==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RECEPTOR 23-MAR-11 2YDO . COMPND 2 MOLECULE: ADENOSINE RECEPTOR A2A; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.LEBON,T.WARNE,P.C.EDWARDS,K.BENNETT,C.J.LANGMEAD,A.G.W.LES . 309 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16820.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 260 84.1 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 . 3 1.0 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 . 0 0.0 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 . 8 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 203 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 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 3 2 2 1 0 0 0 0 2 0 0 0 0 0 2 1 0 0 0 0 1 0 0 1 0 0 2 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 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 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 S >> 0 0 84 0, 0.0 4,-2.3 0, 0.0 3,-1.4 0.000 360.0 360.0 360.0 105.1 -26.8 4.7 -7.2 2 7 A S H 3> + 0 0 95 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.720 360.0 67.5 -57.2 -23.6 -26.2 8.0 -5.3 3 8 A V H 3> S+ 0 0 109 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.900 109.0 35.7 -60.1 -44.9 -22.5 7.6 -6.5 4 9 A Y H <> S+ 0 0 13 -3,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.881 115.0 56.9 -73.4 -43.0 -23.8 8.3 -10.0 5 10 A I H X S+ 0 0 34 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.867 107.9 47.0 -57.9 -41.5 -26.5 10.7 -8.9 6 11 A T H X S+ 0 0 87 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.914 111.5 48.5 -71.6 -44.2 -24.0 13.0 -7.2 7 12 A V H X S+ 0 0 73 -4,-1.2 4,-1.7 1,-0.2 -2,-0.2 0.925 111.1 52.9 -58.4 -45.2 -21.5 13.1 -10.1 8 13 A E H X S+ 0 0 0 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.834 107.8 51.9 -57.9 -35.7 -24.4 13.9 -12.4 9 14 A L H X S+ 0 0 94 -4,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.858 103.1 57.2 -73.0 -37.1 -25.4 16.8 -10.1 10 15 A A H X S+ 0 0 48 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.953 105.9 50.7 -53.7 -51.8 -21.9 18.3 -10.2 11 16 A I H X S+ 0 0 11 -4,-1.7 4,-3.0 1,-0.2 5,-0.2 0.841 105.4 55.9 -59.2 -40.0 -22.0 18.5 -14.0 12 17 A A H X S+ 0 0 8 -4,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.959 112.3 42.5 -56.2 -52.9 -25.4 20.3 -13.9 13 18 A V H X S+ 0 0 77 -4,-1.9 4,-3.4 2,-0.2 -2,-0.2 0.971 115.2 49.3 -55.5 -58.9 -24.0 23.0 -11.6 14 19 A L H X S+ 0 0 90 -4,-3.0 4,-2.4 1,-0.2 5,-0.2 0.851 112.8 48.1 -50.6 -42.2 -20.7 23.2 -13.7 15 20 A A H X S+ 0 0 0 -4,-3.0 4,-1.6 -5,-0.2 -1,-0.2 0.883 114.0 46.7 -66.6 -40.8 -22.8 23.5 -16.9 16 21 A I H X S+ 0 0 48 -4,-2.5 4,-2.2 -5,-0.2 5,-0.3 0.930 115.2 46.2 -66.0 -46.5 -25.0 26.2 -15.3 17 22 A L H X S+ 0 0 108 -4,-3.4 4,-2.8 1,-0.2 -2,-0.2 0.975 114.9 44.4 -61.2 -59.5 -22.0 28.1 -14.0 18 23 A G H X S+ 0 0 9 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.833 118.7 43.0 -54.0 -39.6 -19.9 28.1 -17.1 19 24 A N H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.779 112.3 50.6 -86.6 -27.9 -22.8 28.9 -19.4 20 25 A V H X S+ 0 0 57 -4,-2.2 4,-3.8 2,-0.2 5,-0.2 0.911 111.2 52.6 -65.1 -44.5 -24.3 31.6 -17.3 21 26 A L H X S+ 0 0 29 -4,-2.8 4,-2.5 -5,-0.3 -2,-0.2 0.916 110.2 47.4 -52.5 -48.4 -20.7 33.0 -17.2 22 27 A V H X S+ 0 0 0 -4,-1.7 4,-0.9 2,-0.2 -1,-0.2 0.909 116.1 43.3 -61.0 -46.3 -20.7 32.9 -21.0 23 28 A C H >X S+ 0 0 32 -4,-2.2 4,-1.1 2,-0.2 3,-0.6 0.896 111.9 53.6 -69.2 -42.4 -24.1 34.6 -21.3 24 29 A W H >X S+ 0 0 119 -4,-3.8 4,-1.8 1,-0.2 3,-1.2 0.952 104.0 57.6 -51.3 -53.8 -23.2 37.1 -18.6 25 30 A A H 3X S+ 0 0 0 -4,-2.5 4,-1.5 1,-0.3 -1,-0.2 0.742 103.5 51.8 -52.3 -32.1 -20.1 38.1 -20.5 26 31 A V H << S+ 0 0 18 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.768 107.6 52.4 -80.6 -26.3 -22.0 39.0 -23.7 27 32 A W H << S+ 0 0 197 -3,-1.2 -2,-0.2 -4,-1.1 -1,-0.2 0.924 117.7 35.7 -72.6 -45.8 -24.4 41.3 -21.8 28 33 A L H < S+ 0 0 89 -4,-1.8 2,-0.6 1,-0.1 -2,-0.2 0.991 105.2 67.3 -72.0 -65.6 -21.6 43.3 -20.1 29 34 A N >< - 0 0 15 -4,-1.5 3,-1.0 1,-0.2 4,-0.3 -0.462 64.5-162.6 -67.3 110.8 -18.9 43.5 -22.8 30 35 A S G > S+ 0 0 90 -2,-0.6 3,-0.6 1,-0.3 -1,-0.2 0.675 86.5 62.9 -70.1 -20.4 -20.2 45.6 -25.6 31 36 A N G 3 S+ 0 0 119 1,-0.2 -1,-0.3 249,-0.1 -5,-0.1 0.781 95.8 60.7 -72.0 -28.1 -17.5 44.3 -28.0 32 37 A L G < S+ 0 0 6 -3,-1.0 2,-1.8 -7,-0.2 -1,-0.2 0.577 78.6 98.0 -74.0 -10.5 -19.0 40.8 -27.7 33 38 A Q < + 0 0 111 -3,-0.6 2,-0.3 -4,-0.3 -1,-0.2 -0.422 56.6 113.4 -87.4 65.5 -22.3 41.9 -29.0 34 39 A N S >> S- 0 0 69 -2,-1.8 3,-1.6 1,-0.0 4,-0.6 -0.840 80.7 -95.8-127.5 170.0 -22.1 40.9 -32.7 35 40 A V H >> S+ 0 0 35 1,-0.3 3,-1.3 -2,-0.3 4,-0.8 0.842 117.3 62.6 -50.6 -44.1 -23.7 38.3 -35.0 36 41 A T H 34 S+ 0 0 18 1,-0.3 4,-0.3 2,-0.2 -1,-0.3 0.784 102.7 50.4 -52.7 -32.9 -21.0 35.7 -34.5 37 42 A N H <> S+ 0 0 15 -3,-1.6 4,-2.2 -5,-0.2 -1,-0.3 0.556 88.6 77.7 -94.1 -9.3 -21.8 35.5 -30.8 38 43 A Y H S+ 0 0 0 -4,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.887 110.7 45.7 -78.0 -42.2 -22.5 31.2 -28.9 41 46 A V H X S+ 0 0 44 -4,-2.2 4,-3.4 -3,-0.3 -2,-0.2 0.909 111.4 53.9 -67.3 -43.2 -25.3 32.4 -26.6 42 47 A S H X S+ 0 0 16 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.955 112.3 43.3 -50.9 -57.1 -27.8 30.1 -28.2 43 48 A A H X S+ 0 0 1 -4,-1.5 4,-1.7 46,-0.4 -2,-0.2 0.885 115.9 48.0 -60.2 -41.3 -25.5 27.1 -27.6 44 49 A A H X S+ 0 0 0 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.860 109.2 54.7 -66.6 -37.0 -24.8 28.3 -24.0 45 50 A A H X S+ 0 0 40 -4,-3.4 4,-2.2 2,-0.2 -2,-0.2 0.925 107.1 50.2 -60.0 -47.7 -28.5 28.8 -23.4 46 51 A A H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 40,-0.2 0.893 107.9 52.4 -57.9 -44.6 -29.3 25.2 -24.4 47 52 A D H X S+ 0 0 1 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.799 106.7 53.7 -65.9 -31.2 -26.6 23.8 -22.1 48 53 A I H X S+ 0 0 35 -4,-1.4 4,-3.6 2,-0.2 3,-0.3 0.974 109.2 48.0 -61.5 -54.4 -28.1 25.8 -19.2 49 54 A L H X>S+ 0 0 57 -4,-2.2 4,-2.1 1,-0.3 5,-1.7 0.781 110.4 53.4 -55.9 -30.2 -31.5 24.2 -20.1 50 55 A V H <>S+ 0 0 0 -4,-1.7 5,-2.9 3,-0.2 -1,-0.3 0.892 114.5 40.2 -70.0 -41.9 -29.5 20.9 -20.1 51 56 A G H <5S+ 0 0 2 -4,-2.1 -2,-0.2 -3,-0.3 -3,-0.2 0.893 123.6 39.4 -71.9 -42.3 -28.2 21.6 -16.6 52 57 A V H <5S+ 0 0 74 -4,-3.6 -3,-0.2 -5,-0.1 -2,-0.2 0.926 136.9 6.2 -74.7 -48.6 -31.4 23.0 -15.2 53 58 A L T X5S+ 0 0 61 -4,-2.1 4,-1.9 -5,-0.3 -3,-0.2 0.860 124.8 49.2-106.5 -49.6 -34.0 20.7 -16.9 54 59 A A H >> S+ 0 0 56 0, 0.0 4,-1.6 0, 0.0 3,-0.7 0.964 113.5 45.5 -56.1 -51.3 -32.6 16.5 -13.3 57 62 A F H 3X S+ 0 0 67 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.892 108.8 56.0 -57.1 -43.8 -35.0 14.5 -15.6 58 63 A A H 3< S+ 0 0 11 -4,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.771 105.5 53.4 -59.7 -29.3 -32.1 12.2 -16.6 59 64 A I H X< S+ 0 0 27 -4,-1.4 3,-1.0 -3,-0.7 4,-0.5 0.895 106.6 50.6 -72.7 -43.3 -31.6 11.4 -12.8 60 65 A A H >X>S+ 0 0 33 -4,-1.6 3,-1.5 1,-0.2 4,-0.8 0.904 104.2 58.7 -58.3 -44.5 -35.3 10.5 -12.3 61 66 A I T 3<5S+ 0 0 10 -4,-1.9 102,-0.5 1,-0.3 -1,-0.2 0.627 98.8 60.3 -63.5 -16.6 -35.3 8.1 -15.2 62 67 A S T <45S+ 0 0 28 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.2 0.652 96.3 59.7 -87.6 -17.2 -32.4 6.1 -13.6 63 68 A T T <45S- 0 0 84 -3,-1.5 -2,-0.2 -4,-0.5 -1,-0.2 0.812 96.8-131.3 -82.8 -33.9 -34.4 5.1 -10.5 64 69 A G T <5 - 0 0 2 97,-0.9 98,-0.2 -4,-0.8 -3,-0.1 0.894 36.8-176.2 80.2 44.7 -37.3 3.3 -12.1 65 70 A F < - 0 0 66 -5,-0.5 96,-3.1 96,-0.5 2,-0.6 -0.256 31.7 -95.5 -71.9 160.1 -40.0 5.1 -10.2 66 71 A a E +A 160 0A 46 94,-0.2 2,-0.3 86,-0.1 94,-0.2 -0.684 66.5 123.0 -83.3 118.5 -43.7 4.2 -10.6 67 72 A A E -A 159 0A 22 92,-1.5 92,-2.2 -2,-0.6 2,-0.1 -0.949 65.6 -65.8-157.2 174.2 -45.6 6.4 -13.1 68 73 A A >> - 0 0 52 -2,-0.3 4,-2.5 90,-0.2 3,-0.5 -0.427 43.7-126.1 -64.9 141.0 -47.7 6.1 -16.2 69 74 A b H 3> S+ 0 0 15 88,-0.3 4,-2.3 1,-0.2 5,-0.2 0.929 111.5 48.7 -53.8 -51.1 -45.8 4.8 -19.3 70 75 A H H 3> S+ 0 0 121 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.689 110.6 52.5 -68.8 -18.9 -46.8 7.8 -21.4 71 76 A G H <> S+ 0 0 35 -3,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.889 109.1 49.5 -74.7 -44.5 -45.8 10.1 -18.6 72 77 A c H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.864 108.6 53.1 -61.1 -39.6 -42.4 8.4 -18.4 73 78 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.848 103.3 57.2 -65.4 -36.8 -41.9 8.7 -22.2 74 79 A F H X S+ 0 0 116 -4,-0.9 4,-1.8 2,-0.2 -1,-0.2 0.877 106.7 49.1 -63.5 -39.3 -42.6 12.5 -22.1 75 80 A I H X S+ 0 0 35 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.921 113.0 46.5 -64.5 -46.0 -39.7 12.9 -19.6 76 81 A A H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.893 112.2 50.6 -64.7 -40.9 -37.3 10.9 -21.8 77 82 A C H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.846 107.1 54.7 -64.9 -35.4 -38.4 12.8 -24.9 78 83 A F H X S+ 0 0 56 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.892 108.5 48.3 -65.6 -40.6 -37.8 16.1 -23.1 79 84 A V H X S+ 0 0 15 -4,-1.8 4,-2.4 2,-0.2 5,-0.3 0.944 111.4 50.5 -60.3 -49.4 -34.2 15.0 -22.3 80 85 A L H X S+ 0 0 7 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.866 110.8 50.3 -57.1 -40.1 -33.7 13.9 -26.0 81 86 A V H X S+ 0 0 1 -4,-2.3 4,-2.2 50,-0.2 -1,-0.2 0.938 112.9 42.9 -63.5 -51.2 -35.0 17.4 -27.1 82 87 A L H X S+ 0 0 9 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.838 113.9 50.1 -70.9 -37.0 -32.8 19.5 -24.9 83 88 A T H X S+ 0 0 16 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.878 111.6 50.8 -64.7 -38.1 -29.6 17.4 -25.5 84 89 A A H X S+ 0 0 0 -4,-1.6 4,-2.5 -5,-0.3 -2,-0.2 0.903 107.5 52.0 -64.7 -43.1 -30.4 17.7 -29.2 85 90 A S H X S+ 0 0 1 -4,-2.2 4,-2.3 1,-0.2 5,-0.3 0.885 107.3 53.8 -59.3 -41.7 -30.7 21.5 -29.0 86 91 A S H X S+ 0 0 1 -4,-1.8 4,-1.1 -40,-0.2 -1,-0.2 0.908 111.4 45.6 -56.6 -46.6 -27.3 21.6 -27.2 87 92 A I H X S+ 0 0 2 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.902 115.3 44.4 -65.2 -46.1 -25.7 19.7 -30.1 88 93 A F H X S+ 0 0 19 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.908 110.3 52.2 -72.8 -44.1 -27.3 21.7 -33.0 89 94 A S H X S+ 0 0 1 -4,-2.3 4,-1.2 1,-0.2 -46,-0.4 0.839 111.3 51.0 -57.9 -33.1 -26.8 25.1 -31.5 90 95 A L H X S+ 0 0 2 -4,-1.1 4,-1.4 -5,-0.3 -2,-0.2 0.888 106.8 52.9 -67.4 -42.0 -23.1 24.0 -31.2 91 96 A L H X S+ 0 0 19 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.855 101.1 61.2 -61.0 -38.1 -23.2 22.9 -34.9 92 97 A A H X S+ 0 0 7 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.921 101.1 53.5 -53.3 -46.9 -24.4 26.4 -35.8 93 98 A I H X S+ 0 0 1 -4,-1.2 4,-2.3 -54,-0.3 -1,-0.2 0.926 109.2 48.5 -53.4 -49.1 -21.1 27.8 -34.3 94 99 A A H X S+ 0 0 2 -4,-1.4 4,-1.6 1,-0.2 -1,-0.2 0.871 111.8 48.2 -60.0 -41.3 -19.1 25.4 -36.5 95 100 A I H X S+ 0 0 74 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.837 110.1 53.3 -70.6 -33.4 -21.1 26.4 -39.7 96 101 A D H X S+ 0 0 5 -4,-2.4 4,-3.0 -5,-0.2 3,-0.2 0.961 108.8 47.8 -63.3 -53.5 -20.6 30.1 -38.9 97 102 A R H X S+ 0 0 49 -4,-2.3 4,-1.4 1,-0.2 5,-0.2 0.830 107.7 58.3 -55.6 -36.3 -16.8 29.8 -38.5 98 103 A Y H X S+ 0 0 79 -4,-1.6 4,-2.9 2,-0.2 5,-0.4 0.924 110.7 40.5 -60.2 -47.9 -16.9 27.9 -41.8 99 104 A I H X S+ 0 0 38 -4,-1.8 4,-2.2 -3,-0.2 -2,-0.2 0.930 113.0 56.0 -64.6 -45.4 -18.5 30.8 -43.6 100 105 A A H < S+ 0 0 19 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.722 117.7 34.7 -59.7 -25.5 -16.2 33.2 -41.7 101 106 A I H < S+ 0 0 26 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.864 123.9 38.0 -95.8 -47.5 -13.2 31.4 -43.0 102 107 A R H < S+ 0 0 113 -4,-2.9 -3,-0.2 1,-0.3 -2,-0.2 0.887 135.2 17.8 -76.2 -40.8 -14.1 30.3 -46.5 103 108 A I S < S+ 0 0 90 -4,-2.2 4,-0.5 -5,-0.4 -1,-0.3 -0.676 72.4 156.3-130.8 77.4 -16.1 33.4 -47.5 104 109 A P + 0 0 70 0, 0.0 4,-0.4 0, 0.0 -1,-0.1 0.631 65.6 61.6 -82.1 -15.1 -15.0 36.1 -45.1 105 110 A L S > S+ 0 0 160 1,-0.2 3,-0.7 2,-0.1 4,-0.2 0.976 113.3 29.6 -75.8 -60.1 -15.9 39.1 -47.3 106 111 A R T >> S+ 0 0 190 1,-0.2 4,-1.2 2,-0.1 3,-1.1 0.493 97.8 94.0 -80.2 -3.0 -19.6 38.6 -47.9 107 112 A Y H 3> S+ 0 0 15 -4,-0.5 4,-2.6 1,-0.3 3,-0.4 0.877 83.1 52.0 -50.7 -44.4 -19.9 37.0 -44.4 108 113 A N H <4 S+ 0 0 124 -3,-0.7 -1,-0.3 -4,-0.4 -2,-0.1 0.666 116.7 40.1 -71.0 -17.3 -20.8 40.4 -42.9 109 114 A G H <4 S+ 0 0 51 -3,-1.1 -1,-0.2 -4,-0.2 -2,-0.2 0.438 122.3 40.7-107.0 -5.7 -23.5 40.7 -45.5 110 115 A L H < S+ 0 0 78 -4,-1.2 2,-1.4 -3,-0.4 -3,-0.2 0.793 108.8 54.6-105.2 -52.6 -24.7 37.1 -45.4 111 116 A V S < S+ 0 0 15 -4,-2.6 2,-0.2 -5,-0.2 -1,-0.2 -0.670 78.7 164.5 -88.5 85.1 -24.6 36.2 -41.7 112 117 A T > - 0 0 47 -2,-1.4 4,-2.7 -3,-0.2 5,-0.2 -0.586 52.7-103.6-100.5 164.0 -26.8 38.9 -40.3 113 118 A G H > S+ 0 0 21 2,-0.2 4,-0.9 -2,-0.2 -1,-0.1 0.773 121.3 47.7 -56.8 -32.4 -28.6 39.3 -36.9 114 119 A T H >> S+ 0 0 117 2,-0.2 4,-1.5 1,-0.1 3,-0.9 0.970 113.8 44.2 -71.6 -58.2 -31.9 38.4 -38.5 115 120 A R H 3> S+ 0 0 134 1,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.811 107.6 62.3 -55.7 -32.4 -30.7 35.3 -40.4 116 121 A A H 3X S+ 0 0 0 -4,-2.7 4,-1.6 1,-0.2 -1,-0.3 0.879 104.2 46.8 -60.1 -40.5 -28.8 34.3 -37.3 117 122 A K H X S+ 0 0 52 -4,-1.8 4,-2.5 2,-0.2 3,-0.8 0.967 106.6 51.1 -57.6 -55.9 -35.0 28.6 -34.9 122 127 A I H 3X S+ 0 0 94 -4,-2.1 4,-2.9 1,-0.3 5,-0.2 0.867 105.6 57.0 -48.1 -43.6 -34.0 25.7 -37.2 123 128 A C H 3X S+ 0 0 11 -4,-1.8 4,-1.0 1,-0.2 -1,-0.3 0.876 112.6 40.9 -57.1 -38.9 -31.9 24.3 -34.4 124 129 A W H < S+ 0 0 7 -4,-1.5 3,-0.6 -5,-0.2 -2,-0.2 0.923 119.4 41.4 -73.9 -48.1 -36.4 14.5 -33.3 131 136 A G H 3< S+ 0 0 0 -4,-2.3 -50,-0.2 1,-0.2 -51,-0.2 0.688 116.8 49.6 -77.2 -19.9 -36.9 14.2 -29.6 132 137 A L T >X S+ 0 0 58 -4,-2.0 4,-0.8 -5,-0.2 3,-0.5 0.427 82.7 94.7 -97.6 -0.6 -40.7 14.2 -29.9 133 138 A T G X4>S+ 0 0 27 -3,-0.6 5,-0.8 -4,-0.3 3,-0.8 0.868 81.8 54.9 -55.2 -40.7 -40.7 11.4 -32.6 134 139 A P G >45S+ 0 0 0 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 0.846 98.1 64.6 -64.6 -28.9 -41.2 8.7 -29.9 135 140 A M G <45S+ 0 0 56 -3,-0.5 -2,-0.2 1,-0.3 4,-0.1 0.796 91.4 64.6 -60.2 -31.9 -44.3 10.6 -28.7 136 141 A L G <<5S- 0 0 160 -3,-0.8 -1,-0.3 -4,-0.8 -3,-0.1 0.709 135.8 -72.3 -67.2 -22.9 -46.0 10.0 -32.0 137 142 A G T < 5S+ 0 0 47 -3,-1.3 2,-3.1 -4,-0.4 5,-0.2 0.098 102.4 114.1 153.1 -25.7 -46.1 6.2 -31.5 138 143 A W < + 0 0 90 -5,-0.8 2,-0.3 2,-0.1 -2,-0.1 -0.338 60.0 106.6 -70.2 65.1 -42.5 5.1 -31.9 139 144 A N S > S- 0 0 20 -2,-3.1 3,-0.8 28,-0.1 28,-0.2 -0.989 79.3-118.8-148.2 151.5 -42.3 4.1 -28.2 140 145 A N G > S+ 0 0 55 26,-2.4 3,-1.1 -2,-0.3 27,-0.1 0.210 82.8 105.2 -78.6 17.1 -42.3 0.9 -26.1 141 146 A b G 3 + 0 0 9 25,-0.3 -1,-0.2 1,-0.2 -72,-0.1 0.722 67.4 66.1 -72.5 -22.8 -45.5 1.9 -24.2 142 147 A G G < S+ 0 0 56 -3,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.705 106.0 46.1 -66.2 -20.5 -47.6 -0.7 -26.2 143 148 A Q S < S- 0 0 145 -3,-1.1 -1,-0.3 23,-0.1 -2,-0.1 -0.570 81.9-173.4-125.7 67.0 -45.6 -3.4 -24.4 144 149 A P - 0 0 54 0, 0.0 2,-0.9 0, 0.0 -3,-0.1 -0.224 26.0-124.2 -63.2 149.2 -45.4 -2.5 -20.7 145 150 A K > + 0 0 103 1,-0.2 4,-1.6 15,-0.1 15,-0.5 -0.808 35.7 167.6 -98.8 97.0 -43.1 -4.6 -18.4 146 151 A E H > S+ 0 0 134 -2,-0.9 4,-1.7 2,-0.2 -1,-0.2 0.742 72.4 64.4 -82.8 -25.1 -45.4 -5.8 -15.6 147 152 A G H > S+ 0 0 65 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.794 113.2 36.6 -64.4 -29.9 -42.9 -8.3 -14.2 148 153 A K H > S+ 0 0 81 2,-0.2 4,-1.3 -3,-0.2 -2,-0.2 0.784 111.9 57.8 -89.1 -36.4 -40.7 -5.3 -13.3 149 154 A A H <>S+ 0 0 5 -4,-1.6 5,-2.7 1,-0.2 -2,-0.2 0.794 106.1 53.0 -64.3 -29.6 -43.6 -3.0 -12.3 150 155 A H H ><5S+ 0 0 153 -4,-1.7 3,-2.5 3,-0.2 -1,-0.2 0.939 102.6 54.7 -70.2 -49.9 -44.6 -5.6 -9.7 151 156 A S H 3<5S+ 0 0 102 -4,-0.8 -2,-0.2 1,-0.3 -1,-0.2 0.807 109.8 48.9 -53.8 -32.9 -41.1 -5.8 -8.1 152 157 A Q T 3<5S- 0 0 113 -4,-1.3 -1,-0.3 -87,-0.0 -2,-0.2 0.378 115.0-120.1 -88.4 2.1 -41.2 -2.0 -7.6 153 158 A G T < 5 + 0 0 65 -3,-2.5 -3,-0.2 1,-0.2 2,-0.2 0.804 50.4 170.9 64.0 33.1 -44.7 -2.3 -6.1 154 159 A a < - 0 0 20 -5,-2.7 -1,-0.2 -6,-0.1 4,-0.1 -0.519 31.4-116.4 -77.4 141.5 -46.3 -0.1 -8.8 155 160 A G > - 0 0 37 -2,-0.2 3,-1.4 1,-0.2 2,-0.2 -0.071 48.3 -66.7 -67.7 172.7 -50.1 0.2 -9.0 156 161 A E T 3 S+ 0 0 201 1,-0.3 -1,-0.2 3,-0.0 3,-0.1 -0.443 125.7 27.4 -67.3 131.9 -52.2 -0.9 -11.9 157 162 A G T 3 S+ 0 0 71 1,-0.3 2,-0.4 -2,-0.2 -88,-0.3 0.584 104.0 108.9 88.4 14.3 -51.5 1.2 -15.0 158 163 A Q < - 0 0 77 -3,-1.4 -1,-0.3 -90,-0.2 2,-0.3 -0.970 44.9-173.0-128.3 140.8 -48.0 1.9 -13.8 159 164 A V E -A 67 0A 12 -92,-2.2 -92,-1.5 -2,-0.4 2,-0.7 -0.841 40.9 -89.8-123.9 161.3 -44.6 0.8 -15.0 160 165 A A E -A 66 0A 3 -15,-0.5 2,-1.4 -2,-0.3 -94,-0.2 -0.646 47.5-126.2 -72.8 111.1 -41.0 1.2 -13.7 161 166 A c + 0 0 0 -96,-3.1 -97,-0.9 -2,-0.7 -96,-0.5 -0.441 50.4 149.2 -69.7 89.1 -39.9 4.4 -15.4 162 167 A L > - 0 0 41 -2,-1.4 4,-0.7 -98,-0.2 3,-0.4 -0.844 50.6-129.5-113.7 157.9 -36.6 3.5 -17.2 163 168 A F H >> S+ 0 0 60 -102,-0.5 4,-2.7 -2,-0.3 3,-1.7 0.980 110.8 49.7 -66.5 -57.2 -35.2 5.0 -20.4 164 169 A E H 34 S+ 0 0 65 1,-0.3 -1,-0.2 2,-0.2 5,-0.1 0.483 107.3 61.2 -63.0 -1.7 -34.6 1.7 -22.1 165 170 A D H 34 S+ 0 0 20 -3,-0.4 -1,-0.3 3,-0.1 -2,-0.2 0.697 118.6 19.2 -97.6 -25.6 -38.2 0.8 -21.1 166 171 A V H << S+ 0 0 2 -3,-1.7 -26,-2.4 -4,-0.7 -25,-0.3 0.678 112.4 70.5-115.7 -30.8 -40.0 3.5 -23.0 167 172 A V S < S- 0 0 2 -4,-2.7 -1,-0.2 -28,-0.2 -28,-0.1 -0.847 83.5-126.7 -98.2 116.5 -37.6 4.7 -25.7 168 173 A P > - 0 0 4 0, 0.0 4,-1.7 0, 0.0 5,-0.1 -0.279 4.2-136.1 -64.5 142.8 -37.0 2.1 -28.4 169 174 A M H > S+ 0 0 33 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.796 105.2 56.2 -69.4 -31.2 -33.4 1.0 -29.3 170 175 A N H >>S+ 0 0 59 2,-0.2 4,-2.7 1,-0.2 5,-0.7 0.893 106.2 50.5 -68.9 -39.2 -34.1 1.2 -33.0 171 176 A Y H >>S+ 0 0 0 3,-0.2 5,-3.5 2,-0.2 4,-1.2 0.919 114.1 46.8 -56.9 -45.4 -35.2 4.9 -32.6 172 177 A M H <>S+ 0 0 9 -4,-1.7 5,-3.0 3,-0.2 -2,-0.2 0.944 122.1 32.7 -62.3 -50.6 -31.9 5.4 -30.7 173 178 A V H <>S+ 0 0 3 -4,-3.0 5,-0.5 3,-0.2 -3,-0.2 0.950 128.0 33.8 -76.4 -51.0 -29.6 3.6 -33.2 174 179 A Y H <5S+ 0 0 128 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.1 0.835 135.7 13.8 -79.2 -37.0 -31.3 4.4 -36.5 175 180 A F T XXS+ 0 0 8 -5,-3.5 4,-2.6 2,-0.2 5,-0.6 0.920 116.0 47.0 -64.7 -49.3 -31.3 9.5 -32.8 177 182 A F H >XS+ 0 0 25 -5,-3.0 5,-2.3 -6,-0.3 4,-1.5 0.924 119.9 39.5 -57.6 -48.1 -27.6 8.4 -33.3 178 183 A F H 4XS+ 0 0 93 -5,-0.5 5,-1.9 3,-0.2 -2,-0.2 0.904 121.8 41.1 -71.3 -43.1 -27.5 9.4 -37.0 179 184 A A H <5S+ 0 0 23 -4,-2.7 -3,-0.2 3,-0.1 -2,-0.2 0.904 126.5 29.8 -72.9 -43.2 -29.5 12.6 -36.7 180 185 A C H <5S+ 0 0 2 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.812 133.9 13.3 -91.9 -32.5 -28.1 14.0 -33.4 181 186 A V T X S+ 0 0 1 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.876 115.4 53.0 -53.0 -35.5 -23.4 16.9 -36.9 185 190 A L H X S+ 0 0 16 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.920 110.5 46.0 -61.8 -45.6 -20.0 15.2 -36.0 186 191 A L H X S+ 0 0 110 -4,-2.5 4,-2.8 -3,-0.2 -1,-0.2 0.893 113.3 49.2 -64.7 -41.8 -19.2 14.6 -39.7 187 192 A L H X S+ 0 0 94 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.929 113.5 45.3 -63.4 -47.3 -20.2 18.2 -40.6 188 193 A M H X S+ 0 0 2 -4,-2.4 4,-2.9 -5,-0.3 -2,-0.2 0.922 113.8 50.1 -61.6 -45.6 -18.1 19.7 -37.9 189 194 A L H X S+ 0 0 68 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.925 110.9 49.9 -56.8 -47.0 -15.2 17.4 -38.7 190 195 A G H X S+ 0 0 33 -4,-2.8 4,-1.1 2,-0.2 -2,-0.2 0.873 110.6 50.0 -57.6 -42.0 -15.6 18.5 -42.4 191 196 A V H X S+ 0 0 14 -4,-2.4 4,-1.2 2,-0.2 3,-0.5 0.936 110.1 49.8 -62.6 -49.3 -15.5 22.1 -41.3 192 197 A Y H >X S+ 0 0 54 -4,-2.9 4,-2.9 1,-0.2 3,-0.8 0.927 109.0 51.7 -54.9 -48.8 -12.4 21.6 -39.2 193 198 A L H 3X S+ 0 0 85 -4,-2.6 4,-1.9 1,-0.3 -1,-0.2 0.761 108.7 52.3 -62.3 -25.4 -10.6 19.9 -42.2 194 199 A R H 3< S+ 0 0 117 -4,-1.1 4,-0.5 -3,-0.5 -1,-0.3 0.697 112.8 43.8 -82.8 -21.5 -11.5 22.8 -44.4 195 200 A I H X S+ 0 0 92 -4,-2.9 4,-1.9 2,-0.2 3,-0.7 0.956 109.7 49.0 -64.0 -52.1 -7.0 23.1 -41.4 197 202 A L H 3X S+ 0 0 35 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.774 106.1 58.5 -57.7 -31.2 -6.4 22.8 -45.2 198 203 A A H 3> S+ 0 0 11 -4,-0.5 4,-1.1 2,-0.2 -1,-0.2 0.850 108.0 45.6 -66.8 -36.6 -6.7 26.6 -45.3 199 204 A A H < S+ 0 0 150 -4,-1.8 3,-0.6 1,-0.2 4,-0.5 0.769 104.9 56.8 -72.2 -27.1 3.0 26.2 -48.0 205 210 A Q H >< S+ 0 0 130 -4,-1.0 3,-0.6 1,-0.2 -1,-0.2 0.776 94.8 64.1 -74.4 -28.5 3.1 29.8 -49.3 206 211 A M T 3< S+ 0 0 136 -4,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.619 92.6 66.5 -70.2 -12.9 5.6 30.9 -46.5 207 212 A E T < 0 0 157 -3,-0.6 -1,-0.2 -4,-0.3 -2,-0.2 0.843 360.0 360.0 -75.1 -36.2 8.1 28.5 -48.1 208 213 A S < 0 0 149 -3,-0.6 -3,-0.0 -4,-0.5 0, 0.0 -0.590 360.0 360.0 -77.0 360.0 8.4 30.6 -51.3 209 ! 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 0.0 210 224 A T > 0 0 118 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -38.1 -5.2 35.4 -41.6 211 225 A L H > + 0 0 36 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.853 360.0 51.1 -60.5 -38.1 -2.8 32.5 -40.9 212 226 A Q H > S+ 0 0 176 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.825 111.6 48.4 -68.9 -33.4 -2.8 33.3 -37.1 213 227 A K H > S+ 0 0 157 -3,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.910 111.7 48.8 -68.8 -44.6 -6.7 33.4 -37.1 214 228 A E H X S+ 0 0 15 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.784 109.5 50.9 -71.3 -31.0 -6.9 30.0 -39.0 215 229 A V H X S+ 0 0 78 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.905 114.7 43.8 -71.1 -43.6 -4.5 28.2 -36.7 216 230 A H H X S+ 0 0 72 -4,-1.3 4,-2.5 2,-0.2 -2,-0.2 0.942 114.4 49.3 -64.6 -49.1 -6.4 29.3 -33.6 217 231 A A H X S+ 0 0 11 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.881 109.1 54.4 -56.3 -41.0 -9.8 28.6 -35.3 218 232 A A H X S+ 0 0 9 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.930 110.6 43.9 -60.3 -47.7 -8.5 25.1 -36.2 219 233 A K H X S+ 0 0 124 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.858 112.4 53.5 -68.4 -35.2 -7.5 24.3 -32.7 220 234 A S H X S+ 0 0 1 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.920 113.4 43.1 -61.1 -44.6 -10.8 25.7 -31.4 221 235 A L H X S+ 0 0 2 -4,-2.7 4,-2.4 2,-0.2 5,-0.3 0.866 110.3 55.8 -68.9 -37.3 -12.6 23.5 -33.8 222 236 A A H X S+ 0 0 38 -4,-2.7 4,-2.1 2,-0.2 5,-0.2 0.856 109.1 48.3 -63.2 -34.6 -10.4 20.5 -33.0 223 237 A I H X S+ 0 0 40 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.955 111.0 49.3 -68.7 -50.1 -11.4 21.0 -29.3 224 238 A I H X S+ 0 0 4 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.926 118.0 39.5 -51.7 -51.5 -15.1 21.2 -30.1 225 239 A V H X S+ 0 0 10 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.902 114.7 51.0 -71.8 -44.9 -15.1 18.0 -32.2 226 240 A G H X S+ 0 0 41 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.921 116.0 41.9 -57.9 -47.3 -12.7 16.0 -30.1 227 241 A L H X S+ 0 0 44 -4,-2.5 4,-2.9 -5,-0.2 -2,-0.2 0.872 112.3 54.9 -68.9 -38.3 -14.7 16.6 -27.0 228 242 A F H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.3 5,-0.3 0.913 111.8 43.5 -60.1 -45.7 -18.0 16.1 -28.8 229 243 A A H X S+ 0 0 24 -4,-2.6 4,-1.4 2,-0.2 -1,-0.2 0.850 115.1 50.0 -67.5 -36.5 -16.9 12.7 -30.0 230 244 A L H < S+ 0 0 111 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.894 116.7 41.3 -67.2 -41.2 -15.5 11.9 -26.5 231 245 A C H < S+ 0 0 5 -4,-2.9 4,-0.3 -5,-0.1 -2,-0.2 0.889 125.8 28.7 -74.1 -42.3 -18.7 12.9 -24.8 232 246 A W H X S+ 0 0 12 -4,-2.4 4,-1.4 -5,-0.2 -3,-0.2 0.812 105.3 64.5 -98.1 -34.9 -21.3 11.4 -27.2 233 247 A L H X S+ 0 0 42 -4,-1.4 4,-3.5 -5,-0.3 5,-0.3 0.902 92.7 59.6 -63.3 -46.5 -19.9 8.3 -28.9 234 248 A P H > S+ 0 0 44 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.924 108.8 44.4 -50.7 -52.9 -19.4 5.9 -26.0 235 249 A L H > S+ 0 0 26 24,-0.3 4,-2.4 -4,-0.3 -2,-0.2 0.888 116.9 46.7 -56.6 -42.5 -23.1 6.0 -25.0 236 250 A H H X S+ 0 0 4 -4,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.897 111.1 50.4 -71.2 -40.4 -24.2 5.6 -28.6 237 251 A I H X S+ 0 0 99 -4,-3.5 4,-2.9 2,-0.2 -2,-0.2 0.936 110.4 50.7 -59.0 -47.5 -21.8 2.8 -29.3 238 252 A I H X S+ 0 0 18 -4,-2.9 4,-3.0 -5,-0.3 -2,-0.2 0.940 108.9 52.5 -54.5 -46.8 -23.1 1.0 -26.2 239 253 A N H X S+ 0 0 7 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.899 109.2 48.8 -52.3 -46.1 -26.6 1.6 -27.6 240 254 A C H X S+ 0 0 25 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.926 110.7 50.6 -61.6 -46.2 -25.5 -0.0 -30.9 241 255 A F H X S+ 0 0 87 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.933 111.9 47.5 -54.2 -50.9 -24.0 -3.0 -29.0 242 256 A T H < S+ 0 0 21 -4,-3.0 -2,-0.2 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4,-2.0 0, 0.0 3,-0.3 -0.027 28.2-125.8 -46.6 142.0 -22.7 -3.1 -17.1 253 267 A L H > S+ 0 0 101 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.729 110.1 58.3 -65.2 -26.6 -24.7 -0.4 -15.3 254 268 A W H > S+ 0 0 169 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.906 109.1 45.9 -67.1 -40.0 -21.6 1.3 -14.0 255 269 A L H > S+ 0 0 51 -3,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.855 111.5 52.2 -69.1 -37.6 -20.6 1.7 -17.7 256 270 A M H X S+ 0 0 18 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.976 112.2 45.3 -57.6 -55.6 -24.1 2.9 -18.5 257 271 A Y H X S+ 0 0 30 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.857 113.7 50.2 -55.9 -41.5 -23.8 5.5 -15.7 258 272 A L H X S+ 0 0 84 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.915 113.1 45.3 -62.9 -45.9 -20.4 6.5 -16.9 259 273 A A H X S+ 0 0 3 -4,-2.7 4,-1.8 2,-0.2 -24,-0.3 0.882 113.0 49.1 -67.9 -43.0 -21.6 6.9 -20.6 260 274 A I H X S+ 0 0 41 -4,-2.8 4,-1.5 2,-0.2 -1,-0.2 0.928 114.6 45.6 -61.0 -47.6 -24.7 8.8 -19.6 261 275 A V H X S+ 0 0 20 -4,-2.1 4,-1.5 -5,-0.2 3,-0.5 0.948 111.3 52.8 -58.8 -50.2 -22.7 11.2 -17.4 262 276 A L H < S+ 0 0 51 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.816 106.2 54.0 -56.9 -34.8 -20.0 11.5 -20.1 263 277 A S H >< S+ 0 0 4 -4,-1.8 3,-0.9 1,-0.2 -1,-0.3 0.882 109.1 48.7 -66.4 -37.9 -22.8 12.5 -22.6 264 278 A H H >< S+ 0 0 6 -4,-1.5 3,-1.5 -3,-0.5 4,-0.3 0.725 94.4 73.1 -75.1 -25.2 -23.9 15.3 -20.3 265 279 A T T 3X S+ 0 0 40 -4,-1.5 4,-1.3 1,-0.3 3,-0.3 0.489 78.0 79.2 -72.2 -2.4 -20.5 16.7 -19.7 266 280 A N H <> S+ 0 0 0 -3,-0.9 4,-3.0 1,-0.2 -1,-0.3 0.806 85.9 60.4 -67.7 -30.5 -20.6 18.1 -23.2 267 281 A S H <4 S+ 0 0 2 -3,-1.5 -1,-0.2 1,-0.2 5,-0.2 0.708 104.1 47.4 -74.8 -22.9 -22.7 21.0 -21.9 268 282 A V H 4 S+ 0 0 27 -3,-0.3 -1,-0.2 -4,-0.3 -2,-0.2 0.872 122.2 33.6 -83.7 -41.0 -20.1 22.2 -19.5 269 283 A V H X S+ 0 0 27 -4,-1.3 4,-2.4 3,-0.2 5,-0.5 0.886 102.7 93.4 -82.2 -42.2 -17.2 22.1 -22.0 270 284 A N T < S- 0 0 1 -4,-3.0 -1,-0.2 1,-0.3 -180,-0.1 -0.893 107.0 -6.2-102.7 128.6 -19.2 23.1 -25.1 271 285 A P T > S+ 0 0 0 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 -0.888 122.3 79.3 -98.7 28.0 -19.3 25.8 -25.9 272 286 A F H >> S+ 0 0 45 1,-0.2 4,-2.5 2,-0.2 3,-0.7 0.954 96.5 45.8 -54.4 -59.8 -17.5 27.1 -22.8 273 287 A I H 3X S+ 0 0 47 -4,-2.4 4,-0.9 1,-0.3 -1,-0.2 0.816 107.8 58.2 -56.1 -36.9 -14.0 26.3 -23.8 274 288 A Y H 34 S+ 0 0 15 -5,-0.5 3,-0.5 1,-0.2 -1,-0.3 0.922 111.9 41.8 -57.6 -44.0 -14.5 27.8 -27.3 275 289 A A H X< S+ 0 0 0 -4,-1.7 3,-2.4 -3,-0.7 7,-0.3 0.896 106.8 60.8 -70.8 -42.2 -15.4 31.1 -25.6 276 290 A Y H 3< S+ 0 0 120 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.674 97.3 63.7 -56.9 -18.5 -12.6 30.8 -23.1 277 291 A R T 3< S+ 0 0 58 -4,-0.9 2,-0.5 -3,-0.5 -1,-0.3 0.234 85.8 82.6 -96.0 10.9 -10.3 30.8 -26.1 278 292 A I S <> S- 0 0 46 -3,-2.4 4,-2.4 1,-0.1 3,-0.4 -0.985 72.4-148.8-110.0 126.8 -11.3 34.3 -27.1 279 293 A R H > S+ 0 0 133 -2,-0.5 4,-3.0 1,-0.2 5,-0.3 0.912 95.9 59.1 -58.3 -46.3 -9.4 36.9 -25.2 280 294 A E H > S+ 0 0 53 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.830 112.2 42.0 -55.1 -36.5 -12.3 39.5 -25.2 281 295 A F H > S+ 0 0 1 -3,-0.4 4,-2.6 -6,-0.3 -1,-0.2 0.923 112.9 52.7 -69.8 -48.8 -14.4 36.8 -23.4 282 296 A R H X S+ 0 0 76 -4,-2.4 4,-1.3 -7,-0.3 -2,-0.2 0.828 108.5 49.0 -64.1 -37.5 -11.6 35.7 -21.0 283 297 A Q H X S+ 0 0 68 -4,-3.0 4,-2.1 2,-0.2 3,-0.4 0.938 113.9 46.8 -63.0 -48.5 -10.9 39.3 -19.8 284 298 A T H X S+ 0 0 0 -4,-1.1 4,-1.0 -5,-0.3 -2,-0.2 0.836 108.1 57.4 -60.6 -35.6 -14.6 39.7 -19.2 285 299 A F H X S+ 0 0 7 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.817 106.7 48.6 -65.0 -32.7 -14.6 36.3 -17.5 286 300 A R H X S+ 0 0 138 -4,-1.3 4,-3.1 -3,-0.4 5,-0.3 0.910 104.4 58.4 -72.5 -43.4 -12.0 37.7 -15.1 287 301 A K H X S+ 0 0 94 -4,-2.1 4,-1.0 1,-0.2 -2,-0.2 0.746 111.8 43.3 -54.0 -27.7 -13.9 40.8 -14.4 288 302 A I H X S+ 0 0 19 -4,-1.0 4,-0.7 2,-0.2 -1,-0.2 0.887 117.8 40.2 -88.4 -46.3 -16.8 38.6 -13.2 289 303 A I H X S+ 0 0 86 -4,-1.8 4,-0.7 2,-0.2 -2,-0.2 0.800 115.7 55.0 -73.6 -28.9 -14.9 36.0 -11.1 290 304 A R H >X S+ 0 0 153 -4,-3.1 4,-2.6 2,-0.2 3,-1.6 0.966 107.1 47.9 -62.7 -55.5 -12.7 38.9 -9.7 291 305 A S H 3< S+ 0 0 35 -4,-1.0 -1,-0.2 -5,-0.3 -2,-0.2 0.681 108.6 57.6 -60.1 -20.6 -15.7 40.9 -8.5 292 306 A H H 3X S+ 0 0 118 -4,-0.7 4,-0.8 3,-0.1 -1,-0.3 0.688 111.4 41.1 -81.6 -22.0 -17.0 37.6 -7.0 293 307 A V H S+ 0 0 105 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.851 76.0 57.9 -61.7 -42.8 -14.8 40.8 2.2 299 313 A P H > S+ 0 0 87 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.871 115.1 38.0 -55.1 -38.3 -16.4 39.7 5.5 300 314 A F H > S+ 0 0 162 -3,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.718 111.6 59.5 -84.7 -24.6 -13.3 37.7 6.3 301 315 A K H X S+ 0 0 143 -4,-1.7 4,-1.6 2,-0.2 -3,-0.2 0.892 111.2 40.3 -68.9 -42.8 -10.9 40.3 4.8 302 316 A A H X S+ 0 0 46 -4,-2.3 4,-2.2 2,-0.2 5,-0.2 0.855 112.0 57.2 -72.0 -38.2 -12.2 43.0 7.3 303 317 A A H X S+ 0 0 44 -4,-1.1 4,-1.6 -5,-0.3 -2,-0.2 0.853 110.8 43.1 -61.5 -37.8 -12.3 40.4 10.1 304 318 A A H X S+ 0 0 50 -4,-1.6 4,-1.9 2,-0.2 5,-0.3 0.869 111.0 56.0 -73.4 -38.9 -8.6 39.7 9.6 305 319 A A H X S+ 0 0 64 -4,-1.6 4,-1.4 1,-0.2 -2,-0.2 0.846 111.9 42.5 -62.3 -37.5 -7.8 43.4 9.2 306 320 A E H X S+ 0 0 122 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.880 109.5 56.9 -76.1 -41.0 -9.4 44.2 12.6 307 321 A N H < S+ 0 0 128 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.1 0.864 114.7 37.6 -60.0 -40.4 -7.8 41.2 14.4 308 322 A L H < S+ 0 0 152 -4,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.866 106.7 66.6 -77.4 -39.8 -4.3 42.2 13.5 309 323 A Y H < 0 0 186 -4,-1.4 -2,-0.2 1,-0.3 -1,-0.1 0.900 360.0 360.0 -45.7 -50.3 -5.1 46.0 14.0 310 324 A F < 0 0 179 -4,-1.9 -1,-0.3 -5,-0.0 -2,-0.1 -0.009 360.0 360.0 -82.8 360.0 -5.5 45.2 17.7