==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 27-MAR-11 3RAC . COMPND 2 MOLECULE: HISTIDINE-TRNA LIGASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ALICYCLOBACILLUS ACIDOCALDARIUS SUBSP. . AUTHOR R.WU,J.BEDEAN,A.JOACHIMIAK,MIDWEST CENTER FOR STRUCTURAL GEN . 339 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17198.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 230 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 17 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 35.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.7 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 1 0 1 1 0 0 1 2 2 0 0 0 0 2 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 0 1 1 1 2 0 0 0 1 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 15 A A 0 0 152 0, 0.0 2,-0.8 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-137.2 10.5 47.9 -14.8 2 16 A V - 0 0 146 0, 0.0 2,-0.0 0, 0.0 0, 0.0 -0.861 360.0-163.4 -96.0 108.4 10.5 44.7 -16.8 3 17 A R - 0 0 224 -2,-0.8 2,-0.1 1,-0.2 3,-0.1 -0.142 22.5 -98.3 -75.9 178.3 14.0 43.2 -16.6 4 18 A G - 0 0 70 1,-0.2 -1,-0.2 -2,-0.0 2,-0.1 -0.264 54.3 -69.3 -86.0-178.1 15.4 40.5 -19.0 5 19 A F - 0 0 217 -2,-0.1 2,-0.3 1,-0.1 -1,-0.2 -0.390 51.2-131.8 -70.0 154.1 15.6 36.8 -18.2 6 20 A A - 0 0 94 -3,-0.1 2,-0.3 -2,-0.1 -1,-0.1 -0.716 14.1-137.5-106.1 157.2 18.0 35.7 -15.6 7 21 A D - 0 0 153 -2,-0.3 0, 0.0 3,-0.0 0, 0.0 -0.830 13.2-119.3-114.9 157.2 20.5 32.8 -15.7 8 22 A R - 0 0 115 -2,-0.3 3,-0.1 1,-0.1 6,-0.0 -0.604 43.4 -99.6 -84.6 147.7 21.6 30.1 -13.3 9 23 A P > - 0 0 84 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.263 55.8 -73.1 -68.1 162.3 25.2 30.2 -12.3 10 24 A P T 3 S+ 0 0 115 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.273 118.7 20.2 -63.4 134.0 27.7 27.8 -14.0 11 25 A G T 3 S+ 0 0 39 1,-0.4 106,-0.5 -3,-0.1 2,-0.2 0.045 96.2 113.4 99.3 -26.2 27.3 24.2 -13.1 12 26 A M < - 0 0 46 -3,-1.7 -1,-0.4 104,-0.1 2,-0.4 -0.517 48.0-164.3 -76.9 147.1 23.8 24.5 -11.8 13 27 A Q - 0 0 131 -2,-0.2 2,-0.5 -3,-0.1 104,-0.0 -0.999 13.2-137.1-135.1 137.1 21.0 22.8 -13.6 14 28 A D - 0 0 100 -2,-0.4 2,-0.7 -6,-0.0 -6,-0.0 -0.797 14.9-144.9 -95.4 130.6 17.2 23.3 -13.4 15 29 A G - 0 0 48 -2,-0.5 5,-0.1 4,-0.0 3,-0.1 -0.852 15.5-152.6 -99.8 115.3 15.1 20.2 -13.3 16 30 A Y > - 0 0 177 -2,-0.7 3,-2.2 1,-0.2 4,-0.5 -0.254 44.8 -48.0 -81.2 170.6 11.8 20.7 -15.1 17 31 A P T 3 S+ 0 0 117 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 -0.022 126.5 21.9 -54.3 134.8 8.6 18.8 -14.3 18 32 A D T 3> S+ 0 0 90 -3,-0.1 4,-1.7 0, 0.0 5,-0.1 -0.023 105.2 83.2 97.2 -21.6 8.8 15.1 -13.9 19 33 A F H <> S+ 0 0 57 -3,-2.2 4,-2.3 2,-0.2 5,-0.2 0.920 93.4 45.4 -69.2 -44.3 12.5 15.3 -13.2 20 34 A A H > S+ 0 0 61 -4,-0.5 4,-2.4 2,-0.2 5,-0.2 0.888 111.9 51.2 -65.1 -41.8 11.9 16.0 -9.5 21 35 A K H > S+ 0 0 161 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.911 111.5 48.1 -63.4 -42.7 9.2 13.3 -9.2 22 36 A R H X S+ 0 0 63 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.903 111.7 49.0 -64.5 -42.9 11.6 10.8 -10.7 23 37 A R H X S+ 0 0 39 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.909 111.8 48.0 -64.4 -42.6 14.5 11.8 -8.4 24 38 A R H X S+ 0 0 176 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.907 112.6 51.2 -63.5 -40.8 12.3 11.6 -5.3 25 39 A A H X S+ 0 0 53 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.916 112.5 44.2 -61.2 -46.9 11.1 8.2 -6.5 26 40 A V H X S+ 0 0 14 -4,-2.6 4,-2.2 2,-0.2 5,-0.2 0.913 112.6 51.3 -69.6 -42.9 14.6 6.9 -7.0 27 41 A E H X S+ 0 0 15 -4,-2.9 4,-3.4 1,-0.2 5,-0.3 0.948 110.0 52.3 -52.2 -49.7 15.9 8.3 -3.7 28 42 A T H X S+ 0 0 67 -4,-2.5 4,-3.1 -5,-0.2 5,-0.3 0.910 108.3 48.4 -58.3 -45.2 13.0 6.6 -2.0 29 43 A R H X S+ 0 0 156 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.904 117.3 41.9 -65.8 -39.5 13.7 3.2 -3.5 30 44 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 5,-0.3 0.955 120.0 42.3 -69.1 -49.2 17.3 3.3 -2.6 31 45 A L H X S+ 0 0 42 -4,-3.4 4,-2.4 -5,-0.2 5,-0.2 0.929 113.7 52.0 -65.3 -46.5 16.8 4.8 0.9 32 46 A S H X S+ 0 0 51 -4,-3.1 4,-1.9 -5,-0.3 -1,-0.2 0.900 111.3 49.7 -52.8 -43.6 13.8 2.6 1.7 33 47 A F H X S+ 0 0 58 -4,-1.4 4,-1.0 -5,-0.3 -2,-0.2 0.975 112.9 41.2 -66.6 -55.3 15.8 -0.4 0.8 34 48 A V H <>S+ 0 0 0 -4,-2.2 5,-0.5 1,-0.2 3,-0.3 0.838 112.7 57.1 -64.9 -29.2 18.9 0.2 2.8 35 49 A E H >X5S+ 0 0 85 -4,-2.4 3,-1.5 -5,-0.3 4,-1.1 0.921 105.8 49.1 -65.2 -42.3 16.8 1.4 5.7 36 50 A D H 3<5S+ 0 0 141 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.643 98.9 68.2 -73.2 -15.0 15.0 -1.9 5.8 37 51 A A T 3<5S- 0 0 39 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.314 131.8 -89.2 -83.1 8.8 18.3 -3.7 5.7 38 52 A G T <45S+ 0 0 42 -3,-1.5 2,-0.4 1,-0.3 -2,-0.2 0.894 85.1 131.4 87.6 44.8 18.8 -2.3 9.2 39 53 A Y << - 0 0 4 -4,-1.1 -1,-0.3 -5,-0.5 64,-0.3 -0.997 48.1-138.0-125.4 130.9 20.4 1.1 8.7 40 54 A E E -a 103 0A 130 62,-2.6 64,-2.1 -2,-0.4 -4,-0.0 -0.766 22.7-116.1 -93.1 131.0 19.1 4.2 10.4 41 55 A P E +a 104 0A 65 0, 0.0 2,-0.3 0, 0.0 64,-0.2 -0.329 38.5 179.8 -62.3 140.0 18.8 7.4 8.4 42 56 A V - 0 0 25 62,-2.1 64,-0.3 2,-0.0 2,-0.3 -0.966 5.0-169.8-140.3 152.5 21.0 10.1 9.8 43 57 A T - 0 0 82 -2,-0.3 2,-0.3 62,-0.1 64,-0.0 -0.939 6.5-168.8-141.2 166.3 21.7 13.7 8.6 44 58 A S - 0 0 17 -2,-0.3 42,-0.0 45,-0.0 41,-0.0 -0.965 38.1 -81.8-147.6 164.3 23.9 16.7 9.1 45 59 A G - 0 0 52 -2,-0.3 34,-0.1 2,-0.1 40,-0.0 -0.330 41.3-119.2 -63.7 149.5 24.1 20.4 8.2 46 60 A L S S+ 0 0 54 32,-0.1 33,-2.0 63,-0.0 2,-0.3 0.828 90.2 76.5 -62.5 -34.3 25.4 21.2 4.8 47 61 A F E +H 78 0B 114 31,-0.2 2,-0.3 29,-0.0 31,-0.2 -0.598 53.9 174.6 -85.9 138.9 28.4 23.2 6.0 48 62 A E E -H 77 0B 10 29,-2.8 29,-2.8 -2,-0.3 2,-0.1 -0.959 38.5-100.9-129.1 153.0 31.6 21.7 7.5 49 63 A Y E > -H 76 0B 120 -2,-0.3 4,-1.9 27,-0.2 27,-0.3 -0.475 28.8-125.2 -64.3 145.8 34.8 23.5 8.6 50 64 A V H > S+ 0 0 19 25,-2.9 4,-3.2 1,-0.2 5,-0.2 0.927 114.0 58.6 -57.9 -43.8 37.6 23.1 6.1 51 65 A D H > S+ 0 0 86 24,-0.4 4,-1.4 1,-0.2 -1,-0.2 0.905 103.6 53.0 -48.8 -45.2 39.7 21.7 8.9 52 66 A T H 4 S+ 0 0 9 1,-0.2 4,-0.4 2,-0.2 3,-0.4 0.927 111.6 43.8 -58.6 -46.7 37.1 19.0 9.3 53 67 A L H >< S+ 0 0 5 -4,-1.9 3,-1.6 1,-0.2 -2,-0.2 0.872 106.5 60.9 -69.0 -36.0 37.2 18.1 5.6 54 68 A L H >< S+ 0 0 51 -4,-3.2 3,-2.6 1,-0.3 -1,-0.2 0.842 91.3 69.8 -57.1 -32.4 41.0 18.2 5.6 55 69 A R T 3< S+ 0 0 108 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.767 101.6 45.3 -58.7 -24.6 41.0 15.4 8.2 56 70 A A T < S+ 0 0 6 -3,-1.6 228,-0.4 -4,-0.4 2,-0.3 0.184 108.3 75.5-102.7 15.8 39.7 13.1 5.5 57 71 A R S < S- 0 0 37 -3,-2.6 226,-0.1 227,-0.1 6,-0.0 -0.941 78.8-115.4-129.8 149.4 42.3 14.4 2.9 58 72 A S > - 0 0 48 -2,-0.3 3,-1.5 1,-0.1 -2,-0.1 -0.572 32.0-116.8 -76.7 144.5 46.0 13.9 2.2 59 73 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 0.837 115.3 42.9 -43.5 -43.8 48.2 17.0 2.5 60 74 A E T 3 S+ 0 0 126 2,-0.0 -2,-0.0 0, 0.0 -3,-0.0 0.503 94.0 107.6 -91.0 -4.7 49.1 16.9 -1.2 61 75 A S S < S- 0 0 28 -3,-1.5 2,-0.1 1,-0.1 -4,-0.0 -0.208 76.2 -93.9 -74.2 162.7 45.6 16.1 -2.5 62 76 A S - 0 0 71 1,-0.0 2,-0.7 2,-0.0 -1,-0.1 -0.415 26.8-135.9 -70.8 146.8 43.3 18.4 -4.4 63 77 A R + 0 0 117 -2,-0.1 -1,-0.0 1,-0.1 -9,-0.0 -0.932 30.5 167.7-104.0 111.0 40.7 20.5 -2.6 64 78 A D + 0 0 55 -2,-0.7 48,-3.6 2,-0.1 2,-0.2 0.172 35.1 112.5-112.3 18.3 37.5 20.2 -4.6 65 79 A W - 0 0 16 46,-0.2 2,-0.5 50,-0.0 46,-0.1 -0.546 69.0-113.8 -90.8 159.2 35.0 21.6 -2.1 66 80 A I - 0 0 40 12,-0.3 12,-2.4 44,-0.3 2,-0.2 -0.801 32.0-144.7 -95.1 125.5 33.1 24.9 -2.5 67 81 A R B -I 77 0B 176 -2,-0.5 10,-0.3 10,-0.2 2,-0.1 -0.616 8.7-124.5 -92.4 149.7 34.1 27.5 0.1 68 82 A L - 0 0 61 8,-2.9 8,-0.2 -2,-0.2 -1,-0.1 -0.447 51.3 -67.5 -84.3 160.4 31.7 30.0 1.7 69 83 A F - 0 0 197 -2,-0.1 2,-0.8 1,-0.1 -1,-0.2 -0.242 57.2-118.8 -51.4 134.0 32.4 33.7 1.7 70 84 A D + 0 0 110 1,-0.1 -1,-0.1 -3,-0.1 5,-0.1 -0.689 35.0 174.7 -86.3 106.7 35.5 34.4 3.8 71 85 A G - 0 0 72 -2,-0.8 -1,-0.1 3,-0.2 3,-0.1 0.055 63.2 -97.5 -95.4 23.9 34.7 36.7 6.7 72 86 A G S S+ 0 0 63 1,-0.2 3,-0.1 0, 0.0 -2,-0.1 0.082 97.4 105.3 82.7 -24.3 38.2 36.3 8.1 73 87 A G S S- 0 0 51 1,-0.2 -1,-0.2 3,-0.0 2,-0.1 0.160 88.0 -42.8 -71.2-166.9 37.0 33.7 10.5 74 88 A D S S- 0 0 128 1,-0.1 2,-0.2 -3,-0.1 -1,-0.2 -0.402 72.8-102.1 -62.9 136.9 37.6 29.9 10.2 75 89 A A - 0 0 48 -3,-0.1 -25,-2.9 -2,-0.1 -24,-0.4 -0.407 40.0-168.3 -66.5 125.8 37.1 28.6 6.7 76 90 A V E +H 49 0B 39 -27,-0.3 -8,-2.9 -2,-0.2 2,-0.3 -0.937 7.8 176.0-115.2 140.4 33.8 26.9 6.1 77 91 A A E -HI 48 67B 0 -29,-2.8 -29,-2.8 -2,-0.4 -10,-0.2 -0.868 33.4 -99.3-133.8 169.4 32.9 24.8 3.0 78 92 A L E -H 47 0B 23 -12,-2.4 -12,-0.3 -2,-0.3 -31,-0.2 -0.607 49.9 -94.2 -88.2 150.8 29.9 22.7 1.8 79 93 A R - 0 0 9 -33,-2.0 31,-2.3 -2,-0.2 3,-0.1 -0.431 28.0-166.6 -67.8 135.6 30.2 18.9 2.1 80 94 A P S S- 0 0 17 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.484 79.5 -3.4 -94.4 -6.3 31.5 17.2 -1.0 81 95 A E S S- 0 0 22 27,-0.1 4,-0.3 1,-0.0 29,-0.1 -0.932 71.6-115.9-169.5 171.3 30.3 13.8 0.4 82 96 A M S > S+ 0 0 0 -2,-0.3 4,-2.1 1,-0.1 3,-0.2 0.698 89.3 86.2 -95.4 -18.5 28.7 12.6 3.6 83 97 A T H > S+ 0 0 11 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.808 88.6 47.9 -55.5 -41.4 31.5 10.3 5.0 84 98 A P H > S+ 0 0 1 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.912 112.4 49.6 -70.3 -38.4 33.5 12.9 6.9 85 99 A S H > S+ 0 0 0 -4,-0.3 4,-2.6 -3,-0.2 -2,-0.2 0.882 111.4 50.0 -61.5 -39.9 30.4 14.4 8.6 86 100 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.897 108.4 51.7 -70.8 -39.3 29.4 11.0 9.6 87 101 A A H X S+ 0 0 2 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.911 111.2 48.9 -59.3 -42.2 32.8 10.2 11.0 88 102 A R H < S+ 0 0 99 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.927 114.5 44.6 -62.8 -42.9 32.5 13.5 13.0 89 103 A M H < S+ 0 0 52 -4,-2.6 4,-0.4 1,-0.2 -2,-0.2 0.814 117.4 46.3 -69.2 -29.9 29.0 12.5 14.2 90 104 A A H >X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 3,-0.5 0.789 88.6 80.5 -87.3 -32.6 30.1 9.0 15.0 91 105 A A H 3X S+ 0 0 5 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.865 92.3 49.5 -49.1 -48.5 33.4 9.4 16.9 92 106 A P H 3> S+ 0 0 85 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.898 110.9 50.9 -63.5 -35.4 31.9 10.3 20.3 93 107 A R H <4>S+ 0 0 95 -3,-0.5 5,-2.3 -4,-0.4 4,-0.3 0.894 111.0 49.3 -65.0 -36.9 29.6 7.3 20.1 94 108 A V H ><5S+ 0 0 21 -4,-2.2 3,-1.5 1,-0.2 -1,-0.2 0.902 106.8 55.0 -64.7 -41.1 32.7 5.2 19.3 95 109 A A H 3<5S+ 0 0 80 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.854 107.7 51.5 -59.9 -31.7 34.4 6.8 22.3 96 110 A A T 3<5S- 0 0 66 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.471 115.3-114.3 -85.9 -1.8 31.4 5.5 24.4 97 111 A G T < 5 + 0 0 55 -3,-1.5 2,-1.8 -4,-0.3 -3,-0.2 0.605 69.0 143.4 76.8 12.0 31.6 1.9 23.1 98 112 A R < + 0 0 145 -5,-2.3 -1,-0.1 -6,-0.2 -3,-0.1 -0.431 40.2 175.5 -86.4 66.2 28.2 2.3 21.4 99 113 A T + 0 0 59 -2,-1.8 2,-0.1 -5,-0.1 3,-0.0 -0.844 36.5 52.4-126.5 162.2 29.0 0.2 18.4 100 114 A P - 0 0 77 0, 0.0 2,-0.5 0, 0.0 25,-0.0 0.519 63.8-162.4 -76.7 161.2 28.4 -1.1 15.8 101 115 A I - 0 0 6 -2,-0.1 25,-2.0 2,-0.0 2,-0.6 -0.962 8.8-174.7-112.9 123.2 26.9 1.9 14.1 102 116 A R E + B 0 125A 79 -2,-0.5 -62,-2.6 23,-0.2 2,-0.3 -0.887 19.9 163.2-119.9 98.4 24.7 1.2 11.0 103 117 A W E -aB 40 124A 15 21,-2.3 21,-2.5 -2,-0.6 2,-0.3 -0.847 17.1-175.0-119.1 150.1 23.7 4.4 9.4 104 118 A C E -aB 41 123A 0 -64,-2.1 -62,-2.1 -2,-0.3 2,-0.3 -0.841 8.3-175.8-131.3 175.1 22.3 5.5 6.0 105 119 A Y E - B 0 122A 3 17,-1.8 17,-1.5 -2,-0.3 2,-0.3 -0.994 24.9-152.3-166.0 163.4 21.5 8.8 4.4 106 120 A C E + B 0 121A 28 -64,-0.3 2,-0.3 -2,-0.3 15,-0.2 -0.873 40.7 145.9-145.4 106.1 20.1 10.7 1.4 107 121 A E E - B 0 120A 47 13,-2.2 13,-2.7 -2,-0.3 2,-0.2 -0.988 48.7-108.7-148.8 150.0 21.6 14.1 0.9 108 122 A R E - B 0 119A 76 -2,-0.3 2,-0.3 11,-0.2 11,-0.3 -0.568 37.3-168.7 -72.5 138.4 22.6 16.7 -1.6 109 123 A V E - B 0 118A 0 9,-3.2 9,-2.3 -2,-0.2 2,-0.4 -0.961 7.4-146.6-132.1 158.0 26.5 17.2 -2.1 110 124 A Y E - B 0 117A 36 -31,-2.3 2,-0.3 -2,-0.3 -44,-0.3 -0.951 12.3-177.9-133.0 137.2 28.6 19.8 -3.9 111 125 A R E - B 0 116A 54 5,-1.9 5,-2.9 -2,-0.4 2,-0.3 -0.986 34.8-112.8-134.2 141.1 31.9 19.7 -5.7 112 126 A R 0 0 127 -48,-3.6 -101,-0.0 -2,-0.3 -46,-0.0 -0.613 360.0 360.0 -65.8 132.2 34.0 22.3 -7.4 113 127 A T 0 0 111 -2,-0.3 -1,-0.0 0, 0.0 0, 0.0 -0.747 360.0 360.0-109.1 360.0 33.8 21.3 -11.1 114 ! 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 0.0 115 140 A A 0 0 48 0, 0.0 2,-0.4 0, 0.0 -3,-0.2 0.000 360.0 360.0 360.0 129.4 30.3 23.8 -9.5 116 141 A A E -B 111 0A 42 -5,-2.9 -5,-1.9 -104,-0.0 2,-0.4 -0.972 360.0-156.4-126.6 140.3 28.2 20.6 -9.5 117 142 A E E +B 110 0A 68 -106,-0.5 2,-0.3 -2,-0.4 -7,-0.2 -0.899 23.7 155.7-110.7 136.7 25.3 19.5 -7.4 118 143 A S E -B 109 0A 15 -9,-2.3 -9,-3.2 -2,-0.4 2,-0.4 -0.937 33.4-117.1-150.1 178.2 24.3 15.9 -6.9 119 144 A T E -B 108 0A 0 -2,-0.3 209,-2.8 -11,-0.3 2,-0.4 -0.965 20.2-162.6-127.1 134.7 22.5 13.5 -4.5 120 145 A Q E -BC 107 327A 8 -13,-2.7 -13,-2.2 -2,-0.4 2,-0.5 -0.941 10.6-171.5-119.0 136.3 23.9 10.5 -2.6 121 146 A V E +BC 106 326A 1 205,-1.4 205,-3.3 -2,-0.4 2,-0.3 -0.989 36.4 140.8-117.2 117.3 22.1 7.7 -0.9 122 147 A G E -BC 105 325A 0 -17,-1.5 -17,-1.8 -2,-0.5 2,-0.3 -0.839 39.4-131.4-144.9-179.9 24.6 5.7 1.1 123 148 A I E -BC 104 324A 0 201,-1.9 201,-1.5 -2,-0.3 2,-0.4 -0.927 8.4-157.2-133.1 162.1 25.4 3.7 4.2 124 149 A E E -BC 103 323A 2 -21,-2.5 -21,-2.3 -2,-0.3 2,-0.5 -0.989 0.6-165.8-139.4 130.3 28.2 3.6 6.8 125 150 A R E +BC 102 322A 9 197,-3.6 197,-2.2 -2,-0.4 -23,-0.2 -0.974 20.5 159.5-115.6 117.3 29.2 0.7 9.0 126 151 A I + 0 0 2 -25,-2.0 -1,-0.1 -2,-0.5 -24,-0.1 0.704 53.6 61.6-114.7 -25.4 31.5 1.8 11.8 127 152 A G S S+ 0 0 16 -26,-0.4 2,-0.1 192,-0.1 -28,-0.1 0.823 77.8 93.9 -75.0 -30.1 31.5 -0.6 14.7 128 153 A E S S- 0 0 44 -27,-0.2 3,-0.1 1,-0.1 -3,-0.0 -0.345 76.3-104.7 -90.1 146.2 32.7 -3.9 13.5 129 154 A E - 0 0 169 -2,-0.1 5,-0.2 1,-0.1 -1,-0.1 -0.294 52.2-100.2 -53.6 135.2 36.1 -5.7 13.3 130 155 A A + 0 0 39 4,-0.1 2,-0.3 3,-0.1 -1,-0.1 -0.353 62.2 144.6 -62.9 136.9 37.4 -5.6 9.8 131 156 A S > - 0 0 44 -3,-0.1 4,-2.3 1,-0.1 3,-0.2 -0.974 61.5-110.4-170.3 156.1 36.8 -8.9 7.9 132 157 A V H > S+ 0 0 24 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.827 116.1 59.9 -64.0 -34.0 36.0 -10.4 4.6 133 158 A D H > S+ 0 0 134 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.915 108.9 43.1 -59.0 -44.3 32.5 -11.5 5.9 134 159 A V H > S+ 0 0 16 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.920 114.7 49.4 -68.4 -45.0 31.7 -7.8 6.6 135 160 A D H X S+ 0 0 4 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.922 111.8 49.5 -57.5 -45.7 33.2 -6.7 3.2 136 161 A M H X S+ 0 0 17 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.839 108.5 53.3 -64.2 -34.0 31.2 -9.4 1.4 137 162 A D H X S+ 0 0 56 -4,-1.6 4,-1.9 -5,-0.2 -1,-0.2 0.839 108.4 49.8 -71.2 -32.8 28.0 -8.3 3.2 138 163 A V H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.909 111.7 47.5 -71.4 -42.8 28.5 -4.7 2.1 139 164 A L H X S+ 0 0 5 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.923 111.5 51.9 -62.7 -43.6 29.0 -5.7 -1.5 140 165 A R H X S+ 0 0 118 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.910 109.4 49.8 -57.8 -43.9 26.0 -8.0 -1.3 141 166 A L H X S+ 0 0 8 -4,-1.9 4,-2.4 1,-0.2 5,-0.2 0.931 110.9 48.9 -62.9 -46.1 24.0 -5.0 0.1 142 167 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.909 111.0 51.3 -57.1 -45.7 25.2 -2.8 -2.8 143 168 A H H X S+ 0 0 66 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.916 115.0 41.0 -60.0 -45.2 24.3 -5.5 -5.3 144 169 A E H X S+ 0 0 68 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.800 110.6 56.0 -77.5 -29.5 20.8 -5.9 -4.0 145 170 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.913 108.5 49.7 -69.3 -40.5 20.1 -2.3 -3.4 146 171 A S H X>S+ 0 0 0 -4,-2.1 5,-1.7 -5,-0.2 4,-0.7 0.948 111.5 47.2 -59.0 -51.2 20.9 -1.6 -7.1 147 172 A A H ><5S+ 0 0 53 -4,-1.8 3,-1.3 1,-0.2 -2,-0.2 0.907 109.5 54.9 -59.0 -40.8 18.6 -4.4 -8.2 148 173 A A H 3<5S+ 0 0 30 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.881 101.5 57.9 -59.1 -40.7 15.9 -3.1 -5.9 149 174 A A H 3<5S- 0 0 6 -4,-2.0 -1,-0.3 -3,-0.1 -2,-0.2 0.654 124.2-106.4 -63.1 -17.5 16.2 0.3 -7.6 150 175 A G T <<5S+ 0 0 31 -3,-1.3 2,-0.3 -4,-0.7 -3,-0.2 0.464 71.7 143.8 103.2 2.9 15.4 -1.5 -10.9 151 176 A V < - 0 0 6 -5,-1.7 -1,-0.3 144,-0.0 2,-0.3 -0.597 28.4-168.2 -73.9 131.5 18.8 -1.4 -12.4 152 177 A R + 0 0 136 -2,-0.3 186,-0.0 1,-0.2 -5,-0.0 -0.858 60.2 23.5-116.3 155.9 19.7 -4.5 -14.4 153 178 A H S S+ 0 0 150 -2,-0.3 2,-0.2 1,-0.2 -1,-0.2 0.813 75.8 160.5 64.7 35.1 23.0 -5.7 -15.8 154 179 A H - 0 0 22 -3,-0.2 2,-0.4 141,-0.2 141,-0.2 -0.571 26.3-151.4 -82.9 151.0 25.3 -3.8 -13.4 155 180 A R E -D 294 0A 126 139,-2.7 139,-2.7 -2,-0.2 2,-0.5 -0.981 4.0-146.8-121.7 137.4 28.9 -4.8 -12.9 156 181 A I E -De 293 273A 2 116,-3.5 118,-3.0 -2,-0.4 2,-0.5 -0.915 11.3-156.6-105.3 124.3 30.8 -4.3 -9.6 157 182 A V E -De 292 274A 7 135,-3.5 135,-1.9 -2,-0.5 2,-0.3 -0.871 15.2-169.5-106.3 128.8 34.5 -3.6 -10.0 158 183 A V E +De 291 275A 0 116,-3.0 118,-2.4 -2,-0.5 2,-0.3 -0.842 17.6 142.5-123.8 149.9 36.8 -4.3 -7.0 159 184 A S E -D 290 0A 2 131,-2.3 131,-2.5 -2,-0.3 2,-0.5 -0.909 46.5 -96.1-156.6-169.1 40.3 -3.7 -5.8 160 185 A H E >> -D 289 0A 26 -2,-0.3 3,-1.2 129,-0.2 4,-0.6 -0.989 26.8-138.8-122.8 125.9 42.4 -3.0 -2.7 161 186 A A T 34 S+ 0 0 13 127,-2.9 127,-0.1 -2,-0.5 128,-0.1 0.669 98.4 45.6 -59.8 -20.4 43.3 0.7 -2.1 162 187 A R T 3> S+ 0 0 89 125,-0.2 4,-2.3 2,-0.1 5,-0.4 0.655 88.3 85.4-102.5 -16.3 46.8 0.0 -1.0 163 188 A L H <> S+ 0 0 0 -3,-1.2 4,-1.5 1,-0.2 -2,-0.1 0.942 98.3 33.1 -52.1 -58.9 48.0 -2.4 -3.7 164 189 A V H X S+ 0 0 4 -4,-0.6 4,-2.7 115,-0.2 5,-0.2 0.946 117.9 50.4 -69.7 -48.3 49.0 0.1 -6.4 165 190 A P H > S+ 0 0 9 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.902 115.9 43.2 -57.7 -42.2 50.3 3.0 -4.2 166 191 A R H X S+ 0 0 50 -4,-2.3 4,-3.4 2,-0.2 -2,-0.2 0.796 110.1 57.8 -75.0 -26.0 52.5 0.6 -2.1 167 192 A L H X S+ 0 0 0 -4,-1.5 4,-1.9 -5,-0.4 -1,-0.2 0.944 106.5 47.6 -64.3 -48.8 53.6 -1.1 -5.3 168 193 A L H <>S+ 0 0 0 -4,-2.7 5,-2.6 2,-0.2 -2,-0.2 0.919 114.8 47.9 -54.3 -44.4 54.9 2.2 -6.7 169 194 A D H ><5S+ 0 0 51 -4,-1.8 3,-2.2 -5,-0.2 -2,-0.2 0.942 108.5 53.9 -58.9 -49.2 56.6 2.6 -3.3 170 195 A A H 3<5S+ 0 0 0 -4,-3.4 71,-2.4 1,-0.3 72,-0.9 0.790 107.6 51.0 -59.2 -29.8 58.0 -0.9 -3.4 171 196 A L T 3<5S- 0 0 23 -4,-1.9 -1,-0.3 69,-0.2 -2,-0.2 0.171 120.0-109.0 -95.3 17.2 59.6 -0.2 -6.8 172 197 A G T < 5 + 0 0 47 -3,-2.2 2,-0.4 1,-0.2 -3,-0.2 0.718 57.8 164.3 66.7 25.5 61.2 3.0 -5.5 173 198 A I < - 0 0 17 -5,-2.6 -1,-0.2 -6,-0.2 5,-0.1 -0.615 42.1-108.5 -75.2 129.6 59.0 5.5 -7.4 174 199 A S > - 0 0 58 -2,-0.4 4,-2.6 1,-0.1 5,-0.1 -0.049 25.0-113.2 -52.2 159.0 59.3 9.0 -6.0 175 200 A A H > S+ 0 0 68 2,-0.2 4,-1.5 1,-0.2 -1,-0.1 0.844 115.3 45.8 -68.1 -38.0 56.4 10.5 -4.0 176 201 A S H > S+ 0 0 72 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.882 114.6 48.7 -72.3 -38.5 55.5 13.2 -6.6 177 202 A L H > S+ 0 0 31 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.895 107.4 55.9 -67.1 -40.5 55.7 10.7 -9.4 178 203 A S H X S+ 0 0 10 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.904 105.9 51.8 -55.8 -42.9 53.5 8.3 -7.5 179 204 A R H X S+ 0 0 110 -4,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.884 109.9 49.4 -62.3 -37.6 50.9 11.0 -7.3 180 205 A A H X S+ 0 0 33 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.951 110.7 48.5 -68.9 -47.8 51.1 11.5 -11.0 181 206 A F H X S+ 0 0 0 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.937 115.7 44.5 -53.8 -48.3 50.8 7.7 -11.7 182 207 A L H X S+ 0 0 22 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.871 108.9 55.7 -69.6 -38.1 47.8 7.5 -9.4 183 208 A A H X S+ 0 0 55 -4,-2.4 4,-2.5 -5,-0.2 6,-0.3 0.948 108.0 50.8 -55.7 -46.1 46.2 10.7 -10.8 184 209 A C H X>S+ 0 0 8 -4,-2.6 5,-1.4 1,-0.2 4,-1.4 0.866 109.0 50.3 -59.1 -37.9 46.4 9.0 -14.2 185 210 A L H <5S+ 0 0 10 -4,-1.7 95,-0.3 1,-0.2 -1,-0.2 0.872 112.1 47.7 -71.5 -35.3 44.7 5.9 -13.0 186 211 A T H <5S+ 0 0 62 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.916 118.2 39.5 -68.9 -41.4 41.9 7.9 -11.4 187 212 A S H <5S- 0 0 87 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.597 108.4-117.6 -86.8 -12.4 41.3 10.0 -14.5 188 213 A G T <5 + 0 0 45 -4,-1.4 2,-1.9 -5,-0.2 3,-0.2 0.656 63.0 146.9 80.9 16.8 41.8 7.2 -17.1 189 214 A N >< + 0 0 77 -5,-1.4 4,-1.9 -6,-0.3 -1,-0.2 -0.472 9.9 158.9 -82.3 68.7 44.8 8.9 -18.7 190 215 A Y H > + 0 0 78 -2,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.771 67.5 59.7 -65.2 -27.8 46.4 5.6 -19.6 191 216 A V H > S+ 0 0 117 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.966 106.8 45.5 -64.4 -52.1 48.6 7.2 -22.2 192 217 A Q H > S+ 0 0 82 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.865 111.7 54.5 -58.9 -37.4 50.2 9.5 -19.7 193 218 A F H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.953 108.9 46.1 -59.4 -51.1 50.6 6.6 -17.4 194 219 A R H X S+ 0 0 97 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.869 114.6 49.0 -62.8 -37.7 52.5 4.5 -20.0 195 220 A E H X S+ 0 0 86 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.966 111.1 47.2 -65.8 -53.8 54.7 7.5 -20.9 196 221 A L H X>S+ 0 0 20 -4,-2.8 4,-2.2 1,-0.2 5,-0.5 0.873 112.9 52.3 -54.6 -37.3 55.6 8.4 -17.3 197 222 A W H X5S+ 0 0 5 -4,-2.3 4,-1.1 -5,-0.2 6,-0.3 0.882 111.1 44.8 -71.0 -36.2 56.4 4.7 -16.7 198 223 A Q H <5S+ 0 0 108 -4,-1.8 -2,-0.2 -3,-0.2 -1,-0.2 0.923 116.5 46.2 -71.7 -43.6 58.7 4.5 -19.7 199 224 A L H <5S+ 0 0 112 -4,-3.0 -2,-0.2 -5,-0.1 -1,-0.2 0.889 128.3 18.0 -63.7 -41.8 60.5 7.7 -18.9 200 225 A H H <5S+ 0 0 104 -4,-2.2 2,-0.6 -5,-0.2 -3,-0.2 0.776 98.1 83.1-114.5 -34.6 61.1 7.2 -15.2 201 226 A A << - 0 0 11 -4,-1.1 2,-0.5 -5,-0.5 -29,-0.1 -0.670 64.4-146.4 -77.6 122.1 60.7 3.6 -14.0 202 227 A A S S+ 0 0 106 -2,-0.6 2,-0.4 2,-0.1 -1,-0.1 -0.007 70.1 105.3 -77.1 33.6 64.0 1.8 -14.6 203 228 A K - 0 0 76 -2,-0.5 4,-0.1 -6,-0.3 -2,-0.1 -0.936 64.6-149.2-116.6 140.8 61.9 -1.3 -15.3 204 229 A D + 0 0 183 -2,-0.4 2,-0.2 2,-0.1 -1,-0.1 0.326 66.4 100.0 -90.3 8.3 61.2 -2.8 -18.8 205 230 A V S S- 0 0 54 1,-0.0 2,-1.2 31,-0.0 3,-0.2 -0.560 79.0-117.4 -95.4 155.8 57.8 -4.2 -18.0 206 231 A D >> - 0 0 46 -2,-0.2 4,-1.9 1,-0.2 3,-0.7 -0.666 31.0-177.1 -93.1 83.1 54.4 -2.6 -18.8 207 232 A L H 3> S+ 0 0 0 -2,-1.2 4,-2.7 1,-0.3 5,-0.2 0.872 80.6 53.3 -47.6 -46.4 53.0 -2.0 -15.3 208 233 A L H 3> S+ 0 0 6 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.898 106.4 52.5 -59.2 -41.3 49.7 -0.7 -16.7 209 234 A A H <> S+ 0 0 31 -3,-0.7 4,-0.8 1,-0.2 -1,-0.2 0.872 111.2 48.3 -63.9 -35.6 49.2 -3.8 -18.8 210 235 A N H >X S+ 0 0 13 -4,-1.9 4,-2.5 2,-0.2 3,-1.2 0.954 110.0 49.9 -63.6 -51.5 49.7 -5.9 -15.7 211 236 A L H 3< S+ 0 0 0 -4,-2.7 66,-0.7 1,-0.3 67,-0.4 0.826 109.5 54.2 -59.8 -30.0 47.3 -3.9 -13.6 212 237 A L H 3< S+ 0 0 57 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.739 119.8 29.2 -75.5 -23.2 44.7 -4.2 -16.3 213 238 A T H << S+ 0 0 37 -3,-1.2 11,-2.3 -4,-0.8 -2,-0.2 0.584 88.4 107.1-119.4 -14.7 44.9 -8.0 -16.5 214 239 A W B < +j 224 0C 0 -4,-2.5 63,-0.6 9,-0.2 12,-0.1 -0.486 41.3 164.0 -66.3 135.1 45.9 -9.3 -13.1 215 240 A S - 0 0 0 9,-0.6 14,-0.3 10,-0.4 15,-0.2 -0.962 41.4-151.5-154.0 139.4 43.0 -11.0 -11.2 216 241 A P + 0 0 3 0, 0.0 10,-0.2 0, 0.0 2,-0.1 0.404 67.7 115.3 -84.1 0.7 42.7 -13.3 -8.2 217 242 A A - 0 0 16 7,-0.1 9,-0.4 1,-0.1 3,-0.3 -0.424 64.6-143.1 -70.2 145.1 39.5 -14.7 -9.7 218 243 A E S S+ 0 0 127 1,-0.3 2,-0.5 42,-0.2 8,-0.1 0.939 91.0 28.7 -74.4 -45.6 39.6 -18.3 -10.7 219 244 A R S S+ 0 0 187 6,-0.1 2,-0.4 -3,-0.0 -1,-0.3 -0.803 70.6 133.3-124.4 92.2 37.5 -17.8 -13.9 220 245 A D > - 0 0 34 -2,-0.5 3,-1.6 -3,-0.3 -5,-0.0 -0.950 37.6-156.7-133.2 118.6 37.6 -14.5 -15.6 221 246 A A T 3 S+ 0 0 110 -2,-0.4 -1,-0.1 1,-0.3 4,-0.1 0.738 92.0 52.7 -66.3 -25.0 38.0 -14.7 -19.4 222 247 A A T 3 S+ 0 0 76 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.249 105.6 65.3 -95.9 13.0 39.5 -11.2 -19.7 223 248 A K S < S- 0 0 42 -3,-1.6 -3,-0.2 -8,-0.0 -9,-0.2 -0.938 83.5-103.4-136.4 155.0 42.2 -11.7 -17.1 224 249 A R B -j 214 0C 86 -11,-2.3 -9,-0.6 -2,-0.3 -7,-0.1 -0.488 56.0 -91.4 -69.7 145.2 45.4 -13.7 -16.3 225 250 A S > - 0 0 38 -2,-0.2 4,-1.7 1,-0.1 -10,-0.4 0.057 29.5-112.2 -50.0 165.5 44.9 -16.6 -13.9 226 251 A R H > S+ 0 0 97 -9,-0.4 4,-2.9 2,-0.2 5,-0.2 0.931 120.1 55.4 -62.2 -44.0 45.4 -16.1 -10.2 227 252 A E H > S+ 0 0 160 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.930 112.7 37.7 -52.9 -55.5 48.3 -18.4 -10.6 228 253 A A H > S+ 0 0 18 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.768 114.0 56.4 -73.5 -26.8 50.1 -16.4 -13.3 229 254 A S H X S+ 0 0 0 -4,-1.7 4,-2.7 -14,-0.3 -2,-0.2 0.936 109.3 45.9 -69.9 -45.2 49.1 -13.1 -11.7 230 255 A D H X S+ 0 0 58 -4,-2.9 4,-3.0 2,-0.2 -2,-0.2 0.923 111.2 54.0 -60.1 -45.6 50.7 -14.0 -8.4 231 256 A R H X S+ 0 0 157 -4,-2.1 4,-1.7 -5,-0.2 -2,-0.2 0.944 112.0 43.3 -52.1 -54.0 53.8 -15.2 -10.4 232 257 A E H X S+ 0 0 41 -4,-2.3 4,-1.8 1,-0.2 5,-0.2 0.919 113.0 51.1 -64.3 -43.9 54.2 -11.9 -12.2 233 258 A L H X S+ 0 0 2 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.934 109.4 51.2 -58.8 -46.2 53.5 -9.8 -9.1 234 259 A E H X S+ 0 0 61 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.848 106.7 54.9 -59.2 -35.4 56.2 -11.8 -7.1 235 260 A A H < S+ 0 0 64 -4,-1.7 4,-0.4 2,-0.2 -1,-0.2 0.849 109.6 45.9 -70.4 -36.2 58.7 -11.2 -9.9 236 261 A L H >< S+ 0 0 20 -4,-1.8 3,-1.1 -3,-0.2 -2,-0.2 0.912 114.5 49.4 -64.5 -43.5 58.2 -7.5 -9.7 237 262 A L H >< S+ 0 0 6 -4,-2.4 3,-2.3 1,-0.3 -2,-0.2 0.817 92.6 75.6 -69.2 -29.0 58.5 -7.7 -5.9 238 263 A R T 3< S+ 0 0 210 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.770 104.9 37.5 -54.5 -27.3 61.6 -9.8 -6.0 239 264 A D T < S+ 0 0 105 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.298 85.0 143.4-109.0 9.2 63.5 -6.6 -6.9 240 265 A A < - 0 0 27 -3,-2.3 -69,-0.2 1,-0.1 -70,-0.1 -0.169 41.6-154.3 -46.6 136.6 61.5 -4.3 -4.7 241 266 A V S S+ 0 0 110 -71,-2.4 -70,-0.2 1,-0.2 -1,-0.1 0.408 84.3 52.6 -96.7 1.4 63.8 -1.6 -3.2 242 267 A D > - 0 0 52 -72,-0.9 4,-2.4 1,-0.1 -1,-0.2 -0.818 65.0-169.4-141.0 96.6 61.4 -1.1 -0.1 243 268 A P H > S+ 0 0 97 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.752 86.0 54.0 -65.4 -31.2 60.6 -4.4 1.7 244 269 A R H > S+ 0 0 199 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.955 110.8 46.3 -65.2 -49.0 57.9 -2.9 4.0 245 270 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.932 112.1 52.8 -57.1 -44.0 56.0 -1.5 0.9 246 271 A A H X S+ 0 0 4 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.910 108.3 48.5 -59.4 -44.4 56.5 -4.9 -0.8 247 272 A A H X S+ 0 0 38 -4,-2.2 4,-3.3 1,-0.2 -1,-0.2 0.905 109.1 54.6 -63.3 -40.4 55.0 -6.8 2.2 248 273 A D H X S+ 0 0 61 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.919 109.4 47.0 -55.4 -45.6 52.1 -4.3 2.1 249 274 A V H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.933 111.7 51.0 -62.0 -45.0 51.5 -5.2 -1.5 250 275 A R H X S+ 0 0 62 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.930 110.0 49.7 -60.5 -45.6 51.7 -8.8 -0.7 251 276 A D H X S+ 0 0 87 -4,-3.3 4,-2.1 2,-0.2 -1,-0.2 0.878 110.5 50.5 -58.7 -39.8 49.2 -8.4 2.1 252 277 A A H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.936 111.0 47.7 -66.9 -45.1 46.8 -6.6 -0.3 253 278 A W H X S+ 0 0 7 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.916 109.5 54.6 -58.7 -43.9 47.1 -9.3 -2.9 254 279 A R H X S+ 0 0 137 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.912 107.6 49.7 -58.4 -43.9 46.5 -11.9 -0.3 255 280 A Y H X S+ 0 0 21 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.938 107.9 53.0 -57.9 -48.4 43.3 -10.2 0.8 256 281 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.874 108.5 51.4 -57.8 -37.8 42.0 -10.0 -2.8 257 282 A C H X S+ 0 0 5 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.955 110.2 47.4 -61.1 -50.2 42.5 -13.7 -3.1 258 283 A R H X S+ 0 0 129 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.909 114.0 48.6 -59.0 -40.1 40.6 -14.4 0.1 259 284 A L H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.904 107.6 54.1 -66.6 -41.9 37.8 -12.1 -1.2 260 285 A A H X S+ 0 0 11 -4,-2.6 4,-1.7 -5,-0.2 -1,-0.2 0.885 109.9 49.1 -58.6 -37.6 37.8 -13.8 -4.6 261 286 A E H X S+ 0 0 89 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.945 109.5 49.7 -67.3 -46.8 37.3 -17.1 -2.8 262 287 A A H X S+ 0 0 18 -4,-2.3 4,-2.3 1,-0.3 -2,-0.2 0.888 109.9 52.1 -60.8 -39.4 34.4 -15.8 -0.6 263 288 A L H X>S+ 0 0 13 -4,-2.5 4,-1.7 2,-0.2 5,-1.1 0.899 108.6 51.2 -62.3 -40.1 32.8 -14.4 -3.8 264 289 A H H <5S+ 0 0 112 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.899 108.9 50.1 -62.9 -41.3 33.2 -17.9 -5.3 265 290 A D H <5S+ 0 0 137 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.877 107.5 55.0 -62.9 -38.3 31.5 -19.4 -2.3 266 291 A S H <5S- 0 0 65 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.858 104.6-137.6 -61.8 -36.8 28.8 -16.8 -2.7 267 292 A G T <5 + 0 0 58 -4,-1.7 -3,-0.2 1,-0.3 -2,-0.1 0.512 44.6 158.3 87.7 6.8 28.3 -18.1 -6.2 268 293 A L < - 0 0 61 -5,-1.1 -1,-0.3 1,-0.1 -2,-0.1 -0.378 50.0 -98.2 -63.1 141.0 28.0 -14.6 -7.6 269 294 A A > - 0 0 46 1,-0.1 4,-2.0 -3,-0.1 -1,-0.1 -0.277 18.2-130.8 -64.3 145.1 28.8 -14.4 -11.3 270 295 A S T 4 S+ 0 0 45 1,-0.2 -1,-0.1 2,-0.2 -2,-0.1 0.876 111.3 55.0 -61.9 -38.2 32.3 -13.3 -12.4 271 296 A D T 4 S+ 0 0 124 1,-0.2 -1,-0.2 -116,-0.1 -115,-0.1 0.894 105.6 52.0 -62.0 -40.9 30.6 -10.9 -14.8 272 297 A V T 4 S+ 0 0 19 1,-0.2 -116,-3.5 -117,-0.2 2,-0.4 0.909 122.9 27.2 -63.1 -42.9 28.6 -9.4 -12.0 273 298 A V E < S+e 156 0A 10 -4,-2.0 2,-0.3 -118,-0.2 -1,-0.2 -0.985 74.9 172.9-125.1 128.9 31.7 -8.8 -9.9 274 299 A T E -e 157 0A 23 -118,-3.0 -116,-3.0 -2,-0.4 2,-0.5 -0.972 28.2-126.6-135.6 149.5 35.2 -8.3 -11.3 275 300 A F E -e 158 0A 5 -2,-0.3 2,-0.4 -118,-0.2 -116,-0.2 -0.817 23.1-179.4 -94.8 129.3 38.7 -7.4 -10.0 276 301 A D > - 0 0 35 -118,-2.4 3,-2.2 -2,-0.5 -64,-0.1 -0.876 10.9-170.0-129.5 102.5 40.5 -4.4 -11.7 277 302 A L T 3 S+ 0 0 0 -66,-0.7 -65,-0.2 -63,-0.6 -66,-0.1 0.404 85.1 65.7 -79.1 6.1 43.9 -3.7 -10.2 278 303 A A T 3 S+ 0 0 1 -67,-0.4 -1,-0.3 -66,-0.1 -66,-0.1 0.480 76.0 117.5 -93.7 -6.5 44.1 -0.5 -12.2 279 304 A L < + 0 0 19 -3,-2.2 2,-0.3 -68,-0.2 -115,-0.2 -0.365 35.6 166.7 -60.9 130.9 41.2 0.9 -10.1 280 305 A H - 0 0 39 -95,-0.3 2,-0.1 -2,-0.1 -119,-0.0 -0.843 23.8-140.9-151.2 116.9 42.2 3.9 -8.0 281 306 A R - 0 0 10 -2,-0.3 -95,-0.1 2,-0.1 5,-0.1 -0.388 16.4-127.7 -82.1 149.0 39.7 6.1 -6.3 282 307 A E S S+ 0 0 92 -96,-0.1 2,-0.2 -2,-0.1 -1,-0.1 0.851 87.5 87.7 -55.5 -38.7 39.9 9.9 -5.9 283 308 A L > - 0 0 26 1,-0.1 3,-0.5 -226,-0.1 -2,-0.1 -0.459 65.6-154.5 -74.9 137.7 39.4 9.7 -2.1 284 309 A D T 3 S+ 0 0 48 -228,-0.4 -1,-0.1 1,-0.2 -227,-0.1 0.431 76.2 74.4 -92.8 -3.4 42.5 9.2 -0.0 285 310 A Y T 3 + 0 0 19 -229,-0.2 25,-0.4 -227,-0.0 26,-0.2 0.450 60.4 119.8 -98.2 2.4 41.2 7.5 3.1 286 311 A Y < + 0 0 14 -3,-0.5 22,-0.3 1,-0.1 4,-0.1 -0.394 28.5 171.0 -66.3 142.2 40.6 4.0 1.8 287 312 A T + 0 0 29 20,-3.0 21,-0.2 2,-0.2 -125,-0.2 0.570 65.2 2.5-124.4 -22.6 42.6 1.4 3.6 288 313 A G S S+ 0 0 8 19,-1.5 -127,-2.9 1,-0.4 -126,-0.1 -0.180 111.8 17.9-130.7-132.6 41.2 -1.9 2.3 289 314 A L E -D 160 0A 0 -129,-0.2 18,-2.7 17,-0.1 -1,-0.4 -0.126 59.1-176.0 -43.3 132.9 38.6 -3.0 -0.2 290 315 A V E +DF 159 306A 4 -131,-2.5 -131,-2.3 16,-0.3 2,-0.3 -0.982 7.1 173.0-131.6 150.1 37.6 -0.3 -2.8 291 316 A F E -DF 158 305A 0 14,-2.3 14,-2.0 -2,-0.3 2,-0.3 -0.997 22.7-160.4-157.6 158.6 34.9 -0.6 -5.4 292 317 A E E -DF 157 304A 33 -135,-1.9 -135,-3.5 -2,-0.3 2,-0.4 -0.989 15.6-145.1-137.0 142.0 32.8 1.1 -8.2 293 318 A M E -DF 156 303A 0 10,-3.0 9,-2.5 -2,-0.3 10,-1.1 -0.936 17.5-172.5-109.7 133.0 29.5 -0.1 -9.7 294 319 A F E -D 155 0A 32 -139,-2.7 -139,-2.7 -2,-0.4 5,-0.1 -0.940 5.4-175.3-120.8 146.0 28.7 0.5 -13.4 295 320 A A > - 0 0 6 -2,-0.3 3,-1.3 5,-0.3 -141,-0.2 -0.968 38.4 -91.9-132.1 156.2 25.6 -0.0 -15.4 296 321 A P T 3 S+ 0 0 77 0, 0.0 -144,-0.1 0, 0.0 41,-0.1 -0.429 107.2 45.9 -67.3 138.9 24.9 0.4 -19.2 297 322 A G T 3 S+ 0 0 57 -2,-0.1 2,-0.4 1,-0.1 38,-0.0 0.148 105.4 64.3 116.7 -16.4 23.7 3.9 -20.2 298 323 A V < - 0 0 36 -3,-1.3 -3,-0.3 1,-0.1 -1,-0.1 -0.999 58.7-156.5-142.7 137.0 26.2 5.8 -18.1 299 324 A G S S+ 0 0 70 -2,-0.4 -1,-0.1 -3,-0.1 3,-0.1 0.918 77.9 70.2 -76.7 -45.9 30.0 6.2 -18.3 300 325 A A S S- 0 0 35 1,-0.1 -5,-0.3 -6,-0.1 -2,-0.0 -0.351 99.6 -89.1 -71.1 154.0 30.5 7.3 -14.7 301 326 A P - 0 0 18 0, 0.0 -7,-0.3 0, 0.0 -1,-0.1 -0.329 24.0-150.7 -57.4 140.5 30.1 4.8 -11.8 302 327 A I S S+ 0 0 0 -9,-2.5 25,-3.2 1,-0.2 2,-0.3 0.595 82.1 13.7 -86.3 -13.5 26.5 4.7 -10.3 303 328 A A E -FG 293 326A 0 -10,-1.1 -10,-3.0 23,-0.3 2,-0.3 -0.987 64.5-177.8-159.3 150.3 27.9 3.8 -6.9 304 329 A Q E +FG 292 325A 13 21,-1.7 21,-2.6 -2,-0.3 2,-0.3 -0.978 15.8 134.2-148.5 157.9 31.3 3.7 -5.1 305 330 A G E +FG 291 324A 1 -14,-2.0 -14,-2.3 -2,-0.3 2,-0.3 -0.966 10.2 164.7-176.9-170.3 32.6 2.6 -1.7 306 331 A G E -FG 290 323A 0 17,-2.1 17,-1.5 -2,-0.3 2,-0.4 -0.915 44.8 -60.9 159.1-177.6 35.3 0.8 0.2 307 332 A R E + G 0 322A 7 -18,-2.7 -20,-3.0 -2,-0.3 -19,-1.5 -0.782 35.3 179.5 -98.2 138.3 36.8 0.3 3.7 308 333 A Y > + 0 0 4 13,-2.2 3,-0.6 -2,-0.4 4,-0.4 -0.744 8.1 167.2-136.9 87.2 38.4 3.2 5.6 309 334 A D T 3 S+ 0 0 48 -2,-0.3 4,-0.2 1,-0.2 10,-0.2 0.547 72.6 51.0 -83.0 -9.6 39.7 2.0 8.9 310 335 A E T 3> S+ 0 0 133 -25,-0.4 4,-0.8 2,-0.1 -1,-0.2 0.466 85.7 85.1-105.4 -3.3 41.9 5.0 9.9 311 336 A L T <4 S+ 0 0 4 -3,-0.6 3,-0.5 -26,-0.2 4,-0.5 0.875 84.8 53.5 -73.5 -39.3 39.4 7.8 9.4 312 337 A L T >4>S+ 0 0 2 7,-0.5 5,-2.1 -4,-0.4 3,-1.7 0.896 101.6 59.1 -64.8 -39.5 37.6 7.7 12.8 313 338 A A G >45S+ 0 0 58 1,-0.3 3,-1.1 -4,-0.2 -1,-0.3 0.838 101.0 58.7 -51.5 -33.3 40.9 8.0 14.6 314 339 A Q G 3<5S+ 0 0 98 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.677 107.1 46.9 -71.7 -17.1 41.2 11.3 12.7 315 340 A F G < 5S- 0 0 21 -3,-1.7 -1,-0.2 2,-0.5 -2,-0.2 0.218 128.9 -91.3-111.4 17.4 37.9 12.4 14.3 316 341 A G T < 5S+ 0 0 71 -3,-1.1 2,-0.4 -4,-0.2 -3,-0.2 0.247 105.9 79.4 93.1 -8.4 38.8 11.4 17.9 317 342 A A < - 0 0 4 -5,-2.1 2,-0.6 -6,-0.1 -2,-0.5 -0.998 65.8-150.7-129.2 132.1 37.3 7.9 17.8 318 343 A G + 0 0 56 -2,-0.4 -8,-0.1 -5,-0.2 -9,-0.1 -0.901 35.1 130.6-109.5 120.9 39.1 5.0 16.2 319 344 A A - 0 0 15 -2,-0.6 -7,-0.5 -10,-0.2 -6,-0.2 -0.984 58.5 -89.9-157.1 157.6 37.2 2.1 14.7 320 345 A P - 0 0 34 0, 0.0 2,-0.3 0, 0.0 -11,-0.2 -0.483 49.3-171.8 -68.8 140.7 37.0 0.0 11.6 321 346 A A + 0 0 0 -2,-0.1 -13,-2.2 -194,-0.1 2,-0.3 -0.990 17.8 169.9-140.5 149.3 34.7 1.5 8.9 322 347 A V E +CG 125 307A 2 -197,-2.2 -197,-3.6 -2,-0.3 2,-0.3 -0.981 16.2 134.0-148.7 154.1 33.1 0.6 5.6 323 348 A G E -CG 124 306A 0 -17,-1.5 -17,-2.1 -2,-0.3 2,-0.3 -0.976 26.2-146.6-177.8-176.4 30.4 2.1 3.4 324 349 A F E -CG 123 305A 5 -201,-1.5 -201,-1.9 -2,-0.3 2,-0.4 -0.971 7.5-143.5-161.4 165.9 29.2 3.2 -0.1 325 350 A A E -CG 122 304A 5 -21,-2.6 -21,-1.7 -2,-0.3 2,-0.3 -0.987 10.8-139.6-142.7 131.9 27.1 5.8 -1.8 326 351 A F E -CG 121 303A 2 -205,-3.3 -205,-1.4 -2,-0.4 2,-0.8 -0.666 19.5-132.3 -80.1 141.6 24.8 5.6 -4.8 327 352 A E E > -C 120 0A 7 -25,-3.2 4,-2.1 -2,-0.3 -207,-0.2 -0.891 21.1-161.4 -92.4 110.3 25.0 8.6 -7.2 328 353 A V H > S+ 0 0 0 -209,-2.8 4,-2.8 -2,-0.8 5,-0.2 0.905 83.1 51.5 -68.7 -44.3 21.2 9.3 -7.7 329 354 A E H > S+ 0 0 46 -210,-0.4 4,-1.3 1,-0.2 -1,-0.2 0.868 111.9 49.6 -61.3 -35.2 21.3 11.3 -10.9 330 355 A R H > S+ 0 0 81 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.908 109.4 49.8 -69.2 -44.3 23.4 8.6 -12.5 331 356 A V H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 5,-0.2 0.922 107.7 55.8 -57.0 -43.3 21.0 5.8 -11.4 332 357 A M H X S+ 0 0 7 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.887 107.0 51.5 -54.9 -38.3 18.2 8.0 -12.8 333 358 A A H X S+ 0 0 39 -4,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.846 108.3 47.3 -73.7 -34.5 20.0 8.0 -16.1 334 359 A V H X S+ 0 0 0 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.852 111.8 52.3 -75.4 -30.3 20.5 4.2 -16.4 335 360 A L H X S+ 0 0 28 -4,-2.2 4,-0.8 -5,-0.2 -2,-0.2 0.909 110.5 48.4 -65.4 -41.5 16.9 3.7 -15.5 336 361 A E H >X S+ 0 0 76 -4,-1.9 4,-1.0 -5,-0.2 3,-0.7 0.905 109.7 51.0 -65.6 -41.5 15.9 6.1 -18.3 337 362 A A H 3< S+ 0 0 43 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.733 105.0 57.5 -70.9 -21.9 18.2 4.4 -20.8 338 363 A Q H 3< S+ 0 0 43 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.731 107.5 48.5 -76.4 -24.3 16.6 1.0 -20.0 339 364 A E H << 0 0 169 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.658 360.0 360.0 -86.7 -18.4 13.2 2.5 -20.9 340 365 A E < 0 0 185 -4,-1.0 -3,-0.1 0, 0.0 -4,-0.0 0.115 360.0 360.0-101.3 360.0 14.5 4.0 -24.2