==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 23-FEB-11 3QUF . COMPND 2 MOLECULE: EXTRACELLULAR SOLUTE-BINDING PROTEIN, FAMILY 1; . SOURCE 2 ORGANISM_SCIENTIFIC: BIFIDOBACTERIUM LONGUM SUBSP. INFANTIS . AUTHOR M.E.CUFF,X.XU,H.CUI,S.CHIN,A.SAVCHENKO,A.EDWARDS,A.JOACHIMIA . 775 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31518.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 525 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 8.5 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 . 2 0.3 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 . 34 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 256 33.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 26 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 2 1 5 2 0 3 0 2 4 5 4 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 5 0 0 0 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 PARALLEL BRIDGES PER LADDER . 7 4 0 8 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 . 2 0 4 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 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 36 A G 0 0 93 0, 0.0 285,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -27.2 20.6 -25.4 11.2 2 37 A G - 0 0 71 2,-0.1 2,-0.2 29,-0.0 28,-0.0 -0.107 360.0 -3.0 50.8-138.7 22.3 -28.4 13.2 3 38 A K - 0 0 148 28,-0.1 2,-0.5 26,-0.0 28,-0.2 -0.610 68.3-150.9 -80.5 148.5 25.2 -27.3 15.5 4 39 A T E -a 31 0A 17 26,-2.6 28,-2.5 -2,-0.2 2,-0.5 -0.986 3.3-148.3-124.2 123.5 26.3 -23.7 15.6 5 40 A K E +a 32 0A 134 -2,-0.5 2,-0.3 26,-0.2 28,-0.2 -0.805 24.3 169.8 -89.3 124.6 29.8 -22.7 16.3 6 41 A I E -a 33 0A 5 26,-2.9 28,-2.5 -2,-0.5 2,-0.3 -0.886 20.0-141.9-129.4 160.4 30.4 -19.4 18.1 7 42 A S E -a 34 0A 33 -2,-0.3 53,-1.8 26,-0.2 2,-0.4 -0.896 5.5-162.3-121.8 154.0 33.3 -17.6 19.8 8 43 A F E -ab 35 60A 1 26,-2.4 28,-2.5 -2,-0.3 2,-0.8 -0.989 5.8-161.7-136.2 116.8 33.7 -15.5 22.9 9 44 A Y E -ab 36 61A 5 51,-2.4 53,-0.6 -2,-0.4 2,-0.4 -0.933 29.5-155.2 -99.2 105.7 36.7 -13.3 23.4 10 45 A S E -a 37 0A 0 26,-3.3 28,-2.8 -2,-0.8 4,-0.1 -0.703 32.7-164.5 -98.5 128.3 36.4 -12.8 27.2 11 46 A Y S S+ 0 0 58 -2,-0.4 2,-0.3 26,-0.2 -1,-0.1 0.790 79.9 81.1 -65.1 -32.0 37.7 -9.9 29.4 12 47 A F S S- 0 0 0 1,-0.1 26,-0.2 2,-0.1 -2,-0.1 -0.565 83.5-124.2 -83.4 140.1 36.9 -12.2 32.3 13 48 A K >> - 0 0 91 -2,-0.3 4,-2.4 24,-0.1 3,-1.8 -0.306 30.3-102.4 -74.0 164.9 39.3 -14.9 33.3 14 49 A D H 3> S+ 0 0 82 1,-0.3 4,-2.2 2,-0.2 5,-0.4 0.851 121.8 61.4 -57.4 -33.7 38.3 -18.5 33.6 15 50 A N H 34 S+ 0 0 119 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.682 113.7 36.6 -71.3 -13.0 38.1 -18.2 37.4 16 51 A Q H <4 S+ 0 0 48 -3,-1.8 295,-0.3 295,-0.1 294,-0.2 0.775 136.0 14.4-100.1 -39.4 35.4 -15.5 36.9 17 52 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 293,-0.1 3,-0.4 0.500 94.8 96.7-118.4 -4.7 33.4 -16.8 33.9 18 53 A G H X S+ 0 0 1 -4,-2.2 4,-2.7 -5,-0.4 5,-0.2 0.845 85.5 51.0 -59.9 -40.2 34.4 -20.4 33.4 19 54 A E H > S+ 0 0 118 -5,-0.4 4,-2.6 2,-0.2 -1,-0.3 0.845 109.2 52.2 -66.2 -34.8 31.4 -21.9 35.4 20 55 A V H > S+ 0 0 0 -3,-0.4 4,-2.7 2,-0.2 -2,-0.2 0.954 111.5 46.6 -61.7 -49.7 29.0 -19.8 33.3 21 56 A V H X S+ 0 0 6 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.943 113.5 48.8 -56.7 -48.9 30.6 -21.1 30.1 22 57 A K H X S+ 0 0 121 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.922 112.4 47.8 -59.6 -46.9 30.5 -24.7 31.4 23 58 A G H X S+ 0 0 8 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.914 111.4 50.3 -62.5 -42.8 26.8 -24.4 32.5 24 59 A F H X S+ 0 0 0 -4,-2.7 4,-1.1 1,-0.2 3,-0.3 0.942 110.6 48.3 -60.6 -49.4 25.8 -22.9 29.2 25 60 A E H >< S+ 0 0 76 -4,-2.5 3,-0.6 1,-0.2 6,-0.2 0.903 109.2 54.0 -57.6 -44.4 27.5 -25.6 27.1 26 61 A K H 3< S+ 0 0 161 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.859 114.3 41.0 -57.3 -38.6 25.9 -28.3 29.2 27 62 A K H 3< S+ 0 0 104 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.536 112.9 54.0 -92.1 -5.9 22.4 -26.9 28.6 28 63 A N X< + 0 0 26 -4,-1.1 3,-1.7 -3,-0.6 -1,-0.2 -0.748 57.1 170.8-132.2 82.1 22.8 -26.0 24.9 29 64 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.691 76.1 59.9 -71.4 -20.6 23.9 -29.1 23.0 30 65 A D T 3 S+ 0 0 56 -27,-0.1 -26,-2.6 -28,-0.0 2,-0.5 0.335 95.7 75.6 -82.5 -5.9 23.4 -27.5 19.6 31 66 A I E < -a 4 0A 8 -3,-1.7 2,-0.6 -28,-0.2 -26,-0.2 -0.973 60.9-161.7-118.6 127.3 25.9 -24.7 20.4 32 67 A T E -a 5 0A 54 -28,-2.5 -26,-2.9 -2,-0.5 2,-0.5 -0.954 13.4-162.4-103.8 117.9 29.7 -25.0 20.4 33 68 A L E -a 6 0A 10 -2,-0.6 2,-0.6 -28,-0.2 -26,-0.2 -0.893 6.3-164.9-108.0 117.5 31.3 -22.1 22.3 34 69 A D E -a 7 0A 89 -28,-2.5 -26,-2.4 -2,-0.5 2,-0.5 -0.935 16.3-163.9 -99.5 115.1 35.1 -21.5 21.7 35 70 A V E -a 8 0A 22 -2,-0.6 2,-0.4 -28,-0.2 -26,-0.2 -0.893 13.5-173.9-109.5 129.5 36.3 -19.2 24.5 36 71 A Q E -a 9 0A 93 -28,-2.5 -26,-3.3 -2,-0.5 2,-0.4 -0.930 17.6-141.4-114.7 146.0 39.5 -17.2 24.6 37 72 A Y E -a 10 0A 81 -2,-0.4 -26,-0.2 -28,-0.2 -24,-0.1 -0.871 13.4-121.4-115.3 133.5 40.5 -15.2 27.7 38 73 A G - 0 0 6 -28,-2.8 6,-0.0 -2,-0.4 -28,-0.0 -0.425 12.0-146.3 -66.6 149.5 42.2 -11.8 27.9 39 74 A Q S S- 0 0 139 1,-0.4 -1,-0.1 -2,-0.1 -26,-0.0 0.840 76.3 -20.3 -86.1 -39.1 45.6 -11.7 29.6 40 75 A D S > S- 0 0 79 1,-0.0 4,-2.5 0, 0.0 -1,-0.4 -0.945 75.3 -93.4-164.7 162.4 45.1 -8.2 31.1 41 76 A P H > S+ 0 0 57 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.746 119.5 47.6 -58.2 -36.7 42.9 -5.2 30.3 42 77 A A H > S+ 0 0 67 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.897 116.0 45.2 -68.0 -42.3 45.3 -3.2 28.0 43 78 A Q H > S+ 0 0 44 -3,-0.2 4,-2.3 1,-0.2 5,-0.3 0.855 110.3 57.3 -69.1 -36.1 46.0 -6.3 26.1 44 79 A Y H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.3 0.948 107.6 44.8 -59.8 -51.7 42.3 -7.1 26.0 45 80 A I H X S+ 0 0 44 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.911 116.6 44.0 -67.0 -38.1 41.2 -3.9 24.4 46 81 A S H X S+ 0 0 65 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.906 116.6 46.5 -73.3 -37.0 43.9 -3.8 21.7 47 82 A T H X S+ 0 0 33 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.911 112.9 50.1 -71.3 -37.2 43.5 -7.5 20.9 48 83 A L H X S+ 0 0 0 -4,-3.0 4,-2.9 -5,-0.3 5,-0.2 0.936 108.4 52.8 -65.5 -42.5 39.7 -7.3 20.7 49 84 A Q H X S+ 0 0 128 -4,-2.2 4,-1.7 -5,-0.3 -1,-0.2 0.926 110.7 47.7 -61.2 -42.0 40.0 -4.2 18.4 50 85 A T H X S+ 0 0 103 -4,-1.9 4,-0.9 1,-0.2 -1,-0.2 0.925 113.0 47.8 -62.1 -44.7 42.2 -6.2 16.0 51 86 A R H >< S+ 0 0 95 -4,-2.4 3,-0.5 1,-0.2 5,-0.3 0.874 109.8 51.9 -67.3 -36.3 39.9 -9.2 16.1 52 87 A L H 3< S+ 0 0 16 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.821 112.0 48.5 -67.1 -30.0 36.8 -7.1 15.5 53 88 A A H 3< S+ 0 0 81 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.614 103.8 77.1 -81.2 -18.3 38.6 -5.5 12.5 54 89 A G S << S- 0 0 32 -4,-0.9 -3,-0.1 -3,-0.5 -4,-0.0 0.019 99.0 -86.4 -85.9-165.2 39.7 -8.9 11.0 55 90 A G S S+ 0 0 76 1,-0.2 -3,-0.1 2,-0.0 -4,-0.1 0.557 117.2 40.8 -83.1 -9.8 38.0 -11.6 9.0 56 91 A K S S- 0 0 187 -5,-0.3 -1,-0.2 227,-0.0 -3,-0.1 -0.610 74.5-171.1-137.1 68.4 36.7 -13.6 12.0 57 92 A P - 0 0 17 0, 0.0 -5,-0.2 0, 0.0 -50,-0.1 -0.348 36.6 -98.6 -65.5 150.3 35.4 -11.3 14.7 58 93 A P - 0 0 6 0, 0.0 222,-0.2 0, 0.0 -50,-0.1 -0.445 24.8-136.7 -62.3 138.3 34.5 -13.0 18.0 59 94 A T S S+ 0 0 6 -52,-0.2 221,-2.5 -2,-0.1 2,-0.4 0.845 89.9 27.6 -62.8 -39.1 30.7 -13.6 18.2 60 95 A I E S+bC 8 279A 0 -53,-1.8 -51,-2.4 219,-0.2 2,-0.3 -0.965 74.3 151.2-126.0 141.4 30.6 -12.4 21.8 61 96 A F E -bC 9 278A 0 217,-2.1 217,-2.8 -2,-0.4 2,-0.4 -0.945 37.6 -94.3-156.0 177.8 32.9 -9.9 23.5 62 97 A N E - C 0 277A 0 -53,-0.6 2,-0.7 -2,-0.3 215,-0.2 -0.857 11.2-148.8-113.3 139.3 33.0 -7.3 26.3 63 98 A L E - C 0 276A 0 213,-1.8 213,-2.4 -2,-0.4 2,-0.2 -0.919 31.4-173.3 -96.2 112.9 32.5 -3.6 26.4 64 99 A T >> - 0 0 3 -2,-0.7 4,-1.8 211,-0.2 3,-0.5 -0.522 40.9 -99.0-101.9 174.3 34.7 -2.4 29.2 65 100 A X T 34 S+ 0 0 33 1,-0.2 4,-0.2 -2,-0.2 -1,-0.1 0.785 123.7 48.3 -67.5 -18.9 35.1 1.0 30.7 66 101 A D T 34 S+ 0 0 70 1,-0.1 -1,-0.2 2,-0.1 4,-0.1 0.679 124.7 23.7 -93.2 -19.6 38.1 1.6 28.5 67 102 A N T <> S+ 0 0 9 -3,-0.5 4,-2.9 2,-0.1 5,-0.3 0.424 86.4 106.1-121.8 1.8 36.8 0.5 25.1 68 103 A R H X S+ 0 0 9 -4,-1.8 4,-2.3 1,-0.2 5,-0.2 0.895 89.0 35.8 -59.6 -46.2 33.0 0.9 25.3 69 104 A T H > S+ 0 0 24 2,-0.2 4,-2.9 -4,-0.2 5,-0.2 0.916 115.8 54.6 -76.1 -35.7 32.6 4.0 23.2 70 105 A D H > S+ 0 0 101 1,-0.2 4,-1.0 2,-0.2 -2,-0.2 0.928 113.5 42.9 -59.9 -45.9 35.4 3.0 20.7 71 106 A V H >X>S+ 0 0 10 -4,-2.9 5,-0.9 1,-0.2 3,-0.6 0.939 115.1 47.9 -65.8 -49.2 33.7 -0.3 20.0 72 107 A X H ><5S+ 0 0 4 -4,-2.3 3,-1.4 -5,-0.3 -2,-0.2 0.910 110.1 52.9 -58.7 -42.0 30.2 1.1 19.8 73 108 A K H 3<5S+ 0 0 64 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.749 102.0 61.8 -65.3 -27.3 31.4 3.9 17.4 74 109 A S H <<5S- 0 0 43 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.659 105.5-125.6 -71.5 -17.2 33.0 1.3 15.2 75 110 A G T <<5S+ 0 0 16 -3,-1.4 -3,-0.1 -4,-0.5 206,-0.1 0.421 75.4 122.4 79.6 5.8 29.7 -0.4 14.4 76 111 A A < + 0 0 17 -5,-0.9 205,-2.3 205,-0.1 206,-0.5 0.632 53.4 79.3 -74.6 -18.1 31.1 -3.8 15.5 77 112 A A B S-E 280 0B 4 -6,-0.4 203,-0.2 203,-0.2 2,-0.2 -0.796 82.5-119.7 -96.3 137.3 28.4 -4.4 18.2 78 113 A L - 0 0 21 201,-3.4 2,-0.6 -2,-0.4 201,-0.3 -0.481 27.1-113.5 -69.3 134.5 24.9 -5.6 17.4 79 114 A D + 0 0 59 -2,-0.2 25,-0.2 1,-0.2 -1,-0.1 -0.643 37.6 175.7 -66.9 112.4 22.0 -3.4 18.3 80 115 A I > + 0 0 1 23,-2.9 3,-2.1 -2,-0.6 24,-0.2 0.165 20.6 149.8-108.3 17.2 20.3 -5.5 21.0 81 116 A S T 3 + 0 0 39 22,-0.7 21,-0.1 1,-0.3 -2,-0.0 -0.188 69.9 8.3 -50.9 134.0 17.6 -2.9 21.8 82 117 A G T 3 S+ 0 0 73 1,-0.2 -1,-0.3 2,-0.1 2,-0.1 0.456 85.5 153.4 79.2 -2.0 14.3 -4.4 23.0 83 118 A E X - 0 0 56 -3,-2.1 3,-1.7 1,-0.1 -1,-0.2 -0.382 49.7-130.4 -66.0 142.0 15.6 -8.0 23.3 84 119 A D G > S+ 0 0 125 1,-0.3 3,-1.8 2,-0.2 -1,-0.1 0.789 102.8 70.3 -63.8 -27.6 13.8 -10.1 25.8 85 120 A F G 3 S+ 0 0 15 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.629 88.7 65.4 -67.7 -9.5 17.0 -11.2 27.4 86 121 A L G X S+ 0 0 17 -3,-1.7 3,-1.4 -6,-0.1 -1,-0.3 0.585 75.6 117.8 -80.8 -12.0 17.5 -7.7 28.8 87 122 A D T < + 0 0 101 -3,-1.8 3,-0.1 1,-0.2 -3,-0.0 -0.247 66.0 33.6 -65.8 141.6 14.4 -8.0 31.0 88 123 A G T 3 S+ 0 0 27 1,-0.2 230,-2.3 229,-0.1 2,-0.5 0.253 92.0 102.1 103.1 -12.4 15.0 -7.7 34.8 89 124 A I B < S-F 317 0C 6 -3,-1.4 -1,-0.2 228,-0.2 228,-0.2 -0.917 80.7-112.1-107.1 124.1 17.9 -5.2 34.5 90 125 A D > - 0 0 76 226,-0.7 3,-2.0 -2,-0.5 4,-0.2 -0.206 22.8-121.4 -61.3 143.0 16.9 -1.6 35.3 91 126 A D G > S+ 0 0 106 1,-0.3 3,-1.9 2,-0.2 4,-0.3 0.794 107.0 67.5 -58.3 -30.6 17.1 0.7 32.3 92 127 A T G > S+ 0 0 43 1,-0.3 3,-1.0 2,-0.2 4,-0.3 0.772 89.3 67.8 -61.0 -23.5 19.6 3.1 33.9 93 128 A N G < S+ 0 0 14 -3,-2.0 -1,-0.3 1,-0.2 3,-0.2 0.592 93.7 58.1 -71.9 -10.9 22.2 0.3 33.7 94 129 A F G X S+ 0 0 6 -3,-1.9 3,-1.9 -4,-0.2 -1,-0.2 0.556 76.4 91.7 -95.6 -7.5 22.2 0.5 29.9 95 130 A A G X S+ 0 0 29 -3,-1.0 3,-1.2 -4,-0.3 -1,-0.2 0.874 86.3 50.8 -58.0 -40.1 23.3 4.1 29.6 96 131 A L G 3 S+ 0 0 17 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.591 113.2 47.9 -70.9 -10.5 27.0 3.3 29.5 97 132 A F G < S+ 0 0 0 -3,-1.9 7,-3.2 8,-0.1 8,-0.8 -0.044 96.0 96.4-121.4 29.8 26.2 0.7 26.7 98 133 A Q E < +G 103 0D 39 -3,-1.2 2,-0.3 5,-0.2 5,-0.2 -0.914 41.6 176.5-121.9 149.1 24.1 2.9 24.5 99 134 A Q E > S-G 102 0D 19 3,-2.2 3,-2.3 -2,-0.3 640,-0.1 -0.973 75.8 -2.2-149.5 131.0 24.8 5.1 21.4 100 135 A D T 3 S- 0 0 21 -2,-0.3 639,-0.2 1,-0.3 3,-0.1 0.796 129.7 -60.0 56.4 31.3 22.3 7.0 19.4 101 136 A G T 3 S+ 0 0 16 1,-0.3 2,-0.3 -6,-0.1 -1,-0.3 0.438 113.2 115.6 80.3 -0.3 19.5 5.7 21.7 102 137 A K E < -G 99 0D 36 -3,-2.3 -3,-2.2 -21,-0.1 2,-0.5 -0.808 65.4-123.6-104.2 144.8 20.3 2.0 20.8 103 138 A T E +G 98 0D 12 -2,-0.3 -23,-2.9 -5,-0.2 -22,-0.7 -0.800 31.2 168.3 -90.1 128.6 21.6 -0.6 23.2 104 139 A Y + 0 0 11 -7,-3.2 175,-0.3 -2,-0.5 2,-0.3 0.361 62.0 28.3-119.4 -2.2 24.8 -2.3 22.3 105 140 A G - 0 0 0 -8,-0.8 173,-0.2 -11,-0.1 -1,-0.2 -0.992 60.1-141.4-158.7 159.3 25.7 -4.2 25.5 106 141 A X B -D 277 0A 0 171,-2.2 171,-2.2 -2,-0.3 2,-0.3 -0.975 9.5-160.2-129.7 118.2 24.3 -5.8 28.6 107 142 A P + 0 0 0 0, 0.0 169,-0.2 0, 0.0 168,-0.1 -0.717 11.4 176.1 -86.8 145.6 25.8 -5.6 32.0 108 143 A V + 0 0 0 167,-0.4 208,-2.5 -2,-0.3 209,-0.5 0.437 61.9 38.3-122.3 -3.1 24.7 -8.2 34.5 109 144 A S E -H 315 0E 0 166,-0.4 165,-2.8 206,-0.3 2,-0.3 -0.940 58.2-168.7-150.2 163.0 26.8 -7.4 37.5 110 145 A A E -HI 314 273E 0 204,-2.1 204,-2.9 163,-0.3 2,-0.3 -0.965 15.4-134.4-151.1 158.4 28.3 -4.5 39.5 111 146 A W E - I 0 272E 65 161,-2.1 161,-1.6 -2,-0.3 2,-0.3 -0.829 21.7-159.9-110.2 161.2 30.8 -3.5 42.1 112 147 A V E - I 0 271E 6 -2,-0.3 2,-0.3 159,-0.2 159,-0.3 -0.940 8.6-169.7-138.7 157.8 30.2 -1.1 45.0 113 148 A G E + I 0 270E 2 157,-2.2 157,-2.6 -2,-0.3 126,-0.2 -0.987 15.8 153.2-143.7 155.9 32.1 1.1 47.4 114 149 A A E -K 238 0F 5 124,-2.5 124,-2.6 -2,-0.3 2,-0.5 -0.858 46.9 -61.2-163.6-174.7 31.2 3.1 50.5 115 150 A F E -KL 237 256F 0 141,-2.6 141,-2.8 -2,-0.2 2,-0.5 -0.786 37.7-163.2 -91.7 128.5 32.5 4.5 53.8 116 151 A F E -KL 236 255F 0 120,-3.4 120,-2.6 -2,-0.5 2,-0.3 -0.930 17.5-169.2-106.3 131.4 33.7 2.0 56.4 117 152 A Y E -KL 235 254F 33 137,-2.5 137,-2.2 -2,-0.5 2,-0.8 -0.940 28.9-122.6-132.1 151.2 33.9 3.5 59.9 118 153 A N E > - L 0 253F 7 116,-2.6 4,-2.4 -2,-0.3 135,-0.2 -0.801 21.6-158.3 -90.6 105.7 35.3 2.7 63.3 119 154 A K H > S+ 0 0 93 133,-2.5 4,-2.5 -2,-0.8 -1,-0.2 0.824 88.9 54.1 -57.5 -32.6 32.3 2.8 65.7 120 155 A D H > S+ 0 0 100 132,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.905 108.1 47.6 -71.4 -43.0 34.5 3.4 68.8 121 156 A I H > S+ 0 0 18 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.933 114.4 47.9 -62.2 -45.1 36.3 6.4 67.3 122 157 A L H <>S+ 0 0 2 -4,-2.4 5,-2.6 1,-0.2 3,-0.4 0.923 109.9 52.1 -61.8 -43.4 32.9 7.9 66.3 123 158 A K H ><5S+ 0 0 81 -4,-2.5 3,-2.2 1,-0.2 -1,-0.2 0.922 104.9 55.4 -59.9 -43.0 31.4 7.2 69.7 124 159 A K H 3<5S+ 0 0 153 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.844 107.9 50.2 -57.8 -34.2 34.3 9.0 71.4 125 160 A A T 3<5S- 0 0 14 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.371 128.8 -99.6 -85.7 5.0 33.5 12.0 69.2 126 161 A G T < 5S+ 0 0 69 -3,-2.2 2,-0.6 1,-0.2 -3,-0.2 0.589 82.2 126.8 90.0 13.3 29.8 11.9 70.2 127 162 A Y < + 0 0 40 -5,-2.6 -1,-0.2 -6,-0.1 -2,-0.2 -0.919 25.9 168.1-110.3 120.0 28.4 10.0 67.1 128 163 A D S S+ 0 0 142 -2,-0.6 2,-0.3 -5,-0.1 -1,-0.1 0.494 78.5 39.6 -96.1 -10.6 26.3 6.9 67.5 129 164 A K S S- 0 0 126 -7,-0.1 -1,-0.1 -6,-0.0 3,-0.1 -0.950 94.7 -98.9-136.4 154.7 25.3 7.2 63.8 130 165 A F - 0 0 21 -2,-0.3 7,-0.1 1,-0.1 -2,-0.0 -0.549 49.7 -93.3 -77.8 139.5 27.2 8.1 60.7 131 166 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 6,-0.0 -0.188 27.2-156.3 -49.9 134.7 26.8 11.7 59.4 132 167 A K S S+ 0 0 81 127,-0.1 128,-2.9 -3,-0.1 2,-0.3 0.765 73.4 41.8 -84.7 -30.4 24.1 12.1 56.8 133 168 A T B > S-n 260 0G 13 126,-0.3 4,-2.0 1,-0.1 128,-0.2 -0.847 81.1-118.4-121.5 157.3 25.4 15.3 55.1 134 169 A W H > S+ 0 0 0 126,-3.1 4,-2.3 -2,-0.3 5,-0.2 0.873 114.7 55.7 -58.4 -40.1 28.9 16.4 54.1 135 170 A D H > S+ 0 0 83 125,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.926 109.5 47.6 -60.6 -41.5 28.7 19.5 56.4 136 171 A E H > S+ 0 0 71 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.852 109.0 54.8 -66.3 -35.5 28.0 17.0 59.3 137 172 A F H X S+ 0 0 1 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.891 107.6 49.0 -62.6 -39.8 30.9 14.9 58.1 138 173 A I H X S+ 0 0 12 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.942 112.0 48.6 -66.0 -45.2 33.3 17.9 58.3 139 174 A E H X S+ 0 0 95 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.910 112.9 48.2 -62.1 -40.7 32.0 18.6 61.8 140 175 A X H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.904 110.5 51.9 -64.0 -42.1 32.5 15.0 62.8 141 176 A G H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 10,-0.2 0.868 105.5 53.8 -62.3 -42.3 36.0 14.9 61.3 142 177 A K H X S+ 0 0 84 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.900 110.1 48.5 -62.6 -40.8 37.1 18.0 63.2 143 178 A K H X S+ 0 0 92 -4,-1.5 4,-0.9 1,-0.2 -1,-0.2 0.869 110.8 49.4 -66.2 -42.6 36.1 16.5 66.5 144 179 A I H ><>S+ 0 0 1 -4,-2.0 5,-1.2 1,-0.2 3,-0.8 0.899 109.5 51.8 -63.0 -39.9 37.9 13.2 65.8 145 180 A N H ><5S+ 0 0 52 -4,-2.4 3,-1.4 1,-0.3 -2,-0.2 0.876 100.5 63.6 -68.9 -33.5 41.1 15.0 64.8 146 181 A S H 3<5S+ 0 0 98 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.797 96.4 59.6 -51.0 -38.8 40.9 16.9 68.1 147 182 A N T <<5S- 0 0 75 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.023 121.2-103.2 -87.5 27.9 41.3 13.6 69.9 148 183 A G T < 5S+ 0 0 78 -3,-1.4 2,-0.2 1,-0.2 -3,-0.2 0.489 91.0 114.6 68.7 1.1 44.7 12.7 68.4 149 184 A S S - 0 0 0 1,-0.1 4,-2.2 196,-0.1 5,-0.1 -0.279 28.0-142.7 -59.4 131.9 38.7 10.0 44.9 162 197 A G H > S+ 0 0 1 -7,-0.3 4,-2.4 2,-0.2 5,-0.2 0.866 100.7 54.0 -62.6 -38.0 35.8 7.8 46.0 163 198 A S H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.915 109.5 47.5 -63.8 -43.7 34.6 10.4 48.5 164 199 A F H > S+ 0 0 1 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.923 111.0 51.4 -60.4 -45.1 34.5 13.1 45.9 165 200 A T H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.907 109.2 50.9 -62.5 -40.2 32.7 10.8 43.5 166 201 A G H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.879 112.1 46.7 -61.8 -38.3 30.1 10.1 46.2 167 202 A L H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 94,-0.2 0.912 112.7 49.1 -71.2 -41.5 29.6 13.8 46.8 168 203 A L H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 5,-0.2 0.905 108.0 54.7 -58.6 -43.9 29.3 14.4 43.0 169 204 A A H X S+ 0 0 0 -4,-2.8 4,-3.2 1,-0.2 -2,-0.2 0.910 110.5 46.3 -61.4 -42.2 26.8 11.6 42.7 170 205 A S H X S+ 0 0 0 -4,-1.9 4,-3.0 2,-0.2 5,-0.2 0.904 105.6 59.2 -66.4 -45.5 24.7 13.3 45.4 171 206 A Y H < S+ 0 0 31 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.899 117.5 33.3 -47.2 -44.5 25.0 16.7 43.8 172 207 A Y H ><>S+ 0 0 0 -4,-2.0 5,-1.8 2,-0.2 3,-1.1 0.885 116.4 53.8 -79.3 -43.2 23.4 15.3 40.7 173 208 A G H ><5S+ 0 0 18 -4,-3.2 3,-2.1 1,-0.3 -2,-0.2 0.851 101.1 60.5 -66.2 -33.7 21.1 12.8 42.4 174 209 A E T 3<5S+ 0 0 20 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.744 101.4 55.7 -65.2 -24.3 19.5 15.5 44.6 175 210 A Q T < 5S- 0 0 109 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.323 129.0 -98.1 -83.3 0.3 18.5 17.2 41.3 176 211 A G T < 5S+ 0 0 53 -3,-2.1 -3,-0.2 1,-0.3 -2,-0.1 0.458 75.3 145.8 94.5 5.4 16.6 14.0 40.2 177 212 A K < + 0 0 19 -5,-1.8 -1,-0.3 -8,-0.1 2,-0.3 -0.386 20.1 174.4 -76.1 152.5 19.4 12.7 37.9 178 213 A S + 0 0 37 2,-0.1 2,-0.3 -2,-0.1 162,-0.1 -0.916 44.9 14.4-147.1 167.4 20.0 8.9 37.5 179 214 A G S S+ 0 0 23 160,-0.4 2,-1.5 -2,-0.3 3,-0.1 -0.453 124.7 21.3 71.1-124.6 22.2 6.6 35.5 180 215 A D S > S- 0 0 26 -2,-0.3 3,-1.9 1,-0.2 -2,-0.1 -0.637 76.3-175.0 -81.7 87.2 25.1 8.4 33.7 181 216 A L T 3 S+ 0 0 2 -2,-1.5 3,-0.5 1,-0.3 -1,-0.2 0.787 75.6 54.3 -63.3 -31.3 25.0 11.4 36.1 182 217 A D T >> S+ 0 0 0 1,-0.2 4,-1.8 -3,-0.1 3,-1.3 0.278 71.4 117.9 -85.2 12.5 27.7 13.4 34.2 183 218 A A H <> + 0 0 8 -3,-1.9 4,-2.6 1,-0.3 6,-0.3 0.736 65.2 63.1 -57.8 -29.1 25.8 13.2 30.8 184 219 A D H 34>S+ 0 0 15 -3,-0.5 6,-1.8 2,-0.2 5,-1.5 0.893 108.6 44.4 -60.2 -40.3 25.3 17.0 30.5 185 220 A I H X45S+ 0 0 3 -3,-1.3 3,-1.4 4,-0.2 -2,-0.2 0.948 112.9 49.8 -66.5 -46.7 29.1 17.3 30.4 186 221 A W H 3<5S+ 0 0 35 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.886 113.3 46.6 -62.5 -35.8 29.4 14.4 27.9 187 222 A S T 3<5S- 0 0 54 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.486 114.2-114.9 -86.9 -2.9 26.8 15.8 25.6 188 223 A G T < 5S+ 0 0 62 -3,-1.4 -3,-0.2 -4,-0.4 -4,-0.1 0.465 86.4 115.7 84.3 4.2 28.2 19.4 25.7 189 224 A K S - 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0 0 158 -2,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.639 44.1-127.3 -70.3 123.0 21.9 -12.1 50.5 324 359 A P - 0 0 23 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.429 26.9 -92.9 -74.1 154.1 24.3 -9.4 51.4 325 360 A P > - 0 0 61 0, 0.0 3,-2.0 0, 0.0 4,-0.4 -0.366 43.7-110.9 -52.0 140.7 26.7 -9.7 54.4 326 361 A A G > S+ 0 0 85 1,-0.3 3,-1.4 2,-0.2 4,-0.4 0.823 117.1 56.5 -44.7 -44.1 25.0 -8.1 57.4 327 362 A E G 3 S+ 0 0 63 1,-0.3 -72,-0.3 2,-0.1 -1,-0.3 0.759 111.7 43.3 -65.4 -25.3 27.4 -5.1 57.5 328 363 A L G <> S+ 0 0 9 -3,-2.0 4,-2.8 1,-0.1 5,-0.3 0.330 81.8 103.8-100.4 5.2 26.5 -4.2 53.9 329 364 A K H <> S+ 0 0 101 -3,-1.4 4,-3.3 -4,-0.4 5,-0.4 0.924 83.1 45.1 -59.1 -47.7 22.7 -4.7 54.2 330 365 A D H > S+ 0 0 67 -4,-0.4 4,-2.8 2,-0.2 5,-0.5 0.947 115.3 46.6 -56.2 -54.5 21.9 -0.9 54.3 331 366 A V H >>S+ 0 0 3 -4,-0.3 5,-2.6 -76,-0.2 4,-0.9 0.906 119.4 40.8 -62.0 -38.5 24.3 -0.0 51.4 332 367 A V H <>S+ 0 0 11 -4,-2.8 5,-3.1 3,-0.2 6,-0.3 0.969 122.7 36.2 -73.1 -53.3 23.0 -2.9 49.3 333 368 A D H <5S+ 0 0 44 -4,-3.3 -3,-0.2 -5,-0.3 -2,-0.2 0.865 127.3 33.4 -70.6 -36.5 19.3 -2.7 50.0 334 369 A N H <5S+ 0 0 84 -4,-2.8 -1,-0.2 -5,-0.4 -3,-0.2 0.556 134.9 16.7-101.4 -9.8 18.9 1.1 50.3 335 370 A Y T <>S+ 0 0 28 -4,-0.9 5,-2.9 -5,-0.5 3,-0.3 0.640 125.7 41.4-125.6 -61.1 21.4 2.3 47.8 336 371 A F T > - 0 0 57 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 0.803 65.6-177.2 37.0 61.6 40.2 9.0 26.8 350 385 A P H > S+ 0 0 24 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.861 77.6 51.7 -64.3 -33.0 39.5 7.7 30.3 351 386 A T H > S+ 0 0 98 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.927 110.6 48.6 -66.6 -41.1 43.1 7.2 31.2 352 387 A V H > S+ 0 0 60 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.904 115.4 44.1 -61.6 -45.6 43.9 10.8 30.2 353 388 A X H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.898 111.8 51.1 -73.1 -38.7 41.0 12.2 32.1 354 389 A S H X S+ 0 0 34 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.924 109.6 52.2 -62.3 -43.6 41.6 10.1 35.3 355 390 A T H X S+ 0 0 88 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.912 111.7 45.5 -58.1 -45.6 45.2 11.2 35.3 356 391 A E H X S+ 0 0 39 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.921 113.4 49.7 -65.4 -41.4 44.2 14.9 35.1 357 392 A G H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.889 110.4 50.4 -65.3 -39.5 41.5 14.5 37.8 358 393 A I H X S+ 0 0 22 -4,-2.8 4,-2.1 2,-0.2 5,-0.2 0.938 111.1 49.3 -60.8 -48.7 44.0 12.7 40.1 359 394 A A H X S+ 0 0 29 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.939 114.2 45.3 -57.1 -44.2 46.5 15.6 39.6 360 395 A Q H X S+ 0 0 10 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.899 109.9 52.6 -70.8 -39.7 43.9 18.2 40.3 361 396 A Q H X S+ 0 0 3 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.908 109.1 50.5 -66.0 -38.5 42.4 16.5 43.4 362 397 A Q H X S+ 0 0 45 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.929 109.8 50.5 -62.6 -42.5 45.8 16.2 45.0 363 398 A K H <>S+ 0 0 77 -4,-1.8 5,-2.5 1,-0.2 6,-1.0 0.855 109.6 51.4 -64.3 -35.5 46.5 20.0 44.3 364 399 A I H ><5S+ 0 0 1 -4,-2.2 3,-1.8 4,-0.2 -1,-0.2 0.951 109.4 49.0 -64.3 -46.5 43.2 20.9 45.9 365 400 A V H 3<5S+ 0 0 4 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.911 110.5 52.3 -61.4 -39.4 44.0 18.8 49.0 366 401 A Q T 3<5S- 0 0 79 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.322 113.8-117.2 -79.9 8.0 47.4 20.5 49.2 367 402 A G T < 5S+ 0 0 42 -3,-1.8 -3,-0.2 2,-0.1 -2,-0.1 0.705 81.7 119.5 67.5 20.4 45.8 24.0 49.1 368 403 A Q S - 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A 0 643N 8 116,-2.7 4,-2.2 -2,-0.3 3,-0.3 -0.764 22.2-159.3 -88.3 106.9 41.5 37.5 10.8 509 154 B K H > S+ 0 0 73 133,-2.4 4,-2.7 -2,-0.8 -1,-0.2 0.837 88.8 54.0 -58.8 -34.7 41.1 40.7 8.7 510 155 B D H > S+ 0 0 88 132,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.900 109.2 46.7 -70.5 -36.7 44.7 41.8 9.4 511 156 B I H > S+ 0 0 21 -3,-0.3 4,-1.2 2,-0.2 -2,-0.2 0.912 114.5 48.3 -69.0 -42.3 46.2 38.5 8.2 512 157 B L H ><>S+ 0 0 2 -4,-2.2 5,-2.7 1,-0.2 3,-0.6 0.950 110.4 51.0 -61.4 -46.5 44.0 38.5 5.1 513 158 B K H ><5S+ 0 0 92 -4,-2.7 3,-1.7 1,-0.3 -2,-0.2 0.892 106.2 54.6 -61.2 -39.0 44.9 42.2 4.3 514 159 B K H 3<5S+ 0 0 169 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.812 107.5 51.6 -62.8 -29.3 48.7 41.4 4.6 515 160 B A T <<5S- 0 0 2 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.361 129.2-100.3 -87.2 3.6 48.1 38.6 2.0 516 161 B G T < 5S+ 0 0 56 -3,-1.7 2,-0.6 1,-0.2 -3,-0.2 0.669 81.7 129.6 88.1 17.7 46.3 41.2 -0.3 517 162 B Y < + 0 0 50 -5,-2.7 -1,-0.2 -6,-0.1 -2,-0.2 -0.928 23.9 166.3-111.7 115.6 42.7 40.3 0.5 518 163 B D S S+ 0 0 131 -2,-0.6 2,-0.3 -3,-0.1 -1,-0.1 0.560 76.3 40.0 -94.0 -12.6 40.2 43.0 1.5 519 164 B K S S- 0 0 156 -7,-0.1 3,-0.1 -6,-0.0 -1,-0.0 -0.922 93.7-101.5-132.0 156.6 37.2 40.6 1.0 520 165 B F - 0 0 21 -2,-0.3 7,-0.1 125,-0.1 -2,-0.0 -0.648 48.3 -96.7 -81.5 138.3 36.8 36.9 1.8 521 166 B P - 0 0 11 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.153 26.4-155.2 -53.4 139.8 37.1 34.5 -1.1 522 167 B K S S+ 0 0 91 127,-0.1 128,-2.9 -3,-0.1 2,-0.3 0.771 72.0 43.9 -88.4 -32.0 33.8 33.5 -2.8 523 168 B T B > S-c 650 0O 9 126,-0.3 4,-2.2 1,-0.1 128,-0.2 -0.797 81.2-117.7-116.8 158.7 34.9 30.1 -4.3 524 169 B W H > S+ 0 0 1 126,-2.9 4,-2.3 -2,-0.3 5,-0.2 0.900 116.3 55.3 -59.2 -40.2 36.9 27.1 -3.0 525 170 B D H > S+ 0 0 85 125,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.926 110.1 46.0 -60.7 -41.8 39.5 27.7 -5.7 526 171 B E H > S+ 0 0 51 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.837 108.2 56.6 -66.5 -35.6 39.9 31.3 -4.5 527 172 B F H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.908 107.1 49.8 -60.4 -40.0 40.1 30.1 -0.9 528 173 B I H X S+ 0 0 15 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.929 109.7 50.2 -65.1 -44.2 43.0 27.9 -1.9 529 174 B E H X S+ 0 0 108 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.932 112.7 47.7 -59.4 -48.8 44.7 30.8 -3.7 530 175 B X H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.920 111.0 50.5 -53.9 -50.4 44.3 32.9 -0.5 531 176 B G H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 10,-0.2 0.882 106.9 53.8 -60.2 -41.2 45.5 30.2 1.8 532 177 B K H X S+ 0 0 108 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.905 110.4 48.3 -60.8 -39.5 48.7 29.7 -0.3 533 178 B K H X S+ 0 0 109 -4,-1.7 4,-0.7 2,-0.2 -2,-0.2 0.926 111.2 48.7 -67.9 -46.2 49.4 33.4 -0.0 534 179 B I H ><>S+ 0 0 0 -4,-2.5 5,-1.6 1,-0.2 3,-0.9 0.919 111.9 49.5 -60.2 -40.8 48.9 33.5 3.7 535 180 B N H ><5S+ 0 0 52 -4,-2.5 3,-1.1 1,-0.3 -1,-0.2 0.849 108.6 52.0 -71.0 -31.7 51.1 30.5 4.2 536 181 B S H 3<5S+ 0 0 106 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.578 101.6 64.3 -77.0 -10.8 53.9 32.0 2.0 537 182 B N T <<5S- 0 0 77 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.301 122.5-102.7 -87.8 1.5 53.6 35.1 4.3 538 183 B G T < 5S+ 0 0 77 -3,-1.1 -3,-0.2 1,-0.3 2,-0.1 0.565 91.4 99.1 89.4 8.1 54.8 33.2 7.3 539 184 B S S - 0 0 0 -5,-0.2 4,-2.3 1,-0.1 5,-0.1 -0.378 22.4-140.7 -63.5 137.7 34.4 18.9 8.9 552 197 B G H > S+ 0 0 0 -7,-0.4 4,-2.4 2,-0.2 5,-0.1 0.873 103.8 51.4 -64.2 -37.5 32.4 22.1 8.7 553 198 B S H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.907 110.0 49.1 -67.0 -43.5 34.3 23.2 5.7 554 199 B F H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.927 111.0 51.1 -57.4 -44.4 33.7 19.9 3.9 555 200 B T H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.907 109.2 50.1 -65.6 -38.4 30.0 20.2 4.8 556 201 B G H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.897 111.6 48.0 -63.0 -38.4 29.9 23.7 3.4 557 202 B L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.914 113.2 48.3 -68.9 -40.0 31.5 22.6 0.2 558 203 B L H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 5,-0.2 0.913 109.2 53.4 -64.6 -43.9 29.1 19.6 -0.1 559 204 B A H X S+ 0 0 0 -4,-2.7 4,-3.2 -5,-0.2 -1,-0.2 0.910 110.9 46.3 -59.3 -42.6 26.1 21.9 0.6 560 205 B S H X S+ 0 0 0 -4,-1.9 4,-3.1 2,-0.2 5,-0.2 0.908 105.5 59.8 -66.5 -43.7 27.2 24.1 -2.3 561 206 B Y H < S+ 0 0 34 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.895 117.0 33.7 -49.7 -42.1 27.8 21.1 -4.6 562 207 B Y H ><>S+ 0 0 6 -4,-2.0 5,-1.7 2,-0.1 3,-1.3 0.881 117.6 52.0 -80.2 -43.9 24.2 20.3 -4.1 563 208 B G H ><5S+ 0 0 16 -4,-3.2 3,-2.2 1,-0.3 -3,-0.2 0.848 99.9 63.1 -63.8 -33.8 22.8 23.9 -3.8 564 209 B E T 3<5S+ 0 0 27 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.1 0.676 100.3 55.5 -64.3 -20.2 24.5 25.0 -7.0 565 210 B Q T < 5S- 0 0 105 -3,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.289 127.4-101.8 -88.2 4.0 22.2 22.4 -8.7 566 211 B G T < 5S+ 0 0 69 -3,-2.2 -3,-0.2 1,-0.2 -2,-0.2 0.589 74.0 146.3 85.6 10.9 19.2 24.1 -7.2 567 212 B K < + 0 0 79 -5,-1.7 2,-0.3 2,-0.0 -1,-0.2 -0.447 20.9 177.2 -84.8 155.5 18.7 21.5 -4.4 568 213 B S + 0 0 75 2,-0.1 2,-0.4 -2,-0.1 162,-0.1 -0.941 39.5 22.9-149.5 166.9 17.3 22.3 -1.0 569 214 B G S S+ 0 0 22 160,-0.4 2,-1.5 -2,-0.3 3,-0.1 -0.594 121.1 14.3 82.0-129.2 16.3 20.8 2.4 570 215 B D S > S- 0 0 22 -2,-0.4 3,-2.2 1,-0.2 4,-0.2 -0.710 76.6-170.0 -83.6 88.8 17.9 17.5 3.2 571 216 B L T 3 S+ 0 0 9 -2,-1.5 3,-0.4 1,-0.3 -1,-0.2 0.788 80.3 53.5 -60.2 -29.6 20.5 17.8 0.5 572 217 B D T >> S+ 0 0 0 1,-0.2 4,-1.8 -3,-0.1 3,-1.4 0.199 72.9 121.2 -87.5 14.5 21.6 14.2 0.9 573 218 B A H <> + 0 0 44 -3,-2.2 4,-2.1 1,-0.3 6,-0.2 0.814 69.1 55.7 -47.3 -40.9 18.0 12.8 0.5 574 219 B D H 3>>S+ 0 0 53 -3,-0.4 6,-2.3 2,-0.2 5,-0.8 0.813 106.2 50.6 -71.2 -25.8 18.9 10.7 -2.6 575 220 B I H X45S+ 0 0 5 -3,-1.4 3,-0.8 4,-0.2 -1,-0.2 0.944 110.8 49.8 -71.3 -44.8 21.7 8.9 -0.7 576 221 B W H 3<5S+ 0 0 41 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.880 113.8 44.8 -59.9 -39.2 19.2 8.1 2.2 577 222 B S H 3<5S- 0 0 86 -4,-2.1 -1,-0.3 1,-0.0 -2,-0.2 0.614 113.6-115.8 -80.4 -14.4 16.6 6.8 -0.2 578 223 B G T <<5S+ 0 0 60 -3,-0.8 -3,-0.2 -4,-0.7 -4,-0.1 0.385 85.6 116.1 91.1 -1.8 19.1 4.7 -2.2 579 224 B K S - 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0 0 25 -5,-0.8 2,-0.4 -6,-0.2 -1,-0.2 -0.488 63.8-103.3-108.4 176.0 19.4 29.5 19.1 704 349 B L E -W 500 0M 25 -204,-2.9 -204,-1.6 -2,-0.2 2,-0.2 -0.845 35.6-110.8-101.2 140.9 18.0 31.2 16.0 705 350 B S E -W 499 0M 8 -2,-0.4 7,-0.3 -206,-0.2 -206,-0.3 -0.452 16.6-163.8 -70.6 136.4 14.3 31.3 15.0 706 351 B L + 0 0 15 -208,-2.5 -226,-0.7 -2,-0.2 2,-0.4 0.343 68.0 85.0 -90.5 0.7 13.2 29.2 12.0 707 352 B S B > S-U 479 0K 5 -209,-0.5 3,-1.8 3,-0.3 -228,-0.2 -0.892 72.6-141.5-116.6 138.1 9.8 31.1 11.9 708 353 B S T 3 S+ 0 0 83 -230,-2.2 3,-0.2 -2,-0.4 -230,-0.1 0.626 96.7 80.0 -67.2 -11.8 8.9 34.4 10.3 709 354 B K T 3 S+ 0 0 80 1,-0.2 2,-0.3 -232,-0.2 -1,-0.3 0.698 106.8 23.1 -68.9 -15.7 6.7 35.0 13.4 710 355 B Y S < S- 0 0 23 -3,-1.8 2,-0.4 -232,-0.1 -3,-0.3 -0.897 79.9-143.4-152.3 115.9 9.9 36.0 15.3 711 356 B N - 0 0 104 -2,-0.3 -5,-0.1 -3,-0.2 -3,-0.1 -0.651 25.4-114.2 -83.1 136.4 13.0 37.3 13.7 712 357 B A - 0 0 21 -2,-0.4 -8,-0.1 -7,-0.3 -1,-0.1 -0.305 18.4-143.0 -61.6 149.4 16.4 36.4 15.1 713 358 B E + 0 0 152 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.601 30.1 173.8-116.5 65.2 18.4 39.2 16.6 714 359 B P - 0 0 20 0, 0.0 5,-0.1 0, 0.0 -10,-0.0 -0.350 33.5-101.1 -72.4 155.3 22.0 38.4 15.8 715 360 B P >> - 0 0 55 0, 0.0 3,-1.5 0, 0.0 4,-1.0 -0.171 39.4 -95.3 -69.4 170.5 24.9 40.7 16.4 716 361 B A H >> S+ 0 0 83 1,-0.3 3,-0.7 2,-0.2 4,-0.6 0.830 122.1 57.5 -55.9 -41.2 26.6 42.9 13.8 717 362 B E H 34 S+ 0 0 66 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.744 115.6 35.1 -66.3 -27.6 29.3 40.4 13.0 718 363 B L H <> S+ 0 0 9 -3,-1.5 4,-2.5 2,-0.1 5,-0.3 0.438 90.6 96.5-102.3 -4.4 26.7 37.6 12.2 719 364 B K H >S+ 0 0 6 -4,-0.2 5,-2.2 2,-0.2 4,-1.5 0.878 117.2 47.4 -66.6 -33.6 25.5 35.4 7.2 722 367 B V H <>S+ 0 0 2 -4,-2.5 5,-2.9 3,-0.2 6,-0.2 0.961 118.6 39.1 -69.7 -48.6 22.2 35.3 9.0 723 368 B D H <5S+ 0 0 33 -4,-3.3 -2,-0.2 -5,-0.3 -3,-0.2 0.859 125.9 34.2 -67.3 -40.7 20.4 37.5 6.6 724 369 B N H <5S+ 0 0 87 -4,-2.7 -1,-0.2 -5,-0.3 -3,-0.2 0.650 135.2 15.3 -97.2 -15.3 21.9 36.3 3.4 725 370 B Y T ><>S+ 0 0 39 -4,-1.5 5,-3.0 -5,-0.3 3,-0.7 0.695 124.6 43.8-122.5 -57.0 22.3 32.5 4.1 726 371 B F G > > - 0 0 8 -2,-0.3 4,-1.8 -283,-0.2 3,-0.6 0.799 67.7-179.2 35.7 57.9 23.3 5.2 13.4 740 385 B P H 3> S+ 0 0 19 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.827 73.8 56.9 -59.0 -32.0 24.7 8.7 13.1 741 386 B T H 3> S+ 0 0 37 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.891 106.4 50.7 -67.4 -37.6 27.7 8.1 15.4 742 387 B V H <> S+ 0 0 2 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.921 113.9 44.1 -63.1 -44.5 28.8 5.2 13.4 743 388 B X H X S+ 0 0 0 -4,-1.8 4,-2.6 -5,-0.2 -2,-0.2 0.899 112.1 51.3 -71.2 -39.8 28.7 7.2 10.2 744 389 B S H X S+ 0 0 34 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.921 110.1 51.7 -61.2 -41.0 30.4 10.3 11.7 745 390 B T H X S+ 0 0 43 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.935 111.4 45.9 -60.9 -44.0 33.1 8.0 13.0 746 391 B E H X S+ 0 0 45 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.923 112.4 51.0 -64.7 -42.9 33.7 6.5 9.5 747 392 B G H X S+ 0 0 1 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.883 106.6 54.3 -63.5 -38.2 33.6 10.0 7.9 748 393 B I H X S+ 0 0 21 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.928 107.5 51.2 -58.4 -47.3 36.2 11.3 10.4 749 394 B A H X S+ 0 0 26 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.914 110.6 48.1 -59.4 -42.9 38.5 8.4 9.4 750 395 B Q H X S+ 0 0 9 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.907 109.7 52.8 -66.3 -40.7 38.2 9.2 5.7 751 396 B Q H X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.916 110.5 47.6 -58.4 -46.4 38.8 12.9 6.3 752 397 B Q H X S+ 0 0 54 -4,-2.4 4,-1.8 -206,-0.2 -1,-0.2 0.921 113.2 47.2 -64.0 -43.1 42.0 12.2 8.1 753 398 B K H <>S+ 0 0 80 -4,-2.1 5,-2.9 -5,-0.2 6,-0.7 0.895 111.8 51.6 -64.1 -39.6 43.2 9.8 5.5 754 399 B I H ><5S+ 0 0 2 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.935 108.8 49.6 -63.0 -47.4 42.4 12.2 2.7 755 400 B V H 3<5S+ 0 0 4 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.885 112.8 48.1 -61.3 -37.7 44.3 15.1 4.3 756 401 B Q T 3<5S- 0 0 80 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.353 112.6-118.7 -85.4 4.8 47.3 12.8 4.7 757 402 B G T < 5S+ 0 0 59 -3,-1.7 -3,-0.2 -4,-0.2 -2,-0.1 0.754 77.6 126.5 66.5 26.7 47.1 11.5 1.1 758 403 B Q S - 0 0 47 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.452 32.7-109.5 -83.7 163.9 41.7 8.8 -2.9 761 406 B A H > S+ 0 0 7 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.920 120.5 49.6 -54.3 -47.9 38.5 10.8 -3.0 762 407 B K H > S+ 0 0 112 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.911 109.2 51.0 -63.0 -41.5 36.7 7.8 -4.6 763 408 B D H > S+ 0 0 84 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.896 107.1 54.0 -67.0 -34.4 38.0 5.4 -2.0 764 409 B A H X S+ 0 0 0 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.932 112.7 44.4 -57.7 -47.1 36.8 7.7 0.9 765 410 B A H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -182,-0.3 0.904 109.9 53.7 -70.1 -43.3 33.3 7.7 -0.6 766 411 B K H X S+ 0 0 111 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.882 105.4 55.9 -58.9 -35.6 33.3 4.0 -1.3 767 412 B A H X S+ 0 0 25 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.888 107.9 47.9 -60.1 -39.4 34.1 3.5 2.4 768 413 B L H X S+ 0 0 0 -4,-1.4 4,-2.9 2,-0.2 -2,-0.2 0.903 111.7 49.8 -71.8 -39.6 31.1 5.5 3.4 769 414 B D H X S+ 0 0 34 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.920 111.3 48.8 -63.6 -44.8 28.9 3.5 1.0 770 415 B A H X S+ 0 0 67 -4,-2.6 4,-0.6 2,-0.2 -2,-0.2 0.905 115.0 44.5 -61.4 -42.0 30.1 0.2 2.3 771 416 B K H >< S+ 0 0 47 -4,-2.2 3,-1.3 -5,-0.2 4,-0.4 0.929 110.5 54.1 -67.4 -43.6 29.5 1.4 6.0 772 417 B W H >X S+ 0 0 22 -4,-2.9 4,-2.6 1,-0.3 3,-1.8 0.872 98.2 65.0 -61.7 -32.5 26.1 2.8 5.2 773 418 B A H 3< S+ 0 0 78 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.825 100.3 51.9 -55.9 -33.3 25.1 -0.5 3.7 774 419 B T T << S+ 0 0 102 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.595 121.4 30.4 -79.8 -10.4 25.4 -2.1 7.2 775 420 B L T <4 0 0 31 -3,-1.8 -2,-0.2 -4,-0.4 -1,-0.2 0.590 360.0 360.0-121.5 -25.9 23.2 0.5 8.8 776 421 B K < 0 0 57 -4,-2.6 -3,-0.1 -5,-0.1 -2,-0.1 0.804 360.0 360.0 -69.7 360.0 20.7 1.6 6.3