==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BACTERIORHODOPSIN 25-FEB-00 1DZE . COMPND 2 MOLECULE: BACTERIORHODOPSIN (M INTERMEDIATE); . SOURCE 2 ORGANISM_SCIENTIFIC: HALOBACTERIUM SALINARIUM; . AUTHOR K.TAKEDA,Y.MATSUI,H.SATO,T.HINO,E.KANAMORI,H.OKUMURA, . 225 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10169.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 190 84.4 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 0.4 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 . 6 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 144 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.2 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 0 0 1 0 1 1 1 2 1 0 0 0 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 6 A G 0 0 66 0, 0.0 60,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 130.3 31.5 27.0 6.4 2 7 A R > + 0 0 172 0, 0.0 3,-1.8 0, 0.0 4,-0.3 0.238 360.0 61.5-156.7 -58.1 28.0 28.5 6.1 3 8 A P T > S+ 0 0 86 0, 0.0 3,-0.6 0, 0.0 4,-0.2 0.816 107.3 50.0 -52.9 -36.3 25.1 26.2 7.1 4 9 A E T >> S+ 0 0 1 1,-0.2 3,-2.3 2,-0.1 4,-1.8 0.582 78.3 103.2 -80.7 -8.8 26.3 25.9 10.6 5 10 A W H <> S+ 0 0 123 -3,-1.8 4,-3.1 1,-0.3 5,-0.2 0.805 77.5 58.0 -41.4 -40.7 26.7 29.7 11.0 6 11 A I H <> S+ 0 0 72 -3,-0.6 4,-1.3 -4,-0.3 -1,-0.3 0.851 105.5 48.4 -60.7 -38.7 23.4 29.6 13.0 7 12 A W H <> S+ 0 0 57 -3,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.921 114.2 45.7 -69.5 -42.7 25.0 27.2 15.5 8 13 A L H X S+ 0 0 2 -4,-1.8 4,-1.7 1,-0.2 -2,-0.2 0.900 113.5 48.6 -66.7 -41.4 28.1 29.3 15.8 9 14 A A H X S+ 0 0 27 -4,-3.1 4,-1.2 -5,-0.3 -1,-0.2 0.780 112.1 50.6 -68.0 -27.9 26.1 32.6 16.1 10 15 A L H X S+ 0 0 74 -4,-1.3 4,-2.2 -5,-0.2 -1,-0.2 0.823 110.6 48.1 -77.3 -35.4 23.9 30.9 18.8 11 16 A G H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 5,-0.2 0.777 109.0 54.5 -74.2 -29.3 26.9 29.7 20.7 12 17 A T H X S+ 0 0 13 -4,-1.7 4,-1.4 40,-0.2 -2,-0.2 0.859 110.9 46.4 -70.5 -36.7 28.4 33.2 20.5 13 18 A A H X S+ 0 0 48 -4,-1.2 4,-3.0 2,-0.2 5,-0.2 0.948 114.0 45.3 -69.2 -54.6 25.2 34.7 22.0 14 19 A L H X S+ 0 0 71 -4,-2.2 4,-3.5 2,-0.2 -2,-0.2 0.933 114.7 46.7 -56.7 -52.6 24.8 32.2 24.9 15 20 A M H X S+ 0 0 0 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.899 113.9 51.1 -57.2 -41.9 28.5 32.3 25.9 16 21 A G H X S+ 0 0 16 -4,-1.4 4,-1.8 -5,-0.2 3,-0.3 0.938 114.3 41.1 -60.4 -50.1 28.3 36.1 25.7 17 22 A L H X S+ 0 0 110 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.874 110.8 60.1 -65.6 -36.0 25.1 36.2 27.9 18 23 A G H X S+ 0 0 5 -4,-3.5 4,-1.3 -5,-0.2 -1,-0.2 0.802 106.0 46.7 -60.5 -33.2 26.7 33.5 30.1 19 24 A T H X S+ 0 0 18 -4,-1.6 4,-2.5 -3,-0.3 -1,-0.2 0.912 110.5 52.0 -74.2 -46.1 29.6 35.9 30.9 20 25 A L H X S+ 0 0 106 -4,-1.8 4,-2.3 1,-0.2 5,-0.2 0.857 108.5 52.1 -56.4 -42.2 27.4 38.8 31.6 21 26 A Y H X S+ 0 0 86 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.925 112.1 43.2 -60.7 -53.1 25.3 36.8 34.0 22 27 A F H X S+ 0 0 0 -4,-1.3 4,-3.2 2,-0.2 -2,-0.2 0.884 113.5 52.2 -62.7 -40.9 28.3 35.6 36.1 23 28 A L H X S+ 0 0 103 -4,-2.5 4,-0.6 1,-0.2 -2,-0.2 0.955 115.2 40.6 -59.0 -55.3 29.9 39.1 36.1 24 29 A V H < S+ 0 0 99 -4,-2.3 3,-0.3 -5,-0.2 4,-0.3 0.854 117.2 51.9 -61.5 -36.7 26.8 40.8 37.3 25 30 A K H >< S+ 0 0 68 -4,-2.3 3,-1.0 -5,-0.2 -2,-0.2 0.966 110.2 44.4 -66.1 -54.9 26.2 37.9 39.7 26 31 A G H >< S+ 0 0 16 -4,-3.2 3,-1.0 1,-0.2 -1,-0.2 0.507 87.8 95.9 -71.5 -1.0 29.6 37.8 41.4 27 32 A M T 3< S+ 0 0 152 -4,-0.6 -1,-0.2 -3,-0.3 -2,-0.1 0.807 85.9 44.0 -58.9 -37.2 29.6 41.6 41.7 28 33 A G T < S+ 0 0 73 -3,-1.0 -1,-0.3 -4,-0.3 2,-0.2 0.563 86.4 119.3 -86.4 -8.2 28.3 41.5 45.3 29 34 A V < + 0 0 26 -3,-1.0 -3,-0.0 -4,-0.2 -4,-0.0 -0.396 28.3 168.3 -66.2 128.1 30.6 38.7 46.5 30 35 A S + 0 0 104 -2,-0.2 -1,-0.1 5,-0.0 -4,-0.0 0.634 45.2 104.1-108.5 -28.1 33.0 39.5 49.3 31 36 A D > - 0 0 46 1,-0.1 4,-4.0 2,-0.0 5,-0.3 -0.505 64.8-144.8 -65.8 117.0 34.2 36.0 50.2 32 37 A P T 4 S+ 0 0 78 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 0.615 99.9 48.6 -55.6 -22.9 37.8 35.4 48.9 33 38 A D T >> S+ 0 0 79 2,-0.2 4,-2.0 3,-0.1 3,-0.6 0.894 116.3 40.7 -82.1 -51.0 37.0 31.8 48.2 34 39 A A H 3> S+ 0 0 0 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.915 112.4 58.1 -60.7 -43.6 33.7 32.5 46.4 35 40 A K H 3X S+ 0 0 116 -4,-4.0 4,-0.9 1,-0.2 -1,-0.3 0.757 106.9 47.8 -58.3 -27.2 35.5 35.4 44.7 36 41 A K H <> S+ 0 0 90 -3,-0.6 4,-2.8 -4,-0.3 -1,-0.2 0.852 109.4 52.6 -80.4 -40.5 38.0 33.0 43.3 37 42 A F H X S+ 0 0 6 -4,-2.0 4,-2.9 187,-0.3 -2,-0.2 0.912 111.2 46.1 -60.5 -44.8 35.3 30.6 42.1 38 43 A Y H X S+ 0 0 19 -4,-2.8 4,-2.1 2,-0.2 5,-0.2 0.819 112.0 54.2 -67.1 -30.6 33.6 33.5 40.3 39 44 A A H X S+ 0 0 53 -4,-0.9 4,-1.3 -5,-0.3 -2,-0.2 0.953 114.7 37.4 -66.2 -53.1 37.0 34.5 38.9 40 45 A I H X S+ 0 0 19 -4,-2.8 4,-0.7 1,-0.2 -2,-0.2 0.952 121.0 46.6 -63.8 -49.0 37.7 31.1 37.5 41 46 A T H < S+ 0 0 0 -4,-2.9 3,-0.5 -5,-0.2 -2,-0.2 0.835 109.5 51.1 -65.3 -38.7 34.1 30.4 36.4 42 47 A T H X S+ 0 0 16 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.858 106.0 57.2 -68.5 -34.8 33.4 33.8 34.7 43 48 A L H X S+ 0 0 93 -4,-1.3 4,-1.6 -5,-0.2 -1,-0.2 0.672 93.9 68.0 -68.0 -24.5 36.6 33.5 32.6 44 49 A V H X S+ 0 0 0 -4,-0.7 4,-2.1 -3,-0.5 -1,-0.2 0.978 107.3 34.9 -63.8 -54.5 35.7 30.2 31.0 45 50 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 -2,-0.2 0.832 110.8 63.5 -70.4 -29.7 32.7 31.6 28.9 46 51 A A H X S+ 0 0 31 -4,-1.3 4,-1.7 2,-0.2 -2,-0.2 0.934 109.3 40.7 -57.8 -45.9 34.5 34.9 28.3 47 52 A I H X S+ 0 0 37 -4,-1.6 4,-2.5 1,-0.2 5,-0.2 0.943 112.9 54.8 -65.9 -47.4 37.2 33.0 26.4 48 53 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.818 104.6 56.5 -54.7 -35.2 34.5 30.7 24.8 49 54 A F H X S+ 0 0 73 -4,-2.6 4,-2.5 -34,-0.2 3,-0.3 0.992 108.6 43.6 -60.1 -62.1 32.8 33.9 23.6 50 55 A T H X S+ 0 0 68 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.870 115.3 49.6 -52.4 -42.8 35.8 35.2 21.7 51 56 A M H X S+ 0 0 39 -4,-2.5 4,-1.1 1,-0.2 -1,-0.2 0.866 112.2 47.0 -67.7 -36.2 36.6 31.8 20.3 52 57 A Y H X S+ 0 0 0 -4,-2.1 4,-1.9 -3,-0.3 -2,-0.2 0.839 111.7 51.5 -72.4 -33.0 33.0 31.3 19.1 53 58 A L H X S+ 0 0 57 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.894 105.7 54.9 -68.4 -42.3 32.9 34.7 17.6 54 59 A S H < S+ 0 0 14 -4,-2.3 6,-1.4 -5,-0.2 5,-0.3 0.826 109.2 49.0 -59.9 -32.9 36.2 34.1 15.7 55 60 A M H < S+ 0 0 3 -4,-1.1 3,-0.5 4,-0.2 -1,-0.2 0.887 113.3 45.4 -73.8 -41.2 34.5 31.0 14.2 56 61 A L H < S+ 0 0 58 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.2 0.951 112.9 49.0 -66.1 -52.2 31.4 32.9 13.2 57 62 A L S < S- 0 0 134 -4,-3.1 -1,-0.2 -5,-0.1 -2,-0.2 0.488 122.0-108.6 -67.3 -3.0 33.3 35.9 11.7 58 63 A G S > S+ 0 0 38 -3,-0.5 3,-1.2 -5,-0.2 -3,-0.2 0.021 92.1 104.4 102.2 -26.3 35.4 33.3 9.8 59 64 A Y T 3 S+ 0 0 174 -5,-0.3 2,-0.4 1,-0.3 -4,-0.2 0.943 73.6 56.1 -54.5 -62.6 38.7 33.5 11.6 60 65 A G T 3 S+ 0 0 0 -6,-1.4 16,-1.5 -9,-0.2 15,-0.8 0.256 91.8 93.2 -60.0 13.8 38.7 30.3 13.6 61 66 A L E < +A 74 0A 37 -3,-1.2 13,-0.2 -2,-0.4 2,-0.2 -0.928 48.8 171.0-113.7 137.2 38.1 28.2 10.5 62 67 A T E -A 73 0A 47 11,-2.8 11,-1.8 -2,-0.4 2,-0.4 -0.710 29.3-121.8-130.9 176.6 40.9 26.6 8.5 63 68 A M E -A 72 0A 95 9,-0.3 7,-0.0 -2,-0.2 -2,-0.0 -0.986 24.2-174.3-128.2 120.1 41.1 24.0 5.7 64 69 A V E -A 71 0A 10 7,-3.5 7,-3.6 -2,-0.4 2,-0.8 -0.966 19.7-136.5-117.6 125.9 43.0 20.8 6.1 65 70 A P E +A 70 0A 55 0, 0.0 2,-0.4 0, 0.0 5,-0.2 -0.723 40.8 145.9 -85.9 109.4 43.5 18.4 3.2 66 71 A F - 0 0 11 3,-1.5 2,-0.2 -2,-0.8 59,-0.1 -0.977 61.6 -3.1-142.0 129.9 43.0 14.8 4.2 67 72 A G S S- 0 0 64 57,-0.4 2,-0.4 -2,-0.4 4,-0.0 -0.594 126.1 -35.1 85.6-155.6 41.5 12.2 1.9 68 73 A G S S+ 0 0 79 -2,-0.2 2,-0.3 2,-0.0 -1,-0.2 -0.267 124.4 68.3 -94.9 49.3 40.4 13.3 -1.5 69 74 A E S S- 0 0 136 -2,-0.4 -3,-1.5 -3,-0.1 2,-0.7 -0.996 78.1-120.1-162.6 155.4 39.3 16.7 -0.0 70 75 A Q E -A 65 0A 125 -2,-0.3 -2,-0.0 -5,-0.2 -3,-0.0 -0.903 44.1-152.2 -95.8 109.7 40.2 20.0 1.6 71 76 A N E -A 64 0A 11 -7,-3.6 -7,-3.5 -2,-0.7 2,-0.6 -0.758 12.1-125.8 -99.4 128.3 38.4 19.8 5.0 72 77 A P E -A 63 0A 33 0, 0.0 2,-0.5 0, 0.0 -9,-0.3 -0.545 31.8-175.3 -70.2 110.9 37.0 22.8 7.0 73 78 A I E -A 62 0A 0 -11,-1.8 -11,-2.8 -2,-0.6 2,-1.1 -0.951 21.2-145.3-112.8 122.3 38.5 22.5 10.5 74 79 A Y E > +A 61 0A 5 -2,-0.5 3,-0.7 -13,-0.2 4,-0.3 -0.770 22.9 174.6 -87.4 99.3 37.4 24.9 13.2 75 80 A W T >> + 0 0 76 -2,-1.1 4,-1.9 -15,-0.8 3,-1.3 0.700 66.9 78.4 -77.1 -24.9 40.7 25.3 15.2 76 81 A A H 3> S+ 0 0 0 -16,-1.5 4,-1.2 1,-0.3 -1,-0.2 0.666 85.7 67.0 -57.0 -17.9 39.3 28.0 17.5 77 82 A R H <> S+ 0 0 0 -3,-0.7 4,-2.3 -17,-0.3 -1,-0.3 0.880 103.4 41.8 -67.5 -41.9 37.6 25.1 19.2 78 83 A Y H <> S+ 0 0 7 -3,-1.3 4,-1.8 -4,-0.3 -2,-0.2 0.876 111.8 53.6 -73.2 -38.1 41.0 23.8 20.3 79 84 A A H X S+ 0 0 26 -4,-1.9 4,-0.6 1,-0.2 -1,-0.2 0.800 112.9 47.6 -64.2 -29.3 42.3 27.3 21.2 80 85 A D H >X S+ 0 0 0 -4,-1.2 4,-2.2 -5,-0.2 3,-0.7 0.923 111.9 45.7 -74.3 -56.3 39.2 27.6 23.4 81 86 A W H 3X S+ 0 0 16 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.755 101.4 71.1 -63.0 -23.7 39.4 24.2 25.1 82 87 A L H 3< S+ 0 0 68 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.869 115.6 19.9 -61.7 -42.1 43.1 24.8 25.7 83 88 A F H S+ 0 0 24 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.885 109.3 48.9 -69.1 -39.0 42.2 23.7 32.7 87 92 A L H X S+ 0 0 35 -4,-1.0 4,-1.6 1,-0.2 3,-0.2 0.869 109.8 50.8 -65.8 -39.0 40.2 26.4 34.4 88 93 A L H X S+ 0 0 5 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.781 108.9 53.5 -66.6 -29.3 37.2 24.0 34.8 89 94 A L H X S+ 0 0 5 -4,-1.2 4,-1.3 2,-0.2 -1,-0.2 0.738 106.6 51.9 -73.7 -28.4 39.8 21.6 36.3 90 95 A L H X S+ 0 0 57 -4,-1.1 4,-2.4 -3,-0.2 5,-0.2 0.793 104.1 56.0 -78.0 -34.3 40.8 24.3 38.8 91 96 A D H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.963 111.8 43.6 -60.1 -53.4 37.2 24.9 39.9 92 97 A L H X S+ 0 0 0 -4,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.827 115.3 49.4 -59.8 -37.8 36.8 21.2 40.7 93 98 A A H X>S+ 0 0 2 -4,-1.3 5,-2.5 2,-0.2 4,-1.0 0.816 111.5 46.9 -72.7 -36.6 40.2 21.2 42.4 94 99 A L H <5S+ 0 0 58 -4,-2.4 -2,-0.2 3,-0.2 -1,-0.2 0.890 113.3 50.8 -68.4 -44.9 39.6 24.3 44.6 95 100 A L H <5S+ 0 0 6 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.944 118.8 35.6 -54.1 -55.4 36.2 22.9 45.6 96 101 A V H <5S- 0 0 0 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.595 109.8-123.8 -77.6 -16.0 37.7 19.5 46.6 97 102 A D T <5 - 0 0 109 -4,-1.0 -3,-0.2 1,-0.1 -4,-0.1 0.966 40.5-167.5 69.9 57.8 40.9 21.1 47.9 98 103 A A < - 0 0 16 -5,-2.5 -1,-0.1 1,-0.1 2,-0.1 -0.301 22.3 -96.0 -79.7 160.9 43.4 19.2 45.9 99 104 A D > - 0 0 100 1,-0.1 4,-2.1 -2,-0.1 3,-0.3 -0.382 27.2-122.3 -72.1 147.7 47.2 18.8 46.2 100 105 A Q H > S+ 0 0 183 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.751 114.2 57.1 -61.6 -22.4 49.5 21.1 44.1 101 106 A G H > S+ 0 0 54 2,-0.2 4,-0.9 1,-0.1 -1,-0.2 0.898 106.5 43.8 -75.0 -45.0 50.9 17.8 42.7 102 107 A T H > S+ 0 0 37 -3,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.848 111.6 54.7 -68.8 -35.0 47.6 16.4 41.4 103 108 A I H X S+ 0 0 40 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.881 107.8 49.5 -64.8 -41.8 46.6 19.7 39.9 104 109 A L H X S+ 0 0 124 -4,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.753 110.4 51.8 -66.5 -29.5 49.9 19.9 37.9 105 110 A A H X S+ 0 0 37 -4,-0.9 4,-2.5 2,-0.2 -2,-0.2 0.946 114.2 42.8 -70.5 -50.6 49.2 16.3 36.8 106 111 A L H X S+ 0 0 3 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.887 116.5 44.9 -62.8 -47.5 45.8 17.2 35.6 107 112 A V H X S+ 0 0 58 -4,-3.1 4,-2.3 2,-0.2 -1,-0.2 0.903 116.5 48.3 -65.3 -39.6 46.7 20.5 34.0 108 113 A G H X S+ 0 0 33 -4,-1.5 4,-1.2 -5,-0.3 -2,-0.2 0.869 115.0 44.5 -65.8 -38.5 49.7 18.8 32.4 109 114 A A H X S+ 0 0 15 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.811 112.8 52.1 -72.8 -35.5 47.5 15.9 31.2 110 115 A D H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.885 105.9 52.7 -68.2 -43.7 44.8 18.3 30.0 111 116 A G H X S+ 0 0 30 -4,-2.3 4,-2.6 1,-0.2 5,-0.3 0.891 111.3 48.3 -59.8 -39.8 47.2 20.4 27.9 112 117 A I H X S+ 0 0 96 -4,-1.2 4,-1.6 1,-0.2 -1,-0.2 0.806 108.2 55.3 -68.4 -33.1 48.3 17.1 26.3 113 118 A M H X S+ 0 0 15 -4,-1.3 4,-0.9 3,-0.2 -2,-0.2 0.887 116.1 36.3 -68.4 -38.8 44.7 16.1 25.7 114 119 A I H X S+ 0 0 14 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.959 119.5 44.7 -79.7 -53.9 44.0 19.3 23.8 115 120 A G H X S+ 0 0 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