==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 15-MAY-12 4F7A . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES VULGATUS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 498 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17901.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 327 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 3.2 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 . 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 . 31 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 184 36.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 3.4 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 0 2 1 0 2 0 3 0 2 0 0 3 0 1 0 0 0 1 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 4 1 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 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 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 40 A K > 0 0 122 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -40.4 34.8 77.2 118.7 2 41 A E H > + 0 0 122 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.843 360.0 52.7 -72.7 -36.4 37.1 75.3 116.3 3 42 A Y H > S+ 0 0 77 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.932 114.3 44.3 -61.4 -44.6 34.2 74.5 113.8 4 43 A D H >>S+ 0 0 64 2,-0.2 4,-3.0 1,-0.2 5,-0.6 0.867 108.1 57.8 -67.1 -40.3 33.4 78.3 113.8 5 44 A F H X>S+ 0 0 70 -4,-2.2 4,-1.5 1,-0.2 5,-0.9 0.958 111.6 41.3 -52.8 -53.6 37.1 79.2 113.4 6 45 A Q H <5S+ 0 0 108 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.830 114.7 55.2 -64.5 -31.1 37.4 77.1 110.2 7 46 A K H <5S+ 0 0 91 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.962 128.7 4.4 -66.2 -51.7 34.0 78.5 109.1 8 47 A Y H X5S+ 0 0 4 -4,-3.0 4,-1.0 2,-0.1 3,-0.3 0.828 118.1 59.8-106.7 -41.2 34.8 82.2 109.3 9 48 A T H X S+ 0 0 30 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.902 104.1 53.1 -57.3 -41.4 38.2 83.5 104.7 12 51 A F H X S+ 0 0 1 -4,-1.0 4,-2.2 -3,-0.4 -1,-0.2 0.833 105.8 54.0 -63.7 -33.0 39.4 86.7 106.4 13 52 A E H X S+ 0 0 47 -4,-1.3 4,-2.0 -3,-0.2 -1,-0.2 0.918 110.1 45.5 -67.4 -47.7 43.0 85.6 106.1 14 53 A T H X S+ 0 0 15 -4,-2.0 4,-0.9 2,-0.2 -2,-0.2 0.919 114.4 48.8 -61.5 -43.8 42.7 85.0 102.3 15 54 A I H >< S+ 0 0 0 -4,-2.3 3,-0.7 1,-0.2 4,-0.4 0.946 112.6 46.4 -63.6 -49.7 40.9 88.3 101.8 16 55 A Q H >< S+ 0 0 1 -4,-2.2 3,-0.7 1,-0.3 4,-0.5 0.867 114.1 48.2 -65.4 -33.8 43.4 90.4 103.8 17 56 A K H 3<>S+ 0 0 27 -4,-2.0 5,-2.9 1,-0.2 -1,-0.3 0.682 109.0 58.1 -72.7 -16.8 46.4 88.7 102.1 18 57 A G T <<5S+ 0 0 1 -4,-0.9 3,-0.4 -3,-0.7 -1,-0.2 0.411 87.9 70.3-100.7 -1.0 44.8 89.3 98.7 19 58 A I T < 5S+ 0 0 2 -3,-0.7 2,-1.3 -4,-0.4 -2,-0.1 0.980 114.5 25.3 -77.6 -70.6 44.3 93.1 98.7 20 59 A Y T 5S- 0 0 2 -4,-0.5 -1,-0.3 296,-0.1 13,-0.1 -0.809 123.5-123.0 -85.9 84.0 48.1 94.1 98.3 21 60 A F T 5 + 0 0 0 -2,-1.3 -3,-0.3 -3,-0.4 9,-0.1 -0.054 69.7 130.6 -60.8 120.6 48.1 90.8 96.8 22 61 A N < + 0 0 8 -5,-2.9 2,-0.5 7,-0.1 214,-0.3 -0.062 28.2 142.6-151.3 45.3 50.5 88.2 98.2 23 62 A Y - 0 0 60 -6,-0.1 2,-0.8 212,-0.1 -9,-0.0 -0.748 44.3-140.0 -89.8 126.8 48.2 85.2 98.7 24 63 A D + 0 0 77 -2,-0.5 5,-0.1 1,-0.1 -7,-0.0 -0.792 22.4 176.5 -92.8 106.0 49.8 81.8 97.9 25 64 A W S S- 0 0 47 -2,-0.8 -1,-0.1 3,-0.3 4,-0.1 0.421 75.8 -67.8 -86.2 0.4 47.2 79.6 96.1 26 65 A G S S+ 0 0 64 2,-0.2 3,-0.1 0, 0.0 -2,-0.1 0.270 124.9 78.0 130.4 -7.0 49.8 76.8 95.7 27 66 A E S S- 0 0 123 1,-0.4 2,-0.1 0, 0.0 -3,-0.0 0.186 97.1 -98.6-121.6 16.4 52.3 78.4 93.3 28 67 A G - 0 0 24 3,-0.1 -1,-0.4 2,-0.1 -3,-0.3 -0.400 36.0 -84.5 102.6-175.7 54.3 80.7 95.5 29 68 A T S S+ 0 0 55 -2,-0.1 2,-2.4 -5,-0.1 -7,-0.1 -0.656 87.3 32.2-126.9 177.5 54.5 84.4 96.4 30 69 A T S > S+ 0 0 18 -2,-0.2 4,-1.8 1,-0.2 212,-0.1 -0.318 100.6 74.1 71.0 -57.4 56.0 87.7 95.1 31 70 A W H > S+ 0 0 102 -2,-2.4 4,-0.9 1,-0.2 -1,-0.2 0.863 96.0 48.9 -62.1 -35.0 55.8 86.8 91.4 32 71 A P H >> S+ 0 0 1 0, 0.0 4,-2.3 0, 0.0 3,-0.8 0.958 110.2 50.9 -67.5 -42.8 52.0 87.3 91.1 33 72 A W H 3>>S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-1.5 0.836 98.0 68.7 -59.5 -32.8 52.1 90.7 92.9 34 73 A Q H 3<>S+ 0 0 23 -4,-1.8 5,-2.6 1,-0.2 -1,-0.2 0.894 112.9 28.7 -58.1 -41.1 54.9 91.8 90.5 35 74 A T H <<5S+ 0 0 21 -4,-0.9 37,-0.4 -3,-0.8 36,-0.3 0.742 113.8 65.2 -88.6 -27.1 52.3 91.9 87.6 36 75 A F H <5S- 0 0 2 -4,-2.3 36,-0.4 35,-0.2 5,-0.3 0.967 135.0 -24.2 -51.5 -52.6 49.3 92.6 89.8 37 76 A Q T ><>S+ 0 0 0 -4,-2.5 5,-2.4 3,-0.1 3,-1.0 0.683 122.7 71.3-134.8 -39.8 50.7 96.0 90.7 38 77 A N T 3 5S+ 0 0 0 -3,-1.0 4,-2.9 -6,-0.2 3,-1.2 0.377 128.7 18.1-119.1 -94.0 51.6 98.6 86.3 41 80 A H H 3>5S+ 0 0 1 -5,-0.3 4,-2.6 1,-0.3 6,-0.3 0.802 121.4 56.3 -55.8 -41.1 50.3 101.0 89.0 42 81 A D H 34XS+ 0 0 0 -5,-2.4 6,-2.2 1,-0.2 5,-0.6 0.799 115.9 38.3 -67.1 -29.9 53.6 101.3 90.9 43 82 A X H X45S+ 0 0 12 -3,-1.2 3,-1.9 -6,-0.4 -2,-0.2 0.891 115.6 50.6 -81.9 -46.8 55.3 102.5 87.8 44 83 A F H 3<5S+ 0 0 3 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.842 103.3 61.6 -65.8 -28.3 52.5 104.6 86.4 45 84 A S T 3<5S- 0 0 0 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.1 0.666 113.4-119.9 -61.7 -20.5 52.2 106.3 89.7 46 85 A G T < 5S+ 0 0 8 -3,-1.9 208,-0.9 2,-0.2 207,-0.3 0.310 87.2 105.3 90.7 -3.0 55.8 107.6 89.3 47 86 A Y S - 0 0 10 1,-0.2 3,-2.1 195,-0.1 4,-0.3 -0.510 52.5-160.2 -77.8 112.4 65.6 95.4 83.3 53 92 A S G > S+ 0 0 3 -2,-0.7 3,-1.7 1,-0.3 238,-0.2 0.771 88.0 74.6 -59.7 -24.6 65.9 96.6 79.7 54 93 A K G 3 S+ 0 0 101 238,-0.3 239,-0.4 1,-0.3 3,-0.3 0.789 100.4 44.8 -57.0 -25.0 64.1 93.4 78.6 55 94 A F G X >S+ 0 0 39 -3,-2.1 3,-1.6 1,-0.2 5,-0.6 0.506 88.8 90.1 -90.9 -6.2 60.9 95.1 80.0 56 95 A S T < 5S+ 0 0 13 -3,-1.7 235,-0.7 -4,-0.3 -1,-0.2 0.345 80.5 57.7 -84.4 5.8 61.6 98.6 78.4 57 96 A D T 3 5S+ 0 0 47 -3,-0.3 -1,-0.3 233,-0.2 -2,-0.1 0.190 108.3 53.0-110.2 13.1 59.7 97.8 75.2 58 97 A K T X >S- 0 0 50 -3,-1.6 5,-2.4 4,-0.1 3,-1.3 0.317 116.2 -9.4-115.9-121.0 56.5 97.1 77.1 59 98 A N G > 5S+ 0 0 0 1,-0.3 3,-2.2 3,-0.2 5,-0.1 0.821 122.7 63.7 -58.3 -38.3 54.5 99.0 79.8 60 99 A T G 3 > - 0 0 73 1,-0.1 4,-2.7 -2,-0.0 3,-0.7 -0.751 10.0-148.4 -85.9 115.0 51.7 93.8 78.0 66 105 A A H 3> S+ 0 0 61 -2,-0.7 4,-1.3 1,-0.3 396,-0.3 0.813 95.3 51.5 -56.0 -40.8 48.4 91.9 78.0 67 106 A G H 34 S+ 0 0 41 2,-0.2 4,-0.3 1,-0.2 -1,-0.3 0.867 114.4 43.9 -66.3 -35.3 49.5 89.3 80.6 68 107 A W H X4 S+ 0 0 31 -3,-0.7 3,-1.2 1,-0.2 4,-0.4 0.929 112.3 48.9 -77.2 -47.7 50.7 92.1 83.0 69 108 A T H 3< S+ 0 0 6 -4,-2.7 4,-0.4 1,-0.3 3,-0.3 0.756 108.9 54.5 -67.8 -22.5 47.7 94.4 82.7 70 109 A A T 3X S+ 0 0 0 -4,-1.3 4,-2.8 -5,-0.3 -1,-0.3 0.577 85.4 89.1 -80.6 -12.8 45.2 91.6 83.2 71 110 A S H <> S+ 0 0 6 -3,-1.2 4,-2.6 -4,-0.3 5,-0.4 0.862 80.2 52.5 -63.1 -42.5 46.7 90.5 86.5 72 111 A A H > S+ 0 0 1 -4,-0.4 4,-1.7 -36,-0.4 5,-0.2 0.957 117.0 42.4 -58.2 -47.7 44.9 92.7 89.0 73 112 A W H > S+ 0 0 2 -4,-0.4 4,-2.8 2,-0.2 5,-0.3 0.968 116.6 46.7 -56.9 -55.5 41.6 91.4 87.5 74 113 A N H X S+ 0 0 26 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.911 115.4 42.3 -62.6 -48.9 42.6 87.8 87.1 75 114 A Y H X>S+ 0 0 31 -4,-2.6 4,-2.1 2,-0.2 5,-0.6 0.889 115.9 49.1 -67.2 -39.7 44.1 87.2 90.6 76 115 A T H X>S+ 0 0 3 -4,-1.7 5,-2.8 -5,-0.4 4,-1.7 0.948 117.3 39.4 -68.3 -46.6 41.3 89.1 92.4 77 116 A Y H <5S+ 0 0 24 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.843 118.4 48.8 -73.6 -31.2 38.5 87.3 90.6 78 117 A N H <5S+ 0 0 92 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.907 132.7 5.0 -71.6 -40.4 40.2 83.9 90.7 79 118 A Y H <5S+ 0 0 65 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.677 128.7 33.0-120.5 -24.9 41.2 83.9 94.4 80 119 A I T >X S+ 0 0 44 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.875 109.6 48.9 -63.6 -29.5 34.8 84.8 95.6 83 122 A V H <> S+ 0 0 30 -3,-0.5 4,-2.6 2,-0.2 -2,-0.2 0.879 109.6 50.3 -71.2 -41.1 36.0 84.5 99.2 84 123 A A H X S+ 0 0 2 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.873 112.6 48.5 -62.6 -38.0 34.8 88.0 100.1 85 124 A H H X S+ 0 0 40 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.940 111.2 48.6 -67.4 -47.7 31.4 87.0 98.6 86 125 A K H X S+ 0 0 52 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.914 110.0 52.8 -55.7 -42.3 31.3 83.7 100.4 87 126 A S H X S+ 0 0 0 -4,-2.6 4,-0.9 1,-0.2 -1,-0.2 0.881 108.4 51.0 -65.1 -37.1 32.2 85.5 103.7 88 127 A T H >X S+ 0 0 7 -4,-1.8 4,-2.6 1,-0.2 3,-0.7 0.949 110.1 49.4 -58.6 -49.1 29.3 87.9 103.0 89 128 A L H 3< S+ 0 0 88 -4,-2.4 4,-0.4 1,-0.2 -2,-0.2 0.869 113.0 45.3 -63.3 -39.1 26.8 85.0 102.4 90 129 A I H 3< S+ 0 0 41 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.591 122.7 34.0 -86.5 -8.0 27.8 83.2 105.6 91 130 A T H X< S+ 0 0 1 -4,-0.9 3,-1.9 -3,-0.7 10,-0.3 0.684 95.5 80.4-112.6 -24.1 27.8 86.2 107.9 92 131 A Q T 3< S+ 0 0 79 -4,-2.6 -3,-0.1 1,-0.3 -2,-0.1 0.769 104.9 33.7 -59.4 -29.4 25.0 88.5 106.6 93 132 A D T 3 S+ 0 0 139 -4,-0.4 2,-0.6 -5,-0.2 -1,-0.3 0.204 93.0 112.0-108.6 12.4 22.2 86.5 108.3 94 133 A E X - 0 0 86 -3,-1.9 3,-1.4 1,-0.1 7,-0.2 -0.796 52.8-157.9 -98.5 118.0 24.2 85.4 111.4 95 134 A A G > S+ 0 0 69 -2,-0.6 3,-0.5 1,-0.3 -1,-0.1 0.830 93.1 44.3 -61.1 -36.6 23.0 87.0 114.7 96 135 A K G 3 S+ 0 0 97 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.441 110.0 56.8 -91.4 0.4 26.2 86.6 116.5 97 136 A Y G <> + 0 0 42 -3,-1.4 4,-2.4 -6,-0.2 -1,-0.2 -0.053 56.6 123.7-125.1 34.8 28.5 87.7 113.6 98 137 A K H <> S+ 0 0 52 -3,-0.5 4,-2.6 1,-0.2 -1,-0.1 0.860 80.0 53.4 -60.5 -37.0 27.3 91.2 112.8 99 138 A H H > S+ 0 0 11 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.890 109.0 46.9 -63.0 -42.5 30.9 92.4 113.4 100 139 A F H > S+ 0 0 9 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.855 111.6 52.9 -68.7 -36.0 32.4 89.9 110.9 101 140 A Y H X S+ 0 0 36 -4,-2.4 4,-2.2 -10,-0.3 -2,-0.2 0.964 110.6 46.9 -59.6 -52.2 29.7 90.8 108.4 102 141 A G H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.929 113.3 48.1 -54.5 -49.3 30.6 94.5 108.7 103 142 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.881 108.8 54.4 -60.8 -41.6 34.3 93.7 108.4 104 143 A T H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.930 108.7 48.8 -56.4 -48.3 33.7 91.5 105.4 105 144 A L H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.906 111.1 49.3 -62.1 -44.6 31.9 94.4 103.6 106 145 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.938 113.0 46.7 -60.7 -48.5 34.6 96.9 104.4 107 146 A L H X S+ 0 0 1 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.881 109.7 54.8 -61.3 -36.2 37.3 94.5 103.1 108 147 A K H X S+ 0 0 16 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.917 111.8 43.3 -65.4 -40.6 35.3 93.8 100.0 109 148 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 5,-0.3 0.910 111.7 54.6 -70.2 -42.5 35.0 97.5 99.1 110 149 A E H X S+ 0 0 1 -4,-2.8 4,-0.7 -5,-0.2 -2,-0.2 0.917 115.0 40.7 -54.6 -45.9 38.7 98.0 100.0 111 150 A A H X S+ 0 0 8 -4,-2.5 4,-0.6 -5,-0.2 3,-0.2 0.933 119.1 42.3 -67.1 -48.3 39.6 95.2 97.5 112 151 A X H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.739 101.0 63.4 -86.9 -21.4 37.2 96.0 94.7 113 152 A H H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.890 101.9 57.4 -66.1 -31.9 37.5 99.8 94.5 114 153 A R H < S+ 0 0 7 -4,-0.7 4,-0.4 -5,-0.3 -1,-0.2 0.830 107.8 47.2 -62.2 -31.8 41.1 99.2 93.5 115 154 A I H >X S+ 0 0 1 -4,-0.6 4,-2.3 -3,-0.2 3,-0.8 0.923 112.3 45.7 -77.9 -48.0 39.9 97.0 90.6 116 155 A T H 3X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.893 109.9 56.7 -62.3 -35.9 37.3 99.4 89.2 117 156 A D H 3< S+ 0 0 4 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.726 111.6 44.3 -67.7 -19.4 39.9 102.2 89.6 118 157 A T H <4 S+ 0 0 1 -3,-0.8 340,-2.5 -4,-0.4 -2,-0.2 0.904 133.8 10.2 -83.1 -47.8 42.2 100.1 87.3 119 158 A Y H < S- 0 0 0 -4,-2.3 -3,-0.2 1,-0.3 -2,-0.2 0.646 87.6-133.7-111.5 -25.1 39.7 99.0 84.6 120 159 A G S < S+ 0 0 0 -4,-2.2 -1,-0.3 -5,-0.4 -2,-0.1 -0.887 79.7 49.8 99.1-116.2 36.5 100.9 84.9 121 160 A P S S+ 0 0 3 0, 0.0 2,-0.3 0, 0.0 16,-0.2 -0.255 71.0 170.2 -56.4 143.0 33.5 98.6 84.7 122 161 A I B -C 136 0B 0 14,-1.6 14,-3.2 15,-0.1 2,-0.6 -0.909 41.9 -99.2-142.3 172.7 33.6 95.5 86.9 123 162 A V S S+ 0 0 10 -2,-0.3 12,-0.2 12,-0.2 11,-0.0 -0.903 72.1 113.4 -93.2 118.8 31.6 92.6 88.1 124 163 A Y > + 0 0 12 -2,-0.6 3,-1.8 10,-0.5 -1,-0.1 0.290 64.5 40.1-147.0 -76.8 30.4 93.6 91.6 125 164 A S T 3 S+ 0 0 56 1,-0.3 10,-0.1 3,-0.0 -2,-0.1 0.792 123.3 42.9 -63.7 -24.6 26.8 94.2 92.6 126 165 A K T > S+ 0 0 41 8,-0.4 3,-2.0 2,-0.0 5,-0.4 0.376 80.7 135.7-102.5 6.6 25.6 91.4 90.4 127 166 A F T < S+ 0 0 52 -3,-1.8 8,-0.0 1,-0.3 -3,-0.0 -0.270 80.3 3.5 -57.6 134.1 28.2 88.8 91.4 128 167 A G T 3 S+ 0 0 66 1,-0.1 -1,-0.3 3,-0.1 -2,-0.0 0.585 103.5 103.7 65.7 12.7 26.8 85.3 92.0 129 168 A K S < S- 0 0 134 -3,-2.0 -2,-0.1 5,-0.1 -1,-0.1 0.430 78.9-135.6-101.5 -5.0 23.2 86.5 91.1 130 169 A N + 0 0 105 -4,-0.3 2,-0.2 1,-0.1 -3,-0.1 0.869 42.7 165.0 53.9 43.0 23.2 84.9 87.6 131 170 A E - 0 0 106 -5,-0.4 -1,-0.1 1,-0.1 3,-0.1 -0.530 51.0-110.7 -86.5 160.0 21.7 87.9 85.8 132 171 A T S S+ 0 0 146 1,-0.2 2,-0.6 -2,-0.2 -1,-0.1 0.904 111.7 35.7 -54.9 -49.4 21.8 88.3 82.1 133 172 A N - 0 0 61 1,-0.1 -1,-0.2 2,-0.1 -2,-0.1 -0.953 67.6-174.1-112.2 114.5 24.3 91.2 82.3 134 173 A S + 0 0 25 -2,-0.6 -10,-0.5 -3,-0.1 -8,-0.4 0.488 50.0 105.9 -82.8 -6.0 26.9 90.7 85.1 135 174 A V - 0 0 4 -12,-0.2 2,-0.5 -10,-0.1 -12,-0.2 -0.599 51.1-159.1 -94.1 134.3 28.6 94.1 84.7 136 175 A D B -C 122 0B 1 -14,-3.2 -14,-1.6 -2,-0.3 -2,-0.0 -0.918 23.3-128.0 -94.7 134.4 28.4 97.2 86.8 137 176 A T > - 0 0 39 -2,-0.5 4,-2.4 -16,-0.2 5,-0.2 -0.322 36.5-103.8 -60.2 159.6 29.3 100.6 85.2 138 177 A Q H > S+ 0 0 5 340,-0.3 4,-2.8 1,-0.2 5,-0.2 0.893 124.8 54.8 -57.1 -39.4 31.9 102.3 87.4 139 178 A E H > S+ 0 0 67 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.919 109.4 46.7 -58.6 -45.1 29.1 104.6 88.6 140 179 A E H > S+ 0 0 97 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.862 111.1 51.7 -65.8 -39.2 27.1 101.6 89.7 141 180 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.930 110.5 48.8 -62.5 -47.6 30.1 100.0 91.4 142 181 A Y H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.931 111.0 49.6 -57.3 -45.3 30.8 103.2 93.3 143 182 A K H X S+ 0 0 91 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.922 110.8 50.1 -61.8 -41.4 27.1 103.4 94.4 144 183 A A H X S+ 0 0 12 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.905 108.4 53.9 -64.0 -37.2 27.3 99.8 95.5 145 184 A F H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.939 109.3 46.8 -60.1 -47.1 30.5 100.5 97.5 146 185 A F H X S+ 0 0 2 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.894 112.8 50.5 -63.7 -39.2 28.7 103.4 99.4 147 186 A D H X S+ 0 0 91 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.899 111.0 48.7 -60.5 -45.3 25.7 101.1 100.0 148 187 A D H X S+ 0 0 18 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.893 109.6 51.4 -65.4 -38.7 28.0 98.3 101.3 149 188 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 5,-0.3 0.888 109.0 51.9 -65.5 -35.2 29.8 100.8 103.6 150 189 A D H X S+ 0 0 41 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.933 111.4 46.3 -62.5 -46.7 26.4 101.9 104.9 151 190 A K H X S+ 0 0 109 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.918 113.4 51.2 -62.2 -41.0 25.5 98.3 105.7 152 191 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.926 110.9 44.0 -61.4 -53.3 28.9 97.7 107.3 153 192 A V H X S+ 0 0 10 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.876 114.7 51.7 -65.8 -33.5 28.9 100.7 109.7 154 193 A D H X S+ 0 0 103 -4,-2.1 4,-2.9 -5,-0.3 5,-0.2 0.946 110.7 47.8 -62.3 -49.8 25.2 99.9 110.6 155 194 A A H X S+ 0 0 11 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.922 114.6 44.9 -59.4 -46.5 26.1 96.2 111.4 156 195 A L H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.890 113.8 49.3 -69.4 -38.5 29.2 97.2 113.5 157 196 A D H X S+ 0 0 29 -4,-2.3 4,-2.9 -5,-0.2 5,-0.2 0.934 112.8 47.8 -65.6 -44.6 27.3 99.9 115.4 158 197 A T H X S+ 0 0 55 -4,-2.9 4,-2.2 -5,-0.2 6,-0.2 0.928 107.8 56.0 -58.1 -44.9 24.4 97.5 116.0 159 198 A Y H <>S+ 0 0 25 -4,-2.6 5,-2.5 1,-0.2 -1,-0.2 0.920 112.7 42.4 -53.2 -45.6 26.9 94.8 117.2 160 199 A L H ><5S+ 0 0 30 -4,-2.0 3,-1.9 1,-0.2 -2,-0.2 0.916 111.6 52.1 -70.4 -44.0 28.2 97.3 119.8 161 200 A K H 3<5S+ 0 0 160 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.772 105.3 57.7 -64.9 -25.4 24.8 98.7 120.9 162 201 A E T 3<5S- 0 0 119 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.369 129.5 -96.4 -81.4 1.8 23.7 95.0 121.5 163 202 A G T < 5 + 0 0 62 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.1 0.616 66.2 162.1 93.9 14.5 26.6 94.6 123.9 164 203 A G < - 0 0 20 -5,-2.5 -1,-0.3 -6,-0.2 2,-0.2 -0.451 46.6-107.0 -66.6 137.7 29.2 93.0 121.6 165 204 A K > - 0 0 105 1,-0.1 3,-2.2 -2,-0.1 4,-0.2 -0.470 18.6-129.4 -67.5 134.1 32.7 93.2 123.0 166 205 A E G > S+ 0 0 73 1,-0.3 14,-1.6 -2,-0.2 3,-0.7 0.866 109.1 52.9 -49.3 -39.6 34.9 95.8 121.1 167 206 A D G > S+ 0 0 72 1,-0.2 3,-2.1 12,-0.2 -1,-0.3 0.266 71.6 107.3 -88.5 15.4 37.6 93.1 120.8 168 207 A G G < S+ 0 0 23 -3,-2.2 3,-0.3 1,-0.3 -1,-0.2 0.662 77.1 59.9 -63.7 -14.5 35.3 90.5 119.2 169 208 A V G X> S+ 0 0 0 -3,-0.7 3,-1.6 9,-0.2 4,-0.5 0.348 72.8 106.0 -89.5 3.0 37.2 91.2 116.0 170 209 A K G X4 S+ 0 0 144 -3,-2.1 3,-1.3 1,-0.3 -1,-0.2 0.871 73.6 55.5 -51.3 -45.6 40.5 90.1 117.5 171 210 A S G 34 S+ 0 0 60 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.630 112.6 41.4 -68.4 -15.7 40.7 86.8 115.6 172 211 A I G <4 S+ 0 0 1 -3,-1.6 2,-1.4 5,-0.1 -1,-0.3 0.326 79.9 124.7-113.4 6.6 40.3 88.5 112.2 173 212 A N << + 0 0 51 -3,-1.3 -3,-0.0 -4,-0.5 -160,-0.0 -0.521 12.7 129.8 -77.7 92.9 42.6 91.5 112.7 174 213 A X S S+ 0 0 7 -2,-1.4 57,-2.0 -162,-0.1 -1,-0.2 0.206 70.9 58.6-113.0 14.3 45.3 91.5 109.9 175 214 A C S S- 0 0 0 55,-0.2 54,-0.9 2,-0.1 55,-0.1 0.209 118.2 -94.8-128.3 17.4 44.7 95.2 109.0 176 215 A N S S+ 0 0 44 52,-0.2 54,-0.1 55,-0.2 -3,-0.1 0.863 87.0 125.0 67.8 40.3 45.4 97.1 112.3 177 216 A C + 0 0 0 -8,-0.1 -1,-0.2 1,-0.1 -2,-0.1 -0.848 25.4 166.2-123.5 89.3 41.7 97.2 113.3 178 217 A P + 0 0 45 0, 0.0 2,-0.3 0, 0.0 -9,-0.2 0.554 61.3 40.5 -86.5 -6.0 41.7 95.6 116.8 179 218 A T S > S- 0 0 37 -10,-0.1 4,-1.6 1,-0.1 -12,-0.2 -0.933 82.7-113.1-137.2 159.9 38.2 96.7 117.7 180 219 A A H > S+ 0 0 0 -14,-1.6 4,-1.9 -2,-0.3 3,-0.3 0.924 118.3 55.3 -56.2 -44.5 34.7 97.1 116.2 181 220 A S H > S+ 0 0 28 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.881 104.1 54.2 -57.1 -38.4 35.0 100.9 116.5 182 221 A R H > S+ 0 0 40 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.853 104.6 53.8 -68.3 -32.8 38.3 100.8 114.5 183 222 A W H X S+ 0 0 0 -4,-1.6 4,-2.7 -3,-0.3 -1,-0.2 0.905 108.7 49.3 -62.6 -41.1 36.6 98.9 111.7 184 223 A I H X S+ 0 0 0 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.923 109.5 51.5 -65.8 -40.7 34.0 101.7 111.5 185 224 A K H X S+ 0 0 42 -4,-2.3 4,-2.3 2,-0.2 36,-0.5 0.901 109.3 51.0 -60.3 -40.9 36.7 104.3 111.5 186 225 A F H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 5,-0.3 0.964 111.3 48.0 -55.6 -54.2 38.3 102.4 108.6 187 226 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.888 111.5 50.2 -56.3 -42.7 34.9 102.4 106.8 188 227 A N H X S+ 0 0 1 -4,-2.9 4,-1.9 31,-0.2 -1,-0.2 0.914 113.0 45.5 -63.9 -42.8 34.5 106.1 107.4 189 228 A S H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.904 113.3 49.3 -68.2 -43.8 38.0 107.0 106.1 190 229 A L H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 5,-0.2 0.919 109.1 53.6 -61.0 -42.4 37.5 104.7 103.0 191 230 A R H X S+ 0 0 3 -4,-2.6 4,-2.5 -5,-0.3 -2,-0.2 0.915 107.4 51.3 -59.5 -41.0 34.1 106.4 102.4 192 231 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.900 108.3 51.7 -63.1 -41.9 35.8 109.8 102.4 193 232 A R H X S+ 0 0 2 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.943 112.5 45.0 -55.5 -50.1 38.4 108.5 99.9 194 233 A L H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.862 110.2 56.1 -65.3 -35.9 35.7 107.3 97.6 195 234 A A H < S+ 0 0 0 -4,-2.5 4,-0.3 -5,-0.2 -1,-0.2 0.911 109.4 44.7 -60.4 -46.7 33.8 110.6 98.1 196 235 A X H >< S+ 0 0 0 -4,-2.4 3,-1.6 1,-0.2 4,-0.3 0.903 107.1 60.9 -68.2 -36.0 36.7 112.7 97.0 197 236 A R H 3< S+ 0 0 0 -4,-2.4 3,-0.4 1,-0.3 4,-0.3 0.884 110.4 39.9 -53.4 -42.2 37.3 110.3 94.0 198 237 A V T 3X S+ 0 0 0 -4,-1.6 4,-3.0 1,-0.2 8,-0.3 0.392 86.9 103.1 -90.6 5.4 33.8 111.1 92.6 199 238 A S T <4 S+ 0 0 2 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.1 0.763 82.0 44.8 -64.9 -28.7 34.0 114.9 93.5 200 239 A N T 4 S+ 0 0 10 -3,-0.4 3,-0.3 -4,-0.3 -1,-0.2 0.872 122.1 36.2 -81.5 -38.5 34.7 116.0 89.9 201 240 A V T 4 S+ 0 0 46 -4,-0.3 2,-0.2 290,-0.3 -2,-0.2 0.809 134.1 17.6 -81.6 -33.4 32.1 113.8 88.2 202 241 A D X + 0 0 37 -4,-3.0 4,-2.6 1,-0.1 -1,-0.2 -0.662 58.8 172.6-146.8 81.4 29.3 113.9 90.8 203 242 A K H > S+ 0 0 96 -3,-0.3 4,-2.4 -2,-0.2 5,-0.2 0.837 81.9 57.9 -62.3 -34.8 29.5 116.7 93.4 204 243 A T H > S+ 0 0 115 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.928 111.0 41.6 -62.2 -46.0 26.2 115.9 94.9 205 244 A L H > S+ 0 0 22 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.915 114.1 52.1 -65.3 -47.5 27.3 112.3 95.7 206 245 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 -8,-0.3 5,-0.2 0.895 110.9 49.4 -54.3 -42.3 30.7 113.4 96.9 207 246 A T H X S+ 0 0 49 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.941 113.2 44.3 -65.8 -48.5 29.0 116.0 99.2 208 247 A S H X S+ 0 0 50 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.896 117.7 44.4 -66.1 -40.5 26.5 113.5 100.7 209 248 A E H X S+ 0 0 13 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.902 112.2 51.0 -75.1 -38.0 29.2 110.7 101.2 210 249 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 -5,-0.3 -1,-0.2 0.895 109.4 53.2 -62.6 -35.9 31.8 113.1 102.6 211 250 A Q H X S+ 0 0 96 -4,-2.1 4,-1.3 -5,-0.2 -2,-0.2 0.930 110.9 45.1 -64.9 -44.2 29.2 114.4 105.0 212 251 A K H X S+ 0 0 74 -4,-1.9 4,-1.3 2,-0.2 3,-0.2 0.906 113.4 51.1 -60.2 -46.3 28.4 110.8 106.2 213 252 A A H < S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.907 116.7 37.9 -57.4 -46.3 32.2 110.0 106.5 214 253 A L H < S+ 0 0 8 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.535 117.9 47.5 -93.8 -7.0 33.0 113.1 108.5 215 254 A E H < S+ 0 0 120 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.553 77.7 115.4-103.8 -13.1 29.9 113.2 110.8 216 255 A N S >< S- 0 0 47 -4,-1.3 3,-1.8 -5,-0.2 -4,-0.0 -0.386 70.6-132.0 -59.2 131.5 29.9 109.5 111.7 217 256 A S T 3 S+ 0 0 110 1,-0.3 -1,-0.2 -2,-0.1 -3,-0.0 0.666 99.2 69.0 -65.3 -18.8 30.5 109.5 115.5 218 257 A Y T 3 S- 0 0 48 1,-0.2 -1,-0.3 -34,-0.1 -33,-0.2 0.645 97.9-143.2 -76.9 -13.0 33.2 106.7 115.3 219 258 A G < - 0 0 26 -3,-1.8 2,-0.3 -6,-0.1 -31,-0.2 -0.172 7.8 -86.0 89.0-179.7 35.5 109.2 113.6 220 259 A V - 0 0 4 -32,-0.1 2,-0.3 -6,-0.1 -34,-0.1 -0.802 54.8 -75.3-124.0 167.4 38.1 108.9 110.8 221 260 A I + 0 0 3 -36,-0.5 3,-0.1 -2,-0.3 104,-0.1 -0.509 56.1 155.2 -70.5 124.8 41.8 107.9 111.0 222 261 A E + 0 0 87 -2,-0.3 2,-0.4 1,-0.2 -1,-0.2 0.566 54.4 62.4-123.1 -21.5 43.9 110.8 112.4 223 262 A S S > S- 0 0 54 1,-0.1 3,-2.2 98,-0.0 -1,-0.2 -0.918 73.1-134.7-113.6 139.4 47.0 109.1 114.0 224 263 A S G > S+ 0 0 19 -2,-0.4 3,-1.9 1,-0.3 -1,-0.1 0.773 103.2 72.0 -62.4 -24.1 49.6 107.0 112.1 225 264 A D G 3 S+ 0 0 135 1,-0.3 -1,-0.3 96,-0.0 132,-0.0 0.720 99.4 48.8 -63.0 -17.2 49.4 104.4 114.8 226 265 A E G < S+ 0 0 44 -3,-2.2 -1,-0.3 2,-0.1 -2,-0.2 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5,-0.4 -24,-0.1 2,-0.2 -22,-0.1 -0.372 24.9-107.6 -91.9 173.3 56.4 124.5 96.8 395 434 A P S S+ 0 0 0 0, 0.0 2,-0.6 0, 0.0 -25,-0.1 0.662 91.0 102.5 -74.5 -13.4 55.4 122.8 100.1 396 435 A N > - 0 0 21 -27,-0.9 3,-1.4 1,-0.2 -2,-0.2 -0.594 61.4-157.1 -76.1 114.6 54.2 126.1 101.5 397 436 A F T 3 S+ 0 0 7 -2,-0.6 3,-0.4 -30,-0.5 -1,-0.2 0.846 91.1 60.2 -62.2 -34.4 50.4 126.1 101.4 398 437 A D T 3 S+ 0 0 107 1,-0.3 2,-0.4 -3,-0.0 -1,-0.3 0.659 88.3 74.9 -67.0 -21.0 50.4 130.0 101.5 399 438 A D < + 0 0 70 -3,-1.4 2,-0.5 6,-0.1 -5,-0.4 -0.279 69.0 119.0 -84.1 35.7 52.4 130.1 98.3 400 439 A A - 0 0 27 -3,-0.4 3,-0.1 -2,-0.4 -3,-0.0 -0.955 49.7-162.6 -99.4 132.5 49.4 129.1 96.2 401 440 A V S S- 0 0 125 -2,-0.5 2,-0.3 1,-0.1 -1,-0.1 0.628 76.6 -0.3 -82.5 -18.2 48.3 131.7 93.5 402 441 A N S > S- 0 0 86 1,-0.0 4,-1.6 0, 0.0 3,-0.3 -0.957 81.7 -94.7-160.7 175.6 44.8 130.0 93.2 403 442 A Q H > S+ 0 0 108 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.761 118.7 62.6 -80.6 -20.2 42.8 127.2 94.6 404 443 A E H > S+ 0 0 55 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.910 106.1 47.3 -60.1 -41.7 43.8 124.8 91.7 405 444 A E H > S+ 0 0 32 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.872 109.3 54.8 -67.8 -34.9 47.4 125.2 93.0 406 445 A Q H X S+ 0 0 35 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.932 108.3 47.4 -62.0 -44.3 46.1 124.6 96.5 407 446 A L H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.3 0.923 109.0 55.5 -60.4 -42.3 44.6 121.4 95.3 408 447 A E H X S+ 0 0 10 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.915 108.1 47.9 -56.7 -43.9 47.9 120.5 93.5 409 448 A K H X S+ 0 0 1 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.937 112.5 49.5 -61.3 -46.7 49.8 121.0 96.8 410 449 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.947 116.2 40.7 -58.5 -50.3 47.2 118.8 98.7 411 450 A I H X S+ 0 0 2 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.879 114.4 52.1 -70.6 -38.5 47.4 116.0 96.1 412 451 A T H X S+ 0 0 1 -4,-2.8 4,-2.1 -5,-0.3 -1,-0.2 0.940 113.9 43.6 -63.2 -45.3 51.2 116.2 95.6 413 452 A Q H X S+ 0 0 1 -4,-2.8 4,-2.4 -5,-0.2 -2,-0.2 0.886 112.1 53.3 -67.3 -34.9 51.7 115.9 99.4 414 453 A K H X S+ 0 0 3 -4,-2.4 4,-1.9 -5,-0.3 -1,-0.2 0.898 106.7 53.8 -62.9 -40.7 49.1 113.1 99.5 415 454 A W H X S+ 0 0 5 -4,-2.4 4,-0.5 2,-0.2 -2,-0.2 0.923 109.4 46.5 -61.9 -43.4 51.1 111.3 96.8 416 455 A I H >< S+ 0 0 0 -4,-2.1 3,-1.1 1,-0.2 -1,-0.2 0.949 115.0 49.1 -59.3 -42.4 54.3 111.5 98.9 417 456 A A H 3< S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 -94,-0.2 0.702 103.1 58.3 -74.9 -23.3 52.3 110.3 101.9 418 457 A C H >< S+ 0 0 7 -4,-1.9 3,-2.0 -3,-0.1 -1,-0.2 0.533 88.4 162.1 -82.3 -8.1 50.6 107.3 100.2 419 458 A W T << + 0 0 0 -3,-1.1 -3,-0.0 -4,-0.5 -102,-0.0 -0.284 54.1 18.3 -57.5 138.9 54.0 105.8 99.3 420 459 A P T 3 S+ 0 0 7 0, 0.0 2,-1.2 0, 0.0 -1,-0.3 -0.927 100.7 93.9 -96.2 18.4 54.7 103.0 98.5 421 460 A E <> - 0 0 6 -3,-2.0 4,-1.3 1,-0.2 3,-0.2 -0.551 50.2-175.8 -84.3 97.6 51.1 102.1 97.6 422 461 A G H > + 0 0 0 -2,-1.2 4,-2.6 1,-0.2 5,-0.2 0.691 69.7 65.3 -70.1 -26.2 51.0 102.8 93.9 423 462 A X H > S+ 0 0 8 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.967 105.9 41.0 -65.4 -52.1 47.3 102.1 93.3 424 463 A E H > S+ 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24 -6,-0.6 -2,-0.3 2,-0.1 -1,-0.3 -0.885 41.7 31.3-123.4 146.7 48.4 115.8 90.2 435 474 A P S S- 0 0 0 0, 0.0 2,-1.8 0, 0.0 -2,-0.1 0.687 89.9-121.1 -68.8 166.9 51.2 115.4 90.8 436 475 A K - 0 0 80 -2,-0.2 -46,-0.3 -183,-0.1 -45,-0.2 -0.563 36.7-160.2 -80.0 81.2 52.5 116.5 87.4 437 476 A L - 0 0 3 -2,-1.8 2,-0.1 -4,-0.1 -391,-0.1 -0.303 25.1 -99.8 -59.1 140.7 54.3 113.3 86.5 438 477 A F - 0 0 13 1,-0.1 2,-0.1 -392,-0.1 -1,-0.1 -0.403 44.7-116.9 -55.3 138.1 57.0 113.4 83.8 439 478 A K - 0 0 64 1,-0.1 13,-0.1 -3,-0.1 -1,-0.1 -0.431 35.7 -85.8 -78.1 154.8 55.6 112.1 80.5 440 479 A V - 0 0 8 11,-0.3 -152,-0.3 1,-0.1 -1,-0.1 -0.263 28.9-144.5 -59.1 141.5 56.8 109.0 78.7 441 480 A Q S S+ 0 0 48 -154,-1.2 2,-0.4 1,-0.3 -152,-0.2 0.865 89.1 29.2 -77.4 -35.5 59.9 109.8 76.5 442 481 A T S S- 0 0 50 -154,-1.4 2,-0.6 -382,-0.2 -1,-0.3 -0.994 70.3-160.3-127.3 132.6 58.7 107.2 73.9 443 482 A N + 0 0 43 -2,-0.4 3,-0.2 -3,-0.1 4,-0.2 -0.907 18.0 166.9-118.6 98.6 55.1 106.3 73.3 444 483 A N + 0 0 74 -383,-3.3 -382,-0.1 -2,-0.6 -1,-0.1 -0.092 40.1 117.0-102.9 36.1 54.7 103.0 71.5 445 484 A S S > S- 0 0 6 4,-0.2 3,-1.7 -382,-0.1 -1,-0.2 0.329 83.7-118.7 -84.9 5.7 50.9 102.6 72.1 446 485 A N T 3 S- 0 0 159 1,-0.3 -2,-0.1 -3,-0.2 -1,-0.0 0.866 73.8 -54.7 58.0 37.8 50.1 102.7 68.4 447 486 A G T 3 S+ 0 0 78 2,-0.2 -1,-0.3 -4,-0.2 3,-0.1 0.443 117.0 111.5 78.0 2.9 48.1 105.9 69.0 448 487 A T S < S+ 0 0 58 -3,-1.7 38,-0.4 1,-0.1 2,-0.4 0.761 77.3 41.8 -83.1 -23.5 45.9 104.4 71.8 449 488 A I S S- 0 0 5 36,-0.1 2,-0.4 -387,-0.1 -2,-0.2 -0.987 80.6-134.6-125.1 133.9 47.4 106.4 74.6 450 489 A D > - 0 0 84 -2,-0.4 4,-2.5 4,-0.3 -2,-0.0 -0.704 10.9-139.6 -87.5 131.7 48.2 110.2 74.4 451 490 A T T 4 S+ 0 0 46 -2,-0.4 -11,-0.3 1,-0.2 -1,-0.1 0.937 100.7 38.5 -56.2 -50.1 51.6 111.2 75.8 452 491 A D T 4 S+ 0 0 112 1,-0.2 -1,-0.2 2,-0.1 3,-0.0 0.891 119.1 44.5 -74.3 -40.8 50.3 114.4 77.4 453 492 A I T 4 S- 0 0 78 1,-0.0 -1,-0.2 -14,-0.0 -2,-0.2 0.911 105.0-156.1 -65.2 -37.5 46.9 113.2 78.7 454 493 A X < - 0 0 8 -4,-2.5 -4,-0.3 -14,-0.0 -2,-0.1 0.076 34.4 -33.4 77.9 167.6 48.8 110.1 79.9 455 494 A I - 0 0 3 1,-0.1 31,-0.2 -6,-0.1 3,-0.1 -0.253 52.1-172.7 -58.4 136.3 47.5 106.5 80.5 456 495 A R - 0 0 8 29,-3.4 33,-0.4 1,-0.3 2,-0.3 0.592 58.7 -24.0-106.4 -21.0 44.0 106.6 81.8 457 496 A R - 0 0 0 28,-0.8 -1,-0.3 31,-0.1 -338,-0.2 -0.962 66.0 -91.6-174.8 171.6 43.3 102.9 82.7 458 497 A L - 0 0 0 -340,-2.5 26,-0.1 -2,-0.3 3,-0.1 -0.850 47.4-105.9-100.2 145.6 44.4 99.3 82.0 459 498 A P - 0 0 24 0, 0.0 3,-0.1 0, 0.0 25,-0.1 -0.293 46.3 -86.8 -63.3 156.1 42.5 97.4 79.3 460 499 A F - 0 0 5 1,-0.1 2,-0.5 -341,-0.1 -390,-0.1 -0.154 56.4 -83.7 -57.9 154.6 40.1 94.6 80.4 461 500 A S > - 0 0 3 1,-0.2 4,-2.2 -391,-0.1 -1,-0.1 -0.519 31.9-162.4 -64.5 117.6 41.5 91.2 81.0 462 501 A Q H > S+ 0 0 82 -2,-0.5 4,-2.1 -396,-0.3 -1,-0.2 0.739 91.9 62.4 -70.9 -21.9 41.8 89.2 77.8 463 502 A D H > S+ 0 0 64 2,-0.2 4,-1.0 -397,-0.2 -1,-0.2 0.938 108.8 41.0 -66.1 -43.5 42.0 86.0 79.8 464 503 A D H > S+ 0 0 29 1,-0.2 4,-2.3 2,-0.2 3,-0.5 0.911 111.9 56.4 -66.6 -41.8 38.5 86.8 81.1 465 504 A A H < S+ 0 0 10 -4,-2.2 -2,-0.2 1,-0.2 7,-0.2 0.873 104.9 52.5 -57.7 -37.0 37.4 87.9 77.6 466 505 A K H < S+ 0 0 166 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.812 113.7 43.1 -69.5 -30.6 38.4 84.5 76.2 467 506 A K H < S+ 0 0 165 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.796 131.4 21.9 -78.9 -31.0 36.3 82.7 78.8 468 507 A D X + 0 0 59 -4,-2.3 4,-2.1 1,-0.1 -1,-0.2 -0.657 58.8 169.5-145.8 79.8 33.4 85.1 78.5 469 508 A P H > S+ 0 0 91 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.859 83.8 55.2 -64.0 -35.4 33.1 87.0 75.2 470 509 A E H > S+ 0 0 95 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.949 109.0 47.9 -61.9 -46.9 29.5 88.2 76.1 471 510 A Q H > S+ 0 0 20 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.899 108.8 54.1 -59.5 -40.3 30.8 89.7 79.3 472 511 A Y H X S+ 0 0 61 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.927 108.2 49.6 -59.1 -44.2 33.7 91.3 77.5 473 512 A K H X S+ 0 0 110 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.925 111.8 49.1 -58.8 -44.7 31.2 93.0 75.2 474 513 A N H X S+ 0 0 19 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.839 109.5 50.9 -63.7 -36.1 29.2 94.1 78.2 475 514 A L H X S+ 0 0 4 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.915 110.9 49.5 -65.3 -45.4 32.3 95.5 79.9 476 515 A C H X>S+ 0 0 33 -4,-2.6 4,-1.2 2,-0.2 5,-0.7 0.913 110.4 50.0 -58.8 -46.6 33.1 97.5 76.7 477 516 A T H ><5S+ 0 0 106 -4,-2.6 3,-0.6 1,-0.2 -2,-0.2 0.925 110.9 49.8 -55.6 -46.4 29.5 98.8 76.5 478 517 A A H 3<5S+ 0 0 28 -4,-2.2 -340,-0.3 1,-0.2 -1,-0.2 0.769 103.9 60.5 -65.7 -28.4 29.7 99.9 80.2 479 518 A L H 3<5S- 0 0 18 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.825 92.5-147.4 -69.1 -33.5 33.1 101.6 79.5 480 519 A G T <<5 + 0 0 73 -4,-1.2 2,-0.3 -3,-0.6 -3,-0.1 0.751 68.8 48.9 73.9 22.6 31.5 104.0 77.0 481 520 A G S S- 0 0 37 -2,-2.0 3,-1.1 -26,-0.1 -35,-0.0 -0.879 90.2 -87.3-147.0-178.2 42.5 100.7 75.6 485 524 A G T 3 S+ 0 0 2 -2,-0.3 -29,-3.4 1,-0.2 -28,-0.8 0.503 114.7 64.1 -76.7 -5.4 44.6 102.7 77.9 486 525 A G T 3 S+ 0 0 29 -38,-0.4 2,-0.5 -31,-0.2 -1,-0.2 0.478 74.5 103.0 -96.8 -5.7 43.4 106.1 76.5 487 526 A T S < S- 0 0 24 -3,-1.1 2,-0.1 -5,-0.2 -6,-0.1 -0.694 71.5-126.2 -84.1 123.4 39.8 105.9 77.6 488 527 A R - 0 0 96 -2,-0.5 -31,-0.1 1,-0.1 -2,-0.1 -0.412 19.8-125.0 -66.9 138.2 38.9 107.9 80.6 489 528 A L > - 0 0 5 -33,-0.4 3,-1.7 -2,-0.1 -1,-0.1 -0.313 34.0 -97.2 -73.7 162.8 37.1 106.2 83.5 490 529 A W T 3 S+ 0 0 64 1,-0.3 -1,-0.1 -2,-0.0 -2,-0.1 0.875 124.3 48.3 -50.9 -45.1 33.8 107.6 84.8 491 530 A W T 3 S+ 0 0 0 1,-0.1 2,-0.8 -290,-0.1 -291,-0.3 0.561 93.8 86.9 -76.7 -4.3 35.5 109.6 87.7 492 531 A D < + 0 0 9 -3,-1.7 -61,-0.1 1,-0.1 -1,-0.1 -0.845 45.1 164.4 -99.8 101.4 38.1 111.1 85.4 493 532 A T - 0 0 47 -2,-0.8 -1,-0.1 -62,-0.4 -62,-0.1 0.476 54.0-115.7 -94.9 -8.0 36.5 114.2 83.8 494 533 A G S S+ 0 0 41 -64,-0.3 2,-0.3 -63,-0.2 -2,-0.1 0.432 89.7 49.2 84.6 -3.4 39.8 115.6 82.6 495 534 A K S S- 0 0 132 -64,-0.1 2,-0.5 2,-0.0 -2,-0.3 -0.984 87.4-102.9-159.5 159.0 39.6 118.6 84.9 496 535 A N - 0 0 18 -2,-0.3 2,-0.6 -64,-0.2 -64,-0.1 -0.759 35.5-163.3 -86.5 123.8 39.0 119.6 88.5 497 536 A N 0 0 50 -2,-0.5 -2,-0.0 0, 0.0 -4,-0.0 -0.962 360.0 360.0-110.6 115.5 35.4 120.9 88.8 498 537 A F 0 0 104 -2,-0.6 -164,-0.1 -163,-0.0 -163,-0.1 -0.709 360.0 360.0 -97.0 360.0 34.7 122.9 92.0