0 32.6 -56.4 -47.5 40.4 10.8 -0.3 80 101 A V T 3<5S- 0 0 0 -4,-1.7 -1,-0.3 70,-0.1 -2,-0.2 0.237 110.2-119.1 -96.4 13.5 41.7 9.4 3.0 81 102 A D T < 5 - 0 0 114 -3,-1.1 -3,-0.2 -4,-0.2 -4,-0.1 0.931 43.0-170.6 50.6 54.8 38.2 8.4 4.3 82 103 A A < - 0 0 19 -5,-2.6 -1,-0.1 1,-0.1 2,-0.0 -0.423 23.4-105.4 -75.1 152.8 38.4 10.7 7.3 83 104 A D > - 0 0 95 -2,-0.1 4,-1.6 1,-0.1 -1,-0.1 -0.304 30.2-106.1 -76.0 163.3 35.7 10.4 10.0 84 105 A Q H > S+ 0 0 152 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.912 114.7 54.6 -54.5 -52.2 32.9 12.9 10.3 85 106 A G H > S+ 0 0 37 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.930 107.4 48.9 -49.0 -55.6 34.2 14.6 13.4 86 107 A T H > S+ 0 0 57 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.871 109.7 52.9 -54.6 -41.4 37.6 15.5 11.9 87 108 A I H X S+ 0 0 33 -4,-1.6 4,-2.7 2,-0.2 5,-0.2 0.919 109.0 49.4 -61.4 -44.8 35.9 16.9 8.8 88 109 A L H X S+ 0 0 102 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.917 109.0 51.3 -61.3 -46.1 33.7 19.2 10.8 89 110 A A H X S+ 0 0 41 -4,-2.4 4,-2.9 -5,-0.2 5,-0.2 0.943 111.3 49.9 -58.4 -45.2 36.6 20.5 12.9 90 111 A L H X S+ 0 0 2 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.955 113.6 42.6 -57.2 -54.7 38.5 21.2 9.6 91 112 A V H X S+ 0 0 47 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.777 113.3 55.2 -65.0 -25.2 35.6 23.1 8.0 92 113 A G H X S+ 0 0 38 -4,-2.3 4,-1.7 -5,-0.2 -2,-0.2 0.952 110.7 43.3 -70.7 -49.0 35.0 24.8 11.3 93 114 A A H X S+ 0 0 13 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.862 112.6 53.8 -63.1 -37.7 38.6 26.1 11.5 94 115 A D H X S+ 0 0 0 -4,-2.8 4,-2.4 -5,-0.2 5,-0.3 0.916 106.2 53.2 -63.7 -39.8 38.4 27.0 7.8 95 116 A G H X S+ 0 0 36 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.871 110.3 46.6 -61.8 -37.5 35.3 29.0 8.6 96 117 A I H X S+ 0 0 85 -4,-1.7 4,-3.3 2,-0.2 5,-0.4 0.894 109.0 56.3 -70.9 -37.9 37.2 30.9 11.3 97 118 A M H X S+ 0 0 19 -4,-2.5 4,-1.1 1,-0.2 -2,-0.2 0.945 116.9 33.2 -57.7 -53.2 40.2 31.4 9.0 98 119 A I H X S+ 0 0 11 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.852 121.0 51.6 -72.9 -35.6 38.1 33.1 6.3 99 120 A G H X S+ 0 0 31 -4,-2.1 4,-2.1 -5,-0.3 -2,-0.2 0.940 113.2 41.1 -68.1 -48.2 35.8 34.7 8.9 100 121 A T H X S+ 0 0 14 -4,-3.3 4,-2.1 1,-0.2 -1,-0.2 0.752 108.9 61.7 -72.3 -23.6 38.5 36.3 11.1 101 122 A G H X S+ 0 0 4 -4,-1.1 4,-1.4 -5,-0.4 -1,-0.2 0.906 109.1 43.0 -65.9 -37.8 40.4 37.3 8.0 102 123 A L H < S+ 0 0 52 -4,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.899 111.1 53.4 -72.6 -44.2 37.4 39.4 7.1 103 124 A V H >< S+ 0 0 56 -4,-2.1 3,-1.1 1,-0.2 4,-0.5 0.903 110.9 46.9 -59.5 -42.7 36.8 40.8 10.6 104 125 A G H >< S+ 0 0 0 -4,-2.1 3,-1.0 1,-0.3 -1,-0.2 0.863 106.0 56.3 -68.4 -36.9 40.4 42.0 10.8 105 126 A A T 3< S+ 0 0 21 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.412 108.6 54.1 -73.9 2.1 40.4 43.6 7.4 106 127 A L T < S+ 0 0 114 -3,-1.1 2,-0.4 -4,-0.1 -1,-0.2 0.495 92.0 80.6-109.2 -17.2 37.4 45.5 8.8 107 128 A T < - 0 0 14 -3,-1.0 9,-0.0 -4,-0.5 6,-0.0 -0.799 60.4-160.0 -95.4 138.7 39.0 46.9 12.0 108 129 A K + 0 0 160 -2,-0.4 2,-0.5 5,-0.0 -1,-0.1 0.722 64.1 94.0 -89.1 -25.4 41.1 50.0 11.6 109 130 A V S > S- 0 0 48 1,-0.1 4,-2.5 2,-0.0 3,-0.4 -0.612 71.6-140.5 -78.5 122.6 43.2 49.7 14.7 110 131 A Y H > S+ 0 0 198 -2,-0.5 4,-2.6 1,-0.2 -1,-0.1 0.804 97.9 51.4 -44.4 -46.0 46.5 48.0 14.1 111 132 A S H > S+ 0 0 74 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.902 111.5 44.3 -65.9 -45.8 46.4 46.0 17.4 112 133 A Y H > S+ 0 0 147 -3,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.958 116.6 47.0 -64.1 -51.1 42.9 44.6 17.0 113 134 A R H >X S+ 0 0 67 -4,-2.5 4,-2.5 1,-0.2 3,-0.5 0.934 105.1 59.6 -54.6 -52.0 43.5 43.7 13.3 114 135 A F H 3X S+ 0 0 134 -4,-2.6 4,-1.4 1,-0.3 -1,-0.2 0.906 107.3 47.6 -42.7 -51.5 46.9 42.1 14.1 115 136 A V H 3X S+ 0 0 74 -4,-1.6 4,-2.4 1,-0.2 -1,-0.3 0.843 108.7 53.1 -62.2 -37.7 45.1 39.6 16.4 116 137 A W H S+ 0 0 146 -4,-1.9 4,-3.2 2,-0.2 5,-1.0 0.945 108.9 46.9 -64.7 -49.4 48.9 20.3 10.4 130 151 A V H <>S+ 0 0 22 -4,-2.4 5,-3.1 3,-0.2 6,-0.3 0.935 114.9 47.2 -57.8 -47.4 46.0 18.0 10.2 131 152 A L H <>S+ 0 0 1 -4,-2.5 5,-0.7 3,-0.2 -2,-0.2 0.934 118.6 39.7 -60.9 -47.9 46.6 17.5 6.5 132 153 A F H <5S+ 0 0 65 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.909 134.6 15.5 -71.6 -44.9 50.3 16.9 6.9 133 154 A F T X5S+ 0 0 114 -4,-3.2 4,-1.4 -5,-0.2 -3,-0.2 0.888 131.8 40.2 -96.1 -52.5 50.4 14.8 10.0 134 155 A G H >< S+ 0 0 75 -4,-1.1 3,-0.8 1,-0.2 -2,-0.2 0.873 110.9 51.9 -67.9 -39.7 45.7 7.7 7.4 139 160 A A H >< S+ 0 0 1 -4,-2.6 3,-1.7 1,-0.2 8,-0.3 0.855 102.5 58.8 -66.3 -36.6 46.6 7.8 3.7 140 161 A E T 3< S+ 0 0 119 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.638 99.6 58.2 -70.2 -12.9 49.6 5.5 4.1 141 162 A S T < S+ 0 0 91 -3,-0.8 -1,-0.3 -4,-0.5 2,-0.2 0.354 102.2 76.0 -95.9 5.6 47.4 2.8 5.5 142 163 A M S < S- 0 0 53 -3,-1.7 5,-0.2 1,-0.2 -62,-0.0 -0.571 99.4 -52.9-112.0 174.5 45.4 2.9 2.3 143 164 A R >> - 0 0 78 -2,-0.2 4,-2.3 1,-0.1 3,-0.9 -0.079 54.7-115.4 -44.2 138.2 45.7 1.7 -1.3 144 165 A P H 3> S+ 0 0 106 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.838 114.9 56.1 -47.0 -44.0 49.0 2.8 -3.0 145 166 A E H 3> S+ 0 0 66 2,-0.2 4,-2.3 1,-0.2 62,-0.3 0.892 110.4 45.1 -58.6 -41.8 47.1 4.9 -5.5 146 167 A V H <> S+ 0 0 5 -3,-0.9 4,-2.9 2,-0.2 5,-0.2 0.958 113.2 49.2 -66.7 -52.6 45.4 6.9 -2.7 147 168 A A H X S+ 0 0 10 -4,-2.3 4,-1.9 -8,-0.3 -2,-0.2 0.926 115.6 44.6 -51.9 -50.0 48.6 7.3 -0.6 148 169 A S H X S+ 0 0 73 -4,-2.8 4,-1.5 -5,-0.2 -1,-0.2 0.914 115.8 43.5 -64.9 -47.8 50.5 8.5 -3.7 149 170 A T H X S+ 0 0 16 -4,-2.3 4,-2.3 -5,-0.2 5,-0.2 0.874 112.2 54.9 -68.6 -35.5 47.9 10.9 -5.1 150 171 A F H X S+ 0 0 0 -4,-2.9 4,-2.9 -5,-0.2 -1,-0.2 0.910 103.5 55.5 -63.4 -40.7 47.2 12.3 -1.6 151 172 A K H X S+ 0 0 63 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.899 110.3 44.9 -59.2 -42.5 50.8 13.1 -1.0 152 173 A V H X S+ 0 0 69 -4,-1.5 4,-2.7 2,-0.2 5,-0.2 0.970 115.5 45.7 -67.2 -49.8 51.0 15.3 -4.2 153 174 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.859 112.8 53.5 -60.1 -34.8 47.7 17.0 -3.5 154 175 A R H X S+ 0 0 30 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.908 110.8 44.4 -66.3 -42.9 48.8 17.5 0.1 155 176 A N H X S+ 0 0 71 -4,-2.1 4,-1.7 2,-0.2 5,-0.2 0.866 113.7 50.2 -70.1 -38.3 52.1 19.1 -0.9 156 177 A V H X S+ 0 0 38 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.950 113.3 47.0 -63.5 -47.3 50.4 21.3 -3.5 157 178 A T H X S+ 0 0 2 -4,-2.3 4,-2.1 -5,-0.2 5,-0.4 0.877 110.7 49.5 -62.4 -45.1 47.8 22.5 -0.9 158 179 A V H X S+ 0 0 29 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.904 115.7 43.4 -64.9 -40.7 50.2 23.2 1.9 159 180 A V H X S+ 0 0 103 -4,-1.7 4,-0.9 -5,-0.2 -2,-0.2 0.958 119.3 40.5 -69.2 -53.1 52.5 25.4 -0.4 160 181 A L H >X S+ 0 0 25 -4,-2.5 3,-1.0 -5,-0.2 4,-0.7 0.950 116.2 48.2 -61.4 -53.4 49.8 27.3 -2.2 161 182 A W H >< S+ 0 0 12 -4,-2.1 3,-1.3 -5,-0.3 -1,-0.2 0.900 108.2 56.6 -56.6 -42.4 47.5 27.9 0.8 162 183 A S H 3X S+ 0 0 44 -4,-1.5 4,-0.7 -5,-0.4 -1,-0.3 0.752 98.4 62.4 -60.7 -27.3 50.5 29.1 2.9 163 184 A A H S+ 0 0 28 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.854 113.1 54.1 -63.7 -33.9 48.7 35.1 4.2 166 187 A V H X S+ 0 0 86 -4,-0.7 4,-1.6 2,-0.2 -2,-0.2 0.962 111.3 42.7 -63.8 -53.3 52.1 36.2 2.8 167 188 A V H X S+ 0 0 14 -4,-2.6 4,-1.0 1,-0.2 3,-0.4 0.950 115.1 51.7 -57.2 -50.2 50.7 38.0 -0.2 168 189 A W H < S+ 0 0 18 -4,-2.5 6,-0.7 1,-0.2 5,-0.4 0.859 108.1 50.5 -56.0 -42.5 48.0 39.5 1.9 169 190 A L H < S+ 0 0 79 -4,-2.3 6,-3.3 1,-0.2 -1,-0.2 0.812 117.1 38.1 -70.6 -31.2 50.4 40.9 4.6 170 191 A I H < S+ 0 0 69 -4,-1.6 8,-2.8 -3,-0.4 7,-1.6 0.478 110.1 83.4 -96.5 -2.5 52.7 42.6 2.1 171 192 A G S ><>S- 0 0 0 -4,-1.0 5,-2.3 6,-0.2 3,-1.2 -0.125 107.1 -73.7 -88.8-172.0 49.8 43.7 -0.1 172 193 A S T 3 5S+ 0 0 64 6,-0.3 -4,-0.1 1,-0.3 -3,-0.1 0.662 131.6 53.7 -57.4 -19.2 47.4 46.6 0.1 173 194 A E T 3 5S+ 0 0 35 -5,-0.4 -1,-0.3 2,-0.0 -4,-0.1 0.706 120.8 26.9 -87.9 -27.6 45.6 44.9 3.1 174 195 A G T < 5S- 0 0 34 -3,-1.2 -4,-0.2 -6,-0.7 -5,-0.2 0.520 134.5 -18.5 -97.3-110.6 48.8 44.6 5.0 175 196 A A T 5S- 0 0 72 -6,-3.3 -5,-0.2 -7,-0.1 -3,-0.2 0.702 80.4-122.6 -78.8 -16.5 52.0 46.7 4.8 176 197 A G S - 0 0 63 0, 0.0 4,-2.6 0, 0.0 5,-0.2 -0.232 24.5-115.0 -61.0 148.6 50.7 47.3 -5.8 180 201 A L H > S+ 0 0 69 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.829 115.5 50.8 -54.9 -34.8 47.0 46.5 -6.0 181 202 A N H > S+ 0 0 71 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.916 111.5 44.8 -72.6 -42.4 47.4 45.3 -9.6 182 203 A I H > S+ 0 0 68 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.844 108.7 58.1 -69.2 -34.1 50.3 42.9 -9.0 183 204 A E H X S+ 0 0 2 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.935 105.2 50.8 -60.3 -44.0 48.5 41.6 -5.9 184 205 A T H X S+ 0 0 2 -4,-1.5 4,-1.9 -5,-0.2 -1,-0.2 0.877 108.3 52.7 -60.3 -37.4 45.6 40.7 -8.2 185 206 A L H X S+ 0 0 52 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.959 110.6 48.0 -60.8 -51.9 48.1 38.9 -10.5 186 207 A L H X S+ 0 0 61 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.913 111.4 47.0 -55.7 -53.6 49.4 36.9 -7.6 187 208 A F H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 -1,-0.2 0.844 109.3 54.7 -62.9 -33.4 46.1 35.8 -6.2 188 209 A M H X S+ 0 0 10 -4,-1.9 4,-2.9 -5,-0.2 5,-0.3 0.918 109.7 46.8 -66.7 -40.8 44.8 34.8 -9.6 189 210 A V H X S+ 0 0 67 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.928 115.3 46.3 -64.9 -43.8 47.8 32.5 -10.2 190 211 A L H X S+ 0 0 23 -4,-2.3 4,-3.2 2,-0.2 -2,-0.2 0.940 114.5 47.2 -62.4 -49.6 47.4 31.0 -6.7 191 212 A D H X S+ 0 0 0 -4,-3.0 4,-1.0 1,-0.2 5,-0.4 0.934 112.2 48.4 -59.6 -50.4 43.6 30.5 -7.1 192 213 A V H X>S+ 0 0 20 -4,-2.9 5,-1.9 1,-0.2 4,-1.2 0.886 115.9 46.9 -58.3 -36.7 43.9 28.9 -10.5 193 214 A S H <>S+ 0 0 41 -4,-1.9 5,-0.9 -5,-0.3 -2,-0.2 0.920 110.1 50.2 -71.7 -45.2 46.6 26.7 -9.1 194 215 A A H <5S+ 0 0 4 -4,-3.2 -1,-0.2 3,-0.2 -2,-0.2 0.570 127.5 22.2 -71.3 -10.4 44.7 25.7 -5.9 195 216 A K H X5S+ 0 0 7 -4,-1.0 4,-2.7 -3,-0.3 -3,-0.2 0.695 131.2 29.5-121.7 -60.8 41.6 24.7 -7.9 196 217 A V H X5S+ 0 0 18 -4,-1.2 4,-3.0 -5,-0.4 5,-0.2 0.973 126.5 43.2 -70.1 -52.0 42.3 23.9 -11.5 197 218 A G H >< S+ 0 0 2 -4,-2.1 3,-1.3 1,-0.2 6,-0.3 0.944 116.0 44.4 -62.6 -55.1 43.0 14.6 -8.6 203 224 A L H 3< S+ 0 0 2 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.657 108.9 55.7 -69.6 -19.5 40.7 13.8 -11.5 204 225 A R T 3< S+ 0 0 177 -4,-1.5 2,-0.3 -5,-0.3 -1,-0.3 0.288 96.3 88.2 -95.2 11.5 43.3 12.3 -13.8 205 226 A S S X S- 0 0 21 -3,-1.3 3,-0.8 1,-0.1 4,-0.1 -0.816 76.0-137.6-108.7 148.7 44.3 9.9 -11.0 206 227 A R G > S+ 0 0 130 -2,-0.3 3,-1.8 1,-0.2 -60,-0.1 0.528 88.0 92.1 -81.2 -6.2 42.7 6.5 -10.5 207 228 A A G 3 S+ 0 0 4 1,-0.3 -1,-0.2 -62,-0.3 -61,-0.1 0.711 73.5 68.0 -61.1 -20.8 42.7 7.1 -6.7 208 229 A I G < S+ 0 0 0 -3,-0.8 -1,-0.3 -6,-0.3 -174,-0.2 0.638 85.1 86.7 -75.9 -14.1 39.1 8.5 -7.1 209 230 A F S < S- 0 0 36 -3,-1.8 -3,-0.0 -179,-0.1 0, 0.0 -0.569 73.5-139.6 -87.5 151.7 37.7 5.1 -7.9 210 231 A G 0 0 31 -2,-0.2 -1,-0.1 0, 0.0 -4,-0.0 0.880 360.0 360.0 -73.8 -38.0 36.5 2.6 -5.3 211 232 A E 0 0 133 -3,-0.0 -4,-0.0 -5,-0.0 -5,-0.0 0.501 360.0 360.0 85.8 360.0 38.0 -0.3 -7.2