==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTON TRANSPORT 29-JUL-99 1C8R . COMPND 2 MOLECULE: PROTEIN (BACTERIORHODOPSIN); . SOURCE 2 ORGANISM_SCIENTIFIC: HALOBACTERIUM SALINARUM; . AUTHOR H.LUECKE . 222 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10108.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 188 84.7 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 . 7 3.2 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 . 1 0.5 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 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 146 65.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.3 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 1 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 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 . 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 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 5 A T 0 0 102 0, 0.0 6,-0.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-162.4 23.8 25.1 -14.6 2 6 A G + 0 0 80 4,-0.1 3,-0.0 3,-0.1 0, 0.0 0.361 360.0 83.0 -94.8 -2.3 23.5 27.7 -17.3 3 7 A R S > S- 0 0 58 1,-0.1 3,-2.4 191,-0.0 4,-0.3 -0.947 76.4-144.3 -94.6 120.6 22.7 30.7 -15.0 4 8 A P T > S+ 0 0 87 0, 0.0 3,-0.7 0, 0.0 4,-0.3 0.777 98.1 61.2 -65.9 -24.0 26.1 31.8 -13.7 5 9 A E T >> S+ 0 0 8 1,-0.2 4,-1.9 2,-0.1 3,-0.8 0.553 77.2 95.6 -75.8 -0.9 24.6 32.7 -10.4 6 10 A W H <> S+ 0 0 94 -3,-2.4 4,-3.6 1,-0.2 5,-0.3 0.889 76.7 59.5 -53.1 -40.3 23.6 29.0 -9.9 7 11 A I H <> S+ 0 0 67 -3,-0.7 4,-2.8 -4,-0.3 -1,-0.2 0.906 107.1 45.3 -59.3 -37.3 26.8 28.2 -8.0 8 12 A W H <> S+ 0 0 69 -3,-0.8 4,-2.4 -4,-0.3 -1,-0.2 0.919 113.9 48.7 -76.3 -35.6 25.9 30.8 -5.4 9 13 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.883 114.4 47.0 -64.3 -39.2 22.3 29.5 -5.2 10 14 A A H X S+ 0 0 26 -4,-3.6 4,-2.9 2,-0.2 5,-0.3 0.914 114.2 46.6 -66.0 -48.6 23.6 25.9 -4.9 11 15 A L H X S+ 0 0 63 -4,-2.8 4,-2.9 -5,-0.3 5,-0.3 0.933 113.9 48.7 -58.4 -40.2 26.1 27.0 -2.2 12 16 A G H X S+ 0 0 0 -4,-2.4 4,-2.8 -5,-0.2 5,-0.3 0.942 110.8 50.4 -70.2 -37.2 23.4 28.9 -0.4 13 17 A T H X S+ 0 0 13 -4,-2.4 4,-3.1 2,-0.2 5,-0.3 0.973 113.3 46.5 -59.5 -51.4 21.0 25.9 -0.6 14 18 A A H X S+ 0 0 41 -4,-2.9 4,-3.0 1,-0.2 5,-0.3 0.946 114.1 46.3 -56.4 -45.9 23.7 23.7 0.8 15 19 A L H X S+ 0 0 58 -4,-2.9 4,-2.5 -5,-0.3 -1,-0.2 0.933 113.7 47.4 -73.1 -32.1 24.7 26.0 3.5 16 20 A M H X S+ 0 0 0 -4,-2.8 4,-2.4 -5,-0.3 34,-0.2 0.911 113.8 49.0 -72.0 -34.5 21.1 26.7 4.6 17 21 A G H X S+ 0 0 12 -4,-3.1 4,-2.9 -5,-0.3 5,-0.2 0.945 113.3 46.3 -63.6 -47.3 20.4 23.0 4.5 18 22 A L H X S+ 0 0 102 -4,-3.0 4,-3.3 -5,-0.3 5,-0.3 0.937 112.0 50.5 -60.8 -44.3 23.4 22.2 6.5 19 23 A G H X S+ 0 0 6 -4,-2.5 4,-3.1 -5,-0.3 5,-0.2 0.943 109.9 51.6 -60.8 -40.0 22.7 24.9 9.0 20 24 A T H X S+ 0 0 17 -4,-2.4 4,-2.5 26,-0.2 5,-0.2 0.964 112.8 44.2 -61.4 -50.1 19.1 23.6 9.3 21 25 A L H X S+ 0 0 108 -4,-2.9 4,-2.8 1,-0.2 5,-0.3 0.953 113.1 51.9 -62.8 -43.3 20.3 20.1 10.0 22 26 A Y H X S+ 0 0 103 -4,-3.3 4,-3.0 -5,-0.2 5,-0.2 0.964 113.9 42.4 -54.9 -48.8 23.0 21.4 12.4 23 27 A F H X S+ 0 0 0 -4,-3.1 4,-2.4 -5,-0.3 -1,-0.2 0.885 112.6 54.9 -70.7 -29.1 20.5 23.4 14.4 24 28 A L H < S+ 0 0 95 -4,-2.5 4,-0.2 -5,-0.2 -1,-0.2 0.926 112.9 41.5 -61.2 -50.7 18.0 20.6 14.3 25 29 A V H >< S+ 0 0 92 -4,-2.8 3,-1.6 -5,-0.2 -2,-0.2 0.924 113.7 54.9 -62.7 -44.7 20.4 18.2 15.7 26 30 A K H 3< S+ 0 0 57 -4,-3.0 4,-0.2 1,-0.3 -2,-0.2 0.871 104.4 51.7 -58.8 -41.8 21.6 20.8 18.2 27 31 A G T >< S+ 0 0 21 -4,-2.4 3,-0.9 -5,-0.2 -1,-0.3 0.522 82.6 118.9 -83.4 6.9 18.2 21.5 19.6 28 32 A M T < S+ 0 0 146 -3,-1.6 3,-0.1 1,-0.2 -3,-0.0 -0.495 82.1 14.9 -64.6 133.8 17.7 17.8 20.2 29 33 A G T 3 S+ 0 0 78 1,-0.3 -1,-0.2 -2,-0.2 -2,-0.1 -0.016 88.8 139.3 94.2 -30.3 17.3 17.2 23.9 30 34 A V < + 0 0 33 -3,-0.9 -1,-0.3 -4,-0.2 -3,-0.0 -0.061 18.8 167.8 -50.1 139.0 16.6 20.9 24.7 31 35 A S + 0 0 91 -3,-0.1 -1,-0.1 1,-0.0 3,-0.0 0.605 35.5 110.6-134.3 -15.7 13.8 21.1 27.2 32 36 A D > - 0 0 39 1,-0.2 4,-3.5 2,-0.1 5,-0.2 -0.523 62.5-143.7 -63.8 113.3 13.8 24.6 28.4 33 37 A P H > S+ 0 0 81 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.883 101.4 48.4 -39.8 -51.8 10.6 26.1 27.0 34 38 A D H >> S+ 0 0 65 2,-0.2 4,-1.5 1,-0.2 3,-0.7 0.964 112.7 46.7 -62.9 -46.0 12.4 29.4 26.5 35 39 A A H 3> S+ 0 0 0 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.923 106.3 62.2 -58.2 -42.9 15.4 27.8 24.8 36 40 A K H 3X S+ 0 0 116 -4,-3.5 4,-3.0 1,-0.2 -1,-0.3 0.849 100.1 52.2 -48.5 -41.6 12.9 25.8 22.7 37 41 A K H S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.746 113.8 64.5 -77.0 -11.6 17.3 28.6 7.4 47 51 A A H X S+ 0 0 27 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.960 107.9 40.2 -67.4 -48.7 14.9 25.8 6.9 48 52 A I H X S+ 0 0 35 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.949 116.6 50.2 -58.7 -44.3 12.6 28.2 5.0 49 53 A A H X S+ 0 0 0 -4,-2.3 4,-3.6 -5,-0.3 5,-0.3 0.921 105.3 57.7 -67.1 -34.7 15.6 29.8 3.4 50 54 A F H X S+ 0 0 75 -4,-2.6 4,-2.9 -34,-0.2 5,-0.3 0.950 108.9 45.9 -53.8 -48.1 16.8 26.4 2.3 51 55 A T H X S+ 0 0 64 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.901 115.2 44.9 -67.9 -31.6 13.6 25.8 0.5 52 56 A M H X S+ 0 0 41 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.914 112.4 51.7 -81.5 -37.9 13.5 29.2 -1.2 53 57 A Y H X S+ 0 0 0 -4,-3.6 4,-3.1 -5,-0.2 5,-0.2 0.922 111.6 48.5 -54.3 -45.2 17.2 28.9 -2.1 54 58 A L H X S+ 0 0 56 -4,-2.9 4,-2.9 -5,-0.3 6,-0.3 0.934 108.0 54.5 -61.4 -40.0 16.3 25.5 -3.6 55 59 A S H X>S+ 0 0 13 -4,-2.1 6,-2.4 -5,-0.3 5,-0.7 0.916 111.5 44.8 -62.1 -32.2 13.4 27.1 -5.4 56 60 A M H ><5S+ 0 0 0 -4,-2.3 3,-1.0 4,-0.2 -1,-0.2 0.951 110.7 53.7 -74.4 -41.5 15.8 29.6 -6.9 57 61 A L H 3<5S+ 0 0 33 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.892 112.1 44.3 -57.2 -41.3 18.3 27.0 -7.7 58 62 A L H 3<5S- 0 0 127 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.568 116.5-112.9 -85.9 -3.0 15.7 25.0 -9.6 59 63 A G T X<5S+ 0 0 24 -3,-1.0 3,-1.1 -4,-0.6 -3,-0.2 0.211 89.2 109.3 98.0 -10.5 14.3 28.0 -11.4 60 64 A Y T 3 +A 70 0A 11 3,-2.1 3,-2.1 -2,-0.5 59,-0.1 -0.930 64.0 23.4-159.0 152.8 11.5 47.3 -17.0 68 72 A G T 3 S- 0 0 64 57,-0.3 3,-0.1 -2,-0.3 58,-0.1 0.722 131.0 -71.0 60.6 21.4 13.8 49.6 -18.9 69 73 A G T 3 S+ 0 0 81 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.752 113.5 112.3 64.5 19.7 12.4 47.8 -21.9 70 74 A E E < S-A 67 0A 133 -3,-2.1 -3,-2.1 -5,-0.1 2,-0.9 -0.845 76.2-117.2-120.2 161.1 14.4 44.7 -20.8 71 75 A Q E -A 66 0A 130 -2,-0.3 -3,-0.0 -5,-0.2 -7,-0.0 -0.851 41.2-161.8 -96.2 94.8 13.3 41.3 -19.6 72 76 A N E -A 65 0A 27 -7,-2.4 -7,-2.8 -2,-0.9 2,-0.5 -0.666 16.7-127.6 -91.4 123.9 14.9 41.3 -16.1 73 77 A P E -A 64 0A 38 0, 0.0 2,-0.5 0, 0.0 -9,-0.2 -0.513 30.8-174.6 -69.3 116.7 15.5 38.2 -14.1 74 78 A I E -A 63 0A 0 -11,-3.9 -11,-2.9 -2,-0.5 2,-1.5 -0.957 22.8-146.6-121.8 117.9 13.9 38.7 -10.7 75 79 A Y E > +A 62 0A 0 -2,-0.5 3,-1.0 -13,-0.2 4,-0.3 -0.652 25.6 172.0 -77.3 91.1 14.3 36.1 -7.9 76 80 A W T >> + 0 0 77 -2,-1.5 3,-1.4 -15,-0.5 4,-1.1 0.742 64.2 78.3 -73.9 -24.1 10.9 36.7 -6.3 77 81 A A H 3> S+ 0 0 0 -16,-2.1 4,-1.8 1,-0.3 -1,-0.3 0.784 80.0 69.4 -63.3 -19.3 11.4 33.7 -4.1 78 82 A R H <> S+ 0 0 3 -3,-1.0 4,-3.3 -17,-0.3 -1,-0.3 0.914 96.8 51.1 -64.1 -35.8 13.7 35.8 -1.9 79 83 A Y H <> S+ 0 0 4 -3,-1.4 4,-2.9 -4,-0.3 -1,-0.2 0.842 106.4 54.1 -69.7 -31.3 10.7 37.9 -0.7 80 84 A A H X S+ 0 0 27 -4,-1.1 4,-0.8 2,-0.2 -1,-0.2 0.894 113.6 44.2 -62.9 -40.1 8.8 34.7 0.2 81 85 A D H >X S+ 0 0 0 -4,-1.8 4,-3.3 2,-0.2 3,-1.0 0.980 117.9 42.2 -58.5 -66.2 11.7 33.7 2.3 82 86 A W H 3X S+ 0 0 16 -4,-3.3 4,-2.4 1,-0.3 -2,-0.2 0.809 102.3 68.3 -61.0 -32.2 12.2 37.1 3.9 83 87 A L H 3< S+ 0 0 75 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.886 118.7 22.9 -55.5 -34.0 8.5 37.7 4.4 84 88 A F H S+ 0 0 23 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.912 113.1 52.7 -63.6 -33.0 10.0 38.7 11.3 88 92 A L H X S+ 0 0 36 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.924 109.1 48.6 -64.5 -40.9 11.2 35.5 12.8 89 93 A L H X S+ 0 0 4 -4,-2.5 4,-1.7 2,-0.2 3,-0.3 0.933 112.5 48.5 -61.4 -45.3 14.7 36.9 13.2 90 94 A L H X S+ 0 0 1 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.884 106.2 58.7 -63.2 -32.0 13.2 40.0 14.7 91 95 A L H X S+ 0 0 47 -4,-2.5 4,-3.1 -5,-0.2 5,-0.3 0.906 100.8 55.1 -62.9 -36.8 11.2 37.8 17.0 92 96 A N H X S+ 0 0 1 -4,-1.6 4,-2.0 -3,-0.3 -1,-0.2 0.937 111.9 43.9 -61.9 -41.8 14.4 36.3 18.3 93 97 A L H X S+ 0 0 1 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.948 114.4 49.2 -64.7 -45.8 15.6 39.8 19.2 94 98 A A H <>S+ 0 0 1 -4,-2.8 5,-3.8 1,-0.2 -2,-0.2 0.865 112.6 46.9 -66.3 -38.0 12.2 40.7 20.6 95 99 A L H ><5S+ 0 0 44 -4,-3.1 3,-1.3 3,-0.2 -1,-0.2 0.916 106.8 58.8 -65.9 -45.8 12.0 37.6 22.8 96 100 A L H 3<5S+ 0 0 10 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.931 115.6 34.1 -49.0 -53.0 15.6 38.0 24.0 97 101 A V T 3<5S- 0 0 20 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.351 111.5-118.5 -90.4 10.0 14.8 41.5 25.4 98 102 A D T < 5 - 0 0 137 -3,-1.3 -3,-0.2 -5,-0.1 -4,-0.1 0.973 41.5-157.3 58.1 51.9 11.2 40.5 26.4 99 103 A A < - 0 0 12 -5,-3.8 -1,-0.1 1,-0.1 53,-0.1 -0.318 18.2-103.0 -67.0 148.4 9.7 43.1 24.1 100 104 A D > - 0 0 121 1,-0.1 4,-2.0 4,-0.0 3,-0.3 -0.227 31.9-115.0 -54.0 151.2 6.2 44.4 24.7 101 105 A Q H > S+ 0 0 173 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.891 115.6 55.5 -59.3 -35.9 3.5 43.0 22.4 102 106 A G H > S+ 0 0 56 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.859 107.6 48.4 -72.7 -28.9 2.9 46.4 20.8 103 107 A T H > S+ 0 0 30 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.855 111.3 50.9 -74.7 -35.3 6.6 46.7 20.0 104 108 A I H X S+ 0 0 47 -4,-2.0 4,-2.8 2,-0.2 5,-0.4 0.915 111.1 48.3 -67.0 -39.4 6.5 43.2 18.5 105 109 A L H X S+ 0 0 136 -4,-3.0 4,-2.6 1,-0.2 5,-0.3 0.957 110.8 50.8 -67.7 -41.0 3.5 44.1 16.4 106 110 A A H X S+ 0 0 32 -4,-2.1 4,-2.3 -5,-0.2 5,-0.2 0.916 114.2 44.9 -59.9 -38.0 5.2 47.3 15.3 107 111 A L H X S+ 0 0 2 -4,-2.1 4,-3.2 2,-0.2 5,-0.2 0.965 115.2 44.2 -70.8 -51.7 8.3 45.3 14.2 108 112 A V H X S+ 0 0 60 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.944 118.2 46.4 -58.1 -44.6 6.6 42.4 12.5 109 113 A G H X S+ 0 0 36 -4,-2.6 4,-2.3 -5,-0.4 -1,-0.2 0.956 112.7 47.4 -64.0 -48.4 4.2 44.9 10.8 110 114 A A H X S+ 0 0 11 -4,-2.3 4,-2.8 -5,-0.3 -2,-0.2 0.920 113.3 52.7 -54.4 -41.5 7.0 47.3 9.8 111 115 A D H X S+ 0 0 0 -4,-3.2 4,-2.6 1,-0.2 5,-0.4 0.925 107.0 49.0 -67.2 -38.2 8.9 44.2 8.6 112 116 A G H X S+ 0 0 29 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.899 112.0 50.0 -70.7 -30.4 6.0 42.9 6.4 113 117 A I H X S+ 0 0 96 -4,-2.3 4,-3.3 -5,-0.2 5,-0.4 0.969 109.1 52.3 -66.5 -46.2 5.8 46.3 4.9 114 118 A M H X S+ 0 0 17 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.953 117.2 37.5 -47.2 -58.0 9.5 46.4 4.2 115 119 A I H X S+ 0 0 10 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.931 116.8 49.8 -70.4 -43.5 9.4 43.1 2.4 116 120 A G H X S+ 0 0 27 -4,-2.6 4,-3.0 -5,-0.4 -2,-0.2 0.945 114.2 44.8 -66.9 -35.1 6.1 43.5 0.7 117 121 A T H X S+ 0 0 16 -4,-3.3 4,-3.6 -5,-0.3 -1,-0.2 0.895 112.2 53.4 -71.5 -31.9 7.1 46.9 -0.6 118 122 A G H X S+ 0 0 8 -4,-2.1 4,-2.8 -5,-0.4 -2,-0.2 0.918 111.3 47.1 -60.2 -38.1 10.4 45.5 -1.6 119 123 A L H X S+ 0 0 57 -4,-2.7 4,-2.0 2,-0.2 5,-0.2 0.953 111.7 48.6 -71.5 -44.2 8.5 42.8 -3.4 120 124 A V H X S+ 0 0 60 -4,-3.0 4,-1.1 -5,-0.2 3,-0.3 0.947 112.5 48.9 -57.6 -46.1 6.3 45.2 -5.1 121 125 A G H >< S+ 0 0 0 -4,-3.6 3,-0.7 1,-0.2 -2,-0.2 0.927 109.0 54.3 -61.3 -36.8 9.3 47.3 -6.0 122 126 A A H 3< S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.840 116.5 36.5 -63.6 -31.2 10.9 44.1 -7.4 123 127 A L H 3< S+ 0 0 68 -4,-2.0 -1,-0.2 -3,-0.3 2,-0.2 0.422 87.1 117.8-101.3 -2.0 8.0 43.3 -9.6 124 128 A T << - 0 0 23 -4,-1.1 6,-0.1 -3,-0.7 -59,-0.0 -0.411 50.4-156.6 -73.3 132.6 7.1 46.9 -10.6 125 129 A K S S+ 0 0 145 -2,-0.2 2,-0.7 -58,-0.1 -57,-0.3 0.657 71.4 84.3 -92.5 -4.8 7.4 47.4 -14.3 126 130 A V S > S- 0 0 75 1,-0.2 4,-1.3 -59,-0.1 3,-0.4 -0.850 73.4-147.5 -97.1 112.6 7.8 51.3 -14.3 127 131 A Y H >> S+ 0 0 91 -2,-0.7 3,-0.8 1,-0.3 4,-0.8 0.889 91.0 48.1 -51.8 -51.3 11.5 51.8 -13.7 128 132 A S H >> S+ 0 0 82 1,-0.2 3,-1.1 2,-0.2 4,-0.9 0.925 107.7 55.3 -55.0 -43.5 11.4 55.0 -11.7 129 133 A Y H 3> S+ 0 0 137 -3,-0.4 4,-2.1 1,-0.2 3,-0.3 0.800 91.0 74.5 -67.0 -21.3 8.7 53.7 -9.4 130 134 A R H X>S+ 0 0 138 -4,-2.9 4,-3.0 -5,-0.2 3,-1.1 0.963 109.9 46.3 -53.8 -53.5 15.2 52.7 15.1 147 151 A V H 3X5S+ 0 0 7 -4,-3.0 4,-2.3 1,-0.3 5,-0.3 0.914 107.6 56.6 -62.2 -40.4 13.1 50.5 17.2 148 152 A L H 3<5S+ 0 0 0 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.688 119.7 32.4 -59.4 -22.4 15.9 48.0 17.8 149 153 A F H <<5S+ 0 0 80 -3,-1.1 -2,-0.2 -4,-0.9 -1,-0.2 0.766 137.7 16.2-107.9 -31.4 18.0 50.8 19.2 150 154 A F H <5S+ 0 0 144 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.400 110.5 74.3-121.0 -6.7 15.6 53.2 20.9 151 155 A G << 0 0 33 -4,-2.3 -3,-0.2 -5,-0.5 -4,-0.1 0.450 360.0 360.0 -93.3 -7.6 12.5 51.1 21.2 152 156 A F 0 0 96 -5,-0.3 -1,-0.2 -53,-0.1 -4,-0.1 0.369 360.0 360.0-116.2 360.0 13.7 48.9 24.1 153 ! 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 0.0 154 162 A S 0 0 185 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 81.5 16.9 45.8 33.6 155 163 A M - 0 0 84 1,-0.1 -58,-0.1 2,-0.0 5,-0.1 -0.736 360.0 -75.7-110.2 161.2 17.4 42.6 31.6 156 164 A R > - 0 0 80 -2,-0.2 4,-3.0 1,-0.2 3,-0.4 -0.397 40.2-123.4 -65.5 137.6 19.9 39.9 32.4 157 165 A P H > S+ 0 0 112 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.766 113.7 54.1 -48.3 -31.9 23.5 41.0 31.5 158 166 A E H > S+ 0 0 74 2,-0.2 4,-2.5 1,-0.2 5,-0.4 0.933 110.0 45.9 -68.2 -48.2 23.7 37.8 29.4 159 167 A V H > S+ 0 0 6 -3,-0.4 4,-2.8 1,-0.2 5,-0.3 0.948 113.5 49.4 -59.5 -46.7 20.6 38.8 27.5 160 168 A A H X S+ 0 0 20 -4,-3.0 4,-3.3 1,-0.2 -2,-0.2 0.942 112.4 48.7 -58.4 -45.7 21.8 42.4 27.1 161 169 A S H X S+ 0 0 70 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.892 116.0 40.0 -62.1 -45.4 25.2 41.2 25.8 162 170 A T H X S+ 0 0 15 -4,-2.5 4,-3.4 2,-0.2 5,-0.3 0.916 115.4 54.5 -74.5 -36.5 23.9 38.8 23.2 163 171 A F H X S+ 0 0 5 -4,-2.8 4,-2.9 -5,-0.4 5,-0.3 0.925 108.5 47.8 -63.4 -43.3 21.2 41.2 22.4 164 172 A K H X S+ 0 0 113 -4,-3.3 4,-2.1 -5,-0.3 -1,-0.2 0.939 113.9 47.8 -65.0 -37.4 23.7 43.9 21.7 165 173 A V H X S+ 0 0 66 -4,-2.0 4,-3.1 2,-0.2 -2,-0.2 0.976 115.7 42.5 -64.5 -53.0 25.8 41.6 19.6 166 174 A L H X S+ 0 0 0 -4,-3.4 4,-3.4 1,-0.2 -2,-0.2 0.941 112.6 53.9 -64.7 -40.4 22.9 40.3 17.5 167 175 A R H X S+ 0 0 35 -4,-2.9 4,-2.7 -5,-0.3 5,-0.3 0.896 111.1 47.5 -54.5 -38.8 21.4 43.8 17.2 168 176 A N H X S+ 0 0 82 -4,-2.1 4,-2.3 -5,-0.3 5,-0.3 0.957 111.5 49.1 -67.3 -44.0 24.8 44.9 15.9 169 177 A V H X S+ 0 0 33 -4,-3.1 4,-2.4 1,-0.2 5,-0.3 0.891 111.8 51.9 -58.4 -38.9 24.9 42.0 13.6 170 178 A T H X S+ 0 0 1 -4,-3.4 4,-3.0 1,-0.2 5,-0.4 0.928 108.9 47.0 -65.7 -48.8 21.4 42.9 12.5 171 179 A V H X S+ 0 0 28 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.910 114.8 46.3 -61.8 -40.5 22.0 46.5 11.7 172 180 A V H X S+ 0 0 101 -4,-2.3 4,-0.7 -5,-0.3 -1,-0.2 0.960 120.4 35.9 -73.3 -45.0 25.1 45.9 9.7 173 181 A L H >X S+ 0 0 28 -4,-2.4 3,-1.0 -5,-0.3 4,-1.0 0.970 117.0 49.7 -72.8 -46.0 23.8 43.0 7.6 174 182 A W H 3< S+ 0 0 11 -4,-3.0 3,-0.5 -5,-0.3 -1,-0.2 0.832 106.8 58.3 -62.9 -24.9 20.2 44.1 7.1 175 183 A S H 3X S+ 0 0 41 -4,-1.3 4,-0.9 -5,-0.4 -1,-0.3 0.729 98.9 59.9 -73.2 -22.8 21.5 47.5 6.0 176 184 A A H S+ 0 0 18 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.903 112.0 51.1 -60.7 -34.6 18.9 47.8 0.4 179 187 A V H X S+ 0 0 77 -4,-0.9 4,-2.5 2,-0.2 5,-0.3 0.933 110.5 47.2 -65.5 -43.7 22.3 48.7 -1.0 180 188 A V H X S+ 0 0 10 -4,-2.5 4,-2.6 1,-0.2 7,-0.2 0.939 114.1 48.3 -62.1 -43.4 22.7 45.4 -2.9 181 189 A W H < S+ 0 0 14 -4,-2.4 6,-0.5 -5,-0.3 8,-0.3 0.949 111.9 49.8 -63.6 -42.9 19.2 45.7 -4.2 182 190 A L H < S+ 0 0 53 -4,-2.5 6,-3.7 -5,-0.2 8,-0.2 0.913 120.2 33.7 -62.7 -42.5 19.8 49.3 -5.3 183 191 A I H < S+ 0 0 43 -4,-2.5 8,-2.6 4,-0.2 7,-1.8 0.730 112.8 73.0 -88.9 -19.6 23.0 48.6 -7.1 184 192 A G S ><>S- 0 0 0 -4,-2.6 5,-2.5 -5,-0.3 3,-1.5 0.057 106.0 -70.0 -87.2-161.3 22.0 45.2 -8.4 185 193 A S T 3 5S+ 0 0 17 1,-0.3 -4,-0.1 3,-0.2 8,-0.1 0.607 126.2 57.8 -76.9 -13.7 19.7 43.9 -11.0 186 194 A E T 3 5S+ 0 0 1 -5,-0.3 -1,-0.3 -6,-0.2 -4,-0.1 0.603 122.6 18.8 -78.3 -19.2 16.4 44.8 -9.2 187 195 A G T < 5S- 0 0 2 -3,-1.5 -4,-0.2 -6,-0.5 -5,-0.2 0.358 133.0 -12.8-122.4-113.3 17.6 48.4 -9.1 188 196 A A T 5S- 0 0 41 -6,-3.7 -5,-0.2 -7,-0.2 -3,-0.2 0.576 74.7-130.3 -83.5 -3.6 20.1 50.4 -11.0 189 197 A G < + 0 0 51 -5,-2.5 -5,-0.2 -8,-0.3 -4,-0.2 0.832 65.4 133.4 64.5 30.2 21.8 47.4 -12.6 190 198 A I + 0 0 121 -7,-1.8 -6,-0.2 -6,-0.3 -7,-0.1 0.797 69.2 44.8 -76.7 -39.1 25.3 48.6 -11.5 191 199 A V S S- 0 0 30 -8,-2.6 -1,-0.1 -11,-0.2 -6,-0.1 -0.931 97.0-115.2-110.6 127.9 26.3 45.2 -10.2 192 200 A P > - 0 0 75 0, 0.0 4,-2.7 0, 0.0 3,-0.4 -0.227 26.6-107.2 -66.4 158.1 25.4 42.1 -12.3 193 201 A L H > S+ 0 0 24 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.833 116.3 53.9 -52.7 -38.1 23.0 39.4 -11.1 194 202 A N H > S+ 0 0 51 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.928 112.0 44.1 -73.3 -33.1 25.6 36.8 -10.3 195 203 A I H > S+ 0 0 66 -3,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.885 113.1 52.5 -72.5 -37.4 27.5 39.1 -8.1 196 204 A E H X S+ 0 0 1 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.932 109.0 49.4 -61.3 -40.1 24.3 40.3 -6.5 197 205 A T H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.903 110.1 52.3 -68.8 -36.2 23.3 36.7 -5.8 198 206 A L H X S+ 0 0 44 -4,-1.9 4,-3.1 -5,-0.3 5,-0.3 0.972 111.0 46.7 -60.9 -49.1 26.7 36.1 -4.3 199 207 A L H X S+ 0 0 60 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.946 113.1 47.7 -57.4 -44.6 26.3 39.1 -2.1 200 208 A F H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 5,-0.2 0.873 111.3 52.4 -70.1 -30.8 22.8 38.1 -1.0 201 209 A M H X S+ 0 0 6 -4,-2.4 4,-2.9 -5,-0.2 5,-0.4 0.953 109.9 47.4 -67.2 -45.6 23.9 34.6 -0.3 202 210 A V H X S+ 0 0 75 -4,-3.1 4,-2.1 -5,-0.2 5,-0.2 0.967 116.7 44.6 -60.5 -42.2 26.8 35.8 1.9 203 211 A L H X S+ 0 0 21 -4,-2.9 4,-3.4 -5,-0.3 -2,-0.2 0.964 114.2 48.5 -63.9 -46.8 24.3 38.1 3.7 204 212 A D H X S+ 0 0 0 -4,-3.2 4,-1.9 2,-0.2 5,-0.5 0.919 112.6 46.8 -61.0 -48.8 21.6 35.5 4.0 205 213 A V H X>S+ 0 0 26 -4,-2.9 5,-2.5 -5,-0.2 4,-1.7 0.957 117.4 43.8 -60.6 -44.2 23.9 32.8 5.3 206 214 A S H <>S+ 0 0 44 -4,-2.1 5,-2.3 -5,-0.4 -2,-0.2 0.936 115.0 48.7 -67.4 -35.6 25.4 35.2 7.8 207 215 A A H <5S+ 0 0 1 -4,-3.4 -1,-0.2 -5,-0.2 -2,-0.2 0.758 127.5 24.8 -73.2 -20.8 22.1 36.6 8.8 208 216 A K H X5S+ 0 0 4 -4,-1.9 4,-1.4 -5,-0.2 -3,-0.2 0.850 135.2 24.3-106.7 -60.0 20.5 33.2 9.3 209 217 A V H X5S+ 0 0 18 -4,-1.7 4,-2.4 -5,-0.5 5,-0.2 0.933 127.2 44.0 -80.5 -47.4 23.2 30.7 10.0 210 218 A G H >< S+ 0 0 0 -4,-2.5 3,-0.8 -5,-0.2 6,-0.3 0.958 112.7 50.2 -69.3 -45.9 22.4 33.2 19.3 216 224 A L H 3< S+ 0 0 4 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.523 107.1 58.8 -74.0 -5.5 22.4 29.4 19.9 217 225 A R H 3< S+ 0 0 149 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.748 90.6 83.6 -87.8 -35.5 25.8 29.7 21.6 218 226 A S S X< S- 0 0 21 -4,-1.0 3,-0.9 -3,-0.8 4,-0.1 -0.337 74.4-138.8 -72.0 146.8 24.7 32.2 24.3 219 227 A R G > S+ 0 0 183 1,-0.2 3,-1.8 2,-0.1 -1,-0.1 0.500 88.3 96.3 -81.6 1.8 23.1 31.1 27.5 220 228 A A G 3 S+ 0 0 3 1,-0.3 -1,-0.2 -62,-0.2 -61,-0.1 0.773 73.9 63.3 -59.8 -22.7 20.9 34.1 27.0 221 229 A I G < S+ 0 0 0 -3,-0.9 2,-0.3 -6,-0.3 -1,-0.3 0.636 88.8 82.3 -80.9 -10.8 18.4 31.7 25.4 222 230 A F < 0 0 53 -3,-1.8 -3,-0.0 -188,-0.1 0, 0.0 -0.700 360.0 360.0 -95.4 143.8 17.8 29.7 28.6 223 231 A G 0 0 76 -2,-0.3 -1,-0.1 0, 0.0 -191,-0.0 -0.173 360.0 360.0 -60.4 360.0 15.4 30.8 31.3