==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 15-SEP-09 2WTB . COMPND 2 MOLECULE: FATTY ACID MULTIFUNCTIONAL PROTEIN (ATMFP2); . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR S.ARENT,V.E.PYE,C.E.CHRISTENSEN,A.NORGAARD,A.HENRIKSEN . 676 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29108.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 487 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 57 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 2.2 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 . 1 0.1 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 . 37 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 78 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 262 38.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 3.0 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 2 1 2 1 3 2 1 2 1 2 5 2 0 2 1 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 2 6 0 2 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 1 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 . 0 0 1 0 1 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 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 7 A G 0 0 43 0, 0.0 18,-0.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0-166.8 0.6 64.3 28.3 2 8 A K E -A 18 0A 113 16,-3.0 16,-2.5 26,-0.0 2,-0.3 -0.790 360.0-123.8-147.9-172.7 -2.3 66.8 28.6 3 9 A T E -A 17 0A 15 -2,-0.2 2,-0.4 14,-0.2 14,-0.2 -0.991 12.3-151.9-143.2 146.3 -6.0 67.2 29.1 4 10 A V E -A 16 0A 51 12,-1.7 12,-2.9 -2,-0.3 2,-0.4 -0.978 9.4-162.6-120.5 130.1 -8.7 68.8 27.1 5 11 A M E -A 15 0A 35 -2,-0.4 2,-0.4 10,-0.2 10,-0.2 -0.935 8.2-179.9-114.4 133.1 -11.9 70.3 28.6 6 12 A E E -A 14 0A 135 8,-2.1 8,-2.8 -2,-0.4 2,-0.7 -0.996 18.9-143.0-133.4 130.6 -15.1 71.1 26.6 7 13 A V E -A 13 0A 41 -2,-0.4 6,-0.2 6,-0.2 42,-0.0 -0.822 19.4-148.1 -97.4 114.8 -18.3 72.7 28.0 8 14 A G > - 0 0 26 4,-2.6 3,-1.1 -2,-0.7 -1,-0.0 -0.044 31.0-100.6 -69.2 176.8 -21.5 71.3 26.5 9 15 A G T 3 S+ 0 0 96 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.531 122.3 62.5 -77.5 -7.1 -24.7 73.2 26.0 10 16 A D T 3 S- 0 0 50 2,-0.2 -1,-0.2 0, 0.0 3,-0.1 0.422 119.9-109.5 -94.5 -1.9 -26.0 71.6 29.1 11 17 A G S < S+ 0 0 6 -3,-1.1 36,-2.5 1,-0.3 37,-0.8 0.421 74.2 136.9 91.1 -0.6 -23.3 73.2 31.2 12 18 A V E - b 0 48A 0 34,-0.2 -4,-2.6 35,-0.2 2,-0.6 -0.674 46.7-143.2 -83.6 128.6 -21.4 70.0 31.8 13 19 A A E -Ab 7 49A 0 35,-2.4 37,-3.3 -2,-0.4 2,-0.6 -0.823 11.8-158.8 -93.7 118.6 -17.6 70.2 31.4 14 20 A V E -Ab 6 50A 16 -8,-2.8 -8,-2.1 -2,-0.6 2,-0.6 -0.870 4.3-164.1-100.0 121.0 -16.0 67.1 29.9 15 21 A I E -Ab 5 51A 0 35,-3.1 37,-2.8 -2,-0.6 2,-0.5 -0.917 3.5-158.2-108.8 119.7 -12.3 66.6 30.7 16 22 A T E -Ab 4 52A 37 -12,-2.9 -12,-1.7 -2,-0.6 2,-0.6 -0.850 12.0-138.7-101.0 124.4 -10.4 64.1 28.5 17 23 A L E -Ab 3 53A 1 35,-2.9 37,-2.1 -2,-0.5 2,-0.5 -0.700 23.6-173.7 -80.7 120.7 -7.2 62.6 29.8 18 24 A I E +A 2 0A 44 -16,-2.5 -16,-3.0 -2,-0.6 4,-0.0 -0.849 33.8 116.0-125.8 96.5 -4.7 62.4 27.0 19 25 A N >> - 0 0 22 -2,-0.5 4,-1.1 -18,-0.2 5,-1.0 -0.424 58.5-116.7-158.9 76.5 -1.4 60.7 27.5 20 26 A P T 45S+ 0 0 75 0, 0.0 2,-0.1 0, 0.0 -2,-0.0 -0.092 83.7 35.4 -51.6 153.5 -0.8 57.6 25.4 21 27 A P T 45S- 0 0 98 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 -0.877 141.8 -13.0 -77.0 -37.5 -0.3 54.6 25.6 22 28 A V T 45S- 0 0 40 -3,-0.3 38,-2.3 -2,-0.1 39,-0.2 0.106 91.1-105.8-118.2 21.1 -2.7 54.2 28.6 23 29 A N T <5 - 0 0 4 -4,-1.1 38,-0.3 36,-0.2 40,-0.1 0.908 48.5-167.7 56.7 46.8 -3.3 57.8 29.7 24 30 A S < - 0 0 13 -5,-1.0 2,-1.7 35,-0.2 38,-0.3 -0.301 30.0-105.1 -63.1 149.9 -1.1 57.5 32.8 25 31 A L + 0 0 0 36,-3.6 38,-0.4 4,-0.1 -1,-0.1 -0.570 48.2 176.0 -83.2 81.8 -1.5 60.4 35.3 26 32 A S > - 0 0 4 -2,-1.7 4,-2.4 36,-0.2 5,-0.1 -0.328 47.1-106.7 -72.2 166.0 1.7 62.3 34.8 27 33 A F H > S+ 0 0 84 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.899 122.4 58.8 -59.7 -39.5 2.2 65.6 36.8 28 34 A D H > S+ 0 0 94 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.958 107.4 43.9 -52.8 -57.3 1.6 67.4 33.5 29 35 A V H > S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.922 114.0 52.3 -52.8 -46.8 -1.9 65.8 33.2 30 36 A L H X S+ 0 0 4 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.861 109.9 46.4 -62.3 -39.4 -2.5 66.5 36.9 31 37 A Y H X S+ 0 0 82 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.811 111.5 51.4 -76.1 -30.5 -1.7 70.2 36.7 32 38 A N H X S+ 0 0 61 -4,-2.2 4,-2.5 -5,-0.3 -2,-0.2 0.857 110.9 50.5 -67.3 -35.8 -3.7 70.6 33.5 33 39 A L H X S+ 0 0 3 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.927 107.2 52.8 -66.1 -47.1 -6.5 68.9 35.5 34 40 A K H X S+ 0 0 49 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.925 111.7 46.1 -52.6 -48.8 -6.0 71.3 38.4 35 41 A S H X S+ 0 0 66 -4,-2.0 4,-1.9 1,-0.2 5,-0.2 0.925 108.5 56.7 -61.7 -46.0 -6.4 74.2 36.0 36 42 A N H X S+ 0 0 18 -4,-2.5 4,-2.7 1,-0.2 3,-0.2 0.932 110.9 43.5 -47.0 -52.4 -9.4 72.6 34.4 37 43 A Y H X S+ 0 0 3 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.893 108.1 56.1 -66.6 -42.5 -11.2 72.5 37.8 38 44 A E H < S+ 0 0 87 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.836 114.5 42.7 -60.1 -31.2 -10.2 76.0 38.9 39 45 A E H >X S+ 0 0 90 -4,-1.9 4,-1.8 -3,-0.2 3,-1.8 0.924 112.3 50.9 -77.5 -48.7 -11.8 77.2 35.7 40 46 A A H 3< S+ 0 0 0 -4,-2.7 6,-0.2 1,-0.3 -2,-0.2 0.837 109.2 51.7 -59.9 -34.8 -14.9 75.0 35.8 41 47 A L T 3< S+ 0 0 53 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.446 114.6 44.1 -84.4 1.0 -15.6 76.0 39.4 42 48 A S T <4 S+ 0 0 93 -3,-1.8 2,-0.4 -5,-0.2 -2,-0.2 0.587 91.9 93.3-113.9 -21.9 -15.4 79.7 38.4 43 49 A R >< - 0 0 77 -4,-1.8 3,-1.2 1,-0.1 -4,-0.0 -0.629 61.6-153.9 -80.0 125.8 -17.4 79.6 35.2 44 50 A N T 3 S+ 0 0 167 -2,-0.4 -1,-0.1 1,-0.2 -4,-0.0 0.782 94.7 60.5 -67.1 -27.9 -21.1 80.4 35.6 45 51 A D T 3 S+ 0 0 84 2,-0.0 2,-0.5 -3,-0.0 -1,-0.2 0.543 90.2 86.7 -78.7 -7.4 -21.9 78.4 32.5 46 52 A V < + 0 0 4 -3,-1.2 -34,-0.2 -6,-0.2 3,-0.1 -0.822 43.4 166.7 -97.3 131.6 -20.5 75.2 34.1 47 53 A K - 0 0 113 -36,-2.5 2,-0.3 -2,-0.5 -35,-0.2 0.729 65.8 -10.3-109.4 -37.9 -22.8 73.1 36.4 48 54 A A E -b 12 0A 0 -37,-0.8 -35,-2.4 38,-0.2 -1,-0.4 -0.884 63.8-117.2-151.7-179.4 -20.8 69.9 36.8 49 55 A I E -bc 13 88A 0 38,-2.8 40,-1.9 -2,-0.3 2,-0.4 -0.970 13.6-166.4-132.2 144.4 -17.8 68.0 35.6 50 56 A V E -bc 14 89A 0 -37,-3.3 -35,-3.1 -2,-0.4 2,-0.4 -0.989 9.7-156.7-126.8 140.5 -17.2 64.7 33.8 51 57 A I E +bc 15 90A 0 38,-2.5 40,-4.0 -2,-0.4 2,-0.3 -0.964 22.1 152.1-120.6 133.9 -13.9 63.0 33.5 52 58 A T E -bc 16 91A 15 -37,-2.8 -35,-2.9 -2,-0.4 2,-0.2 -0.957 33.6-115.4-150.3 166.5 -12.9 60.4 30.8 53 59 A G E -b 17 0A 9 38,-0.6 3,-0.4 -2,-0.3 2,-0.2 -0.604 30.3-103.4-104.5 166.4 -9.9 59.2 28.9 54 60 A A S S+ 0 0 18 -37,-2.1 3,-0.4 4,-0.2 -35,-0.1 -0.562 94.1 16.6 -87.2 151.3 -8.8 59.3 25.3 55 61 A K S S- 0 0 155 1,-0.2 -1,-0.2 -2,-0.2 3,-0.1 0.909 131.7 -56.5 57.0 48.7 -9.0 56.3 22.9 56 62 A G S S+ 0 0 34 -3,-0.4 2,-0.3 1,-0.1 -1,-0.2 0.813 113.4 104.5 57.7 38.1 -11.4 54.2 25.0 57 63 A R - 0 0 108 -3,-0.4 37,-0.2 37,-0.2 -3,-0.1 -0.931 51.7-161.3-151.5 123.6 -9.2 54.1 28.2 58 64 A F - 0 0 0 35,-2.3 -4,-0.2 37,-0.8 2,-0.2 0.999 68.5 -45.1 -67.2 -68.5 -9.7 56.0 31.4 59 65 A S B -f 96 0B 0 36,-1.6 38,-2.0 34,-0.2 -36,-0.2 -0.780 37.3-155.6-173.4 125.3 -6.2 55.9 33.0 60 66 A G - 0 0 18 -38,-2.3 2,-0.4 -2,-0.2 -36,-0.2 0.523 58.6 -88.9 -86.6 -7.1 -3.7 53.0 33.4 61 67 A G S S- 0 0 8 -38,-0.3 -36,-3.6 -39,-0.2 2,-0.3 -0.998 72.7 -10.2 142.4-140.0 -1.8 54.4 36.4 62 68 A F S S- 0 0 93 -2,-0.4 -36,-0.2 -38,-0.3 -38,-0.1 -0.755 73.4 -94.0-104.5 150.7 1.2 56.7 37.0 63 69 A D 0 0 76 -38,-0.4 -1,-0.1 -2,-0.3 -38,-0.1 -0.156 360.0 360.0 -64.2 151.7 3.6 57.9 34.3 64 70 A I 0 0 127 -40,-0.0 -1,-0.1 -38,-0.0 0, 0.0 0.519 360.0 360.0-119.4 360.0 6.9 56.0 33.6 65 ! 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 66 83 A E 0 0 58 0, 0.0 -39,-0.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 130.0 4.7 67.8 44.1 67 84 A P + 0 0 105 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.957 360.0 23.4 -48.1 -78.7 5.4 70.4 46.8 68 85 A K S S- 0 0 171 1,-0.1 3,-0.2 0, 0.0 4,-0.1 0.062 95.3 -98.0 -75.6-167.4 4.2 68.6 49.9 69 86 A A S S+ 0 0 64 1,-0.2 4,-0.2 2,-0.1 3,-0.1 0.800 121.7 23.1 -84.3 -32.1 4.0 64.8 50.4 70 87 A G S >>S+ 0 0 9 1,-0.1 4,-2.8 2,-0.1 5,-0.9 -0.117 78.7 129.1-126.6 35.7 0.2 64.7 49.6 71 88 A Y H >>S+ 0 0 49 3,-0.2 5,-1.5 2,-0.2 4,-0.7 0.921 85.9 34.0 -55.4 -46.5 -0.2 67.9 47.6 72 89 A I H >>S+ 0 0 12 3,-0.2 5,-3.1 2,-0.2 4,-0.6 0.977 119.4 48.7 -72.9 -58.9 -2.0 66.0 44.9 73 90 A S H 4>S+ 0 0 6 57,-0.4 5,-1.0 -4,-0.2 -2,-0.2 0.885 130.6 18.6 -46.5 -47.4 -3.8 63.4 47.0 74 91 A I H <>S+ 0 0 13 -4,-2.8 5,-2.7 3,-0.2 6,-0.3 0.935 130.4 36.5 -96.1 -59.1 -5.1 66.0 49.5 75 92 A D H - g 0 119B 25 -38,-2.0 3,-2.2 21,-0.2 23,-0.2 -0.878 50.9 -33.9-115.9 143.0 -5.7 51.2 37.5 98 115 A G T >> S+ 0 0 3 21,-2.3 4,-2.7 -2,-0.4 3,-1.1 -0.246 136.1 10.2 55.0-130.5 -3.8 52.7 40.4 99 116 A G H 3> S+ 0 0 2 1,-0.3 4,-2.7 2,-0.2 -1,-0.3 0.798 131.7 59.0 -47.2 -31.9 -3.8 56.5 40.3 100 117 A G H <> S+ 0 0 0 -3,-2.2 4,-1.2 2,-0.2 -1,-0.3 0.904 109.2 40.8 -65.3 -42.6 -6.4 56.1 37.5 101 118 A L H <> S+ 0 0 1 -3,-1.1 4,-2.2 18,-0.3 -2,-0.2 0.856 114.3 54.4 -72.3 -35.9 -8.7 54.2 39.8 102 119 A E H X S+ 0 0 2 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.936 105.8 50.8 -64.3 -48.1 -8.0 56.6 42.6 103 120 A L H X S+ 0 0 1 -4,-2.7 4,-0.8 1,-0.2 -1,-0.2 0.878 111.5 49.7 -55.8 -39.5 -8.9 59.7 40.6 104 121 A A H >< S+ 0 0 0 -4,-1.2 3,-0.7 1,-0.2 -14,-0.2 0.883 106.2 54.4 -68.9 -38.9 -12.2 58.0 39.7 105 122 A M H 3< S+ 0 0 0 -4,-2.2 92,-0.3 1,-0.2 -1,-0.2 0.769 101.8 60.8 -65.0 -25.2 -12.9 57.1 43.3 106 123 A A H 3< S+ 0 0 0 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.799 90.8 86.7 -70.4 -30.7 -12.5 60.8 44.1 107 124 A C S << S- 0 0 0 -4,-0.8 90,-0.3 -3,-0.7 -18,-0.2 -0.209 89.5-118.7 -65.8 165.0 -15.4 61.6 41.7 108 125 A H S S+ 0 0 7 -20,-2.0 87,-0.5 1,-0.1 2,-0.3 0.588 90.0 9.6 -88.8 -11.3 -18.9 61.5 43.1 109 126 A A E -d 89 0A 1 -21,-0.6 -19,-2.2 -5,-0.2 2,-0.4 -0.973 68.1-136.4-158.9 161.6 -20.2 58.7 40.8 110 127 A R E -d 90 0A 6 -2,-0.3 58,-1.7 -21,-0.2 59,-1.3 -0.962 11.6-174.7-135.0 121.1 -18.7 56.2 38.4 111 128 A I E -de 91 169A 0 -21,-2.9 -19,-3.9 -2,-0.4 2,-0.3 -0.923 19.4-178.8-107.2 135.7 -19.9 55.0 34.9 112 129 A S E -de 92 170A 0 57,-2.4 59,-1.8 -2,-0.4 -19,-0.2 -0.959 28.1-115.2-138.4 152.4 -18.0 52.2 33.3 113 130 A A > - 0 0 4 -21,-1.8 3,-1.8 -2,-0.3 45,-0.2 -0.567 48.8 -92.9 -82.7 152.2 -17.9 50.1 30.1 114 131 A P T 3 S+ 0 0 50 0, 0.0 45,-0.7 0, 0.0 44,-0.3 0.754 113.5 21.4 -33.2 -72.1 -18.7 46.4 30.4 115 132 A A T 3 S+ 0 0 68 43,-0.2 -22,-0.1 42,-0.1 -2,-0.0 0.040 84.7 145.4 -99.8 28.7 -15.3 44.6 30.8 116 133 A A < - 0 0 2 -3,-1.8 42,-1.3 -24,-0.1 2,-0.4 -0.256 46.3-123.6 -64.1 150.7 -13.2 47.5 32.1 117 134 A Q E -gH 95 157B 71 -23,-1.8 -21,-2.6 40,-0.2 2,-0.4 -0.848 27.0-177.2-103.3 133.2 -10.5 46.7 34.6 118 135 A L E +gH 96 156B 0 38,-2.8 38,-2.6 -2,-0.4 2,-0.3 -0.994 25.5 107.8-131.6 127.6 -10.4 48.3 38.0 119 136 A G E -g 97 0B 0 -23,-1.5 -21,-2.3 -2,-0.4 -18,-0.3 -0.991 60.3-106.2-178.5 176.1 -7.7 47.8 40.7 120 137 A L + 0 0 0 34,-0.3 3,-0.5 -2,-0.3 33,-0.2 -0.820 32.7 167.4-126.8 90.5 -4.7 49.0 42.6 121 138 A P > + 0 0 32 0, 0.0 3,-2.5 0, 0.0 4,-0.5 0.451 43.5 111.9 -81.3 -4.0 -1.5 47.1 41.4 122 139 A E G > > + 0 0 28 1,-0.3 3,-1.9 2,-0.2 5,-1.8 0.784 66.4 63.9 -42.0 -42.8 0.9 49.5 43.2 123 140 A L G > 5S+ 0 0 11 -3,-0.5 3,-1.3 27,-0.3 -1,-0.3 0.763 89.9 66.7 -60.0 -26.2 2.0 46.8 45.6 124 141 A Q G < 5S+ 0 0 134 -3,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.767 103.1 46.7 -66.4 -23.8 3.6 44.7 42.8 125 142 A L G < 5S- 0 0 61 -3,-1.9 -1,-0.3 -4,-0.5 145,-0.2 0.379 122.8-107.2 -95.8 2.3 6.1 47.5 42.3 126 143 A G T < 5S+ 0 0 0 -3,-1.3 -3,-0.2 1,-0.3 2,-0.2 0.653 88.5 107.2 79.7 16.1 6.8 47.7 46.0 127 144 A V < - 0 0 36 -5,-1.8 -1,-0.3 -6,-0.1 -2,-0.2 -0.580 60.8-128.1-114.6 179.6 4.9 51.0 46.2 128 145 A I - 0 0 5 -2,-0.2 2,-0.2 129,-0.1 5,-0.0 -0.887 34.8 -82.2-128.1 160.1 1.5 52.0 47.7 129 146 A P + 0 0 1 0, 0.0 5,-0.3 0, 0.0 3,-0.1 -0.454 44.8 179.9 -57.3 127.0 -1.6 53.8 46.5 130 147 A G + 0 0 28 -2,-0.2 -57,-0.4 1,-0.1 -58,-0.1 0.189 63.4 66.7-123.1 15.3 -0.7 57.5 46.9 131 148 A F S S- 0 0 21 -58,-0.1 -1,-0.1 -59,-0.1 119,-0.1 0.209 126.2 -71.9-120.6 13.2 -3.8 59.4 45.7 132 149 A G S >> S+ 0 0 3 -3,-0.1 4,-2.8 118,-0.1 3,-1.5 0.452 93.8 126.3 112.8 4.9 -6.3 58.3 48.4 133 150 A G H 3> + 0 0 0 1,-0.3 4,-1.4 2,-0.2 -3,-0.1 0.831 69.1 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33,-0.0 -1,-0.2 0.331 93.2 -73.3 -67.5-155.5 6.8 13.2 25.2 305 322 A L H > S+ 0 0 116 2,-0.2 4,-1.0 1,-0.1 129,-0.2 0.934 133.2 38.7 -73.4 -47.1 6.5 15.2 28.4 306 323 A M H > S+ 0 0 40 2,-0.2 4,-1.8 72,-0.2 -1,-0.1 0.885 118.3 49.8 -71.8 -39.2 8.3 18.3 27.1 307 324 A G H > S+ 0 0 0 71,-0.4 4,-2.2 1,-0.2 5,-0.2 0.955 108.1 50.8 -62.8 -52.7 6.7 18.1 23.7 308 325 A S H X S+ 0 0 3 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.787 108.1 57.0 -57.6 -28.2 3.2 17.7 24.9 309 326 A G H X S+ 0 0 3 -4,-1.0 4,-2.0 2,-0.2 -1,-0.2 0.940 105.7 47.6 -67.4 -49.5 3.8 20.7 27.1 310 327 A I H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.960 109.2 53.4 -54.7 -56.0 4.8 23.0 24.2 311 328 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.868 106.9 54.1 -48.1 -42.7 1.8 21.9 22.2 312 329 A T H X S+ 0 0 1 -4,-1.5 4,-1.9 -5,-0.2 -1,-0.2 0.946 108.6 47.1 -57.8 -51.6 -0.4 22.9 25.1 313 330 A A H < S+ 0 0 7 -4,-2.0 4,-0.2 -3,-0.2 -1,-0.2 0.861 114.2 49.4 -58.5 -38.0 1.0 26.4 25.3 314 331 A L H ><>S+ 0 0 4 -4,-2.3 3,-1.7 1,-0.2 5,-0.8 0.956 112.1 42.6 -70.9 -53.8 0.6 26.9 21.5 315 332 A I H ><5S+ 0 0 1 -4,-2.6 3,-1.6 1,-0.3 -1,-0.2 0.806 104.4 67.1 -64.5 -29.0 -3.0 25.7 21.1 316 333 A L T 3<5S+ 0 0 53 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.668 104.5 46.6 -62.8 -15.3 -3.9 27.7 24.2 317 334 A S T < 5S- 0 0 16 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 -0.207 129.2 -96.5-117.6 40.3 -3.0 30.7 22.1 318 335 A N T < 5S+ 0 0 132 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.887 73.6 149.4 41.0 54.6 -5.0 29.6 19.0 319 336 A Y < - 0 0 20 -5,-0.8 2,-0.5 -8,-0.2 -1,-0.2 -0.965 50.4-127.2-111.4 117.5 -2.0 28.0 17.2 320 337 A P - 0 0 49 0, 0.0 -22,-2.6 0, 0.0 2,-0.4 -0.508 38.1-169.1 -61.2 113.0 -2.8 25.1 14.9 321 338 A V E -ik 298 360C 1 38,-1.1 40,-2.8 -2,-0.5 2,-0.5 -0.886 16.0-166.3-116.0 140.2 -0.4 22.4 16.2 322 339 A I E -ik 299 361C 13 -24,-1.9 -22,-2.6 -2,-0.4 2,-0.4 -0.976 8.1-153.9-127.8 120.6 0.5 19.1 14.8 323 340 A L E -ik 300 362C 0 38,-1.1 40,-1.1 -2,-0.5 2,-0.4 -0.759 5.7-161.8 -92.6 134.8 2.4 16.3 16.7 324 341 A K E +ik 301 363C 27 -24,-1.3 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-2,-0.2 0.932 111.8 52.0 -59.2 -49.9 1.3 12.5 23.8 335 352 A I H X S+ 0 0 53 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.820 108.6 55.4 -55.7 -31.2 -2.1 13.6 22.6 336 353 A G H X S+ 0 0 38 -4,-0.8 4,-2.2 -5,-0.3 -1,-0.2 0.905 103.1 51.7 -69.5 -44.1 -3.4 12.2 25.9 337 354 A R H X S+ 0 0 104 -4,-1.9 4,-2.0 -34,-0.2 -2,-0.2 0.895 108.5 53.8 -59.4 -40.9 -1.0 14.2 28.1 338 355 A V H >X S+ 0 0 0 -4,-1.9 4,-1.6 2,-0.2 3,-0.6 0.973 108.9 45.7 -57.7 -58.4 -2.2 17.4 26.3 339 356 A K H 3X S+ 0 0 23 -4,-1.9 4,-2.9 1,-0.3 5,-0.2 0.874 111.3 54.9 -52.4 -40.1 -5.9 16.7 27.0 340 357 A A H 3X S+ 0 0 48 -4,-2.2 4,-1.4 1,-0.2 -1,-0.3 0.867 105.3 52.5 -62.4 -37.4 -5.0 15.9 30.6 341 358 A N H X S+ 0 0 134 -4,-2.9 3,-1.1 1,-0.2 4,-0.8 0.797 102.0 63.3 -64.9 -28.4 -8.8 19.0 31.7 344 361 A S H >< S+ 0 0 91 -4,-1.4 3,-0.8 1,-0.3 -1,-0.2 0.932 103.2 45.0 -62.1 -48.6 -6.8 19.9 34.7 345 362 A R T 3< S+ 0 0 151 -4,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.242 100.9 71.8 -83.4 14.3 -7.5 23.7 34.5 346 363 A V T <4 0 0 62 -3,-1.1 -1,-0.2 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-58.7 22.0 31.1 30.3 478 498 A V H >5S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -2,-0.1 0.962 120.4 35.6 -61.7 -60.4 19.6 29.8 32.9 479 499 A N H >5S+ 0 0 30 -4,-0.4 4,-0.5 1,-0.2 -1,-0.2 0.875 118.9 50.5 -64.8 -39.6 20.9 26.3 33.5 480 500 A R H 4 S+ 0 0 5 0, 0.0 4,-3.4 0, 0.0 5,-0.3 0.831 97.1 74.0 -67.6 -32.0 27.3 25.9 40.6 485 505 A Y H > S+ 0 0 9 1,-0.2 4,-1.6 -4,-0.2 -2,-0.2 0.924 102.6 35.5 -41.9 -63.4 24.4 26.5 42.9 486 506 A T H X S+ 0 0 39 -4,-1.0 4,-2.3 1,-0.2 -1,-0.2 0.844 118.6 51.3 -66.2 -35.9 23.7 22.8 43.6 487 507 A Q H X S+ 0 0 11 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.882 107.5 51.7 -71.8 -38.4 27.4 21.8 43.5 488 508 A A H X S+ 0 0 0 -4,-3.4 4,-1.6 2,-0.2 -1,-0.2 0.893 111.4 49.7 -63.0 -39.8 28.5 24.5 46.0 489 509 A A H X S+ 0 0 0 -4,-1.6 4,-1.9 -5,-0.3 3,-0.3 0.961 111.6 46.2 -61.7 -53.5 25.8 23.2 48.3 490 510 A M H X S+ 0 0 12 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.822 108.8 55.7 -63.8 -33.1 26.8 19.5 48.0 491 511 A F H X S+ 0 0 29 -4,-2.2 4,-0.7 2,-0.2 -1,-0.2 0.891 107.4 50.5 -64.0 -39.1 30.5 20.4 48.5 492 512 A L H <>S+ 0 0 6 -4,-1.6 5,-2.4 -3,-0.3 3,-0.3 0.885 109.5 51.5 -63.9 -39.7 29.5 22.1 51.8 493 513 A V H ><5S+ 0 0 14 -4,-1.9 3,-2.4 1,-0.2 -2,-0.2 0.930 105.9 52.3 -64.0 -47.2 27.6 19.0 52.8 494 514 A E H 3<5S+ 0 0 20 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.708 107.1 57.2 -61.6 -17.3 30.5 16.7 52.1 495 515 A C T 3<5S- 0 0 3 -4,-0.7 84,-0.5 -3,-0.3 85,-0.4 0.422 133.0 -91.2 -93.3 -0.7 32.4 19.1 54.3 496 516 A G T < 5S+ 0 0 44 -3,-2.4 -3,-0.2 1,-0.3 -2,-0.1 0.158 76.2 145.6 116.2 -17.2 29.9 18.5 57.2 497 517 A A < - 0 0 7 -5,-2.4 -1,-0.3 -6,-0.1 83,-0.2 -0.308 56.8-113.5 -58.7 127.3 27.4 21.3 56.6 498 518 A D > - 0 0 74 1,-0.2 4,-1.8 -2,-0.1 3,-0.5 -0.494 21.2-149.0 -64.4 119.1 23.9 20.2 57.6 499 519 A P H > S+ 0 0 38 0, 0.0 4,-2.3 0, 0.0 17,-0.2 0.854 94.5 54.2 -59.3 -40.7 21.9 20.0 54.3 500 520 A Y H > S+ 0 0 99 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.801 106.0 52.5 -69.5 -30.1 18.5 20.9 55.9 501 521 A L H > S+ 0 0 99 -3,-0.5 4,-2.8 2,-0.2 -1,-0.2 0.914 107.7 53.6 -66.0 -43.9 20.1 24.1 57.4 502 522 A I H X S+ 0 0 1 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.951 110.5 45.6 -52.4 -54.6 21.3 24.9 53.9 503 523 A D H X S+ 0 0 22 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.899 114.0 48.3 -58.4 -44.7 17.7 24.6 52.5 504 524 A R H X S+ 0 0 54 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.890 110.7 50.6 -65.6 -40.4 16.2 26.6 55.4 505 525 A A H X S+ 0 0 1 -4,-2.8 4,-0.7 1,-0.2 -1,-0.2 0.871 118.4 38.6 -64.0 -36.4 18.7 29.4 55.1 506 526 A I H X>S+ 0 0 0 -4,-1.9 5,-1.4 -5,-0.2 4,-0.8 0.770 110.1 56.8 -90.0 -29.6 18.1 29.7 51.3 507 527 A S H <5S+ 0 0 50 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.760 112.2 45.5 -70.6 -24.4 14.3 29.1 51.3 508 528 A K H <5S+ 0 0 132 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.730 98.7 70.7 -87.1 -26.6 14.1 32.1 53.7 509 529 A F H <5S- 0 0 14 -4,-0.7 -2,-0.2 -5,-0.2 -1,-0.2 0.798 130.9 -85.5 -58.3 -29.3 16.5 34.1 51.5 510 530 A G T <5S+ 0 0 18 -4,-0.8 -3,-0.2 1,-0.4 -2,-0.1 0.130 90.2 126.0 143.1 -21.0 13.7 34.3 49.0 511 531 A M < - 0 0 10 -5,-1.4 -1,-0.4 1,-0.1 113,-0.1 -0.306 62.3-131.5 -61.1 149.0 14.0 31.1 47.0 512 532 A P S S+ 0 0 103 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.507 87.9 13.9 -78.3 -3.4 10.8 29.0 46.7 513 533 A M S S- 0 0 29 -7,-0.2 -2,-0.1 110,-0.1 -3,-0.1 -0.965 81.4 -99.9-162.8 164.4 12.9 26.0 47.7 514 534 A G > - 0 0 0 -2,-0.3 4,-3.6 1,-0.1 5,-0.4 -0.634 39.5-107.6 -94.6 159.5 16.2 24.8 49.0 515 535 A P H > S+ 0 0 1 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.918 121.9 31.8 -49.2 -53.1 19.1 23.5 46.9 516 536 A F H > S+ 0 0 44 -17,-0.2 4,-2.0 2,-0.2 5,-0.2 0.903 117.8 55.3 -73.9 -43.1 18.5 19.9 48.0 517 537 A R H > S+ 0 0 138 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.887 114.0 41.9 -55.6 -41.4 14.8 20.3 48.4 518 538 A L H X S+ 0 0 45 -4,-3.6 4,-2.3 2,-0.2 -1,-0.2 0.807 108.1 61.5 -74.5 -31.6 14.6 21.5 44.8 519 539 A C H X S+ 0 0 6 -4,-1.4 4,-0.8 -5,-0.4 8,-0.3 0.837 105.8 46.4 -64.0 -33.9 17.1 18.8 43.7 520 540 A D H < S+ 0 0 39 -4,-2.0 4,-0.2 2,-0.2 -1,-0.2 0.834 110.3 53.7 -76.1 -34.1 14.6 16.1 44.8 521 541 A L H < S+ 0 0 122 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.905 106.6 50.4 -66.9 -44.0 11.7 17.9 43.1 522 542 A V H < S- 0 0 64 -4,-2.3 -1,-0.2 1,-0.1 4,-0.2 0.794 121.5-109.3 -63.7 -28.2 13.5 18.0 39.7 523 543 A G >X - 0 0 25 -4,-0.8 4,-2.7 -5,-0.2 3,-1.4 0.476 13.1-110.9 96.7 119.2 14.2 14.3 40.1 524 544 A F H 3> S+ 0 0 68 1,-0.3 4,-2.1 -4,-0.2 5,-0.2 0.834 118.6 57.0 -46.9 -39.4 17.6 12.9 40.7 525 545 A G H 3> S+ 0 0 49 2,-0.2 4,-0.7 1,-0.2 -1,-0.3 0.857 113.7 38.1 -62.3 -37.1 17.6 11.4 37.2 526 546 A V H <> S+ 0 0 77 -3,-1.4 4,-2.3 2,-0.2 3,-0.3 0.929 114.6 51.4 -79.5 -50.2 17.1 14.9 35.7 527 547 A A H X S+ 0 0 21 -4,-2.7 4,-0.8 -8,-0.3 -2,-0.2 0.847 114.9 44.5 -56.4 -36.6 19.3 16.9 38.0 528 548 A I H X S+ 0 0 52 -4,-2.1 4,-0.9 -5,-0.3 -1,-0.3 0.738 111.7 53.3 -81.8 -23.6 22.2 14.5 37.4 529 549 A A H X S+ 0 0 54 -4,-0.7 4,-0.5 -3,-0.3 -2,-0.2 0.830 111.0 44.8 -79.1 -33.9 21.5 14.4 33.6 530 550 A T H < S+ 0 0 43 -4,-2.3 4,-0.4 1,-0.2 -2,-0.2 0.666 110.3 55.7 -83.9 -18.3 21.6 18.2 33.2 531 551 A A H >X S+ 0 0 26 -4,-0.8 4,-1.8 -5,-0.3 3,-1.0 0.787 92.1 70.7 -81.9 -30.3 24.7 18.6 35.4 532 552 A T H 3X S+ 0 0 53 -4,-0.9 4,-1.5 1,-0.3 5,-0.2 0.872 88.6 65.2 -52.6 -40.5 26.7 16.1 33.3 533 553 A Q H 3X S+ 0 0 22 -4,-0.5 4,-0.8 1,-0.2 -1,-0.3 0.870 107.6 38.8 -50.5 -43.3 26.8 18.8 30.6 534 554 A F H <> S+ 0 0 4 -3,-1.0 4,-2.6 -4,-0.4 -1,-0.2 0.810 106.8 63.0 -83.2 -32.3 28.9 21.1 32.7 535 555 A I H < S+ 0 0 53 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.827 110.7 41.6 -58.2 -31.6 31.1 18.5 34.3 536 556 A E H < S+ 0 0 140 -4,-1.5 -1,-0.2 2,-0.1 -2,-0.2 0.687 122.4 36.5 -93.3 -21.2 32.4 17.7 30.8 537 557 A N H < S+ 0 0 92 -4,-0.8 -2,-0.2 -5,-0.2 -3,-0.2 0.605 130.4 27.5-107.5 -16.8 32.8 21.2 29.5 538 558 A F S >< S+ 0 0 36 -4,-2.6 3,-2.2 -5,-0.1 4,-0.3 -0.262 71.0 151.8-137.0 48.8 33.9 23.0 32.7 539 559 A S G > S+ 0 0 85 1,-0.3 3,-1.5 2,-0.2 -1,-0.1 0.851 71.2 56.0 -49.7 -45.2 35.7 20.3 34.6 540 560 A E G 3 S+ 0 0 88 1,-0.3 -1,-0.3 -3,-0.1 -5,-0.1 0.322 113.4 43.1 -75.2 11.2 38.1 22.6 36.4 541 561 A R G < S+ 0 0 49 -3,-2.2 2,-0.3 -7,-0.2 -1,-0.3 0.244 104.2 75.3-135.8 6.6 35.1 24.6 37.8 542 562 A T < - 0 0 24 -3,-1.5 2,-0.4 -4,-0.3 115,-0.1 -0.821 59.6-146.5-124.8 161.5 32.7 21.8 38.7 543 563 A Y - 0 0 58 -2,-0.3 2,-1.4 114,-0.1 -53,-0.1 -0.938 7.3-154.2-132.2 111.9 32.3 19.2 41.5 544 564 A K - 0 0 59 -2,-0.4 2,-0.4 -9,-0.1 -2,-0.0 -0.662 16.8-161.4 -85.8 88.6 30.8 15.8 40.8 545 565 A S > - 0 0 16 -2,-1.4 3,-0.5 1,-0.1 -54,-0.1 -0.574 12.9-151.2 -73.0 125.8 29.4 14.8 44.2 546 566 A M T 3> S+ 0 0 103 -2,-0.4 4,-2.3 25,-0.3 5,-0.2 0.441 75.4 97.7 -77.5 2.0 28.8 11.1 44.4 547 567 A I H 3> S+ 0 0 17 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.956 83.6 41.6 -55.2 -59.1 26.0 11.7 46.8 548 568 A I H X> S+ 0 0 12 -3,-0.5 4,-2.2 1,-0.2 3,-0.9 0.941 114.0 50.9 -56.9 -53.6 23.1 11.5 44.3 549 569 A P H 3> S+ 0 0 33 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.907 107.6 53.7 -52.7 -46.2 24.4 8.5 42.4 550 570 A L H 3< S+ 0 0 38 -4,-2.3 4,-0.3 1,-0.2 -2,-0.2 0.794 110.6 48.2 -59.6 -29.5 24.9 6.5 45.5 551 571 A M H X< S+ 0 0 78 -4,-1.2 3,-0.6 -3,-0.9 -1,-0.2 0.861 109.1 52.5 -77.5 -38.0 21.3 7.2 46.4 552 572 A Q H >< S+ 0 0 68 -4,-2.2 3,-2.3 1,-0.2 -2,-0.2 0.897 102.9 56.8 -64.7 -42.4 20.0 6.2 42.9 553 573 A E T 3< S+ 0 0 136 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.672 111.6 45.0 -65.5 -16.0 21.8 2.9 43.0 554 574 A D T < 0 0 142 -3,-0.6 -1,-0.3 -4,-0.3 -2,-0.2 0.090 360.0 360.0-109.2 19.1 19.8 2.2 46.2 555 575 A K < 0 0 97 -3,-2.3 -4,-0.1 0, 0.0 -3,-0.1 -0.383 360.0 360.0 89.2 360.0 16.6 3.5 44.7 556 ! 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 0.0 557 597 A D 0 0 157 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 58.4 4.6 16.2 52.9 558 598 A P - 0 0 72 0, 0.0 2,-0.3 0, 0.0 3,-0.1 -0.762 360.0-179.6-101.4 144.9 8.4 15.6 53.1 559 599 A E - 0 0 70 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.860 39.4 -63.0-135.7 170.2 10.4 15.5 56.4 560 600 A L - 0 0 85 -2,-0.3 2,-0.6 1,-0.1 -1,-0.1 -0.098 46.9-134.2 -52.1 149.4 14.0 15.0 57.5 561 601 A K > - 0 0 53 1,-0.1 3,-1.5 -3,-0.1 4,-0.4 -0.938 11.2-162.8-115.5 114.6 15.6 11.6 56.7 562 602 A K T 3 S+ 0 0 113 -2,-0.6 4,-0.2 1,-0.3 -1,-0.1 0.440 91.1 61.5 -72.9 1.8 17.6 9.9 59.4 563 603 A Y T 3 S+ 0 0 82 1,-0.1 -1,-0.3 2,-0.1 4,-0.2 0.137 82.2 80.2-113.6 17.8 19.2 7.7 56.7 564 604 A I S X> S+ 0 0 36 -3,-1.5 4,-1.8 2,-0.1 3,-1.1 0.795 78.0 67.4 -91.5 -34.2 20.9 10.6 54.8 565 605 A E H 3> S+ 0 0 82 -4,-0.4 4,-1.7 1,-0.3 5,-0.1 0.878 100.3 50.4 -53.4 -42.7 23.9 11.0 57.1 566 606 A K H 3> S+ 0 0 78 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.718 107.1 56.9 -69.9 -21.3 25.2 7.6 56.1 567 607 A A H <> S+ 0 0 24 -3,-1.1 4,-1.0 2,-0.2 -2,-0.2 0.918 107.0 44.4 -77.4 -46.3 24.8 8.5 52.4 568 608 A R H >< S+ 0 0 23 -4,-1.8 3,-0.5 1,-0.2 -2,-0.2 0.893 109.9 57.2 -64.8 -40.6 27.0 11.6 52.4 569 609 A S H >< S+ 0 0 74 -4,-1.7 3,-1.9 1,-0.2 -1,-0.2 0.903 100.9 56.7 -56.5 -43.8 29.7 9.9 54.4 570 610 A I H 3< S+ 0 0 73 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.829 100.7 57.8 -59.2 -33.6 30.0 7.2 51.8 571 611 A S T << S+ 0 0 9 -4,-1.0 2,-1.4 -3,-0.5 3,-0.4 0.164 77.0 145.6 -81.8 19.5 30.7 9.9 49.2 572 612 A G < + 0 0 55 -3,-1.9 -3,-0.1 1,-0.2 3,-0.1 -0.431 8.7 128.9 -65.5 90.8 33.6 10.9 51.5 573 613 A V + 0 0 94 -2,-1.4 -1,-0.2 2,-0.1 2,-0.2 0.651 68.1 49.2-108.5 -33.5 36.3 12.0 49.0 574 614 A K S S- 0 0 43 -3,-0.4 2,-0.0 1,-0.2 0, 0.0 -0.474 87.7-111.1 -97.2 173.3 37.0 15.3 50.7 575 615 A L - 0 0 78 -2,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 -0.046 31.0-100.3 -90.3-163.0 37.7 16.0 54.3 576 616 A D + 0 0 80 -80,-0.1 -81,-0.1 -2,-0.0 -80,-0.1 -0.809 42.3 169.9-131.6 93.5 35.6 17.9 56.9 577 617 A P > - 0 0 61 0, 0.0 3,-0.5 0, 0.0 0, 0.0 0.176 57.5 -75.8 -78.5-158.9 36.5 21.5 57.7 578 618 A K T 3 S+ 0 0 89 1,-0.2 -82,-0.1 3,-0.0 -83,-0.0 -0.102 94.9 113.5 -95.2 33.0 34.5 24.0 59.8 579 619 A L T > + 0 0 10 -84,-0.5 3,-0.7 -87,-0.1 2,-0.5 0.544 61.8 84.2 -77.0 -8.3 32.1 24.5 56.9 580 620 A A T < S+ 0 0 45 -3,-0.5 -83,-0.1 -85,-0.4 -87,-0.0 -0.866 89.0 32.3 -93.8 126.1 29.6 22.9 59.3 581 621 A N T 3 S+ 0 0 77 -2,-0.5 -1,-0.2 1,-0.2 -2,-0.1 0.552 86.0 157.3 100.0 13.7 28.2 25.5 61.7 582 622 A L < - 0 0 36 -3,-0.7 -1,-0.2 1,-0.1 2,-0.1 -0.315 45.2-104.5 -68.1 154.0 28.3 28.2 59.1 583 623 A S > - 0 0 68 1,-0.1 4,-2.8 4,-0.0 5,-0.2 -0.416 25.9-113.3 -77.2 156.7 26.0 31.2 59.4 584 624 A E H > S+ 0 0 85 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.861 121.2 53.8 -58.0 -36.5 22.9 31.6 57.2 585 625 A K H > S+ 0 0 120 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.912 110.3 47.0 -61.3 -42.8 24.6 34.6 55.6 586 626 A D H > S+ 0 0 68 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.891 109.0 52.9 -68.5 -42.7 27.7 32.4 54.8 587 627 A I H X S+ 0 0 11 -4,-2.8 4,-1.1 2,-0.2 -2,-0.2 0.969 115.0 42.2 -54.6 -54.7 25.6 29.5 53.5 588 628 A I H >X S+ 0 0 20 -4,-2.3 4,-2.2 1,-0.2 3,-0.7 0.933 114.9 50.8 -56.3 -48.6 23.9 31.9 51.1 589 629 A E H 3X S+ 0 0 11 -4,-2.8 4,-1.4 1,-0.3 -1,-0.2 0.831 112.5 45.0 -64.1 -34.1 27.1 33.7 50.3 590 630 A M H 3< S+ 0 0 14 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.629 118.3 44.6 -83.4 -14.0 29.0 30.5 49.4 591 631 A T H << S+ 0 0 0 -4,-1.1 -2,-0.2 -3,-0.7 -103,-0.2 0.698 122.5 32.4-100.1 -24.1 26.1 29.2 47.4 592 632 A F H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 3,-0.3 0.741 104.0 66.8-108.6 -30.9 25.2 32.3 45.4 593 633 A F H X S+ 0 0 0 -4,-1.4 4,-2.8 -5,-0.4 -3,-0.1 0.879 100.6 53.7 -61.7 -38.6 28.5 34.2 44.9 594 634 A P H > S+ 0 0 4 0, 0.0 4,-1.6 0, 0.0 -1,-0.3 0.819 108.0 52.1 -62.9 -29.1 29.7 31.3 42.6 595 635 A V H > S+ 0 0 0 -3,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.897 108.5 49.0 -70.8 -42.4 26.5 31.9 40.7 596 636 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.941 109.1 54.7 -56.6 -47.2 27.3 35.6 40.4 597 637 A N H X S+ 0 0 2 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.882 111.6 43.1 -52.6 -42.8 30.7 34.5 39.2 598 638 A E H X S+ 0 0 2 -4,-1.6 4,-2.6 -117,-0.2 -1,-0.2 0.867 108.4 57.7 -75.4 -37.9 29.2 32.4 36.5 599 639 A A H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.853 105.8 52.4 -58.2 -35.4 26.6 35.0 35.6 600 640 A C H X S+ 0 0 0 -4,-2.1 4,-3.2 2,-0.2 5,-0.2 0.876 106.6 51.1 -70.6 -39.4 29.6 37.3 34.9 601 641 A R H X S+ 0 0 31 -4,-1.3 4,-2.9 2,-0.2 6,-0.3 0.945 113.4 46.5 -58.4 -48.8 31.2 34.8 32.6 602 642 A V H <>S+ 0 0 0 -4,-2.6 5,-1.3 1,-0.2 6,-1.2 0.903 116.1 44.9 -59.3 -43.8 27.9 34.5 30.7 603 643 A F H ><5S+ 0 0 6 -4,-2.5 3,-0.5 4,-0.2 -2,-0.2 0.890 116.2 45.4 -69.8 -40.8 27.6 38.3 30.6 604 644 A A H 3<5S+ 0 0 34 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.912 107.0 57.0 -69.8 -44.3 31.2 38.9 29.6 605 645 A E T 3<5S- 0 0 109 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.599 114.6-116.3 -64.7 -10.3 31.3 36.2 27.0 606 646 A G T < 5S+ 0 0 46 -3,-0.5 -3,-0.2 -4,-0.4 -1,-0.1 0.520 79.6 128.8 85.6 5.9 28.4 38.0 25.3 607 647 A I S > - 0 0 51 1,-0.1 3,-1.9 67,-0.1 4,-1.0 -0.991 68.5-110.4-153.3 152.0 22.6 42.8 29.0 611 651 A A H >> S+ 0 0 6 64,-0.5 4,-1.7 -2,-0.3 3,-0.7 0.880 114.3 62.9 -50.8 -43.4 22.8 42.3 32.7 612 652 A A H 3> S+ 0 0 20 1,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.726 98.0 57.5 -59.6 -22.7 19.1 43.0 33.2 613 653 A D H <> S+ 0 0 5 -3,-1.9 4,-2.3 2,-0.2 -1,-0.3 0.883 103.1 52.1 -73.3 -40.0 18.4 39.9 31.1 614 654 A L H - 0 0 0 0, 0.0 3,-1.6 0, 0.0 5,-0.4 -0.186 35.8-155.6 -49.4 112.2 13.8 36.8 44.9 626 666 A P G > S+ 0 0 53 0, 0.0 3,-2.5 0, 0.0 -354,-0.2 0.865 92.3 61.9 -57.7 -41.3 12.2 39.6 42.7 627 667 A Y G 3 S+ 0 0 14 1,-0.3 -359,-0.4 2,-0.1 -358,-0.3 0.589 97.6 60.1 -65.2 -9.5 12.6 42.2 45.6 628 668 A R G < S- 0 0 70 -3,-1.6 2,-0.4 -360,-0.2 -1,-0.3 0.312 110.3-125.5 -98.5 6.1 16.3 41.6 45.3 629 669 A G < - 0 0 0 -3,-2.5 2,-0.2 -364,-0.2 4,-0.2 0.014 58.0 -61.8 83.0 -30.2 16.3 42.7 41.7 630 670 A G > - 0 0 0 -5,-0.4 4,-3.2 -2,-0.4 5,-0.3 -0.558 64.8 -65.9 130.0 163.6 18.0 39.7 40.2 631 671 A I H > S+ 0 0 0 -16,-0.4 4,-1.2 -17,-0.3 -1,-0.1 0.824 134.5 35.7 -53.8 -36.0 21.2 37.8 40.4 632 672 A M H > S+ 0 0 0 -21,-0.2 4,-2.1 2,-0.2 5,-0.2 0.894 116.2 51.1 -86.7 -44.1 23.2 40.7 38.9 633 673 A F H > S+ 0 0 56 1,-0.2 4,-0.7 2,-0.2 -2,-0.2 0.865 113.9 48.2 -57.8 -36.3 21.2 43.5 40.5 634 674 A W H X S+ 0 0 20 -4,-3.2 4,-1.0 2,-0.2 -1,-0.2 0.893 105.8 57.1 -71.8 -41.5 21.8 41.8 43.8 635 675 A A H >X S+ 0 0 0 -4,-1.2 4,-1.9 -5,-0.3 3,-0.8 0.911 110.8 42.7 -55.9 -46.5 25.5 41.3 43.2 636 676 A D H 3< S+ 0 0 38 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.703 104.5 67.2 -72.6 -19.4 26.0 45.0 42.7 637 677 A S H 3< S+ 0 0 73 -4,-0.7 -1,-0.2 -5,-0.2 -2,-0.2 0.750 110.5 35.0 -69.5 -24.0 23.7 45.6 45.7 638 678 A I H << S- 0 0 55 -4,-1.0 -2,-0.2 -3,-0.8 -1,-0.2 0.761 122.1-104.4 -98.3 -34.4 26.5 44.0 47.8 639 679 A G X - 0 0 24 -4,-1.9 4,-2.3 -5,-0.2 5,-0.2 0.225 8.5-119.9 111.2 127.8 29.4 45.4 45.9 640 680 A S H > S+ 0 0 4 32,-0.3 4,-3.2 1,-0.2 5,-0.2 0.884 111.9 58.2 -62.3 -40.7 31.9 43.8 43.4 641 681 A K H > S+ 0 0 132 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.891 110.2 44.0 -58.6 -41.5 34.9 44.5 45.6 642 682 A Y H > S+ 0 0 76 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.983 114.5 46.9 -64.3 -60.2 33.3 42.5 48.5 643 683 A I H X S+ 0 0 0 -4,-2.3 4,-2.0 -8,-0.2 -2,-0.2 0.865 116.6 47.3 -50.0 -41.1 32.1 39.6 46.3 644 684 A Y H X S+ 0 0 60 -4,-3.2 4,-1.7 -5,-0.2 5,-0.2 0.980 112.9 45.7 -64.2 -58.6 35.6 39.5 44.7 645 685 A S H X S+ 0 0 59 -4,-2.7 4,-1.4 1,-0.2 -2,-0.2 0.858 118.4 44.0 -53.9 -40.1 37.6 39.7 48.0 646 686 A R H X S+ 0 0 72 -4,-3.1 4,-1.1 1,-0.2 -1,-0.2 0.845 111.4 52.6 -75.5 -35.0 35.3 37.0 49.5 647 687 A L H X S+ 0 0 0 -4,-2.0 4,-1.2 -5,-0.3 -2,-0.2 0.711 109.3 50.6 -76.2 -20.9 35.4 34.8 46.5 648 688 A D H X S+ 0 0 36 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.859 102.1 59.0 -82.4 -39.8 39.2 34.8 46.4 649 689 A E H < S+ 0 0 56 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.852 110.8 44.5 -55.8 -34.9 39.6 33.9 50.0 650 690 A W H >X>S+ 0 0 23 -4,-1.1 3,-1.6 1,-0.2 4,-1.3 0.864 108.2 55.8 -78.6 -38.3 37.6 30.7 49.2 651 691 A S H 3X5S+ 0 0 22 -4,-1.2 4,-0.8 7,-0.4 3,-0.4 0.894 108.9 48.7 -58.7 -40.4 39.5 30.1 46.0 652 692 A K H 3<5S+ 0 0 163 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.1 0.020 122.3 35.0 -88.2 27.4 42.7 30.1 48.0 653 693 A A H <45S+ 0 0 61 -3,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.362 130.6 19.3-157.0 -3.9 41.2 27.8 50.6 654 694 A Y H <5S- 0 0 89 -4,-1.3 -3,-0.2 -3,-0.4 2,-0.2 0.472 109.8 -80.9-147.4 -23.5 38.9 25.3 48.8 655 695 A G ><< - 0 0 28 -4,-0.8 3,-1.9 -5,-0.7 4,-0.3 -0.619 50.7 -62.2 135.7 168.0 39.8 25.2 45.1 656 696 A E G > S+ 0 0 39 1,-0.3 3,-0.7 2,-0.2 -1,-0.1 0.577 110.7 85.5 -61.0 -9.9 39.5 26.9 41.7 657 697 A F G 3 S+ 0 0 35 1,-0.3 -1,-0.3 -6,-0.1 -6,-0.1 0.874 97.3 38.2 -57.4 -37.8 35.8 26.2 41.9 658 698 A F G < S+ 0 0 3 -3,-1.9 -7,-0.4 -8,-0.2 -1,-0.3 0.459 88.8 128.7 -92.9 -3.2 35.5 29.5 43.8 659 699 A K < - 0 0 75 -3,-0.7 -11,-0.1 -4,-0.3 2,-0.1 -0.318 64.1-115.9 -60.2 129.8 38.1 31.3 41.7 660 700 A P - 0 0 18 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.418 28.8-119.5 -64.9 137.1 36.8 34.7 40.4 661 701 A C >> - 0 0 16 -2,-0.1 4,-2.5 -64,-0.1 3,-0.7 -0.491 29.4-103.0 -78.5 151.7 36.6 34.9 36.6 662 702 A A H 3> S+ 0 0 85 1,-0.3 4,-2.5 2,-0.2 5,-0.3 0.813 120.8 52.8 -41.2 -45.7 38.7 37.6 34.8 663 703 A F H 3> S+ 0 0 31 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.930 112.8 42.3 -59.7 -48.8 35.6 39.8 34.3 664 704 A L H <> S+ 0 0 0 -3,-0.7 4,-3.0 2,-0.2 -2,-0.2 0.916 115.3 50.2 -65.9 -44.3 34.7 39.8 38.0 665 705 A A H X S+ 0 0 21 -4,-2.5 4,-2.1 2,-0.2 5,-0.2 0.944 110.5 47.3 -60.3 -51.6 38.2 40.2 39.3 666 706 A E H X S+ 0 0 132 -4,-2.5 4,-0.8 -5,-0.2 -1,-0.2 0.856 120.1 39.8 -61.8 -36.3 39.1 43.1 37.0 667 707 A R H X>S+ 0 0 31 -4,-1.6 5,-1.8 -5,-0.3 4,-0.5 0.833 111.2 57.3 -81.4 -35.0 35.9 44.9 38.0 668 708 A G H ><5S+ 0 0 0 -4,-3.0 3,-0.7 1,-0.2 -2,-0.2 0.888 103.2 53.0 -64.2 -41.6 35.9 44.0 41.6 669 709 A S H 3<5S+ 0 0 62 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.893 111.0 46.1 -61.8 -41.6 39.3 45.5 42.3 670 710 A K H 3<5S- 0 0 80 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.548 108.4-128.6 -79.0 -7.5 38.3 48.9 40.8 671 711 A G T <<5 + 0 0 43 -3,-0.7 -3,-0.2 -4,-0.5 -31,-0.1 0.719 57.5 148.5 67.1 22.2 35.1 48.6 42.8 672 712 A V < - 0 0 63 -5,-1.8 -32,-0.3 1,-0.1 -1,-0.2 -0.360 54.7 -84.0 -85.2 166.9 33.0 49.3 39.7 673 713 A L - 0 0 115 1,-0.1 3,-0.3 -2,-0.1 -1,-0.1 -0.459 25.4-152.8 -74.6 141.0 29.6 48.0 38.9 674 714 A L S S+ 0 0 0 1,-0.2 -1,-0.1 -42,-0.2 -41,-0.1 0.767 92.9 60.6 -82.4 -28.3 29.3 44.5 37.4 675 715 A S S S+ 0 0 37 -43,-0.2 -64,-0.5 -42,-0.1 -63,-0.2 0.587 78.8 117.2 -77.9 -9.9 26.0 45.2 35.5 676 716 A A S S- 0 0 36 -3,-0.3 3,-0.1 1,-0.1 -4,-0.0 -0.296 81.2 -87.6 -58.5 141.6 27.7 47.9 33.6 677 717 A P - 0 0 109 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.116 47.9-101.0 -52.0 145.6 27.8 47.3 29.8 678 718 A V 0 0 76 -75,-0.1 -3,-0.0 -3,-0.1 -74,-0.0 -0.528 360.0 360.0 -73.1 132.3 30.8 45.3 28.5 679 719 A K 0 0 143 -2,-0.3 -1,-0.1 -3,-0.1 -3,-0.0 -0.085 360.0 360.0-129.0 360.0 33.5 47.4 26.9