==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 12-SEP-00 1E7Y . COMPND 2 MOLECULE: GLUCOSE 6-PHOSPHATE 1-DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LEUCONOSTOC MESENTEROIDES; . AUTHOR M.J.ADAMS,M.S.COSGROVE,S.GOVER . 485 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21445.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 366 75.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 9.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 1 0.2 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 . 49 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 138 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.5 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 1 1 1 1 3 0 3 2 3 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 1 3 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 . 1 0 0 1 1 2 0 1 1 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 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 A V 0 0 127 0, 0.0 2,-0.5 0, 0.0 32,-0.0 0.000 360.0 360.0 360.0 164.8 99.2 -5.2 2.9 2 2 A S - 0 0 106 1,-0.1 2,-0.0 33,-0.0 0, 0.0 -0.703 360.0-116.5 -79.8 123.0 100.9 -2.2 4.6 3 3 A E - 0 0 53 -2,-0.5 2,-0.7 1,-0.1 32,-0.2 -0.323 17.2-140.1 -61.7 136.0 102.8 -3.5 7.6 4 4 A I - 0 0 15 30,-2.6 2,-0.8 2,-0.1 32,-0.4 -0.914 14.3-163.1-100.1 111.0 101.7 -2.2 11.0 5 5 A K + 0 0 101 -2,-0.7 2,-0.3 30,-0.1 34,-0.2 -0.866 35.8 130.0 -98.8 102.5 104.8 -1.5 13.1 6 6 A T E -a 39 0A 2 -2,-0.8 34,-1.1 32,-0.6 2,-0.4 -0.949 47.5-140.6-148.1 165.9 103.5 -1.3 16.7 7 7 A L E -ab 40 112A 0 104,-2.1 106,-2.5 -2,-0.3 2,-0.5 -0.985 19.4-162.6-135.1 119.5 104.2 -2.6 20.3 8 8 A V E -ab 41 113A 1 32,-2.2 34,-2.6 -2,-0.4 2,-0.6 -0.906 5.9-161.0-111.4 130.5 101.3 -3.4 22.6 9 9 A T E -ab 42 114A 0 104,-2.7 106,-2.4 -2,-0.5 2,-0.9 -0.932 11.2-153.1-110.1 114.8 101.6 -3.9 26.4 10 10 A F E > -ab 43 115A 0 32,-2.4 34,-2.0 -2,-0.6 3,-1.0 -0.759 2.8-160.7 -94.9 101.2 98.7 -5.8 27.9 11 11 A F E 3 S+ab 44 116A 2 104,-2.8 106,-1.9 -2,-0.9 34,-0.2 -0.688 88.4 25.9 -77.2 121.8 98.0 -4.8 31.5 12 12 A G T > S+ 0 0 12 32,-2.7 3,-1.2 -2,-0.6 6,-0.4 0.789 79.1 161.8 89.9 35.6 95.9 -7.7 32.9 13 13 A G T < + 0 0 0 31,-2.4 32,-0.1 -3,-1.0 -2,-0.1 0.312 69.3 51.3 -72.1 4.9 97.4 -10.1 30.3 14 14 A T T 3 S+ 0 0 28 30,-0.3 -1,-0.3 4,-0.0 31,-0.1 0.470 89.6 111.7-114.1 -12.7 96.4 -13.2 32.2 15 15 A G S <> S- 0 0 28 -3,-1.2 4,-1.8 102,-0.2 5,-0.2 -0.032 83.0-105.1 -62.2 165.3 92.8 -12.1 32.6 16 16 A D H > S+ 0 0 104 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.904 118.3 53.2 -56.8 -45.9 89.7 -13.7 31.0 17 17 A L H >>S+ 0 0 40 1,-0.2 4,-2.7 2,-0.2 5,-1.6 0.883 106.3 51.3 -59.8 -44.7 89.4 -10.8 28.5 18 18 A A H 4>S+ 0 0 0 -6,-0.4 5,-2.6 3,-0.2 -1,-0.2 0.911 116.2 42.6 -59.8 -41.3 92.9 -11.1 27.2 19 19 A K H <5S+ 0 0 93 -4,-1.8 -2,-0.2 3,-0.2 -1,-0.2 0.901 121.5 38.3 -72.9 -42.9 92.4 -14.8 26.7 20 20 A R H <5S- 0 0 180 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.933 137.2 -1.6 -75.9 -47.8 88.9 -14.6 25.2 21 21 A K T X5S+ 0 0 85 -4,-2.7 4,-2.3 -5,-0.2 5,-0.2 0.837 120.0 56.4-110.5 -58.8 89.1 -11.5 23.0 22 22 A L H > S+ 0 0 7 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.926 109.2 55.2 -58.6 -37.8 93.0 -13.9 19.3 25 25 A S H X S+ 0 0 11 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.874 109.1 47.7 -59.9 -36.5 92.0 -10.5 17.8 26 26 A V H X S+ 0 0 0 -4,-1.7 4,-1.0 -3,-0.3 -1,-0.2 0.884 109.4 53.4 -70.6 -38.4 95.8 -9.7 17.6 27 27 A F H >X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 3,-0.5 0.895 105.2 54.3 -63.4 -39.9 96.4 -13.1 16.0 28 28 A N H 3X S+ 0 0 42 -4,-2.6 4,-2.5 1,-0.3 -1,-0.2 0.937 105.7 52.5 -60.8 -42.2 93.7 -12.4 13.4 29 29 A L H 3<>S+ 0 0 0 -4,-1.6 5,-1.7 1,-0.2 6,-1.5 0.735 111.7 47.3 -64.4 -24.0 95.6 -9.2 12.5 30 30 A Y H X<5S+ 0 0 45 -4,-1.0 3,-2.0 -3,-0.5 -2,-0.2 0.900 109.6 50.9 -82.1 -45.6 98.7 -11.2 12.1 31 31 A K H 3<5S+ 0 0 56 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.876 105.1 58.5 -59.2 -37.3 97.0 -13.9 9.9 32 32 A K T 3<5S- 0 0 82 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.1 0.306 120.1-112.3 -75.6 7.8 95.6 -11.1 7.7 33 33 A G T < 5S+ 0 0 28 -3,-2.0 -3,-0.2 2,-0.2 -2,-0.1 0.575 88.2 114.4 72.7 10.6 99.2 -10.1 7.1 34 34 A Y S > - 0 0 80 -2,-0.3 4,-2.1 1,-0.1 3,-1.1 -0.528 39.3 -96.0 -84.1 159.2 108.2 -17.1 32.9 51 51 A D H 3> S+ 0 0 47 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.851 125.9 54.2 -40.8 -45.4 108.1 -16.6 29.1 52 52 A D H 3> S+ 0 0 125 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.900 111.3 45.2 -59.2 -41.4 107.6 -20.3 28.4 53 53 A E H <> S+ 0 0 104 -3,-1.1 4,-1.2 2,-0.2 -1,-0.2 0.826 113.6 49.4 -71.1 -36.1 104.6 -20.3 30.7 54 54 A F H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 3,-0.4 0.934 105.2 56.1 -69.3 -47.4 103.1 -17.2 29.3 55 55 A K H X S+ 0 0 26 -4,-2.8 4,-2.6 1,-0.3 -1,-0.2 0.806 104.6 54.8 -56.3 -29.3 103.4 -18.3 25.7 56 56 A Q H X S+ 0 0 86 -4,-1.0 4,-2.7 2,-0.2 -1,-0.3 0.896 105.6 51.4 -71.4 -39.4 101.4 -21.4 26.5 57 57 A L H X S+ 0 0 29 -4,-1.2 4,-2.2 -3,-0.4 -2,-0.2 0.925 113.6 45.5 -60.6 -43.1 98.6 -19.1 27.9 58 58 A V H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.908 110.8 54.2 -66.6 -38.6 98.8 -17.3 24.6 59 59 A R H < S+ 0 0 58 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.883 111.5 43.5 -63.4 -42.4 98.9 -20.6 22.7 60 60 A D H >< S+ 0 0 76 -4,-2.7 3,-1.8 1,-0.2 4,-0.5 0.895 108.1 60.4 -69.5 -40.0 95.7 -21.9 24.4 61 61 A S H 3< S+ 0 0 14 -4,-2.2 3,-0.2 1,-0.3 -2,-0.2 0.891 114.1 35.3 -53.7 -43.4 94.0 -18.5 23.9 62 62 A I T >< S+ 0 0 0 -4,-1.9 3,-0.7 1,-0.2 4,-0.3 0.081 87.5 105.1-101.5 24.2 94.4 -18.8 20.1 63 63 A K G X S+ 0 0 124 -3,-1.8 3,-1.8 1,-0.2 -1,-0.2 0.966 79.3 50.0 -69.2 -48.8 93.9 -22.6 19.8 64 64 A D G 3 S+ 0 0 141 -4,-0.5 -1,-0.2 1,-0.3 -2,-0.1 0.460 115.2 46.8 -69.7 1.7 90.3 -22.4 18.4 65 65 A F G < S+ 0 0 88 -3,-0.7 2,-0.5 2,-0.0 -1,-0.3 0.338 89.7 103.4-120.4 -1.6 91.7 -19.9 15.8 66 66 A T < + 0 0 33 -3,-1.8 3,-0.2 -4,-0.3 -3,-0.0 -0.744 24.7 150.3 -90.6 123.0 94.8 -22.0 14.9 67 67 A D S S+ 0 0 126 -2,-0.5 2,-0.6 1,-0.3 -1,-0.2 0.589 75.7 43.2-116.7 -31.4 94.6 -23.9 11.6 68 68 A D > - 0 0 81 1,-0.1 4,-1.7 2,-0.0 3,-0.4 -0.953 68.0-164.1-119.6 109.3 98.4 -23.8 10.8 69 69 A Q H > S+ 0 0 100 -2,-0.6 4,-2.6 1,-0.2 5,-0.2 0.863 89.3 57.3 -61.4 -39.0 100.5 -24.5 13.9 70 70 A A H > S+ 0 0 71 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.854 107.2 50.3 -61.0 -34.2 103.7 -23.1 12.3 71 71 A Q H > S+ 0 0 46 -3,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.894 108.6 52.1 -69.3 -41.9 101.9 -19.8 11.8 72 72 A A H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.941 110.5 48.0 -59.9 -47.4 100.7 -19.9 15.5 73 73 A E H X S+ 0 0 57 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.890 106.4 55.3 -62.6 -41.6 104.3 -20.4 16.7 74 74 A A H < S+ 0 0 42 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.877 112.1 46.5 -58.2 -36.2 105.8 -17.6 14.5 75 75 A F H >< S+ 0 0 0 -4,-1.5 3,-1.8 -3,-0.2 -2,-0.2 0.891 106.1 57.0 -72.4 -43.5 103.3 -15.3 16.1 76 76 A I H >< S+ 0 0 0 -4,-2.2 3,-2.4 1,-0.3 -2,-0.2 0.815 91.1 72.6 -61.2 -29.3 104.0 -16.5 19.7 77 77 A E T 3< S+ 0 0 91 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.612 89.1 63.0 -62.4 -11.0 107.6 -15.6 19.3 78 78 A H T < S+ 0 0 16 -3,-1.8 -37,-2.9 -4,-0.1 2,-0.3 0.351 87.9 94.9 -94.3 3.2 106.6 -12.0 19.5 79 79 A F E < +c 41 0A 3 -3,-2.4 2,-0.3 -39,-0.2 -37,-0.2 -0.781 43.8 166.2-103.0 143.7 105.3 -12.4 23.1 80 80 A S E -c 42 0A 17 -39,-1.9 -37,-3.0 -2,-0.3 2,-0.3 -0.918 14.5-154.4-144.3 164.0 107.0 -11.7 26.4 81 81 A Y E -c 43 0A 3 -2,-0.3 2,-0.3 -39,-0.2 -30,-0.2 -0.965 10.3-174.5-144.6 157.6 105.9 -11.4 30.0 82 82 A R E -c 44 0A 48 -39,-0.9 -37,-0.8 -2,-0.3 2,-0.2 -0.934 28.3-125.7-153.6 126.2 107.0 -9.7 33.3 83 83 A A E +c 45 0A 41 -2,-0.3 -37,-0.3 -39,-0.2 2,-0.3 -0.552 46.7 159.9 -70.7 142.3 105.3 -10.1 36.7 84 84 A H - 0 0 6 -39,-2.3 2,-0.5 -2,-0.2 -37,-0.1 -0.879 41.2-138.9-171.6 136.0 104.4 -6.7 38.0 85 85 A D > - 0 0 59 -2,-0.3 3,-1.3 -39,-0.1 6,-0.2 -0.849 18.7-145.8 -97.2 128.2 102.2 -4.8 40.5 86 86 A V T 3 S+ 0 0 15 -2,-0.5 43,-0.1 1,-0.2 -1,-0.1 0.687 96.5 58.9 -67.3 -20.9 100.8 -1.6 39.0 87 87 A T T 3 S+ 0 0 76 1,-0.1 2,-0.9 4,-0.0 -1,-0.2 0.426 84.9 92.8 -87.6 1.0 101.0 0.3 42.4 88 88 A D X - 0 0 74 -3,-1.3 3,-0.6 1,-0.2 4,-0.5 -0.784 55.2-170.9-102.1 97.3 104.8 -0.3 42.6 89 89 A A G > S+ 0 0 33 -2,-0.9 3,-0.8 1,-0.3 4,-0.2 0.828 87.3 50.5 -51.3 -39.8 106.5 2.7 41.1 90 90 A A G > S+ 0 0 76 1,-0.2 3,-1.5 2,-0.2 4,-0.3 0.850 99.7 62.7 -71.0 -34.6 109.9 1.0 41.3 91 91 A S G <> S+ 0 0 27 -3,-0.6 4,-1.1 1,-0.3 3,-0.4 0.528 85.2 79.3 -70.3 -5.1 108.7 -2.2 39.6 92 92 A Y H <> S+ 0 0 0 -3,-0.8 4,-2.5 -4,-0.5 -1,-0.3 0.734 80.0 66.0 -75.5 -22.0 107.9 -0.2 36.4 93 93 A A H <> S+ 0 0 63 -3,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.835 97.7 55.2 -67.7 -31.3 111.6 -0.2 35.5 94 94 A V H > S+ 0 0 58 -3,-0.4 4,-2.1 -4,-0.3 3,-0.3 0.973 109.5 45.8 -63.1 -52.2 111.2 -3.9 35.0 95 95 A L H X S+ 0 0 0 -4,-1.1 4,-2.6 1,-0.3 -2,-0.2 0.889 109.6 54.3 -57.8 -43.5 108.4 -3.4 32.5 96 96 A K H X S+ 0 0 68 -4,-2.5 4,-2.5 1,-0.2 -1,-0.3 0.863 106.9 53.9 -60.3 -34.8 110.3 -0.6 30.8 97 97 A E H X S+ 0 0 93 -4,-1.7 4,-2.5 -3,-0.3 -2,-0.2 0.981 109.2 46.0 -62.4 -56.4 113.1 -3.2 30.3 98 98 A A H X S+ 0 0 1 -4,-2.1 4,-3.0 1,-0.2 5,-0.2 0.903 114.2 48.4 -52.1 -49.9 110.8 -5.7 28.7 99 99 A I H X S+ 0 0 1 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.941 115.6 42.6 -59.2 -49.9 109.3 -3.1 26.4 100 100 A E H X S+ 0 0 75 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.788 112.7 55.6 -68.5 -26.3 112.6 -1.7 25.3 101 101 A E H X S+ 0 0 110 -4,-2.5 4,-2.8 -5,-0.2 3,-0.3 0.968 111.5 42.3 -67.2 -52.5 113.9 -5.3 25.0 102 102 A A H X S+ 0 0 6 -4,-3.0 4,-2.4 1,-0.2 5,-0.3 0.891 110.0 59.0 -60.1 -41.8 111.1 -6.2 22.6 103 103 A A H <>S+ 0 0 11 -4,-2.7 5,-2.4 -5,-0.2 4,-0.5 0.879 112.6 38.7 -56.5 -41.5 111.6 -2.8 20.8 104 104 A D H <5S+ 0 0 134 -4,-1.7 3,-0.4 -3,-0.3 -2,-0.2 0.915 112.5 57.2 -75.0 -44.5 115.2 -3.8 20.0 105 105 A K H <5S+ 0 0 132 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.831 122.1 24.9 -55.2 -41.5 114.4 -7.4 19.3 106 106 A F T <5S- 0 0 36 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.370 107.3-118.4-108.2 4.4 111.9 -6.7 16.6 107 107 A D T 5 + 0 0 116 -4,-0.5 2,-0.6 -3,-0.4 -3,-0.2 0.971 46.9 173.0 57.2 60.1 113.2 -3.3 15.6 108 108 A I < - 0 0 10 -5,-2.4 2,-1.5 -6,-0.2 -1,-0.2 -0.896 26.2-147.2-103.0 115.1 110.1 -1.3 16.5 109 109 A D - 0 0 112 -2,-0.6 2,-0.2 -71,-0.1 -104,-0.1 -0.614 57.6 -69.4 -84.8 86.0 110.6 2.5 16.2 110 110 A G S S+ 0 0 4 -2,-1.5 30,-0.3 30,-0.1 32,-0.1 -0.506 79.0 135.5 70.7-135.7 108.3 3.8 19.0 111 111 A N + 0 0 36 28,-0.8 -104,-2.1 -2,-0.2 2,-0.4 0.971 35.8 179.4 54.3 72.7 104.6 3.3 18.3 112 112 A R E -bd 7 142A 16 29,-2.9 31,-2.6 -106,-0.2 2,-0.4 -0.875 20.0-168.8-114.8 136.6 103.3 2.0 21.7 113 113 A I E -bd 8 143A 0 -106,-2.5 -104,-2.7 -2,-0.4 2,-0.6 -0.953 7.3-159.1-117.8 133.2 99.9 1.0 22.8 114 114 A F E -bd 9 144A 0 29,-2.6 31,-2.2 -2,-0.4 2,-0.7 -0.951 8.3-161.6-116.4 107.3 99.1 0.4 26.4 115 115 A Y E -bd 10 145A 0 -106,-2.4 -104,-2.8 -2,-0.6 2,-1.3 -0.835 5.3-154.6 -93.2 117.0 96.0 -1.7 26.9 116 116 A M E +bd 11 146A 0 29,-2.7 2,-1.2 -2,-0.7 31,-0.9 -0.630 25.0 164.1 -93.8 81.7 94.6 -1.5 30.4 117 117 A S + 0 0 18 -106,-1.9 2,-0.3 -2,-1.3 -102,-0.2 -0.431 48.0 101.7 -91.9 56.8 92.7 -4.8 30.8 118 118 A V S S- 0 0 32 -2,-1.2 29,-0.2 1,-0.1 5,-0.1 -0.875 84.8 -69.5-134.7 166.7 92.5 -4.3 34.5 119 119 A A > - 0 0 36 -2,-0.3 3,-2.1 1,-0.1 4,-0.4 -0.240 50.4-110.9 -57.1 147.2 90.0 -3.1 37.1 120 120 A P G > S+ 0 0 70 0, 0.0 3,-1.5 0, 0.0 4,-0.5 0.755 110.8 72.9 -50.8 -33.9 89.1 0.7 36.9 121 121 A R G 3 S+ 0 0 189 1,-0.3 4,-0.3 2,-0.1 -2,-0.1 0.661 99.1 48.9 -57.9 -18.0 90.8 1.5 40.2 122 122 A F G <> S+ 0 0 51 -3,-2.1 4,-2.6 2,-0.1 5,-0.3 0.564 85.5 90.5 -99.7 -10.4 94.1 1.0 38.4 123 123 A F H <> S+ 0 0 1 -3,-1.5 4,-1.8 -4,-0.4 -2,-0.1 0.916 92.1 37.7 -52.3 -57.7 93.5 3.2 35.4 124 124 A G H > S+ 0 0 11 -4,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.904 116.6 52.8 -63.1 -43.9 94.8 6.5 36.7 125 125 A T H > S+ 0 0 43 -4,-0.3 4,-2.1 2,-0.2 5,-0.2 0.966 108.7 48.4 -55.7 -57.8 97.7 4.9 38.6 126 126 A I H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.897 110.9 53.3 -51.4 -43.7 99.0 3.0 35.6 127 127 A A H >X S+ 0 0 0 -4,-1.8 4,-1.4 -5,-0.3 3,-0.5 0.933 106.1 50.6 -58.9 -52.3 98.8 6.2 33.5 128 128 A K H >X S+ 0 0 108 -4,-2.4 4,-2.8 1,-0.2 3,-0.8 0.950 113.7 45.5 -51.4 -53.4 100.9 8.3 35.9 129 129 A Y H 3X S+ 0 0 37 -4,-2.1 4,-1.7 1,-0.3 6,-0.3 0.697 101.8 64.6 -67.4 -21.9 103.6 5.7 36.0 130 130 A L H <<>S+ 0 0 0 -4,-1.5 5,-1.9 -3,-0.5 6,-1.2 0.865 115.7 33.0 -68.0 -33.6 103.7 5.2 32.2 131 131 A K H X<5S+ 0 0 125 -4,-1.4 3,-1.4 -3,-0.8 -2,-0.2 0.949 122.6 43.4 -84.6 -54.6 104.8 8.8 32.0 132 132 A S H 3<5S+ 0 0 70 -4,-2.8 -3,-0.2 1,-0.3 -2,-0.1 0.856 114.6 48.0 -61.8 -40.4 106.9 9.2 35.2 133 133 A E T 3<5S- 0 0 65 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.1 0.243 116.7-112.6 -85.9 12.8 108.8 5.9 35.0 134 134 A G T < 5S+ 0 0 29 -3,-1.4 -3,-0.2 1,-0.1 -4,-0.1 0.830 72.2 136.0 62.3 42.4 109.6 6.6 31.3 135 135 A L < + 0 0 0 -5,-1.9 2,-0.3 -6,-0.3 -4,-0.2 0.664 42.4 103.0 -90.1 -16.3 107.6 3.9 29.5 136 136 A L S S- 0 0 40 -6,-1.2 6,-0.1 -5,-0.2 -26,-0.0 -0.492 80.6-110.7 -72.6 128.0 106.3 6.3 26.8 137 137 A A - 0 0 9 -2,-0.3 -1,-0.1 4,-0.2 -2,-0.1 -0.214 13.5-148.7 -56.1 142.9 108.0 6.0 23.5 138 138 A D S S+ 0 0 144 3,-0.0 2,-0.3 -27,-0.0 -1,-0.1 0.458 83.9 38.1 -91.9 -4.6 110.2 9.0 22.5 139 139 A T S S+ 0 0 53 2,-0.1 -28,-0.8 0, 0.0 -2,-0.0 -0.865 109.7 13.0-136.0 170.4 109.3 8.4 18.8 140 140 A G S S- 0 0 57 -2,-0.3 2,-0.3 -30,-0.3 -30,-0.1 -0.338 104.2 -45.6 62.1-137.7 106.3 7.4 16.9 141 141 A Y - 0 0 35 2,-0.0 -29,-2.9 31,-0.0 2,-0.4 -0.787 36.8-147.7-126.5 172.7 103.1 7.5 19.0 142 142 A N E +d 112 0A 16 -2,-0.3 2,-0.4 -31,-0.2 -29,-0.2 -0.991 22.7 178.5-141.5 122.0 101.8 6.5 22.4 143 143 A R E -d 113 0A 40 -31,-2.6 -29,-2.6 -2,-0.4 2,-0.5 -0.992 17.4-149.1-134.1 141.1 98.2 5.5 22.8 144 144 A L E -de 114 173A 0 28,-2.6 30,-3.0 -2,-0.4 2,-0.7 -0.931 4.0-157.9-114.2 118.5 96.2 4.3 25.8 145 145 A M E -de 115 174A 1 -31,-2.2 -29,-2.7 -2,-0.5 2,-0.5 -0.848 13.3-161.4 -96.9 111.6 93.3 1.9 25.4 146 146 A I E -de 116 175A 0 -2,-0.7 30,-2.8 28,-0.7 -29,-0.1 -0.841 10.6-138.5 -96.1 125.1 91.0 2.2 28.4 147 147 A E - 0 0 17 -31,-0.9 -30,-0.0 -2,-0.5 -24,-0.0 -0.258 43.0 -47.3 -79.3 163.9 88.6 -0.7 29.1 148 148 A K S S+ 0 0 77 1,-0.1 -1,-0.1 2,-0.1 29,-0.1 -0.505 106.5 49.1 -69.5 143.9 85.0 -0.3 30.2 149 149 A P - 0 0 50 0, 0.0 2,-1.6 0, 0.0 -1,-0.1 0.477 55.2-170.5 -99.3 143.4 83.8 1.4 32.3 150 150 A F S S- 0 0 17 26,-0.1 3,-0.1 -4,-0.1 7,-0.1 -0.663 73.6 -37.4 -89.0 81.9 85.1 4.9 31.9 151 151 A G - 0 0 11 -2,-1.6 3,-0.1 5,-0.1 4,-0.0 -0.235 53.0-121.6 90.4 175.4 83.6 6.2 35.2 152 152 A T S S+ 0 0 86 1,-0.4 2,-0.3 -2,-0.1 -1,-0.1 0.095 92.9 6.7-139.3 11.2 80.3 5.4 36.9 153 153 A S S > S- 0 0 28 -3,-0.1 4,-2.0 1,-0.1 -1,-0.4 -0.926 91.0 -88.1-176.4 176.3 79.1 9.0 37.0 154 154 A Y H > S+ 0 0 63 286,-0.3 4,-3.2 -2,-0.3 5,-0.2 0.910 123.7 51.0 -69.7 -42.2 80.2 12.3 35.7 155 155 A D H > S+ 0 0 108 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.964 114.8 41.2 -58.2 -55.0 82.3 13.1 38.7 156 156 A T H > S+ 0 0 44 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.905 116.6 50.0 -61.7 -41.4 84.2 9.8 38.7 157 157 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.936 112.0 48.3 -62.4 -44.2 84.5 9.9 34.9 158 158 A A H X S+ 0 0 27 -4,-3.2 4,-1.7 2,-0.2 -2,-0.2 0.867 111.2 50.0 -64.4 -38.8 85.8 13.5 35.1 159 159 A E H X S+ 0 0 120 -4,-2.6 4,-2.4 2,-0.2 3,-0.5 0.970 110.8 49.4 -62.9 -53.0 88.3 12.5 37.8 160 160 A L H X S+ 0 0 19 -4,-2.7 4,-2.3 1,-0.3 -2,-0.2 0.902 109.4 52.6 -51.0 -48.1 89.5 9.6 35.7 161 161 A Q H X S+ 0 0 5 -4,-2.5 4,-2.1 1,-0.2 -1,-0.3 0.859 108.7 51.0 -58.4 -36.9 89.9 12.0 32.7 162 162 A N H X S+ 0 0 105 -4,-1.7 4,-0.6 -3,-0.5 -2,-0.2 0.957 109.5 48.2 -67.5 -48.3 92.0 14.3 34.9 163 163 A D H >< S+ 0 0 73 -4,-2.4 3,-0.6 1,-0.2 4,-0.2 0.878 115.5 46.3 -58.2 -41.0 94.4 11.5 36.0 164 164 A L H >X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 3,-1.6 0.833 103.8 60.0 -72.1 -36.9 94.8 10.3 32.4 165 165 A E H 3< S+ 0 0 95 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.574 89.9 74.1 -70.1 -5.8 95.3 13.8 30.9 166 166 A N T << S+ 0 0 105 -3,-0.6 -1,-0.3 -4,-0.6 -2,-0.2 0.735 116.6 17.6 -74.8 -23.8 98.4 14.1 33.2 167 167 A A T <4 S+ 0 0 14 -3,-1.6 2,-0.3 -4,-0.2 -2,-0.2 0.564 129.5 37.8-121.5 -19.1 100.2 11.7 30.8 168 168 A F < - 0 0 1 -4,-2.2 2,-0.3 -25,-0.0 -1,-0.2 -0.927 68.9-123.8-136.6 157.8 98.1 11.7 27.6 169 169 A D > - 0 0 101 -2,-0.3 3,-2.3 1,-0.1 4,-0.5 -0.669 42.3-105.7 -91.9 156.0 96.2 14.1 25.4 170 170 A D G > S+ 0 0 38 1,-0.3 3,-1.0 -2,-0.3 -1,-0.1 0.799 118.8 62.5 -55.0 -29.0 92.5 13.2 24.8 171 171 A N G 3 S+ 0 0 112 1,-0.2 -1,-0.3 3,-0.1 256,-0.0 0.550 99.4 54.7 -74.7 -6.4 93.4 12.1 21.2 172 172 A Q G < S+ 0 0 43 -3,-2.3 -28,-2.6 -29,-0.1 2,-0.7 0.508 89.8 94.6 -99.8 -7.9 95.7 9.4 22.5 173 173 A L E < -e 144 0A 3 -3,-1.0 2,-0.8 -4,-0.5 -28,-0.2 -0.769 52.2-175.2 -93.0 113.9 92.9 7.9 24.7 174 174 A F E -e 145 0A 5 -30,-3.0 -28,-0.7 -2,-0.7 2,-0.2 -0.761 9.2-164.0-112.0 84.9 91.0 5.1 23.1 175 175 A R E -e 146 0A 11 -2,-0.8 2,-0.5 256,-0.4 256,-0.3 -0.445 24.7-114.0 -67.8 138.7 88.1 4.1 25.4 176 176 A I + 0 0 14 -30,-2.8 2,-0.4 -2,-0.2 -26,-0.1 -0.632 44.1 158.0 -83.2 119.3 86.5 0.7 24.7 177 177 A N >> - 0 0 15 -2,-0.5 3,-0.9 252,-0.2 4,-0.8 -0.868 19.3-168.2-137.3 94.9 82.9 0.6 23.4 178 178 A H T 34 S+ 0 0 52 -2,-0.4 4,-0.2 1,-0.2 -1,-0.1 0.728 83.0 63.4 -62.9 -20.5 82.3 -2.6 21.6 179 179 A Y T >4 S+ 0 0 7 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 0.882 100.2 52.9 -71.5 -33.3 79.0 -1.5 20.2 180 180 A L T <4 S+ 0 0 0 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.758 103.9 59.9 -70.0 -22.1 80.8 1.2 18.2 181 181 A G T 3< S+ 0 0 2 -4,-0.8 2,-0.5 -3,-0.1 -1,-0.3 0.510 79.2 110.8 -82.7 -6.0 83.0 -1.6 17.0 182 182 A K S X> S- 0 0 29 -3,-1.4 3,-1.5 -4,-0.2 4,-1.0 -0.619 70.2-134.6 -76.6 121.2 80.1 -3.5 15.4 183 183 A E G >4 S+ 0 0 75 -2,-0.5 3,-0.6 229,-0.4 4,-0.2 0.784 102.6 53.0 -39.0 -49.5 80.2 -3.5 11.5 184 184 A M G >> S+ 0 0 12 1,-0.2 3,-1.5 189,-0.2 4,-0.6 0.837 101.5 59.5 -62.1 -33.9 76.5 -2.6 11.1 185 185 A V G X4 S+ 0 0 0 -3,-1.5 3,-0.6 1,-0.3 4,-0.3 0.808 100.7 56.7 -64.6 -29.6 76.8 0.4 13.4 186 186 A Q G S+ 0 0 38 -3,-1.5 4,-3.0 -4,-0.2 3,-0.4 0.793 77.2 79.8 -83.5 -28.1 76.9 1.6 8.2 188 188 A I H S+ 0 0 4 -4,-0.3 4,-1.8 1,-0.2 5,-0.4 0.848 113.9 50.0 -64.5 -38.3 77.1 7.1 8.1 190 190 A A H X S+ 0 0 56 -4,-0.5 4,-1.5 -3,-0.4 -2,-0.2 0.934 113.4 44.8 -66.6 -46.3 77.4 5.4 4.8 191 191 A L H X S+ 0 0 20 -4,-3.0 4,-0.7 2,-0.2 8,-0.3 0.939 119.8 41.9 -62.6 -49.3 73.6 4.9 4.3 192 192 A R H >< S+ 0 0 1 -4,-2.5 3,-0.9 -5,-0.3 7,-0.7 0.995 126.9 26.2 -62.2 -70.1 72.9 8.5 5.4 193 193 A F H 3< S+ 0 0 45 -4,-1.8 -1,-0.2 1,-0.2 -3,-0.2 0.640 117.9 61.1 -72.2 -18.7 75.6 10.6 3.7 194 194 A G H 3< S+ 0 0 52 -4,-1.5 -1,-0.2 -5,-0.4 -2,-0.2 0.619 103.8 50.2 -84.4 -13.5 76.1 8.1 0.9 195 195 A N XX - 0 0 73 -3,-0.9 4,-2.5 -4,-0.7 3,-2.5 -0.890 68.8-157.5-128.0 101.2 72.5 8.4 -0.4 196 196 A P H 3> S+ 0 0 99 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.784 91.9 65.4 -46.5 -34.2 71.3 12.0 -1.0 197 197 A I H 34 S+ 0 0 134 1,-0.2 4,-0.1 2,-0.2 -5,-0.1 0.807 114.8 31.1 -59.8 -30.6 67.6 10.8 -0.7 198 198 A F H X> S+ 0 0 32 -3,-2.5 4,-1.0 -6,-0.3 3,-0.5 0.835 116.5 56.5 -93.4 -40.6 68.4 9.9 3.0 199 199 A D H >< S+ 0 0 24 -4,-2.5 3,-1.0 -7,-0.7 -2,-0.2 0.941 110.4 45.3 -56.2 -50.2 70.9 12.6 3.7 200 200 A A T 3< S+ 0 0 63 -4,-2.9 -1,-0.3 1,-0.2 -2,-0.2 0.709 115.1 49.8 -67.9 -19.1 68.5 15.3 2.7 201 201 A A T <4 S+ 0 0 6 -3,-0.5 2,-2.5 -5,-0.3 6,-0.3 0.497 77.1 104.4 -98.0 -4.7 65.8 13.6 4.7 202 202 A W S << S+ 0 0 2 -4,-1.0 2,-0.3 -3,-1.0 -1,-0.1 -0.340 71.4 74.7 -76.1 62.4 67.8 13.2 7.9 203 203 A N S >> S- 0 0 26 -2,-2.5 4,-2.7 124,-0.1 3,-0.8 -0.920 97.5 -80.9-158.5 179.7 66.0 16.0 9.7 204 204 A K T 34 S+ 0 0 63 122,-1.5 123,-0.1 -2,-0.3 122,-0.1 0.667 117.6 63.7 -63.9 -25.3 62.8 17.2 11.5 205 205 A D T 34 S+ 0 0 118 121,-0.1 -1,-0.2 1,-0.1 -3,-0.1 0.839 119.5 21.6 -70.4 -31.8 61.0 17.9 8.2 206 206 A Y T <4 S+ 0 0 124 -3,-0.8 146,-3.5 -5,-0.3 2,-0.3 0.818 109.5 74.5-103.4 -42.2 61.1 14.3 7.2 207 207 A I E < -F 351 0B 1 -4,-2.7 144,-0.3 -6,-0.3 3,-0.1 -0.588 46.7-171.6 -85.3 137.6 61.5 12.2 10.3 208 208 A K E S- 0 0 52 142,-3.3 2,-0.3 1,-0.4 143,-0.2 0.824 72.2 -27.4 -87.7 -43.6 58.7 11.5 12.9 209 209 A N E -F 350 0B 2 141,-1.6 141,-2.2 121,-0.2 -1,-0.4 -0.955 55.8-128.2-168.5 157.5 60.9 9.8 15.5 210 210 A V E -Fg 349 332B 3 121,-2.5 123,-3.3 -2,-0.3 2,-0.4 -0.939 20.8-158.3-117.5 141.3 64.1 7.7 15.8 211 211 A Q E -Fg 348 333B 0 137,-2.0 137,-2.9 -2,-0.4 2,-0.5 -0.980 11.0-175.0-127.3 130.8 64.3 4.4 17.7 212 212 A V E -Fg 347 334B 2 121,-2.6 123,-1.4 -2,-0.4 2,-0.5 -0.991 11.7-174.0-122.3 123.5 67.3 2.6 19.2 213 213 A T E +Fg 346 335B 0 133,-2.7 133,-2.0 -2,-0.5 2,-0.5 -0.977 17.7 178.5-126.0 122.4 66.7 -0.9 20.6 214 214 A L E +Fg 345 336B 1 121,-2.3 123,-1.2 -2,-0.5 2,-0.4 -0.833 23.3 177.0-119.6 83.6 69.2 -3.1 22.5 215 215 A S E -Fg 344 337B 0 129,-3.3 129,-2.5 -2,-0.5 2,-0.4 -0.775 7.8-175.4 -95.2 137.3 67.0 -6.1 23.3 216 216 A E - 0 0 25 121,-1.3 124,-2.7 -2,-0.4 127,-0.2 -0.988 23.5-160.4-132.9 142.0 68.4 -9.2 25.1 217 217 A V + 0 0 62 -2,-0.4 -1,-0.1 122,-0.3 121,-0.1 0.687 69.3 94.2 -92.7 -18.5 66.8 -12.5 25.9 218 218 A L - 0 0 91 121,-0.1 121,-1.7 120,-0.1 122,-0.2 -0.347 66.2-142.3 -74.0 151.1 69.4 -13.3 28.7 219 219 A G - 0 0 3 119,-0.2 3,-0.2 120,-0.1 -1,-0.1 -0.193 40.1 -87.2 -95.9-166.7 68.8 -12.5 32.3 220 220 A V S > S+ 0 0 8 1,-0.2 2,-1.2 -2,-0.1 3,-0.9 0.905 73.8 148.0 -70.3 -37.8 71.4 -11.2 34.8 221 221 A E T 3 + 0 0 97 1,-0.2 83,-0.3 2,-0.1 3,-0.2 -0.195 67.4 19.9 46.9 -80.5 72.2 -14.9 35.5 222 222 A E T 3 S+ 0 0 148 -2,-1.2 2,-0.4 -3,-0.2 3,-0.4 0.965 122.9 41.7 -82.2 -62.6 75.9 -14.7 36.2 223 223 A R <> + 0 0 158 -3,-0.9 4,-2.7 1,-0.2 3,-0.5 -0.118 62.7 132.2 -90.3 42.1 77.1 -11.1 37.2 224 224 A A H > + 0 0 0 -2,-0.4 4,-2.8 -3,-0.2 -1,-0.2 0.869 66.1 65.6 -58.4 -41.8 74.3 -9.9 39.5 225 225 A G H 4 S+ 0 0 48 -3,-0.4 -1,-0.2 1,-0.2 4,-0.2 0.901 114.6 29.4 -46.8 -51.9 76.7 -8.6 42.1 226 226 A Y H >> S+ 0 0 103 -3,-0.5 3,-1.6 1,-0.2 4,-0.8 0.922 119.7 56.5 -75.0 -45.0 78.1 -6.0 39.8 227 227 A Y H 3X S+ 0 0 5 -4,-2.7 4,-2.2 1,-0.3 -2,-0.2 0.728 91.7 71.6 -61.1 -23.4 74.9 -5.6 37.8 228 228 A D H 3< S+ 0 0 30 -4,-2.8 -1,-0.3 1,-0.2 83,-0.2 0.673 107.2 34.6 -69.7 -18.1 72.8 -4.7 40.9 229 229 A T H <4 S+ 0 0 123 -3,-1.6 -1,-0.2 -4,-0.2 -2,-0.2 0.501 123.4 44.5-110.3 -10.7 74.4 -1.3 41.2 230 230 A A H X S+ 0 0 12 -4,-0.8 4,-1.4 -3,-0.2 -2,-0.2 0.866 81.5 175.7 -96.5 -53.2 74.8 -0.6 37.5 231 231 A G H X - 0 0 0 -4,-2.2 4,-2.5 2,-0.2 3,-0.2 -0.034 57.0 -59.5 69.9-179.7 71.5 -1.7 36.0 232 232 A A H >>S+ 0 0 0 81,-2.7 4,-2.6 1,-0.2 5,-2.2 0.875 130.4 68.4 -64.4 -38.3 70.4 -1.3 32.4 233 233 A L H 4>S+ 0 0 3 80,-0.3 5,-2.8 1,-0.2 -1,-0.2 0.898 116.9 19.6 -48.7 -51.2 70.9 2.5 32.7 234 234 A L H <5S+ 0 0 31 -4,-1.4 5,-0.3 -3,-0.2 -1,-0.2 0.793 123.2 57.6 -92.9 -30.2 74.7 2.3 33.1 235 235 A D H <5S- 0 0 22 -4,-2.5 5,-0.2 -5,-0.2 -3,-0.2 0.909 132.9 -3.8 -66.7 -43.8 75.3 -1.2 31.6 236 236 A M T <>S+ 0 0 8 -4,-2.6 5,-2.6 -5,-0.2 4,-0.3 0.709 129.6 52.8-121.9 -34.4 73.7 -0.5 28.2 237 237 A I T XS+ 0 0 0 -5,-2.2 5,-2.6 3,-0.2 6,-0.2 0.987 106.3 46.7 -70.5 -61.4 72.2 3.0 28.0 238 238 A Q T 5S+ 0 0 21 -5,-0.3 4,-1.3 -6,-0.2 -2,-0.1 0.899 131.7 28.7 -99.0 -65.4 77.6 3.6 26.9 240 240 A H H >5S+ 0 0 8 -4,-0.3 4,-1.1 -5,-0.2 -3,-0.2 0.969 124.8 39.9 -66.3 -58.5 76.1 1.6 24.0 241 241 A T H >> S- 0 0 68 1,-0.1 4,-2.9 170,-0.0 3,-0.3 -0.632 75.8-113.4 -85.4 147.1 87.9 12.5 9.4 258 258 A D H > S+ 0 0 41 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.778 116.5 58.7 -47.5 -29.7 87.5 11.4 13.0 259 259 A K H > S+ 0 0 154 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.972 111.4 36.0 -66.7 -56.1 88.0 15.1 14.0 260 260 A D H > S+ 0 0 37 -3,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.861 115.9 56.3 -67.0 -36.5 85.0 16.5 11.9 261 261 A I H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.968 111.1 43.9 -57.7 -52.0 83.0 13.4 12.7 262 262 A R H X S+ 0 0 34 -4,-2.3 4,-2.7 -5,-0.2 -2,-0.2 0.866 111.3 53.5 -61.4 -40.1 83.4 14.0 16.4 263 263 A A H X S+ 0 0 57 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.971 111.1 46.9 -59.4 -50.0 82.8 17.7 16.1 264 264 A A H X S+ 0 0 6 -4,-2.8 -13,-1.4 1,-0.2 4,-0.9 0.883 112.7 48.8 -58.8 -45.2 79.5 16.9 14.3 265 265 A K H >X S+ 0 0 7 -4,-2.5 4,-2.3 -15,-0.2 3,-0.6 0.892 110.8 51.2 -62.3 -40.4 78.5 14.4 17.0 266 266 A N H 3X S+ 0 0 19 -4,-2.7 4,-3.0 1,-0.2 -2,-0.2 0.807 97.7 66.4 -67.5 -30.9 79.4 16.9 19.7 267 267 A A H 3< S+ 0 0 38 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.869 110.2 37.8 -57.0 -35.7 77.2 19.5 18.0 268 268 A A H XX S+ 0 0 2 -4,-0.9 3,-1.5 -3,-0.6 4,-0.8 0.904 113.0 55.0 -82.0 -46.0 74.3 17.2 18.9 269 269 A F H >< S+ 0 0 4 -4,-2.3 3,-1.2 1,-0.3 -2,-0.2 0.910 105.8 52.9 -53.9 -44.0 75.6 16.1 22.3 270 270 A N T 3< S+ 0 0 102 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.649 109.5 51.6 -68.0 -12.4 75.8 19.7 23.4 271 271 A A T <4 S+ 0 0 16 -3,-1.5 52,-2.4 -5,-0.2 -1,-0.3 0.550 82.7 113.8 -98.4 -14.0 72.2 20.1 22.4 272 272 A L B << -N 322 0C 8 -3,-1.2 2,-0.3 -4,-0.8 50,-0.2 -0.384 66.9-126.5 -62.9 132.8 70.9 17.1 24.3 273 273 A K - 0 0 84 48,-2.2 2,-0.5 -2,-0.1 48,-0.3 -0.631 12.3-145.9 -85.6 140.2 68.6 18.1 27.1 274 274 A I - 0 0 80 -2,-0.3 2,-0.1 46,-0.1 168,-0.1 -0.905 22.7-136.7-104.2 130.0 69.2 16.9 30.7 275 275 A Y - 0 0 9 -2,-0.5 2,-0.2 167,-0.3 3,-0.0 -0.442 6.3-143.1 -91.1 161.1 66.0 16.3 32.7 276 276 A D > - 0 0 90 -2,-0.1 4,-2.4 173,-0.0 3,-0.2 -0.497 47.1 -79.5-106.3-178.2 64.9 17.1 36.3 277 277 A E H > S+ 0 0 88 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.906 130.1 46.6 -50.1 -52.5 62.8 14.9 38.6 278 278 A A H > S+ 0 0 71 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.870 114.8 47.3 -59.4 -39.1 59.5 15.7 37.0 279 279 A E H > S+ 0 0 42 -3,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.806 106.0 56.7 -74.2 -33.4 60.9 15.2 33.4 280 280 A V H X S+ 0 0 1 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.969 108.6 48.0 -62.6 -47.3 62.5 11.9 34.2 281 281 A N H < S+ 0 0 67 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.760 116.2 46.7 -61.5 -26.7 59.1 10.6 35.3 282 282 A K H < S+ 0 0 147 -4,-0.8 -2,-0.2 -5,-0.2 -1,-0.2 0.897 124.3 25.6 -83.0 -45.2 57.7 12.0 32.1 283 283 A Y H < S+ 0 0 53 -4,-3.1 36,-2.5 36,-0.1 2,-0.3 0.382 114.0 63.4-104.9 3.2 60.2 10.8 29.5 284 284 A F E < -H 318 0B 11 -4,-2.1 2,-0.4 34,-0.2 34,-0.2 -0.961 51.0-165.4-135.2 151.2 61.6 7.7 31.1 285 285 A V E -H 317 0B 15 32,-3.1 32,-2.1 -2,-0.3 2,-0.4 -0.999 6.7-168.4-134.0 128.0 60.5 4.2 32.3 286 286 A R E +Hi 316 457B 4 170,-0.5 172,-3.0 -2,-0.4 2,-0.3 -0.950 16.2 172.7-117.7 139.1 62.6 1.9 34.5 287 287 A A E -Hi 315 458B 0 28,-2.6 27,-2.1 -2,-0.4 28,-1.7 -0.973 25.7-147.3-146.7 164.0 61.6 -1.7 35.0 288 288 A Q E - i 0 459B 23 170,-1.6 172,-1.0 -2,-0.3 2,-0.2 -0.996 32.3-112.2-133.6 131.2 62.6 -5.0 36.6 289 289 A Y E - i 0 460B 1 -2,-0.4 11,-2.7 170,-0.2 12,-0.3 -0.415 31.3-171.6 -71.2 132.6 61.7 -8.4 35.1 290 290 A G - 0 0 12 170,-3.0 172,-0.1 1,-0.3 -1,-0.1 -0.079 46.1 -46.7 -98.6-156.8 59.4 -10.7 37.0 291 291 A A - 0 0 40 1,-0.1 171,-1.2 170,-0.1 -1,-0.3 -0.349 50.5-151.6 -74.7 155.8 58.5 -14.3 36.2 292 292 A G - 0 0 8 5,-1.7 -1,-0.1 2,-0.7 171,-0.1 0.423 44.0 -81.8 -93.8-123.1 57.8 -15.3 32.6 293 293 A D S S+ 0 0 158 169,-0.3 2,-0.2 168,-0.1 170,-0.1 0.651 111.7 69.9-112.9 -41.4 55.5 -18.2 31.9 294 294 A S S > S- 0 0 69 168,-0.2 3,-1.5 1,-0.1 -2,-0.7 -0.514 82.9-130.8 -79.7 143.6 58.1 -20.9 32.4 295 295 A A T 3 S+ 0 0 101 1,-0.3 -1,-0.1 -2,-0.2 -3,-0.0 0.843 106.3 70.9 -61.1 -32.7 59.5 -21.6 35.9 296 296 A D T 3 S+ 0 0 130 1,-0.2 2,-1.2 -5,-0.1 -1,-0.3 0.740 86.8 70.0 -55.0 -27.9 63.0 -21.3 34.3 297 297 A F S < S+ 0 0 52 -3,-1.5 -5,-1.7 165,-0.1 -1,-0.2 -0.690 75.4 177.6 -94.7 79.5 62.3 -17.6 34.0 298 298 A K - 0 0 95 -2,-1.2 -2,-0.0 -7,-0.2 -9,-0.0 -0.467 35.8 -90.1 -82.0 155.3 62.4 -16.6 37.6 299 299 A P > - 0 0 33 0, 0.0 3,-1.5 0, 0.0 -9,-0.3 -0.105 36.2-108.9 -57.2 164.5 62.0 -12.9 38.7 300 300 A Y G > S+ 0 0 0 -11,-2.7 3,-2.4 1,-0.3 -10,-0.1 0.925 117.0 65.9 -61.6 -41.4 65.1 -10.7 39.1 301 301 A L G 3 S+ 0 0 66 -12,-0.3 -1,-0.3 1,-0.3 9,-0.1 0.525 100.2 50.6 -58.0 -10.6 64.6 -10.8 42.9 302 302 A E G < S+ 0 0 120 -3,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.212 84.3 113.5-112.9 10.4 65.4 -14.5 42.9 303 303 A E S X S- 0 0 19 -3,-2.4 3,-1.8 1,-0.1 -81,-0.1 -0.495 83.0 -81.5 -80.9 154.9 68.6 -14.4 40.9 304 304 A L T 3 S+ 0 0 114 -83,-0.3 -80,-0.2 1,-0.3 -1,-0.1 -0.336 113.5 6.4 -58.0 131.8 71.9 -15.2 42.5 305 305 A D T 3 S+ 0 0 104 1,-0.2 -1,-0.3 -81,-0.1 -77,-0.1 0.596 93.3 133.4 69.9 15.6 73.3 -12.3 44.6 306 306 A V < - 0 0 15 -3,-1.8 -1,-0.2 -6,-0.1 2,-0.1 -0.861 60.7-119.6-100.1 121.8 70.3 -10.1 44.1 307 307 A P > - 0 0 53 0, 0.0 3,-2.8 0, 0.0 -4,-0.1 -0.376 20.9-125.0 -59.5 130.3 69.0 -8.4 47.3 308 308 A A T 3 S+ 0 0 87 1,-0.3 -7,-0.1 -2,-0.1 -2,-0.0 0.532 110.8 43.6 -53.7 -8.4 65.4 -9.4 48.0 309 309 A D T 3 S+ 0 0 133 -8,-0.0 -1,-0.3 2,-0.0 -8,-0.0 0.130 81.8 147.6-124.2 17.1 64.4 -5.7 48.1 310 310 A S < - 0 0 13 -3,-2.8 -9,-0.1 1,-0.1 -10,-0.0 -0.255 31.2-171.7 -57.9 138.3 66.4 -4.6 45.1 311 311 A K + 0 0 120 -83,-0.2 -1,-0.1 2,-0.0 2,-0.1 -0.135 39.3 143.5-117.7 27.0 64.8 -1.7 43.1 312 312 A N - 0 0 16 1,-0.1 2,-0.6 145,-0.0 -84,-0.1 -0.384 51.5-118.5 -70.7 151.6 67.4 -2.1 40.3 313 313 A N + 0 0 11 1,-0.1 -81,-2.7 -25,-0.1 -80,-0.3 -0.824 31.7 172.4 -99.6 119.4 66.5 -1.7 36.7 314 314 A T S S+ 0 0 0 -27,-2.1 24,-2.1 -2,-0.6 2,-0.3 0.381 78.6 37.6 -98.7 1.0 66.8 -4.6 34.3 315 315 A F E -HJ 287 337B 0 -28,-1.7 -28,-2.6 22,-0.3 2,-0.3 -0.986 64.6-175.7-153.0 137.8 65.1 -2.5 31.6 316 316 A I E +HJ 286 336B 0 20,-2.3 20,-2.2 -2,-0.3 2,-0.3 -0.989 2.7 177.8-136.3 143.5 65.1 1.2 30.7 317 317 A A E +HJ 285 335B 0 -32,-2.1 -32,-3.1 -2,-0.3 2,-0.3 -0.986 17.1 154.3-144.0 136.1 63.1 3.1 28.1 318 318 A G E -HJ 284 334B 0 16,-2.5 16,-2.3 -2,-0.3 2,-0.5 -0.998 39.4-116.4-164.6 164.0 63.2 6.8 27.4 319 319 A E E - J 0 333B 15 -36,-2.5 2,-0.3 -2,-0.3 14,-0.2 -0.896 25.6-160.7-108.5 118.9 62.8 9.8 25.1 320 320 A L E - 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0 0 72 0, 0.0 2,-0.7 0, 0.0 -170,-0.5 -0.349 20.4-140.6 -74.4 153.2 58.2 4.4 39.7 457 457 A L E -i 286 0B 48 -172,-0.1 -170,-0.2 -4,-0.1 -145,-0.0 -0.954 24.0-160.1-113.7 106.1 59.7 0.9 39.1 458 458 A E E -i 287 0B 73 -172,-3.0 -170,-1.6 -2,-0.7 2,-0.3 -0.228 3.8-142.9 -77.6 176.6 57.6 -0.9 36.5 459 459 A T E -i 288 0B 98 -172,-0.2 2,-0.3 -2,-0.0 9,-0.3 -0.909 12.5-167.4-138.0 162.5 57.5 -4.6 36.0 460 460 A Y E -i 289 0B 9 -172,-1.0 -170,-3.0 -2,-0.3 2,-0.3 -0.993 31.2-100.5-155.4 148.8 57.3 -7.0 33.1 461 461 A K > - 0 0 123 -2,-0.3 3,-2.4 5,-0.3 2,-0.5 -0.526 50.3-106.3 -69.3 128.6 56.7 -10.6 32.2 462 462 A S T 3 S+ 0 0 1 -171,-1.2 -169,-0.3 1,-0.3 -168,-0.2 -0.441 110.2 31.2 -59.2 109.1 60.0 -12.3 31.5 463 463 A G T 3 S+ 0 0 33 -124,-2.5 -1,-0.3 -2,-0.5 -123,-0.2 0.286 95.1 102.6 123.7 -10.2 59.9 -12.7 27.7 464 464 A S S < S- 0 0 40 -3,-2.4 -123,-1.6 -125,-0.4 -1,-0.3 0.003 85.2-104.5 -84.5-164.3 57.8 -9.6 26.7 465 465 A M S S- 0 0 27 1,-0.4 -125,-0.1 -125,-0.2 -3,-0.1 0.253 77.8 -70.5-107.5 9.6 59.3 -6.5 25.2 466 466 A G S S- 0 0 15 -5,-0.3 -1,-0.4 -127,-0.1 -5,-0.3 -0.814 73.3 -34.2 133.5-175.9 58.9 -4.5 28.4 467 467 A P >> - 0 0 5 0, 0.0 3,-2.0 0, 0.0 4,-0.6 -0.453 57.7-112.8 -75.9 157.9 56.3 -2.9 30.7 468 468 A E H >> S+ 0 0 142 1,-0.3 4,-2.0 -9,-0.3 3,-1.6 0.862 114.3 72.2 -59.4 -31.9 53.2 -1.4 29.1 469 469 A A H 3> S+ 0 0 22 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.745 87.7 64.3 -55.2 -24.4 54.5 2.0 30.2 470 470 A S H <> S+ 0 0 2 -3,-2.0 4,-1.0 2,-0.2 -1,-0.3 0.886 106.2 42.5 -66.4 -38.8 57.1 1.6 27.5 471 471 A D H <>S+ 0 0 0 -4,-1.0 3,-2.5 -3,-0.4 5,-0.9 0.910 109.8 65.9 -71.0 -44.1 55.7 6.6 22.7 475 475 A A H ><5S+ 0 0 61 -4,-2.6 3,-2.0 1,-0.3 -1,-0.2 0.811 89.6 68.5 -48.1 -36.2 51.8 6.7 22.2 476 476 A A T 3<5S+ 0 0 83 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.746 107.7 37.0 -56.7 -29.7 51.8 10.1 23.9 477 477 A N T < 5S- 0 0 63 -3,-2.5 -1,-0.3 -4,-0.2 -2,-0.2 0.256 126.9-102.2-102.8 5.1 53.6 11.5 20.8 478 478 A G T < 5S+ 0 0 48 -3,-2.0 2,-0.3 -4,-0.3 -3,-0.2 0.962 82.8 121.4 72.1 52.1 51.6 9.3 18.6 479 479 A D < - 0 0 14 -5,-0.9 2,-0.3 -8,-0.2 -1,-0.3 -0.914 40.9-163.7-138.5 165.8 54.4 6.7 18.0 480 480 A A - 0 0 56 -2,-0.3 2,-0.4 -6,-0.1 3,-0.1 -0.940 36.1 -89.0-147.7 161.0 54.9 3.0 18.5 481 481 A W - 0 0 3 -2,-0.3 -10,-0.0 1,-0.2 -270,-0.0 -0.640 28.2-152.7 -76.8 127.7 57.9 0.7 18.6 482 482 A V S S+ 0 0 42 -2,-0.4 2,-0.5 -134,-0.1 -1,-0.2 0.949 82.8 62.7 -63.6 -52.7 58.7 -0.7 15.2 483 483 A F + 0 0 15 1,-0.1 -2,-0.0 2,-0.1 -1,-0.0 -0.667 57.8 173.2 -78.9 125.0 60.2 -3.9 16.5 484 484 A K 0 0 130 -2,-0.5 -1,-0.1 -143,-0.0 -143,-0.1 0.473 360.0 360.0-108.7 -9.0 57.6 -5.9 18.4 485 485 A G 0 0 74 -144,-0.1 -2,-0.1 -20,-0.0 -142,-0.1 0.414 360.0 360.0 132.5 360.0 59.7 -9.1 18.9