==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR 25-AUG-13 4ME9 . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR, TETR FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 374 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18710.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 285 76.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.1 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 . 6 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 238 63.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.6 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 0 2 2 2 0 0 0 0 0 3 0 1 2 0 2 2 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 0 ANTIPARALLEL 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 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A X 0 0 240 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 114.6 35.0 12.7 -25.9 2 2 A A - 0 0 109 1,-0.1 2,-0.3 2,-0.0 0, 0.0 -0.184 360.0-146.9 -46.4 108.1 31.8 14.6 -26.8 3 3 A K - 0 0 76 -2,-0.1 2,-0.6 1,-0.1 -1,-0.1 -0.637 19.1-111.3 -84.7 139.1 30.6 16.5 -23.6 4 4 A N > - 0 0 95 -2,-0.3 3,-0.7 1,-0.1 4,-0.3 -0.601 25.4-169.3 -74.7 112.9 26.9 17.0 -23.0 5 5 A K T 3> + 0 0 93 -2,-0.6 4,-2.2 1,-0.2 5,-0.2 0.444 65.9 95.7 -81.9 0.1 26.0 20.7 -23.3 6 6 A Q H 3> S+ 0 0 32 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.825 80.8 53.3 -58.5 -37.5 22.5 20.1 -21.8 7 7 A E H <> S+ 0 0 137 -3,-0.7 4,-2.4 2,-0.2 -1,-0.2 0.950 111.7 44.2 -65.0 -47.3 23.6 21.1 -18.3 8 8 A D H > S+ 0 0 82 -4,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.861 115.1 49.5 -63.2 -38.1 25.1 24.4 -19.5 9 9 A I H X S+ 0 0 2 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.906 112.2 47.7 -67.7 -44.8 21.9 25.1 -21.7 10 10 A F H X S+ 0 0 20 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.889 112.8 48.7 -64.1 -40.8 19.5 24.3 -18.7 11 11 A D H X S+ 0 0 56 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.918 113.4 46.9 -64.7 -45.5 21.5 26.6 -16.3 12 12 A A H X S+ 0 0 5 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.887 112.2 50.9 -61.9 -41.9 21.5 29.4 -18.9 13 13 A A H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 -2,-0.2 0.900 108.5 50.4 -66.3 -41.5 17.8 29.0 -19.6 14 14 A X H X S+ 0 0 17 -4,-2.2 4,-2.1 2,-0.2 5,-0.2 0.892 107.1 53.6 -66.2 -39.5 16.8 29.1 -15.9 15 15 A Q H X S+ 0 0 92 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.893 115.2 41.7 -61.1 -37.4 18.8 32.3 -15.3 16 16 A L H X S+ 0 0 16 -4,-1.5 4,-3.1 2,-0.2 5,-0.3 0.887 112.2 53.6 -76.1 -39.6 16.9 33.9 -18.2 17 17 A F H X S+ 0 0 13 -4,-3.0 4,-0.7 3,-0.2 5,-0.3 0.825 115.4 42.4 -61.6 -33.1 13.5 32.4 -17.1 18 18 A A H < S+ 0 0 90 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.896 123.3 34.7 -79.5 -45.6 14.1 33.9 -13.6 19 19 A E H < S+ 0 0 144 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.755 137.5 19.4 -82.8 -28.1 15.4 37.4 -14.7 20 20 A R H < S- 0 0 51 -4,-3.1 4,-0.4 -5,-0.2 -3,-0.2 0.310 108.9-108.2-125.8 6.9 13.2 37.7 -17.9 21 21 A G X - 0 0 33 -4,-0.7 4,-1.4 -5,-0.3 -3,-0.2 0.339 29.3 -92.6 76.5 148.2 10.2 35.2 -17.5 22 22 A Y T 4 S+ 0 0 22 -5,-0.3 3,-0.3 1,-0.2 -1,-0.1 0.913 126.5 48.4 -60.4 -45.0 9.7 31.9 -19.3 23 23 A D T 4 S+ 0 0 120 1,-0.2 -1,-0.2 -6,-0.1 -2,-0.1 0.809 111.7 50.7 -65.7 -32.2 7.4 33.6 -22.1 24 24 A G T 4 S+ 0 0 41 -4,-0.4 -1,-0.2 -7,-0.1 -2,-0.2 0.744 93.7 91.5 -76.4 -24.2 10.0 36.4 -22.6 25 25 A T < - 0 0 0 -4,-1.4 2,-0.2 -3,-0.3 23,-0.1 -0.485 55.6-172.9 -77.8 141.9 13.0 34.0 -23.0 26 26 A T > - 0 0 57 -2,-0.2 4,-1.4 1,-0.1 5,-0.1 -0.783 37.2-106.2-127.3 168.4 14.0 32.7 -26.5 27 27 A I H > S+ 0 0 7 -2,-0.2 4,-2.4 2,-0.2 3,-0.4 0.934 117.7 53.4 -65.7 -46.0 16.5 30.1 -27.9 28 28 A P H > S+ 0 0 65 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.890 107.4 52.8 -58.0 -37.6 19.0 32.7 -29.2 29 29 A X H > S+ 0 0 79 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.873 110.8 46.4 -61.2 -40.0 19.1 34.4 -25.7 30 30 A I H X S+ 0 0 0 -4,-1.4 4,-2.2 -3,-0.4 -1,-0.2 0.862 111.0 53.3 -69.7 -37.3 19.9 30.9 -24.1 31 31 A A H X>S+ 0 0 5 -4,-2.4 5,-2.7 2,-0.2 4,-0.7 0.888 110.3 47.3 -64.0 -40.2 22.6 30.3 -26.8 32 32 A E H ><5S+ 0 0 159 -4,-2.2 3,-0.6 3,-0.2 -2,-0.2 0.931 115.8 42.9 -67.1 -47.9 24.2 33.7 -25.9 33 33 A K H 3<5S+ 0 0 109 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.812 116.5 48.3 -69.2 -32.1 24.2 33.1 -22.1 34 34 A A H 3<5S- 0 0 20 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.574 108.8-127.0 -81.2 -11.9 25.3 29.5 -22.6 35 35 A K T <<5S+ 0 0 96 -4,-0.7 2,-0.3 -3,-0.6 -3,-0.2 0.912 70.4 116.7 61.6 48.2 28.2 30.6 -25.0 36 36 A V S - 0 0 40 -2,-0.3 4,-1.2 1,-0.1 3,-0.4 -0.557 30.7-122.4 -79.7 151.0 25.6 28.5 -31.2 38 38 A A H > S+ 0 0 43 1,-0.2 4,-1.7 -2,-0.2 3,-0.1 0.873 113.1 56.1 -59.0 -38.7 21.7 28.6 -31.8 39 39 A G H > S+ 0 0 53 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.798 99.8 57.6 -63.4 -35.3 22.0 25.6 -34.0 40 40 A T H >> S+ 0 0 50 -3,-0.4 4,-1.3 2,-0.2 3,-0.6 0.888 106.2 49.9 -67.2 -36.5 23.7 23.4 -31.3 41 41 A I H 3X S+ 0 0 0 -4,-1.2 4,-2.9 1,-0.2 3,-0.4 0.928 108.5 52.9 -65.3 -42.7 20.6 24.1 -28.9 42 42 A Y H 3< S+ 0 0 118 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.648 100.9 62.5 -67.2 -15.9 18.3 23.0 -31.8 43 43 A R H << S+ 0 0 159 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.915 115.1 31.6 -72.0 -43.9 20.3 19.8 -32.1 44 44 A Y H < S+ 0 0 52 -4,-1.3 2,-0.4 -3,-0.4 -2,-0.2 0.878 131.1 29.0 -77.2 -44.3 19.3 18.8 -28.5 45 45 A F < - 0 0 9 -4,-2.9 -1,-0.2 -5,-0.1 3,-0.1 -0.987 59.3-149.1-127.6 131.2 15.8 20.5 -28.5 46 46 A E S S- 0 0 162 -2,-0.4 2,-0.2 -3,-0.1 -1,-0.1 0.844 83.0 -19.6 -61.4 -36.8 13.3 21.1 -31.3 47 47 A N S > S- 0 0 59 -6,-0.1 4,-2.1 -20,-0.0 3,-0.3 -0.910 77.9 -81.3-158.2 178.6 12.0 24.3 -29.4 48 48 A K H > S+ 0 0 41 -2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.820 125.5 57.0 -60.9 -34.0 11.8 26.1 -26.0 49 49 A E H > S+ 0 0 89 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.851 109.0 45.8 -67.8 -33.9 8.8 23.9 -25.0 50 50 A A H > S+ 0 0 33 -3,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.911 113.0 50.1 -71.3 -46.4 11.0 20.7 -25.6 51 51 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.933 113.3 44.7 -54.0 -53.6 14.0 22.2 -23.7 52 52 A V H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.835 112.7 51.8 -67.5 -32.4 11.8 23.2 -20.7 53 53 A N H X S+ 0 0 3 -4,-1.4 4,-2.6 2,-0.2 -1,-0.2 0.842 109.8 49.5 -71.8 -33.7 10.0 19.8 -20.7 54 54 A S H X S+ 0 0 22 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.940 112.1 48.5 -68.7 -45.2 13.4 18.0 -20.7 55 55 A L H X S+ 0 0 4 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.950 115.6 44.3 -57.2 -48.7 14.6 20.2 -17.8 56 56 A F H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.940 115.1 46.5 -62.7 -54.4 11.3 19.5 -15.8 57 57 A S H X S+ 0 0 11 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.906 112.9 49.4 -55.3 -48.9 11.2 15.7 -16.5 58 58 A K H X S+ 0 0 92 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.930 113.3 45.9 -61.4 -46.0 14.9 15.2 -15.7 59 59 A S H X S+ 0 0 12 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.914 113.5 48.6 -63.6 -48.0 14.7 17.1 -12.3 60 60 A X H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.890 113.1 47.8 -58.8 -42.8 11.4 15.4 -11.2 61 61 A L H X S+ 0 0 87 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.847 111.3 50.4 -70.7 -30.6 12.9 12.0 -12.1 62 62 A Q H X S+ 0 0 99 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.912 114.5 44.3 -72.3 -37.2 16.1 12.8 -10.2 63 63 A L H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 5,-0.2 0.922 111.6 52.9 -68.5 -45.0 14.1 13.9 -7.1 64 64 A S H >X S+ 0 0 21 -4,-3.0 4,-3.4 1,-0.2 3,-0.5 0.959 111.7 47.1 -51.4 -50.7 11.8 10.8 -7.5 65 65 A E H 3X S+ 0 0 99 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.877 108.4 54.8 -56.9 -47.2 15.0 8.6 -7.5 66 66 A X H 3< S+ 0 0 56 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.818 118.7 33.5 -58.0 -37.1 16.4 10.4 -4.4 67 67 A I H << S+ 0 0 2 -4,-1.8 -2,-0.2 -3,-0.5 -1,-0.2 0.882 118.0 50.1 -88.6 -45.3 13.2 9.7 -2.4 68 68 A K H >< S+ 0 0 80 -4,-3.4 3,-1.5 -5,-0.2 2,-0.4 0.719 88.8 96.1 -69.6 -20.7 12.2 6.3 -3.7 69 69 A T T 3< S- 0 0 63 -4,-1.8 -4,-0.0 -5,-0.3 0, 0.0 -0.600 107.0 -4.4 -73.2 124.9 15.7 4.9 -3.2 70 70 A D T 3 S+ 0 0 123 -2,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.756 89.0 178.3 60.7 31.6 15.8 3.0 0.2 71 71 A F < - 0 0 26 -3,-1.5 2,-2.2 1,-0.1 -1,-0.2 -0.451 34.4-124.7 -65.1 125.6 12.3 4.2 0.9 72 72 A P > + 0 0 23 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.420 42.3 166.9 -79.6 77.4 11.3 2.6 4.3 73 73 A V T 3 S+ 0 0 105 -2,-2.2 7,-0.1 1,-0.3 -2,-0.0 0.831 75.2 45.3 -56.7 -42.0 8.2 0.8 3.1 74 74 A E T 3 S+ 0 0 180 -3,-0.2 -1,-0.3 6,-0.0 2,-0.0 0.509 98.9 92.2 -86.0 -3.2 7.8 -1.4 6.3 75 75 A A S < S- 0 0 39 -3,-1.3 2,-0.0 1,-0.1 0, 0.0 -0.247 85.3 -91.2 -82.0 173.8 8.5 1.6 8.7 76 76 A N > - 0 0 104 1,-0.1 4,-2.2 -2,-0.0 3,-0.3 -0.245 41.3 -99.9 -77.5 170.6 5.9 3.9 10.3 77 77 A I H > S+ 0 0 30 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.876 122.6 63.0 -63.0 -32.3 4.7 7.2 8.7 78 78 A R H > S+ 0 0 74 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.888 109.8 38.5 -54.3 -47.8 7.1 9.1 11.1 79 79 A E H > S+ 0 0 82 -3,-0.3 4,-3.0 2,-0.2 5,-0.2 0.872 114.5 52.0 -73.2 -42.0 10.1 7.3 9.5 80 80 A Q H X S+ 0 0 19 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.904 112.9 47.5 -61.8 -37.9 8.7 7.5 5.9 81 81 A F H X S+ 0 0 22 -4,-3.0 4,-3.2 2,-0.2 5,-0.2 0.937 111.7 49.9 -63.4 -50.2 8.3 11.3 6.5 82 82 A S H X S+ 0 0 23 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.931 113.1 46.5 -55.4 -49.8 11.8 11.6 7.9 83 83 A H H X S+ 0 0 22 -4,-3.0 4,-2.4 2,-0.2 5,-0.3 0.930 114.9 46.5 -57.8 -51.0 13.3 9.8 5.0 84 84 A T H X S+ 0 0 22 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.935 113.2 48.8 -58.4 -50.2 11.2 11.8 2.4 85 85 A Y H X S+ 0 0 3 -4,-3.2 4,-2.4 2,-0.2 -1,-0.2 0.872 114.4 43.9 -58.3 -47.7 12.0 15.2 4.1 86 86 A N H X S+ 0 0 48 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.889 115.2 47.2 -68.6 -43.7 15.8 14.6 4.3 87 87 A R H X S+ 0 0 47 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.874 113.4 50.3 -65.2 -36.1 16.1 13.2 0.8 88 88 A L H X S+ 0 0 17 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.924 112.7 45.9 -65.2 -47.1 14.0 16.2 -0.5 89 89 A F H X S+ 0 0 2 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.883 112.5 50.9 -63.1 -42.5 16.3 18.7 1.4 90 90 A E H X S+ 0 0 77 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.876 112.1 47.1 -62.0 -42.8 19.5 16.9 0.1 91 91 A F H X S+ 0 0 5 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.930 115.4 44.6 -64.3 -48.9 18.2 17.0 -3.5 92 92 A A H < S+ 0 0 0 -4,-2.4 3,-0.4 2,-0.2 -2,-0.2 0.915 112.6 52.8 -61.1 -43.5 17.2 20.7 -3.2 93 93 A R H < S+ 0 0 125 -4,-2.9 3,-0.5 1,-0.2 -2,-0.2 0.880 117.9 36.1 -57.9 -45.8 20.6 21.6 -1.4 94 94 A N H < S+ 0 0 109 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.507 125.4 39.2 -89.1 -10.7 22.7 19.9 -4.3 95 95 A N S X S+ 0 0 70 -4,-1.1 4,-2.0 -3,-0.4 5,-0.2 -0.395 71.3 155.6-135.1 54.4 20.4 21.0 -7.2 96 96 A V H > + 0 0 45 -3,-0.5 4,-1.3 1,-0.2 -1,-0.1 0.885 69.2 45.9 -54.1 -51.7 19.5 24.5 -6.1 97 97 A D H > S+ 0 0 88 1,-0.2 4,-1.5 2,-0.2 3,-0.3 0.967 116.3 39.9 -58.8 -64.9 18.7 26.0 -9.5 98 98 A A H > S+ 0 0 15 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.738 110.0 59.0 -59.6 -33.1 16.5 23.2 -11.0 99 99 A F H X S+ 0 0 0 -4,-2.0 4,-2.0 -7,-0.2 -1,-0.2 0.935 106.0 46.0 -64.9 -50.3 14.5 22.3 -7.9 100 100 A L H X S+ 0 0 39 -4,-1.3 4,-1.0 -3,-0.3 -2,-0.2 0.967 117.0 45.4 -57.6 -52.7 13.0 25.8 -7.4 101 101 A F H >X S+ 0 0 19 -4,-1.5 4,-0.8 1,-0.2 3,-0.7 0.905 113.2 48.2 -52.8 -59.6 12.1 26.1 -11.1 102 102 A T H >< S+ 0 0 0 -4,-2.3 3,-0.7 1,-0.2 -1,-0.2 0.889 112.9 45.0 -57.4 -45.9 10.5 22.6 -11.5 103 103 A N H 3< S+ 0 0 24 -4,-2.0 3,-0.2 1,-0.2 -1,-0.2 0.633 112.4 52.5 -81.1 -8.8 8.3 22.7 -8.3 104 104 A S H << S+ 0 0 81 -4,-1.0 -1,-0.2 -3,-0.7 -2,-0.2 0.547 114.4 43.4 -94.2 -12.4 7.0 26.3 -9.1 105 105 A H S X< S+ 0 0 49 -4,-0.8 3,-1.1 -3,-0.7 -2,-0.2 -0.013 73.9 115.9-121.0 29.1 6.0 25.2 -12.7 106 106 A C T 3 S+ 0 0 40 -3,-0.2 -1,-0.1 1,-0.2 -3,-0.1 0.583 86.4 37.7 -76.1 -12.9 4.4 21.8 -12.0 107 107 A D T 3 S+ 0 0 156 -3,-0.2 -1,-0.2 -4,-0.0 -2,-0.1 0.102 89.4 138.7-119.4 18.5 0.9 23.1 -13.2 108 108 A S X - 0 0 30 -3,-1.1 3,-1.1 1,-0.1 -3,-0.1 -0.258 60.0-127.7 -68.0 150.2 2.3 25.3 -16.2 109 109 A Y T 3 S+ 0 0 158 1,-0.2 -1,-0.1 0, 0.0 -4,-0.0 0.732 105.2 63.3 -65.2 -30.2 0.6 25.4 -19.6 110 110 A F T 3 S+ 0 0 3 -5,-0.1 2,-0.3 2,-0.0 -1,-0.2 0.528 75.1 111.4 -76.8 -10.6 3.9 24.5 -21.4 111 111 A L < - 0 0 6 -3,-1.1 -61,-0.1 -6,-0.1 -62,-0.0 -0.546 61.9-140.1 -69.6 130.3 4.2 20.9 -19.7 112 112 A D > - 0 0 60 -2,-0.3 4,-2.2 -63,-0.2 5,-0.2 -0.206 32.0 -91.6 -79.8 174.6 3.7 18.1 -22.2 113 113 A E H > S+ 0 0 76 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.881 126.1 50.8 -57.8 -40.8 1.8 14.8 -21.4 114 114 A Q H > S+ 0 0 134 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.888 109.0 50.1 -67.5 -41.2 5.0 13.0 -20.2 115 115 A S H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.941 113.8 46.5 -60.6 -43.8 6.0 15.8 -17.9 116 116 A K H X S+ 0 0 104 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.882 112.1 49.6 -66.3 -39.4 2.5 15.8 -16.4 117 117 A K H X S+ 0 0 128 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.879 110.9 50.8 -68.1 -36.4 2.5 12.0 -16.0 118 118 A I H X S+ 0 0 23 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.943 115.1 42.5 -63.1 -49.9 6.0 12.1 -14.3 119 119 A F H X S+ 0 0 25 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.884 114.8 49.2 -63.4 -44.9 4.8 14.7 -11.8 120 120 A D H X S+ 0 0 95 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.876 111.5 49.4 -66.9 -38.9 1.3 13.1 -11.2 121 121 A D H X S+ 0 0 89 -4,-2.2 4,-0.7 -5,-0.2 -1,-0.2 0.875 115.3 45.8 -65.4 -37.0 3.0 9.7 -10.6 122 122 A F H X S+ 0 0 14 -4,-1.7 4,-0.8 -5,-0.2 3,-0.4 0.947 117.7 39.8 -70.2 -52.6 5.4 11.4 -8.1 123 123 A I H >X S+ 0 0 41 -4,-3.1 4,-2.2 1,-0.2 3,-1.2 0.939 109.9 59.7 -67.3 -42.6 2.9 13.5 -6.2 124 124 A G H 3X S+ 0 0 33 -4,-2.3 4,-2.0 1,-0.3 -1,-0.2 0.756 96.9 63.0 -55.2 -29.2 0.2 10.7 -6.1 125 125 A F H 3X S+ 0 0 64 -4,-0.7 4,-1.1 -3,-0.4 -1,-0.3 0.915 110.3 37.0 -63.1 -42.7 2.7 8.5 -4.3 126 126 A F H S+ 0 0 0 -4,-2.3 5,-2.0 2,-0.2 6,-1.9 0.852 110.6 48.9 -64.5 -38.2 -2.2 8.8 7.6 134 134 A I H ><5S+ 0 0 42 -4,-2.4 3,-1.1 4,-0.2 -2,-0.2 0.927 111.4 49.8 -66.7 -45.7 -5.4 11.0 7.7 135 135 A V H 3<5S+ 0 0 125 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.867 108.0 52.8 -61.6 -41.6 -7.7 7.9 7.8 136 136 A K T 3<5S- 0 0 157 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.568 115.8-117.3 -71.3 -8.9 -5.7 6.3 10.7 137 137 A G T < 5S+ 0 0 48 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.598 87.7 111.3 81.3 16.9 -6.1 9.6 12.7 138 138 A L < + 0 0 66 -5,-2.0 49,-2.3 -6,-0.2 2,-0.3 0.810 69.3 49.8 -91.2 -38.4 -2.3 10.2 12.7 139 139 A L B S-A 186 0A 5 -6,-1.9 47,-0.3 47,-0.3 -2,-0.1 -0.735 101.3 -85.9-101.9 158.3 -2.2 13.2 10.4 140 140 A R - 0 0 18 45,-2.7 2,-2.7 -2,-0.3 -1,-0.1 -0.313 41.3-114.9 -56.2 137.1 -4.3 16.4 10.6 141 141 A P S S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 222,-0.1 -0.315 72.3 130.7 -77.7 67.8 -7.6 16.1 8.8 142 142 A L S S- 0 0 8 -2,-2.7 5,-0.1 43,-0.1 -8,-0.1 -0.759 74.5 -80.0-109.0 161.2 -6.7 18.7 6.2 143 143 A P >> - 0 0 48 0, 0.0 3,-1.4 0, 0.0 4,-1.3 -0.393 46.1-121.5 -59.0 133.8 -7.0 18.4 2.4 144 144 A P H 3> S+ 0 0 30 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.838 113.6 55.9 -50.5 -35.3 -3.9 16.3 1.4 145 145 A V H 3> S+ 0 0 40 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.842 103.3 55.7 -66.2 -31.2 -2.7 19.1 -1.0 146 146 A A H <> S+ 0 0 0 -3,-1.4 4,-1.9 1,-0.2 -1,-0.2 0.886 107.2 49.2 -67.5 -35.8 -2.7 21.5 2.1 147 147 A L H X S+ 0 0 2 -4,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.845 109.1 51.6 -72.6 -31.6 -0.4 19.1 4.0 148 148 A I H X S+ 0 0 34 -4,-1.7 4,-3.2 2,-0.2 5,-0.2 0.916 111.2 48.6 -67.8 -42.8 2.0 18.9 1.0 149 149 A I H X S+ 0 0 12 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.886 108.2 54.4 -59.4 -44.0 2.1 22.8 0.9 150 150 A I H < S+ 0 0 9 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.876 117.7 35.9 -60.5 -40.1 2.7 22.9 4.8 151 151 A V H X S+ 0 0 21 -4,-1.6 4,-0.9 2,-0.1 -2,-0.2 0.920 124.5 39.7 -78.8 -50.0 5.8 20.6 4.3 152 152 A Y H X S+ 0 0 30 -4,-3.2 4,-2.7 -5,-0.2 5,-0.2 0.886 105.7 57.6 -71.3 -50.4 7.1 21.9 1.0 153 153 A Q H X S+ 0 0 26 -4,-2.4 4,-2.2 -5,-0.2 5,-0.2 0.900 107.6 46.7 -59.6 -44.0 6.6 25.8 1.0 154 154 A P H > S+ 0 0 4 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.932 115.9 47.1 -59.4 -43.5 8.8 26.5 4.2 155 155 A L H X S+ 0 0 0 -4,-0.9 4,-2.4 2,-0.2 -2,-0.2 0.941 111.0 51.2 -58.9 -53.9 11.5 24.1 2.8 156 156 A E H X S+ 0 0 20 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.899 114.0 43.8 -50.3 -49.0 11.4 25.8 -0.6 157 157 A K H X S+ 0 0 67 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.889 111.2 53.3 -70.3 -38.4 11.8 29.3 0.9 158 158 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.867 106.9 52.8 -64.5 -35.0 14.5 28.2 3.4 159 159 A I H X S+ 0 0 6 -4,-2.4 4,-2.9 2,-0.2 -1,-0.2 0.939 110.9 47.6 -61.7 -46.7 16.6 26.8 0.4 160 160 A K H X S+ 0 0 84 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.875 113.4 47.4 -59.0 -42.5 16.2 30.3 -1.3 161 161 A V H <>S+ 0 0 7 -4,-2.3 5,-1.2 2,-0.2 6,-1.1 0.881 113.3 47.6 -70.1 -39.1 17.2 32.1 1.9 162 162 A I H ><5S+ 0 0 33 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.939 108.1 57.0 -65.3 -43.7 20.2 29.7 2.4 163 163 A A H 3<5S+ 0 0 65 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.758 105.5 50.4 -58.1 -29.6 21.1 30.3 -1.4 164 164 A T T 3<5S- 0 0 105 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.569 114.8-119.0 -81.5 -14.1 21.3 34.1 -0.7 165 165 A G T < 5S+ 0 0 40 -3,-1.8 -3,-0.2 -4,-0.5 -2,-0.1 0.408 85.3 117.4 88.4 1.1 23.6 33.5 2.3 166 166 A Q S - 0 0 52 1,-0.1 4,-1.8 -2,-0.0 5,-0.2 -0.958 49.9-118.9-161.2 152.9 23.9 22.7 8.8 171 171 A K H > S+ 0 0 179 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.896 118.2 51.5 -60.3 -39.5 22.9 19.1 9.7 172 172 A E H > S+ 0 0 98 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.840 105.2 56.0 -67.5 -34.3 21.2 20.5 13.0 173 173 A L H > S+ 0 0 11 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.955 112.0 42.1 -62.1 -47.9 19.2 23.1 10.9 174 174 A V H X S+ 0 0 7 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.872 111.8 55.1 -66.6 -41.3 17.7 20.3 8.7 175 175 A K H X S+ 0 0 104 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.924 113.6 41.9 -57.3 -43.8 17.1 18.0 11.8 176 176 A E H X S+ 0 0 24 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.891 113.8 51.2 -70.8 -40.8 15.1 20.8 13.5 177 177 A L H X S+ 0 0 2 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.835 109.7 51.8 -65.1 -32.5 13.2 21.8 10.3 178 178 A E H X S+ 0 0 9 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.907 109.8 47.2 -70.7 -41.7 12.3 18.2 9.8 179 179 A E H X S+ 0 0 50 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.885 112.2 51.9 -65.6 -38.1 10.9 17.9 13.4 180 180 A S H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.933 110.2 47.3 -61.8 -49.8 9.0 21.2 12.9 181 181 A S H X S+ 0 0 6 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.842 111.9 50.2 -62.6 -37.2 7.4 19.9 9.6 182 182 A W H X S+ 0 0 15 -4,-2.0 4,-1.9 1,-0.2 3,-0.4 0.932 111.2 48.8 -66.6 -43.7 6.4 16.6 11.2 183 183 A N H < S+ 0 0 9 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.796 107.5 57.7 -65.0 -28.4 4.8 18.5 14.2 184 184 A A H < S+ 0 0 3 -4,-1.7 -1,-0.2 186,-0.2 -2,-0.2 0.857 116.0 32.2 -68.5 -37.3 3.0 20.7 11.6 185 185 A I H < S+ 0 0 7 -4,-1.3 -45,-2.7 -3,-0.4 -2,-0.2 0.637 105.3 80.1 -99.0 -18.1 1.2 17.7 9.9 186 186 A R B < S-A 139 0A 52 -4,-1.9 2,-0.5 -47,-0.3 -47,-0.3 -0.482 82.0-110.7 -89.0 166.2 0.7 15.2 12.8 187 187 A I 0 0 77 -49,-2.3 -2,-0.1 -2,-0.1 -3,-0.1 -0.827 360.0 360.0 -91.0 120.0 -2.0 15.1 15.6 188 188 A I 0 0 101 -2,-0.5 -50,-0.0 -5,-0.1 -5,-0.0 -0.847 360.0 360.0 -98.8 360.0 -0.0 15.9 18.8 189 !* 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 0.0 190 3 B K > 0 0 102 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 154.3 -11.6 57.5 -0.2 191 4 B N H > + 0 0 89 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.745 360.0 53.0 -68.8 -25.3 -13.7 55.8 -2.9 192 5 B K H > S+ 0 0 60 2,-0.2 4,-2.0 3,-0.1 -1,-0.2 0.969 112.5 42.4 -71.6 -53.6 -11.6 57.7 -5.6 193 6 B Q H > S+ 0 0 68 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.845 115.7 50.2 -57.0 -45.9 -8.2 56.5 -4.2 194 7 B E H X S+ 0 0 56 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.883 110.4 48.3 -64.0 -43.0 -9.5 52.9 -3.6 195 8 B D H X S+ 0 0 87 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.858 110.1 53.2 -70.7 -32.4 -11.0 52.6 -7.2 196 9 B I H X S+ 0 0 9 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.947 113.1 43.4 -62.9 -48.2 -7.6 53.9 -8.7 197 10 B F H X S+ 0 0 18 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.890 114.6 49.1 -64.8 -41.3 -5.7 51.2 -6.7 198 11 B D H X S+ 0 0 46 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.913 114.2 45.9 -64.5 -42.3 -8.3 48.5 -7.6 199 12 B A H X S+ 0 0 9 -4,-2.6 4,-1.3 2,-0.2 -2,-0.2 0.807 112.9 50.6 -69.0 -34.2 -8.1 49.5 -11.3 200 13 B A H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.897 109.6 50.7 -69.5 -41.3 -4.2 49.6 -11.1 201 14 B X H X S+ 0 0 26 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.914 109.1 50.3 -62.6 -45.8 -4.1 46.1 -9.5 202 15 B Q H X S+ 0 0 60 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.855 115.0 44.1 -61.9 -37.6 -6.4 44.5 -12.3 203 16 B L H X S+ 0 0 16 -4,-1.3 4,-3.1 2,-0.2 5,-0.3 0.888 111.1 53.1 -75.8 -39.8 -4.1 46.1 -15.0 204 17 B F H X S+ 0 0 13 -4,-2.7 4,-0.7 3,-0.2 5,-0.3 0.825 115.8 42.2 -61.9 -33.3 -0.8 45.1 -13.2 205 18 B A H < S+ 0 0 91 -4,-1.9 -2,-0.2 3,-0.2 -1,-0.2 0.895 123.6 34.5 -79.5 -45.6 -2.2 41.5 -13.1 206 19 B E H < S+ 0 0 95 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.745 137.5 19.8 -83.0 -27.3 -3.6 41.3 -16.6 207 20 B R H < S- 0 0 53 -4,-3.1 4,-0.4 -5,-0.1 -3,-0.2 0.316 108.5-109.7-125.9 6.2 -1.0 43.5 -18.4 208 21 B G X - 0 0 32 -4,-0.7 4,-1.6 -5,-0.3 -3,-0.2 0.341 28.7 -92.9 76.0 149.8 2.1 43.5 -16.0 209 22 B Y T 4 S+ 0 0 38 -5,-0.3 3,-0.3 1,-0.2 -1,-0.1 0.924 126.3 48.2 -60.9 -48.0 3.4 46.4 -13.9 210 23 B D T 4 S+ 0 0 147 1,-0.2 -1,-0.2 -6,-0.1 -2,-0.1 0.810 112.7 49.5 -64.8 -31.7 5.9 47.6 -16.7 211 24 B G T 4 S+ 0 0 46 -4,-0.4 -1,-0.2 -7,-0.1 -2,-0.2 0.754 94.3 89.6 -77.1 -28.1 3.2 47.4 -19.4 212 25 B T < - 0 0 0 -4,-1.6 2,-0.2 -3,-0.3 23,-0.1 -0.415 57.0-171.3 -74.6 146.3 0.5 49.4 -17.3 213 26 B T > - 0 0 64 -2,-0.1 4,-1.4 1,-0.1 5,-0.1 -0.820 36.7-104.8-130.4 168.8 0.3 53.2 -17.7 214 27 B I H > S+ 0 0 7 -2,-0.2 4,-2.4 2,-0.2 3,-0.4 0.934 118.0 53.7 -65.8 -46.0 -1.5 56.1 -15.9 215 28 B P H > S+ 0 0 66 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.889 107.3 52.8 -57.9 -37.6 -4.1 56.7 -18.7 216 29 B X H > S+ 0 0 73 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.875 111.0 46.1 -61.1 -40.3 -5.0 52.9 -18.6 217 30 B I H X S+ 0 0 0 -4,-1.4 4,-2.3 -3,-0.4 -1,-0.2 0.860 111.0 53.6 -69.9 -37.4 -5.6 53.2 -14.8 218 31 B A H X>S+ 0 0 5 -4,-2.4 5,-2.6 2,-0.2 4,-0.6 0.893 110.2 47.1 -63.5 -40.9 -7.7 56.4 -15.4 219 32 B E H ><5S+ 0 0 158 -4,-2.3 3,-0.6 3,-0.2 -2,-0.2 0.929 116.0 43.0 -66.5 -47.9 -9.9 54.6 -18.0 220 33 B K H 3<5S+ 0 0 70 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.816 116.7 47.0 -69.8 -33.3 -10.5 51.5 -15.8 221 34 B A H 3<5S- 0 0 6 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.535 110.2-125.1 -83.5 -7.5 -11.1 53.7 -12.6 222 35 B K T <<5S+ 0 0 92 -4,-0.6 2,-0.2 -3,-0.6 -3,-0.2 0.887 71.5 112.9 62.9 47.3 -13.5 56.0 -14.7 223 36 B V S - 0 0 37 -2,-0.2 4,-1.5 1,-0.1 3,-0.5 -0.658 27.7-127.7 -88.1 145.5 -9.3 61.7 -15.7 225 38 B A H > S+ 0 0 34 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.865 112.3 57.6 -60.8 -33.7 -5.6 61.1 -16.0 226 39 B G H > S+ 0 0 56 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.840 102.1 53.8 -62.3 -36.0 -5.0 64.7 -14.6 227 40 B T H >> S+ 0 0 81 -3,-0.5 4,-1.3 2,-0.2 3,-0.5 0.889 107.8 50.3 -67.9 -36.9 -7.0 63.7 -11.4 228 41 B I H 3X S+ 0 0 0 -4,-1.5 4,-3.1 1,-0.2 3,-0.3 0.923 108.2 52.9 -64.7 -42.2 -4.6 60.7 -10.9 229 42 B Y H 3< S+ 0 0 116 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.665 101.3 61.4 -67.7 -16.3 -1.6 63.1 -11.3 230 43 B R H << S+ 0 0 90 -4,-0.8 -1,-0.2 -3,-0.5 -2,-0.2 0.925 115.9 31.6 -71.5 -44.2 -3.2 65.3 -8.6 231 44 B Y H < S+ 0 0 62 -4,-1.3 2,-0.4 -3,-0.3 -2,-0.2 0.874 131.0 29.4 -77.2 -44.7 -2.9 62.3 -6.1 232 45 B F < - 0 0 11 -4,-3.1 -1,-0.2 -5,-0.1 3,-0.1 -0.987 59.6-149.7-127.5 130.6 0.3 60.7 -7.6 233 46 B E S S- 0 0 165 -2,-0.4 2,-0.2 -3,-0.1 -1,-0.1 0.845 82.4 -20.3 -61.3 -36.7 3.3 62.2 -9.4 234 47 B N S > S- 0 0 61 -6,-0.1 4,-1.8 1,-0.0 3,-0.3 -0.912 77.6 -80.8-158.4 179.0 3.8 58.9 -11.4 235 48 B K H > S+ 0 0 42 -2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.824 125.4 56.1 -61.1 -36.0 3.1 55.1 -11.5 236 49 B E H > S+ 0 0 36 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.864 107.4 48.7 -68.1 -33.0 6.0 54.5 -9.1 237 50 B A H > S+ 0 0 33 -3,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.907 112.8 49.5 -68.9 -38.9 4.4 56.9 -6.5 238 51 B L H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.917 111.6 46.3 -63.1 -50.5 1.0 55.1 -7.0 239 52 B V H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.781 114.1 49.1 -69.6 -25.1 2.4 51.6 -6.6 240 53 B N H X S+ 0 0 8 -4,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.786 111.5 48.8 -83.0 -30.3 4.4 52.8 -3.4 241 54 B S H X S+ 0 0 24 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.933 114.5 46.5 -70.0 -45.6 1.3 54.4 -1.9 242 55 B L H X S+ 0 0 6 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.955 115.4 44.9 -57.2 -57.5 -0.6 51.2 -2.6 243 56 B F H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.937 116.8 45.5 -52.9 -53.9 2.2 48.9 -1.1 244 57 B S H X S+ 0 0 9 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.895 112.4 49.2 -58.1 -50.1 2.7 51.2 2.0 245 58 B K H X S+ 0 0 92 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.922 112.5 49.4 -58.3 -44.7 -1.1 51.6 2.8 246 59 B S H X S+ 0 0 6 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.860 112.0 48.4 -60.6 -42.4 -1.6 47.8 2.5 247 60 B X H X S+ 0 0 5 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.920 113.3 46.0 -66.5 -43.0 1.4 47.1 4.8 248 61 B L H X S+ 0 0 82 -4,-2.6 4,-3.4 2,-0.2 -2,-0.2 0.825 112.0 52.4 -70.8 -28.9 0.2 49.6 7.4 249 62 B Q H X S+ 0 0 68 -4,-2.1 4,-3.2 2,-0.2 -2,-0.2 0.950 112.4 44.7 -70.3 -45.1 -3.4 48.1 7.1 250 63 B L H X S+ 0 0 13 -4,-2.6 4,-2.1 2,-0.2 5,-0.2 0.941 115.9 48.1 -61.4 -42.8 -1.9 44.6 7.7 251 64 B S H X S+ 0 0 16 -4,-3.0 4,-3.3 2,-0.2 5,-0.2 0.950 113.2 47.3 -63.5 -45.8 0.2 46.2 10.6 252 65 B E H X S+ 0 0 133 -4,-3.4 4,-2.7 1,-0.2 -2,-0.2 0.944 110.6 53.6 -58.0 -50.8 -3.0 48.0 12.0 253 66 B X H < S+ 0 0 49 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.839 117.6 35.1 -52.0 -46.5 -5.0 44.7 11.7 254 67 B I H < S+ 0 0 2 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.921 119.7 48.4 -77.4 -45.4 -2.5 42.7 13.7 255 68 B K H >< S+ 0 0 83 -4,-3.3 3,-1.5 -5,-0.2 2,-0.4 0.722 90.7 95.4 -69.2 -21.9 -1.5 45.5 16.1 256 69 B T T 3< S- 0 0 68 -4,-2.7 -4,-0.0 1,-0.3 0, 0.0 -0.596 107.3 -4.2 -73.3 125.3 -5.2 46.3 16.9 257 70 B D T 3 S+ 0 0 123 -2,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.761 88.8 177.9 60.3 32.0 -6.3 44.5 20.1 258 71 B F < - 0 0 28 -3,-1.5 2,-2.3 1,-0.1 -1,-0.2 -0.460 34.3-125.3 -65.6 124.8 -2.9 42.8 20.2 259 72 B P > + 0 0 25 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.419 42.2 166.6 -80.2 77.4 -3.0 40.6 23.3 260 73 B V T 3 S+ 0 0 119 -2,-2.3 7,-0.1 1,-0.3 -2,-0.0 0.834 75.6 45.1 -56.5 -42.0 0.2 42.0 25.0 261 74 B E T 3 S+ 0 0 108 -3,-0.2 -1,-0.3 6,-0.0 2,-0.0 0.508 98.9 92.7 -85.9 -3.7 -0.5 40.5 28.4 262 75 B A S < S- 0 0 34 -3,-1.3 2,-0.0 1,-0.2 0, 0.0 -0.255 83.8 -91.6 -81.6 173.4 -1.5 37.0 27.0 263 76 B N > - 0 0 99 1,-0.1 4,-2.2 -2,-0.0 3,-0.3 -0.221 41.1 -96.9 -77.2 173.6 0.8 34.0 26.5 264 77 B I H > S+ 0 0 29 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.844 122.9 60.0 -58.0 -38.5 2.7 33.2 23.2 265 78 B R H > S+ 0 0 65 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.899 109.4 40.5 -58.8 -46.7 -0.1 30.8 22.2 266 79 B E H > S+ 0 0 84 -3,-0.3 4,-3.0 2,-0.2 5,-0.2 0.868 113.3 52.5 -73.1 -41.6 -2.7 33.6 22.2 267 80 B Q H X S+ 0 0 29 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.902 113.2 46.8 -61.2 -38.1 -0.4 36.2 20.6 268 81 B F H X S+ 0 0 21 -4,-2.5 4,-3.2 2,-0.2 5,-0.2 0.940 111.8 49.5 -65.2 -49.9 0.3 33.6 17.8 269 82 B S H X S+ 0 0 21 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.927 113.4 47.0 -55.6 -48.9 -3.4 32.8 17.4 270 83 B H H X S+ 0 0 23 -4,-3.0 4,-2.4 2,-0.2 5,-0.2 0.928 114.9 45.9 -57.9 -51.8 -4.3 36.5 17.2 271 84 B T H X S+ 0 0 23 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.936 113.8 48.5 -58.5 -50.5 -1.5 37.2 14.7 272 85 B Y H X S+ 0 0 3 -4,-3.2 4,-2.4 2,-0.2 -1,-0.2 0.870 115.2 42.9 -58.4 -47.9 -2.3 34.2 12.5 273 86 B N H X S+ 0 0 63 -4,-2.3 4,-2.6 -5,-0.2 -1,-0.2 0.883 115.2 48.1 -69.8 -43.0 -6.1 34.9 12.3 274 87 B R H X S+ 0 0 68 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.870 113.7 49.6 -64.5 -36.8 -5.7 38.6 11.7 275 88 B L H X S+ 0 0 16 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.929 114.1 44.3 -65.3 -47.6 -3.1 37.8 9.0 276 89 B F H X S+ 0 0 3 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.884 113.6 51.0 -63.8 -42.4 -5.4 35.3 7.4 277 90 B E H X S+ 0 0 74 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.866 110.7 49.2 -63.6 -41.5 -8.4 37.7 7.6 278 91 B F H X S+ 0 0 3 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.923 115.3 43.3 -63.3 -47.3 -6.4 40.5 6.1 279 92 B A H >< S+ 0 0 0 -4,-2.1 3,-0.8 1,-0.2 7,-0.3 0.957 112.0 53.3 -63.9 -48.3 -5.3 38.3 3.2 280 93 B R H >< S+ 0 0 110 -4,-2.9 3,-0.5 1,-0.2 -1,-0.2 0.885 117.4 36.5 -53.5 -46.3 -8.7 36.8 2.7 281 94 B N H 3< S+ 0 0 91 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.495 125.6 38.6 -87.6 -10.7 -10.4 40.3 2.4 282 95 B N T S+ 0 0 40 -3,-0.5 4,-5.0 2,-0.2 5,-0.3 0.905 74.7 44.4 -57.5 -50.2 -6.5 39.2 -1.8 284 97 B D H > S+ 0 0 101 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.965 120.5 41.4 -61.9 -48.0 -5.4 41.5 -4.7 285 98 B A H > S+ 0 0 10 2,-0.2 4,-3.6 1,-0.2 5,-0.3 0.905 120.0 46.0 -63.1 -41.9 -3.6 43.8 -2.3 286 99 B F H X S+ 0 0 6 -4,-4.6 4,-3.2 -7,-0.3 -2,-0.2 0.950 117.7 41.1 -64.6 -54.9 -2.3 40.8 -0.4 287 100 B L H X S+ 0 0 47 -4,-5.0 4,-1.6 2,-0.2 -2,-0.2 0.858 120.0 47.0 -61.2 -37.4 -1.2 38.9 -3.5 288 101 B F H X S+ 0 0 15 -4,-3.4 4,-0.7 -5,-0.3 -2,-0.2 0.973 116.8 40.9 -68.9 -53.3 0.2 42.2 -4.9 289 102 B T H >< S+ 0 0 10 -4,-3.6 3,-1.3 1,-0.2 4,-0.3 0.927 116.4 51.3 -59.2 -47.3 2.0 43.3 -1.7 290 103 B N H 3< S+ 0 0 27 -4,-3.2 3,-0.5 1,-0.3 -1,-0.2 0.836 111.1 48.9 -57.0 -38.1 3.2 39.6 -1.2 291 104 B S H 3< S+ 0 0 83 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.543 116.9 40.5 -81.1 -9.4 4.5 39.6 -4.9 292 105 B H X< + 0 0 33 -3,-1.3 3,-1.2 -4,-0.7 -1,-0.2 0.137 69.2 115.8-132.1 28.7 6.4 42.9 -4.6 293 106 B C T 3 S+ 0 0 42 -3,-0.5 -1,-0.1 -4,-0.3 -2,-0.1 0.728 94.4 31.2 -65.3 -29.2 8.2 43.1 -1.1 294 107 B D T 3 S+ 0 0 103 -3,-0.1 -1,-0.3 3,-0.0 -2,-0.1 0.073 90.9 141.2-117.7 22.0 11.6 43.1 -2.8 295 108 B S X - 0 0 31 -3,-1.2 3,-1.1 1,-0.1 -3,-0.1 -0.268 58.0-127.4 -68.0 150.3 10.6 44.9 -6.1 296 109 B Y T 3 S+ 0 0 111 1,-0.2 -1,-0.1 0, 0.0 -4,-0.0 0.747 106.9 62.4 -67.2 -28.1 13.0 47.5 -7.6 297 110 B F T 3 S+ 0 0 39 2,-0.0 -1,-0.2 -5,-0.0 2,-0.1 0.548 78.2 113.1 -76.0 -11.4 10.3 50.2 -7.7 298 111 B L < - 0 0 12 -3,-1.1 2,-0.1 -6,-0.1 -58,-0.0 -0.451 58.9-143.6 -65.4 136.1 9.9 50.1 -3.8 299 112 B D > - 0 0 66 -2,-0.1 4,-2.0 -63,-0.1 5,-0.2 -0.367 28.6 -95.4 -94.3 173.5 11.0 53.4 -2.1 300 113 B E H > S+ 0 0 169 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.871 124.3 50.4 -57.9 -40.7 12.9 53.9 1.2 301 114 B Q H > S+ 0 0 130 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.887 108.4 51.8 -67.3 -40.8 9.6 54.5 3.2 302 115 B S H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.901 114.1 45.1 -60.5 -40.3 7.9 51.3 1.7 303 116 B K H X S+ 0 0 106 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.881 112.3 50.2 -71.0 -39.0 11.1 49.3 2.9 304 117 B K H X S+ 0 0 128 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.876 110.2 51.4 -68.3 -35.8 11.1 51.0 6.3 305 118 B I H X S+ 0 0 23 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.939 114.0 43.7 -63.3 -49.1 7.4 50.2 6.8 306 119 B F H X S+ 0 0 46 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.888 114.6 47.9 -63.3 -44.7 8.0 46.5 5.9 307 120 B D H X S+ 0 0 98 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.879 111.4 50.8 -67.6 -38.3 11.2 46.2 8.0 308 121 B D H X S+ 0 0 92 -4,-2.2 4,-0.7 -5,-0.2 -1,-0.2 0.814 112.4 47.9 -65.4 -33.9 9.5 47.8 11.1 309 122 B F H X S+ 0 0 26 -4,-1.4 4,-0.8 -5,-0.2 3,-0.5 0.942 114.2 45.2 -70.3 -50.2 6.5 45.3 10.6 310 123 B I H >X S+ 0 0 59 -4,-2.5 4,-1.8 1,-0.2 3,-0.8 0.903 109.2 56.6 -56.2 -50.7 8.9 42.2 10.3 311 124 B G H 3X S+ 0 0 22 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.729 96.6 63.8 -56.7 -29.7 11.1 43.3 13.3 312 125 B F H 3X S+ 0 0 64 -4,-0.7 4,-1.2 -3,-0.5 -1,-0.2 0.911 109.5 39.0 -62.9 -41.4 8.0 43.4 15.6 313 126 B F H S+ 0 0 2 -4,-2.4 5,-2.3 2,-0.2 6,-1.5 0.847 110.7 48.7 -65.2 -38.4 9.8 33.0 22.8 321 134 B I H ><5S+ 0 0 42 -4,-2.4 3,-1.1 4,-0.2 -2,-0.2 0.926 112.1 49.0 -67.1 -46.0 13.1 31.2 21.9 322 135 B V H 3<5S+ 0 0 128 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.864 109.2 51.6 -62.5 -41.6 14.9 32.6 25.0 323 136 B K T 3<5S- 0 0 146 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.553 116.4-115.4 -72.2 -8.3 12.0 31.5 27.4 324 137 B G T < 5S+ 0 0 38 -3,-1.1 -3,-0.2 -4,-0.3 -2,-0.1 0.651 87.0 118.0 80.0 17.1 12.2 28.0 25.8 325 138 B L S > - 0 0 45 0, 0.0 3,-1.4 0, 0.0 4,-1.4 -0.402 45.7-121.8 -58.8 133.3 16.9 31.1 13.4 331 144 B P H 3> S+ 0 0 28 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.834 112.9 56.1 -49.8 -36.1 13.9 33.6 13.9 332 145 B V H 3> S+ 0 0 30 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.843 103.4 55.5 -65.8 -31.3 13.7 34.1 10.1 333 146 B A H <> S+ 0 0 0 -3,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.891 107.3 49.2 -68.1 -35.8 13.3 30.3 9.7 334 147 B L H X S+ 0 0 2 -4,-1.4 4,-1.7 2,-0.2 -2,-0.2 0.840 109.4 51.4 -72.2 -31.4 10.2 30.4 12.1 335 148 B I H X S+ 0 0 43 -4,-1.6 4,-3.2 2,-0.2 5,-0.2 0.915 111.0 48.8 -68.0 -43.2 8.7 33.3 10.1 336 149 B I H X S+ 0 0 8 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.888 108.1 54.3 -59.1 -44.7 9.1 31.4 6.9 337 150 B I H < S+ 0 0 10 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.872 118.1 35.3 -59.6 -40.7 7.5 28.3 8.6 338 151 B V H X S+ 0 0 22 -4,-1.7 4,-0.9 2,-0.1 -2,-0.2 0.918 124.7 39.1 -78.3 -50.5 4.4 30.3 9.5 339 152 B Y H X S+ 0 0 52 -4,-3.2 4,-2.7 -5,-0.2 5,-0.2 0.884 105.3 58.2 -72.6 -49.6 4.1 32.6 6.5 340 153 B Q H X S+ 0 0 23 -4,-2.3 4,-2.3 -5,-0.2 5,-0.2 0.903 107.2 46.8 -59.6 -43.9 5.0 30.5 3.4 341 154 B P H > S+ 0 0 4 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.931 116.0 46.7 -59.5 -43.6 2.3 27.9 3.8 342 155 B L H X S+ 0 0 0 -4,-0.9 4,-2.5 2,-0.2 -2,-0.2 0.935 111.2 51.2 -59.1 -53.8 -0.4 30.6 4.5 343 156 B E H X S+ 0 0 10 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.903 114.1 43.9 -50.4 -49.2 0.8 32.7 1.5 344 157 B K H X S+ 0 0 71 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.883 111.1 53.5 -70.1 -38.4 0.5 29.7 -0.8 345 158 B L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.865 106.8 52.8 -64.8 -34.8 -2.9 28.6 0.6 346 159 B I H X S+ 0 0 6 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.941 111.2 47.4 -61.8 -46.6 -4.3 32.1 -0.1 347 160 B K H X S+ 0 0 80 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.873 113.4 47.3 -59.4 -42.5 -3.1 31.8 -3.7 348 161 B V H <>S+ 0 0 8 -4,-2.3 5,-1.2 2,-0.2 6,-1.1 0.882 113.1 48.0 -70.0 -39.2 -4.6 28.3 -4.0 349 162 B I H ><5S+ 0 0 34 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.940 108.1 56.6 -65.2 -43.6 -7.9 29.5 -2.5 350 163 B A H 3<5S+ 0 0 56 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.747 105.2 50.8 -59.2 -28.5 -7.8 32.5 -4.9 351 164 B T T 3<5S- 0 0 103 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.567 114.8-119.0 -81.4 -13.9 -7.6 30.1 -7.9 352 165 B G T < 5S+ 0 0 41 -3,-1.8 -3,-0.2 -4,-0.5 -2,-0.1 0.404 85.4 117.4 88.2 1.0 -10.7 28.2 -6.5 353 166 B Q S - 0 0 40 1,-0.1 4,-1.8 -2,-0.1 5,-0.2 -0.963 50.6-119.8-161.0 153.1 -13.8 27.8 5.7 358 171 B K H > S+ 0 0 166 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.895 118.1 54.6 -60.6 -35.7 -13.5 28.7 9.4 359 172 B E H > S+ 0 0 137 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.790 104.7 52.7 -66.3 -37.3 -12.6 25.0 9.9 360 173 B L H > S+ 0 0 12 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.946 111.7 44.2 -66.9 -48.1 -9.7 25.2 7.4 361 174 B V H X S+ 0 0 7 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.867 111.9 53.9 -66.1 -36.0 -8.1 28.3 9.1 362 175 B K H X S+ 0 0 107 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.949 112.0 44.8 -62.9 -45.4 -8.6 26.7 12.5 363 176 B E H X S+ 0 0 41 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.819 114.9 48.1 -63.9 -39.7 -6.7 23.6 11.2 364 177 B L H X S+ 0 0 2 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.829 110.4 51.2 -72.6 -33.4 -4.0 25.7 9.6 365 178 B E H X S+ 0 0 1 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.910 110.9 47.5 -70.7 -41.8 -3.5 27.8 12.7 366 179 B E H X S+ 0 0 52 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.890 112.5 51.2 -64.4 -39.6 -3.1 24.7 15.0 367 180 B S H X S+ 0 0 1 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.934 110.1 47.7 -61.9 -50.0 -0.6 23.3 12.4 368 181 B S H X S+ 0 0 7 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.848 111.5 50.5 -62.4 -37.4 1.5 26.5 12.3 369 182 B W H X S+ 0 0 22 -4,-2.0 4,-1.9 1,-0.2 3,-0.4 0.931 111.0 48.8 -66.4 -43.3 1.6 26.7 16.2 370 183 B N H < S+ 0 0 12 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.802 107.3 57.6 -65.3 -29.0 2.7 23.0 16.3 371 184 B A H < S+ 0 0 3 -4,-1.7 -1,-0.2 -188,-0.2 -2,-0.2 0.862 116.1 32.1 -67.9 -37.8 5.4 23.8 13.7 372 185 B I H < S+ 0 0 8 -4,-1.3 -45,-2.7 -3,-0.4 -2,-0.2 0.637 100.9 91.7 -99.5 -16.7 7.1 26.5 15.8 373 186 B R B < S-B 326 0B 63 -4,-1.9 2,-0.4 -47,-0.3 -47,-0.3 -0.455 80.2-102.3 -88.2 161.1 6.5 25.4 19.5 374 187 B I 0 0 82 -49,-1.3 -1,-0.1 -2,-0.1 -2,-0.1 -0.620 360.0 360.0 -79.3 117.8 8.7 23.4 21.8 375 188 B I 0 0 112 -2,-0.4 -192,-0.0 -5,-0.0 -49,-0.0 -0.887 360.0 360.0-123.0 360.0 7.3 19.8 22.1