==== 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 TRANSPORT PROTEIN 02-MAY-09 3HAQ . COMPND 2 MOLECULE: BACTERIORHODOPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HALOBACTERIUM SALINARUM; . AUTHOR N.H.JOH,D.YANG,J.U.BOWIE . 225 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10437.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 196 87.1 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 3.1 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 . 3 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 3.6 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 1 0 3 1 1 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 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 6 A G 0 0 120 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 66.8 -7.6 -18.6 -18.9 2 7 A R > - 0 0 100 1,-0.1 3,-2.4 2,-0.0 4,-0.2 -0.568 360.0-127.8 -69.1 131.8 -10.0 -16.1 -17.5 3 8 A P T > S+ 0 0 83 0, 0.0 3,-0.8 0, 0.0 4,-0.2 0.752 105.9 64.5 -58.1 -27.3 -7.9 -13.2 -15.8 4 9 A E T >> S+ 0 0 1 1,-0.2 4,-1.6 2,-0.1 3,-1.4 0.556 75.6 94.7 -69.9 -8.0 -9.9 -13.5 -12.6 5 10 A W H <> S+ 0 0 133 -3,-2.4 4,-2.2 1,-0.3 -1,-0.2 0.809 74.1 63.3 -56.7 -34.6 -8.5 -17.1 -12.1 6 11 A I H <> S+ 0 0 79 -3,-0.8 4,-1.8 1,-0.2 -1,-0.3 0.833 105.9 42.8 -60.2 -37.1 -5.7 -15.9 -9.9 7 12 A W H <> S+ 0 0 73 -3,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.764 111.4 55.6 -83.5 -27.9 -8.2 -14.6 -7.2 8 13 A L H X S+ 0 0 2 -4,-1.6 4,-1.3 2,-0.2 48,-0.2 0.841 111.2 45.7 -66.5 -30.3 -10.2 -17.8 -7.6 9 14 A A H X S+ 0 0 24 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.884 112.4 47.7 -79.6 -43.4 -7.0 -19.8 -6.9 10 15 A L H X S+ 0 0 70 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.859 111.9 52.0 -65.8 -38.3 -6.0 -17.6 -3.9 11 16 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 5,-0.2 0.881 110.5 48.8 -60.4 -38.3 -9.6 -17.9 -2.5 12 17 A T H X S+ 0 0 13 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.928 112.0 48.1 -66.0 -51.1 -9.4 -21.7 -2.9 13 18 A A H X S+ 0 0 47 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.948 115.4 44.3 -52.3 -54.4 -6.0 -21.8 -1.1 14 19 A L H X S+ 0 0 62 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.837 115.1 46.3 -66.9 -36.3 -7.2 -19.6 1.8 15 20 A M H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 34,-0.2 0.836 114.5 49.1 -72.7 -35.8 -10.5 -21.3 2.3 16 21 A G H X S+ 0 0 14 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.920 111.9 48.4 -66.9 -47.6 -8.8 -24.7 2.1 17 22 A L H X S+ 0 0 117 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.895 112.9 46.3 -61.0 -43.4 -6.2 -23.7 4.6 18 23 A G H X S+ 0 0 6 -4,-2.0 4,-3.1 2,-0.2 5,-0.2 0.898 111.3 53.8 -68.7 -38.0 -8.7 -22.2 7.1 19 24 A T H X S+ 0 0 20 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.942 111.9 43.5 -57.0 -54.4 -10.9 -25.3 6.8 20 25 A L H X S+ 0 0 106 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.923 114.8 50.2 -59.0 -47.8 -8.0 -27.7 7.6 21 26 A Y H X S+ 0 0 120 -4,-2.5 4,-2.2 -5,-0.2 5,-0.2 0.938 113.9 44.1 -54.7 -45.9 -6.9 -25.4 10.4 22 27 A F H X S+ 0 0 3 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.886 113.5 52.1 -69.7 -37.0 -10.4 -25.2 11.9 23 28 A L H X S+ 0 0 88 -4,-2.5 4,-2.2 -5,-0.2 5,-0.2 0.942 109.5 48.6 -62.7 -48.3 -10.8 -29.0 11.5 24 29 A V H X S+ 0 0 88 -4,-2.7 4,-1.1 1,-0.2 -2,-0.2 0.927 116.8 41.5 -59.8 -47.8 -7.5 -29.8 13.3 25 30 A K H < S+ 0 0 96 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.856 114.2 52.6 -66.7 -37.4 -8.4 -27.5 16.2 26 31 A G H >< S+ 0 0 9 -4,-2.3 3,-0.5 -5,-0.2 -2,-0.2 0.817 105.9 52.3 -73.4 -30.7 -12.0 -28.6 16.4 27 32 A M H 3< S+ 0 0 142 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.750 105.4 56.8 -74.0 -28.2 -11.1 -32.3 16.5 28 33 A G T 3< S+ 0 0 70 -4,-1.1 2,-0.2 -5,-0.2 -1,-0.2 0.629 90.4 95.2 -73.2 -14.8 -8.7 -31.6 19.4 29 34 A V < + 0 0 22 -3,-0.5 -3,-0.0 -4,-0.5 -4,-0.0 -0.548 45.0 179.1 -83.2 136.9 -11.6 -30.1 21.5 30 35 A S + 0 0 111 -2,-0.2 -1,-0.1 4,-0.0 5,-0.0 0.765 50.8 104.7-106.3 -30.8 -13.6 -32.1 24.0 31 36 A D > - 0 0 56 1,-0.2 4,-2.3 2,-0.1 5,-0.1 -0.309 65.5-146.0 -48.8 114.6 -16.1 -29.4 25.3 32 37 A P H > S+ 0 0 93 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.829 95.7 52.6 -60.3 -33.4 -19.4 -30.3 23.6 33 38 A D H > S+ 0 0 107 2,-0.2 4,-1.2 1,-0.2 3,-0.4 0.939 111.1 45.2 -66.8 -43.1 -20.4 -26.6 23.4 34 39 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 3,-0.3 0.903 106.3 62.5 -65.9 -38.1 -17.2 -25.6 21.7 35 40 A K H X S+ 0 0 88 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.844 100.0 53.6 -48.4 -42.6 -17.5 -28.7 19.4 36 41 A K H X S+ 0 0 134 -4,-1.2 4,-1.7 -3,-0.4 -1,-0.2 0.858 108.5 48.7 -64.8 -41.2 -20.8 -27.2 18.0 37 42 A F H X S+ 0 0 14 -4,-1.2 4,-2.3 -3,-0.3 -2,-0.2 0.888 111.9 49.9 -65.6 -39.5 -19.1 -23.9 17.1 38 43 A Y H X S+ 0 0 22 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.874 109.0 50.6 -65.0 -43.2 -16.3 -25.8 15.4 39 44 A A H X S+ 0 0 68 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.920 116.7 40.4 -60.1 -46.5 -18.6 -28.0 13.3 40 45 A I H X S+ 0 0 17 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.920 119.7 45.5 -65.8 -45.9 -20.6 -25.0 12.0 41 46 A T H < S+ 0 0 1 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.776 111.5 50.4 -77.4 -30.7 -17.5 -22.8 11.6 42 47 A T H X S+ 0 0 17 -4,-2.4 4,-1.2 -5,-0.2 -1,-0.2 0.893 107.3 55.7 -72.3 -37.8 -15.4 -25.5 9.9 43 48 A L H X S+ 0 0 82 -4,-1.7 4,-2.2 -5,-0.2 5,-0.2 0.807 96.8 66.5 -64.8 -30.2 -18.2 -26.3 7.4 44 49 A V H X S+ 0 0 1 -4,-1.1 4,-2.2 1,-0.2 3,-0.2 0.959 107.3 34.8 -57.2 -60.7 -18.4 -22.6 6.3 45 50 A P H > S+ 0 0 0 0, 0.0 4,-3.2 0, 0.0 -1,-0.2 0.754 114.2 62.2 -67.2 -21.4 -15.0 -22.3 4.6 46 51 A A H X S+ 0 0 26 -4,-1.2 4,-1.5 2,-0.2 -2,-0.2 0.861 106.9 42.4 -66.6 -46.2 -15.3 -26.0 3.5 47 52 A I H X S+ 0 0 26 -4,-2.2 4,-1.8 -3,-0.2 5,-0.2 0.935 115.8 50.0 -61.3 -49.2 -18.4 -25.1 1.4 48 53 A A H X S+ 0 0 0 -4,-2.2 4,-3.4 1,-0.2 5,-0.2 0.902 108.4 53.2 -57.0 -44.2 -16.6 -21.9 0.1 49 54 A F H X S+ 0 0 72 -4,-3.2 4,-2.5 -34,-0.2 -1,-0.2 0.926 109.2 48.0 -54.5 -49.6 -13.5 -24.0 -0.8 50 55 A T H X S+ 0 0 66 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.842 114.7 46.4 -64.2 -31.8 -15.5 -26.4 -3.0 51 56 A M H X S+ 0 0 40 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.919 112.7 48.5 -75.5 -44.6 -17.3 -23.5 -4.7 52 57 A Y H X S+ 0 0 1 -4,-3.4 4,-3.0 2,-0.2 -2,-0.2 0.899 113.3 48.9 -59.2 -38.9 -14.1 -21.5 -5.3 53 58 A L H X S+ 0 0 62 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.918 108.8 52.0 -71.5 -44.4 -12.5 -24.7 -6.7 54 59 A S H <>S+ 0 0 44 -4,-2.0 5,-2.6 2,-0.2 -2,-0.2 0.931 115.0 42.9 -45.1 -54.9 -15.5 -25.4 -9.0 55 60 A M H ><5S+ 0 0 4 -4,-2.5 3,-1.9 1,-0.2 -2,-0.2 0.910 109.8 57.0 -65.5 -42.5 -15.3 -21.8 -10.3 56 61 A L H 3<5S+ 0 0 56 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.896 108.6 47.8 -51.0 -40.5 -11.5 -22.1 -10.6 57 62 A L T 3<5S- 0 0 125 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.317 129.1 -94.1 -89.4 5.3 -12.0 -25.2 -12.8 58 63 A G T < 5S+ 0 0 57 -3,-1.9 3,-0.3 1,-0.3 -3,-0.2 0.536 85.9 116.3 98.1 9.9 -14.6 -23.4 -15.0 59 64 A Y < + 0 0 170 -5,-2.6 -1,-0.3 1,-0.2 17,-0.1 -0.619 55.9 45.1-102.2 167.3 -17.9 -24.4 -13.5 60 65 A G S S+ 0 0 7 1,-0.2 16,-1.7 -2,-0.2 15,-0.6 0.723 86.7 113.3 77.2 21.2 -20.5 -22.2 -12.0 61 66 A L E +A 74 0A 49 -3,-0.3 2,-0.3 13,-0.3 13,-0.2 -0.989 36.2 167.3-129.1 130.4 -20.3 -19.6 -14.7 62 67 A T E -A 73 0A 58 11,-3.0 11,-2.7 -2,-0.4 2,-0.5 -0.856 32.9-117.0-133.9 170.9 -23.0 -18.8 -17.2 63 68 A M E -A 72 0A 81 -2,-0.3 7,-0.0 9,-0.2 -2,-0.0 -0.946 26.1-168.5-113.0 129.7 -23.6 -16.0 -19.8 64 69 A V E -A 71 0A 8 7,-3.0 7,-2.4 -2,-0.5 2,-0.4 -0.978 18.0-133.2-120.5 123.6 -26.6 -13.8 -19.3 65 70 A P E +A 70 0A 50 0, 0.0 2,-0.3 0, 0.0 5,-0.2 -0.633 46.3 135.2 -74.9 123.3 -27.8 -11.4 -22.1 66 71 A F E > +A 69 0A 10 3,-2.4 3,-0.8 -2,-0.4 59,-0.1 -0.918 61.0 21.7-161.6 151.2 -28.6 -7.8 -20.8 67 72 A G T 3 S- 0 0 55 -2,-0.3 3,-0.1 57,-0.2 58,-0.1 0.801 130.0 -62.1 56.7 33.1 -27.7 -4.3 -22.1 68 73 A G T 3 S+ 0 0 87 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.727 119.0 90.4 74.4 22.8 -27.2 -5.7 -25.7 69 74 A E E < S-A 66 0A 132 -3,-0.8 -3,-2.4 -5,-0.1 2,-0.6 -0.974 80.0-114.1-150.2 153.1 -24.3 -7.9 -24.6 70 75 A Q E -A 65 0A 115 -2,-0.3 -3,-0.0 -5,-0.2 -7,-0.0 -0.861 40.0-161.5 -94.4 115.9 -23.7 -11.4 -23.3 71 76 A N E -A 64 0A 24 -7,-2.4 -7,-3.0 -2,-0.6 2,-0.3 -0.876 16.9-124.4-109.5 132.8 -22.3 -11.0 -19.7 72 77 A P E -A 63 0A 26 0, 0.0 2,-0.4 0, 0.0 -9,-0.2 -0.596 31.2-177.2 -75.3 131.4 -20.4 -13.6 -17.6 73 78 A I E -A 62 0A 0 -11,-2.7 -11,-3.0 -2,-0.3 2,-1.1 -1.000 22.8-142.7-132.3 124.0 -22.1 -14.3 -14.3 74 79 A Y E > +A 61 0A 10 -2,-0.4 3,-0.7 -13,-0.2 -13,-0.3 -0.771 22.8 174.6 -86.8 97.9 -20.7 -16.7 -11.7 75 80 A W T >> + 0 0 115 -2,-1.1 3,-1.2 -15,-0.6 4,-0.9 0.629 65.4 78.1 -76.5 -13.8 -23.8 -18.3 -10.3 76 81 A A H 3> S+ 0 0 3 -16,-1.7 4,-1.7 1,-0.3 -1,-0.2 0.730 80.1 71.1 -72.1 -16.5 -21.8 -20.7 -8.0 77 82 A R H <> S+ 0 0 2 -3,-0.7 4,-3.0 -17,-0.3 -1,-0.3 0.814 96.9 50.0 -61.8 -32.5 -21.3 -17.9 -5.6 78 83 A Y H <> S+ 0 0 6 -3,-1.2 4,-2.6 2,-0.2 -1,-0.2 0.802 104.7 56.9 -81.8 -31.2 -25.0 -18.1 -4.7 79 84 A A H X S+ 0 0 25 -4,-0.9 4,-0.6 2,-0.2 -2,-0.2 0.869 113.7 41.8 -60.7 -38.6 -24.7 -21.9 -4.2 80 85 A D H >X S+ 0 0 2 -4,-1.7 4,-2.1 2,-0.2 3,-1.1 0.978 116.1 46.5 -69.7 -60.9 -21.9 -21.0 -1.6 81 86 A W H 3X S+ 0 0 18 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.804 99.7 69.5 -50.5 -40.7 -23.7 -18.1 0.0 82 87 A L H 3< S+ 0 0 76 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.844 116.8 23.0 -48.8 -42.1 -27.0 -20.0 0.3 83 88 A F H S+ 0 0 23 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.814 111.2 56.8 -68.2 -26.1 -27.1 -18.8 7.5 87 92 A L H X S+ 0 0 34 -4,-0.8 4,-2.0 2,-0.2 -2,-0.2 0.944 108.7 47.7 -64.9 -41.4 -24.4 -21.0 9.0 88 93 A L H X S+ 0 0 3 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.918 110.6 50.9 -58.0 -47.0 -22.6 -17.7 10.0 89 94 A L H X S+ 0 0 3 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.854 106.8 55.4 -61.0 -37.8 -25.9 -16.3 11.4 90 95 A L H X S+ 0 0 52 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.911 101.9 55.9 -60.0 -47.8 -26.3 -19.4 13.4 91 96 A D H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.906 111.1 45.4 -49.5 -46.6 -22.9 -19.0 15.1 92 97 A L H X S+ 0 0 0 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.899 112.5 50.5 -63.8 -42.5 -24.0 -15.5 16.2 93 98 A A H X>S+ 0 0 1 -4,-2.2 5,-2.3 1,-0.2 4,-0.5 0.822 109.9 49.5 -68.6 -32.4 -27.4 -16.8 17.4 94 99 A L H ><5S+ 0 0 55 -4,-2.5 3,-0.7 1,-0.2 -1,-0.2 0.911 106.7 56.6 -76.1 -38.7 -25.8 -19.6 19.4 95 100 A L H 3<5S+ 0 0 4 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.819 117.2 33.8 -52.3 -40.8 -23.4 -17.1 21.0 96 101 A V H 3<5S- 0 0 2 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.377 106.1-120.0-105.0 3.8 -26.3 -15.0 22.3 97 102 A D T <<5 - 0 0 105 -3,-0.7 -3,-0.2 -4,-0.5 -4,-0.1 0.928 44.0-168.5 56.3 47.6 -28.9 -17.7 22.9 98 103 A A < - 0 0 14 -5,-2.3 -1,-0.1 1,-0.1 2,-0.1 -0.281 27.0 -92.4 -64.9 151.8 -31.2 -16.1 20.4 99 104 A D > - 0 0 88 1,-0.1 4,-2.1 4,-0.0 3,-0.4 -0.371 27.7-120.4 -66.5 144.4 -34.8 -17.4 20.3 100 105 A Q H > S+ 0 0 173 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.844 114.7 53.2 -46.4 -47.3 -35.8 -20.2 17.9 101 106 A G H > S+ 0 0 53 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.815 107.5 52.3 -64.5 -30.8 -38.3 -17.9 16.1 102 107 A T H > S+ 0 0 48 -3,-0.4 4,-2.8 2,-0.2 -2,-0.2 0.935 109.0 49.6 -67.5 -44.8 -35.6 -15.3 15.7 103 108 A I H X S+ 0 0 37 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.916 111.0 49.3 -60.0 -46.9 -33.3 -17.8 14.1 104 109 A L H X S+ 0 0 138 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.869 112.1 47.6 -61.0 -44.9 -36.1 -19.0 11.7 105 110 A A H X S+ 0 0 38 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.919 113.8 49.5 -59.9 -46.3 -36.9 -15.4 10.7 106 111 A L H X S+ 0 0 2 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.926 112.3 44.8 -55.9 -55.5 -33.2 -14.7 10.2 107 112 A V H X S+ 0 0 60 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.907 114.0 52.5 -57.7 -45.3 -32.5 -17.9 8.0 108 113 A G H X S+ 0 0 36 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.935 110.1 45.2 -54.4 -55.9 -35.7 -17.0 6.0 109 114 A A H X S+ 0 0 11 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.896 113.1 54.1 -53.3 -41.8 -34.6 -13.4 5.3 110 115 A D H X S+ 0 0 1 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.923 107.1 49.4 -58.9 -48.7 -31.2 -14.9 4.4 111 116 A G H X S+ 0 0 28 -4,-2.7 4,-3.0 1,-0.2 -2,-0.2 0.884 110.9 48.9 -58.8 -48.7 -32.7 -17.3 1.9 112 117 A I H X S+ 0 0 94 -4,-2.3 4,-3.1 2,-0.2 5,-0.4 0.899 109.1 56.0 -50.2 -44.1 -34.7 -14.6 0.2 113 118 A M H X S+ 0 0 17 -4,-2.3 4,-1.4 1,-0.2 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