==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 09-JUN-10 3NF4 . COMPND 2 MOLECULE: ACYL-COA DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM THERMORESISTIBILE; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 736 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29910.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 551 74.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 75 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 27 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 319 43.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.9 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 4 4 0 0 2 4 2 2 0 0 0 2 0 0 0 0 0 0 0 0 2 2 1 1 0 RESIDUES PER ALPHA HELIX . 2 0 0 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 PARALLEL BRIDGES PER LADDER . 3 3 2 0 2 0 2 0 2 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 . 1 0 0 0 0 0 2 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 5 A M 0 0 141 0, 0.0 2,-0.2 0, 0.0 257,-0.0 0.000 360.0 360.0 360.0 57.3 49.9 50.2 48.6 2 6 A A - 0 0 64 2,-0.0 2,-0.2 0, 0.0 0, 0.0 -0.781 360.0 -98.4-169.5 136.4 51.7 48.4 51.5 3 7 A V - 0 0 33 -2,-0.2 2,-0.9 1,-0.1 251,-0.0 -0.365 27.3-133.5 -67.7 125.9 54.0 49.9 54.2 4 8 A D - 0 0 164 -2,-0.2 2,-0.3 2,-0.0 -1,-0.1 -0.687 36.0-158.5 -77.9 105.2 57.8 49.6 53.6 5 9 A R - 0 0 31 -2,-0.9 2,-0.7 8,-0.0 8,-0.0 -0.660 22.3-136.0-100.1 141.9 58.9 48.4 57.0 6 10 A L + 0 0 149 -2,-0.3 -2,-0.0 2,-0.0 -1,-0.0 -0.830 38.7 171.3 -89.7 114.0 62.3 48.4 58.8 7 11 A L - 0 0 47 -2,-0.7 64,-0.1 1,-0.0 6,-0.1 -0.940 40.1-127.8-131.2 146.2 62.7 45.0 60.4 8 12 A P S S- 0 0 72 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.528 83.4 -0.8 -75.1 -8.4 65.6 43.2 62.2 9 13 A S S > S- 0 0 62 1,-0.1 4,-1.4 0, 0.0 3,-0.0 -0.988 71.4 -99.0-167.6 170.0 65.6 39.9 60.1 10 14 A Q H > S+ 0 0 156 -2,-0.3 4,-1.6 1,-0.2 5,-0.1 0.810 118.6 61.0 -66.2 -30.9 64.0 37.9 57.3 11 15 A E H > S+ 0 0 74 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.918 103.2 48.9 -63.4 -44.8 62.1 35.9 59.9 12 16 A A H > S+ 0 0 4 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.881 106.5 57.5 -62.4 -39.0 60.3 39.1 61.1 13 17 A A H X S+ 0 0 29 -4,-1.4 4,-1.8 1,-0.2 -1,-0.2 0.864 107.1 47.6 -59.6 -40.2 59.4 40.0 57.5 14 18 A E H X S+ 0 0 55 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.805 107.5 56.1 -71.0 -31.9 57.6 36.7 57.1 15 19 A L H X S+ 0 0 28 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.875 107.7 48.6 -68.1 -37.1 55.7 37.2 60.4 16 20 A I H X S+ 0 0 11 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.936 110.6 52.2 -63.4 -43.3 54.5 40.5 59.0 17 21 A E H X S+ 0 0 121 -4,-1.8 4,-1.5 1,-0.2 -2,-0.2 0.881 107.2 51.2 -61.5 -41.6 53.5 38.6 55.9 18 22 A L H X S+ 0 0 77 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.907 109.1 52.4 -61.1 -40.3 51.6 36.1 57.9 19 23 A T H X S+ 0 0 1 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.881 106.0 52.0 -63.0 -42.5 49.7 38.9 59.7 20 24 A R H X S+ 0 0 57 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.873 110.6 50.3 -63.2 -36.7 48.6 40.6 56.5 21 25 A E H X S+ 0 0 118 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.952 113.1 42.4 -67.3 -54.1 47.2 37.3 55.2 22 26 A I H X>S+ 0 0 36 -4,-2.2 4,-3.1 1,-0.2 5,-0.7 0.912 115.9 50.4 -57.7 -45.6 45.1 36.4 58.4 23 27 A A H X>S+ 0 0 2 -4,-2.3 5,-2.6 1,-0.2 4,-0.8 0.887 112.4 45.8 -64.1 -41.1 43.8 40.0 58.7 24 28 A D H <5S+ 0 0 70 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.771 120.8 39.9 -72.0 -26.2 42.7 40.3 55.1 25 29 A K H <5S+ 0 0 152 -4,-1.6 -2,-0.2 -5,-0.1 -3,-0.2 0.837 129.9 22.0 -90.4 -39.5 41.0 36.8 55.2 26 30 A V H <5S+ 0 0 15 -4,-3.1 4,-0.2 -5,-0.2 -3,-0.2 0.868 130.5 30.1-100.7 -44.0 39.4 36.8 58.7 27 31 A L T >X S+ 0 0 61 -3,-1.0 4,-1.8 -4,-0.2 5,-0.2 0.453 92.1 92.2-113.0 -8.6 33.2 41.0 58.2 31 35 A V H X S+ 0 0 0 -4,-1.1 4,-2.1 1,-0.2 5,-0.3 0.879 83.2 51.3 -63.3 -43.7 34.3 44.3 59.9 32 36 A D H > S+ 0 0 76 -4,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.869 112.8 46.7 -62.0 -37.4 31.7 46.7 58.4 33 37 A R H > S+ 0 0 167 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.874 112.9 46.7 -76.5 -38.4 28.8 44.5 59.3 34 38 A H H X>S+ 0 0 42 -4,-1.8 5,-1.5 2,-0.2 4,-1.3 0.826 114.1 47.4 -72.8 -33.7 29.7 43.8 62.9 35 39 A E H <5S+ 0 0 4 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.875 114.6 47.5 -73.2 -36.8 30.6 47.4 63.7 36 40 A K H <5S+ 0 0 154 -4,-1.7 -2,-0.2 -5,-0.3 -1,-0.2 0.888 119.5 38.2 -67.7 -42.1 27.3 48.5 62.1 37 41 A D H <5S- 0 0 69 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.634 103.2-130.5 -82.8 -18.3 25.2 45.9 64.0 38 42 A E T <5 + 0 0 86 -4,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.876 56.0 145.6 65.7 44.8 27.2 46.2 67.2 39 43 A T < - 0 0 60 -5,-1.5 -1,-0.2 -6,-0.1 -2,-0.1 -0.794 52.7-103.1-115.4 155.7 27.7 42.5 67.6 40 44 A Y - 0 0 39 -2,-0.3 2,-1.2 1,-0.1 166,-0.1 -0.515 29.6-124.5 -74.7 137.6 30.5 40.2 68.9 41 45 A P >> - 0 0 1 0, 0.0 3,-1.0 0, 0.0 4,-0.5 -0.687 28.2-156.4 -85.4 90.0 32.8 38.4 66.4 42 46 A E T 34 S+ 0 0 146 -2,-1.2 0, 0.0 1,-0.2 0, 0.0 -0.393 73.5 14.0 -63.7 135.6 32.6 34.7 67.4 43 47 A G T 3> S+ 0 0 41 -2,-0.1 4,-1.6 1,-0.1 -1,-0.2 0.110 97.2 102.0 92.0 -21.5 35.6 32.6 66.3 44 48 A V H <> S+ 0 0 5 -3,-1.0 4,-1.5 1,-0.2 5,-0.2 0.914 81.2 43.9 -65.1 -50.9 37.9 35.5 65.5 45 49 A F H X S+ 0 0 13 -4,-0.5 4,-1.7 1,-0.2 -1,-0.2 0.780 110.7 58.0 -67.7 -26.7 40.1 35.5 68.6 46 50 A E H > S+ 0 0 64 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.884 107.4 47.8 -66.2 -41.1 40.4 31.7 68.4 47 51 A Q H < S+ 0 0 106 -4,-1.6 4,-0.4 2,-0.2 -2,-0.2 0.789 112.3 47.0 -70.2 -35.1 41.8 32.0 64.9 48 52 A L H ><>S+ 0 0 2 -4,-1.5 5,-1.8 2,-0.2 3,-0.6 0.870 110.2 54.5 -73.7 -39.2 44.5 34.7 65.8 49 53 A G H ><5S+ 0 0 5 -4,-1.7 3,-0.9 70,-0.3 -2,-0.2 0.827 103.3 54.2 -63.2 -35.7 45.5 32.7 68.9 50 54 A A T 3<5S+ 0 0 93 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.680 105.6 55.0 -73.3 -18.6 46.3 29.5 66.9 51 55 A A T < 5S- 0 0 34 -3,-0.6 -1,-0.2 -4,-0.4 -2,-0.2 0.492 120.0-109.9 -89.5 -5.9 48.5 31.5 64.6 52 56 A G T X 5S+ 0 0 28 -3,-0.9 3,-1.2 -4,-0.3 -3,-0.2 0.359 82.8 124.2 94.6 -2.6 50.6 32.8 67.6 53 57 A L T 3 < + 0 0 4 -5,-1.8 3,-0.2 1,-0.3 -4,-0.2 0.565 62.9 60.3 -74.4 -10.1 49.4 36.4 67.3 54 58 A L T 3 S+ 0 0 8 -6,-0.3 -1,-0.3 -5,-0.2 65,-0.1 0.282 113.5 32.0 -99.6 10.0 48.0 36.8 70.9 55 59 A S S X S+ 0 0 8 -3,-1.2 10,-1.8 63,-0.1 3,-0.7 0.182 73.0 131.4-151.6 24.3 51.3 36.1 72.7 56 60 A L T 3 S+ 0 0 9 1,-0.2 11,-2.3 8,-0.2 -2,-0.1 0.852 71.9 45.0 -50.8 -50.4 54.1 37.4 70.6 57 61 A P T 3 S+ 0 0 24 0, 0.0 -1,-0.2 0, 0.0 12,-0.1 0.689 91.6 94.7 -79.0 -16.9 56.1 39.5 73.1 58 62 A Q S < S- 0 0 15 -3,-0.7 8,-2.7 1,-0.1 9,-0.2 -0.304 85.4 -84.2 -79.0 157.0 56.3 37.1 76.0 59 63 A P > > - 0 0 52 0, 0.0 5,-2.2 0, 0.0 3,-1.4 -0.245 27.2-132.3 -64.0 142.1 59.1 34.6 76.8 60 64 A E G > 5S+ 0 0 148 1,-0.3 3,-2.0 3,-0.2 -2,-0.1 0.790 100.7 72.2 -62.2 -30.7 59.1 31.2 75.1 61 65 A E G 3 5S+ 0 0 158 1,-0.3 -1,-0.3 2,-0.1 -3,-0.0 0.650 107.4 38.2 -61.9 -15.0 59.8 29.3 78.4 62 66 A W G < 5S- 0 0 57 -3,-1.4 -1,-0.3 51,-0.1 55,-0.3 0.283 132.6 -88.4-113.6 4.6 56.2 30.2 79.3 63 67 A G T < 5S+ 0 0 46 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.441 84.7 125.8 101.4 0.7 54.7 29.7 75.8 64 68 A G < - 0 0 10 -5,-2.2 -1,-0.2 1,-0.1 -8,-0.2 -0.197 69.6-112.2 -78.4-180.0 55.1 33.2 74.1 65 69 A G - 0 0 30 -10,-1.8 -9,-0.2 -13,-0.2 -5,-0.1 0.474 38.0-130.6 -93.1 -3.2 56.8 33.9 70.8 66 70 A G + 0 0 38 -8,-2.7 -10,-0.1 -11,-0.4 -8,-0.1 0.516 48.1 161.4 68.6 9.1 59.7 35.8 72.3 67 71 A Q - 0 0 59 -11,-2.3 -1,-0.2 -9,-0.2 2,-0.1 -0.250 38.3-122.2 -68.8 141.0 59.4 38.7 70.0 68 72 A P >> - 0 0 50 0, 0.0 4,-2.9 0, 0.0 3,-1.4 -0.417 28.5-110.4 -71.4 160.6 61.0 42.2 70.6 69 73 A Y H 3> S+ 0 0 18 228,-0.3 4,-2.7 1,-0.3 5,-0.4 0.841 115.1 69.0 -60.2 -35.8 58.7 45.2 70.7 70 74 A E H 34 S+ 0 0 46 227,-0.2 -1,-0.3 1,-0.2 4,-0.2 0.738 114.8 29.2 -54.3 -25.9 60.1 46.5 67.4 71 75 A V H <> S+ 0 0 2 -3,-1.4 4,-1.6 2,-0.1 3,-0.4 0.819 118.6 53.7-100.5 -48.9 58.4 43.5 65.8 72 76 A Y H >X S+ 0 0 6 -4,-2.9 4,-2.0 1,-0.2 3,-0.5 0.921 108.6 50.2 -50.2 -49.7 55.4 43.0 68.1 73 77 A L H 3X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.812 108.0 52.2 -63.1 -33.5 54.2 46.6 67.8 74 78 A Q H 3> S+ 0 0 2 -3,-0.4 4,-1.4 -5,-0.4 -1,-0.2 0.743 107.5 52.3 -77.1 -26.0 54.3 46.6 64.0 75 79 A V H X S+ 0 0 3 -4,-2.3 3,-2.6 1,-0.2 4,-2.1 0.954 107.2 54.8 -52.7 -53.9 45.9 44.4 62.6 80 84 A A H 3< S+ 0 0 3 -4,-2.4 4,-0.3 1,-0.3 -1,-0.2 0.691 96.8 66.4 -60.3 -24.0 44.6 47.9 63.6 81 85 A A T 3< S+ 0 0 22 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.659 112.3 33.2 -69.4 -17.8 44.5 48.9 59.9 82 86 A R T <4 S+ 0 0 20 -3,-2.6 2,-0.3 -4,-0.4 -2,-0.2 0.797 138.4 6.2 -99.6 -45.5 41.8 46.3 59.3 83 87 A W X - 0 0 0 -4,-2.1 4,-1.7 1,-0.1 3,-0.4 -0.753 56.0-173.0-147.7 96.9 39.8 46.4 62.7 84 88 A A H > S+ 0 0 1 -2,-0.3 4,-2.3 -4,-0.3 5,-0.2 0.872 87.1 54.4 -60.3 -45.1 40.6 48.9 65.4 85 89 A S H > S+ 0 0 4 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.878 109.0 49.1 -57.5 -38.3 38.3 47.5 68.1 86 90 A V H > S+ 0 0 0 -3,-0.4 4,-1.6 2,-0.2 -1,-0.2 0.878 109.9 50.2 -68.0 -39.3 40.0 44.0 67.7 87 91 A A H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.886 105.1 56.6 -72.4 -38.5 43.5 45.4 68.0 88 92 A V H X S+ 0 0 6 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.957 108.0 50.0 -50.0 -48.8 42.7 47.3 71.1 89 93 A A H X S+ 0 0 1 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.834 106.9 53.6 -63.2 -34.5 41.5 44.0 72.6 90 94 A V H X S+ 0 0 4 -4,-1.6 4,-1.4 2,-0.2 -1,-0.2 0.936 109.1 49.7 -62.8 -43.4 44.8 42.3 71.6 91 95 A S H X S+ 0 0 4 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.889 108.4 51.9 -61.0 -44.4 46.7 45.1 73.4 92 96 A V H X S+ 0 0 17 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.887 102.7 59.9 -60.6 -38.7 44.6 44.6 76.6 93 97 A H H X S+ 0 0 4 -4,-1.8 4,-1.2 1,-0.2 -1,-0.2 0.888 104.4 50.2 -59.0 -41.5 45.3 40.9 76.6 94 98 A S H < S+ 0 0 9 -4,-1.4 4,-0.5 1,-0.2 3,-0.4 0.915 111.7 47.1 -59.6 -50.6 49.1 41.6 76.8 95 99 A L H >< S+ 0 0 12 -4,-1.7 3,-1.1 1,-0.2 -2,-0.2 0.848 105.0 62.2 -58.2 -36.4 48.6 44.0 79.7 96 100 A S H 3< S+ 0 0 1 -4,-2.5 4,-0.3 1,-0.3 -1,-0.2 0.838 106.2 43.8 -65.3 -30.3 46.3 41.4 81.5 97 101 A S T 3X S+ 0 0 2 -4,-1.2 4,-1.7 -3,-0.4 -1,-0.3 0.555 93.4 89.1 -86.5 -3.7 49.1 38.9 81.8 98 102 A H H <> S+ 0 0 30 -3,-1.1 4,-1.8 -4,-0.5 5,-0.3 0.869 79.7 51.9 -69.9 -44.4 51.7 41.5 82.9 99 103 A P H > S+ 0 0 2 0, 0.0 4,-1.9 0, 0.0 5,-0.4 0.875 112.9 46.2 -58.2 -38.9 51.3 41.5 86.8 100 104 A L H > S+ 0 0 5 -4,-0.3 4,-1.5 3,-0.2 -2,-0.2 0.924 112.0 51.3 -70.3 -42.4 51.6 37.7 87.0 101 105 A L H < S+ 0 0 41 -4,-1.7 -1,-0.2 1,-0.2 -3,-0.1 0.822 122.1 28.6 -64.3 -36.4 54.7 37.5 84.7 102 106 A V H < S+ 0 0 84 -4,-1.8 -1,-0.2 1,-0.0 -2,-0.2 0.747 133.4 25.8 -99.3 -24.8 56.7 40.2 86.5 103 107 A F H < S+ 0 0 43 -4,-1.9 122,-0.2 -5,-0.3 -3,-0.2 0.619 93.6 100.2-118.3 -15.2 55.5 39.9 90.2 104 108 A G S < S- 0 0 15 -4,-1.5 2,-0.2 -5,-0.4 120,-0.1 -0.115 72.7 -97.5 -76.1 169.4 54.2 36.4 90.8 105 109 A T > - 0 0 76 1,-0.1 4,-2.6 120,-0.1 3,-0.4 -0.515 32.4-115.5 -77.2 151.2 55.7 33.4 92.5 106 110 A E H > S+ 0 0 76 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.875 121.4 54.2 -56.3 -37.4 57.3 30.6 90.4 107 111 A E H > S+ 0 0 76 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.859 107.9 48.7 -62.1 -39.4 54.5 28.4 91.7 108 112 A Q H > S+ 0 0 22 -3,-0.4 4,-1.8 2,-0.2 5,-0.4 0.917 110.4 50.8 -67.5 -44.8 51.9 30.9 90.6 109 113 A K H X S+ 0 0 45 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.920 106.9 54.5 -56.9 -47.8 53.4 31.2 87.1 110 114 A K H < S+ 0 0 66 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.876 109.5 48.5 -55.3 -44.3 53.5 27.4 86.7 111 115 A R H < S+ 0 0 165 -4,-1.5 4,-0.2 -5,-0.1 -1,-0.2 0.961 129.0 8.8 -56.4 -56.5 49.7 27.2 87.4 112 116 A W H X S+ 0 0 46 -4,-1.8 4,-1.5 2,-0.1 3,-0.4 0.738 103.2 77.7-112.4 -30.3 48.3 29.8 85.1 113 117 A L H X S+ 0 0 1 -4,-1.8 4,-1.9 -5,-0.4 5,-0.2 0.874 91.2 55.9 -59.3 -43.9 50.7 31.4 82.6 114 118 A P H 4 S+ 0 0 61 0, 0.0 -1,-0.2 0, 0.0 4,-0.2 0.868 108.5 48.6 -62.1 -35.8 50.8 28.6 80.0 115 119 A G H >4 S+ 0 0 23 -3,-0.4 3,-0.8 -4,-0.2 6,-0.5 0.848 108.7 53.8 -67.2 -37.0 47.0 28.7 79.6 116 120 A M H >< S+ 0 0 4 -4,-1.5 3,-0.5 1,-0.2 5,-0.3 0.907 114.5 40.3 -62.6 -39.2 46.9 32.5 79.2 117 121 A L T 3< S+ 0 0 4 -4,-1.9 -1,-0.2 -55,-0.3 -2,-0.2 0.334 89.5 95.8 -94.8 9.0 49.5 32.4 76.3 118 122 A S T < S- 0 0 72 -3,-0.8 -1,-0.2 -4,-0.2 -2,-0.1 0.735 94.7-117.1 -73.9 -27.4 48.1 29.3 74.7 119 123 A G S < S+ 0 0 7 -3,-0.5 -70,-0.3 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-4,-2.3 4,-0.6 1,-0.2 3,-0.3 0.825 102.9 59.0 -69.6 -30.7 37.1 55.6 66.3 350 360 A A H >X S+ 0 0 0 -4,-1.6 4,-0.8 1,-0.2 3,-0.5 0.825 90.8 68.8 -73.1 -31.6 40.0 58.0 66.7 351 361 A K H >< S+ 0 0 0 -4,-0.8 3,-0.8 -3,-0.2 4,-0.3 0.871 96.6 51.1 -55.5 -44.5 38.4 60.3 69.3 352 362 A I H >X S+ 0 0 15 -4,-0.6 4,-2.5 -3,-0.3 3,-1.5 0.786 98.6 67.7 -69.5 -25.8 38.4 57.8 72.2 353 363 A M H << S+ 0 0 0 -4,-0.6 -1,-0.2 -3,-0.5 -2,-0.2 0.847 94.4 56.2 -61.8 -33.6 42.2 57.1 71.6 354 364 A Q T << S+ 0 0 17 -4,-0.8 6,-1.9 -3,-0.8 -1,-0.3 0.654 115.6 41.8 -66.0 -14.0 42.9 60.7 72.8 355 365 A I T <4 S+ 0 0 11 -3,-1.5 3,-0.4 -4,-0.3 -2,-0.2 0.860 99.4 64.8-108.3 -51.7 41.1 59.7 76.0 356 366 A F S < S+ 0 0 50 -4,-2.5 347,-0.0 1,-0.2 -111,-0.0 -0.268 89.9 38.1 -81.6 168.7 41.9 56.2 77.2 357 367 A E S S- 0 0 57 2,-0.0 -1,-0.2 -112,-0.0 -112,-0.0 0.826 143.1 -29.8 63.8 33.3 45.3 54.8 78.5 358 368 A G S S- 0 0 24 -3,-0.4 -2,-0.1 4,-0.0 5,-0.1 0.632 85.9-101.8 90.2 113.7 45.8 58.2 80.2 359 369 A T > - 0 0 19 1,-0.1 4,-2.3 3,-0.1 -4,-0.2 -0.105 33.9-105.4 -58.5 157.7 44.2 61.3 78.5 360 370 A N H > S+ 0 0 1 -6,-1.9 4,-1.5 1,-0.2 -1,-0.1 0.712 122.4 57.8 -61.7 -16.6 46.4 63.5 76.4 361 371 A Q H > S+ 0 0 46 2,-0.2 4,-1.5 1,-0.1 -1,-0.2 0.904 107.0 47.2 -76.5 -41.9 46.3 66.1 79.3 362 372 A I H > S+ 0 0 38 2,-0.2 4,-3.0 -3,-0.2 -2,-0.2 0.912 108.7 56.2 -60.2 -43.4 47.7 63.5 81.8 363 373 A Q H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.939 107.9 47.6 -52.0 -51.2 50.4 62.7 79.1 364 374 A R H X S+ 0 0 118 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.824 110.7 51.9 -58.0 -35.1 51.5 66.3 79.0 365 375 A L H X S+ 0 0 83 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.927 109.2 49.9 -71.9 -42.3 51.6 66.4 82.9 366 376 A V H X S+ 0 0 37 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.959 111.7 48.6 -56.0 -51.3 53.8 63.3 82.9 367 377 A I H < S+ 0 0 30 -4,-2.4 4,-0.4 1,-0.2 -2,-0.2 0.889 109.8 51.0 -57.6 -46.4 56.2 64.8 80.4 368 378 A A H >< S+ 0 0 48 -4,-2.2 3,-1.2 1,-0.2 -1,-0.2 0.895 107.8 53.2 -60.9 -40.0 56.5 68.2 82.3 369 379 A R H >< S+ 0 0 157 -4,-2.0 3,-2.2 1,-0.3 -2,-0.2 0.907 102.6 58.1 -60.3 -43.0 57.3 66.3 85.6 370 380 A G T 3< S+ 0 0 51 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.555 105.0 52.8 -62.0 -11.2 60.1 64.5 83.8 371 381 A L T < 0 0 139 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.314 360.0 360.0 -99.5 0.4 61.5 68.0 83.0 372 382 A T < 0 0 161 -3,-2.2 -2,-0.2 -4,-0.1 -3,-0.1 0.924 360.0 360.0 -96.0 360.0 61.4 69.0 86.7 373 !* 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 0.0 374 5 B M 0 0 146 0, 0.0 3,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -20.4 24.4 82.4 81.0 375 6 B A - 0 0 65 1,-0.1 2,-0.0 3,-0.0 3,-0.0 -0.414 360.0 -81.5 -70.1 153.5 22.8 83.3 77.7 376 7 B V - 0 0 31 1,-0.1 2,-0.8 -2,-0.1 -1,-0.1 -0.316 35.9-128.5 -58.8 134.0 25.0 85.2 75.2 377 8 B D - 0 0 163 -3,-0.1 2,-0.3 -2,-0.0 -1,-0.1 -0.774 38.5-157.6 -81.8 108.9 25.3 89.0 75.7 378 9 B R - 0 0 29 -2,-0.8 2,-0.8 8,-0.0 8,-0.0 -0.675 21.9-131.9-102.2 146.2 24.5 90.3 72.3 379 10 B L + 0 0 148 -2,-0.3 -2,-0.0 2,-0.0 -1,-0.0 -0.845 40.8 173.9 -87.5 109.1 25.2 93.5 70.4 380 11 B L - 0 0 52 -2,-0.8 64,-0.1 1,-0.1 6,-0.0 -0.910 38.2-138.7-125.5 146.1 21.9 94.6 68.9 381 12 B P S S+ 0 0 73 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.708 79.2 8.6 -72.7 -23.6 20.6 97.7 67.0 382 13 B S > - 0 0 62 1,-0.1 4,-1.5 0, 0.0 5,-0.1 -0.954 67.9-106.1-153.6 168.8 17.2 98.2 68.8 383 14 B Q H > S+ 0 0 88 -2,-0.3 4,-1.9 1,-0.2 5,-0.2 0.872 118.2 55.0 -60.5 -44.8 14.7 97.3 71.6 384 15 B E H > S+ 0 0 71 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.781 105.2 53.3 -62.9 -30.5 12.5 95.4 69.1 385 16 B A H > S+ 0 0 1 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.882 106.2 51.8 -72.8 -39.2 15.5 93.3 68.1 386 17 B A H X S+ 0 0 52 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.911 110.1 50.2 -60.9 -41.6 16.2 92.3 71.8 387 18 B E H X S+ 0 0 67 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.750 107.0 54.0 -70.4 -26.4 12.5 91.2 72.1 388 19 B L H X S+ 0 0 24 -4,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.897 107.7 51.4 -69.6 -39.8 12.8 89.2 68.9 389 20 B I H X S+ 0 0 5 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.955 109.2 48.8 -62.2 -48.7 15.8 87.4 70.4 390 21 B E H X S+ 0 0 59 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.850 110.4 53.0 -60.5 -35.2 13.8 86.6 73.6 391 22 B L H X S+ 0 0 77 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.887 108.1 49.0 -65.1 -45.4 10.9 85.3 71.5 392 23 B T H X S+ 0 0 1 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.923 111.1 50.8 -57.7 -45.3 13.2 82.9 69.5 393 24 B R H X S+ 0 0 60 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.803 110.4 49.6 -64.7 -32.2 14.7 81.6 72.8 394 25 B E H X S+ 0 0 61 -4,-1.5 4,-0.9 -5,-0.2 -1,-0.2 0.927 114.6 42.8 -75.6 -45.0 11.2 81.0 74.2 395 26 B I H X>S+ 0 0 25 -4,-2.3 4,-2.4 1,-0.2 5,-0.6 0.869 113.9 51.7 -66.3 -36.8 10.0 79.1 71.2 396 27 B A H X>S+ 0 0 1 -4,-2.6 5,-2.3 1,-0.2 4,-1.4 0.888 107.5 52.3 -71.4 -34.4 13.2 77.1 70.8 397 28 B D H <5S+ 0 0 83 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.723 120.6 31.1 -77.6 -19.5 13.2 75.9 74.4 398 29 B K H <5S+ 0 0 154 -4,-0.9 -2,-0.2 -3,-0.3 -1,-0.2 0.689 129.4 33.5-108.8 -22.8 9.6 74.5 74.3 399 30 B V H <5S+ 0 0 13 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.748 130.9 24.0 -99.1 -32.5 9.2 73.4 70.6 400 31 B L T >X S+ 0 0 40 -3,-1.5 4,-2.0 2,-0.1 5,-0.2 0.564 90.2 90.8-120.3 -12.0 12.3 66.5 71.1 404 35 B V H X S+ 0 0 0 -4,-1.5 4,-1.8 1,-0.2 5,-0.2 0.854 86.9 49.2 -57.5 -46.1 15.7 66.9 69.4 405 36 B D H > S+ 0 0 68 -4,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.925 112.6 48.3 -66.1 -41.9 17.6 63.9 70.9 406 37 B R H > S+ 0 0 141 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.947 113.6 44.9 -61.0 -50.1 14.8 61.4 70.2 407 38 B H H X>S+ 0 0 20 -4,-2.0 5,-1.4 1,-0.2 4,-0.8 0.821 113.8 49.4 -65.7 -33.7 14.3 62.5 66.5 408 39 B E H <5S+ 0 0 7 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.878 111.5 49.6 -74.1 -37.4 18.0 62.5 65.7 409 40 B K H <5S+ 0 0 131 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.890 119.9 35.8 -64.0 -42.3 18.5 59.1 67.3 410 41 B D H <5S- 0 0 97 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.488 103.4-129.6 -90.0 -11.1 15.6 57.5 65.3 411 42 B E T <5 + 0 0 83 -4,-0.8 2,-0.2 -5,-0.2 -3,-0.2 0.811 55.9 150.8 62.8 34.4 16.3 59.6 62.1 412 43 B T < - 0 0 57 -5,-1.4 -1,-0.2 -6,-0.2 -2,-0.1 -0.630 48.5-104.6-101.5 156.3 12.6 60.7 62.0 413 44 B Y - 0 0 44 -2,-0.2 2,-1.9 1,-0.1 158,-0.1 -0.582 21.9-128.8 -85.3 132.4 11.0 63.9 60.6 414 45 B P > - 0 0 2 0, 0.0 3,-2.1 0, 0.0 4,-0.5 -0.470 31.1-161.5 -75.5 73.5 9.7 66.7 63.0 415 46 B E T 3 S+ 0 0 152 -2,-1.9 0, 0.0 1,-0.3 0, 0.0 -0.320 73.1 15.3 -62.1 133.9 6.1 67.1 61.5 416 47 B G T 3> S+ 0 0 30 1,-0.0 4,-1.4 4,-0.0 -1,-0.3 0.238 94.4 105.2 88.3 -12.6 4.6 70.4 62.5 417 48 B V H <> S+ 0 0 5 -3,-2.1 4,-1.7 1,-0.2 5,-0.2 0.918 80.2 49.4 -68.2 -41.2 7.8 72.0 63.8 418 49 B F H > S+ 0 0 14 -4,-0.5 4,-2.9 1,-0.2 -1,-0.2 0.870 105.8 57.3 -67.9 -33.1 8.1 74.3 60.7 419 50 B E H > S+ 0 0 60 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.906 107.8 48.1 -60.3 -41.0 4.5 75.5 61.0 420 51 B Q H X S+ 0 0 97 -4,-1.4 4,-0.8 2,-0.2 -1,-0.2 0.845 113.3 46.0 -71.8 -34.6 5.1 76.7 64.6 421 52 B L H ><>S+ 0 0 2 -4,-1.7 5,-1.9 2,-0.2 3,-0.6 0.922 113.1 52.7 -69.0 -43.6 8.3 78.5 63.6 422 53 B G H ><5S+ 0 0 4 -4,-2.9 3,-1.6 70,-0.3 5,-0.3 0.867 103.8 54.5 -54.3 -44.1 6.4 80.0 60.7 423 54 B A H 3<5S+ 0 0 94 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.713 104.4 54.8 -69.7 -23.6 3.5 81.3 62.7 424 55 B A T <<5S- 0 0 33 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.346 119.5-110.5 -89.4 5.4 5.8 83.3 65.0 425 56 B G T X 5S+ 0 0 29 -3,-1.6 3,-0.8 66,-0.1 -3,-0.2 0.537 82.1 124.9 82.4 10.7 7.3 85.0 61.9 426 57 B L T 3 < + 0 0 4 -5,-1.9 3,-0.3 1,-0.2 -4,-0.2 0.528 61.2 62.7 -87.0 -5.6 10.7 83.3 62.1 427 58 B L T 3 S+ 0 0 5 -6,-0.3 -1,-0.2 -5,-0.3 65,-0.1 0.465 111.6 33.0 -95.7 -2.6 10.8 81.8 58.5 428 59 B S S < S+ 0 0 9 -3,-0.8 10,-2.2 -6,-0.1 11,-0.4 -0.086 73.3 133.6-144.7 39.1 10.7 85.1 56.7 429 60 B L S S+ 0 0 10 -3,-0.3 11,-2.5 8,-0.2 -2,-0.1 0.881 74.3 38.8 -65.6 -44.3 12.6 87.5 58.8 430 61 B P S S+ 0 0 26 0, 0.0 -1,-0.2 0, 0.0 12,-0.1 0.602 91.7 98.4 -88.8 -9.6 14.9 89.2 56.2 431 62 B Q S S- 0 0 15 -3,-0.2 8,-2.6 1,-0.1 9,-0.2 -0.410 88.0 -82.3 -74.2 151.1 12.5 89.5 53.2 432 63 B P > > - 0 0 50 0, 0.0 5,-1.9 0, 0.0 3,-1.5 -0.219 28.7-131.0 -62.1 142.3 10.7 92.9 52.5 433 64 B E G > 5S+ 0 0 70 1,-0.3 3,-2.0 3,-0.2 -2,-0.1 0.812 103.7 68.6 -60.1 -35.9 7.5 93.7 54.5 434 65 B E G 3 5S+ 0 0 147 1,-0.3 -1,-0.3 2,-0.1 -3,-0.0 0.783 104.7 43.3 -52.7 -30.6 5.6 94.6 51.3 435 66 B W G < 5S- 0 0 28 -3,-1.5 -1,-0.3 51,-0.1 55,-0.2 0.315 133.7 -89.3-100.5 7.0 5.8 90.9 50.3 436 67 B G T < 5S+ 0 0 51 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.1 0.481 88.5 122.1 98.8 5.9 4.9 89.7 53.8 437 68 B G S > - 0 0 48 0, 0.0 4,-2.7 0, 0.0 3,-1.5 -0.354 24.4-113.3 -67.8 158.1 18.7 93.4 58.7 442 73 B Y H 3> S+ 0 0 23 1,-0.3 4,-2.7 225,-0.2 5,-0.4 0.846 115.3 68.0 -56.8 -34.2 21.2 90.5 58.5 443 74 B E H 34 S+ 0 0 40 224,-0.3 -1,-0.3 1,-0.2 4,-0.2 0.745 113.2 31.0 -57.4 -23.5 22.9 91.7 61.7 444 75 B V H <> S+ 0 0 1 -3,-1.5 4,-1.2 2,-0.1 3,-0.3 0.833 118.7 51.7-101.6 -49.1 19.6 90.7 63.5 445 76 B Y H X S+ 0 0 7 -4,-2.7 4,-2.2 1,-0.2 3,-0.4 0.881 106.2 55.0 -52.3 -47.6 18.5 87.7 61.4 446 77 B L H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.874 106.6 52.0 -57.8 -35.6 21.9 85.9 61.6 447 78 B Q H > S+ 0 0 2 -5,-0.4 4,-1.5 -3,-0.3 -1,-0.2 0.805 107.5 51.1 -74.6 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85.1 37.1 598 238 B I H < S+ 0 0 0 -4,-2.0 4,-0.4 2,-0.2 -2,-0.2 0.953 113.1 44.5 -59.5 -52.3 21.2 84.2 39.3 599 239 B A H >< S+ 0 0 16 -4,-2.3 3,-0.8 1,-0.2 4,-0.2 0.826 112.1 51.9 -62.7 -38.2 23.0 81.3 41.1 600 240 B F H >< S+ 0 0 138 -4,-2.0 3,-1.5 1,-0.2 4,-0.4 0.881 100.3 64.2 -67.6 -36.4 26.2 83.3 41.5 601 241 B S T 3< S+ 0 0 43 -4,-1.9 4,-0.2 1,-0.2 -1,-0.2 0.626 101.2 52.0 -61.3 -17.0 24.2 86.2 43.2 602 242 B A T <> S+ 0 0 5 -3,-0.8 4,-1.6 -4,-0.4 -1,-0.2 0.385 82.1 90.3-100.8 -1.3 23.2 83.9 46.1 603 243 B L H <> S+ 0 0 53 -3,-1.5 4,-2.3 -4,-0.2 5,-0.2 0.953 85.6 49.0 -58.3 -54.9 26.7 82.6 47.2 604 244 B D H > S+ 0 0 29 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.884 111.5 49.4 -57.0 -46.9 27.6 85.3 49.7 605 245 B S H > S+ 0 0 13 -4,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.866 110.3 50.3 -62.9 -41.3 24.2 85.0 51.6 606 246 B G H X S+ 0 0 1 -4,-1.6 4,-2.2 2,-0.2 5,-0.2 0.949 109.2 50.5 -59.6 -50.2 24.4 81.2 51.8 607 247 B R H X S+ 0 0 20 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.893 109.5 52.7 -56.3 -40.1 28.0 81.3 53.3 608 248 B L H X S+ 0 0 0 -4,-2.0 4,-1.5 -5,-0.2 -1,-0.2 0.912 106.9 52.7 -61.7 -43.5 26.7 83.9 55.8 609 249 B G H X S+ 0 0 1 -4,-1.9 4,-1.8 2,-0.2 3,-0.3 0.947 111.6 44.1 -53.0 -55.3 23.9 81.5 56.8 610 250 B I H X S+ 0 0 9 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.879 108.0 59.3 -63.9 -41.1 26.2 78.5 57.5 611 251 B A H X S+ 0 0 0 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.882 109.6 44.4 -47.9 -43.5 28.7 80.8 59.4 612 252 B A H X S+ 0 0 0 -4,-1.5 4,-1.6 -3,-0.3 -2,-0.2 0.865 112.6 50.7 -77.7 -35.5 25.9 81.6 61.9 613 253 B V H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.911 111.1 48.1 -64.3 -44.1 24.7 78.0 62.2 614 254 B A H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.901 108.7 55.3 -64.2 -40.6 28.3 76.7 62.9 615 255 B T H X S+ 0 0 1 -4,-1.7 4,-2.2 -5,-0.3 -1,-0.2 0.888 107.2 49.5 -58.7 -41.6 28.7 79.4 65.5 616 256 B G H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.876 111.2 48.5 -67.1 -37.5 25.5 78.3 67.4 617 257 B L H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.902 110.8 50.8 -70.9 -38.9 26.6 74.6 67.5 618 258 B A H X S+ 0 0 2 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.923 109.9 51.3 -59.8 -44.3 30.1 75.7 68.7 619 259 B Q H X S+ 0 0 23 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.898 108.3 51.3 -59.1 -42.4 28.4 77.7 71.5 620 260 B A H X S+ 0 0 9 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.898 110.6 47.8 -62.8 -41.7 26.2 74.7 72.5 621 261 B A H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.877 111.1 51.6 -68.2 -33.7 29.3 72.4 72.8 622 262 B L H X S+ 0 0 15 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.930 106.7 53.3 -70.0 -41.9 31.1 75.1 74.9 623 263 B D H X S+ 0 0 79 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.908 108.7 50.1 -60.5 -44.5 28.1 75.5 77.3 624 264 B E H X S+ 0 0 54 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.931 113.2 45.0 -51.4 -52.2 28.1 71.7 78.0 625 265 B A H X S+ 0 0 0 -4,-1.7 4,-3.0 2,-0.2 -2,-0.2 0.903 111.9 50.8 -66.7 -46.4 31.8 71.5 78.7 626 266 B V H X S+ 0 0 55 -4,-2.5 4,-1.0 2,-0.2 -1,-0.2 0.926 112.6 47.8 -56.4 -45.8 31.9 74.6 80.9 627 267 B A H >< S+ 0 0 66 -4,-2.2 3,-0.6 -5,-0.2 4,-0.3 0.928 114.3 45.9 -61.7 -46.6 29.0 73.1 82.9 628 268 B Y H >X S+ 0 0 38 -4,-2.7 4,-2.2 1,-0.2 3,-1.6 0.898 107.7 55.8 -65.6 -41.7 30.7 69.7 83.3 629 269 B A H 3< S+ 0 0 0 -4,-3.0 11,-2.0 1,-0.3 12,-0.3 0.697 103.4 57.2 -65.8 -20.7 34.1 71.2 84.3 630 270 B N T << S+ 0 0 81 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.431 117.3 31.7 -84.6 -6.5 32.4 73.1 87.2 631 271 B E T <4 S+ 0 0 72 -3,-1.6 -2,-0.2 -4,-0.3 -3,-0.1 0.725 97.8 82.9-113.8 -51.5 31.0 69.8 88.8 632 272 B R < - 0 0 90 -4,-2.2 7,-2.6 6,-0.1 2,-0.3 -0.271 62.8-158.8 -64.2 137.7 33.4 66.9 88.0 633 273 B T E +R 638 0F 82 5,-0.3 2,-0.3 6,-0.1 5,-0.3 -0.896 15.5 174.3-118.6 150.2 36.4 66.6 90.4 634 274 B A E > +R 637 0F 23 3,-2.8 3,-0.9 -2,-0.3 -502,-0.1 -0.974 69.3 7.6-150.9 144.7 39.8 64.9 90.2 635 275 B F T 3 S- 0 0 96 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.870 133.5 -53.7 54.4 39.3 42.9 64.8 92.5 636 276 B G T 3 S+ 0 0 84 1,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.705 121.1 81.4 71.0 23.2 40.8 66.7 95.2 637 277 B R E < S-R 634 0F 132 -3,-0.9 -3,-2.8 5,-0.0 -1,-0.1 -0.991 87.4 -90.2-152.8 150.8 39.6 69.7 93.0 638 278 B K E > -R 633 0F 101 -2,-0.3 3,-1.9 -5,-0.3 4,-0.3 -0.379 44.2-122.9 -51.2 133.4 37.0 70.7 90.4 639 279 B I G > S+ 0 0 22 -7,-2.6 3,-1.3 1,-0.3 6,-0.2 0.779 109.2 64.2 -64.5 -26.2 38.6 70.0 87.0 640 280 B I G 3 S+ 0 0 52 -11,-2.0 -1,-0.3 -8,-0.3 6,-0.2 0.783 95.3 63.8 -61.1 -25.5 38.2 73.6 85.8 641 281 B D G < S+ 0 0 98 -3,-1.9 2,-0.7 -12,-0.3 -1,-0.2 0.588 75.9 94.9 -80.2 -10.6 40.7 74.4 88.6 642 282 B H S X> S- 0 0 56 -3,-1.3 4,-2.1 -4,-0.3 3,-0.7 -0.760 78.4-141.7 -73.2 112.9 43.5 72.4 87.0 643 283 B Q H 3> S+ 0 0 148 -2,-0.7 4,-2.3 1,-0.2 5,-0.2 0.888 96.1 55.9 -51.0 -45.5 45.3 75.2 85.0 644 284 B G H 3> S+ 0 0 57 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.884 111.1 43.8 -50.6 -45.8 46.0 73.0 81.9 645 285 B L H <> S+ 0 0 24 -3,-0.7 4,-2.1 -6,-0.2 -1,-0.2 0.842 109.7 57.2 -68.3 -37.7 42.3 72.1 81.5 646 286 B G H X S+ 0 0 21 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.860 104.8 52.2 -59.1 -40.3 41.4 75.8 82.1 647 287 B F H X S+ 0 0 124 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.901 105.9 52.9 -64.4 -43.8 43.6 76.8 79.2 648 288 B L H X S+ 0 0 29 -4,-1.5 4,-1.9 2,-0.2 3,-0.2 0.951 111.8 46.4 -53.2 -54.1 41.8 74.3 76.8 649 289 B L H X S+ 0 0 11 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.860 109.7 55.2 -56.0 -39.2 38.4 75.8 77.8 650 290 B A H X S+ 0 0 57 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.879 106.2 49.7 -61.9 -43.4 39.9 79.3 77.3 651 291 B D H X S+ 0 0 97 -4,-2.1 4,-1.8 -3,-0.2 -2,-0.2 0.874 110.3 52.0 -61.1 -42.6 41.0 78.5 73.7 652 292 B M H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.924 110.1 47.6 -56.1 -47.1 37.4 77.2 72.9 653 293 B A H X S+ 0 0 45 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.843 110.7 51.2 -68.8 -36.9 35.7 80.4 74.2 654 294 B A H X S+ 0 0 55 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.841 109.2 51.4 -66.0 -38.8 38.1 82.6 72.2 655 295 B A H X S+ 0 0 20 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.884 109.3 49.8 -67.3 -40.3 37.3 80.6 69.1 656 296 B V H X S+ 0 0 2 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.923 113.3 46.1 -61.5 -42.4 33.5 81.0 69.6 657 297 B A H X S+ 0 0 54 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.867 111.2 51.6 -73.3 -37.9 33.7 84.8 70.1 658 298 B T H X S+ 0 0 78 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.879 109.9 49.9 -61.4 -42.8 36.1 85.3 67.1 659 299 B A H X S+ 0 0 3 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.896 111.7 47.7 -64.6 -39.0 33.6 83.4 64.8 660 300 B R H X S+ 0 0 33 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.951 111.6 50.6 -69.5 -45.4 30.7 85.5 66.1 661 301 B A H X S+ 0 0 64 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.862 109.4 52.0 -52.1 -42.5 32.6 88.8 65.6 662 302 B T H X S+ 0 0 39 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.911 108.8 47.0 -69.0 -45.5 33.6 87.8 62.0 663 303 B Y H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.873 111.5 51.8 -67.1 -32.2 30.1 87.0 60.7 664 304 B L H X S+ 0 0 25 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.867 105.0 56.2 -71.4 -33.9 28.6 90.2 62.1 665 305 B D H X S+ 0 0 65 -4,-1.6 4,-1.2 2,-0.2 -2,-0.2 0.922 111.5 42.8 -62.0 -46.8 31.3 92.3 60.5 666 306 B A H X S+ 0 0 0 -4,-1.7 4,-2.1 13,-0.2 3,-0.5 0.930 113.4 53.5 -58.9 -46.2 30.4 90.9 57.0 667 307 B A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -224,-0.3 0.899 104.9 54.5 -54.1 -42.2 26.6 91.2 57.9 668 308 B R H X S+ 0 0 134 -4,-2.4 4,-0.6 1,-0.2 -1,-0.2 0.805 107.3 50.5 -70.5 -29.2 27.1 94.9 58.8 669 309 B R H ><>S+ 0 0 76 -4,-1.2 5,-2.4 -3,-0.5 3,-0.7 0.914 109.1 50.7 -68.3 -47.2 28.6 95.5 55.3 670 310 B R H ><5S+ 0 0 87 -4,-2.1 3,-1.4 1,-0.2 -2,-0.2 0.874 105.5 56.7 -59.4 -38.7 25.7 93.8 53.5 671 311 B D H 3<5S+ 0 0 60 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.748 107.6 48.9 -65.2 -25.0 23.2 96.0 55.5 672 312 B Q T <<5S- 0 0 117 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.329 117.6-109.3 -95.9 7.0 24.9 99.2 54.2 673 313 B G T < 5S+ 0 0 73 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.751 74.6 137.8 67.2 26.9 24.9 98.1 50.5 674 314 B R < - 0 0 135 -5,-2.4 -1,-0.2 -6,-0.1 -2,-0.1 -0.664 64.5 -89.1 -98.4 155.7 28.8 97.6 50.6 675 315 B P + 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.377 48.1 163.8 -64.6 143.3 30.7 94.7 49.0 676 316 B Y > + 0 0 25 -7,-0.1 4,-1.5 2,-0.1 5,-0.1 0.190 35.9 113.3-150.1 12.5 31.1 91.8 51.5 677 317 B S H > S+ 0 0 46 2,-0.2 4,-1.3 1,-0.2 3,-0.2 0.903 82.5 40.7 -60.2 -52.9 32.1 88.9 49.2 678 318 B Q H > S+ 0 0 54 1,-0.2 4,-2.1 2,-0.2 3,-0.3 0.926 116.1 53.8 -60.6 -43.1 35.7 88.4 50.5 679 319 B Q H > S+ 0 0 58 1,-0.2 4,-1.5 2,-0.2 -13,-0.2 0.756 105.8 51.1 -66.4 -27.2 34.4 88.9 54.1 680 320 B A H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.805 108.5 50.8 -81.5 -34.7 31.7 86.3 53.8 681 321 B S H X S+ 0 0 0 -4,-1.3 4,-2.4 -3,-0.3 -2,-0.2 0.909 110.9 49.8 -65.2 -45.1 34.1 83.6 52.6 682 322 B I H X S+ 0 0 68 -4,-2.1 4,-3.1 1,-0.2 5,-0.2 0.909 110.9 50.9 -58.1 -40.8 36.4 84.4 55.5 683 323 B A H X S+ 0 0 2 -4,-1.5 4,-2.3 2,-0.2 5,-0.2 0.898 110.6 45.9 -68.3 -46.2 33.5 84.1 57.9 684 324 B K H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 5,-0.3 0.917 116.3 47.8 -58.3 -46.9 32.3 80.7 56.7 685 325 B L H X S+ 0 0 25 -4,-2.4 4,-1.8 1,-0.2 5,-0.2 0.965 115.1 43.9 -59.8 -55.2 35.9 79.5 56.7 686 326 B T H X S+ 0 0 45 -4,-3.1 4,-1.8 1,-0.2 -2,-0.2 0.883 115.5 47.0 -55.4 -48.2 36.6 80.8 60.3 687 327 B A H X S+ 0 0 0 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.854 112.4 46.6 -69.5 -37.7 33.3 79.6 61.8 688 328 B T H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 36,-0.2 0.867 112.5 49.5 -79.9 -33.8 33.3 76.1 60.5 689 329 B D H X S+ 0 0 53 -4,-1.8 4,-1.9 -5,-0.3 -2,-0.2 0.874 111.5 52.7 -63.4 -40.0 37.0 75.4 61.4 690 330 B A H X S+ 0 0 10 -4,-1.8 4,-2.7 -5,-0.2 -2,-0.2 0.891 107.2 50.2 -59.9 -45.4 36.1 76.8 64.9 691 331 B A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 5,-0.3 0.905 109.6 50.2 -63.5 -41.9 33.1 74.4 65.3 692 332 B M H X S+ 0 0 9 -4,-1.7 4,-1.6 28,-0.2 -2,-0.2 0.918 115.6 43.4 -63.8 -43.5 35.2 71.3 64.4 693 333 B K H X S+ 0 0 91 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.899 115.2 47.7 -66.0 -45.6 37.9 72.3 66.9 694 334 B V H X S+ 0 0 0 -4,-2.7 4,-1.7 2,-0.2 -2,-0.2 0.893 113.6 46.3 -67.0 -39.1 35.5 73.3 69.8 695 335 B T H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 22,-0.2 0.873 111.5 51.5 -73.6 -37.7 33.3 70.1 69.5 696 336 B T H X S+ 0 0 13 -4,-1.6 4,-1.3 -5,-0.3 -1,-0.2 0.894 113.8 45.9 -62.1 -40.8 36.4 67.8 69.3 697 337 B D H X S+ 0 0 27 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.757 104.6 60.5 -73.2 -28.2 37.7 69.6 72.5 698 338 B A H X S+ 0 0 0 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.914 103.9 50.3 -67.9 -41.3 34.3 69.4 74.3 699 339 B V H X S+ 0 0 0 -4,-1.6 4,-1.1 14,-0.2 7,-0.3 0.939 108.9 53.5 -55.2 -49.3 34.3 65.5 74.2 700 340 B Q H >< S+ 0 0 9 -4,-1.3 3,-0.7 1,-0.2 -2,-0.2 0.896 104.4 54.4 -51.2 -46.8 37.9 65.7 75.6 701 341 B V H 3< S+ 0 0 7 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.892 108.6 50.5 -56.8 -39.4 36.7 67.9 78.6 702 342 B F H >< S- 0 0 8 -4,-1.6 3,-0.6 -3,-0.2 -1,-0.2 0.687 93.4-161.2 -70.2 -23.4 34.1 65.2 79.4 703 343 B G G XX - 0 0 16 -4,-1.1 3,-1.3 -3,-0.7 4,-0.6 -0.423 61.5 -10.4 67.6-149.8 36.5 62.2 79.4 704 344 B G G >4 S+ 0 0 23 1,-0.3 3,-1.2 2,-0.2 -1,-0.2 0.826 135.5 55.4 -50.1 -43.3 35.1 58.6 79.0 705 345 B V G X4 S+ 0 0 37 -3,-0.6 3,-1.6 1,-0.2 5,-0.3 0.768 97.2 65.8 -61.6 -28.8 31.4 59.7 79.5 706 346 B G G <4 S+ 0 0 0 -3,-1.3 -1,-0.2 -7,-0.3 8,-0.2 0.743 94.8 59.0 -66.5 -21.9 31.8 62.2 76.6 707 347 B Y G << S+ 0 0 3 -3,-1.2 -506,-2.2 -4,-0.6 -505,-0.3 0.400 97.5 79.1 -85.7 3.0 32.3 59.2 74.3 708 348 B T B X S-I 200 0C 2 -3,-1.6 3,-0.9 -508,-0.2 6,-0.4 -0.658 86.4-118.4-108.3 164.5 28.8 57.8 75.2 709 349 B R T 3 S+ 0 0 72 -510,-2.0 -509,-0.1 1,-0.2 -3,-0.1 0.180 96.5 90.7 -90.1 18.5 25.3 58.7 74.1 710 350 B D T 3 S+ 0 0 110 -5,-0.3 2,-0.3 -511,-0.2 -1,-0.2 0.554 93.6 44.2 -79.5 -12.0 24.3 59.7 77.6 711 351 B Y S < S- 0 0 88 -3,-0.9 4,-0.3 -6,-0.3 3,-0.3 -0.866 81.1-128.3-128.8 164.4 25.5 63.2 76.7 712 352 B R S > S+ 0 0 47 -2,-0.3 4,-2.0 1,-0.2 3,-0.4 0.636 86.7 86.9 -87.2 -16.4 25.1 65.4 73.6 713 353 B V H > S+ 0 0 1 1,-0.2 4,-1.7 2,-0.2 -14,-0.2 0.813 85.1 55.4 -61.4 -30.5 28.7 66.3 72.9 714 354 B E H > S+ 0 0 11 -6,-0.4 4,-1.7 -3,-0.3 -1,-0.2 0.923 109.1 48.9 -65.7 -42.7 29.4 63.1 70.7 715 355 B R H > S+ 0 0 14 -3,-0.4 4,-2.3 -4,-0.3 -2,-0.2 0.917 108.1 53.9 -59.3 -43.9 26.4 64.2 68.5 716 356 B Y H X S+ 0 0 8 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.882 106.3 52.2 -63.1 -36.9 27.7 67.8 68.2 717 357 B M H X S+ 0 0 5 -4,-1.7 4,-1.0 -22,-0.2 -1,-0.2 0.904 109.1 49.9 -63.8 -42.1 31.1 66.5 66.9 718 358 B R H X S+ 0 0 38 -4,-1.7 4,-0.6 1,-0.2 3,-0.3 0.915 110.3 51.2 -62.5 -40.3 29.4 64.5 64.2 719 359 B E H X S+ 0 0 1 -4,-2.3 4,-0.6 1,-0.2 3,-0.2 0.785 103.3 59.0 -65.7 -30.3 27.3 67.5 63.1 720 360 B A H >X S+ 0 0 0 -4,-1.4 4,-0.8 1,-0.2 3,-0.6 0.831 91.1 67.3 -74.8 -32.0 30.3 69.9 62.7 721 361 B K H >< S+ 0 0 0 -4,-1.0 3,-0.9 -3,-0.3 4,-0.4 0.881 97.5 52.2 -55.7 -43.0 32.3 67.8 60.2 722 362 B I H >X S+ 0 0 6 -4,-0.6 4,-2.4 -3,-0.2 3,-0.8 0.759 98.9 65.7 -71.5 -23.1 29.7 68.4 57.3 723 363 B M H << S+ 0 0 0 -3,-0.6 -1,-0.2 -4,-0.6 -2,-0.2 0.805 94.9 57.3 -64.8 -31.1 29.8 72.1 57.9 724 364 B Q T << S+ 0 0 22 -3,-0.9 6,-1.7 -4,-0.8 -1,-0.2 0.698 114.5 41.9 -65.3 -20.5 33.4 72.2 56.7 725 365 B I T <4 S+ 0 0 11 -3,-0.8 3,-0.3 -4,-0.4 -2,-0.2 0.862 99.1 67.5-100.5 -45.4 32.2 70.6 53.5 726 366 B F S < S+ 0 0 58 -4,-2.4 -393,-0.0 1,-0.2 4,-0.0 -0.312 87.6 35.8 -93.0 172.2 29.0 72.1 52.2 727 367 B E S S- 0 0 60 -2,-0.0 -1,-0.2 -117,-0.0 -117,-0.1 0.893 142.5 -26.2 56.4 45.3 28.2 75.6 50.8 728 368 B G S S- 0 0 27 -3,-0.3 5,-0.1 4,-0.0 -2,-0.1 0.728 86.9-101.8 81.5 109.5 31.6 75.5 49.2 729 369 B T > - 0 0 32 1,-0.1 4,-2.2 3,-0.1 3,-0.4 -0.159 33.7-108.5 -55.0 153.1 34.3 73.3 50.8 730 370 B N H > S+ 0 0 1 -6,-1.7 4,-1.9 1,-0.2 -1,-0.1 0.760 120.0 56.3 -57.8 -26.0 36.9 75.2 52.9 731 371 B Q H > S+ 0 0 30 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.885 107.1 49.2 -68.5 -42.4 39.6 74.5 50.2 732 372 B I H > S+ 0 0 73 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.874 108.0 54.3 -66.4 -37.3 37.4 76.2 47.7 733 373 B Q H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.918 107.7 50.2 -58.4 -45.1 37.0 79.1 50.2 734 374 B R H X S+ 0 0 117 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.910 109.4 51.5 -59.3 -42.6 40.8 79.5 50.4 735 375 B L H X S+ 0 0 111 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.919 109.0 50.5 -55.9 -48.9 41.0 79.5 46.5 736 376 B V H X S+ 0 0 45 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.896 110.4 48.9 -58.1 -44.4 38.3 82.3 46.4 737 377 B I H < S+ 0 0 28 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.923 111.8 50.2 -64.4 -41.7 40.3 84.4 48.9 738 378 B A H >X S+ 0 0 50 -4,-2.4 3,-2.8 1,-0.2 4,-1.0 0.964 107.0 51.8 -60.3 -56.0 43.5 83.9 46.9 739 379 B R H >< S+ 0 0 73 -4,-2.8 3,-0.5 1,-0.3 -1,-0.2 0.850 105.5 59.5 -49.7 -34.6 41.9 84.9 43.6 740 380 B G T 3< S+ 0 0 44 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.455 106.7 45.1 -74.8 -2.0 40.7 88.1 45.5 741 381 B L T <4 0 0 145 -3,-2.8 -1,-0.2 -4,-0.2 -2,-0.2 0.415 360.0 360.0-112.3 -9.2 44.3 89.1 46.3 742 382 B T << 0 0 164 -4,-1.0 -2,-0.2 -3,-0.5 -3,-0.2 0.795 360.0 360.0 -99.2 360.0 45.5 88.3 42.7