==== 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 HYDROLASE 15-MAR-99 4CEV . COMPND 2 MOLECULE: PROTEIN (ARGINASE); . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CALDOVELOX; . AUTHOR M.C.BEWLEY,P.D.JEFFREY,M.L.PATCHETT,Z.F.KANYO,E.N.BAKER . 1794 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 63647.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1290 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 276 15.4 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 . 133 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 218 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 532 29.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 50 2.8 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 6 6 5 13 6 0 6 0 0 12 6 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 0 6 18 0 18 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 0 0 0 0 6 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 K 0 0 171 0, 0.0 88,-0.1 0, 0.0 40,-0.1 0.000 360.0 360.0 360.0 133.3 42.2 100.7 41.8 2 3 A P - 0 0 43 0, 0.0 88,-3.1 0, 0.0 2,-0.3 -0.237 360.0-132.9 -61.3 150.2 41.4 100.4 38.0 3 4 A I E -ab 42 90A 1 38,-2.0 40,-1.5 86,-0.2 2,-0.4 -0.805 13.8-161.8-111.0 148.7 38.1 98.8 37.0 4 5 A S E -ab 43 91A 0 86,-2.7 88,-2.6 -2,-0.3 2,-0.4 -0.977 11.7-150.2-130.9 115.8 37.3 96.1 34.5 5 6 A I E -ab 44 92A 0 38,-3.5 40,-2.5 -2,-0.4 2,-0.4 -0.719 13.3-176.5 -88.7 132.6 33.8 95.7 33.3 6 7 A I E - b 0 93A 2 86,-1.9 88,-2.7 -2,-0.4 2,-0.4 -0.999 13.5-150.0-129.7 120.2 32.7 92.2 32.2 7 8 A G E -ab 47 94A 0 39,-3.1 41,-2.7 -2,-0.4 88,-0.2 -0.802 7.1-166.7 -92.8 136.9 29.2 91.8 30.8 8 9 A V E - b 0 95A 1 86,-2.7 2,-2.8 -2,-0.4 88,-0.6 -0.845 6.0-161.3-125.1 90.3 27.5 88.4 31.3 9 10 A P + 0 0 31 0, 0.0 2,-0.4 0, 0.0 11,-0.2 -0.344 35.7 156.5 -71.0 67.6 24.4 88.3 29.0 10 11 A M + 0 0 0 -2,-2.8 87,-1.6 9,-0.3 86,-0.5 -0.791 23.7 146.1-105.1 134.1 22.8 85.5 31.0 11 12 A D > + 0 0 24 -2,-0.4 3,-1.3 85,-0.2 -1,-0.1 0.284 55.9 92.8-139.3 1.6 19.1 84.5 31.2 12 13 A L T 3 S+ 0 0 16 1,-0.3 125,-0.4 85,-0.1 58,-0.2 0.496 72.1 73.2 -75.9 -6.7 19.4 80.8 31.6 13 14 A G T 3 S+ 0 0 0 124,-0.1 125,-3.3 123,-0.1 126,-0.3 0.567 113.8 7.2 -83.2 -9.3 19.3 81.1 35.3 14 15 A Q S < S- 0 0 3 -3,-1.3 123,-0.1 123,-0.2 83,-0.1 -0.841 78.7-104.3-152.9-170.5 15.6 81.9 35.1 15 16 A T S S+ 0 0 86 -2,-0.2 2,-0.6 2,-0.1 -3,-0.1 0.621 80.2 93.9-106.8 -15.5 12.6 82.0 32.7 16 17 A R > - 0 0 115 -5,-0.0 3,-0.7 1,-0.0 -2,-0.1 -0.711 69.9-137.8 -81.7 121.8 11.9 85.6 31.8 17 18 A R T 3 S+ 0 0 116 -2,-0.6 -2,-0.1 1,-0.2 257,-0.1 -0.361 77.3 53.9 -76.1 157.8 13.7 86.5 28.6 18 19 A G T > + 0 0 3 255,-0.1 3,-2.6 256,-0.1 -1,-0.2 0.038 69.9 102.8 110.0 -27.7 15.5 89.8 28.3 19 20 A V G X S+ 0 0 1 -3,-0.7 3,-1.1 1,-0.3 -9,-0.3 0.672 73.4 70.0 -64.0 -14.1 17.7 89.8 31.4 20 21 A D G 3 S+ 0 0 55 1,-0.2 -1,-0.3 -11,-0.2 4,-0.2 0.583 90.2 62.0 -75.9 -11.6 20.5 88.9 29.0 21 22 A M G <> S+ 0 0 90 -3,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.421 76.4 95.9 -92.0 -1.1 20.2 92.5 27.7 22 23 A G H <> S+ 0 0 0 -3,-1.1 4,-2.3 249,-0.3 74,-0.2 0.867 75.9 56.5 -57.8 -44.3 21.1 93.9 31.1 23 24 A P H > S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.927 114.4 37.9 -56.4 -46.2 24.8 94.5 30.3 24 25 A S H > S+ 0 0 39 -4,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.796 111.0 59.8 -77.5 -24.0 24.2 96.7 27.3 25 26 A A H X S+ 0 0 8 -4,-1.9 4,-1.0 2,-0.2 -1,-0.2 0.913 111.1 42.2 -68.1 -40.9 21.2 98.4 29.0 26 27 A M H <>S+ 0 0 0 -4,-2.3 5,-1.4 2,-0.2 -2,-0.2 0.838 112.5 52.1 -73.4 -36.3 23.6 99.5 31.7 27 28 A R H ><5S+ 0 0 37 -4,-1.8 3,-1.8 1,-0.2 5,-0.3 0.950 112.2 47.2 -62.4 -45.9 26.3 100.4 29.2 28 29 A Y H 3<5S+ 0 0 189 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.762 102.8 62.6 -66.5 -24.9 23.7 102.5 27.4 29 30 A A T 3<5S- 0 0 28 -4,-1.0 -1,-0.3 -5,-0.1 -2,-0.2 0.463 126.0-104.5 -78.8 2.0 22.7 103.9 30.8 30 31 A G T <>5 + 0 0 8 -3,-1.8 4,-2.2 -5,-0.1 -3,-0.2 0.841 63.5 156.4 83.3 39.7 26.2 105.3 30.8 31 32 A V H > S+ 0 0 29 -5,-0.3 4,-2.5 2,-0.2 5,-0.2 0.963 113.0 45.8 -68.0 -52.0 31.6 104.0 31.6 33 34 A E H > S+ 0 0 90 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.916 111.5 54.0 -56.1 -46.4 31.1 107.7 31.5 34 35 A R H < S+ 0 0 55 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.896 114.5 39.5 -55.4 -47.5 29.9 107.8 35.0 35 36 A L H <>S+ 0 0 0 -4,-1.8 5,-1.6 1,-0.2 3,-0.3 0.767 110.1 58.4 -77.1 -29.1 33.0 106.0 36.4 36 37 A E H ><5S+ 0 0 104 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.881 99.6 59.9 -67.3 -36.8 35.4 107.9 34.2 37 38 A R T 3<5S+ 0 0 149 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.777 96.8 59.7 -60.7 -29.3 34.1 111.1 35.7 38 39 A L T 3 5S- 0 0 41 -4,-0.5 -1,-0.3 -3,-0.3 -2,-0.2 0.200 125.5-107.4 -84.1 14.6 35.3 109.8 39.1 39 40 A H T < 5 + 0 0 180 -3,-2.0 -3,-0.2 1,-0.2 2,-0.2 0.764 67.2 156.2 66.4 30.4 38.7 109.7 37.5 40 41 A Y < - 0 0 67 -5,-1.6 2,-1.3 1,-0.0 -1,-0.2 -0.553 52.6-126.8 -89.4 152.3 38.8 105.9 37.2 41 42 A D - 0 0 92 -2,-0.2 -38,-2.0 -40,-0.1 2,-0.4 -0.827 45.2-177.5 -92.4 86.4 40.9 103.8 34.8 42 43 A I E -a 3 0A 20 -2,-1.3 2,-0.4 -40,-0.2 -38,-0.2 -0.798 9.7-174.1 -95.0 139.0 37.8 102.0 33.6 43 44 A E E -a 4 0A 51 -40,-1.5 -38,-3.5 -2,-0.4 2,-0.7 -0.997 16.5-146.6-133.0 135.6 38.1 99.2 31.0 44 45 A D E -a 5 0A 64 -2,-0.4 -38,-0.2 -40,-0.2 3,-0.1 -0.858 11.0-176.3-108.8 107.0 35.4 97.2 29.2 45 46 A L E - 0 0 78 -40,-2.5 -39,-0.1 -2,-0.7 -1,-0.1 0.216 40.7-129.2 -82.6 16.6 36.4 93.6 28.5 46 47 A G E - 0 0 28 -41,-0.2 -39,-3.1 -40,-0.1 2,-0.3 -0.314 43.0 -35.7 72.5-154.1 33.1 93.0 26.6 47 48 A D E -a 7 0A 66 -41,-0.2 -39,-0.2 -3,-0.1 -41,-0.0 -0.825 48.4-114.7-114.4 150.6 30.8 90.0 27.3 48 49 A I - 0 0 13 -41,-2.7 2,-0.4 -2,-0.3 25,-0.1 -0.581 40.7-114.3 -76.9 130.9 31.1 86.4 28.2 49 50 A P - 0 0 89 0, 0.0 2,-0.5 0, 0.0 27,-0.1 -0.580 33.9-159.8 -71.5 123.1 29.9 84.1 25.4 50 51 A I - 0 0 41 -2,-0.4 2,-0.3 -41,-0.1 20,-0.1 -0.906 7.6-137.8-108.0 132.6 26.8 82.3 26.6 51 52 A G - 0 0 37 -2,-0.5 2,-0.2 18,-0.3 22,-0.1 -0.636 26.2-105.0 -88.8 145.8 25.6 79.1 25.0 52 53 A K - 0 0 193 -2,-0.3 2,-0.2 1,-0.1 -1,-0.1 -0.472 44.1-109.2 -67.7 137.5 22.0 78.4 24.3 53 54 A A - 0 0 19 -2,-0.2 3,-0.1 1,-0.1 -1,-0.1 -0.462 26.9-108.5 -76.1 141.5 20.5 75.9 26.7 54 55 A E - 0 0 64 -2,-0.2 12,-0.2 1,-0.1 -1,-0.1 -0.304 51.7 -89.6 -59.9 145.6 19.6 72.4 25.6 55 56 A R > - 0 0 187 1,-0.1 4,-1.5 11,-0.0 3,-0.5 -0.373 34.7-113.3 -68.6 138.4 15.8 72.0 25.6 56 57 A L T 4 S+ 0 0 104 1,-0.2 -1,-0.1 2,-0.2 -2,-0.1 0.766 107.6 65.5 -32.0 -48.1 14.2 70.8 28.8 57 58 A H T 4 S+ 0 0 174 1,-0.2 -1,-0.2 5,-0.0 5,-0.0 0.924 112.9 25.1 -45.6 -69.9 13.2 67.5 27.3 58 59 A E T 4 S+ 0 0 151 -3,-0.5 -1,-0.2 0, 0.0 -2,-0.2 0.588 107.2 103.4 -77.7 -10.2 16.5 65.7 26.6 59 60 A Q S < S- 0 0 13 -4,-1.5 3,-0.1 1,-0.1 6,-0.1 -0.346 72.8-130.6 -69.5 152.8 18.0 67.9 29.4 60 61 A G S S+ 0 0 74 1,-0.2 2,-0.4 4,-0.1 -1,-0.1 0.993 74.4 33.4 -70.8 -85.0 18.6 66.3 32.7 61 62 A D - 0 0 50 3,-0.3 6,-0.3 1,-0.1 -1,-0.2 -0.678 41.3-173.5 -87.9 126.5 17.3 68.0 35.9 62 63 A S S S+ 0 0 74 -2,-0.4 3,-0.5 1,-0.2 -1,-0.1 0.598 98.1 58.9 -83.2 -16.1 14.1 70.1 35.9 63 64 A R S S+ 0 0 99 1,-0.3 72,-0.2 73,-0.0 -1,-0.2 0.559 114.7 37.8 -84.4 -13.3 15.3 71.0 39.4 64 65 A L S > S- 0 0 3 -3,-0.1 3,-1.4 70,-0.1 -3,-0.3 -0.595 88.3-163.9-137.3 69.4 18.4 72.3 37.7 65 66 A R T 3 S- 0 0 67 70,-2.3 72,-0.4 -3,-0.5 -3,-0.1 -0.287 72.1 -1.3 -59.7 138.1 17.2 73.9 34.5 66 67 A N T 3> S+ 0 0 13 -12,-0.2 4,-2.7 -5,-0.1 5,-0.3 0.739 82.5 160.7 53.0 31.8 19.8 74.7 31.8 67 68 A L H <> + 0 0 23 -3,-1.4 4,-2.8 -6,-0.3 5,-0.2 0.839 66.2 46.8 -50.9 -47.9 22.5 73.3 34.2 68 69 A K H > S+ 0 0 157 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.955 114.9 44.2 -66.3 -44.7 25.2 72.7 31.6 69 70 A A H > S+ 0 0 18 2,-0.2 4,-2.3 1,-0.2 -18,-0.3 0.898 117.8 46.7 -64.8 -40.6 24.9 76.1 29.8 70 71 A V H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.928 114.0 47.4 -66.0 -45.2 24.8 77.9 33.1 71 72 A A H X S+ 0 0 11 -4,-2.8 4,-1.1 -5,-0.3 -2,-0.2 0.910 113.6 47.8 -64.7 -40.4 27.7 75.9 34.5 72 73 A E H X S+ 0 0 102 -4,-2.9 4,-2.0 2,-0.2 3,-0.3 0.911 110.2 50.4 -68.1 -41.6 29.8 76.5 31.3 73 74 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.3 -1,-0.2 0.907 110.0 51.2 -62.7 -41.5 29.1 80.2 31.2 74 75 A N H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -1,-0.3 0.762 105.1 57.6 -67.4 -24.7 30.1 80.5 34.8 75 76 A E H X S+ 0 0 68 -4,-1.1 4,-1.9 -3,-0.3 -1,-0.2 0.944 109.6 43.6 -69.1 -47.2 33.3 78.7 34.0 76 77 A K H X S+ 0 0 76 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.910 114.1 51.0 -63.2 -43.8 34.2 81.2 31.4 77 78 A L H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.922 107.3 53.4 -59.9 -45.7 33.2 84.1 33.8 78 79 A A H X S+ 0 0 4 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.908 110.6 47.4 -56.9 -42.1 35.3 82.7 36.6 79 80 A A H X S+ 0 0 59 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.949 112.4 48.1 -64.8 -48.5 38.3 82.6 34.3 80 81 A A H X S+ 0 0 27 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.904 115.3 45.5 -57.9 -45.1 37.7 86.2 33.0 81 82 A V H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.845 109.4 55.9 -67.0 -37.6 37.2 87.5 36.6 82 83 A D H X S+ 0 0 27 -4,-2.2 4,-2.3 -5,-0.3 -2,-0.2 0.914 107.7 48.1 -63.0 -44.9 40.3 85.5 37.9 83 84 A Q H X S+ 0 0 113 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.895 108.7 53.7 -64.6 -40.2 42.5 87.2 35.3 84 85 A V H <>S+ 0 0 2 -4,-1.6 5,-2.4 2,-0.2 -1,-0.2 0.924 110.7 46.8 -59.5 -45.9 41.2 90.7 36.1 85 86 A V H ><5S+ 0 0 24 -4,-2.0 3,-2.2 1,-0.2 -1,-0.2 0.942 110.2 53.3 -63.0 -43.5 42.0 90.2 39.8 86 87 A Q H 3<5S+ 0 0 126 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.854 103.7 57.2 -60.2 -34.2 45.4 88.8 38.9 87 88 A R T 3<5S- 0 0 111 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.381 121.5-108.9 -77.3 3.7 46.0 92.0 36.8 88 89 A G T < 5S+ 0 0 34 -3,-2.2 2,-0.2 1,-0.3 -3,-0.2 0.685 77.3 129.0 78.4 18.1 45.4 94.1 40.0 89 90 A R < - 0 0 26 -5,-2.4 -1,-0.3 -6,-0.2 -86,-0.2 -0.639 63.4-110.2-107.3 163.7 42.1 95.4 38.8 90 91 A F E -b 3 0A 18 -88,-3.1 -86,-2.7 -2,-0.2 2,-0.6 -0.806 30.9-134.8 -90.5 124.4 38.6 95.6 40.3 91 92 A P E -b 4 0A 2 0, 0.0 175,-2.0 0, 0.0 2,-0.6 -0.744 21.4-175.6 -87.0 119.8 36.1 93.2 38.6 92 93 A L E -bc 5 266A 0 -88,-2.6 -86,-1.9 -2,-0.6 2,-0.4 -0.950 10.3-165.2-115.1 102.9 32.8 94.9 38.0 93 94 A V E -bc 6 267A 0 173,-2.5 175,-2.0 -2,-0.6 2,-0.5 -0.796 3.6-160.9 -94.0 130.1 30.4 92.2 36.6 94 95 A L E -bc 7 268A 0 -88,-2.7 -86,-2.7 -2,-0.4 175,-0.2 -0.947 30.6-108.2-114.4 121.7 27.2 93.3 34.9 95 96 A G E +b 8 0A 0 173,-2.6 176,-0.2 -2,-0.5 2,-0.1 -0.355 47.0 170.2-101.0-175.3 24.4 90.8 34.4 96 97 A G S S- 0 0 0 -88,-0.6 174,-2.9 -86,-0.5 175,-0.3 0.538 80.5 -27.3 94.6 144.0 22.4 88.9 33.5 97 98 A D S > S- 0 0 0 -87,-1.6 3,-1.6 172,-0.2 -1,-0.2 -0.271 72.9 -94.5 -74.1 171.0 20.4 86.9 36.1 98 99 A H G > S+ 0 0 0 1,-0.3 3,-2.1 2,-0.1 4,-0.3 0.595 109.0 84.8 -63.2 -12.4 21.8 86.1 39.5 99 100 A S G > S+ 0 0 0 1,-0.3 3,-1.1 2,-0.2 4,-0.4 0.680 76.8 72.8 -64.8 -14.3 23.2 82.7 38.6 100 101 A I G X> S+ 0 0 0 -3,-1.6 4,-2.2 1,-0.2 3,-0.5 0.674 74.5 79.8 -73.1 -16.0 26.3 84.5 37.4 101 102 A A H <> S+ 0 0 0 -3,-2.1 4,-2.5 1,-0.2 5,-0.3 0.830 83.8 65.5 -59.0 -29.0 27.3 85.2 41.0 102 103 A I H <> S+ 0 0 2 -3,-1.1 4,-1.2 -4,-0.3 -1,-0.2 0.937 107.2 37.9 -58.8 -46.0 28.5 81.6 40.8 103 104 A G H <> S+ 0 0 0 -3,-0.5 4,-1.2 -4,-0.4 -2,-0.2 0.884 114.8 53.6 -73.8 -39.3 31.2 82.5 38.3 104 105 A T H >X S+ 0 0 0 -4,-2.2 4,-1.3 1,-0.2 3,-0.8 0.959 113.0 42.4 -60.7 -52.6 32.1 85.9 39.8 105 106 A L H 3X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 5,-0.3 0.803 109.2 60.7 -64.5 -28.6 32.7 84.5 43.3 106 107 A A H 3< S+ 0 0 0 -4,-1.2 4,-0.4 -5,-0.3 -1,-0.2 0.777 109.8 41.1 -69.6 -27.5 34.6 81.5 41.7 107 108 A G H << S+ 0 0 0 -4,-1.2 -1,-0.2 -3,-0.8 -2,-0.2 0.696 122.8 38.2 -92.7 -19.7 37.1 83.9 40.2 108 109 A V H >< S+ 0 0 1 -4,-1.3 3,-2.1 -5,-0.2 -2,-0.2 0.883 103.7 62.3 -95.4 -50.8 37.5 86.2 43.2 109 110 A A G >< S+ 0 0 5 -4,-2.2 3,-2.9 1,-0.3 6,-0.1 0.851 91.4 65.7 -48.2 -46.2 37.3 84.0 46.3 110 111 A K G 3 S+ 0 0 93 -4,-0.4 -1,-0.3 -5,-0.3 -2,-0.1 0.755 98.8 59.1 -51.0 -22.2 40.5 82.0 45.5 111 112 A H G < S+ 0 0 63 -3,-2.1 2,-0.4 -4,-0.1 -1,-0.3 0.334 100.0 65.7 -89.6 4.6 42.3 85.3 45.9 112 113 A Y < - 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0 0 9 -5,-1.8 2,-0.3 -6,-0.2 -1,-0.2 -0.617 31.5-118.9 -80.1 132.5 23.8 83.4 57.9 190 191 A K E +f 169 0A 58 -22,-1.3 -20,-2.5 -25,-0.5 2,-0.4 -0.563 42.6 179.5 -70.3 131.2 23.5 87.0 59.0 191 192 A I E -f 170 0A 32 -2,-0.3 2,-0.6 -22,-0.2 -20,-0.2 -0.987 30.6-167.2-147.0 135.0 20.4 88.6 57.5 192 193 A Y E -f 171 0A 11 -22,-2.9 -20,-2.0 -2,-0.4 -19,-0.9 -0.923 20.3-172.7-117.9 97.3 18.5 91.8 57.5 193 194 A T E >> -f 173 0A 4 -2,-0.6 4,-1.9 -21,-0.2 3,-0.6 -0.284 49.0 -87.0 -77.0 177.7 15.0 91.3 56.0 194 195 A M H 3> S+ 0 0 7 -21,-2.1 4,-3.1 1,-0.2 5,-0.2 0.775 127.4 66.0 -60.1 -23.0 12.8 94.3 55.4 195 196 A H H 3> S+ 0 0 26 -22,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.935 105.0 41.6 -62.6 -48.0 11.6 94.0 59.0 196 197 A E H <>>S+ 0 0 59 -3,-0.6 4,-3.4 2,-0.2 5,-0.8 0.845 113.9 53.1 -68.1 -34.0 15.0 94.9 60.3 197 198 A V H X5S+ 0 0 2 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.946 114.8 41.2 -66.7 -43.0 15.4 97.6 57.7 198 199 A D H <5S+ 0 0 34 -4,-3.1 603,-0.3 -5,-0.2 -2,-0.2 0.897 122.5 41.6 -69.1 -38.6 12.1 99.1 58.7 199 200 A R H <5S+ 0 0 63 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.924 129.3 23.3 -76.9 -48.0 12.9 98.6 62.4 200 201 A L H <5S- 0 0 47 -4,-3.4 4,-0.4 -5,-0.2 -3,-0.2 0.783 104.5-122.6 -89.5 -32.1 16.5 99.6 62.6 201 202 A G X< - 0 0 27 -4,-1.6 4,-2.1 -5,-0.8 3,-0.4 0.191 26.4 -88.4 96.0 143.7 16.9 101.8 59.6 202 203 A M H > S+ 0 0 7 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.820 123.7 60.2 -54.3 -34.9 19.3 101.4 56.7 203 204 A T H > S+ 0 0 24 294,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.939 109.2 40.2 -60.8 -50.8 22.0 103.4 58.5 204 205 A R H > S+ 0 0 124 -4,-0.4 4,-2.6 -3,-0.4 5,-0.2 0.858 114.3 53.7 -66.8 -37.3 22.2 101.0 61.4 205 206 A V H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.934 113.5 43.0 -62.2 -44.7 21.9 97.9 59.2 206 207 A M H X S+ 0 0 2 -4,-2.7 4,-3.0 2,-0.2 5,-0.3 0.887 113.1 51.6 -70.2 -38.9 24.8 99.2 57.1 207 208 A E H X S+ 0 0 101 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.943 114.5 43.1 -60.8 -49.6 26.9 100.2 60.1 208 209 A E H X S+ 0 0 64 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.882 115.3 50.5 -64.1 -39.1 26.4 96.8 61.7 209 210 A T H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 5,-0.3 0.924 112.4 45.0 -65.1 -47.2 27.0 95.1 58.4 210 211 A I H X S+ 0 0 17 -4,-3.0 4,-2.4 1,-0.2 5,-0.2 0.906 114.6 47.7 -66.7 -42.0 30.2 96.9 57.6 211 212 A A H X S+ 0 0 56 -4,-2.3 4,-1.6 -5,-0.3 -1,-0.2 0.928 111.3 52.3 -65.0 -43.2 31.6 96.5 61.1 212 213 A Y H < S+ 0 0 40 -4,-2.3 4,-0.2 -5,-0.2 -2,-0.2 0.939 116.5 36.6 -57.5 -54.9 30.7 92.8 61.1 213 214 A L H >X S+ 0 0 0 -4,-2.2 3,-2.2 1,-0.2 4,-1.3 0.921 112.9 57.4 -67.6 -43.8 32.5 91.9 57.9 214 215 A K H 3< S+ 0 0 118 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.834 102.9 58.0 -58.5 -29.0 35.4 94.3 58.4 215 216 A E T 3< S+ 0 0 148 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.527 122.9 17.9 -80.2 -5.4 36.1 92.5 61.6 216 217 A R T <4 S+ 0 0 83 -3,-2.2 2,-0.3 -4,-0.2 -2,-0.2 0.329 107.5 71.1-152.0 16.0 36.6 89.1 60.0 217 218 A T < - 0 0 20 -4,-1.3 -102,-0.2 -3,-0.2 3,-0.1 -0.862 52.1-151.6-131.0 166.3 37.2 89.3 56.2 218 219 A D S S+ 0 0 64 -104,-2.2 2,-0.3 1,-0.4 -103,-0.2 0.322 86.4 13.2-119.2 6.7 40.0 90.3 54.0 219 220 A G E -d 115 0A 4 -105,-0.7 -103,-3.1 -6,-0.1 2,-0.4 -0.896 68.2-143.6-174.0 144.4 38.0 91.3 51.0 220 221 A V E -dg 116 263A 2 42,-1.0 44,-2.7 -2,-0.3 45,-1.2 -0.986 5.0-154.8-127.0 127.1 34.2 91.9 50.4 221 222 A H E -dg 117 265A 0 -105,-2.9 -103,-2.3 -2,-0.4 2,-0.7 -0.874 10.0-148.6 -99.1 124.7 32.2 91.1 47.3 222 223 A L E -dg 118 266A 0 43,-2.7 45,-2.1 -2,-0.5 2,-0.9 -0.833 11.9-173.4 -93.3 111.7 29.0 93.1 46.7 223 224 A S E -dg 119 267A 0 -105,-2.8 -103,-1.7 -2,-0.7 2,-0.7 -0.843 12.0-171.7-106.7 92.8 26.4 91.1 44.9 224 225 A L E -dg 120 268A 0 43,-2.7 45,-2.7 -2,-0.9 2,-0.6 -0.796 10.4-168.1 -96.4 112.8 23.7 93.6 44.2 225 226 A D E > - g 0 269A 0 -105,-2.9 3,-2.1 -2,-0.7 4,-0.2 -0.852 18.3-143.9 -95.5 120.6 20.4 92.3 42.8 226 227 A L G > S+ 0 0 0 43,-2.1 3,-1.7 -2,-0.6 -1,-0.1 0.722 95.8 70.2 -57.3 -23.3 18.3 95.2 41.5 227 228 A D G 3 S+ 0 0 1 1,-0.3 14,-0.4 42,-0.2 -1,-0.3 0.489 77.9 81.5 -73.7 -1.2 15.0 93.4 42.7 228 229 A G G < S+ 0 0 0 -3,-2.1 17,-1.9 -108,-0.3 -1,-0.3 0.686 85.3 71.6 -71.8 -23.3 16.3 94.3 46.2 229 230 A L B < S-h 245 0B 1 -3,-1.7 12,-0.3 15,-0.2 17,-0.2 -0.563 107.2 -84.6 -87.6 160.2 14.8 97.7 45.5 230 231 A D >> - 0 0 31 15,-2.9 4,-3.1 -2,-0.2 3,-1.8 -0.375 35.4-118.6 -65.0 141.8 11.1 98.2 45.3 231 232 A P T 34 S+ 0 0 29 0, 0.0 -1,-0.1 0, 0.0 11,-0.1 0.695 115.6 61.6 -54.5 -19.1 9.5 97.4 42.0 232 233 A S T 34 S+ 0 0 69 2,-0.2 14,-0.1 1,-0.1 -2,-0.0 0.796 113.8 33.5 -76.3 -31.6 8.4 101.1 41.9 233 234 A D T <4 S+ 0 0 38 -3,-1.8 51,-0.2 1,-0.2 -1,-0.1 0.819 135.7 26.4 -88.8 -38.6 12.0 102.2 41.9 234 235 A A < + 0 0 0 -4,-3.1 -1,-0.2 1,-0.1 -2,-0.2 -0.666 69.0 160.2-126.8 75.8 13.4 99.2 39.9 235 236 A P + 0 0 22 0, 0.0 2,-1.9 0, 0.0 -1,-0.1 0.814 56.9 81.1 -66.3 -32.2 10.5 97.9 37.7 236 237 A G + 0 0 0 41,-0.1 36,-2.9 -10,-0.0 2,-0.3 -0.397 65.8 111.1 -79.5 65.0 12.7 96.1 35.2 237 238 A V - 0 0 4 -2,-1.9 34,-0.1 38,-0.3 33,-0.1 -0.969 63.7-135.3-134.9 148.2 13.3 92.8 37.1 238 239 A G S S+ 0 0 6 32,-0.4 -1,-0.1 -2,-0.3 33,-0.1 0.836 100.6 30.6 -72.8 -38.2 12.1 89.3 36.4 239 240 A T S S+ 0 0 36 31,-0.1 -1,-0.2 -223,-0.1 2,-0.0 -0.586 81.7 178.4-123.6 71.1 11.0 88.3 39.9 240 241 A P - 0 0 62 0, 0.0 2,-0.4 0, 0.0 -10,-0.1 -0.316 10.8-164.1 -71.3 154.4 9.9 91.5 41.6 241 242 A V - 0 0 30 -14,-0.4 3,-0.1 -12,-0.3 -66,-0.1 -0.994 19.9-122.5-140.4 126.9 8.6 91.5 45.2 242 243 A I S S+ 0 0 106 -2,-0.4 -12,-0.0 1,-0.2 0, 0.0 -0.255 84.9 46.1 -71.0 163.6 6.7 94.5 46.7 243 244 A G S S+ 0 0 9 1,-0.1 -1,-0.2 2,-0.0 2,-0.1 0.942 82.3 151.5 72.6 49.3 7.7 96.4 49.8 244 245 A G - 0 0 2 1,-0.2 -15,-0.2 -3,-0.1 -14,-0.2 -0.306 48.8 -63.6-103.7-172.8 11.4 96.8 48.9 245 246 A L B -h 229 0B 0 -17,-1.9 -15,-2.9 -73,-0.2 -12,-0.2 -0.320 54.6-121.2 -68.2 150.8 14.3 99.2 49.6 246 247 A T > - 0 0 51 -17,-0.2 4,-1.9 1,-0.1 5,-0.1 -0.391 20.7-106.8 -90.8 172.2 14.0 102.7 48.2 247 248 A Y H > S+ 0 0 42 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.934 121.9 46.7 -59.8 -49.5 16.2 104.6 45.8 248 249 A R H > S+ 0 0 30 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.893 109.2 52.7 -63.1 -43.4 17.6 106.7 48.6 249 250 A E H > S+ 0 0 30 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.877 109.9 51.0 -60.4 -38.3 18.2 103.7 50.9 250 251 A S H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.875 110.8 46.9 -66.9 -40.2 20.2 102.1 48.1 251 252 A H H X S+ 0 0 22 -4,-1.9 4,-3.1 2,-0.2 -2,-0.2 0.934 111.0 51.5 -68.6 -42.6 22.3 105.2 47.6 252 253 A L H X S+ 0 0 3 -4,-2.7 4,-3.0 1,-0.2 -2,-0.2 0.929 110.4 50.4 -57.7 -45.4 23.0 105.6 51.3 253 254 A A H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.931 113.3 44.0 -56.5 -51.9 24.1 102.0 51.4 254 255 A M H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.888 114.2 51.4 -62.0 -40.6 26.5 102.4 48.5 255 256 A E H X S+ 0 0 26 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.923 109.9 48.6 -63.6 -43.8 27.7 105.7 49.9 256 257 A M H X S+ 0 0 2 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.790 112.3 48.6 -68.5 -27.6 28.4 104.1 53.3 257 258 A L H X>S+ 0 0 2 -4,-1.6 4,-1.6 2,-0.2 5,-0.8 0.899 108.4 53.8 -77.4 -42.3 30.3 101.2 51.6 258 259 A A H ><5S+ 0 0 25 -4,-2.5 3,-0.7 1,-0.2 -2,-0.2 0.959 111.0 47.2 -53.3 -50.3 32.3 103.6 49.5 259 260 A E H 3<5S+ 0 0 112 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.877 109.1 53.7 -58.2 -42.8 33.3 105.3 52.8 260 261 A A H 3<5S- 0 0 16 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.736 93.1-148.9 -67.0 -25.8 34.1 102.0 54.5 261 262 A Q T <<5 + 0 0 177 -4,-1.6 -3,-0.1 -3,-0.7 -2,-0.1 0.892 60.0 119.5 55.5 44.1 36.5 101.1 51.6 262 263 A I < + 0 0 17 -5,-0.8 -42,-1.0 -43,-0.1 2,-0.6 0.595 35.2 103.0-110.3 -17.6 35.7 97.4 52.1 263 264 A I E + g 0 220A 24 -6,-0.4 -42,-0.2 1,-0.2 3,-0.1 -0.608 34.8 168.1 -76.1 113.4 34.2 96.4 48.7 264 265 A T E + 0 0 41 -44,-2.7 2,-0.3 -2,-0.6 -43,-0.2 0.516 67.3 8.0-103.4 -8.7 36.8 94.6 46.6 265 266 A S E - 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