==== 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 TRANSCRIPTION REGULATOR 19-OCT-10 3PAS . COMPND 2 MOLECULE: TETR FAMILY TRANSCRIPTION REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: MARINOBACTER AQUAEOLEI; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 767 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34870.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 617 80.4 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 . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 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 . 15 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 502 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 6 6 0 4 7 3 2 0 4 0 0 4 0 1 0 0 2 1 3 1 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 . 4 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 0 171 0, 0.0 4,-1.9 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 142.6 -19.9 35.7 -5.9 2 2 A R H > + 0 0 184 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.904 360.0 58.8 -50.9 -45.6 -16.4 34.6 -4.9 3 3 A Q H > S+ 0 0 100 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.864 105.2 49.0 -61.1 -36.1 -15.3 38.3 -5.1 4 4 A R H > S+ 0 0 119 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.896 112.0 49.1 -64.2 -47.2 -18.0 39.2 -2.4 5 5 A D H X S+ 0 0 56 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.946 112.2 48.3 -54.5 -49.6 -16.8 36.3 -0.2 6 6 A D H X S+ 0 0 66 -4,-3.2 4,-2.9 1,-0.2 -2,-0.2 0.873 108.9 53.2 -60.7 -39.7 -13.2 37.4 -0.6 7 7 A S H X S+ 0 0 58 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.904 111.9 45.8 -61.9 -42.2 -14.0 41.0 0.2 8 8 A K H X S+ 0 0 56 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.937 112.2 50.6 -67.8 -44.2 -15.7 39.9 3.4 9 9 A R H X S+ 0 0 72 -4,-2.9 4,-3.2 1,-0.2 5,-0.2 0.946 109.7 50.4 -57.0 -47.8 -12.8 37.6 4.3 10 10 A I H X S+ 0 0 71 -4,-2.9 4,-3.3 1,-0.2 5,-0.3 0.894 108.0 54.5 -59.2 -39.6 -10.3 40.4 3.8 11 11 A A H X S+ 0 0 27 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.913 112.8 42.1 -59.3 -43.3 -12.4 42.6 6.0 12 12 A F H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.902 115.7 49.0 -72.2 -40.7 -12.2 40.0 8.8 13 13 A L H X S+ 0 0 13 -4,-3.2 4,-2.2 2,-0.2 -2,-0.2 0.934 114.8 44.2 -61.7 -48.2 -8.6 39.3 8.2 14 14 A E H X S+ 0 0 29 -4,-3.3 4,-2.5 1,-0.2 -1,-0.2 0.862 111.9 53.8 -65.1 -38.9 -7.7 43.0 8.2 15 15 A A H X S+ 0 0 0 -4,-2.0 4,-3.1 -5,-0.3 5,-0.2 0.904 108.3 49.3 -59.5 -42.6 -9.9 43.6 11.3 16 16 A T H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 5,-0.4 0.926 109.8 52.5 -64.4 -46.6 -8.1 40.8 13.2 17 17 A V H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.958 115.1 40.9 -50.0 -53.2 -4.7 42.4 12.2 18 18 A R H X S+ 0 0 98 -4,-2.5 4,-2.1 1,-0.2 5,-0.2 0.930 116.7 47.0 -65.9 -49.7 -5.8 45.8 13.5 19 19 A E H X S+ 0 0 34 -4,-3.1 4,-2.7 2,-0.2 5,-0.3 0.912 116.7 42.6 -61.3 -45.2 -7.5 44.6 16.7 20 20 A V H X S+ 0 0 1 -4,-2.7 4,-2.7 -5,-0.2 -1,-0.2 0.901 113.9 52.0 -71.1 -38.0 -4.7 42.2 17.7 21 21 A A H < S+ 0 0 11 -4,-2.4 -1,-0.2 -5,-0.4 -2,-0.2 0.861 118.7 36.7 -65.0 -35.4 -2.0 44.8 16.9 22 22 A D H < S+ 0 0 103 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.823 138.5 12.4 -81.9 -35.6 -3.7 47.4 19.0 23 23 A H H X S- 0 0 113 -4,-2.7 4,-0.5 -5,-0.2 -3,-0.2 0.484 96.2-122.3-127.4 -7.3 -5.0 45.2 21.8 24 24 A G H X - 0 0 22 -4,-2.7 4,-0.6 -5,-0.3 -1,-0.2 -0.077 39.9 -68.0 81.8 172.6 -3.5 41.8 21.7 25 25 A F H >4 S+ 0 0 24 1,-0.2 3,-0.8 2,-0.2 -1,-0.1 0.920 122.5 53.5 -67.2 -49.1 -5.1 38.3 21.5 26 26 A S H 34 S+ 0 0 85 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.857 110.3 44.7 -60.5 -43.4 -6.9 38.1 24.9 27 27 A A H 3< S+ 0 0 50 -4,-0.5 2,-0.8 -7,-0.1 -1,-0.3 0.612 97.6 88.1 -76.8 -14.1 -8.8 41.3 24.7 28 28 A T << + 0 0 1 -3,-0.8 2,-0.2 -4,-0.6 -1,-0.1 -0.768 58.8 179.6 -96.3 108.8 -9.8 40.6 21.0 29 29 A S > - 0 0 21 -2,-0.8 4,-2.4 1,-0.1 5,-0.2 -0.511 45.8-105.1-100.4 165.6 -13.0 38.6 20.7 30 30 A V H > S+ 0 0 3 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.909 123.1 55.1 -47.9 -49.0 -15.0 37.4 17.7 31 31 A G H > S+ 0 0 23 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.910 108.7 46.4 -53.7 -46.2 -17.5 40.2 18.5 32 32 A K H > S+ 0 0 104 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.851 112.3 49.2 -69.4 -38.9 -14.9 42.9 18.4 33 33 A I H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.934 111.5 49.9 -64.2 -47.9 -13.3 41.6 15.2 34 34 A A H X>S+ 0 0 0 -4,-2.7 5,-2.5 -5,-0.2 4,-0.8 0.932 111.7 48.1 -56.5 -45.2 -16.7 41.5 13.5 35 35 A K H ><5S+ 0 0 180 -4,-2.2 3,-1.0 1,-0.2 -1,-0.2 0.934 110.4 51.2 -65.3 -43.0 -17.6 45.0 14.6 36 36 A A H 3<5S+ 0 0 32 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.823 111.2 48.8 -60.3 -34.3 -14.2 46.3 13.4 37 37 A A H 3<5S- 0 0 20 -4,-2.0 -1,-0.3 2,-0.2 -2,-0.2 0.527 113.7-120.4 -79.7 -14.8 -14.8 44.6 10.0 38 38 A G T <<5S+ 0 0 64 -3,-1.0 2,-0.2 -4,-0.8 -3,-0.2 0.724 78.6 104.7 79.1 28.0 -18.4 46.2 9.8 39 39 A L S - 0 0 50 -2,-0.2 4,-2.2 1,-0.1 3,-0.2 -0.535 26.4-116.7 -91.8 161.8 -21.9 40.6 12.1 41 41 A P H > S+ 0 0 57 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.866 116.5 60.5 -62.8 -31.7 -20.6 37.6 14.1 42 42 A A H > S+ 0 0 72 1,-0.2 4,-0.7 2,-0.2 -3,-0.0 0.917 107.1 46.0 -58.9 -42.9 -23.1 35.4 12.2 43 43 A T H >> S+ 0 0 29 -3,-0.2 4,-1.0 2,-0.2 3,-0.8 0.887 108.3 56.1 -64.5 -40.6 -21.3 36.4 9.0 44 44 A L H >X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 3,-1.3 0.954 105.1 53.5 -54.2 -50.2 -17.9 35.8 10.6 45 45 A Y H 3< S+ 0 0 57 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.670 96.5 65.1 -65.6 -18.8 -18.9 32.3 11.3 46 46 A I H << S+ 0 0 120 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.875 117.8 26.9 -61.5 -36.0 -19.9 31.6 7.7 47 47 A Y H << S+ 0 0 41 -3,-1.3 2,-0.4 -4,-1.0 -2,-0.2 0.718 127.8 34.9-102.5 -25.2 -16.2 32.1 6.9 48 48 A Y < - 0 0 23 -4,-2.1 -1,-0.2 -5,-0.1 3,-0.1 -0.999 64.0-144.7-138.7 129.6 -14.3 31.0 10.1 49 49 A E S S- 0 0 109 -2,-0.4 2,-0.3 1,-0.1 560,-0.2 0.914 76.1 -30.0 -58.0 -44.7 -15.3 28.3 12.5 50 50 A D S > S- 0 0 8 -6,-0.1 4,-1.9 1,-0.1 5,-0.2 -0.893 75.0 -73.9-162.0 179.3 -14.0 30.2 15.6 51 51 A K H > S+ 0 0 15 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.928 122.9 56.2 -55.0 -51.6 -11.5 32.7 16.9 52 52 A E H > S+ 0 0 29 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.871 109.3 45.9 -49.8 -48.7 -8.6 30.2 16.8 53 53 A Q H > S+ 0 0 73 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.848 112.5 50.0 -67.6 -36.4 -9.1 29.5 13.1 54 54 A L H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.898 108.3 52.8 -71.9 -37.7 -9.5 33.2 12.2 55 55 A L H X S+ 0 0 0 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.910 113.0 45.3 -61.0 -40.4 -6.2 34.1 14.1 56 56 A L H X S+ 0 0 43 -4,-1.8 4,-2.5 -5,-0.2 -2,-0.2 0.919 111.9 49.8 -69.5 -44.5 -4.4 31.4 12.1 57 57 A A H X S+ 0 0 29 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.915 112.4 50.4 -57.5 -40.4 -5.9 32.5 8.7 58 58 A T H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.897 107.4 52.4 -66.2 -41.6 -4.9 36.0 9.7 59 59 A F H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.913 113.3 44.6 -58.6 -44.3 -1.3 34.8 10.5 60 60 A Y H X S+ 0 0 50 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.890 111.4 52.5 -69.8 -37.8 -1.1 33.2 7.0 61 61 A Y H X S+ 0 0 48 -4,-2.7 4,-1.7 -5,-0.2 -2,-0.2 0.937 115.2 42.0 -58.3 -46.8 -2.7 36.3 5.3 62 62 A V H X S+ 0 0 2 -4,-2.9 4,-2.1 2,-0.2 5,-0.2 0.939 117.2 46.8 -65.5 -49.1 -0.0 38.5 7.0 63 63 A S H X S+ 0 0 3 -4,-2.8 4,-3.3 -5,-0.2 5,-0.3 0.931 112.3 49.1 -60.6 -47.5 2.9 36.1 6.4 64 64 A D H X S+ 0 0 27 -4,-2.7 4,-2.5 -5,-0.2 5,-0.2 0.874 109.7 51.1 -63.2 -41.6 2.0 35.4 2.7 65 65 A Q H X S+ 0 0 64 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.927 117.6 39.5 -58.3 -47.9 1.7 39.1 1.9 66 66 A V H X S+ 0 0 23 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.954 119.1 45.2 -68.8 -50.6 5.1 39.9 3.4 67 67 A I H X S+ 0 0 28 -4,-3.3 4,-2.8 -5,-0.2 5,-0.2 0.926 113.0 51.4 -61.3 -43.2 6.9 36.7 2.1 68 68 A D H X S+ 0 0 64 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.888 112.0 45.7 -62.1 -42.4 5.4 37.1 -1.4 69 69 A A H X S+ 0 0 32 -4,-1.7 4,-2.4 -5,-0.2 -1,-0.2 0.926 113.3 50.0 -67.1 -44.7 6.5 40.7 -1.7 70 70 A A H X S+ 0 0 9 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.896 112.6 47.4 -55.9 -48.5 10.0 39.8 -0.3 71 71 A L H X S+ 0 0 34 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.855 109.5 52.4 -63.3 -41.8 10.3 36.9 -2.8 72 72 A D H X S+ 0 0 78 -4,-2.2 4,-0.6 -5,-0.2 -2,-0.2 0.955 114.5 42.6 -61.5 -47.0 9.2 39.1 -5.8 73 73 A S H >< S+ 0 0 18 -4,-2.4 3,-1.2 1,-0.2 4,-0.4 0.923 112.7 52.6 -65.7 -45.3 11.8 41.7 -4.9 74 74 A F H >< S+ 0 0 29 -4,-2.7 3,-1.6 1,-0.2 -1,-0.2 0.882 102.0 61.0 -54.8 -41.2 14.5 39.1 -4.2 75 75 A S H 3< S+ 0 0 84 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.682 95.8 61.9 -64.4 -19.5 13.8 37.5 -7.6 76 76 A R T << S+ 0 0 150 -3,-1.2 2,-0.3 -4,-0.6 -1,-0.3 0.590 81.3 99.7 -84.5 -10.7 14.8 40.7 -9.5 77 77 A G < - 0 0 19 -3,-1.6 6,-0.1 -4,-0.4 3,-0.0 -0.579 66.9-145.0 -80.2 136.9 18.4 40.7 -8.2 78 78 A K S S+ 0 0 104 -2,-0.3 2,-0.3 5,-0.0 -1,-0.1 0.581 83.4 17.3 -75.2 -15.3 21.1 39.4 -10.5 79 79 A D S > S- 0 0 100 1,-0.1 4,-2.5 0, 0.0 5,-0.2 -0.929 92.6 -91.7-147.1 172.8 23.1 37.9 -7.6 80 80 A L H > S+ 0 0 20 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.906 121.6 48.4 -58.6 -48.9 22.5 36.9 -4.0 81 81 A R H > S+ 0 0 74 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.926 113.0 47.4 -57.7 -43.6 23.6 40.2 -2.5 82 82 A E H > S+ 0 0 40 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.902 112.1 50.8 -67.4 -39.9 21.5 42.3 -4.9 83 83 A G H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.934 112.6 45.1 -58.9 -49.5 18.5 40.0 -4.2 84 84 A L H X S+ 0 0 2 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.876 112.1 53.6 -65.1 -34.5 18.8 40.4 -0.5 85 85 A R H X S+ 0 0 61 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.941 110.6 45.4 -66.1 -46.3 19.3 44.1 -0.9 86 86 A R H X S+ 0 0 100 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.934 114.4 49.2 -62.6 -45.6 16.1 44.6 -2.9 87 87 A Q H X S+ 0 0 1 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.2 0.849 108.1 54.8 -58.6 -38.4 14.2 42.4 -0.4 88 88 A W H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.961 108.8 46.1 -63.8 -51.0 15.6 44.4 2.5 89 89 A H H X S+ 0 0 45 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.882 113.4 51.1 -55.9 -41.8 14.3 47.7 1.1 90 90 A T H X S+ 0 0 35 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.934 111.1 46.3 -64.1 -47.7 10.9 46.1 0.4 91 91 A L H X S+ 0 0 23 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.890 111.4 52.7 -64.8 -41.0 10.6 44.7 3.9 92 92 A F H X S+ 0 0 0 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.931 110.1 48.2 -60.1 -42.5 11.6 48.0 5.4 93 93 A R H X S+ 0 0 160 -4,-2.3 4,-2.3 2,-0.2 5,-0.3 0.922 111.0 50.3 -64.4 -43.5 9.0 49.8 3.4 94 94 A I H X S+ 0 0 27 -4,-2.5 4,-3.2 1,-0.2 7,-0.2 0.929 111.2 48.9 -61.0 -45.6 6.3 47.3 4.4 95 95 A G H < S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.900 113.9 46.6 -60.4 -40.1 7.2 47.7 8.1 96 96 A L H < S+ 0 0 47 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.817 123.2 33.0 -72.9 -30.1 7.1 51.5 7.8 97 97 A E H < S+ 0 0 113 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.751 134.5 24.2 -97.9 -30.7 3.8 51.6 6.0 98 98 A R >X + 0 0 63 -4,-3.2 3,-1.8 -5,-0.3 4,-0.9 -0.476 65.8 155.9-132.5 58.9 2.1 48.6 7.5 99 99 A P H 3> + 0 0 30 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.798 69.3 70.9 -57.1 -29.3 3.7 48.1 10.8 100 100 A E H 3> S+ 0 0 44 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.808 93.9 56.0 -57.1 -30.4 0.6 46.4 12.0 101 101 A L H <> S+ 0 0 3 -3,-1.8 4,-2.2 -7,-0.2 -1,-0.2 0.937 110.0 44.6 -65.3 -46.5 1.5 43.4 9.7 102 102 A F H X S+ 0 0 27 -4,-0.9 4,-2.3 2,-0.2 -2,-0.2 0.899 114.3 49.7 -59.1 -46.3 4.9 43.2 11.5 103 103 A R H X S+ 0 0 94 -4,-2.8 4,-2.6 2,-0.2 5,-0.3 0.901 109.9 50.0 -66.2 -41.5 3.2 43.5 14.9 104 104 A Y H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.960 112.8 47.7 -58.5 -45.6 0.6 40.8 14.2 105 105 A H H X S+ 0 0 70 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.918 114.4 45.8 -61.6 -46.6 3.4 38.4 13.0 106 106 A E H X S+ 0 0 30 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.897 113.4 47.9 -63.7 -45.2 5.5 39.1 16.0 107 107 A T H < S+ 0 0 45 -4,-2.6 3,-0.3 2,-0.2 -2,-0.2 0.953 115.9 46.1 -63.7 -45.4 2.7 38.8 18.5 108 108 A F H >< S+ 0 0 3 -4,-2.8 3,-2.1 -5,-0.3 6,-0.5 0.943 109.7 51.0 -63.6 -54.0 1.6 35.6 16.9 109 109 A T H 3< S+ 0 0 35 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.749 112.3 48.5 -60.5 -22.7 5.0 33.9 16.6 110 110 A H T 3< S+ 0 0 106 -4,-1.3 -1,-0.3 -3,-0.3 2,-0.2 0.101 101.6 84.1-103.3 23.2 5.7 34.6 20.3 111 111 A S S X S- 0 0 30 -3,-2.1 3,-1.6 -5,-0.0 580,-0.1 -0.719 93.4-102.4-117.0 171.0 2.3 33.2 21.5 112 112 A A T 3 S+ 0 0 63 1,-0.3 579,-0.3 -2,-0.2 580,-0.1 0.442 113.7 74.0 -72.7 -0.5 1.0 29.8 22.4 113 113 A W T 3 S+ 0 0 31 -5,-0.3 -1,-0.3 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111.6 51.1 -63.1 -46.2 21.0 31.7 1.1 134 134 A D H 3X S+ 0 0 75 -4,-2.7 4,-2.0 1,-0.3 3,-0.4 0.914 108.6 52.4 -55.4 -43.2 21.9 28.0 1.8 135 135 A Q H 3X S+ 0 0 106 -4,-2.2 4,-1.6 1,-0.2 -1,-0.3 0.779 104.8 55.8 -63.9 -29.2 23.5 27.8 -1.6 136 136 A G H S+ 0 0 2 -4,-1.3 6,-2.4 -3,-0.6 5,-1.9 0.793 104.7 52.9 -74.3 -30.1 25.6 30.9 -0.8 137 137 A K H ><5S+ 0 0 54 -4,-1.5 3,-0.7 -3,-0.4 -2,-0.2 0.930 111.1 46.9 -65.5 -42.1 26.8 29.1 2.3 138 138 A Q H 3<5S+ 0 0 141 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.824 113.9 47.9 -67.9 -31.5 27.9 26.2 -0.0 139 139 A S H 3<5S- 0 0 70 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.537 115.4-108.9 -90.1 -9.5 29.5 28.5 -2.5 140 140 A G T <<5S+ 0 0 42 -4,-0.7 -3,-0.2 -3,-0.7 -4,-0.1 0.606 92.6 106.8 90.3 10.0 31.6 30.6 -0.0 141 141 A L S > - 0 0 52 0, 0.0 3,-1.4 0, 0.0 4,-1.1 -0.179 43.6-113.2 -57.4 149.5 23.8 28.2 11.8 147 147 A F H 3> S+ 0 0 75 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.765 109.8 68.2 -55.7 -36.7 20.7 29.8 10.7 148 148 A P H 3> S+ 0 0 21 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 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114.1 44.9 -63.3 -44.8 14.2 46.6 15.3 161 161 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.856 109.0 54.9 -72.8 -38.9 15.0 49.5 13.0 162 162 A V H X S+ 0 0 4 -4,-2.7 4,-2.4 -5,-0.2 5,-0.2 0.931 110.1 49.6 -55.4 -45.5 11.4 50.0 11.7 163 163 A Q H X S+ 0 0 61 -4,-2.1 4,-2.5 -5,-0.3 -2,-0.2 0.960 111.0 47.2 -60.0 -47.6 10.4 50.2 15.4 164 164 A R H <>S+ 0 0 43 -4,-2.2 5,-2.1 1,-0.2 6,-0.7 0.898 112.2 51.4 -62.7 -38.1 13.0 52.8 16.1 165 165 A C H ><5S+ 0 0 21 -4,-2.5 3,-1.1 4,-0.2 -1,-0.2 0.921 111.7 45.0 -63.3 -47.2 12.1 54.8 13.0 166 166 A L H 3<5S+ 0 0 94 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.867 113.8 51.3 -67.3 -33.6 8.4 54.9 13.9 167 167 A Q T 3<5S- 0 0 114 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.364 116.8-113.7 -81.9 0.5 9.3 55.8 17.6 168 168 A G T < 5S+ 0 0 65 -3,-1.1 -3,-0.2 -4,-0.3 -4,-0.1 0.542 87.8 110.9 82.3 9.3 11.6 58.7 16.4 169 169 A S S - 0 0 42 -2,-2.2 4,-2.9 1,-0.1 5,-0.3 -0.476 59.1-114.6 -79.1 159.7 15.7 57.4 4.9 174 174 A D H > S+ 0 0 118 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.896 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2,-0.2 -1,-0.1 0.924 123.4 53.8 -66.7 -50.7 5.1 47.2 36.0 216 26 B S T 34 S+ 0 0 122 1,-0.3 -1,-0.2 -6,-0.1 -2,-0.1 0.850 110.5 46.6 -58.6 -38.9 1.4 47.6 36.4 217 27 B A T 34 S+ 0 0 46 -4,-0.5 2,-0.7 -7,-0.1 -1,-0.3 0.687 97.2 85.3 -77.5 -16.9 0.9 44.3 38.1 218 28 B T << + 0 0 1 -3,-0.8 2,-0.2 -4,-0.7 -1,-0.1 -0.776 58.8 179.8 -96.4 113.3 3.8 44.9 40.5 219 29 B S > - 0 0 49 -2,-0.7 4,-2.2 1,-0.1 5,-0.2 -0.578 44.4-104.6-101.0 165.7 3.0 46.9 43.6 220 30 B V H > S+ 0 0 17 1,-0.2 4,-2.9 -2,-0.2 5,-0.2 0.905 121.8 56.1 -51.8 -43.7 5.1 48.1 46.6 221 31 B G H > S+ 0 0 33 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.880 107.8 45.4 -61.0 -41.3 3.4 45.3 48.6 222 32 B K H > S+ 0 0 102 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.875 113.0 50.2 -72.8 -37.7 4.4 42.5 46.2 223 33 B I H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.938 111.9 48.2 -60.9 -49.7 8.0 43.8 45.9 224 34 B A H <>S+ 0 0 0 -4,-2.9 5,-2.6 2,-0.2 4,-0.5 0.947 113.1 48.2 -56.2 -47.2 8.2 43.9 49.8 225 35 B K H ><5S+ 0 0 98 -4,-2.2 3,-1.7 1,-0.2 -2,-0.2 0.940 110.2 51.3 -60.4 -45.7 6.8 40.4 50.0 226 36 B A H 3<5S+ 0 0 33 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.825 110.6 49.9 -61.8 -34.3 9.2 39.1 47.4 227 37 B A T 3<5S- 0 0 21 -4,-2.0 -1,-0.3 2,-0.2 -2,-0.2 0.454 114.0-118.2 -77.9 -9.5 12.0 40.6 49.4 228 38 B G T < 5S+ 0 0 32 -3,-1.7 2,-0.3 -4,-0.5 -3,-0.2 0.744 79.1 104.3 76.0 24.6 10.9 39.0 52.7 229 39 B L S - 0 0 53 -2,-0.3 4,-1.9 1,-0.1 5,-0.1 -0.490 28.0-120.9 -83.5 155.9 7.5 44.8 55.2 231 41 B P H > S+ 0 0 57 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.878 115.9 61.4 -58.7 -35.7 6.3 47.7 53.1 232 42 B A H > S+ 0 0 75 1,-0.2 4,-0.6 2,-0.2 -3,-0.0 0.930 106.4 46.5 -56.8 -40.6 7.2 50.0 56.2 233 43 B T H >> S+ 0 0 27 1,-0.2 3,-1.2 2,-0.2 4,-0.9 0.910 108.2 54.3 -65.7 -46.6 10.8 48.8 55.7 234 44 B L H >X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.3 3,-1.2 0.925 103.9 56.7 -51.7 -48.4 10.7 49.4 52.0 235 45 B Y H 3< S+ 0 0 119 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.674 92.7 69.0 -63.2 -16.5 9.6 52.9 52.6 236 46 B I H << S+ 0 0 116 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.924 116.8 24.2 -61.2 -39.2 12.7 53.5 54.8 237 47 B Y H << S+ 0 0 36 -3,-1.2 2,-0.4 -4,-0.9 -2,-0.2 0.789 129.1 36.3 -98.4 -31.8 14.8 53.3 51.6 238 48 B Y < - 0 0 15 -4,-2.5 -1,-0.2 -5,-0.1 3,-0.1 -0.995 63.0-149.6-132.5 130.4 12.4 54.2 48.8 239 49 B E S S- 0 0 164 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.822 73.7 -25.0 -70.4 -36.4 9.7 56.8 49.0 240 50 B D S > S- 0 0 62 -6,-0.1 4,-1.9 1,-0.1 5,-0.2 -0.933 77.3 -77.7-161.8-179.0 7.3 55.3 46.6 241 51 B K H > S+ 0 0 55 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.912 122.1 59.0 -60.5 -44.6 7.1 52.9 43.6 242 52 B E H > S+ 0 0 97 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.922 108.9 43.4 -51.5 -50.7 8.3 55.5 41.2 243 53 B Q H > S+ 0 0 74 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.859 113.1 51.7 -68.3 -34.4 11.5 56.0 43.0 244 54 B L H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.932 108.8 50.7 -68.4 -42.2 12.1 52.3 43.6 245 55 B L H X S+ 0 0 1 -4,-3.1 4,-2.0 2,-0.2 -2,-0.2 0.907 113.5 45.8 -60.0 -43.0 11.6 51.6 39.8 246 56 B L H X S+ 0 0 39 -4,-2.0 4,-2.4 -5,-0.3 -2,-0.2 0.937 112.5 49.0 -65.3 -50.0 14.1 54.3 38.9 247 57 B A H X S+ 0 0 29 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.844 111.9 51.1 -56.4 -38.7 16.7 53.1 41.6 248 58 B T H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.891 106.9 52.9 -66.8 -42.0 16.2 49.6 40.2 249 59 B F H X S+ 0 0 0 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.946 112.6 45.0 -60.2 -44.9 16.8 50.8 36.7 250 60 B Y H X S+ 0 0 46 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.858 111.9 51.8 -67.0 -36.7 20.1 52.4 37.8 251 61 B Y H X S+ 0 0 38 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.930 114.3 42.9 -61.1 -47.3 21.1 49.4 39.8 252 62 B V H X S+ 0 0 1 -4,-2.7 4,-2.3 2,-0.2 5,-0.2 0.971 118.1 45.4 -64.8 -50.8 20.5 47.1 36.8 253 63 B S H X S+ 0 0 4 -4,-3.0 4,-3.4 -5,-0.2 5,-0.3 0.907 113.5 49.7 -60.4 -46.1 22.2 49.6 34.4 254 64 B D H X S+ 0 0 28 -4,-2.8 4,-2.5 -5,-0.2 5,-0.3 0.917 109.5 50.7 -61.5 -46.1 25.2 50.2 36.7 255 65 B Q H X S+ 0 0 70 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.936 118.8 38.1 -53.5 -52.1 25.8 46.5 37.3 256 66 B V H X S+ 0 0 24 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.917 117.9 46.9 -68.6 -49.8 25.9 45.8 33.6 257 67 B I H X S+ 0 0 25 -4,-3.4 4,-3.0 -5,-0.2 5,-0.2 0.929 112.7 50.4 -60.0 -47.4 27.7 49.0 32.4 258 68 B D H X S+ 0 0 64 -4,-2.5 4,-2.1 -5,-0.3 -1,-0.2 0.896 111.6 47.1 -60.3 -42.1 30.4 48.7 35.0 259 69 B A H X S+ 0 0 31 -4,-1.5 4,-2.1 -5,-0.3 -1,-0.2 0.897 114.3 48.3 -62.5 -44.0 31.1 45.0 34.1 260 70 B A H X S+ 0 0 10 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.907 112.3 48.1 -62.4 -45.2 31.2 46.0 30.5 261 71 B L H X S+ 0 0 37 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.852 110.5 52.5 -63.4 -38.8 33.5 49.0 31.1 262 72 B D H X S+ 0 0 76 -4,-2.1 4,-0.6 -5,-0.2 -1,-0.2 0.927 114.3 41.3 -62.9 -48.1 35.8 46.8 33.2 263 73 B S H >< S+ 0 0 13 -4,-2.1 3,-1.2 1,-0.2 4,-0.4 0.926 112.9 53.9 -67.8 -45.1 36.1 44.2 30.4 264 74 B F H >< S+ 0 0 29 -4,-2.9 3,-1.7 1,-0.2 -2,-0.2 0.904 103.9 57.0 -54.1 -44.4 36.4 46.8 27.7 265 75 B S H 3< S+ 0 0 85 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.720 99.4 59.4 -65.5 -18.1 39.3 48.5 29.5 266 76 B R T << S+ 0 0 141 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.561 81.5 107.4 -85.6 -7.2 41.3 45.2 29.5 267 77 B G < - 0 0 17 -3,-1.7 6,-0.1 -4,-0.4 3,-0.0 -0.466 69.1-140.7 -73.4 142.7 41.2 45.0 25.7 268 78 B K S S+ 0 0 210 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.611 84.2 2.1 -80.2 -11.9 44.6 45.8 24.0 269 79 B D S > S- 0 0 101 1,-0.1 4,-2.3 0, 0.0 5,-0.2 -0.903 93.6 -81.3-154.0-177.7 42.8 47.7 21.2 270 80 B L H > S+ 0 0 25 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.914 126.3 47.3 -58.7 -47.4 39.2 48.8 20.3 271 81 B R H > S+ 0 0 67 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.920 114.0 47.4 -61.8 -45.7 38.3 45.5 18.7 272 82 B E H > S+ 0 0 51 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.864 110.9 53.0 -61.8 -37.6 39.6 43.5 21.7 273 83 B G H X S+ 0 0 1 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.918 111.9 44.0 -63.8 -43.7 37.9 45.8 24.0 274 84 B L H X S+ 0 0 2 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.881 112.6 53.2 -70.5 -35.6 34.5 45.2 22.3 275 85 B R H X S+ 0 0 55 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.926 111.3 45.3 -65.9 -42.5 35.2 41.5 22.0 276 86 B R H X S+ 0 0 99 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.937 113.7 49.3 -65.9 -45.1 35.8 41.2 25.8 277 87 B Q H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.867 109.2 54.2 -57.8 -41.3 32.8 43.4 26.6 278 88 B W H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.936 108.8 46.5 -61.3 -49.6 30.7 41.2 24.3 279 89 B H H X S+ 0 0 31 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.892 113.6 49.2 -60.0 -43.4 31.6 38.0 26.0 280 90 B T H X S+ 0 0 34 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.952 113.6 45.9 -65.1 -42.9 31.0 39.6 29.5 281 91 B L H X S+ 0 0 18 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.897 111.4 51.6 -64.9 -40.6 27.5 40.9 28.5 282 92 B F H X S+ 0 0 0 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.933 111.3 48.3 -65.1 -42.1 26.5 37.6 26.9 283 93 B R H X S+ 0 0 136 -4,-2.1 4,-2.0 1,-0.2 5,-0.2 0.874 109.8 51.8 -66.0 -39.6 27.5 35.8 30.1 284 94 B I H X S+ 0 0 32 -4,-2.3 4,-3.3 1,-0.2 -1,-0.2 0.926 109.3 50.6 -60.4 -44.5 25.6 38.2 32.2 285 95 B G H < S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.878 110.9 49.3 -59.9 -41.7 22.5 37.7 30.0 286 96 B L H < S+ 0 0 33 -4,-2.0 274,-0.3 -5,-0.2 -1,-0.2 0.884 121.3 33.3 -67.1 -37.4 22.8 33.9 30.4 287 97 B E H < S+ 0 0 111 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.833 135.4 22.0 -88.4 -35.1 23.1 34.0 34.2 288 98 B R >X + 0 0 62 -4,-3.3 3,-1.8 -5,-0.2 4,-0.9 -0.511 64.5 157.2-133.2 61.3 20.9 36.9 35.0 289 99 B P H 3> + 0 0 6 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.803 69.7 72.1 -62.5 -24.5 18.5 37.4 32.1 290 100 B E H 3> S+ 0 0 34 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.822 91.8 57.9 -58.4 -28.3 16.1 39.2 34.5 291 101 B L H <> S+ 0 0 4 -3,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.943 108.6 44.2 -66.9 -48.1 18.6 42.2 34.4 292 102 B F H X S+ 0 0 27 -4,-0.9 4,-2.5 2,-0.2 -2,-0.2 0.897 114.4 50.2 -59.8 -42.8 18.3 42.5 30.6 293 103 B R H X S+ 0 0 89 -4,-2.5 4,-3.4 2,-0.2 5,-0.2 0.930 110.2 49.3 -65.6 -43.7 14.5 42.1 30.8 294 104 B Y H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 5,-0.3 0.954 112.5 48.5 -57.4 -50.6 14.2 44.8 33.5 295 105 B H H X S+ 0 0 69 -4,-2.4 4,-3.0 -5,-0.2 -2,-0.2 0.939 115.4 44.3 -53.6 -50.0 16.3 47.1 31.4 296 106 B E H X S+ 0 0 28 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.927 114.0 48.8 -61.5 -49.3 14.2 46.4 28.3 297 107 B T H < S+ 0 0 40 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.942 116.3 43.8 -58.9 -46.1 10.9 46.7 30.1 298 108 B F H >< S+ 0 0 3 -4,-2.9 3,-1.7 -5,-0.2 6,-0.4 0.932 112.4 49.4 -65.8 -50.1 11.9 50.0 31.7 299 109 B T H 3< S+ 0 0 37 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.777 112.1 50.2 -63.0 -26.0 13.5 51.6 28.5 300 110 B H T 3< S+ 0 0 89 -4,-1.7 -1,-0.3 -5,-0.2 2,-0.3 0.027 102.7 84.6 -97.2 21.0 10.3 50.7 26.5 301 111 B S S X S- 0 0 28 -3,-1.7 3,-1.8 -5,-0.0 -3,-0.0 -0.812 92.9-106.6-118.8 165.6 8.0 52.2 29.2 302 112 B A T 3 S+ 0 0 105 -2,-0.3 -4,-0.1 1,-0.3 -3,-0.1 0.603 111.9 74.4 -64.2 -14.0 6.7 55.7 29.9 303 113 B W T 3 S+ 0 0 96 -5,-0.2 -1,-0.3 2,-0.0 2,-0.3 0.661 78.7 94.5 -69.3 -18.5 9.1 55.8 32.9 304 114 B X < + 0 0 36 -3,-1.8 -5,-0.1 -6,-0.4 -58,-0.0 -0.572 53.3 175.0 -80.9 139.1 12.0 56.3 30.5 305 115 B T >> - 0 0 55 -2,-0.3 4,-2.1 1,-0.1 3,-0.5 -0.952 44.6-110.9-136.9 158.2 13.2 59.8 29.7 306 116 B P H 3> S+ 0 0 112 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.815 117.8 58.3 -55.8 -32.9 16.0 61.4 27.7 307 117 B E H 3> S+ 0 0 146 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.859 106.1 47.2 -65.2 -39.3 17.6 62.5 31.0 308 118 B I H <> S+ 0 0 7 -3,-0.5 4,-2.1 2,-0.2 5,-0.2 0.956 112.5 50.5 -65.8 -49.1 17.8 58.9 32.3 309 119 B Q H X S+ 0 0 93 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.916 110.0 50.4 -47.7 -52.7 19.3 57.9 28.9 310 120 B A H X S+ 0 0 48 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.870 106.5 54.7 -59.8 -41.7 21.9 60.6 29.1 311 121 B R H X S+ 0 0 74 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.906 110.8 45.0 -60.5 -44.9 22.8 59.5 32.6 312 122 B N H X S+ 0 0 16 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.905 112.2 51.4 -63.8 -42.4 23.6 56.0 31.4 313 123 B E H < S+ 0 0 93 -4,-2.4 7,-0.2 1,-0.2 -2,-0.2 0.910 109.5 52.8 -60.1 -41.0 25.5 57.3 28.3 314 124 B S H >< S+ 0 0 86 -4,-2.8 3,-1.3 2,-0.2 -2,-0.2 0.901 108.0 47.6 -59.7 -46.2 27.5 59.4 30.7 315 125 B R H 3< S+ 0 0 99 -4,-1.9 3,-0.4 1,-0.2 -1,-0.2 0.881 117.0 45.6 -63.8 -35.1 28.5 56.4 32.9 316 126 B A T >X S+ 0 0 13 -4,-2.2 4,-2.3 1,-0.2 3,-1.1 0.250 79.3 119.6 -87.8 14.0 29.4 54.6 29.7 317 127 B A H <> + 0 0 28 -3,-1.3 4,-3.6 1,-0.3 5,-0.3 0.829 67.0 57.2 -54.2 -41.7 31.3 57.6 28.3 318 128 B N H 3> S+ 0 0 126 -3,-0.4 4,-1.1 -4,-0.2 -1,-0.3 0.844 113.1 41.2 -61.1 -36.3 34.7 55.9 28.0 319 129 B L H <> S+ 0 0 16 -3,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.946 117.7 46.1 -72.7 -47.8 33.2 53.1 25.8 320 130 B L H X S+ 0 0 34 -4,-2.3 4,-2.5 -7,-0.2 -2,-0.2 0.881 112.4 50.3 -68.1 -38.7 31.0 55.5 23.7 321 131 B N H X S+ 0 0 93 -4,-3.6 4,-2.3 -5,-0.2 -1,-0.2 0.895 111.3 49.3 -64.4 -36.6 33.8 58.0 23.2 322 132 B A H X S+ 0 0 31 -4,-1.1 4,-2.3 -5,-0.3 -2,-0.2 0.917 111.6 48.5 -70.5 -39.9 36.2 55.2 22.0 323 133 B V H X S+ 0 0 8 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.946 110.2 52.0 -64.3 -43.3 33.5 53.9 19.6 324 134 B D H X S+ 0 0 71 -4,-2.5 4,-0.6 2,-0.2 3,-0.3 0.899 109.3 49.3 -59.2 -44.5 33.0 57.5 18.3 325 135 B Q H >X S+ 0 0 149 -4,-2.3 3,-1.2 1,-0.2 4,-0.8 0.902 105.7 58.2 -60.8 -38.2 36.7 57.9 17.7 326 136 B G H 3X>S+ 0 0 3 -4,-2.3 6,-2.4 1,-0.3 5,-1.3 0.824 98.0 61.3 -61.3 -29.4 36.7 54.6 15.9 327 137 B K H 3<5S+ 0 0 31 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.752 112.0 36.6 -70.2 -24.6 34.1 56.0 13.5 328 138 B Q H <<5S+ 0 0 155 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.469 110.5 61.8-101.9 -4.1 36.5 58.7 12.4 329 139 B S H <5S- 0 0 78 -4,-0.8 -2,-0.2 -3,-0.5 -3,-0.1 0.478 114.1 -98.1-103.4 -5.5 39.7 56.7 12.4 330 140 B G T <5S+ 0 0 33 -4,-0.7 -3,-0.1 2,-0.4 -4,-0.1 0.432 102.1 93.9 102.8 -1.0 39.0 53.9 9.8 331 141 B L S > - 0 0 39 0, 0.0 3,-1.7 0, 0.0 4,-1.0 -0.214 44.5-116.0 -54.9 142.6 24.6 56.8 13.0 337 147 B F H 3> S+ 0 0 60 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.787 109.9 67.0 -55.6 -35.5 24.8 55.4 16.4 338 148 B P H 3> S+ 0 0 22 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.854 101.2 51.4 -56.9 -29.8 21.4 53.6 16.2 339 149 B L H <> S+ 0 0 0 -3,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.868 107.9 51.3 -70.3 -38.0 22.9 51.4 13.5 340 150 B L H X>S+ 0 0 4 -4,-1.0 4,-2.2 2,-0.2 5,-0.5 0.926 110.6 49.2 -62.9 -43.2 25.9 50.6 15.8 341 151 B E H X>S+ 0 0 38 -4,-2.6 5,-2.9 1,-0.2 4,-1.6 0.917 110.2 52.6 -57.6 -46.1 23.4 49.7 18.6 342 152 B T H <5S+ 0 0 3 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.850 120.8 28.9 -60.5 -39.9 21.5 47.5 16.2 343 153 B F H <5S+ 0 0 0 -4,-1.8 -1,-0.2 3,-0.1 -2,-0.2 0.601 129.3 33.6-101.6 -17.9 24.4 45.4 15.0 344 154 B X H <5S+ 0 0 5 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 0.674 129.5 18.3-112.1 -27.7 26.8 45.5 18.1 345 155 B F T >X S+ 0 0 5 0, 0.0 4,-2.8 0, 0.0 -1,-0.3 0.800 94.6 61.0 -65.7 -23.1 22.2 41.0 19.0 348 158 B I H <> S+ 0 0 4 -3,-1.5 4,-2.9 2,-0.2 5,-0.3 0.964 106.7 46.1 -61.1 -51.4 23.5 40.0 22.5 349 159 B Y H X S+ 0 0 35 -4,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.944 115.2 46.6 -52.8 -50.6 19.9 40.4 23.9 350 160 B H H X S+ 0 0 21 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.921 115.6 44.4 -62.7 -44.7 18.4 38.5 21.0 351 161 B L H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.865 110.6 53.9 -72.5 -38.0 20.9 35.6 21.1 352 162 B V H X S+ 0 0 4 -4,-2.9 4,-2.5 -5,-0.2 -1,-0.2 0.927 110.3 49.0 -56.6 -44.0 20.8 35.3 24.9 353 163 B Q H X S+ 0 0 49 -4,-2.1 4,-1.8 -5,-0.3 -2,-0.2 0.956 110.5 49.4 -63.9 -48.3 17.0 34.9 24.5 354 164 B R H <>S+ 0 0 51 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-4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.910 111.4 50.9 -66.7 -45.7 32.9 34.4 19.7 369 179 B L H X S+ 0 0 52 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.920 109.6 50.7 -59.1 -44.6 31.5 33.6 16.3 370 180 B A H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.913 109.7 50.8 -60.5 -43.5 28.5 35.9 16.9 371 181 B F H X S+ 0 0 0 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.911 106.0 55.3 -60.1 -42.1 30.9 38.7 18.0 372 182 B N H X S+ 0 0 46 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.882 109.2 47.7 -57.9 -36.3 32.9 38.2 14.8 373 183 B X H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.903 111.3 50.1 -67.7 -43.6 29.7 38.7 12.8 374 184 B A H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.918 111.8 48.7 -63.0 -41.6 28.9 41.9 14.9 375 185 B W H X S+ 0 0 26 -4,-3.0 4,-2.5 1,-0.2 3,-0.2 0.958 109.7 50.6 -63.1 -49.6 32.3 43.2 14.3 376 186 B D H < S+ 0 0 24 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.895 108.5 54.9 -54.4 -40.5 32.1 42.6 10.6 377 187 B A H < S+ 0 0 0 -4,-2.3 -1,-0.2 -191,-0.2 -2,-0.2 0.920 120.4 28.7 -57.1 -46.4 28.8 44.4 10.6 378 188 B V H < S+ 0 0 3 -4,-1.9 -45,-3.3 -3,-0.2 -2,-0.2 0.612 95.7 106.6 -90.6 -19.3 30.2 47.6 12.2 379 189 B A B < S-B 332 0B 9 -4,-2.5 2,-0.5 -47,-0.3 -47,-0.3 -0.434 71.4-123.1 -76.1 137.8 33.8 47.5 11.0 380 190 B D - 0 0 17 -49,-2.0 -1,-0.1 -2,-0.2 -2,-0.1 -0.670 19.4-161.0 -76.7 123.6 35.0 49.9 8.3 381 191 B R > + 0 0 97 -2,-0.5 3,-2.0 2,-0.1 -1,-0.1 0.395 44.1 131.1 -90.7 4.7 36.4 47.8 5.4 382 192 B R T 3 S+ 0 0 157 1,-0.2 -2,-0.1 -52,-0.1 0, 0.0 -0.406 77.7 14.1 -62.6 129.6 38.5 50.6 3.8 383 193 B N T 3 0 0 172 1,-0.3 -1,-0.2 -2,-0.1 -2,-0.1 0.201 360.0 360.0 85.0 -4.1 42.0 49.3 3.2 384 194 B T < 0 0 165 -3,-2.0 -1,-0.3 -4,-0.0 -3,-0.1 -0.570 360.0 360.0-120.5 360.0 41.2 45.6 3.7 385 !* 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 0.0 386 0 C G > 0 0 86 0, 0.0 4,-2.1 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0-154.5 22.5 2.1 -2.0 387 1 C X H > + 0 0 154 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.894 360.0 56.4 -54.9 -48.2 19.0 0.8 -1.3 388 2 C R H > S+ 0 0 67 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.835 109.0 45.7 -58.0 -38.4 19.7 0.4 2.5 389 3 C Q H > S+ 0 0 87 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.913 113.9 48.4 -72.1 -45.5 20.6 4.2 2.8 390 4 C R H X S+ 0 0 185 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.924 112.3 50.8 -58.5 -46.9 17.6 5.3 0.7 391 5 C D H X S+ 0 0 36 -4,-3.2 4,-2.7 1,-0.2 -2,-0.2 0.930 111.7 45.8 -54.3 -51.4 15.5 3.0 3.0 392 6 C D H X S+ 0 0 87 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.860 109.7 54.9 -67.1 -33.1 16.9 4.5 6.2 393 7 C S H X S+ 0 0 81 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.930 111.9 44.7 -63.9 -44.0 16.4 8.0 4.8 394 8 C K H X S+ 0 0 72 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.919 112.2 50.8 -64.3 -45.3 12.7 7.2 4.2 395 9 C R H X S+ 0 0 86 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.935 109.2 52.1 -56.9 -47.4 12.2 5.5 7.6 396 10 C I H X S+ 0 0 72 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.912 107.5 52.6 -58.0 -42.3 13.8 8.5 9.3 397 11 C A H X S+ 0 0 31 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.885 110.8 46.3 -59.8 -42.0 11.4 10.8 7.5 398 12 C F H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.883 113.2 49.9 -66.5 -39.9 8.3 8.8 8.6 399 13 C L H X S+ 0 0 15 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.961 114.5 42.9 -63.9 -51.7 9.6 8.7 12.2 400 14 C E H X S+ 0 0 58 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.874 113.1 53.3 -62.1 -38.1 10.3 12.4 12.4 401 15 C A H X S+ 0 0 8 -4,-2.1 4,-2.8 -5,-0.3 5,-0.2 0.883 108.6 50.3 -65.9 -37.7 6.9 13.1 10.7 402 16 C T H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 5,-0.4 0.933 109.8 50.6 -63.5 -45.9 5.2 11.0 13.3 403 17 C V H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.932 114.5 42.8 -52.4 -52.9 6.9 12.9 16.1 404 18 C R H X S+ 0 0 95 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.967 116.9 46.0 -63.5 -52.2 5.9 16.3 14.7 405 19 C E H X S+ 0 0 19 -4,-2.8 4,-3.0 1,-0.2 5,-0.4 0.901 117.1 41.9 -60.3 -48.2 2.3 15.3 13.8 406 20 C V H X S+ 0 0 1 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.904 112.5 54.2 -67.6 -39.8 1.5 13.5 17.1 407 21 C A H < S+ 0 0 13 -4,-2.3 -2,-0.2 -5,-0.4 -1,-0.2 0.907 119.1 35.3 -57.6 -40.5 3.2 16.2 19.2 408 22 C D H < S+ 0 0 41 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.872 137.2 14.2 -83.8 -41.1 1.1 18.8 17.5 409 23 C H H < S- 0 0 97 -4,-3.0 4,-0.4 -5,-0.2 -3,-0.2 0.551 97.2-122.7-117.9 -9.2 -2.3 17.0 17.0 410 24 C G X - 0 0 21 -4,-2.2 4,-0.7 -5,-0.4 -1,-0.2 -0.097 37.2 -69.8 84.2 174.8 -2.3 13.8 19.1 411 25 C F T >4 S+ 0 0 11 2,-0.2 3,-0.7 1,-0.2 -1,-0.1 0.927 122.2 52.5 -66.8 -53.9 -2.8 10.1 18.0 412 26 C S T 34 S+ 0 0 115 1,-0.3 -1,-0.2 -6,-0.1 -2,-0.1 0.826 113.5 43.8 -58.5 -36.5 -6.4 10.0 17.0 413 27 C A T 34 S+ 0 0 48 -4,-0.4 2,-0.9 -7,-0.1 -1,-0.3 0.673 95.8 88.7 -82.0 -18.2 -6.3 12.9 14.7 414 28 C T << - 0 0 0 -3,-0.7 2,-0.2 -4,-0.7 -1,-0.1 -0.733 61.4-174.2 -90.0 104.2 -2.9 11.7 13.1 415 29 C S > - 0 0 53 -2,-0.9 4,-2.3 1,-0.1 5,-0.2 -0.544 40.5-110.8 -88.0 162.0 -3.7 9.4 10.2 416 30 C V H > S+ 0 0 14 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.893 120.9 58.4 -56.3 -40.0 -1.2 7.5 8.1 417 31 C G H > S+ 0 0 34 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.909 106.5 45.7 -55.7 -49.1 -2.1 9.9 5.3 418 32 C K H > S+ 0 0 105 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.905 113.9 48.6 -62.3 -46.0 -1.1 13.0 7.3 419 33 C I H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.940 111.5 49.8 -59.5 -48.4 2.2 11.4 8.5 420 34 C A H X>S+ 0 0 0 -4,-3.0 5,-2.4 -5,-0.2 4,-0.7 0.950 112.0 47.4 -57.8 -49.2 3.1 10.3 4.9 421 35 C K H ><5S+ 0 0 176 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.911 111.4 50.9 -58.1 -44.5 2.4 13.8 3.5 422 36 C A H 3<5S+ 0 0 52 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.881 111.0 50.6 -61.7 -34.4 4.4 15.4 6.3 423 37 C A H 3<5S- 0 0 18 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.601 113.1-119.2 -79.3 -10.3 7.2 13.0 5.4 424 38 C G T <<5S+ 0 0 66 -3,-1.1 2,-0.3 -4,-0.7 -3,-0.2 0.748 81.2 99.3 78.3 22.8 7.1 13.8 1.6 425 39 C L S - 0 0 48 -2,-0.3 4,-2.1 1,-0.1 3,-0.3 -0.544 24.8-121.2 -90.5 154.3 3.1 8.2 -0.0 427 41 C P H > S+ 0 0 60 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.886 115.9 58.8 -54.3 -39.0 0.9 6.1 2.3 428 42 C A H > S+ 0 0 70 1,-0.2 4,-0.6 2,-0.2 -3,-0.0 0.898 107.0 46.6 -57.9 -39.7 1.7 3.1 0.1 429 43 C T H >> S+ 0 0 32 -3,-0.3 4,-1.3 2,-0.2 3,-0.9 0.890 107.0 57.4 -70.9 -37.1 5.4 3.7 0.9 430 44 C L H >X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.3 3,-0.6 0.940 105.5 51.3 -55.4 -45.4 4.6 4.1 4.6 431 45 C Y H 3< S+ 0 0 122 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.668 101.4 61.9 -69.6 -15.9 3.0 0.6 4.5 432 46 C I H << S+ 0 0 127 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.874 115.4 32.0 -72.2 -36.2 6.2 -0.9 2.9 433 47 C Y H << S+ 0 0 35 -4,-1.3 2,-0.4 -3,-0.6 -2,-0.2 0.763 127.9 34.4 -92.5 -27.7 8.3 0.1 6.0 434 48 C Y S < S- 0 0 15 -4,-2.3 -1,-0.2 -5,-0.2 3,-0.1 -0.994 70.9-140.6-134.6 131.1 5.7 -0.2 8.8 435 49 C E S S- 0 0 143 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.886 79.3 -22.9 -62.4 -37.6 2.9 -2.9 8.7 436 50 C D S > S- 0 0 52 -6,-0.1 4,-1.6 1,-0.0 3,-0.3 -0.909 79.7 -77.1-160.9 174.8 0.3 -0.5 10.2 437 51 C K H > S+ 0 0 39 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.889 123.4 56.6 -52.4 -46.1 -0.1 2.7 12.2 438 52 C E H > S+ 0 0 90 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.888 104.5 50.9 -55.5 -44.2 0.6 0.9 15.5 439 53 C Q H > S+ 0 0 89 -3,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.890 112.5 47.6 -66.6 -36.5 4.0 -0.4 14.3 440 54 C L H X S+ 0 0 1 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.907 109.6 52.5 -67.8 -43.7 5.0 3.1 13.2 441 55 C L H X S+ 0 0 1 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.910 114.9 42.5 -58.4 -39.6 3.8 4.7 16.5 442 56 C L H X S+ 0 0 57 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.914 111.6 52.3 -75.1 -43.1 5.9 2.2 18.4 443 57 C A H X S+ 0 0 30 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.915 111.6 49.4 -57.7 -38.5 8.9 2.5 16.2 444 58 C T H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.904 106.8 54.7 -67.5 -43.3 8.7 6.2 16.7 445 59 C F H X S+ 0 0 0 -4,-1.9 4,-3.3 -5,-0.2 -2,-0.2 0.914 112.5 42.9 -55.3 -45.0 8.4 5.7 20.5 446 60 C Y H X S+ 0 0 48 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.875 111.2 54.8 -70.6 -36.9 11.7 3.7 20.5 447 61 C Y H X S+ 0 0 49 -4,-2.5 4,-1.1 -5,-0.2 -2,-0.2 0.917 116.8 37.9 -58.8 -41.7 13.4 6.2 18.1 448 62 C V H X S+ 0 0 1 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.954 119.0 48.4 -73.4 -51.9 12.5 9.0 20.5 449 63 C S H X S+ 0 0 2 -4,-3.3 4,-3.3 -5,-0.2 5,-0.3 0.875 108.7 53.0 -57.6 -45.9 13.2 6.9 23.7 450 64 C D H X S+ 0 0 31 -4,-2.9 4,-2.6 1,-0.2 5,-0.3 0.910 109.3 47.3 -61.5 -43.2 16.6 5.6 22.5 451 65 C Q H X S+ 0 0 63 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0.928 116.3 44.2 -64.6 -43.4 -20.0 23.2 31.1 593 14 D E H X S+ 0 0 49 -4,-2.8 4,-2.9 -5,-0.2 -2,-0.2 0.902 112.4 51.4 -71.3 -42.9 -20.0 19.5 31.7 594 15 D A H X S+ 0 0 0 -4,-2.4 4,-3.2 -5,-0.3 -1,-0.2 0.877 111.6 49.2 -58.3 -40.1 -20.2 18.8 27.9 595 16 D T H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.4 0.933 110.3 49.1 -66.9 -48.3 -17.2 21.2 27.5 596 17 D V H X S+ 0 0 2 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.953 117.3 43.7 -51.1 -50.9 -15.2 19.4 30.2 597 18 D R H X S+ 0 0 81 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.945 114.8 45.7 -62.3 -55.2 -16.0 16.1 28.6 598 19 D E H X S+ 0 0 35 -4,-3.2 4,-3.3 1,-0.2 5,-0.4 0.933 119.4 40.4 -58.0 -46.6 -15.4 17.0 25.0 599 20 D V H X S+ 0 0 2 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.903 112.6 53.9 -72.4 -41.8 -12.1 18.9 25.7 600 21 D A H < S+ 0 0 11 -4,-2.7 -1,-0.2 -5,-0.4 -2,-0.2 0.920 120.5 37.1 -53.6 -41.6 -10.8 16.3 28.2 601 22 D D H < S+ 0 0 107 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.916 136.4 9.7 -75.0 -50.4 -11.4 13.7 25.4 602 23 D H H < S- 0 0 112 -4,-3.3 4,-0.5 1,-0.2 -3,-0.2 0.428 97.7-113.4-122.4 -1.4 -10.5 15.5 22.2 603 24 D G X - 0 0 25 -4,-2.1 4,-0.6 -5,-0.4 -1,-0.2 -0.110 36.9 -74.9 90.9 167.0 -8.7 18.8 22.9 604 25 D F T >4 S+ 0 0 12 2,-0.2 3,-0.8 1,-0.1 -1,-0.1 0.942 119.2 55.3 -67.7 -49.1 -9.7 22.4 22.3 605 26 D S T 34 S+ 0 0 67 1,-0.3 -1,-0.1 -6,-0.1 -2,-0.1 0.876 112.2 40.5 -61.7 -43.7 -9.2 22.6 18.5 606 27 D A T 34 S+ 0 0 49 -4,-0.5 2,-1.2 1,-0.1 -1,-0.3 0.634 94.0 93.4 -75.5 -17.9 -11.4 19.8 17.4 607 28 D T << - 0 0 0 -3,-0.8 2,-0.1 -4,-0.6 -1,-0.1 -0.658 61.4-176.2 -84.8 98.2 -14.1 20.6 20.0 608 29 D S > - 0 0 23 -2,-1.2 4,-2.4 1,-0.1 5,-0.1 -0.392 42.6-107.2 -86.3 167.9 -16.5 22.9 18.1 609 30 D V H > S+ 0 0 8 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.822 122.8 54.4 -59.6 -35.6 -19.6 24.6 19.4 610 31 D G H > S+ 0 0 33 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.921 108.1 46.4 -66.5 -44.3 -21.6 22.0 17.4 611 32 D K H > S+ 0 0 101 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.922 114.9 47.9 -67.8 -39.3 -19.9 19.1 19.1 612 33 D I H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.967 110.2 51.5 -60.2 -51.4 -20.3 20.7 22.5 613 34 D A H <>S+ 0 0 0 -4,-2.6 5,-2.6 1,-0.2 4,-0.4 0.872 110.7 48.5 -56.7 -40.9 -23.9 21.5 21.9 614 35 D K H ><5S+ 0 0 125 -4,-2.1 3,-1.8 1,-0.2 -1,-0.2 0.945 108.8 51.8 -65.0 -49.8 -24.7 17.8 20.9 615 36 D A H 3<5S+ 0 0 35 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.784 112.2 49.3 -56.5 -26.1 -22.9 16.4 23.9 616 37 D A T 3<5S- 0 0 17 -4,-1.6 -1,-0.3 2,-0.2 -2,-0.2 0.508 112.4-120.2 -87.5 -11.3 -25.1 18.7 26.0 617 38 D G T < 5S+ 0 0 64 -3,-1.8 2,-0.3 -4,-0.4 -3,-0.2 0.756 78.8 102.9 72.7 28.5 -28.3 17.7 24.3 618 39 D L S - 0 0 52 -2,-0.3 4,-1.9 1,-0.1 3,-0.3 -0.562 25.7-121.3 -91.4 153.5 -28.7 23.3 20.0 620 41 D P H > S+ 0 0 62 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.908 116.3 59.5 -56.2 -38.1 -25.8 25.4 18.9 621 42 D A H > S+ 0 0 65 1,-0.2 4,-0.7 2,-0.2 -3,-0.0 0.920 106.1 47.6 -50.1 -48.1 -28.3 28.4 18.8 622 43 D T H > S+ 0 0 24 -3,-0.3 4,-1.2 2,-0.2 3,-0.5 0.854 106.6 58.1 -63.5 -36.6 -29.0 27.8 22.5 623 44 D L H >X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 3,-1.0 0.961 106.1 47.2 -61.3 -51.1 -25.3 27.6 23.2 624 45 D Y H 3< S+ 0 0 76 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.643 105.7 60.5 -65.4 -16.3 -24.7 31.1 21.8 625 46 D I H 3< S+ 0 0 134 -4,-0.7 -1,-0.2 -3,-0.5 -2,-0.2 0.773 114.3 35.1 -78.5 -27.0 -27.7 32.4 23.8 626 47 D Y H << S+ 0 0 51 -4,-1.2 2,-0.4 -3,-1.0 -2,-0.2 0.754 125.5 36.4 -94.7 -29.0 -25.9 31.3 27.1 627 48 D Y S < S- 0 0 18 -4,-2.4 -1,-0.2 -5,-0.2 3,-0.1 -0.981 73.0-136.0-129.4 135.8 -22.3 32.1 26.1 628 49 D E S S- 0 0 110 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.908 81.2 -31.3 -57.0 -42.9 -21.1 35.0 24.0 629 50 D D S > S- 0 0 8 -3,-0.1 4,-1.6 -6,-0.1 5,-0.1 -0.885 76.3 -76.2-160.3-179.4 -18.8 32.8 22.0 630 51 D K H > S+ 0 0 5 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.889 124.2 56.9 -60.7 -43.4 -16.6 29.6 22.3 631 52 D E H > S+ 0 0 25 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.915 106.0 49.8 -55.2 -46.1 -13.8 31.5 24.3 632 53 D Q H > S+ 0 0 91 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.883 111.9 48.4 -62.3 -40.0 -16.3 32.6 27.0 633 54 D L H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.889 110.3 51.5 -67.2 -37.9 -17.6 29.0 27.4 634 55 D L H X S+ 0 0 1 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.914 113.9 44.3 -65.0 -41.7 -14.0 27.6 27.6 635 56 D L H X S+ 0 0 53 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.936 112.1 50.7 -65.8 -53.5 -13.2 30.2 30.3 636 57 D A H X S+ 0 0 30 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.877 110.9 50.7 -49.3 -43.4 -16.4 29.6 32.3 637 58 D T H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.927 108.3 52.1 -65.6 -40.5 -15.7 25.9 32.1 638 59 D F H X S+ 0 0 0 -4,-1.9 4,-3.3 1,-0.2 -2,-0.2 0.930 112.5 44.6 -59.7 -46.6 -12.2 26.5 33.5 639 60 D Y H X S+ 0 0 51 -4,-2.8 4,-3.1 2,-0.2 5,-0.2 0.862 110.6 55.2 -64.7 -37.4 -13.5 28.5 36.4 640 61 D Y H X S+ 0 0 49 -4,-2.3 4,-1.2 -5,-0.2 -2,-0.2 0.875 115.1 38.9 -60.5 -41.9 -16.2 25.9 37.0 641 62 D V H X S+ 0 0 1 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.934 119.1 47.5 -72.2 -47.4 -13.5 23.2 37.2 642 63 D S H X S+ 0 0 1 -4,-3.3 4,-3.2 -5,-0.2 5,-0.3 0.886 109.1 53.5 -63.5 -42.3 -11.1 25.5 39.2 643 64 D D H X S+ 0 0 40 -4,-3.1 4,-2.1 1,-0.2 5,-0.2 0.937 108.7 48.6 -60.1 -49.2 -13.7 26.7 41.7 644 65 D Q H X S+ 0 0 56 -4,-1.2 4,-1.4 -5,-0.2 -1,-0.2 0.922 119.2 39.1 -52.7 -48.1 -14.8 23.2 42.7 645 66 D V H X S+ 0 0 21 -4,-1.8 4,-2.3 2,-0.2 5,-0.2 0.887 114.3 49.6 -78.1 -44.5 -11.2 22.0 43.2 646 67 D I H X S+ 0 0 30 -4,-3.2 4,-3.1 1,-0.2 5,-0.2 0.928 113.1 49.0 -60.2 -42.4 -9.7 25.1 44.8 647 68 D D H X S+ 0 0 69 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.846 111.0 48.2 -69.6 -37.9 -12.6 25.3 47.3 648 69 D A H X S+ 0 0 31 -4,-1.4 4,-2.3 -5,-0.2 -1,-0.2 0.918 114.8 46.9 -66.9 -43.5 -12.3 21.6 48.3 649 70 D A H X S+ 0 0 10 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.903 112.8 49.0 -63.9 -44.0 -8.5 22.0 48.7 650 71 D L H X S+ 0 0 32 -4,-3.1 4,-2.3 -5,-0.2 -1,-0.2 0.893 110.6 51.2 -63.3 -38.8 -9.0 25.2 50.7 651 72 D D H < S+ 0 0 82 -4,-1.9 4,-0.5 2,-0.2 -2,-0.2 0.925 114.1 42.5 -62.7 -48.5 -11.6 23.6 53.0 652 73 D S H >< S+ 0 0 11 -4,-2.3 3,-1.4 1,-0.2 4,-0.3 0.937 113.4 53.0 -64.7 -46.7 -9.3 20.6 53.7 653 74 D F H >< S+ 0 0 26 -4,-2.8 3,-1.9 1,-0.3 -2,-0.2 0.880 100.5 62.0 -54.8 -42.1 -6.2 22.8 54.1 654 75 D S T 3< S+ 0 0 86 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.698 94.7 63.1 -62.8 -18.4 -8.0 25.0 56.7 655 76 D R T < S+ 0 0 152 -3,-1.4 -1,-0.3 -4,-0.5 2,-0.2 0.567 80.2 102.7 -83.9 -6.2 -8.4 22.0 59.0 656 77 D G < - 0 0 19 -3,-1.9 6,-0.1 -4,-0.3 4,-0.0 -0.543 68.3-140.3 -81.6 143.8 -4.7 21.5 59.5 657 78 D K S S+ 0 0 184 -2,-0.2 2,-0.2 2,-0.0 -1,-0.1 0.709 85.2 7.5 -73.4 -23.6 -3.0 22.6 62.8 658 79 D D S > S- 0 0 72 1,-0.1 4,-2.1 0, 0.0 5,-0.2 -0.845 92.5 -85.2-144.0-178.3 0.1 23.9 61.0 659 80 D L H > S+ 0 0 20 -2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.932 122.8 48.6 -61.4 -49.2 1.3 24.4 57.4 660 81 D R H > S+ 0 0 78 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.903 112.1 48.2 -58.3 -44.8 2.6 20.9 56.8 661 82 D E H > S+ 0 0 39 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.875 111.2 51.5 -68.1 -38.6 -0.6 19.2 58.1 662 83 D G H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.904 111.1 46.3 -58.7 -46.2 -2.8 21.5 56.0 663 84 D L H X S+ 0 0 4 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.869 112.2 52.7 -65.8 -37.3 -0.8 20.7 52.8 664 85 D R H X S+ 0 0 52 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.969 111.0 46.1 -61.3 -49.3 -1.0 17.0 53.8 665 86 D R H X S+ 0 0 96 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.942 114.2 47.9 -58.6 -49.6 -4.8 17.1 54.2 666 87 D Q H X S+ 0 0 1 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.824 108.0 56.0 -59.6 -40.1 -5.2 19.1 50.9 667 88 D W H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.950 109.4 45.5 -59.5 -51.0 -2.9 16.6 49.1 668 89 D H H X S+ 0 0 34 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.924 113.6 50.1 -59.2 -47.2 -5.1 13.7 50.1 669 90 D T H X S+ 0 0 24 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.914 111.6 47.2 -55.5 -49.6 -8.2 15.5 49.2 670 91 D L H X S+ 0 0 18 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.903 111.0 52.9 -62.4 -42.5 -6.9 16.5 45.7 671 92 D F H X S+ 0 0 4 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.946 109.8 47.3 -56.5 -50.1 -5.7 12.9 45.1 672 93 D R H X S+ 0 0 126 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.911 113.0 49.6 -59.1 -42.7 -9.2 11.6 45.9 673 94 D I H X S+ 0 0 17 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.918 111.5 48.0 -61.7 -47.0 -10.9 14.2 43.6 674 95 D G H < S+ 0 0 0 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.915 112.3 48.7 -60.5 -45.3 -8.6 13.5 40.7 675 96 D L H < S+ 0 0 49 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.925 118.4 40.5 -60.3 -45.5 -9.1 9.7 41.0 676 97 D E H < S+ 0 0 123 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.747 132.9 19.7 -75.8 -30.9 -12.9 10.2 41.2 677 98 D R >X + 0 0 103 -4,-2.8 3,-1.5 -5,-0.2 4,-0.9 -0.493 66.9 165.2-140.6 66.9 -13.3 12.9 38.5 678 99 D P H 3> S+ 0 0 53 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.717 71.2 68.4 -60.4 -26.5 -10.1 12.8 36.4 679 100 D E H 3> S+ 0 0 75 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.811 93.6 58.4 -61.5 -35.0 -11.8 14.9 33.6 680 101 D L H <> S+ 0 0 4 -3,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.959 111.2 42.0 -57.4 -52.5 -11.8 17.9 36.0 681 102 D F H X S+ 0 0 22 -4,-0.9 4,-2.5 2,-0.2 -2,-0.2 0.872 112.9 52.0 -61.6 -41.6 -8.1 17.6 36.3 682 103 D R H X S+ 0 0 71 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.940 110.5 48.5 -69.9 -38.0 -7.5 16.9 32.6 683 104 D Y H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.939 112.2 48.8 -60.9 -46.9 -9.5 20.0 31.6 684 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