==== 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 15-JUL-00 1FBB . COMPND 2 MOLECULE: BACTERIORHODOPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HALOBACTERIUM SALINARUM; . AUTHOR S.SUBRAMANIAM,R.HENDERSON . 224 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10861.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 202 90.2 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 . 4 1.8 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 0.4 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 . 11 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 145 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 1 0 0 0 0 0 0 0 0 1 0 0 1 0 2 0 1 0 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 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 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 4 A I 0 0 70 0, 0.0 197,-0.1 0, 0.0 198,-0.0 0.000 360.0 360.0 360.0 -50.6 22.9 1.2 -15.2 2 5 A T - 0 0 74 71,-0.1 73,-0.0 196,-0.0 71,-0.0 0.101 360.0 -24.4 174.1 50.4 19.5 -0.3 -14.6 3 6 A G S S+ 0 0 33 71,-0.0 59,-0.0 59,-0.0 60,-0.0 0.471 128.0 57.3 114.6 4.0 19.7 -3.8 -13.1 4 7 A R S > S+ 0 0 176 3,-0.0 3,-1.0 2,-0.0 4,-0.2 0.656 90.6 54.8-130.3 -46.6 23.1 -5.1 -14.3 5 8 A P T > S+ 0 0 49 0, 0.0 3,-0.5 0, 0.0 194,-0.0 0.901 115.8 39.0 -61.4 -41.0 26.2 -3.0 -13.3 6 9 A E T 3> S+ 0 0 0 1,-0.2 4,-2.4 2,-0.1 5,-0.2 0.228 74.2 114.9 -94.4 13.1 25.4 -3.0 -9.5 7 10 A W H <> S+ 0 0 139 -3,-1.0 4,-2.4 2,-0.2 -1,-0.2 0.834 79.3 58.7 -49.4 -28.8 24.2 -6.6 -9.3 8 11 A I H <> S+ 0 0 55 -3,-0.5 4,-2.8 -4,-0.2 3,-0.5 0.991 104.0 39.8 -63.5 -81.8 27.4 -6.9 -7.2 9 12 A W H > S+ 0 0 78 1,-0.3 4,-3.2 2,-0.2 5,-0.2 0.850 116.9 56.0 -36.0 -46.6 26.9 -4.4 -4.4 10 13 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -1,-0.3 0.954 109.1 43.5 -52.1 -58.9 23.2 -5.6 -4.4 11 14 A A H X S+ 0 0 35 -4,-2.4 4,-2.5 -3,-0.5 -1,-0.2 0.916 115.0 51.6 -52.0 -46.4 24.3 -9.3 -3.9 12 15 A L H X S+ 0 0 79 -4,-2.8 4,-1.7 1,-0.2 -1,-0.3 0.871 109.0 50.6 -58.8 -39.5 26.8 -8.0 -1.3 13 16 A G H X S+ 0 0 2 -4,-3.2 4,-2.4 -5,-0.3 -1,-0.2 0.860 109.1 49.9 -68.3 -37.1 24.0 -6.1 0.5 14 17 A T H X S+ 0 0 14 -4,-2.4 4,-2.5 40,-0.3 5,-0.4 0.966 109.2 51.9 -66.5 -48.5 21.8 -9.2 0.6 15 18 A A H X S+ 0 0 53 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.861 114.1 44.5 -53.6 -40.6 24.6 -11.3 2.1 16 19 A L H X S+ 0 0 61 -4,-1.7 4,-2.5 -5,-0.2 -1,-0.2 0.929 112.3 48.2 -72.6 -48.1 25.2 -8.7 4.8 17 20 A M H X S+ 0 0 1 -4,-2.4 4,-1.3 1,-0.2 34,-0.2 0.942 118.1 42.0 -57.2 -50.8 21.5 -8.0 5.8 18 21 A G H X S+ 0 0 7 -4,-2.5 4,-2.7 -5,-0.2 5,-0.2 0.816 110.5 54.8 -68.8 -34.5 20.7 -11.7 6.0 19 22 A L H X S+ 0 0 117 -4,-1.4 4,-2.2 -5,-0.4 -2,-0.2 0.978 108.8 49.7 -63.0 -49.8 23.9 -12.6 7.8 20 23 A G H X S+ 0 0 8 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.823 110.1 53.5 -54.4 -33.1 23.1 -10.0 10.4 21 24 A T H X S+ 0 0 15 -4,-1.3 4,-2.2 2,-0.2 5,-0.3 0.980 107.2 47.0 -67.0 -57.4 19.7 -11.6 10.6 22 25 A L H X S+ 0 0 102 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.842 111.3 56.8 -54.1 -32.3 20.8 -15.1 11.2 23 26 A Y H < S+ 0 0 131 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.984 108.2 41.9 -64.1 -60.6 23.2 -13.7 13.8 24 27 A F H >X S+ 0 0 6 -4,-2.2 3,-1.7 1,-0.2 4,-1.1 0.963 111.0 56.3 -51.8 -57.6 20.6 -11.9 16.0 25 28 A L H >< S+ 0 0 96 -4,-2.2 3,-0.8 1,-0.3 2,-0.7 0.882 110.2 47.0 -40.2 -46.9 18.2 -14.8 15.8 26 29 A V T 3< S+ 0 0 97 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.1 -0.291 113.8 49.8 -92.5 48.9 21.1 -16.9 17.2 27 30 A K T <4 S+ 0 0 70 -3,-1.7 4,-0.3 -2,-0.7 -1,-0.2 0.316 102.4 54.0-158.7 -9.6 21.8 -14.4 19.9 28 31 A G S << S+ 0 0 24 -4,-1.1 -2,-0.1 -3,-0.8 -3,-0.1 0.355 78.1 102.0-110.4 -1.6 18.4 -13.7 21.4 29 32 A M S S+ 0 0 138 -4,-0.4 -1,-0.1 -5,-0.3 -3,-0.1 0.921 87.3 38.6 -45.0 -56.8 17.9 -17.4 22.0 30 33 A G S S+ 0 0 67 -3,-0.0 -2,-0.1 2,-0.0 -1,-0.1 0.990 77.4 133.5 -58.8 -84.0 18.8 -17.0 25.7 31 34 A V + 0 0 42 -4,-0.3 -3,-0.1 1,-0.1 -4,-0.0 0.804 20.6 171.4 27.1 107.3 17.2 -13.7 26.8 32 35 A S + 0 0 118 1,-0.0 -1,-0.1 2,-0.0 3,-0.0 0.804 55.5 85.3-101.2 -48.0 15.4 -13.9 30.1 33 36 A D > - 0 0 84 1,-0.2 4,-1.9 2,-0.0 -1,-0.0 -0.394 62.6-159.6 -59.6 115.5 14.6 -10.3 30.7 34 37 A P H > S+ 0 0 86 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.883 88.7 66.0 -66.3 -34.0 11.3 -9.5 28.9 35 38 A D H >> S+ 0 0 88 1,-0.2 4,-0.7 2,-0.2 3,-0.7 0.945 108.7 35.3 -50.0 -56.8 12.3 -5.8 29.0 36 39 A A H 3> S+ 0 0 29 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.860 102.8 74.7 -67.9 -35.8 15.3 -6.3 26.8 37 40 A K H 3X S+ 0 0 117 -4,-1.9 4,-2.4 1,-0.2 5,-0.2 0.864 90.2 61.2 -44.6 -39.9 13.6 -8.9 24.7 38 41 A K H X S+ 0 0 61 -4,-2.4 4,-1.9 1,-0.2 3,-0.8 0.856 121.2 39.9 -37.1 -51.6 12.5 -8.6 18.5 42 45 A I H 3X S+ 0 0 23 -4,-2.4 4,-1.7 -5,-0.2 3,-0.4 0.986 109.9 56.2 -62.9 -63.5 12.6 -5.1 17.1 43 46 A T H 3< S+ 0 0 5 -4,-4.0 -1,-0.2 -5,-0.3 -2,-0.2 0.392 113.9 46.2 -55.4 8.8 16.3 -5.0 16.5 44 47 A T H <> S+ 0 0 19 -3,-0.8 4,-2.4 -4,-0.4 -1,-0.2 0.706 99.7 57.6-120.5 -44.1 15.8 -8.1 14.4 45 48 A L H X S+ 0 0 94 -4,-1.9 4,-3.4 -3,-0.4 5,-0.5 0.966 102.9 63.9 -51.7 -47.9 12.8 -7.5 12.1 46 49 A V H X S+ 0 0 2 -4,-1.7 4,-2.8 1,-0.2 -1,-0.2 0.893 107.1 36.9 -42.0 -62.4 14.8 -4.6 10.9 47 50 A P H > S+ 0 0 2 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.974 118.2 52.8 -58.6 -49.5 17.6 -6.6 9.4 48 51 A A H >X S+ 0 0 30 -4,-2.4 4,-1.9 2,-0.2 3,-0.5 0.934 114.3 39.7 -47.3 -62.3 15.2 -9.4 8.3 49 52 A I H 3X S+ 0 0 46 -4,-3.4 4,-2.1 1,-0.3 3,-0.4 0.948 112.9 57.0 -54.8 -48.5 12.9 -7.0 6.4 50 53 A A H 3X S+ 0 0 0 -4,-2.8 4,-2.3 -5,-0.5 -1,-0.3 0.854 105.5 53.1 -48.6 -38.6 15.9 -5.2 5.2 51 54 A F H < S+ 0 0 38 -4,-1.5 3,-0.9 -5,-0.2 -1,-0.1 -0.501 100.3 95.7 143.5 -73.2 14.8 -7.6 -10.3 61 64 A Y T 3 S+ 0 0 178 1,-0.2 -4,-0.2 -2,-0.1 -5,-0.1 0.668 77.6 78.2 -22.1 -38.5 11.4 -6.8 -8.8 62 65 A G T 3 S+ 0 0 0 -6,-3.0 15,-0.6 -7,-0.1 16,-0.6 0.922 84.5 56.5 -40.8 -77.3 13.3 -4.0 -7.0 63 66 A L < - 0 0 28 -3,-0.9 2,-0.3 -6,-0.4 13,-0.2 0.170 55.2-177.4 -58.6 173.0 13.6 -1.3 -9.6 64 67 A T - 0 0 51 9,-0.1 11,-1.5 2,-0.0 2,-0.6 -0.910 32.5-105.7-159.8 169.5 11.1 0.5 -11.8 65 68 A M E -A 74 0A 106 -2,-0.3 -63,-0.0 9,-0.2 -2,-0.0 -0.830 31.3-172.4-114.5 95.1 11.3 3.1 -14.6 66 69 A V E -A 73 0A 8 7,-2.3 7,-2.7 -2,-0.6 2,-0.7 -0.739 18.1-138.8 -89.7 126.7 10.4 6.7 -13.5 67 70 A P E +A 72 0A 77 0, 0.0 2,-0.4 0, 0.0 5,-0.2 -0.761 36.5 154.0 -87.0 108.7 10.2 9.2 -16.4 68 71 A F - 0 0 14 3,-1.4 3,-0.4 -2,-0.7 59,-0.1 -0.939 58.0 -18.6-146.4 123.1 11.6 12.7 -15.5 69 72 A G S S- 0 0 67 57,-0.6 2,-0.4 -2,-0.4 3,-0.1 0.789 125.7 -30.8 62.2 36.9 13.2 15.5 -17.4 70 73 A G S S+ 0 0 77 1,-0.2 -1,-0.2 0, 0.0 2,-0.1 -0.720 120.3 37.8 129.8 -85.0 14.1 13.7 -20.7 71 74 A E S S- 0 0 138 -3,-0.4 -3,-1.4 -2,-0.4 2,-0.6 -0.330 85.3 -85.2-101.4-179.3 14.9 10.1 -20.2 72 75 A Q E -A 67 0A 123 -5,-0.2 -1,-0.1 -2,-0.1 -6,-0.0 -0.765 44.4-161.7 -89.4 117.2 13.8 7.0 -18.1 73 76 A N E -A 66 0A 23 -7,-2.7 -7,-2.3 -2,-0.6 2,-0.2 -0.759 16.9-115.5-105.2 145.3 15.5 6.8 -14.7 74 77 A P E -A 65 0A 13 0, 0.0 2,-0.3 0, 0.0 -9,-0.2 -0.480 28.4-179.9 -75.7 141.7 15.8 3.9 -12.3 75 78 A I - 0 0 0 -11,-1.5 2,-2.6 -2,-0.2 3,-0.2 -0.751 21.6-153.5-147.1 93.6 14.1 3.9 -8.9 76 79 A Y >> + 0 0 3 -2,-0.3 3,-1.9 1,-0.2 4,-0.6 -0.447 19.1 177.0 -64.0 84.2 14.5 0.9 -6.5 77 80 A W H 3> S+ 0 0 82 -2,-2.6 4,-1.7 -15,-0.6 -1,-0.2 0.768 70.7 82.2 -61.8 -18.7 11.2 1.8 -4.9 78 81 A A H 3> S+ 0 0 0 -16,-0.6 4,-2.1 2,-0.2 -1,-0.3 0.811 82.7 59.1 -52.4 -34.8 12.1 -1.4 -3.0 79 82 A R H <> S+ 0 0 1 -3,-1.9 4,-1.4 1,-0.2 3,-0.4 0.998 102.5 50.2 -56.9 -69.7 14.3 0.7 -0.8 80 83 A Y H X S+ 0 0 7 -4,-0.6 4,-2.7 1,-0.3 -1,-0.2 0.779 104.5 58.2 -40.0 -39.4 11.4 2.9 0.3 81 84 A A H X S+ 0 0 22 -4,-1.7 4,-1.1 2,-0.2 -1,-0.3 0.998 113.3 41.2 -53.8 -60.8 9.4 -0.2 1.2 82 85 A D H >X S+ 0 0 0 -4,-2.1 3,-2.9 -3,-0.4 4,-2.6 0.940 116.7 44.7 -44.6 -74.8 12.3 -1.1 3.5 83 86 A W H 3X S+ 0 0 16 -4,-1.4 4,-0.6 1,-0.3 -1,-0.2 0.807 105.4 64.2 -42.3 -40.6 13.0 2.4 5.0 84 87 A L H 3< S+ 0 0 78 -4,-2.7 -1,-0.3 -5,-0.3 -2,-0.2 0.827 118.7 25.8 -55.9 -33.4 9.2 2.8 5.4 85 88 A F H S+ 0 0 23 0, 0.0 4,-2.3 0, 0.0 5,-0.3 1.000 112.0 51.5 -64.8 -59.3 10.2 3.6 12.3 89 92 A L H X S+ 0 0 32 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.823 109.9 52.1 -40.1 -42.5 11.3 0.4 14.1 90 93 A L H >X S+ 0 0 8 -4,-2.2 4,-2.1 2,-0.2 3,-0.7 0.978 106.0 51.7 -60.9 -57.6 14.7 2.1 14.6 91 94 A L H 3X S+ 0 0 4 -4,-2.3 4,-3.5 1,-0.3 5,-0.2 0.898 108.5 52.9 -45.3 -47.4 13.2 5.2 16.2 92 95 A L H 3X S+ 0 0 50 -4,-2.3 4,-2.6 1,-0.3 5,-0.5 0.901 102.7 57.0 -56.8 -41.1 11.3 3.0 18.5 93 96 A D H S+ 0 0 1 -4,-3.5 5,-1.2 1,-0.2 -3,-0.2 0.960 116.9 50.2 -47.9 -58.8 12.5 6.1 22.0 96 99 A L H ><5S+ 0 0 66 -4,-2.6 3,-1.1 -5,-0.2 -1,-0.2 0.866 111.1 49.6 -47.9 -46.5 12.0 2.8 23.8 97 100 A L H 3<5S+ 0 0 37 -4,-1.9 2,-2.3 -5,-0.5 -2,-0.2 0.995 115.5 40.4 -56.0 -70.2 15.5 2.8 25.1 98 101 A V T 3<5S- 0 0 0 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 -0.169 112.1-121.6 -75.0 45.8 15.4 6.3 26.4 99 102 A D T < 5 - 0 0 116 -2,-2.3 2,-0.3 -3,-1.1 -3,-0.2 0.625 41.1-168.8 9.9 73.6 11.9 5.7 27.7 100 103 A A < - 0 0 8 -5,-1.2 -1,-0.1 1,-0.1 2,-0.1 -0.607 29.2 -97.7 -87.4 144.0 10.2 8.5 25.7 101 104 A D >> - 0 0 104 -2,-0.3 4,-1.8 1,-0.2 3,-1.0 -0.371 32.0-121.8 -59.9 127.9 6.6 9.6 26.4 102 105 A Q H 3> S+ 0 0 167 1,-0.3 4,-3.2 2,-0.2 5,-0.3 0.777 110.3 70.7 -40.1 -33.3 4.3 8.0 23.8 103 106 A G H 3> S+ 0 0 50 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.972 105.8 34.4 -49.3 -63.3 3.4 11.5 22.9 104 107 A T H <> S+ 0 0 58 -3,-1.0 4,-2.5 2,-0.2 -1,-0.2 0.851 114.9 58.4 -62.0 -37.2 6.8 12.2 21.3 105 108 A I H X S+ 0 0 38 -4,-1.8 4,-2.7 2,-0.2 3,-0.5 0.991 109.7 44.8 -53.0 -62.1 7.1 8.6 20.1 106 109 A L H X S+ 0 0 131 -4,-3.2 4,-2.4 1,-0.3 5,-0.3 0.881 115.3 45.1 -46.5 -54.8 3.8 9.0 18.1 107 110 A A H X S+ 0 0 50 -4,-2.3 4,-1.3 -5,-0.3 -1,-0.3 0.817 114.0 53.8 -62.8 -29.3 4.7 12.4 16.7 108 111 A L H X S+ 0 0 3 -4,-2.5 4,-2.4 -3,-0.5 -2,-0.2 0.887 108.6 45.6 -73.7 -41.8 8.1 11.0 16.0 109 112 A V H X S+ 0 0 47 -4,-2.7 4,-4.0 2,-0.2 -2,-0.2 0.976 115.1 47.1 -65.1 -53.2 6.9 8.0 14.0 110 113 A G H X S+ 0 0 36 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.811 109.2 56.1 -57.0 -31.5 4.4 10.1 12.0 111 114 A A H X S+ 0 0 13 -4,-1.3 4,-1.8 -5,-0.3 -1,-0.2 0.975 113.6 39.2 -63.7 -52.8 7.3 12.6 11.5 112 115 A D H X S+ 0 0 1 -4,-2.4 4,-2.2 2,-0.2 5,-0.4 0.893 111.9 60.8 -61.7 -40.7 9.3 9.8 9.9 113 116 A G H X S+ 0 0 28 -4,-4.0 4,-2.5 1,-0.2 5,-0.3 0.963 107.5 41.6 -49.6 -60.8 6.2 8.5 8.3 114 117 A I H X S+ 0 0 107 -4,-2.8 4,-2.0 3,-0.2 -1,-0.2 0.821 114.1 57.8 -57.5 -32.7 5.7 11.8 6.3 115 118 A M H X S+ 0 0 21 -4,-1.8 4,-1.9 -5,-0.2 5,-0.2 0.998 114.0 30.6 -61.5 -73.1 9.4 11.8 5.7 116 119 A I H X S+ 0 0 13 -4,-2.2 4,-1.8 1,-0.2 3,-0.4 0.928 119.7 55.0 -52.5 -51.2 9.9 8.4 3.9 117 120 A G H >X S+ 0 0 30 -4,-2.5 4,-1.8 -5,-0.4 3,-0.6 0.921 113.0 41.8 -47.2 -52.5 6.4 8.5 2.4 118 121 A T H 3X S+ 0 0 20 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.3 0.733 106.3 63.3 -68.6 -24.6 7.1 11.8 0.9 119 122 A G H 3X S+ 0 0 12 -4,-1.9 4,-2.1 -3,-0.4 -1,-0.3 0.825 104.6 50.0 -69.1 -28.7 10.6 10.7 -0.1 120 123 A L H << S+ 0 0 52 -4,-1.8 -2,-0.2 -3,-0.6 5,-0.2 0.993 108.5 47.4 -71.1 -62.6 8.8 8.2 -2.2 121 124 A V H >< S+ 0 0 64 -4,-1.8 3,-1.3 1,-0.3 4,-0.4 0.837 110.6 56.6 -46.8 -35.7 6.4 10.6 -4.0 122 125 A G H >< S+ 0 0 0 -4,-1.9 3,-1.7 1,-0.3 2,-1.1 0.994 107.7 45.7 -58.3 -57.9 9.5 12.7 -4.5 123 126 A A T 3< S+ 0 0 0 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 -0.055 114.6 51.0 -77.0 35.9 11.2 9.7 -6.3 124 127 A L T < S+ 0 0 77 -3,-1.3 -1,-0.3 -2,-1.1 -2,-0.2 0.262 78.3 116.5-149.4 1.2 8.0 9.1 -8.3 125 128 A T < - 0 0 14 -3,-1.7 6,-0.0 -4,-0.4 -3,-0.0 -0.524 46.7-160.1 -77.5 144.8 7.2 12.5 -9.7 126 129 A K S S+ 0 0 141 -2,-0.2 -57,-0.6 -58,-0.1 2,-0.4 0.888 73.9 81.1 -88.4 -48.9 7.3 13.0 -13.6 127 130 A V S > S- 0 0 70 1,-0.2 4,-1.1 -59,-0.1 3,-0.4 -0.439 78.8-143.4 -60.9 115.7 7.6 16.8 -13.6 128 131 A Y H > S+ 0 0 97 -2,-0.4 4,-0.6 1,-0.2 3,-0.2 0.829 92.9 51.4 -50.9 -43.8 11.4 17.3 -13.0 129 132 A S H >> S+ 0 0 84 1,-0.2 3,-0.8 2,-0.2 4,-0.7 0.870 103.2 57.8 -66.8 -38.1 11.1 20.4 -10.9 130 133 A Y H >> S+ 0 0 133 -3,-0.4 4,-1.7 1,-0.2 3,-1.0 0.827 88.2 74.9 -62.7 -33.7 8.5 19.0 -8.4 131 134 A R H 3X S+ 0 0 0 -4,-1.1 4,-2.0 1,-0.3 3,-0.3 0.891 100.7 44.6 -43.6 -46.7 10.8 16.1 -7.5 132 135 A F H X S+ 0 0 16 -4,-3.5 4,-1.7 2,-0.2 3,-0.8 0.962 106.9 48.5 -67.2 -55.6 10.7 15.8 3.2 139 142 A T H 3X S+ 0 0 28 -4,-2.5 4,-2.8 -5,-0.3 5,-0.5 0.946 105.9 59.1 -51.1 -50.1 14.0 17.0 4.6 140 143 A A H 3X S+ 0 0 61 -4,-2.7 4,-1.2 1,-0.3 -1,-0.3 0.896 104.4 53.4 -44.8 -40.6 12.0 19.5 6.6 141 144 A A H X S+ 0 0 20 -4,-2.1 4,-2.6 2,-0.2 3,-0.9 0.833 112.4 52.8 -50.4 -36.1 16.7 14.8 14.3 147 150 A Y H 3X S+ 0 0 136 -4,-1.5 4,-1.5 -5,-0.4 2,-0.6 0.997 111.0 41.9 -62.9 -71.4 15.8 18.0 16.2 148 151 A V H 3<>S+ 0 0 32 -4,-2.0 5,-0.5 1,-0.2 -1,-0.2 0.221 120.1 49.0 -62.8 19.1 13.4 16.5 18.6 149 152 A L H <45S+ 0 0 3 -3,-0.9 5,-0.4 -2,-0.6 -1,-0.2 0.647 109.8 44.3-119.0 -52.1 15.8 13.6 19.1 150 153 A F H <5S+ 0 0 95 -4,-2.6 -2,-0.2 -3,-0.3 -3,-0.1 0.566 124.6 39.4 -72.0 -11.5 19.1 15.3 19.6 151 154 A F T X5S+ 0 0 95 -4,-1.5 4,-1.6 -5,-0.2 3,-0.4 0.826 125.9 24.4-101.4 -70.2 17.4 17.7 22.0 152 155 A G H >>5S+ 0 0 38 -5,-0.2 3,-1.4 1,-0.2 4,-0.9 0.986 119.8 50.2 -57.9 -79.4 14.8 15.8 24.0 153 156 A F H 3> S+ 0 0 27 -3,-0.4 4,-3.2 -5,-0.4 -1,-0.3 0.943 108.2 42.9 -78.2 -53.5 19.4 13.6 25.1 155 158 A S H << S+ 0 0 75 -4,-1.6 -2,-0.2 -3,-1.4 -3,-0.1 0.984 118.7 41.5 -54.3 -70.8 18.0 15.2 28.2 156 159 A K H < S+ 0 0 73 -4,-0.9 3,-0.5 1,-0.2 -1,-0.2 0.866 115.2 54.6 -46.3 -42.7 15.7 12.3 29.4 157 160 A A H < S+ 0 0 0 -4,-0.7 2,-2.8 -5,-0.4 8,-0.4 0.985 102.4 56.0 -54.9 -61.9 18.5 9.9 28.4 158 161 A E S < S+ 0 0 95 -4,-3.2 -1,-0.3 1,-0.2 -2,-0.1 -0.354 96.0 69.6 -74.0 63.6 21.0 11.7 30.6 159 162 A S S S+ 0 0 99 -2,-2.8 -1,-0.2 -3,-0.5 2,-0.1 -0.015 96.0 40.9-169.2 37.5 18.9 11.4 33.8 160 163 A M S S- 0 0 97 -3,-0.4 -2,-0.1 1,-0.2 -3,-0.1 -0.248 105.4 -5.6-150.0-120.0 19.0 7.6 34.6 161 164 A R > - 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0 0 74 0, 0.0 3,-1.8 0, 0.0 4,-1.5 -0.422 28.8-102.1 -88.2 170.4 25.8 7.1 -12.0 198 201 A L H 3> S+ 0 0 11 1,-0.3 4,-1.1 2,-0.2 5,-0.3 0.668 116.5 77.0 -64.7 -16.9 23.7 4.2 -10.6 199 202 A N H 3> S+ 0 0 82 2,-0.1 4,-0.6 3,-0.1 -1,-0.3 0.872 109.4 30.2 -57.2 -36.1 27.1 2.3 -10.4 200 203 A I H X> S+ 0 0 59 -3,-1.8 4,-1.9 2,-0.1 3,-0.7 0.952 108.9 63.4 -85.6 -71.2 27.4 4.6 -7.3 201 204 A E H >X S+ 0 0 1 -4,-1.5 4,-2.0 1,-0.3 3,-0.9 0.748 106.3 48.1 -18.1 -71.9 24.0 5.2 -5.9 202 205 A T H 3X S+ 0 0 0 -4,-1.1 4,-1.7 1,-0.3 -1,-0.3 0.887 113.8 46.4 -38.7 -62.8 23.4 1.5 -5.2 203 206 A L H S+ 0 0 27 -4,-2.2 4,-1.0 1,-0.3 5,-0.7 0.804 120.2 50.2 -49.6 -31.5 24.4 -2.2 6.3 211 214 A S H <>S+ 0 0 47 -4,-2.2 5,-0.8 -5,-0.3 -1,-0.3 0.886 110.7 45.5 -77.9 -40.2 26.1 0.3 8.6 212 215 A A H X5S+ 0 0 7 -4,-1.5 4,-1.0 -3,-0.4 -2,-0.2 0.931 125.3 29.8 -69.9 -42.9 22.9 2.0 9.9 213 216 A K H <5S+ 0 0 9 -4,-2.4 4,-0.3 2,-0.2 -3,-0.2 0.947 134.4 28.1 -81.9 -59.0 20.9 -1.3 10.6 214 217 A V T X5S+ 0 0 23 -4,-1.0 4,-2.5 -5,-0.4 5,-0.4 0.778 123.1 54.2 -77.1 -24.7 23.7 -3.8 11.4 215 218 A G H > S+ 0 0 0 -4,-0.3 4,-0.7 -6,-0.2 5,-0.4 0.979 110.3 29.6 -79.2 -62.1 22.5 -3.6 15.5 218 221 A L H X S+ 0 0 67 -4,-2.5 4,-2.0 -3,-0.3 -2,-0.2 0.971 122.6 53.6 -61.2 -52.9 25.8 -4.8 17.0 219 222 A I H < S+ 0 0 63 -4,-2.3 3,-0.3 -5,-0.4 -3,-0.2 0.951 118.6 32.6 -47.5 -66.5 26.2 -1.4 18.6 220 223 A L H >< S+ 0 0 7 -4,-1.0 3,-1.3 -5,-0.3 -3,-0.2 0.942 119.2 44.7 -54.3 -89.2 22.9 -1.4 20.3 221 224 A L H 3< S+ 0 0 17 -4,-0.7 -1,-0.2 -5,-0.4 -3,-0.2 0.568 104.5 65.4 -30.7 -28.8 22.0 -5.0 21.2 222 225 A R T 3< S+ 0 0 149 -4,-2.0 2,-0.3 -5,-0.4 -1,-0.3 0.085 91.5 85.4 -88.6 24.9 25.6 -5.7 22.5 223 226 A S < 0 0 28 -3,-1.3 -59,-0.0 1,-0.0 -60,-0.0 -0.899 360.0 360.0-125.7 153.7 25.1 -3.2 25.4 224 227 A R 0 0 181 -2,-0.3 -57,-0.1 -61,-0.0 -2,-0.0 -0.272 360.0 360.0 -70.7 360.0 23.5 -3.5 28.9