==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 19-JAN-13 4IU1 . COMPND 2 MOLECULE: ARGINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LEISHMANIA MEXICANA; . AUTHOR E.L.D'ANTONIO,B.ULLMAN,S.C.ROBERTS,U.GAUR DIXIT,M.E.WILSON,Y . 311 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12416.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 233 74.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 46 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.0 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 . 1 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 . 27 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 32.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.3 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 0 0 1 2 0 0 2 1 0 0 1 0 0 0 1 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 1 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 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 1 0 0 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 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 13 A K 0 0 149 0, 0.0 40,-2.3 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 72.1 35.1 4.3 41.7 2 14 A K E -a 41 0A 86 90,-0.4 92,-3.2 38,-0.2 2,-0.4 -0.876 360.0-173.4-109.3 137.3 36.4 2.0 39.0 3 15 A M E -ab 42 94A 0 38,-3.1 40,-1.3 -2,-0.4 2,-0.5 -0.978 14.5-159.7-133.4 142.9 34.2 0.0 36.6 4 16 A S E -ab 43 95A 0 90,-2.7 92,-2.1 -2,-0.4 2,-1.2 -0.981 13.7-149.0-121.5 117.5 34.9 -2.6 33.9 5 17 A I E -ab 44 96A 0 38,-1.7 40,-1.8 -2,-0.5 2,-0.5 -0.743 17.0-152.1 -91.2 96.9 32.1 -3.0 31.4 6 18 A V E -ab 45 97A 0 -2,-1.2 92,-2.4 90,-1.0 2,-0.6 -0.559 3.8-146.8 -72.6 116.9 32.4 -6.7 30.4 7 19 A L E +ab 46 98A 7 38,-2.3 40,-1.0 -2,-0.5 41,-0.3 -0.753 21.7 173.5 -89.6 119.2 31.2 -7.4 26.9 8 20 A A + 0 0 0 90,-2.6 2,-2.0 -2,-0.6 92,-0.5 -0.611 5.5 174.9-128.4 75.4 29.5 -10.8 26.5 9 21 A P + 0 0 14 0, 0.0 2,-0.3 0, 0.0 11,-0.2 -0.446 29.3 144.1 -78.4 68.5 28.0 -11.2 23.0 10 22 A F + 0 0 0 -2,-2.0 91,-2.0 9,-0.2 90,-0.6 -0.845 23.4 164.8-111.4 146.9 26.9 -14.9 23.4 11 23 A S > + 0 0 1 -2,-0.3 3,-1.2 89,-0.2 -1,-0.1 0.242 49.6 102.0-141.2 8.0 23.8 -16.5 21.9 12 24 A G T 3 + 0 0 1 1,-0.3 129,-0.4 61,-0.1 62,-0.1 0.674 68.0 73.4 -71.1 -16.4 24.5 -20.2 22.2 13 25 A G T 3 S+ 0 0 0 128,-0.2 129,-3.3 127,-0.1 130,-0.3 0.406 107.5 24.2 -78.7 6.2 22.3 -20.6 25.3 14 26 A Q S < S- 0 0 2 -3,-1.2 87,-0.1 127,-0.2 125,-0.0 -0.991 80.5-103.0-163.6 165.2 19.2 -20.3 23.1 15 27 A P S S+ 0 0 64 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.936 88.0 75.0 -55.6 -64.1 17.6 -20.6 19.6 16 28 A H - 0 0 92 1,-0.1 3,-0.4 228,-0.1 2,-0.3 -0.309 67.8-145.7 -64.6 136.1 17.4 -17.0 18.2 17 29 A S S S+ 0 0 59 1,-0.2 -1,-0.1 2,-0.1 -6,-0.0 -0.708 71.9 65.4 -98.4 151.6 20.5 -15.3 17.0 18 30 A G > + 0 0 0 -2,-0.3 3,-2.0 261,-0.1 262,-0.2 -0.025 69.0 96.6 128.1 -29.8 20.9 -11.5 17.4 19 31 A V G > S+ 0 0 1 -3,-0.4 3,-1.1 1,-0.3 258,-0.2 0.645 74.3 69.1 -65.4 -16.5 21.1 -11.3 21.2 20 32 A E G 3 S+ 0 0 20 1,-0.2 4,-0.4 -11,-0.2 -1,-0.3 0.546 87.4 68.6 -78.5 -6.5 24.9 -11.3 20.9 21 33 A L G <> S+ 0 0 40 -3,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.536 73.6 93.7 -86.3 -8.9 24.5 -7.8 19.3 22 34 A G H <> S+ 0 0 0 -3,-1.1 4,-2.9 255,-0.3 5,-0.3 0.949 79.3 51.7 -47.5 -64.7 23.4 -6.5 22.7 23 35 A P H > S+ 0 0 1 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.874 112.9 45.4 -40.8 -54.0 26.8 -5.3 23.8 24 36 A D H > S+ 0 0 83 -4,-0.4 4,-2.5 2,-0.2 5,-0.2 0.957 114.3 47.3 -58.1 -54.2 27.4 -3.3 20.6 25 37 A Y H X S+ 0 0 56 -4,-2.4 4,-1.3 2,-0.2 -1,-0.2 0.913 113.3 48.4 -53.7 -49.6 23.9 -1.7 20.6 26 38 A L H ><>S+ 0 0 2 -4,-2.9 5,-1.4 -5,-0.2 3,-1.0 0.963 112.0 49.7 -55.5 -54.1 24.1 -0.8 24.3 27 39 A L H ><5S+ 0 0 27 -4,-2.6 3,-1.4 -5,-0.3 6,-0.3 0.856 109.2 50.6 -56.2 -38.9 27.5 0.8 23.8 28 40 A K H 3<5S+ 0 0 147 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.748 100.4 64.8 -73.6 -18.5 26.4 2.8 20.8 29 41 A Q T <<5S- 0 0 73 -4,-1.3 -1,-0.3 -3,-1.0 -2,-0.2 0.505 127.9-100.3 -77.5 -3.8 23.5 4.0 22.9 30 42 A G T <>5S+ 0 0 12 -3,-1.4 4,-3.0 -4,-0.3 -3,-0.2 0.689 71.1 150.8 94.2 22.1 26.1 5.7 25.1 31 43 A L H > S+ 0 0 41 -5,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.893 113.4 51.6 -62.9 -40.6 30.0 3.9 28.7 33 45 A Q H > S+ 0 0 112 -6,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.915 109.5 52.6 -61.1 -41.2 29.5 7.7 28.4 34 46 A D H X S+ 0 0 28 -4,-3.0 4,-1.5 1,-0.2 -2,-0.2 0.925 107.7 48.5 -60.6 -46.2 26.6 7.3 30.8 35 47 A M H <>S+ 0 0 0 -4,-2.3 5,-3.2 1,-0.2 -1,-0.2 0.837 112.3 50.6 -64.2 -30.8 28.6 5.5 33.4 36 48 A E H ><5S+ 0 0 77 -4,-1.8 3,-2.5 3,-0.2 -2,-0.2 0.943 107.6 52.2 -67.8 -48.4 31.3 8.2 33.0 37 49 A K H 3<5S+ 0 0 177 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.753 105.0 56.5 -57.6 -28.9 28.6 10.9 33.5 38 50 A L T 3<5S- 0 0 36 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.423 129.9-101.5 -83.6 -0.3 27.6 9.0 36.7 39 51 A G T < 5S+ 0 0 43 -3,-2.5 2,-0.6 1,-0.3 -3,-0.2 0.611 73.8 147.0 90.6 14.4 31.2 9.5 37.8 40 52 A W < - 0 0 36 -5,-3.2 2,-1.2 -6,-0.2 -1,-0.3 -0.758 48.0-139.0 -91.9 121.9 32.4 6.0 37.0 41 53 A D E -a 2 0A 95 -40,-2.3 -38,-3.1 -2,-0.6 2,-0.3 -0.648 41.4-170.5 -72.8 100.2 35.9 5.6 35.8 42 54 A T E +a 3 0A 12 -2,-1.2 2,-0.3 -40,-0.2 -38,-0.2 -0.711 26.3 172.2-108.6 155.3 35.1 3.0 33.1 43 55 A R E -a 4 0A 95 -40,-1.3 -38,-1.7 -2,-0.3 2,-0.1 -0.967 30.3-119.9-153.3 136.0 37.0 0.7 30.8 44 56 A L E -a 5 0A 44 -2,-0.3 2,-0.4 -40,-0.2 -38,-0.2 -0.423 16.9-158.9 -78.6 152.0 35.8 -2.1 28.5 45 57 A E E -a 6 0A 31 -40,-1.8 -38,-2.3 -2,-0.1 2,-0.4 -0.928 5.3-160.1-135.0 107.0 36.7 -5.7 28.8 46 58 A R E -a 7 0A 170 -2,-0.4 -38,-0.1 -40,-0.2 3,-0.1 -0.767 10.8-179.0 -91.1 131.1 36.3 -7.9 25.7 47 59 A V - 0 0 27 -40,-1.0 2,-0.3 -2,-0.4 -1,-0.1 0.760 63.6 -15.1 -98.2 -33.0 36.2 -11.7 26.3 48 60 A F S S- 0 0 27 -41,-0.3 2,-0.5 33,-0.0 -1,-0.3 -0.975 75.2 -82.1-168.7 157.9 35.8 -13.0 22.8 49 61 A D > - 0 0 77 -2,-0.3 4,-1.8 1,-0.1 5,-0.2 -0.529 34.6-151.1 -69.4 114.9 35.0 -12.1 19.1 50 62 A G H > S+ 0 0 9 -2,-0.5 4,-1.2 1,-0.2 -1,-0.1 0.846 92.8 44.8 -55.0 -41.8 31.2 -12.1 18.8 51 63 A K H > S+ 0 0 142 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.826 107.6 58.1 -75.0 -32.2 31.1 -13.1 15.1 52 64 A V H > S+ 0 0 84 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.918 108.5 46.3 -63.1 -42.5 33.6 -15.8 15.5 53 65 A V H X S+ 0 0 8 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.841 106.9 57.8 -68.7 -34.4 31.5 -17.5 18.1 54 66 A E H X S+ 0 0 38 -4,-1.2 4,-3.1 1,-0.2 -1,-0.2 0.896 104.8 52.7 -62.0 -39.7 28.3 -17.1 15.9 55 67 A A H X S+ 0 0 59 -4,-1.8 4,-1.8 1,-0.2 5,-0.3 0.936 109.0 48.0 -61.2 -48.2 30.1 -19.0 13.2 56 68 A R H X S+ 0 0 105 -4,-1.6 4,-0.9 1,-0.2 -1,-0.2 0.764 116.1 45.2 -66.0 -25.0 30.9 -21.9 15.5 57 69 A K H < S+ 0 0 11 -4,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.882 108.5 54.5 -83.9 -41.7 27.3 -22.0 16.7 58 70 A A H < S+ 0 0 76 -4,-3.1 -2,-0.2 -5,-0.2 -3,-0.2 0.863 121.0 30.6 -58.7 -38.2 25.7 -21.7 13.3 59 71 A S H < S+ 0 0 85 -4,-1.8 2,-2.4 -5,-0.2 -2,-0.2 0.969 99.8 72.8 -85.3 -68.5 27.6 -24.7 12.0 60 72 A D >< + 0 0 75 -4,-0.9 3,-1.2 -5,-0.3 -1,-0.2 -0.234 44.5 155.2 -55.3 71.6 28.3 -27.2 14.8 61 73 A N T 3 + 0 0 116 -2,-2.4 -1,-0.2 1,-0.2 9,-0.1 0.458 64.5 76.4 -79.1 2.3 24.9 -28.7 15.4 62 74 A G T 3 + 0 0 64 1,-0.1 2,-1.3 7,-0.1 -1,-0.2 0.413 64.1 103.6 -91.0 1.3 26.7 -31.7 16.7 63 75 A D < + 0 0 5 -3,-1.2 7,-3.2 -6,-0.1 2,-0.3 -0.683 55.1 116.8 -87.1 87.7 27.5 -30.0 20.0 64 76 A R E -H 69 0B 115 -2,-1.3 5,-0.2 5,-0.2 3,-0.1 -0.977 47.2-163.9-150.3 160.3 24.9 -31.7 22.3 65 77 A I E > S-H 68 0B 68 3,-1.7 3,-0.6 -2,-0.3 2,-0.5 -0.542 77.9 -48.1-146.3 71.1 24.6 -33.9 25.4 66 78 A G T 3 S- 0 0 61 1,-0.2 68,-0.1 2,-0.1 67,-0.0 -0.885 121.0 -20.7 101.4-128.0 21.0 -35.2 25.5 67 79 A R T 3 S+ 0 0 115 -2,-0.5 2,-0.2 66,-0.3 -1,-0.2 0.672 112.1 109.6 -88.1 -18.0 18.4 -32.4 25.0 68 80 A V E < -H 65 0B 3 -3,-0.6 -3,-1.7 65,-0.2 2,-0.5 -0.405 62.7-147.4 -61.7 121.0 21.0 -29.9 26.1 69 81 A K E -Hi 64 140B 49 70,-2.5 72,-0.5 -2,-0.2 -5,-0.2 -0.817 66.9 -7.2 -99.8 127.7 22.1 -27.8 23.0 70 82 A R S > S+ 0 0 28 -7,-3.2 4,-1.9 -2,-0.5 -1,-0.2 0.905 71.3 158.3 60.7 50.0 25.6 -26.5 22.6 71 83 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.901 72.6 48.7 -69.5 -40.9 27.1 -27.4 26.0 72 84 A R H > S+ 0 0 122 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.969 113.9 45.6 -62.3 -54.4 30.7 -27.3 25.0 73 85 A L H > S+ 0 0 5 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.880 115.2 47.5 -56.9 -41.9 30.4 -24.0 23.3 74 86 A T H X S+ 0 0 2 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.877 112.6 49.9 -68.5 -37.4 28.5 -22.5 26.2 75 87 A A H X S+ 0 0 2 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.919 110.1 49.8 -66.9 -43.7 31.0 -24.0 28.7 76 88 A E H X S+ 0 0 62 -4,-2.9 4,-1.5 2,-0.2 -2,-0.2 0.942 117.1 39.6 -60.0 -52.3 34.0 -22.6 26.8 77 89 A C H X S+ 0 0 1 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.922 113.7 51.6 -66.7 -46.8 32.6 -19.1 26.6 78 90 A T H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.757 107.9 55.8 -64.2 -21.5 31.1 -18.9 30.1 79 91 A E H X S+ 0 0 58 -4,-1.3 4,-2.8 2,-0.2 -1,-0.2 0.903 105.8 49.1 -74.9 -40.5 34.5 -20.0 31.4 80 92 A K H X S+ 0 0 81 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.851 112.8 49.0 -64.3 -34.4 36.2 -17.1 29.7 81 93 A I H X S+ 0 0 0 -4,-1.9 4,-3.2 2,-0.2 5,-0.3 0.921 109.4 51.9 -70.3 -45.1 33.6 -14.8 31.2 82 94 A Y H X S+ 0 0 37 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.975 113.0 44.1 -53.3 -59.8 34.1 -16.4 34.6 83 95 A K H X S+ 0 0 116 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.904 115.2 49.6 -51.9 -47.8 37.9 -15.8 34.4 84 96 A C H X S+ 0 0 8 -4,-2.2 4,-2.4 1,-0.2 3,-0.2 0.966 112.7 44.5 -58.0 -57.4 37.4 -12.3 33.1 85 97 A V H X S+ 0 0 1 -4,-3.2 4,-1.6 1,-0.2 -1,-0.2 0.854 110.3 57.9 -57.2 -35.8 34.9 -11.2 35.7 86 98 A R H X S+ 0 0 86 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.925 109.1 43.2 -61.2 -46.4 37.0 -12.8 38.4 87 99 A R H X S+ 0 0 100 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.930 108.7 58.6 -65.4 -46.4 40.1 -10.6 37.5 88 100 A V H <>S+ 0 0 0 -4,-2.4 5,-2.0 1,-0.2 -1,-0.2 0.826 112.1 41.5 -52.2 -35.9 37.9 -7.5 37.2 89 101 A A H ><5S+ 0 0 11 -4,-1.6 3,-2.3 3,-0.2 -1,-0.2 0.846 108.3 57.6 -81.8 -37.5 36.8 -8.0 40.8 90 102 A E H 3<5S+ 0 0 102 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.809 103.1 57.4 -61.7 -28.1 40.3 -8.9 42.1 91 103 A Q T 3<5S- 0 0 67 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.429 120.2-115.4 -80.6 -0.3 41.3 -5.6 40.6 92 104 A G T < 5S+ 0 0 52 -3,-2.3 -90,-0.4 1,-0.3 2,-0.3 0.801 71.6 134.4 70.4 29.8 38.7 -4.0 42.9 93 105 A R < - 0 0 24 -5,-2.0 -90,-0.3 -6,-0.2 -1,-0.3 -0.821 61.6-111.1-110.8 151.0 36.6 -2.7 40.0 94 106 A F E -b 3 0A 18 -92,-3.2 -90,-2.7 -2,-0.3 2,-0.6 -0.710 31.4-143.6 -82.5 122.5 32.8 -3.0 39.6 95 107 A P E -b 4 0A 5 0, 0.0 177,-1.7 0, 0.0 2,-0.6 -0.784 17.8-176.5 -93.3 117.5 31.9 -5.4 36.8 96 108 A L E -bc 5 272A 0 -92,-2.1 -90,-1.0 -2,-0.6 2,-0.4 -0.949 14.1-160.0-112.5 108.7 28.9 -4.5 34.7 97 109 A T E -bc 6 273A 1 175,-2.4 177,-2.5 -2,-0.6 2,-0.5 -0.793 5.7-162.5 -97.6 132.3 28.3 -7.3 32.2 98 110 A I E -bc 7 274A 3 -92,-2.4 -90,-2.6 -2,-0.4 177,-0.2 -0.952 30.3-119.4-115.2 121.1 26.2 -6.8 29.0 99 111 A G - 0 0 1 175,-2.2 178,-0.2 -2,-0.5 2,-0.2 -0.323 46.9-179.1-100.7-174.0 24.8 -9.9 27.1 100 112 A G S S- 0 0 0 -90,-0.6 176,-2.1 -92,-0.5 177,-0.3 0.498 83.0 -26.3 91.4 143.9 24.1 -11.9 25.3 101 113 A D S > S- 0 0 0 -91,-2.0 3,-1.5 174,-0.2 -1,-0.2 -0.221 73.1 -96.5 -71.8 169.9 21.6 -14.5 26.5 102 114 A H G > S+ 0 0 0 1,-0.3 3,-1.2 2,-0.2 4,-0.1 0.504 109.0 84.4 -67.0 -6.1 21.3 -15.3 30.3 103 115 A S G > S+ 0 0 2 1,-0.3 3,-1.3 2,-0.2 4,-0.3 0.668 77.0 73.1 -70.8 -12.4 23.6 -18.4 30.1 104 116 A I G X> S+ 0 0 0 -3,-1.5 3,-2.0 1,-0.3 4,-1.9 0.805 77.3 75.5 -70.9 -26.2 26.5 -15.9 30.5 105 117 A A H <> S+ 0 0 0 -3,-1.2 4,-2.1 1,-0.3 5,-0.5 0.616 80.4 71.2 -60.8 -11.3 25.5 -15.4 34.1 106 118 A L H <> S+ 0 0 4 -3,-1.3 4,-0.8 2,-0.2 -1,-0.3 0.873 106.9 37.2 -71.1 -34.5 27.1 -18.7 34.8 107 119 A G H <> S+ 0 0 0 -3,-2.0 4,-2.2 -4,-0.3 -2,-0.2 0.904 119.6 48.5 -80.4 -42.6 30.4 -16.9 34.2 108 120 A T H X S+ 0 0 0 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.971 114.7 40.7 -63.1 -59.5 29.3 -13.7 35.9 109 121 A V H X S+ 0 0 1 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.903 116.2 52.3 -56.9 -41.3 27.9 -15.0 39.1 110 122 A A H < S+ 0 0 0 -4,-0.8 4,-0.3 -5,-0.5 -1,-0.2 0.884 111.9 47.5 -62.0 -39.1 30.8 -17.6 39.3 111 123 A G H >X S+ 0 0 0 -4,-2.2 4,-0.6 2,-0.2 3,-0.6 0.920 114.1 44.8 -68.4 -45.0 33.2 -14.7 38.9 112 124 A V H >X S+ 0 0 3 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221 233 A K S S- 0 0 161 1,-0.1 -2,-0.1 2,-0.0 0, 0.0 0.548 105.7-126.0 -60.4 -6.4 23.8 -9.8 58.5 222 234 A G S S+ 0 0 46 -3,-0.2 -1,-0.1 -6,-0.2 -3,-0.1 0.651 97.0 80.4 68.1 15.0 22.5 -6.7 56.5 223 235 A T + 0 0 97 2,-0.1 -1,-0.1 45,-0.0 -4,-0.0 0.478 60.5 124.4-124.4 -14.5 26.1 -6.1 55.4 224 236 A E - 0 0 10 1,-0.1 -105,-0.1 -105,-0.0 2,-0.1 -0.091 65.5-108.3 -56.9 145.9 26.4 -8.6 52.5 225 237 A P - 0 0 20 0, 0.0 -105,-2.9 0, 0.0 2,-0.4 -0.423 35.9-142.1 -70.6 148.8 27.5 -7.6 49.0 226 238 A V E -dg 120 269A 0 42,-3.2 44,-3.8 -107,-0.2 45,-0.9 -0.953 16.6-172.0-122.9 137.8 24.6 -7.7 46.5 227 239 A M E -dg 121 271A 0 -107,-2.0 -105,-3.2 -2,-0.4 2,-0.5 -0.962 6.0-160.5-123.6 141.2 24.7 -8.8 42.9 228 240 A V E -dg 122 272A 0 43,-1.8 45,-2.1 -2,-0.4 2,-0.8 -0.981 7.4-163.3-126.5 124.4 21.8 -8.4 40.4 229 241 A S E -dg 123 273A 0 -107,-2.0 -105,-1.4 -2,-0.5 2,-0.8 -0.931 21.4-158.5-104.2 109.5 21.5 -10.4 37.2 230 242 A Y E -dg 124 274A 0 43,-3.3 45,-2.5 -2,-0.8 2,-0.7 -0.792 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-1,-0.1 -0.721 67.1 155.6-121.4 77.4 10.8 -4.5 26.0 241 253 A P + 0 0 32 0, 0.0 2,-2.0 0, 0.0 -1,-0.1 0.867 56.5 76.5 -71.0 -39.3 9.6 -6.1 22.7 242 254 A A S S+ 0 0 0 45,-0.6 36,-2.2 -5,-0.0 2,-0.3 -0.476 72.0 110.1 -79.0 75.5 13.1 -7.2 21.4 243 255 A T - 0 0 1 -2,-2.0 34,-0.1 38,-0.4 33,-0.0 -0.993 69.6-122.0-147.6 148.7 13.7 -10.2 23.5 244 256 A G S S+ 0 0 12 32,-0.5 -1,-0.1 -2,-0.3 -228,-0.1 0.842 100.8 21.8 -59.7 -43.3 13.9 -14.0 22.9 245 257 A T S S- 0 0 43 31,-0.1 -1,-0.2 2,-0.0 2,-0.1 -0.607 77.1-179.0-132.0 74.7 11.2 -15.3 25.2 246 258 A P - 0 0 67 0, 0.0 2,-0.4 0, 0.0 -12,-0.1 -0.426 5.6-168.0 -75.9 147.3 8.6 -12.6 26.2 247 259 A V - 0 0 36 -14,-0.4 3,-0.1 -12,-0.2 -67,-0.1 -0.999 21.3-119.2-137.8 132.0 5.7 -13.3 28.5 248 260 A R S S+ 0 0 219 -2,-0.4 -12,-0.0 1,-0.2 -13,-0.0 -0.180 88.9 50.4 -65.6 160.2 2.7 -11.0 29.1 249 261 A G S S+ 0 0 45 1,-0.1 -1,-0.2 2,-0.0 3,-0.1 0.838 79.9 151.6 80.1 35.1 2.0 -9.6 32.6 250 262 A G - 0 0 13 1,-0.2 -15,-0.2 -3,-0.1 -1,-0.1 -0.216 51.7 -67.0 -91.6-177.5 5.4 -8.2 33.2 251 263 A L B -j 235 0C 0 -17,-1.8 -15,-2.9 -74,-0.1 -1,-0.2 -0.350 53.8-115.5 -66.5 148.7 6.8 -5.3 35.2 252 264 A S > - 0 0 29 -17,-0.2 4,-3.0 1,-0.1 5,-0.2 -0.416 28.4-105.9 -79.5 163.2 5.9 -1.9 34.0 253 265 A F H > S+ 0 0 88 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.902 123.9 52.7 -56.3 -40.6 8.7 0.4 32.7 254 266 A R H > S+ 0 0 203 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.889 111.3 44.5 -63.4 -40.8 8.3 2.4 36.0 255 267 A E H > S+ 0 0 45 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.898 108.1 58.3 -69.9 -41.7 8.7 -0.8 38.1 256 268 A A H X S+ 0 0 1 -4,-3.0 4,-0.7 1,-0.2 -2,-0.2 0.912 117.4 33.1 -53.3 -45.3 11.6 -2.0 36.1 257 269 A L H X S+ 0 0 23 -4,-1.9 4,-1.9 -5,-0.2 3,-0.3 0.846 113.4 57.2 -81.7 -38.8 13.4 1.2 36.9 258 270 A F H X S+ 0 0 66 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.928 102.5 58.8 -57.7 -43.1 12.1 1.9 40.4 259 271 A L H X S+ 0 0 1 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.872 105.1 50.1 -50.7 -43.0 13.5 -1.6 41.3 260 272 A C H X S+ 0 0 0 -4,-0.7 4,-3.5 -3,-0.3 5,-0.2 0.928 108.1 51.2 -64.6 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5.7-111.0 -12.7 28.8 -5.3 43.7 271 283 A A E - g 0 227A 0 -45,-0.9 -43,-1.8 -177,-0.2 2,-0.3 -0.981 56.3-161.5-165.0 160.5 27.9 -6.4 40.2 272 284 A L E -cg 96 228A 0 -177,-1.7 -175,-2.4 -2,-0.3 2,-0.4 -0.968 3.2-163.8-154.3 133.0 25.2 -6.3 37.5 273 285 A D E -cg 97 229A 0 -45,-2.1 -43,-3.3 -2,-0.3 2,-0.5 -0.939 4.5-165.7-115.3 139.7 24.4 -8.2 34.4 274 286 A V E +cg 98 230A 2 -177,-2.5 -175,-2.2 -2,-0.4 2,-0.2 -0.958 28.8 167.9-126.3 109.0 21.9 -6.8 31.9 275 287 A V E + g 0 231A 0 -45,-2.5 -43,-2.4 -2,-0.5 -42,-0.2 -0.690 31.9 43.9-126.6 175.1 20.8 -9.5 29.5 276 288 A E + 0 0 0 -176,-2.1 2,-0.8 -2,-0.2 -32,-0.5 0.583 58.0 149.9 72.1 19.7 18.5 -10.9 26.8 277 289 A C + 0 0 2 -177,-0.3 -255,-0.3 -258,-0.2 -1,-0.2 -0.724 18.0 178.0 -83.8 111.8 18.5 -7.8 24.5 278 290 A N > - 0 0 2 -36,-2.2 3,-2.3 -2,-0.8 -259,-0.2 -0.796 11.1-176.7-119.2 89.8 18.0 -9.0 20.9 279 291 A P T 3 S+ 0 0 4 0, 0.0 3,-0.4 0, 0.0 -1,-0.2 0.834 83.6 60.2 -48.6 -43.3 17.8 -6.0 18.5 280 292 A L T 3 S+ 0 0 106 1,-0.3 2,-0.3 -262,-0.2 -263,-0.1 0.570 90.8 75.0 -66.8 -6.3 17.1 -8.3 15.5 281 293 A L S < S+ 0 0 60 -3,-2.3 -38,-0.4 -39,-0.1 -1,-0.3 -0.296 81.1 95.4-101.9 47.3 14.0 -9.4 17.3 282 294 A A - 0 0 38 -3,-0.4 3,-0.1 -2,-0.3 -2,-0.0 -0.678 62.5-146.2-126.4-179.1 12.0 -6.3 16.6 283 295 A A S S+ 0 0 82 -2,-0.2 2,-0.2 1,-0.1 -1,-0.1 0.584 81.8 16.6-120.5 -27.9 9.4 -4.9 14.2 284 296 A T S > S- 0 0 63 1,-0.0 4,-1.0 0, 0.0 -1,-0.1 -0.709 82.3 -99.5-134.7-174.6 10.4 -1.2 14.0 285 297 A E H > S+ 0 0 175 -2,-0.2 4,-2.1 2,-0.2 5,-0.1 0.684 123.1 54.4 -82.9 -20.3 13.3 1.1 14.9 286 298 A S H > S+ 0 0 61 2,-0.2 4,-3.0 3,-0.2 5,-0.3 0.757 99.6 61.1 -82.7 -27.2 11.4 2.1 18.1 287 299 A H H > S+ 0 0 61 2,-0.2 4,-1.8 3,-0.2 -45,-0.6 0.952 114.1 35.4 -61.1 -50.4 11.1 -1.6 19.1 288 300 A V H X S+ 0 0 25 -4,-1.0 4,-3.3 2,-0.2 5,-0.3 0.935 119.8 48.9 -68.9 -50.3 14.9 -1.8 19.2 289 301 A N H X S+ 0 0 79 -4,-2.1 4,-2.9 1,-0.2 5,-0.3 0.937 112.5 48.0 -56.9 -49.6 15.5 1.7 20.5 290 302 A D H X S+ 0 0 74 -4,-3.0 4,-1.1 2,-0.2 -1,-0.2 0.924 116.1 45.5 -58.5 -43.5 13.0 1.3 23.2 291 303 A T H X S+ 0 0 1 -4,-1.8 4,-1.9 -5,-0.3 3,-0.3 0.972 117.2 41.0 -64.1 -56.8 14.5 -2.0 24.2 292 304 A I H X S+ 0 0 1 -4,-3.3 4,-2.3 1,-0.2 -2,-0.2 0.877 114.7 51.3 -60.8 -40.8 18.2 -0.9 24.1 293 305 A S H X S+ 0 0 38 -4,-2.9 4,-1.7 -5,-0.3 -1,-0.2 0.771 107.5 55.1 -69.3 -23.5 17.5 2.4 25.8 294 306 A V H X S+ 0 0 6 -4,-1.1 4,-2.0 -3,-0.3 -1,-0.2 0.901 105.6 52.3 -72.8 -39.8 15.7 0.5 28.4 295 307 A G H X S+ 0 0 1 -4,-1.9 4,-1.6 1,-0.2 3,-0.3 0.954 111.4 45.0 -58.9 -49.6 18.9 -1.6 28.9 296 308 A C H X S+ 0 0 2 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.854 109.3 58.4 -62.5 -33.7 20.9 1.6 29.3 297 309 A A H X S+ 0 0 6 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.873 103.6 50.2 -63.4 -39.9 18.2 3.0 31.7 298 310 A I H X S+ 0 0 0 -4,-2.0 4,-2.3 -3,-0.3 -1,-0.2 0.881 111.3 51.6 -65.6 -38.0 18.6 0.0 34.1 299 311 A A H X S+ 0 0 0 -4,-1.6 4,-2.4 -5,-0.2 -2,-0.2 0.954 111.2 44.3 -64.4 -52.0 22.3 0.6 34.0 300 312 A R H <>S+ 0 0 57 -4,-2.6 5,-2.9 1,-0.2 -2,-0.2 0.946 116.8 46.6 -59.8 -47.5 22.1 4.4 34.8 301 313 A C H ><5S+ 0 0 5 -4,-2.5 3,-1.1 1,-0.2 -1,-0.2 0.863 112.8 48.3 -62.7 -39.4 19.5 3.8 37.6 302 314 A M H 3<5S+ 0 0 5 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.891 110.4 54.2 -66.9 -39.0 21.4 0.9 39.1 303 315 A M T 3<5S- 0 0 15 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.194 134.4 -79.5 -82.9 15.4 24.5 3.0 39.1 304 316 A G T < 5S+ 0 0 31 -3,-1.1 -3,-0.2 1,-0.3 2,-0.2 0.282 74.8 149.7 111.3 -13.1 23.0 5.9 40.9 305 317 A E < - 0 0 59 -5,-2.9 2,-0.3 -6,-0.2 -1,-0.3 -0.378 23.8-175.9 -61.5 123.1 21.0 7.9 38.5 306 318 A T - 0 0 65 2,-0.2 4,-0.1 -2,-0.2 -1,-0.0 -0.806 35.2-129.2-119.6 160.5 18.0 9.6 40.2 307 319 A L S S+ 0 0 155 -2,-0.3 2,-0.2 2,-0.1 -1,-0.1 0.754 93.1 33.6 -78.4 -25.7 15.1 11.7 39.1 308 320 A L S S- 0 0 153 1,-0.2 -2,-0.2 -3,-0.0 0, 0.0 -0.453 110.8 -39.1-116.5-168.5 15.8 14.4 41.6 309 321 A Y 0 0 228 -2,-0.2 -1,-0.2 1,-0.1 -2,-0.1 -0.210 360.0 360.0 -56.4 139.4 18.8 16.0 43.3 310 322 A T 0 0 127 -4,-0.1 -1,-0.1 -3,-0.1 -5,-0.0 0.454 360.0 360.0-134.9 360.0 21.6 13.7 44.4 311 ! 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 0.0 312 403 A X 0 0 24 0, 0.0 -172,-0.4 0, 0.0 -169,-0.3 0.000 360.0 360.0 360.0 360.0 12.6 -22.3 29.7