==== 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 08-NOV-06 2NTW . COMPND 2 MOLECULE: BACTERIORHODOPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HALOBACTERIUM SALINARUM; . AUTHOR J.K.LANYI,B.SCHOBERT . 222 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10238.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 192 86.5 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 . 6 2.7 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 . 5 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 11.7 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 2 0 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 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 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 0 107 0, 0.0 5,-0.1 0, 0.0 57,-0.0 0.000 360.0 360.0 360.0-179.7 22.6 25.7 -15.6 2 6 A G + 0 0 87 3,-0.1 3,-0.1 4,-0.1 0, 0.0 0.379 360.0 94.9 -73.7 5.9 22.9 28.5 -18.0 3 7 A R > - 0 0 44 1,-0.2 3,-2.4 191,-0.0 4,-0.3 -0.876 65.2-154.9-102.6 118.1 22.8 31.0 -15.2 4 8 A P T > S+ 0 0 89 0, 0.0 3,-1.0 0, 0.0 4,-0.3 0.876 93.8 63.9 -60.8 -32.5 26.3 32.0 -13.9 5 9 A E T >> S+ 0 0 9 1,-0.2 4,-1.6 2,-0.1 3,-0.9 0.565 74.7 98.4 -67.4 -2.6 24.8 32.8 -10.5 6 10 A W H <> S+ 0 0 112 -3,-2.4 4,-2.5 1,-0.3 5,-0.2 0.871 74.5 59.3 -52.7 -40.8 23.9 29.1 -10.1 7 11 A I H <> S+ 0 0 70 -3,-1.0 4,-2.6 -4,-0.3 -1,-0.3 0.897 105.8 46.9 -61.6 -35.1 27.0 28.4 -8.0 8 12 A W H <> S+ 0 0 66 -3,-0.9 4,-1.8 -4,-0.3 -1,-0.2 0.881 110.9 52.0 -75.1 -30.3 26.0 30.9 -5.4 9 13 A L H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 48,-0.2 0.847 112.4 46.7 -68.0 -36.1 22.4 29.6 -5.3 10 14 A A H X S+ 0 0 27 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.920 112.4 48.8 -72.4 -46.0 23.8 26.0 -4.8 11 15 A L H X S+ 0 0 70 -4,-2.6 4,-2.5 -5,-0.2 5,-0.2 0.902 112.6 48.6 -59.2 -36.4 26.3 27.1 -2.1 12 16 A G H X S+ 0 0 0 -4,-1.8 4,-2.8 -5,-0.2 5,-0.2 0.943 109.9 51.6 -73.0 -36.1 23.5 29.0 -0.3 13 17 A T H X S+ 0 0 13 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.954 113.5 45.0 -54.9 -52.9 21.2 26.1 -0.5 14 18 A A H X S+ 0 0 41 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.956 114.2 47.4 -59.7 -50.0 23.9 23.8 1.0 15 19 A L H X S+ 0 0 62 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.937 113.4 47.9 -64.1 -35.8 24.9 26.2 3.7 16 20 A M H X S+ 0 0 0 -4,-2.8 4,-2.1 -5,-0.2 34,-0.2 0.907 112.2 50.3 -71.0 -33.6 21.3 26.9 4.7 17 21 A G H X S+ 0 0 12 -4,-2.5 4,-2.6 -5,-0.2 5,-0.2 0.930 112.4 47.0 -62.5 -49.6 20.6 23.1 4.7 18 22 A L H X S+ 0 0 108 -4,-2.8 4,-2.7 -5,-0.2 5,-0.2 0.902 110.7 50.6 -62.5 -44.0 23.6 22.4 6.9 19 23 A G H X S+ 0 0 7 -4,-2.2 4,-2.7 -5,-0.3 5,-0.2 0.956 109.9 52.1 -60.9 -41.2 22.8 25.2 9.3 20 24 A T H X S+ 0 0 17 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.958 111.5 45.3 -58.6 -51.0 19.2 23.9 9.7 21 25 A L H X S+ 0 0 110 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.942 112.2 53.0 -61.9 -40.5 20.4 20.4 10.4 22 26 A Y H X S+ 0 0 96 -4,-2.7 4,-3.2 1,-0.2 -2,-0.2 0.959 112.3 42.9 -58.0 -49.0 23.0 21.7 12.9 23 27 A F H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.855 112.3 54.9 -69.1 -31.2 20.5 23.7 14.9 24 28 A L H < S+ 0 0 100 -4,-2.3 4,-0.4 -5,-0.2 -1,-0.2 0.934 112.8 42.0 -64.0 -50.4 18.0 20.9 14.8 25 29 A V H >< S+ 0 0 92 -4,-2.7 3,-2.3 -5,-0.2 -2,-0.2 0.980 114.5 52.3 -56.3 -56.7 20.6 18.5 16.2 26 30 A K H 3< S+ 0 0 56 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.860 106.0 52.1 -51.3 -40.8 21.8 21.1 18.7 27 31 A G T >< S+ 0 0 20 -4,-2.3 3,-1.5 -5,-0.2 -1,-0.3 0.604 82.7 124.2 -78.2 -4.3 18.3 21.9 20.1 28 32 A M T < S+ 0 0 147 -3,-2.3 -3,-0.1 -4,-0.4 -4,-0.0 -0.307 78.5 10.2 -54.3 126.6 17.9 18.1 20.6 29 33 A G T 3 S+ 0 0 79 1,-0.3 -1,-0.2 -2,-0.1 -2,-0.1 0.052 85.0 146.0 98.5 -28.2 17.0 17.5 24.2 30 34 A V < + 0 0 33 -3,-1.5 -1,-0.3 -4,-0.2 -3,-0.0 -0.161 16.1 170.7 -57.0 126.1 16.3 21.1 25.3 31 35 A S + 0 0 93 4,-0.0 -1,-0.1 5,-0.0 -2,-0.0 0.668 41.4 106.4-111.9 -24.4 13.6 21.3 27.9 32 36 A D > - 0 0 37 1,-0.2 4,-2.7 2,-0.1 5,-0.2 -0.502 65.8-143.7 -63.0 118.3 13.7 24.9 29.2 33 37 A P H > S+ 0 0 84 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.815 98.5 54.3 -54.0 -36.9 10.6 26.4 27.5 34 38 A D H >> S+ 0 0 61 2,-0.2 4,-1.5 1,-0.2 3,-0.8 0.954 110.1 43.8 -60.0 -54.7 12.4 29.7 27.0 35 39 A A H 3> S+ 0 0 0 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.863 107.7 61.9 -59.5 -37.4 15.3 28.0 25.2 36 40 A K H 3X S+ 0 0 116 -4,-2.7 4,-2.4 1,-0.2 -1,-0.3 0.840 101.0 53.6 -55.6 -36.7 12.8 26.0 23.3 37 41 A K H S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.792 113.4 61.9 -72.0 -18.1 17.5 28.7 7.7 47 51 A A H X S+ 0 0 29 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.946 109.1 41.1 -67.6 -43.3 14.9 25.9 7.0 48 52 A I H X S+ 0 0 38 -4,-2.9 4,-2.1 -5,-0.2 5,-0.2 0.969 114.5 51.5 -64.4 -45.9 12.8 28.4 5.2 49 53 A A H X S+ 0 0 0 -4,-2.4 4,-3.2 -5,-0.3 5,-0.3 0.896 104.9 58.3 -59.3 -36.8 15.8 30.0 3.5 50 54 A F H X S+ 0 0 78 -4,-2.5 4,-2.5 -34,-0.2 5,-0.2 0.929 107.5 46.5 -53.3 -49.0 16.9 26.5 2.4 51 55 A T H X S+ 0 0 64 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.914 114.9 45.5 -67.4 -35.7 13.6 26.0 0.6 52 56 A M H X S+ 0 0 42 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.908 112.3 50.6 -77.1 -39.2 13.7 29.4 -1.1 53 57 A Y H X S+ 0 0 0 -4,-3.2 4,-2.9 -5,-0.2 5,-0.2 0.943 112.2 48.8 -57.0 -43.9 17.4 29.1 -2.1 54 58 A L H X S+ 0 0 59 -4,-2.5 4,-2.5 -5,-0.3 6,-0.3 0.943 107.6 54.0 -67.4 -34.7 16.6 25.7 -3.6 55 59 A S H <>S+ 0 0 18 -4,-2.1 6,-2.2 -5,-0.2 5,-1.0 0.885 111.3 46.4 -67.6 -26.8 13.6 27.1 -5.4 56 60 A M H ><5S+ 0 0 0 -4,-1.8 3,-1.1 4,-0.2 -2,-0.2 0.940 110.1 53.6 -73.0 -43.7 15.9 29.8 -6.9 57 61 A L H 3<5S+ 0 0 34 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.896 110.8 45.8 -53.3 -44.6 18.5 27.2 -7.8 58 62 A L T 3<5S- 0 0 126 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.540 118.5-109.1 -81.3 -6.7 15.9 25.0 -9.7 59 63 A G T X 5S+ 0 0 30 -3,-1.1 3,-0.9 -4,-0.4 -3,-0.2 0.346 90.7 108.5 101.5 -9.1 14.5 28.0 -11.5 60 64 A Y T 3 +A 70 0A 14 3,-2.6 3,-1.6 -2,-0.3 59,-0.1 -0.956 55.6 27.8-171.3 164.4 11.5 47.5 -17.5 68 72 A G T 3 S- 0 0 47 57,-0.4 3,-0.1 -2,-0.3 58,-0.1 0.807 133.6 -59.3 44.4 36.7 13.9 50.1 -18.7 69 73 A G T 3 S+ 0 0 76 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.746 118.6 86.3 67.6 30.5 13.3 48.5 -22.1 70 74 A E E < S-A 67 0A 117 -3,-1.6 -3,-2.6 -5,-0.1 2,-1.0 -0.990 81.2-105.2-154.6 161.9 14.4 44.9 -21.2 71 75 A Q E -A 66 0A 125 -2,-0.3 -3,-0.0 -5,-0.2 -7,-0.0 -0.806 42.1-162.9 -91.2 103.1 13.4 41.6 -19.6 72 76 A N E -A 65 0A 27 -7,-2.1 -7,-3.1 -2,-1.0 2,-0.8 -0.699 17.9-128.5 -92.8 129.1 15.1 41.6 -16.2 73 77 A P E -A 64 0A 43 0, 0.0 2,-0.6 0, 0.0 -9,-0.2 -0.622 31.2-171.5 -78.6 110.2 15.5 38.4 -14.3 74 78 A I E -A 63 0A 0 -11,-3.8 -11,-2.1 -2,-0.8 2,-1.5 -0.897 21.1-145.8-111.2 121.4 14.0 39.0 -10.9 75 79 A Y > + 0 0 0 -2,-0.6 3,-0.9 -13,-0.2 4,-0.3 -0.625 25.0 171.8 -77.5 89.4 14.4 36.4 -8.1 76 80 A W T >> + 0 0 80 -2,-1.5 4,-1.3 -15,-0.3 3,-1.3 0.720 64.2 78.3 -74.1 -20.8 11.1 36.9 -6.3 77 81 A A H 3> S+ 0 0 0 -16,-2.0 4,-1.9 1,-0.3 -1,-0.2 0.806 79.7 69.8 -65.8 -16.3 11.6 34.0 -4.0 78 82 A R H <> S+ 0 0 1 -3,-0.9 4,-2.8 -17,-0.3 -1,-0.3 0.918 98.5 49.9 -63.6 -34.6 13.9 36.1 -1.9 79 83 A Y H <> S+ 0 0 6 -3,-1.3 4,-2.2 -4,-0.3 -2,-0.2 0.866 106.6 53.3 -73.2 -32.7 10.9 38.1 -0.8 80 84 A A H X S+ 0 0 28 -4,-1.3 4,-0.7 2,-0.2 -1,-0.2 0.901 113.7 46.0 -63.7 -34.6 8.9 35.0 0.1 81 85 A D H >X S+ 0 0 1 -4,-1.9 4,-2.8 2,-0.2 3,-1.2 0.987 115.3 43.2 -62.2 -62.6 11.9 34.0 2.2 82 86 A W H 3X S+ 0 0 18 -4,-2.8 4,-2.0 1,-0.3 -2,-0.2 0.822 101.3 70.1 -59.4 -32.5 12.4 37.4 3.9 83 87 A L H 3< S+ 0 0 79 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.890 116.6 23.2 -54.7 -35.8 8.7 37.8 4.5 84 88 A F H S+ 0 0 23 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.931 110.3 55.0 -64.1 -34.2 10.2 38.9 11.5 88 92 A L H X S+ 0 0 35 -4,-1.2 4,-1.8 2,-0.2 -2,-0.2 0.927 106.7 50.1 -62.7 -38.8 11.4 35.7 13.1 89 93 A L H X S+ 0 0 8 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.927 111.7 49.1 -64.6 -40.8 14.8 37.2 13.5 90 94 A L H X S+ 0 0 1 -4,-2.2 4,-3.0 1,-0.2 -1,-0.2 0.875 106.0 55.8 -66.9 -32.2 13.2 40.3 15.1 91 95 A L H X S+ 0 0 53 -4,-2.6 4,-3.2 -5,-0.2 -1,-0.2 0.926 103.9 54.8 -64.9 -39.4 11.2 38.0 17.4 92 96 A D H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.916 112.8 43.2 -56.8 -47.0 14.5 36.5 18.6 93 97 A L H X S+ 0 0 2 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.957 114.9 49.5 -62.8 -48.7 15.7 40.0 19.5 94 98 A A H <>S+ 0 0 0 -4,-3.0 5,-2.4 1,-0.2 4,-0.3 0.905 110.8 48.7 -60.4 -42.6 12.4 40.9 21.0 95 99 A L H ><5S+ 0 0 52 -4,-3.2 3,-1.2 3,-0.2 -1,-0.2 0.891 103.4 61.6 -68.0 -38.2 12.1 37.8 23.2 96 100 A L H 3<5S+ 0 0 8 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.935 114.2 34.8 -47.4 -50.9 15.7 38.2 24.5 97 101 A V T 3<5S- 0 0 17 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.358 110.8-118.2 -94.6 9.0 14.8 41.5 26.0 98 102 A D T < 5 - 0 0 135 -3,-1.2 -3,-0.2 -4,-0.3 -4,-0.1 0.968 42.1-159.2 59.6 50.8 11.2 40.6 27.0 99 103 A A < - 0 0 15 -5,-2.4 -1,-0.1 1,-0.1 53,-0.1 -0.347 19.5-102.9 -66.9 150.7 9.7 43.3 24.8 100 104 A D > - 0 0 126 1,-0.1 4,-2.0 4,-0.0 3,-0.4 -0.296 31.7-116.7 -59.6 149.5 6.2 44.6 25.3 101 105 A Q H > S+ 0 0 171 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.874 113.8 57.8 -65.1 -35.1 3.6 43.2 22.8 102 106 A G H > S+ 0 0 60 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.876 106.6 49.2 -63.3 -32.6 2.9 46.6 21.3 103 107 A T H > S+ 0 0 34 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.887 110.7 50.2 -74.0 -38.7 6.6 46.9 20.4 104 108 A I H X S+ 0 0 35 -4,-2.0 4,-2.5 2,-0.2 5,-0.4 0.926 109.8 49.5 -64.1 -42.6 6.6 43.4 18.9 105 109 A L H X S+ 0 0 124 -4,-2.8 4,-2.5 1,-0.2 5,-0.3 0.957 109.6 53.9 -65.6 -38.1 3.6 44.2 16.8 106 110 A A H X S+ 0 0 32 -4,-2.0 4,-2.2 -5,-0.2 5,-0.2 0.910 112.0 43.8 -52.9 -45.4 5.3 47.4 15.7 107 111 A L H X S+ 0 0 2 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.955 114.2 47.6 -70.1 -51.1 8.4 45.5 14.5 108 112 A V H X S+ 0 0 59 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.941 115.8 45.9 -55.3 -46.5 6.5 42.7 12.7 109 113 A G H X S+ 0 0 33 -4,-2.5 4,-2.1 -5,-0.4 -2,-0.2 0.946 112.6 47.8 -68.7 -40.9 4.3 45.1 10.9 110 114 A A H X S+ 0 0 11 -4,-2.2 4,-2.7 -5,-0.3 -1,-0.2 0.893 112.5 52.5 -63.7 -34.3 7.0 47.5 9.9 111 115 A D H X S+ 0 0 1 -4,-2.5 4,-2.7 -5,-0.2 5,-0.4 0.945 106.3 51.4 -64.6 -45.1 8.9 44.4 8.7 112 116 A G H X S+ 0 0 31 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.921 111.7 48.4 -56.8 -37.6 6.0 43.2 6.6 113 117 A I H X S+ 0 0 97 -4,-2.1 4,-2.6 -5,-0.2 5,-0.4 0.949 109.2 53.6 -67.3 -42.1 5.8 46.7 5.1 114 118 A M H X S+ 0 0 18 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.951 115.9 37.2 -55.4 -52.9 9.5 46.6 4.4 115 119 A I H X S+ 0 0 11 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.938 116.1 51.3 -73.2 -41.4 9.5 43.3 2.6 116 120 A G H X S+ 0 0 31 -4,-2.5 4,-2.4 -5,-0.4 -2,-0.2 0.925 111.9 45.8 -66.3 -35.7 6.2 43.8 0.8 117 121 A T H X S+ 0 0 17 -4,-2.6 4,-2.8 -5,-0.3 -1,-0.2 0.880 110.2 56.1 -74.0 -30.4 7.1 47.2 -0.6 118 122 A G H X S+ 0 0 10 -4,-1.8 4,-2.2 -5,-0.4 -2,-0.2 0.918 109.3 47.2 -57.0 -40.1 10.5 45.6 -1.6 119 123 A L H X S+ 0 0 58 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.946 110.5 50.0 -70.9 -42.2 8.6 43.0 -3.5 120 124 A V H X S+ 0 0 62 -4,-2.4 4,-1.0 -5,-0.2 3,-0.4 0.968 111.9 49.2 -57.6 -47.7 6.3 45.6 -5.2 121 125 A G H >< S+ 0 0 0 -4,-2.8 3,-0.6 1,-0.2 -2,-0.2 0.919 108.3 54.5 -58.9 -36.7 9.4 47.5 -6.2 122 126 A A H 3< S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.867 116.0 37.1 -64.6 -32.5 11.0 44.4 -7.5 123 127 A L H 3< S+ 0 0 72 -4,-1.8 2,-0.3 -3,-0.4 -1,-0.2 0.412 86.8 118.3-102.3 0.5 8.1 43.6 -9.8 124 128 A T << - 0 0 23 -4,-1.0 6,-0.1 -3,-0.6 -59,-0.0 -0.471 48.9-158.5 -72.9 132.5 7.2 47.2 -10.8 125 129 A K S S+ 0 0 140 -2,-0.3 2,-0.8 -58,-0.1 -57,-0.4 0.733 71.6 83.6 -91.1 -17.2 7.5 47.8 -14.6 126 130 A V S >> S- 0 0 74 1,-0.2 4,-1.1 -59,-0.1 3,-0.6 -0.801 74.2-148.6 -84.9 109.6 7.9 51.6 -14.5 127 131 A Y H >> S+ 0 0 91 -2,-0.8 3,-1.0 1,-0.2 4,-0.7 0.885 90.8 50.5 -50.5 -52.3 11.6 52.0 -13.8 128 132 A S H >> S+ 0 0 83 1,-0.3 3,-1.0 2,-0.2 4,-0.7 0.899 106.1 56.5 -55.3 -38.0 11.4 55.3 -11.9 129 133 A Y H X> S+ 0 0 139 -3,-0.6 4,-1.9 1,-0.2 3,-0.6 0.791 89.1 74.7 -69.5 -23.6 8.7 54.0 -9.6 130 134 A R H X S+ 0 0 133 -4,-2.3 4,-2.2 1,-0.2 3,-0.6 0.933 108.6 48.5 -54.8 -47.6 15.4 52.9 15.5 147 151 A V H 3X S+ 0 0 9 -4,-2.7 4,-2.1 1,-0.3 -1,-0.2 0.930 107.0 56.3 -64.7 -35.9 13.1 50.8 17.6 148 152 A L H 3< S+ 0 0 1 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.787 117.2 35.6 -64.9 -23.2 15.9 48.3 18.2 149 153 A F H << S+ 0 0 80 -4,-1.2 -2,-0.2 -3,-0.6 -1,-0.2 0.660 134.6 18.4-102.9 -17.2 18.1 51.1 19.6 150 154 A F H < S+ 0 0 149 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 0.464 108.3 71.4-134.5 -2.0 15.6 53.3 21.4 151 155 A G < 0 0 37 -4,-2.1 -3,-0.1 -5,-0.3 -4,-0.1 0.353 360.0 360.0 -99.5 -3.3 12.4 51.2 22.0 152 156 A F 0 0 86 -5,-0.2 -1,-0.2 -4,-0.1 -4,-0.0 -0.322 360.0 360.0-117.3 360.0 13.9 48.9 24.7 153 ! 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 0 147 0, 0.0 -57,-0.0 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 20.3 17.9 46.8 31.6 155 163 A M - 0 0 65 1,-0.2 5,-0.1 -58,-0.1 -58,-0.1 0.114 360.0 -42.1 -70.0-176.5 17.5 43.0 32.0 156 164 A R > - 0 0 106 1,-0.1 4,-2.4 3,-0.1 3,-0.4 -0.086 61.8-109.7 -52.7 148.9 20.1 40.5 33.4 157 165 A P H > S+ 0 0 110 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.795 115.4 51.5 -54.6 -38.2 23.7 41.0 32.2 158 166 A E H > S+ 0 0 88 2,-0.2 4,-1.7 1,-0.2 5,-0.3 0.920 111.2 48.8 -73.6 -34.0 23.8 37.9 30.1 159 167 A V H > S+ 0 0 1 -3,-0.4 4,-2.7 2,-0.2 5,-0.2 0.985 112.2 48.2 -62.3 -52.3 20.6 38.8 28.3 160 168 A A H X S+ 0 0 10 -4,-2.4 4,-3.7 1,-0.2 5,-0.3 0.936 110.9 50.3 -52.7 -53.8 21.8 42.4 27.6 161 169 A S H X S+ 0 0 73 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.885 113.7 42.6 -55.4 -44.4 25.2 41.4 26.3 162 170 A T H X S+ 0 0 21 -4,-1.7 4,-2.7 -5,-0.2 5,-0.3 0.929 115.2 52.1 -71.5 -37.1 24.0 38.9 23.8 163 171 A F H X S+ 0 0 8 -4,-2.7 4,-2.7 -5,-0.3 5,-0.2 0.927 108.4 49.9 -63.4 -43.8 21.2 41.2 22.8 164 172 A K H X S+ 0 0 104 -4,-3.7 4,-1.6 -5,-0.2 -1,-0.2 0.889 112.2 48.9 -63.9 -32.7 23.7 44.1 22.2 165 173 A V H X S+ 0 0 67 -4,-1.8 4,-2.0 -5,-0.3 -2,-0.2 0.945 114.0 43.2 -69.9 -43.7 25.8 41.8 20.1 166 174 A L H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 -2,-0.2 0.889 110.2 57.5 -73.3 -33.5 23.0 40.5 17.9 167 175 A R H X S+ 0 0 37 -4,-2.7 4,-2.7 -5,-0.3 5,-0.2 0.922 108.6 46.1 -58.6 -40.4 21.5 44.0 17.6 168 176 A N H X S+ 0 0 79 -4,-1.6 4,-2.1 -5,-0.2 5,-0.2 0.893 111.8 50.3 -74.2 -35.0 24.8 45.2 16.1 169 177 A V H X S+ 0 0 36 -4,-2.0 4,-2.5 -5,-0.2 5,-0.3 0.938 111.0 52.3 -59.0 -43.7 25.1 42.3 13.8 170 178 A T H X S+ 0 0 2 -4,-3.0 4,-2.5 1,-0.2 5,-0.4 0.945 109.0 46.3 -63.7 -49.5 21.5 43.0 12.8 171 179 A V H X S+ 0 0 29 -4,-2.7 4,-1.9 1,-0.2 5,-0.2 0.950 113.9 49.6 -61.1 -42.6 22.1 46.7 12.0 172 180 A V H X S+ 0 0 105 -4,-2.1 4,-0.7 -5,-0.2 -1,-0.2 0.971 118.5 35.2 -62.9 -46.3 25.2 46.0 10.0 173 181 A L H >X S+ 0 0 26 -4,-2.5 3,-0.8 -5,-0.2 4,-0.8 0.959 116.6 51.0 -75.9 -43.5 23.9 43.3 7.8 174 182 A W H >< S+ 0 0 14 -4,-2.5 3,-1.1 -5,-0.3 -1,-0.2 0.908 105.4 59.1 -58.5 -39.6 20.3 44.5 7.3 175 183 A S H 3X S+ 0 0 46 -4,-1.9 4,-0.8 -5,-0.4 -1,-0.2 0.791 98.9 58.9 -61.7 -24.2 21.6 47.9 6.3 176 184 A A H S+ 0 0 19 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.885 111.9 52.2 -59.1 -33.8 19.0 48.1 0.5 179 187 A V H X S+ 0 0 79 -4,-0.8 4,-2.3 2,-0.2 5,-0.3 0.944 108.9 48.3 -66.0 -41.2 22.4 49.0 -1.0 180 188 A V H X S+ 0 0 12 -4,-2.4 4,-2.0 1,-0.2 7,-0.2 0.962 112.7 48.8 -63.8 -44.4 22.7 45.8 -2.8 181 189 A W H < S+ 0 0 15 -4,-2.4 6,-0.5 -5,-0.2 5,-0.2 0.930 110.1 52.3 -59.7 -44.7 19.3 46.1 -4.2 182 190 A L H < S+ 0 0 57 -4,-2.4 6,-3.5 -5,-0.2 7,-0.2 0.904 117.9 34.6 -62.4 -39.4 19.9 49.7 -5.3 183 191 A I H < S+ 0 0 50 -4,-2.3 8,-2.5 4,-0.2 7,-1.5 0.683 111.6 74.1 -92.7 -13.1 23.1 48.9 -7.2 184 192 A G S ><>S- 0 0 1 -4,-2.0 5,-2.7 -5,-0.3 3,-1.2 0.030 104.8 -68.9 -88.9-161.4 22.1 45.5 -8.5 185 193 A S T 3 5S+ 0 0 18 1,-0.3 -4,-0.1 6,-0.2 8,-0.1 0.609 127.4 54.6 -68.8 -22.7 19.7 44.1 -11.2 186 194 A E T 3 5S+ 0 0 0 -5,-0.2 -1,-0.3 7,-0.0 -4,-0.1 0.606 122.9 20.3 -80.9 -21.3 16.5 45.2 -9.4 187 195 A G T < 5S- 0 0 2 -3,-1.2 -4,-0.2 -6,-0.5 -5,-0.2 0.389 133.0 -12.7-118.1-112.7 17.7 48.8 -9.1 188 196 A A T 5S- 0 0 42 -6,-3.5 -5,-0.2 -7,-0.2 -3,-0.2 0.678 75.1-131.4 -79.6 -13.2 20.3 50.7 -11.1 189 197 A G < + 0 0 51 -5,-2.7 -5,-0.2 -7,-0.2 -4,-0.2 0.819 64.2 133.8 70.8 28.1 21.9 47.6 -12.7 190 198 A I + 0 0 115 -7,-1.5 -6,-0.2 -6,-0.3 -7,-0.1 0.769 66.6 47.0 -74.7 -38.4 25.4 48.8 -11.7 191 199 A V S S- 0 0 25 -8,-2.5 -6,-0.2 -11,-0.2 -1,-0.1 -0.945 95.3-113.1-114.1 126.4 26.4 45.3 -10.5 192 200 A P > - 0 0 75 0, 0.0 4,-2.6 0, 0.0 3,-0.2 -0.105 27.9-110.4 -57.0 155.5 25.6 42.2 -12.5 193 201 A L H > S+ 0 0 25 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.819 116.2 57.1 -57.1 -33.5 23.1 39.6 -11.2 194 202 A N H > S+ 0 0 58 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.931 111.4 41.4 -69.8 -40.7 25.8 37.0 -10.5 195 203 A I H > S+ 0 0 72 -3,-0.2 4,-2.5 2,-0.2 5,-0.2 0.887 114.6 53.7 -69.6 -35.1 27.7 39.4 -8.2 196 204 A E H X S+ 0 0 1 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.963 108.2 48.6 -62.4 -44.2 24.4 40.5 -6.8 197 205 A T H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.889 109.5 53.1 -64.5 -36.2 23.4 37.0 -6.0 198 206 A L H X S+ 0 0 52 -4,-1.9 4,-2.7 -5,-0.2 5,-0.2 0.957 109.0 49.4 -63.1 -44.1 26.8 36.3 -4.4 199 207 A L H X S+ 0 0 64 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.921 111.6 47.5 -59.5 -43.1 26.3 39.3 -2.2 200 208 A F H X S+ 0 0 1 -4,-2.4 4,-3.0 -5,-0.2 5,-0.2 0.885 110.3 53.9 -67.9 -33.0 22.8 38.3 -1.0 201 209 A M H X S+ 0 0 8 -4,-2.1 4,-2.5 -5,-0.2 5,-0.3 0.937 109.5 47.1 -65.6 -46.4 24.1 34.8 -0.4 202 210 A V H X S+ 0 0 75 -4,-2.7 4,-1.7 -5,-0.2 5,-0.2 0.951 116.2 44.2 -61.3 -43.5 26.8 36.1 1.9 203 211 A L H X S+ 0 0 23 -4,-2.5 4,-2.7 -5,-0.2 5,-0.3 0.961 113.5 50.9 -63.8 -45.0 24.5 38.4 3.7 204 212 A D H X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.2 5,-0.5 0.929 110.8 47.0 -59.3 -47.8 21.7 35.8 4.0 205 213 A V H X>S+ 0 0 26 -4,-2.5 5,-2.8 -5,-0.2 4,-1.2 0.936 115.4 47.0 -64.0 -38.2 24.0 33.1 5.4 206 214 A S H <>S+ 0 0 45 -4,-1.7 5,-2.0 -5,-0.3 -2,-0.2 0.922 115.2 43.5 -68.2 -40.0 25.5 35.5 7.9 207 215 A A H <5S+ 0 0 4 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.754 128.2 30.1 -77.9 -20.9 22.2 37.0 9.2 208 216 A K H X5S+ 0 0 5 -4,-1.7 4,-1.4 -5,-0.3 -3,-0.2 0.886 135.5 20.1-102.3 -65.8 20.6 33.6 9.3 209 217 A V H X5S+ 0 0 19 -4,-1.2 4,-1.9 -5,-0.5 -3,-0.2 0.916 128.5 47.6 -77.8 -42.1 23.3 31.0 10.1 210 218 A G H >X S+ 0 0 65 -4,-2.0 4,-0.6 -5,-0.2 3,-0.6 0.951 115.9 42.8 -57.4 -47.1 25.8 33.4 18.2 215 223 A L H >< S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.2 6,-0.3 0.949 112.2 50.4 -65.8 -46.4 22.5 33.2 19.8 216 224 A L H 3< S+ 0 0 3 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.502 106.7 54.8 -78.0 -6.4 22.2 29.5 20.4 217 225 A R H << S+ 0 0 173 -4,-0.9 -1,-0.3 -3,-0.6 2,-0.2 0.539 92.8 91.2 -99.2 -11.6 25.7 29.3 22.1 218 226 A S S X< S- 0 0 19 -3,-1.1 3,-0.9 -4,-0.6 -59,-0.0 -0.533 73.1-142.5 -79.6 145.2 24.7 32.0 24.6 219 227 A R G > S+ 0 0 158 1,-0.2 3,-1.8 -2,-0.2 -1,-0.1 0.494 87.5 94.8 -86.3 3.7 23.1 31.0 27.9 220 228 A A G 3 S+ 0 0 3 1,-0.3 -1,-0.2 -62,-0.2 -4,-0.1 0.795 73.3 65.7 -60.0 -24.6 21.0 34.1 27.4 221 229 A I G < S+ 0 0 1 -3,-0.9 2,-0.4 -6,-0.3 -183,-0.3 0.535 88.1 80.0 -79.9 -4.6 18.3 31.8 25.9 222 230 A F < 0 0 45 -3,-1.8 -3,-0.0 -188,-0.2 0, 0.0 -0.796 360.0 360.0-103.0 146.0 17.6 29.9 29.1 223 231 A G 0 0 70 -2,-0.4 -1,-0.1 0, 0.0 -191,-0.1 -0.022 360.0 360.0 -72.7 360.0 15.4 31.1 31.9