==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 23-JAN-05 1WXE . COMPND 2 MOLECULE: NH(3)-DEPENDENT NAD(+) SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.JAUCH,A.HUMM,R.HUBER,M.C.WAHL . 258 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13778.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 18 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 43.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 3.1 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 0 0 0 1 1 1 1 0 1 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 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 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 2 A T > 0 0 115 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 171.3 48.3 20.8 19.5 2 3 A L H > + 0 0 56 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.881 360.0 55.7 -66.2 -37.7 47.3 24.3 18.3 3 4 A Q H > S+ 0 0 39 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.877 107.8 47.3 -62.2 -39.9 50.9 25.5 19.0 4 5 A Q H > S+ 0 0 134 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.889 112.6 50.8 -68.7 -37.5 52.4 22.7 16.8 5 6 A Q H X S+ 0 0 116 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.891 111.4 46.7 -66.0 -42.6 49.9 23.6 14.1 6 7 A I H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.918 110.8 51.5 -66.8 -44.5 50.7 27.3 14.2 7 8 A I H X>S+ 0 0 33 -4,-2.2 5,-1.3 1,-0.2 4,-1.1 0.906 111.8 48.6 -58.7 -41.7 54.5 26.7 14.3 8 9 A K H <5S+ 0 0 181 -4,-1.9 3,-0.3 1,-0.2 -1,-0.2 0.917 110.7 50.1 -64.2 -45.3 54.1 24.5 11.2 9 10 A A H <5S+ 0 0 50 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.872 116.9 39.7 -62.7 -39.4 52.0 27.1 9.4 10 11 A L H <5S- 0 0 2 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.561 104.8-128.0 -88.6 -9.7 54.4 30.0 10.0 11 12 A G T <5 + 0 0 40 -4,-1.1 -3,-0.2 -3,-0.3 2,-0.1 0.736 47.9 163.7 70.2 25.4 57.5 27.8 9.4 12 13 A A < - 0 0 10 -5,-1.3 -1,-0.2 -6,-0.2 174,-0.1 -0.433 22.0-156.2 -78.5 149.2 59.2 28.8 12.6 13 14 A K - 0 0 102 172,-0.4 174,-0.2 -2,-0.1 3,-0.1 -0.913 23.3-127.1-124.1 151.9 62.2 26.8 14.1 14 15 A P S S+ 0 0 79 0, 0.0 2,-0.3 0, 0.0 209,-0.1 0.833 96.7 12.2 -64.2 -35.8 63.4 26.6 17.8 15 16 A Q S S- 0 0 164 -3,-0.0 2,-0.3 2,-0.0 175,-0.0 -0.998 70.4-167.1-145.4 142.7 66.9 27.5 16.7 16 17 A I - 0 0 24 -2,-0.3 2,-0.7 -3,-0.1 170,-0.0 -0.898 26.6-120.2-130.8 160.4 68.4 28.9 13.5 17 18 A N > - 0 0 81 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 -0.908 25.5-150.1 -99.3 111.2 71.9 29.4 12.1 18 19 A A H > S+ 0 0 8 -2,-0.7 4,-1.9 1,-0.2 -1,-0.2 0.904 92.4 41.8 -49.5 -57.9 72.3 33.1 11.5 19 20 A E H > S+ 0 0 115 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.885 114.4 53.3 -60.1 -40.5 74.7 33.1 8.5 20 21 A E H > S+ 0 0 107 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.888 110.0 47.3 -63.0 -38.8 72.7 30.2 6.9 21 22 A E H X S+ 0 0 4 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.819 107.4 56.8 -73.1 -29.9 69.5 32.2 7.2 22 23 A I H X S+ 0 0 11 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.937 110.4 45.0 -64.1 -44.3 71.1 35.3 5.8 23 24 A R H X S+ 0 0 83 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.842 108.4 56.6 -69.2 -33.0 72.0 33.2 2.7 24 25 A R H X S+ 0 0 105 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.934 112.4 41.9 -63.9 -43.2 68.6 31.6 2.4 25 26 A S H X S+ 0 0 2 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.882 116.9 46.8 -71.1 -39.9 66.9 35.1 2.2 26 27 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.930 112.9 47.8 -69.8 -42.9 69.5 36.6 -0.1 27 28 A D H X S+ 0 0 79 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.845 109.4 56.9 -65.6 -30.4 69.5 33.6 -2.5 28 29 A F H X S+ 0 0 87 -4,-1.4 4,-2.2 -5,-0.3 -1,-0.2 0.942 109.1 43.6 -63.7 -50.4 65.7 33.8 -2.4 29 30 A L H X S+ 0 0 2 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.925 115.0 49.5 -62.0 -45.3 65.7 37.4 -3.6 30 31 A K H X S+ 0 0 19 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.907 110.5 50.8 -61.1 -41.9 68.4 36.7 -6.2 31 32 A S H X S+ 0 0 64 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.895 109.5 50.0 -63.7 -40.8 66.5 33.7 -7.5 32 33 A Y H X S+ 0 0 93 -4,-2.2 4,-1.6 1,-0.2 3,-0.4 0.932 110.3 49.4 -64.6 -45.2 63.2 35.6 -7.9 33 34 A L H < S+ 0 0 12 -4,-2.3 6,-0.3 1,-0.2 -1,-0.2 0.821 110.4 50.8 -64.5 -30.9 64.9 38.4 -9.8 34 35 A Q H < S+ 0 0 111 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.767 110.2 50.2 -77.6 -23.4 66.6 35.9 -12.2 35 36 A T H < S+ 0 0 88 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.735 120.1 35.5 -83.7 -26.0 63.2 34.2 -12.8 36 37 A Y S >< S+ 0 0 97 -4,-1.6 3,-2.1 -5,-0.1 -1,-0.3 -0.684 71.7 176.4-127.5 74.6 61.5 37.6 -13.6 37 38 A P T 3 + 0 0 99 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.537 70.0 74.5 -60.2 -7.1 64.2 39.6 -15.4 38 39 A F T 3 S+ 0 0 136 -3,-0.1 2,-0.6 2,-0.0 -5,-0.1 0.649 75.5 93.9 -80.2 -12.5 61.9 42.5 -16.0 39 40 A I < + 0 0 11 -3,-2.1 115,-0.2 -6,-0.3 114,-0.1 -0.702 46.7 168.1 -80.8 119.5 62.2 43.4 -12.3 40 41 A K + 0 0 95 113,-3.1 36,-2.0 -2,-0.6 2,-0.3 0.531 55.6 36.8-109.8 -10.3 65.0 46.0 -12.1 41 42 A S E -ab 76 154A 0 112,-1.1 114,-1.6 34,-0.2 2,-0.5 -0.994 57.5-142.9-147.8 152.9 64.5 47.2 -8.5 42 43 A L E -ab 77 155A 2 34,-1.7 36,-3.3 -2,-0.3 2,-0.5 -0.958 23.8-157.5-111.4 128.0 63.6 46.2 -5.0 43 44 A V E +ab 78 156A 0 112,-2.6 114,-3.1 -2,-0.5 2,-0.3 -0.924 16.9 168.9-111.5 130.6 61.6 48.8 -3.0 44 45 A L E -a 79 0A 3 34,-2.1 36,-2.9 -2,-0.5 2,-0.4 -0.984 32.3-129.3-145.7 132.2 61.6 48.9 0.7 45 46 A G E -a 80 0A 20 112,-0.4 2,-0.5 -2,-0.3 36,-0.2 -0.659 25.4-151.9 -79.4 127.7 60.3 51.4 3.3 46 47 A I + 0 0 6 34,-2.5 36,-0.5 -2,-0.4 47,-0.1 -0.903 23.6 168.6-106.1 122.5 63.0 52.2 5.9 47 48 A S - 0 0 64 -2,-0.5 46,-0.2 2,-0.2 -1,-0.1 0.528 54.0-109.6-108.6 -10.3 61.8 53.2 9.4 48 49 A G S S+ 0 0 7 1,-0.3 2,-0.1 45,-0.2 -2,-0.1 0.475 81.6 119.1 91.9 3.7 65.1 53.0 11.4 49 50 A G S > S- 0 0 27 1,-0.1 4,-1.8 156,-0.0 -1,-0.3 -0.460 79.1 -96.3 -98.7 173.3 63.8 49.9 13.2 50 51 A Q H > S+ 0 0 17 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.922 114.8 47.3 -52.0 -58.3 65.0 46.4 13.5 51 52 A D H > S+ 0 0 16 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.904 115.5 41.2 -56.9 -50.8 62.8 44.7 10.8 52 53 A S H > S+ 0 0 5 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.825 113.7 54.6 -71.0 -28.3 63.3 47.2 8.0 53 54 A T H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.930 112.0 44.0 -68.8 -42.6 67.0 47.6 8.7 54 55 A L H X S+ 0 0 2 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.963 116.2 45.8 -65.3 -51.0 67.5 43.8 8.5 55 56 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.895 112.0 53.6 -59.4 -40.2 65.4 43.5 5.3 56 57 A G H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.908 107.2 49.1 -61.9 -43.8 67.2 46.4 3.8 57 58 A K H X S+ 0 0 36 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.920 111.9 49.9 -62.7 -42.7 70.6 45.0 4.3 58 59 A L H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.873 109.9 51.1 -64.0 -37.9 69.6 41.7 2.8 59 60 A C H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.920 110.3 47.6 -65.9 -45.1 68.1 43.5 -0.3 60 61 A Q H X S+ 0 0 3 -4,-2.3 4,-3.1 1,-0.2 -2,-0.2 0.896 110.7 52.5 -64.5 -38.6 71.2 45.5 -0.9 61 62 A M H X S+ 0 0 38 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.914 108.9 50.1 -62.6 -42.3 73.3 42.4 -0.6 62 63 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.918 114.0 44.2 -61.7 -45.4 71.1 40.6 -3.1 63 64 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.942 111.5 53.8 -65.2 -47.9 71.4 43.5 -5.6 64 65 A N H X S+ 0 0 73 -4,-3.1 4,-1.9 1,-0.2 -2,-0.2 0.931 112.7 43.5 -51.2 -51.2 75.2 43.8 -5.0 65 66 A E H X S+ 0 0 43 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.902 112.3 52.1 -64.4 -42.5 75.8 40.1 -5.8 66 67 A L H X>S+ 0 0 3 -4,-2.3 4,-2.7 -5,-0.2 5,-0.5 0.876 108.1 51.8 -62.8 -38.6 73.4 40.1 -8.8 67 68 A R H X5S+ 0 0 39 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.933 112.5 45.4 -62.8 -45.9 75.2 43.1 -10.4 68 69 A L H <5S+ 0 0 155 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.835 117.6 44.3 -66.1 -34.9 78.6 41.4 -10.0 69 70 A E H <5S+ 0 0 113 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.903 127.9 23.8 -78.9 -43.8 77.4 38.1 -11.3 70 71 A T H <5S- 0 0 77 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.693 92.2-132.5 -96.3 -23.3 75.3 39.2 -14.3 71 72 A G << + 0 0 45 -4,-2.1 2,-0.8 -5,-0.5 -4,-0.2 0.484 53.6 148.2 83.3 1.9 77.0 42.6 -15.0 72 73 A N > - 0 0 67 -6,-0.4 3,-0.7 1,-0.2 -1,-0.3 -0.607 27.0-174.1 -75.3 110.0 73.6 44.3 -15.3 73 74 A E T 3 S+ 0 0 140 -2,-0.8 -1,-0.2 1,-0.2 -6,-0.1 0.497 72.0 75.2 -84.2 -2.7 74.1 47.8 -14.0 74 75 A S T 3 S+ 0 0 42 -7,-0.1 -1,-0.2 2,-0.0 2,-0.2 0.630 71.0 102.2 -84.3 -13.1 70.4 48.7 -14.2 75 76 A L < + 0 0 14 -3,-0.7 2,-0.3 -12,-0.1 -34,-0.2 -0.475 51.0 170.2 -70.9 140.2 69.5 46.7 -11.1 76 77 A Q E -a 41 0A 46 -36,-2.0 -34,-1.7 -2,-0.2 2,-0.5 -1.000 35.4-135.3-154.0 149.8 69.0 48.9 -7.9 77 78 A F E -a 42 0A 0 -2,-0.3 27,-1.4 -36,-0.2 2,-0.6 -0.933 24.8-158.8-104.8 126.4 67.8 48.7 -4.4 78 79 A I E -ac 43 104A 0 -36,-3.3 -34,-2.1 -2,-0.5 2,-0.5 -0.922 2.8-161.5-111.9 115.7 65.6 51.7 -3.5 79 80 A A E -ac 44 105A 2 25,-2.9 27,-2.5 -2,-0.6 2,-0.5 -0.803 11.0-156.8 -92.9 132.9 65.2 52.6 0.2 80 81 A V E -ac 45 106A 0 -36,-2.9 -34,-2.5 -2,-0.5 2,-0.5 -0.948 7.5-157.7-118.0 121.9 62.2 54.8 0.8 81 82 A R E - c 0 107A 23 25,-3.1 27,-2.9 -2,-0.5 -34,-0.1 -0.843 11.6-177.2 -93.3 129.9 61.9 57.1 3.8 82 83 A L + 0 0 12 -2,-0.5 27,-0.1 -36,-0.5 25,-0.1 -0.446 9.0 175.4-127.8 60.6 58.2 57.8 4.5 83 84 A P - 0 0 5 0, 0.0 27,-1.7 0, 0.0 2,-0.9 -0.274 31.2-135.0 -67.2 151.0 58.1 60.3 7.4 84 85 A Y S S- 0 0 60 25,-0.2 2,-0.4 26,-0.2 25,-0.1 -0.868 75.5 -52.1-103.4 93.1 54.8 61.7 8.6 85 86 A G S S- 0 0 16 -2,-0.9 2,-0.7 2,-0.1 26,-0.1 -0.631 125.0 -3.8 75.9-126.3 55.8 65.3 9.0 86 87 A V S S- 0 0 129 -2,-0.4 2,-0.3 -3,-0.1 -1,-0.1 -0.889 75.5-147.4-106.2 108.8 59.0 65.4 11.2 87 88 A Q > - 0 0 53 -2,-0.7 3,-1.1 1,-0.1 -2,-0.1 -0.571 7.4-146.1 -76.6 132.7 59.9 61.9 12.5 88 89 A A T 3 S+ 0 0 107 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.221 95.3 62.2 -81.7 15.9 61.6 61.9 15.9 89 90 A D T >> + 0 0 77 1,-0.1 4,-1.9 2,-0.1 3,-0.8 0.233 62.7 118.6-123.0 10.6 63.7 58.9 14.8 90 91 A E H <> S+ 0 0 82 -3,-1.1 4,-2.9 1,-0.3 5,-0.2 0.850 72.6 54.7 -47.6 -47.7 65.6 60.5 11.9 91 92 A Q H 3> S+ 0 0 131 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.883 108.9 49.3 -57.4 -38.5 69.1 60.0 13.4 92 93 A D H <> S+ 0 0 50 -3,-0.8 4,-2.4 2,-0.2 -1,-0.2 0.897 111.1 50.1 -66.3 -39.1 68.3 56.3 13.8 93 94 A C H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.895 108.6 52.7 -65.3 -39.4 67.2 56.3 10.1 94 95 A Q H X S+ 0 0 88 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.907 111.4 45.8 -62.0 -42.5 70.4 58.0 9.2 95 96 A D H X S+ 0 0 55 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.875 110.1 54.5 -68.5 -36.8 72.5 55.3 10.9 96 97 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.918 109.6 47.6 -61.7 -43.5 70.3 52.6 9.4 97 98 A I H X S+ 0 0 29 -4,-2.4 4,-3.3 1,-0.2 -2,-0.2 0.903 108.7 53.3 -64.2 -42.7 71.1 54.0 5.9 98 99 A A H < S+ 0 0 71 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.827 112.2 46.7 -62.4 -30.9 74.8 54.3 6.7 99 100 A F H < S+ 0 0 23 -4,-1.7 -2,-0.2 -5,-0.1 -1,-0.2 0.871 117.7 40.5 -77.4 -40.3 74.7 50.6 7.7 100 101 A I H < S- 0 0 3 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.866 86.1-154.9 -76.8 -37.9 72.8 49.5 4.6 101 102 A Q < - 0 0 146 -4,-3.3 -3,-0.1 -5,-0.2 -4,-0.1 0.965 21.7-158.7 57.3 55.7 74.6 51.7 2.1 102 103 A P - 0 0 21 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.261 22.9-127.0 -65.5 149.4 71.6 51.7 -0.3 103 104 A D S S+ 0 0 64 -26,-0.4 2,-0.3 1,-0.2 -25,-0.2 0.890 92.7 8.3 -62.9 -39.0 72.0 52.5 -4.0 104 105 A R E -c 78 0A 109 -27,-1.4 -25,-2.9 2,-0.0 2,-0.4 -0.999 61.4-160.5-147.1 143.6 69.3 55.1 -3.8 105 106 A V E -c 79 0A 55 -2,-0.3 2,-0.4 -27,-0.2 -25,-0.2 -0.977 9.4-171.6-129.4 118.7 67.2 56.8 -1.0 106 107 A L E -c 80 0A 48 -27,-2.5 -25,-3.1 -2,-0.4 2,-0.6 -0.900 9.8-152.6-109.3 137.3 64.0 58.6 -1.8 107 108 A T E +c 81 0A 89 -2,-0.4 2,-0.5 -27,-0.2 -25,-0.2 -0.943 15.7 176.5-114.3 118.1 62.2 60.7 0.9 108 109 A V - 0 0 52 -27,-2.9 2,-0.7 -2,-0.6 36,-0.1 -0.969 19.9-148.1-123.1 116.8 58.4 61.0 0.6 109 110 A N - 0 0 82 -2,-0.5 3,-0.4 -27,-0.1 4,-0.3 -0.751 9.7-169.8 -87.9 116.2 56.5 62.9 3.3 110 111 A I > + 0 0 2 -27,-1.7 4,-2.0 -2,-0.7 5,-0.2 0.437 61.8 94.8 -84.8 -0.8 53.1 61.4 3.6 111 112 A K H > S+ 0 0 91 -28,-0.5 4,-2.5 1,-0.2 5,-0.3 0.909 81.2 53.4 -59.1 -45.7 51.5 64.0 5.9 112 113 A G H > S+ 0 0 51 -3,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.909 111.7 44.5 -57.0 -45.3 50.0 66.0 3.1 113 114 A A H > S+ 0 0 36 -4,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.873 112.5 51.5 -68.3 -38.8 48.1 63.1 1.6 114 115 A V H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.923 110.8 47.6 -65.6 -43.9 46.9 61.8 5.0 115 116 A L H X S+ 0 0 81 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.887 111.8 51.6 -64.3 -37.4 45.5 65.2 6.0 116 117 A A H X S+ 0 0 62 -4,-1.8 4,-2.0 -5,-0.3 -2,-0.2 0.920 109.5 48.5 -65.2 -44.0 43.8 65.4 2.6 117 118 A S H X S+ 0 0 51 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.880 112.3 50.1 -63.8 -38.0 42.2 62.0 3.0 118 119 A E H X S+ 0 0 10 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.872 107.8 52.5 -69.7 -34.9 41.0 62.9 6.4 119 120 A Q H X S+ 0 0 78 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.901 108.5 51.0 -67.7 -38.7 39.5 66.2 5.3 120 121 A A H X S+ 0 0 64 -4,-2.0 4,-0.8 1,-0.2 -1,-0.2 0.867 113.5 44.9 -65.9 -36.3 37.5 64.4 2.6 121 122 A L H X>S+ 0 0 67 -4,-1.6 5,-3.0 2,-0.2 4,-1.0 0.882 110.1 54.8 -74.3 -38.7 36.2 61.9 5.1 122 123 A R H ><5S+ 0 0 88 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.910 105.7 51.6 -61.6 -43.1 35.4 64.6 7.6 123 124 A E H 3<5S+ 0 0 149 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.804 109.4 51.5 -65.5 -26.2 33.3 66.6 5.1 124 125 A A H 3<5S- 0 0 86 -4,-0.8 -1,-0.3 -3,-0.2 -2,-0.2 0.653 130.2 -94.3 -82.8 -18.5 31.3 63.4 4.4 125 126 A G T <<5S+ 0 0 59 -4,-1.0 2,-0.6 -3,-0.8 -3,-0.2 0.505 86.2 119.4 117.8 9.4 30.7 62.8 8.1 126 127 A I < - 0 0 89 -5,-3.0 2,-0.4 -8,-0.1 -1,-0.2 -0.922 34.9-175.9-115.1 116.8 33.5 60.5 9.2 127 128 A E - 0 0 136 -2,-0.6 2,-0.2 -5,-0.1 -8,-0.0 -0.883 24.1-129.8-105.6 137.6 36.0 61.5 11.9 128 129 A L - 0 0 37 -2,-0.4 2,-0.2 -10,-0.1 -10,-0.0 -0.609 5.6-134.2 -94.0 150.5 38.9 59.0 12.6 129 130 A S > - 0 0 65 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.529 36.0-104.5 -88.9 162.5 40.1 57.6 15.9 130 131 A D H > S+ 0 0 141 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.878 121.6 54.6 -56.6 -38.0 43.9 57.6 16.5 131 132 A F H > S+ 0 0 153 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.920 110.2 43.9 -61.9 -47.0 43.9 53.8 15.8 132 133 A V H > S+ 0 0 61 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.843 109.8 56.6 -68.4 -33.7 42.3 54.2 12.4 133 134 A R H X S+ 0 0 50 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.872 103.4 56.2 -65.1 -33.9 44.5 57.1 11.5 134 135 A G H X S+ 0 0 35 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.899 108.0 45.9 -63.2 -41.4 47.4 54.8 12.2 135 136 A N H X S+ 0 0 30 -4,-1.4 4,-2.1 1,-0.2 -1,-0.2 0.853 109.0 56.7 -69.1 -34.9 46.2 52.3 9.7 136 137 A E H X S+ 0 0 29 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.899 106.0 50.1 -62.1 -42.1 45.5 55.1 7.2 137 138 A K H X S+ 0 0 53 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.923 109.2 52.0 -63.0 -42.6 49.2 56.1 7.5 138 139 A A H X S+ 0 0 15 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.874 110.1 48.6 -61.8 -38.6 50.3 52.5 6.9 139 140 A R H X S+ 0 0 94 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.827 107.9 53.8 -72.6 -31.6 48.1 52.4 3.7 140 141 A E H X S+ 0 0 30 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.887 107.8 51.5 -69.2 -35.6 49.5 55.7 2.4 141 142 A R H X S+ 0 0 83 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.895 108.4 51.5 -66.2 -37.3 53.0 54.3 2.8 142 143 A M H X S+ 0 0 44 -4,-1.6 4,-2.6 1,-0.2 5,-0.2 0.954 109.3 51.2 -61.8 -48.5 51.9 51.2 0.9 143 144 A K H X S+ 0 0 103 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.912 109.3 49.1 -55.0 -47.9 50.6 53.5 -1.9 144 145 A A H X S+ 0 0 12 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.927 111.6 49.3 -60.0 -45.7 53.8 55.4 -2.2 145 146 A Q H X S+ 0 0 23 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.905 111.7 48.1 -62.9 -41.3 55.9 52.3 -2.4 146 147 A Y H X S+ 0 0 72 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.842 109.9 52.1 -69.8 -31.1 53.7 50.8 -5.1 147 148 A S H X S+ 0 0 81 -4,-2.2 4,-1.3 -5,-0.2 -2,-0.2 0.909 111.6 47.4 -69.1 -39.4 53.8 54.0 -7.1 148 149 A I H X S+ 0 0 23 -4,-2.3 4,-1.1 1,-0.2 3,-0.3 0.922 112.6 48.7 -65.4 -43.4 57.6 54.0 -6.9 149 150 A A H <>S+ 0 0 6 -4,-2.5 5,-2.6 1,-0.2 4,-0.5 0.869 107.7 56.2 -64.0 -36.3 57.7 50.3 -7.9 150 151 A G H <5S+ 0 0 60 -4,-2.1 3,-0.3 1,-0.2 -1,-0.2 0.831 112.3 41.3 -65.0 -31.8 55.4 51.0 -10.8 151 152 A M H <5S+ 0 0 162 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.569 119.3 43.0 -92.7 -11.3 57.7 53.7 -12.2 152 153 A T T <5S- 0 0 26 -4,-1.1 -112,-0.3 -3,-0.3 -2,-0.2 0.171 108.5-111.9-119.5 16.6 61.0 51.8 -11.6 153 154 A S T 5S+ 0 0 67 -4,-0.5 -113,-3.1 -3,-0.3 -112,-1.1 0.933 74.5 133.7 54.0 49.3 60.0 48.3 -12.7 154 155 A G E < -b 41 0A 13 -5,-2.6 2,-0.3 -114,-0.2 -112,-0.2 -0.602 53.4-126.7-123.1-176.8 60.2 47.0 -9.2 155 156 A V E -b 42 0A 15 -114,-1.6 -112,-2.6 -2,-0.2 2,-0.5 -0.936 28.9-114.2-127.5 153.1 58.6 44.9 -6.5 156 157 A V E -b 43 0A 1 -2,-0.3 23,-2.5 -114,-0.2 24,-1.7 -0.788 25.5-147.2 -93.4 124.2 57.8 45.9 -2.9 157 158 A V B -d 180 0B 2 -114,-3.1 -112,-0.4 -2,-0.5 2,-0.2 -0.758 12.5-152.5 -92.9 133.7 59.6 44.1 -0.2 158 159 A G - 0 0 2 22,-2.7 25,-0.4 -2,-0.4 26,-0.1 -0.670 15.9-148.3-104.7 161.2 57.9 43.4 3.1 159 160 A T + 0 0 28 16,-0.3 22,-0.1 -2,-0.2 17,-0.1 0.269 47.3 140.4-108.9 9.3 59.3 43.0 6.6 160 161 A D + 0 0 21 15,-0.2 23,-0.3 4,-0.1 2,-0.3 -0.247 23.9 170.0 -57.3 136.9 56.6 40.6 7.9 161 162 A H >> - 0 0 5 23,-0.2 4,-3.0 24,-0.1 3,-1.4 -0.863 48.7 -86.1-140.8 174.0 58.0 37.8 10.1 162 163 A A H 3> S+ 0 0 0 24,-1.3 4,-2.3 21,-0.4 25,-0.2 0.851 121.2 55.9 -52.2 -42.9 56.7 35.0 12.4 163 164 A A H 34 S+ 0 0 0 23,-0.9 -1,-0.3 1,-0.2 4,-0.2 0.697 117.4 35.8 -67.2 -19.5 56.4 37.2 15.5 164 165 A E H <>>S+ 0 0 23 -3,-1.4 5,-2.0 2,-0.1 4,-0.9 0.792 115.0 54.0 -98.9 -38.4 54.2 39.6 13.7 165 166 A A H <5S+ 0 0 0 -4,-3.0 3,-0.4 1,-0.2 -2,-0.2 0.877 99.6 62.1 -63.7 -39.4 52.2 37.2 11.5 166 167 A I T <5S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 76,-0.2 0.821 116.6 29.8 -59.1 -32.7 51.1 35.0 14.5 167 168 A T T 45S- 0 0 2 -3,-0.5 -1,-0.2 -4,-0.2 -2,-0.2 0.470 105.4-122.7-105.0 -3.6 49.2 37.9 16.1 168 169 A G T <5 + 0 0 3 -4,-0.9 2,-2.1 -3,-0.4 -3,-0.2 0.848 48.7 167.2 65.2 33.2 48.3 39.6 12.8 169 170 A F < + 0 0 102 -5,-2.0 2,-0.3 -6,-0.1 -1,-0.2 -0.439 41.7 83.0 -82.9 67.1 50.0 42.8 14.1 170 171 A F S S- 0 0 27 -2,-2.1 2,-0.5 -3,-0.1 -35,-0.0 -0.957 86.8 -93.0-158.1 159.1 50.2 44.6 10.8 171 172 A T > > - 0 0 14 -2,-0.3 3,-2.7 -37,-0.1 5,-1.7 -0.711 42.7-114.0 -85.2 126.1 47.7 46.8 8.8 172 173 A K T 3 5S- 0 0 56 -2,-0.5 -1,-0.1 1,-0.3 5,-0.1 -0.410 102.2 -2.7 -59.7 119.9 45.7 44.9 6.3 173 174 A Y T 3 5S+ 0 0 120 -2,-0.2 -1,-0.3 72,-0.2 -31,-0.1 0.695 126.2 84.9 66.8 20.6 46.7 46.2 2.9 174 175 A G T X 5S- 0 0 1 -3,-2.7 3,-1.6 -32,-0.1 -1,-0.1 0.366 115.1 -15.8-112.3-111.8 49.0 48.6 4.7 175 176 A D T 3 5S+ 0 0 71 1,-0.3 -16,-0.3 -3,-0.1 -15,-0.2 0.647 140.1 61.8 -71.5 -10.5 52.5 47.3 5.7 176 177 A G T 3 + 0 0 47 -2,-0.4 3,-0.9 -24,-0.2 -22,-0.1 -0.817 9.9 176.1-118.0 92.0 58.7 38.9 2.3 182 183 A P T 3 S+ 0 0 1 0, 0.0 -1,-0.1 0, 0.0 -23,-0.1 0.564 79.3 55.6 -71.5 -9.7 62.2 37.5 2.8 183 184 A L T > S+ 0 0 3 -25,-0.4 3,-2.1 -23,-0.3 -21,-0.4 0.591 73.2 125.9 -97.6 -12.4 62.0 37.5 6.6 184 185 A Y T < + 0 0 91 -3,-0.9 -23,-0.2 1,-0.2 3,-0.1 -0.263 68.7 35.9 -52.0 126.7 58.9 35.3 6.9 185 186 A R T 3 S+ 0 0 43 1,-0.4 -172,-0.4 -172,-0.0 -1,-0.2 -0.120 93.5 104.1 117.8 -26.4 59.7 32.3 9.2 186 187 A L < - 0 0 3 -3,-2.1 -24,-1.3 -174,-0.1 -23,-0.9 -0.571 60.4-141.0 -86.5 146.0 61.9 34.2 11.7 187 188 A N > - 0 0 2 -25,-0.2 4,-1.4 -2,-0.2 -25,-0.1 -0.424 34.9 -92.8 -94.9 178.3 60.8 35.2 15.2 188 189 A K H >> S+ 0 0 31 1,-0.2 4,-1.3 2,-0.2 3,-0.5 0.940 121.9 43.5 -59.2 -54.9 61.8 38.5 16.8 189 190 A R H 3> S+ 0 0 65 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.843 110.9 57.4 -62.7 -31.2 65.0 37.5 18.7 190 191 A Q H 3> S+ 0 0 2 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.842 100.9 57.2 -68.4 -30.6 66.2 35.5 15.7 191 192 A G H S+ 0 0 0 -4,-1.8 5,-2.5 1,-0.2 3,-0.4 0.894 108.3 52.4 -65.5 -38.6 71.6 41.7 12.6 196 197 A A H ><5S+ 0 0 53 -4,-2.6 3,-1.5 1,-0.2 -1,-0.2 0.917 107.8 52.4 -62.3 -40.7 74.3 40.8 15.1 197 198 A A H 3<5S+ 0 0 39 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.724 107.6 51.9 -66.5 -22.9 75.9 38.5 12.5 198 199 A L T 3<5S- 0 0 29 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.352 116.5-116.6 -93.7 3.6 75.9 41.4 10.0 199 200 A A T < 5 + 0 0 82 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.802 48.9 178.3 65.5 31.6 77.6 43.6 12.6 200 201 A C < - 0 0 7 -5,-2.5 -1,-0.2 1,-0.1 5,-0.1 -0.420 42.7 -92.0 -66.3 136.5 74.6 46.0 12.7 201 202 A P > - 0 0 49 0, 0.0 3,-2.5 0, 0.0 4,-0.3 -0.286 36.3-128.9 -52.6 123.2 75.1 48.9 15.2 202 203 A E G >> S+ 0 0 116 1,-0.3 3,-1.8 2,-0.2 4,-1.1 0.805 102.9 61.8 -43.3 -44.9 73.7 47.6 18.5 203 204 A H G 34 S+ 0 0 99 1,-0.3 -1,-0.3 2,-0.2 -111,-0.0 0.603 91.9 69.9 -64.5 -9.5 71.4 50.7 19.1 204 205 A L G <4 S+ 0 0 7 -3,-2.5 -1,-0.3 1,-0.1 -2,-0.2 0.605 117.0 15.9 -84.1 -12.1 69.5 49.9 15.9 205 206 A Y T <4 0 0 34 -3,-1.8 -2,-0.2 -4,-0.3 -1,-0.1 0.330 360.0 360.0-141.6 5.9 67.9 46.8 17.3 206 207 A K < 0 0 164 -4,-1.1 -1,-0.1 -14,-0.0 -2,-0.1 -0.541 360.0 360.0-132.6 360.0 68.2 46.9 21.1 207 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 208 224 A E 0 0 200 0, 0.0 5,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-152.1 52.8 46.3 24.4 209 225 A V + 0 0 130 3,-0.1 3,-0.1 5,-0.0 0, 0.0 -0.318 360.0 58.7 -62.9 157.9 49.1 46.3 25.4 210 226 A A S S+ 0 0 48 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.835 109.6 46.5 73.9 92.0 47.0 44.9 22.6 211 227 A L S S- 0 0 7 1,-0.1 2,-4.0 23,-0.0 24,-0.1 0.783 89.8-147.9 98.7 69.2 48.8 41.5 22.6 212 228 A G S S+ 0 0 61 -3,-0.1 2,-0.3 22,-0.1 -3,-0.1 -0.013 73.6 78.7 -61.8 40.7 48.7 41.1 26.4 213 229 A V S S- 0 0 10 -2,-4.0 2,-0.1 -5,-0.5 18,-0.0 -0.957 80.0-116.4-145.3 158.2 52.0 39.3 26.0 214 230 A T > - 0 0 77 -2,-0.3 4,-2.0 1,-0.1 3,-0.2 -0.467 32.5-107.4 -92.9 168.6 55.6 40.3 25.4 215 231 A Y H > S+ 0 0 80 1,-0.2 4,-3.1 2,-0.2 -27,-0.2 0.812 121.5 57.8 -64.7 -29.3 57.8 39.5 22.4 216 232 A D H > S+ 0 0 97 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.876 104.6 50.8 -68.4 -35.7 59.7 37.0 24.5 217 233 A N H > S+ 0 0 41 -3,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.935 113.8 45.3 -63.9 -45.7 56.4 35.2 25.2 218 234 A I H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.938 113.7 47.8 -63.8 -47.9 55.7 35.2 21.5 219 235 A D H X S+ 0 0 3 -4,-3.1 4,-1.5 2,-0.2 -2,-0.2 0.923 112.4 49.6 -60.8 -44.0 59.2 34.1 20.5 220 236 A D H <>S+ 0 0 41 -4,-2.5 5,-2.3 2,-0.2 3,-0.4 0.930 111.2 49.6 -59.5 -45.6 59.2 31.3 23.2 221 237 A Y H ><5S+ 0 0 0 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.940 110.7 49.8 -57.8 -48.8 55.8 30.1 21.9 222 238 A L H 3<5S+ 0 0 1 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.743 105.9 57.2 -62.8 -25.2 57.1 30.1 18.3 223 239 A E T 3<5S- 0 0 22 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.391 120.4-108.7 -87.3 3.2 60.1 28.1 19.5 224 240 A G T < 5 + 0 0 44 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.634 66.8 152.0 80.8 16.2 57.9 25.4 20.8 225 241 A K < - 0 0 93 -5,-2.3 2,-0.6 -6,-0.2 -1,-0.2 -0.348 53.9-102.5 -79.6 159.5 58.6 26.1 24.5 226 242 A N + 0 0 154 -2,-0.1 -1,-0.1 6,-0.0 -5,-0.1 -0.722 48.6 176.5 -82.5 116.9 56.2 25.5 27.4 227 243 A V - 0 0 12 -2,-0.6 5,-0.1 1,-0.1 -10,-0.0 -0.785 42.7 -72.5-118.7 164.0 54.6 28.8 28.3 228 244 A P >> - 0 0 85 0, 0.0 4,-2.1 0, 0.0 3,-0.5 -0.266 45.2-124.2 -53.7 141.3 52.0 29.7 30.9 229 245 A Q H 3> S+ 0 0 130 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.860 110.8 55.5 -58.6 -37.6 48.6 28.5 29.7 230 246 A Q H 3> S+ 0 0 108 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.861 109.0 49.3 -63.6 -33.8 47.0 31.9 30.0 231 247 A V H <> S+ 0 0 17 -3,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.906 109.7 50.4 -70.4 -43.3 49.8 33.2 27.7 232 248 A A H X S+ 0 0 4 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.906 109.5 51.7 -61.3 -42.3 49.2 30.4 25.2 233 249 A R H X S+ 0 0 138 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.882 109.0 50.3 -63.0 -39.4 45.5 31.2 25.1 234 250 A T H X S+ 0 0 27 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.950 112.4 45.9 -64.0 -49.1 46.1 34.9 24.5 235 251 A I H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.911 114.6 47.9 -60.4 -43.9 48.5 34.2 21.6 236 252 A E H X S+ 0 0 42 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.855 107.4 56.2 -67.3 -34.4 46.1 31.6 20.1 237 253 A N H X S+ 0 0 100 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.931 109.4 46.4 -62.6 -45.3 43.1 34.0 20.4 238 254 A W H X S+ 0 0 54 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.901 111.6 52.3 -62.2 -43.0 45.0 36.6 18.4 239 255 A Y H < S+ 0 0 20 -4,-2.1 3,-0.3 1,-0.2 -2,-0.2 0.947 113.4 42.3 -58.9 -51.0 46.0 34.0 15.8 240 256 A L H >< S+ 0 0 106 -4,-2.7 3,-1.1 1,-0.2 4,-0.2 0.892 112.5 54.7 -63.5 -41.6 42.4 32.7 15.3 241 257 A K H 3< S+ 0 0 130 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.785 112.3 43.3 -64.3 -28.5 41.0 36.3 15.3 242 258 A T T >X S+ 0 0 6 -4,-1.6 3,-1.5 -3,-0.3 4,-0.5 0.137 70.7 113.2-109.5 22.8 43.3 37.4 12.5 243 259 A E G X4 S+ 0 0 33 -3,-1.1 3,-1.4 1,-0.3 4,-0.3 0.856 72.5 66.7 -60.6 -32.6 43.2 34.5 10.0 244 260 A H G >4 S+ 0 0 67 -3,-0.3 3,-0.6 1,-0.3 -1,-0.3 0.763 95.5 57.4 -60.0 -24.1 41.5 36.9 7.6 245 261 A K G <4 S+ 0 0 61 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.704 105.8 48.6 -79.2 -20.1 44.7 39.0 7.4 246 262 A R G << S+ 0 0 56 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.285 108.4 60.6-103.4 10.0 46.8 36.0 6.3 247 263 A R S < S- 0 0 102 -3,-0.6 3,-0.1 -4,-0.3 0, 0.0 -0.912 88.9 -97.2-133.8 158.3 44.4 34.8 3.5 248 264 A P S S- 0 0 105 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.184 70.9 -56.0 -66.6 169.5 43.0 36.3 0.3 249 265 A P - 0 0 90 0, 0.0 2,-0.2 0, 0.0 -4,-0.0 -0.127 68.1-101.0 -49.1 140.9 39.5 37.9 0.4 250 266 A I - 0 0 92 -3,-0.1 2,-0.2 2,-0.1 -6,-0.0 -0.428 44.5-178.2 -70.9 135.0 36.8 35.5 1.6 251 267 A T > - 0 0 72 -2,-0.2 3,-1.7 -3,-0.1 -1,-0.0 -0.748 46.0 -92.4-125.9 173.9 34.5 33.8 -0.9 252 268 A V T 3 S+ 0 0 133 1,-0.3 -2,-0.1 -2,-0.2 -1,-0.0 0.666 121.6 61.9 -61.8 -14.8 31.6 31.4 -0.9 253 269 A F T 3 S+ 0 0 189 2,-0.0 -1,-0.3 0, 0.0 2,-0.1 0.659 83.4 96.0 -86.7 -16.9 34.1 28.5 -1.2 254 270 A D < + 0 0 45 -3,-1.7 -4,-0.0 1,-0.1 0, 0.0 -0.434 36.4 167.1 -76.2 148.3 35.9 29.2 2.1 255 271 A D > + 0 0 94 -2,-0.1 3,-1.8 2,-0.1 4,-0.4 0.363 51.3 98.5-138.1 -1.4 35.0 27.4 5.3 256 272 A F G > S+ 0 0 47 1,-0.3 3,-1.0 2,-0.2 -13,-0.1 0.829 83.8 56.5 -59.8 -31.3 37.9 28.2 7.6 257 273 A W G 3 S+ 0 0 147 1,-0.2 -1,-0.3 -14,-0.0 -2,-0.1 0.579 96.4 65.7 -77.2 -8.3 35.8 30.9 9.2 258 274 A K G < 0 0 131 -3,-1.8 -1,-0.2 0, 0.0 -2,-0.2 0.539 360.0 360.0 -90.5 -7.1 33.1 28.3 10.0 259 275 A K < 0 0 229 -3,-1.0 -3,-0.0 -4,-0.4 0, 0.0 -0.503 360.0 360.0-106.5 360.0 35.2 26.3 12.5