==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-JUN-08 3DJB . COMPND 2 MOLECULE: HYDROLASE, HD FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS THURINGIENSIS SEROVAR . AUTHOR F.FOROUHAR,M.SU,J.SEETHARAMAN,S.M.VOROBIEV,H.JANJUA,Y.FANG, . 376 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19080.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 277 73.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 8 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 14.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 202 53.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.1 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 2 0 2 0 2 0 4 2 0 0 2 4 0 0 0 0 0 0 0 0 0 2 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 . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 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 2 A T > 0 0 114 0, 0.0 4,-0.7 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 166.1 53.1 27.4 87.3 2 3 A K H >> + 0 0 88 1,-0.2 4,-3.1 2,-0.2 3,-1.9 0.927 360.0 56.7 -58.7 -49.4 50.9 29.8 85.5 3 4 A Q H 3> S+ 0 0 93 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.812 103.0 56.1 -54.9 -31.7 48.9 30.9 88.6 4 5 A E H 3> S+ 0 0 129 -3,-0.4 4,-1.8 2,-0.2 -1,-0.3 0.779 112.4 43.5 -72.8 -20.9 52.2 31.8 90.2 5 6 A K H X S+ 0 0 95 -4,-1.9 3,-4.5 2,-0.2 4,-1.1 0.953 107.7 54.6 -83.6 -59.4 53.5 48.3 91.8 16 17 A I H 3< S+ 0 0 65 -4,-1.8 -2,-0.2 1,-0.3 -3,-0.1 0.768 102.2 64.2 -48.5 -25.6 53.9 50.3 88.6 17 18 A L T 3< S+ 0 0 21 -4,-1.7 -1,-0.3 1,-0.2 7,-0.2 0.569 100.7 52.2 -75.4 -8.5 50.7 52.0 89.6 18 19 A E T <4 S+ 0 0 139 -3,-4.5 -2,-0.2 4,-0.2 -1,-0.2 0.838 93.2 66.4 -94.7 -38.8 52.6 53.4 92.6 19 20 A K S < S- 0 0 138 -4,-1.1 2,-0.2 3,-0.1 -1,-0.2 0.370 127.4 -17.8 -64.2 9.5 55.6 54.9 90.8 20 21 A D S S+ 0 0 116 -3,-0.2 3,-0.2 -4,-0.0 -3,-0.1 -0.638 121.1 34.0-169.8-129.5 53.1 57.3 89.3 21 22 A A S S- 0 0 45 42,-0.2 2,-0.3 -2,-0.2 -4,-0.1 0.647 102.6 -68.1 -10.3-102.1 49.3 57.7 88.8 22 23 A S > - 0 0 53 -5,-0.0 3,-1.9 -3,-0.0 -4,-0.2 -0.887 19.8-124.5-171.4 138.0 47.8 56.0 91.8 23 24 A G T 3 S+ 0 0 38 1,-0.3 4,-0.2 -2,-0.3 -5,-0.1 0.176 102.5 81.5 -71.5 23.4 47.4 52.5 93.3 24 25 A H T > S+ 0 0 56 -7,-0.2 3,-0.7 1,-0.1 4,-0.3 0.680 71.6 69.7-101.3 -20.5 43.7 53.3 93.2 25 26 A D T <> S+ 0 0 70 -3,-1.9 4,-1.5 1,-0.2 3,-0.3 0.494 83.6 81.0 -72.6 -2.2 43.2 52.5 89.5 26 27 A W H 3> S+ 0 0 17 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.930 77.8 62.2 -69.0 -47.4 43.8 48.9 90.6 27 28 A Y H <> S+ 0 0 39 -3,-0.7 4,-1.5 1,-0.3 -1,-0.2 0.772 107.6 48.0 -52.5 -23.3 40.3 48.3 91.9 28 29 A H H > S+ 0 0 43 -4,-0.3 4,-1.7 -3,-0.3 -1,-0.3 0.902 109.0 51.0 -79.9 -47.1 39.2 48.9 88.3 29 30 A I H X S+ 0 0 2 -4,-1.5 4,-2.6 2,-0.2 3,-0.2 0.937 114.7 44.4 -54.0 -51.6 41.8 46.6 86.8 30 31 A R H X>S+ 0 0 68 -4,-2.9 4,-3.2 1,-0.2 5,-0.6 0.966 106.7 57.2 -60.3 -55.9 40.7 43.8 89.2 31 32 A R H X5S+ 0 0 14 -4,-1.5 4,-0.7 -5,-0.3 -1,-0.2 0.825 113.4 42.8 -44.4 -37.1 37.0 44.4 88.7 32 33 A V H X5S+ 0 0 0 -4,-1.7 4,-2.1 -3,-0.2 -1,-0.3 0.924 115.8 48.6 -75.6 -47.1 37.6 43.8 85.0 33 34 A H H >X5S+ 0 0 15 -4,-2.6 4,-2.0 2,-0.3 3,-0.5 0.965 112.1 45.7 -57.2 -59.3 39.9 40.8 85.6 34 35 A K H 3X5S+ 0 0 95 -4,-3.2 4,-1.8 1,-0.3 -1,-0.2 0.860 115.7 51.5 -54.5 -30.9 37.7 39.0 88.1 35 36 A X H 3XX S+ 0 0 23 -4,-2.0 4,-2.1 2,-0.2 3,-1.1 0.988 108.4 45.1 -66.0 -74.9 37.3 35.2 84.6 38 39 A S H 3< S+ 0 0 48 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.740 114.7 53.2 -39.4 -30.6 33.6 34.6 85.3 39 40 A L H >< S+ 0 0 9 -4,-1.4 3,-0.8 -5,-0.1 4,-0.3 0.921 109.1 45.3 -74.7 -45.8 33.0 35.5 81.7 40 41 A S H XX S+ 0 0 4 -4,-2.0 4,-3.7 -3,-1.1 3,-2.6 0.937 102.7 65.0 -62.6 -48.0 35.4 32.8 80.3 41 42 A E T 3< S+ 0 0 126 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.1 0.096 113.3 35.7 -65.9 29.2 34.2 30.1 82.6 42 43 A Q T <4 S+ 0 0 141 -2,-1.3 -1,-0.3 -3,-0.8 -2,-0.2 0.298 128.2 32.5-156.3 -4.9 30.9 30.5 80.7 43 44 A E T <4 S- 0 0 58 -3,-2.6 2,-0.3 1,-0.3 -2,-0.2 0.434 97.4-128.8-135.1 -8.8 32.2 31.2 77.3 44 45 A G < + 0 0 39 -4,-3.7 -1,-0.3 -5,-0.1 -2,-0.2 -0.722 47.6 132.7 97.2-144.1 35.4 29.3 76.9 45 46 A G S S- 0 0 30 -2,-0.3 2,-0.9 1,-0.1 -1,-0.1 0.389 71.8 -55.7 68.9 154.6 38.7 30.7 75.7 46 47 A N > - 0 0 57 1,-0.2 4,-2.8 2,-0.1 3,-0.4 -0.492 47.5-158.2 -69.0 102.0 42.2 30.4 77.2 47 48 A R H > S+ 0 0 93 -2,-0.9 4,-3.0 1,-0.2 5,-0.3 0.918 87.2 51.2 -43.1 -72.3 42.0 31.6 80.8 48 49 A F H > S+ 0 0 13 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.831 114.4 45.0 -36.0 -49.4 45.7 32.4 81.4 49 50 A I H > S+ 0 0 6 -3,-0.4 4,-3.0 2,-0.2 -1,-0.2 0.989 113.6 49.4 -62.3 -55.5 45.7 34.5 78.2 50 51 A I H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.2 0.915 116.9 42.5 -47.3 -51.9 42.4 36.2 79.1 51 52 A E H X S+ 0 0 10 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.958 113.6 48.8 -61.4 -56.0 43.7 37.0 82.6 52 53 A X H < S+ 0 0 1 -4,-3.1 4,-0.4 -5,-0.3 -1,-0.2 0.863 116.3 47.1 -53.6 -35.0 47.2 38.1 81.7 53 54 A A H >X S+ 0 0 2 -4,-3.0 3,-2.5 -5,-0.3 4,-1.2 0.988 110.5 47.0 -71.7 -59.0 45.6 40.3 79.1 54 55 A A H 3< S+ 0 0 0 -4,-3.0 4,-0.3 1,-0.3 3,-0.2 0.811 111.4 56.7 -51.3 -32.3 42.9 41.9 81.2 55 56 A L T 3< S+ 0 0 0 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.575 116.0 31.7 -77.7 -12.7 45.6 42.5 83.8 56 57 A L T <> S+ 0 0 0 -3,-2.5 4,-0.7 -4,-0.4 3,-0.4 0.391 85.1 96.8-128.0 3.9 47.9 44.5 81.5 57 58 A H H X S+ 0 0 7 -4,-1.2 4,-0.8 1,-0.2 3,-0.3 0.813 91.6 49.0 -61.9 -29.8 45.7 46.4 79.0 58 59 A D H 4 S+ 0 0 49 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.741 98.3 65.5 -82.4 -25.8 46.0 49.3 81.3 59 60 A V H 4 S+ 0 0 12 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.668 107.1 42.4 -74.0 -14.6 49.7 49.3 81.7 60 61 A A H < 0 0 6 -4,-0.7 10,-0.4 -3,-0.3 4,-0.2 0.718 360.0 360.0 -99.7 -26.3 50.2 50.1 78.0 61 62 A D < 0 0 103 -4,-0.8 4,-0.2 9,-0.1 6,-0.2 0.918 360.0 360.0 -39.7 360.0 47.5 52.7 77.9 62 ! 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 63 65 A L 0 0 124 0, 0.0 -42,-0.2 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 19.8 49.2 57.5 80.9 64 66 A N - 0 0 29 -4,-0.2 -3,-0.1 3,-0.1 -4,-0.1 0.908 360.0 -67.9 -79.5 -45.1 51.9 54.8 80.8 65 67 A E S S- 0 0 144 -5,-0.2 2,-0.3 -4,-0.2 3,-0.1 -0.274 87.3 -28.8-168.3 -95.7 54.4 56.8 78.8 66 68 A S S S- 0 0 80 1,-0.3 3,-0.1 -2,-0.1 -5,-0.0 -0.789 88.6 -60.7-154.7 105.0 54.0 57.8 75.1 67 69 A E S > S- 0 0 91 -2,-0.3 2,-1.9 1,-0.2 3,-1.1 -0.257 119.7 -1.8 57.6-141.8 51.9 55.9 72.4 68 70 A E T 3> S+ 0 0 136 1,-0.3 4,-0.5 2,-0.1 -1,-0.2 -0.070 104.1 105.7 -71.9 39.0 53.1 52.3 71.7 69 71 A A T 34 S+ 0 0 39 -2,-1.9 -1,-0.3 -9,-0.2 4,-0.2 0.681 74.1 55.4 -90.6 -20.7 55.9 52.8 74.2 70 72 A G T <> S+ 0 0 0 -3,-1.1 4,-2.1 -10,-0.4 5,-0.3 0.690 90.1 74.6 -83.7 -21.1 54.1 50.6 76.7 71 73 A X H >> S+ 0 0 35 1,-0.3 4,-3.7 2,-0.2 3,-0.5 0.958 101.6 40.8 -55.3 -53.6 53.9 47.7 74.3 72 74 A K H 3X S+ 0 0 125 -4,-0.5 4,-1.9 1,-0.2 -1,-0.3 0.669 109.4 63.5 -69.3 -14.4 57.5 46.9 74.7 73 75 A K H 34 S+ 0 0 46 -4,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.878 114.3 30.6 -74.3 -36.8 57.0 47.7 78.4 74 76 A V H XX S+ 0 0 0 -4,-2.1 4,-2.4 -3,-0.5 3,-0.7 0.817 117.1 61.7 -85.0 -38.3 54.6 44.7 78.5 75 77 A S H 3X S+ 0 0 44 -4,-3.7 4,-0.9 -5,-0.3 3,-0.2 0.966 105.5 42.7 -51.0 -65.3 56.5 42.9 75.9 76 78 A D H 3X S+ 0 0 77 -4,-1.9 4,-1.1 1,-0.2 -1,-0.3 0.584 112.9 58.2 -62.3 -10.0 59.8 42.6 77.8 77 79 A W H <> S+ 0 0 23 -3,-0.7 4,-2.0 2,-0.2 5,-0.2 0.915 97.7 54.0 -85.2 -50.2 57.8 41.7 80.9 78 80 A L H < S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.1 0.765 108.9 56.8 -54.7 -22.2 56.0 38.6 79.6 79 81 A E H >< S+ 0 0 104 -4,-0.9 3,-2.1 -5,-0.2 -1,-0.2 0.932 101.4 50.6 -74.1 -50.3 59.6 37.6 78.8 80 82 A E H 3< S+ 0 0 142 -4,-1.1 -2,-0.2 1,-0.3 -1,-0.2 0.846 114.1 46.8 -57.1 -33.5 60.9 37.9 82.4 81 83 A L T 3< S- 0 0 25 -4,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.405 117.8-124.6 -87.0 0.6 57.9 35.8 83.4 82 84 A H < + 0 0 144 -3,-2.1 2,-0.3 -5,-0.2 -3,-0.2 0.910 40.9 172.7 53.1 103.3 58.8 33.4 80.5 83 85 A V - 0 0 11 -5,-0.1 5,-0.3 -4,-0.0 -1,-0.2 -0.881 38.6-111.3-144.5 106.7 55.9 33.0 78.2 84 86 A E >> - 0 0 147 -2,-0.3 3,-3.7 1,-0.2 4,-2.4 -0.032 25.5-123.8 -36.5 127.7 56.3 31.1 74.9 85 87 A E H 3> S+ 0 0 133 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.785 110.7 75.6 -47.9 -26.1 55.9 33.6 72.1 86 88 A E H 34 S+ 0 0 164 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.796 113.4 19.7 -57.4 -28.9 53.2 31.2 71.0 87 89 A E H X> S+ 0 0 46 -3,-3.7 4,-2.1 2,-0.1 3,-1.7 0.782 121.2 58.4-106.5 -45.0 51.1 32.6 73.8 88 90 A S H 3X S+ 0 0 7 -4,-2.4 4,-1.9 1,-0.3 5,-0.3 0.894 98.8 60.9 -53.3 -44.9 52.7 36.0 74.4 89 91 A K H 3< S+ 0 0 134 -4,-2.3 -1,-0.3 -5,-0.3 -3,-0.1 0.787 112.2 40.9 -54.7 -25.6 52.2 37.0 70.8 90 92 A H H <> S+ 0 0 47 -3,-1.7 4,-1.4 -5,-0.2 -2,-0.2 0.780 113.8 51.8 -92.1 -34.4 48.5 36.6 71.7 91 93 A V H X S+ 0 0 1 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.997 115.1 38.0 -67.4 -66.8 48.5 38.1 75.1 92 94 A L H < S+ 0 0 38 -4,-1.9 -1,-0.2 1,-0.2 -3,-0.1 0.473 110.0 72.8 -66.5 5.9 50.2 41.4 74.2 93 95 A H H >> S+ 0 0 107 -5,-0.3 3,-2.9 2,-0.1 4,-0.6 0.963 99.0 36.0 -81.0 -71.3 48.2 41.2 71.1 94 96 A I H 3< S+ 0 0 14 -4,-1.4 -2,-0.2 1,-0.3 -1,-0.1 0.768 103.0 77.5 -51.7 -25.5 44.7 42.1 72.2 95 97 A I T 3< S+ 0 0 5 -4,-1.3 -1,-0.3 1,-0.3 3,-0.3 0.559 92.5 55.3 -61.0 -8.1 46.4 44.4 74.7 96 98 A A T <4 S+ 0 0 59 -3,-2.9 2,-0.8 1,-0.2 -1,-0.3 0.868 101.1 53.0 -90.7 -47.2 46.7 46.6 71.6 97 99 A N < 0 0 123 -4,-0.6 -1,-0.2 1,-0.2 -2,-0.2 -0.069 360.0 360.0 -80.7 37.6 42.9 46.6 70.8 98 100 A X 0 0 68 -2,-0.8 -1,-0.2 -3,-0.3 -3,-0.1 -0.036 360.0 360.0-120.6 360.0 42.3 47.8 74.3 99 ! 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 0.0 100 112 A S > 0 0 74 0, 0.0 4,-3.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 112.7 39.6 36.1 69.0 101 113 A I H > + 0 0 61 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.907 360.0 53.1 -59.6 -42.6 37.4 34.7 71.7 102 114 A E H > S+ 0 0 29 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.965 117.2 36.8 -54.7 -58.5 40.0 35.4 74.5 103 115 A G H > S+ 0 0 6 1,-0.2 4,-2.6 2,-0.2 5,-0.4 0.978 111.2 60.6 -58.7 -54.9 40.4 39.0 73.5 104 116 A K H X S+ 0 0 102 -4,-3.4 4,-1.2 1,-0.3 58,-0.3 0.842 108.0 47.1 -40.8 -41.6 36.7 39.3 72.7 105 117 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 3,-0.5 0.943 107.5 53.1 -70.0 -47.0 36.1 38.4 76.4 106 118 A V H X S+ 0 0 1 -4,-2.1 4,-0.9 1,-0.3 3,-0.2 0.934 111.0 49.3 -53.0 -44.7 38.6 40.8 77.9 107 119 A Q H X S+ 0 0 64 -4,-2.6 4,-2.0 1,-0.3 -1,-0.3 0.801 109.9 49.9 -65.2 -30.0 36.9 43.5 75.9 108 120 A D H X S+ 0 0 0 -4,-1.2 4,-1.1 -3,-0.5 -1,-0.3 0.770 110.1 52.2 -78.0 -24.6 33.5 42.4 77.1 109 121 A A H < S+ 0 0 0 -4,-2.1 -2,-0.2 -3,-0.2 -1,-0.2 0.612 113.5 43.6 -84.4 -13.7 34.9 42.5 80.6 110 122 A D H >< S+ 0 0 45 -4,-0.9 3,-0.5 -5,-0.2 -2,-0.2 0.846 112.9 47.2 -96.7 -43.7 36.2 46.0 80.3 111 123 A R H 3< S+ 0 0 53 -4,-2.0 4,-0.4 1,-0.2 3,-0.3 0.867 104.8 62.0 -66.3 -36.1 33.3 47.7 78.6 112 124 A L T >< S+ 0 0 0 -4,-1.1 2,-1.7 1,-0.3 3,-1.3 0.820 88.8 75.6 -58.6 -29.4 30.9 46.1 81.1 113 125 A D T < S+ 0 0 12 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.1 -0.235 88.4 57.3 -79.1 48.5 32.8 48.1 83.7 114 126 A A T 3 S+ 0 0 22 -2,-1.7 -1,-0.2 -3,-0.3 2,-0.2 0.368 95.3 70.9-144.9 -24.8 31.2 51.3 82.7 115 127 A L S < S+ 0 0 2 -3,-1.3 3,-0.2 -4,-0.4 4,-0.2 -0.569 76.1 39.1 -98.8 162.7 27.6 50.4 83.2 116 128 A G S >> S- 0 0 0 57,-0.3 4,-1.9 -2,-0.2 3,-1.3 -0.234 109.6 -34.2 92.6 177.7 25.6 49.9 86.4 117 129 A A H 3> S+ 0 0 0 1,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.852 136.9 53.7 -34.3 -58.2 25.5 51.5 89.8 118 130 A I H 3> S+ 0 0 2 -3,-0.2 4,-5.0 1,-0.2 -1,-0.3 0.871 108.5 50.9 -47.2 -46.1 29.3 52.2 89.6 119 131 A G H <> S+ 0 0 1 -3,-1.3 4,-3.3 2,-0.2 -1,-0.2 0.980 107.5 51.1 -57.9 -59.7 28.8 53.9 86.2 120 132 A I H X S+ 0 0 0 -4,-1.9 4,-1.9 1,-0.2 5,-0.3 0.939 117.6 41.1 -41.3 -58.1 26.0 56.1 87.5 121 133 A A H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.3 0.970 109.7 55.5 -58.7 -56.6 28.4 57.1 90.3 122 134 A R H X S+ 0 0 83 -4,-5.0 4,-2.8 -5,-0.2 -1,-0.2 0.883 111.3 50.8 -44.3 -37.8 31.5 57.4 88.2 123 135 A T H X S+ 0 0 9 -4,-3.3 4,-3.1 2,-0.2 -2,-0.2 0.995 111.5 38.4 -65.7 -70.8 29.4 59.8 86.2 124 136 A F H X S+ 0 0 1 -4,-1.9 4,-2.9 1,-0.2 -1,-0.2 0.854 118.5 56.0 -49.7 -32.6 28.0 62.3 88.7 125 137 A A H X S+ 0 0 17 -4,-2.8 4,-2.2 -5,-0.3 -1,-0.2 0.967 109.1 41.8 -62.4 -57.7 31.4 62.0 90.3 126 138 A Y H X S+ 0 0 113 -4,-2.8 4,-3.0 -5,-0.3 -1,-0.2 0.843 114.1 57.1 -58.6 -32.4 33.3 62.9 87.2 127 139 A G H X>S+ 0 0 0 -4,-3.1 5,-1.0 -5,-0.2 4,-0.8 0.934 104.2 50.0 -64.7 -46.9 30.6 65.6 86.8 128 140 A G H ><5S+ 0 0 13 -4,-2.9 3,-0.8 -5,-0.2 -2,-0.2 0.939 114.1 44.6 -56.5 -49.5 31.3 67.1 90.2 129 141 A A H 3<5S+ 0 0 59 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.966 113.1 49.7 -60.2 -54.7 35.0 67.3 89.5 130 142 A K H 3<5S- 0 0 126 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.582 117.6-116.2 -63.2 -6.8 34.5 68.7 86.0 131 143 A G T <<5 + 0 0 62 -3,-0.8 2,-0.3 -4,-0.8 -3,-0.2 0.999 64.1 130.3 69.5 72.8 32.1 71.3 87.5 132 144 A R < - 0 0 86 -5,-1.0 -1,-0.2 -8,-0.2 -2,-0.0 -0.956 55.7-101.7-148.4 163.6 28.7 70.6 86.1 133 145 A L - 0 0 62 -2,-0.3 13,-2.0 1,-0.1 3,-0.1 -0.126 25.8-127.4 -76.7-178.4 25.1 70.1 87.2 134 146 A X S S- 0 0 31 1,-0.4 13,-3.4 11,-0.2 2,-0.3 0.815 85.5 -0.7 -98.0 -43.0 23.5 66.7 87.4 135 147 A Y - 0 0 47 11,-0.2 -1,-0.4 12,-0.1 11,-0.1 -0.978 57.3-179.2-146.1 154.7 20.4 67.4 85.3 136 148 A D > - 0 0 23 -2,-0.3 3,-1.7 3,-0.3 12,-0.0 -0.827 20.7-154.3-160.1 114.7 19.0 70.4 83.4 137 149 A P T 3 S+ 0 0 64 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 0.540 97.4 64.9 -67.5 -6.9 15.7 70.5 81.4 138 150 A T T 3 S+ 0 0 99 1,-0.2 0, 0.0 2,-0.0 0, 0.0 0.596 101.8 51.8 -88.8 -15.1 17.2 73.3 79.3 139 151 A I S < S- 0 0 70 -3,-1.7 -3,-0.3 0, 0.0 -1,-0.2 -0.764 79.6-169.3-125.1 84.3 19.8 70.9 77.9 140 152 A P - 0 0 91 0, 0.0 8,-0.0 0, 0.0 -2,-0.0 -0.151 34.3 -78.1 -68.4 166.6 18.1 67.7 76.6 141 153 A P 0 0 72 0, 0.0 8,-0.1 0, 0.0 7,-0.1 -0.126 360.0 360.0 -63.9 161.7 20.1 64.6 75.6 142 154 A R 0 0 224 6,-0.2 7,-0.0 0, 0.0 6,-0.0 0.537 360.0 360.0-132.4 360.0 22.0 64.2 72.3 143 ! 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 0.0 144 167 A D 0 0 134 0, 0.0 2,-0.1 0, 0.0 -11,-0.0 0.000 360.0 360.0 360.0 81.7 26.3 69.5 79.3 145 168 A P > - 0 0 7 0, 0.0 4,-1.0 0, 0.0 3,-0.4 -0.404 360.0-112.9 -82.8 161.1 25.0 67.9 82.6 146 169 A S T 4 S+ 0 0 7 -13,-2.0 4,-0.5 1,-0.2 3,-0.2 0.828 111.3 59.4 -63.3 -36.7 26.0 64.5 84.1 147 170 A L T >> S+ 0 0 2 -13,-3.4 3,-1.1 1,-0.2 4,-0.6 0.854 99.7 57.6 -64.2 -33.9 22.6 62.8 83.5 148 171 A N H 3> S+ 0 0 4 -3,-0.4 4,-2.8 -14,-0.3 3,-0.4 0.900 88.9 73.0 -63.7 -39.7 22.8 63.4 79.8 149 172 A H H 3X S+ 0 0 62 -4,-1.0 4,-2.3 1,-0.2 -1,-0.2 0.788 89.3 65.6 -45.0 -29.5 26.1 61.5 79.5 150 173 A F H <>>S+ 0 0 0 -3,-1.1 5,-2.3 -4,-0.5 4,-1.7 0.989 110.1 30.8 -59.5 -62.7 24.0 58.4 80.1 151 174 A Y H <5S+ 0 0 98 -4,-0.6 -2,-0.2 -3,-0.4 5,-0.2 0.894 116.5 66.4 -60.8 -39.4 22.0 58.6 76.9 152 175 A E H <5S- 0 0 48 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.937 130.8 -21.1 -45.9 -69.5 25.1 60.2 75.3 153 176 A K H <5S+ 0 0 154 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 -0.162 127.1 58.9-144.8 47.7 27.5 57.4 75.4 154 177 A L T ><5S+ 0 0 10 -4,-1.7 3,-1.7 -3,-0.2 4,-0.3 0.532 91.7 54.4-138.5 -52.2 26.5 54.8 78.0 155 178 A L G > S- 0 0 13 -59,-0.2 4,-1.8 -62,-0.1 5,-0.1 -0.106 83.7-112.3 -67.0 170.9 30.0 37.0 74.0 164 187 A N H > S+ 0 0 111 2,-0.2 4,-3.5 1,-0.2 5,-0.2 0.970 111.9 53.7 -69.2 -57.6 26.7 36.0 75.5 165 188 A A H > S+ 0 0 13 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.862 112.6 47.5 -46.2 -42.4 27.6 36.1 79.2 166 189 A A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.3 0.929 112.1 48.8 -65.1 -48.0 28.8 39.7 78.7 167 190 A K H X S+ 0 0 78 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.920 111.9 50.8 -59.0 -43.4 25.6 40.5 76.8 168 191 A Q H >X S+ 0 0 121 -4,-3.5 4,-1.9 2,-0.2 3,-0.9 0.991 112.8 42.3 -57.2 -66.3 23.5 38.9 79.6 169 192 A E H 3X S+ 0 0 42 -4,-2.5 4,-3.1 1,-0.3 5,-0.2 0.904 112.2 58.1 -45.0 -47.9 25.2 40.8 82.4 170 193 A A H 3X S+ 0 0 0 -4,-2.8 4,-3.6 1,-0.2 -1,-0.3 0.838 103.2 51.2 -53.0 -42.1 25.1 44.0 80.3 171 194 A E H X S+ 0 0 0 -4,-2.7 4,-3.6 -5,-0.3 3,-1.1 0.985 106.4 46.2 -60.4 -59.6 17.5 54.5 87.9 181 204 A I H 3X S+ 0 0 6 -4,-2.3 4,-1.3 1,-0.3 -1,-0.2 0.668 112.4 56.9 -57.7 -13.2 17.0 57.5 85.5 182 205 A E H 3X S+ 0 0 138 -4,-0.8 4,-1.3 2,-0.2 -1,-0.3 0.822 111.3 38.3 -86.3 -35.6 13.4 56.5 85.9 183 206 A Q H <>S+ 0 0 80 -4,-1.3 5,-1.2 1,-0.2 3,-0.5 0.894 111.3 49.1 -53.7 -39.5 10.1 61.2 89.2 187 210 A E H ><5S+ 0 0 2 -4,-1.4 3,-2.7 3,-0.2 -1,-0.2 0.913 101.9 61.7 -67.0 -39.8 12.0 62.7 92.1 188 211 A W H 3<5S+ 0 0 11 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.787 113.7 36.6 -55.7 -28.0 13.1 65.6 89.9 189 212 A N T <<5S- 0 0 66 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 -0.025 119.1-111.8-112.3 24.2 9.4 66.4 89.6 190 213 A A T < 5 0 0 11 -3,-2.7 -3,-0.2 -5,-0.1 -2,-0.1 0.928 360.0 360.0 42.5 75.2 8.6 65.4 93.2 191 214 A Q < 0 0 144 -5,-1.2 -4,-0.1 39,-0.0 -5,-0.0 0.860 360.0 360.0 -96.0 360.0 6.5 62.3 92.3 192 !* 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 0.0 193 2 B T > 0 0 112 0, 0.0 4,-0.7 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 165.7 -5.7 86.3 95.7 194 3 B K H >> + 0 0 88 1,-0.2 4,-3.1 2,-0.2 3,-1.9 0.924 360.0 56.7 -58.3 -49.6 -3.3 84.0 97.5 195 4 B Q H 3> S+ 0 0 94 1,-0.3 4,-1.1 2,-0.2 -1,-0.2 0.808 103.0 56.0 -54.8 -31.3 -2.3 82.0 94.5 196 5 B E H 3> S+ 0 0 129 -3,-0.4 4,-1.7 2,-0.2 -1,-0.3 0.774 112.4 43.4 -73.1 -20.7 -1.3 85.3 92.9 197 6 B K H X S+ 0 0 98 -4,-1.8 3,-4.5 2,-0.2 4,-1.1 0.955 107.7 54.4 -83.5 -59.7 15.2 86.7 91.2 208 17 B I H 3< S+ 0 0 62 -4,-1.8 -2,-0.2 1,-0.3 -3,-0.1 0.765 102.2 64.3 -48.2 -25.6 17.1 87.1 94.4 209 18 B L T 3< S+ 0 0 23 -4,-1.7 -1,-0.3 1,-0.2 7,-0.2 0.572 100.7 52.2 -75.6 -8.5 18.9 83.9 93.4 210 19 B E T <4 S+ 0 0 139 -3,-4.5 -2,-0.2 4,-0.2 -1,-0.2 0.837 93.2 66.5 -94.5 -38.8 20.2 85.8 90.4 211 20 B K S < S- 0 0 139 -4,-1.1 2,-0.2 3,-0.1 -1,-0.2 0.371 127.4 -18.1 -64.1 9.4 21.8 88.8 92.2 212 21 B D S S+ 0 0 114 -3,-0.2 3,-0.2 -4,-0.0 -3,-0.1 -0.641 121.1 34.3-170.2-129.5 24.2 86.2 93.7 213 22 B A S S- 0 0 46 42,-0.2 2,-0.3 -2,-0.2 -4,-0.1 0.644 102.5 -68.3 -10.2-102.4 24.5 82.5 94.2 214 23 B S > - 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0 0 55 1,-0.2 4,-2.8 2,-0.1 3,-0.3 -0.512 47.6-158.2 -70.3 102.8 -2.7 75.3 105.9 239 48 B R H > S+ 0 0 95 -2,-0.9 4,-3.0 1,-0.2 5,-0.3 0.923 87.1 50.9 -43.9 -72.2 -1.6 75.1 102.2 240 49 B F H > S+ 0 0 13 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.835 114.5 45.1 -36.1 -49.5 -0.7 78.8 101.7 241 50 B I H > S+ 0 0 5 -3,-0.3 4,-3.0 2,-0.2 5,-0.2 0.989 113.5 49.5 -62.2 -55.4 1.4 78.9 104.8 242 51 B I H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.2 0.915 117.0 42.5 -47.1 -51.7 3.1 75.6 103.9 243 52 B E H X S+ 0 0 12 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.957 113.6 48.7 -61.5 -56.2 3.8 76.9 100.4 244 53 B X H < S+ 0 0 0 -4,-3.1 4,-0.4 -5,-0.3 -1,-0.2 0.863 116.3 47.3 -53.6 -35.1 4.9 80.4 101.4 245 54 B A H >X S+ 0 0 1 -4,-3.0 3,-2.5 -5,-0.3 4,-1.2 0.987 110.3 47.1 -71.6 -58.7 7.1 78.8 104.0 246 55 B A H 3< S+ 0 0 0 -4,-3.0 4,-0.3 1,-0.3 3,-0.2 0.813 111.2 57.0 -51.5 -31.8 8.8 76.0 101.9 247 56 B L T 3< S+ 0 0 0 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.573 115.9 31.4 -77.9 -12.4 9.4 78.7 99.2 248 57 B L T <> S+ 0 0 0 -3,-2.5 4,-0.7 -4,-0.4 3,-0.3 0.385 85.1 97.1-128.8 4.6 11.4 81.1 101.5 249 58 B H H X S+ 0 0 5 -4,-1.2 4,-0.8 1,-0.2 3,-0.3 0.816 91.7 48.8 -62.5 -30.2 13.2 78.8 104.0 250 59 B D H 4 S+ 0 0 48 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.745 98.4 65.5 -81.8 -26.1 16.2 79.1 101.7 251 60 B V H 4 S+ 0 0 14 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.667 107.1 42.4 -73.4 -15.2 16.2 82.9 101.3 252 61 B A H < 0 0 7 -4,-0.7 10,-0.4 -3,-0.3 4,-0.2 0.718 360.0 360.0 -99.3 -26.6 16.9 83.4 105.0 253 62 B D < 0 0 104 -4,-0.8 4,-0.2 9,-0.1 6,-0.2 0.919 360.0 360.0 -39.8 360.0 19.6 80.6 105.2 254 ! 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 0.0 255 65 B L 0 0 125 0, 0.0 -42,-0.2 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 20.3 24.4 82.3 102.1 256 66 B N - 0 0 28 -4,-0.2 -3,-0.1 3,-0.1 2,-0.1 0.910 360.0 -67.6 -79.7 -45.2 21.6 85.0 102.2 257 67 B E S S- 0 0 142 -5,-0.2 2,-0.3 -4,-0.2 3,-0.1 -0.280 87.5 -29.2-168.2 -96.8 23.6 87.5 104.3 258 68 B S S S- 0 0 79 1,-0.3 3,-0.1 -2,-0.1 -5,-0.0 -0.803 88.7 -60.4-153.9 105.4 24.7 87.1 107.9 259 69 B E S > S- 0 0 91 -2,-0.3 2,-1.9 1,-0.2 3,-1.1 -0.249 119.9 -1.9 57.3-142.0 22.8 85.1 110.6 260 70 B E T 3> S+ 0 0 133 1,-0.3 4,-0.5 2,-0.1 -1,-0.2 -0.068 104.2 106.0 -71.7 39.3 19.2 86.2 111.3 261 71 B A T 34 S+ 0 0 41 -2,-1.9 -1,-0.3 -9,-0.2 4,-0.2 0.683 73.9 55.2 -90.7 -20.9 19.7 89.0 108.8 262 72 B G T <> S+ 0 0 0 -3,-1.1 4,-2.2 -10,-0.4 5,-0.3 0.692 90.1 74.8 -83.5 -21.4 17.5 87.3 106.3 263 73 B X H > S+ 0 0 35 1,-0.3 4,-3.8 2,-0.2 3,-0.5 0.958 101.6 40.8 -54.8 -53.6 14.6 87.0 108.7 264 74 B K H X S+ 0 0 128 -4,-0.5 4,-1.9 1,-0.2 -1,-0.3 0.670 109.5 63.3 -69.3 -14.7 13.8 90.7 108.3 265 75 B K H 4 S+ 0 0 45 -4,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.881 114.3 30.7 -74.3 -36.9 14.6 90.1 104.6 266 76 B V H >X S+ 0 0 0 -4,-2.2 4,-2.4 -3,-0.5 3,-0.7 0.821 117.2 61.7 -84.6 -38.5 11.6 87.7 104.5 267 77 B S H 3X S+ 0 0 42 -4,-3.8 4,-1.0 -5,-0.3 3,-0.2 0.965 105.4 42.6 -50.8 -65.2 9.7 89.6 107.1 268 78 B D H 3X S+ 0 0 74 -4,-1.9 4,-1.1 1,-0.2 -1,-0.3 0.579 113.0 58.3 -62.5 -9.7 9.5 92.9 105.2 269 79 B W H <> S+ 0 0 22 -3,-0.7 4,-2.0 2,-0.2 5,-0.2 0.914 97.6 53.9 -85.2 -50.3 8.6 90.9 102.1 270 80 B L H < S+ 0 0 1 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.1 0.767 108.8 56.8 -54.6 -22.5 5.5 89.2 103.4 271 81 B E H >< S+ 0 0 104 -4,-1.0 3,-2.1 -5,-0.2 -1,-0.2 0.932 101.4 50.6 -73.7 -50.4 4.5 92.8 104.2 272 82 B E H 3< S+ 0 0 140 -4,-1.1 -2,-0.2 1,-0.3 -1,-0.2 0.846 114.1 46.9 -57.1 -33.7 4.8 94.1 100.7 273 83 B L T 3< S- 0 0 24 -4,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.406 117.7-124.7 -86.8 0.4 2.6 91.1 99.7 274 84 B H < + 0 0 143 -3,-2.1 2,-0.3 -5,-0.2 -3,-0.2 0.911 41.0 172.5 53.0 103.1 0.3 91.9 102.5 275 85 B V - 0 0 10 -5,-0.1 5,-0.3 -4,-0.0 -1,-0.2 -0.880 38.7-111.4-144.4 106.6 -0.1 89.0 104.8 276 86 B E >> - 0 0 142 -2,-0.3 3,-3.6 1,-0.2 4,-2.4 -0.030 25.6-123.7 -36.5 127.9 -2.0 89.4 108.1 277 87 B E H 3> S+ 0 0 132 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.785 110.6 75.6 -48.2 -26.4 0.5 89.1 111.0 278 88 B E H 34 S+ 0 0 163 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.799 113.4 19.7 -57.0 -29.1 -2.0 86.3 112.0 279 89 B E H X> S+ 0 0 46 -3,-3.6 4,-2.1 2,-0.1 3,-1.7 0.784 121.2 58.3-106.6 -45.2 -0.5 84.2 109.3 280 90 B S H 3X S+ 0 0 6 -4,-2.4 4,-1.9 1,-0.3 5,-0.3 0.897 98.9 60.9 -53.1 -45.1 2.8 85.9 108.6 281 91 B K H 3< S+ 0 0 131 -4,-2.3 -1,-0.3 -5,-0.3 -3,-0.1 0.785 112.2 40.9 -54.4 -25.5 3.9 85.3 112.2 282 92 B H H <> S+ 0 0 47 -3,-1.7 4,-1.4 -5,-0.2 -2,-0.2 0.777 113.8 51.8 -92.1 -34.5 3.4 81.6 111.4 283 93 B V H X S+ 0 0 1 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.997 115.2 37.9 -67.3 -67.1 5.0 81.6 107.9 284 94 B L H < S+ 0 0 38 -4,-1.9 -1,-0.2 1,-0.2 -3,-0.1 0.475 110.0 72.9 -66.3 5.9 8.2 83.4 108.8 285 95 B H H >> S+ 0 0 105 -5,-0.3 3,-2.9 2,-0.1 4,-0.6 0.963 99.0 36.0 -80.9 -71.1 8.1 81.3 112.0 286 96 B I H 3< S+ 0 0 15 -4,-1.4 -2,-0.2 1,-0.3 -1,-0.1 0.765 103.0 77.4 -52.2 -25.1 8.9 77.8 110.8 287 97 B I T 3< S+ 0 0 7 -4,-1.3 -1,-0.3 1,-0.3 3,-0.3 0.562 92.6 55.4 -61.3 -8.3 11.3 79.5 108.3 288 98 B A T <4 S+ 0 0 61 -3,-2.9 2,-0.8 1,-0.2 -1,-0.3 0.871 101.0 52.9 -90.4 -47.3 13.4 79.8 111.5 289 99 B N < 0 0 123 -4,-0.6 -1,-0.2 1,-0.2 -2,-0.2 -0.065 360.0 360.0 -80.7 37.8 13.4 76.1 112.3 290 100 B X 0 0 69 -2,-0.8 -1,-0.2 -3,-0.3 -3,-0.1 -0.030 360.0 360.0-120.6 360.0 14.7 75.4 108.7 291 ! 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 0.0 292 112 B S > 0 0 74 0, 0.0 4,-3.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 112.1 3.0 72.8 114.0 293 113 B I H > + 0 0 60 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.903 360.0 53.3 -58.9 -42.7 1.5 70.6 111.3 294 114 B E H > S+ 0 0 30 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.963 117.0 36.9 -54.4 -58.5 2.2 73.2 108.6 295 115 B G H > S+ 0 0 6 1,-0.2 4,-2.6 2,-0.2 5,-0.4 0.977 111.2 60.7 -58.8 -54.4 5.9 73.5 109.5 296 116 B K H X S+ 0 0 101 -4,-3.4 4,-1.3 1,-0.3 58,-0.3 0.846 107.8 47.0 -41.0 -42.1 6.2 69.8 110.3 297 117 B L H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 3,-0.4 0.942 107.6 53.0 -69.6 -46.6 5.2 69.2 106.6 298 118 B V H X S+ 0 0 0 -4,-2.0 4,-0.9 1,-0.3 -2,-0.2 0.933 111.1 49.3 -53.6 -44.3 7.6 71.7 105.2 299 119 B Q H X S+ 0 0 63 -4,-2.6 4,-2.0 1,-0.3 -1,-0.3 0.809 109.9 49.7 -65.4 -30.9 10.4 70.0 107.1 300 120 B D H X S+ 0 0 0 -4,-1.3 4,-1.1 -3,-0.4 -1,-0.3 0.779 110.2 52.3 -77.0 -25.1 9.3 66.6 105.9 301 121 B A H < S+ 0 0 0 -4,-2.2 -2,-0.2 -3,-0.2 -1,-0.2 0.614 113.3 43.7 -83.8 -14.0 9.3 68.1 102.4 302 122 B D H < S+ 0 0 43 -4,-0.9 3,-0.5 -5,-0.2 -2,-0.2 0.844 112.9 47.1 -96.4 -43.3 12.9 69.4 102.8 303 123 B R H < S+ 0 0 54 -4,-2.0 4,-0.4 1,-0.2 3,-0.3 0.861 104.7 62.1 -67.0 -35.5 14.5 66.4 104.4 304 124 B L S >< S+ 0 0 0 -4,-1.1 2,-1.8 1,-0.3 3,-1.4 0.824 88.9 75.6 -59.3 -29.8 13.0 64.0 101.9 305 125 B D T 3 S+ 0 0 12 -3,-0.5 -1,-0.3 1,-0.2 3,-0.1 -0.245 88.4 57.0 -78.6 49.4 15.0 66.0 99.3 306 126 B A T 3 S+ 0 0 22 -2,-1.8 -1,-0.2 -3,-0.3 2,-0.2 0.365 95.4 71.4-145.8 -25.0 18.2 64.3 100.3 307 127 B L S < S+ 0 0 3 -3,-1.4 3,-0.2 -4,-0.4 4,-0.2 -0.565 76.1 39.2 -98.2 162.2 17.3 60.7 99.8 308 128 B G S >> S- 0 0 0 57,-0.3 4,-1.9 -2,-0.2 3,-1.3 -0.237 109.6 -34.3 92.9 177.4 16.7 58.7 96.6 309 129 B A H 3> S+ 0 0 0 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.856 136.9 53.6 -34.3 -58.7 18.4 58.7 93.2 310 130 B I H 3> S+ 0 0 3 -3,-0.2 4,-5.1 1,-0.2 -1,-0.3 0.867 108.5 50.9 -46.7 -45.9 19.1 62.5 93.4 311 131 B G H <> S+ 0 0 1 -3,-1.3 4,-3.2 2,-0.2 -1,-0.2 0.979 107.6 51.0 -58.3 -59.1 20.8 61.9 96.8 312 132 B I H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 5,-0.3 0.942 117.8 40.9 -42.1 -58.2 23.0 59.2 95.4 313 133 B A H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.3 0.968 109.9 55.5 -58.7 -56.1 23.9 61.5 92.7 314 134 B R H X S+ 0 0 84 -4,-5.1 4,-2.8 -5,-0.2 -1,-0.2 0.885 111.4 50.7 -44.7 -37.7 24.2 64.6 94.8 315 135 B T H X S+ 0 0 10 -4,-3.2 4,-3.1 2,-0.2 5,-0.2 0.995 111.5 38.6 -66.3 -70.3 26.7 62.5 96.8 316 136 B F H X S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.2 -1,-0.2 0.859 118.5 55.9 -49.6 -32.9 29.2 61.1 94.3 317 137 B A H X S+ 0 0 16 -4,-2.8 4,-2.2 -5,-0.3 -1,-0.2 0.970 109.1 41.9 -61.8 -58.3 28.8 64.5 92.7 318 138 B Y H X S+ 0 0 107 -4,-2.8 4,-3.0 -5,-0.3 -1,-0.2 0.842 114.0 57.1 -58.0 -32.3 29.8 66.4 95.8 319 139 B G H X>S+ 0 0 0 -4,-3.1 5,-1.1 -5,-0.2 4,-0.8 0.928 104.1 50.2 -65.0 -46.2 32.4 63.7 96.2 320 140 B G H ><5S+ 0 0 13 -4,-2.9 3,-0.9 -5,-0.2 -2,-0.2 0.947 114.0 44.5 -57.0 -50.2 33.9 64.5 92.8 321 141 B A H 3<5S+ 0 0 60 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.964 113.1 49.7 -59.7 -54.4 34.1 68.2 93.5 322 142 B K H 3<5S- 0 0 123 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.584 117.5-116.0 -63.5 -7.0 35.6 67.6 97.0 323 143 B G T <<5 + 0 0 59 -3,-0.9 2,-0.3 -4,-0.8 -3,-0.2 0.999 64.1 130.2 69.8 73.0 38.1 65.2 95.5 324 144 B R < - 0 0 83 -5,-1.1 -1,-0.2 -8,-0.2 -2,-0.0 -0.958 55.7-101.7-148.8 163.6 37.5 61.8 96.9 325 145 B L - 0 0 63 -2,-0.3 13,-1.9 1,-0.1 3,-0.1 -0.132 25.8-127.3 -77.0-178.5 37.0 58.2 95.8 326 146 B X S S- 0 0 30 1,-0.4 13,-3.3 11,-0.2 2,-0.3 0.812 85.6 -0.2 -98.1 -42.9 33.5 56.6 95.6 327 147 B Y - 0 0 49 11,-0.2 -1,-0.4 12,-0.1 11,-0.1 -0.981 57.2-179.2-146.0 154.2 34.3 53.5 97.7 328 148 B D > - 0 0 24 -2,-0.3 3,-1.7 3,-0.3 12,-0.0 -0.830 20.5-154.8-159.4 114.5 37.2 52.1 99.6 329 149 B P T 3 S+ 0 0 63 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 0.553 97.4 64.8 -67.3 -7.5 37.3 48.8 101.6 330 150 B T T 3 S+ 0 0 100 1,-0.2 0, 0.0 2,-0.0 0, 0.0 0.603 101.9 51.7 -88.1 -15.5 40.2 50.3 103.7 331 151 B I S < S- 0 0 71 -3,-1.7 -3,-0.3 0, 0.0 -1,-0.2 -0.769 79.7-169.0-124.8 84.8 37.7 52.9 105.1 332 152 B P - 0 0 93 0, 0.0 8,-0.0 0, 0.0 -2,-0.0 -0.158 34.2 -78.4 -68.7 166.4 34.6 51.2 106.4 333 153 B P 0 0 72 0, 0.0 8,-0.1 0, 0.0 7,-0.1 -0.124 360.0 360.0 -63.7 161.7 31.4 53.2 107.4 334 154 B R 0 0 227 6,-0.2 7,-0.0 0, 0.0 6,-0.0 0.540 360.0 360.0-132.4 360.0 31.0 55.1 110.7 335 ! 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 0.0 336 167 B D 0 0 133 0, 0.0 2,-0.1 0, 0.0 -11,-0.0 0.000 360.0 360.0 360.0 81.7 36.3 59.4 103.7 337 168 B P > - 0 0 6 0, 0.0 4,-1.0 0, 0.0 3,-0.4 -0.402 360.0-113.0 -82.7 161.3 34.7 58.1 100.4 338 169 B S T 4 S+ 0 0 6 -13,-1.9 4,-0.5 1,-0.2 -11,-0.2 0.827 111.3 59.4 -63.6 -36.7 31.4 59.1 98.9 339 170 B L T >> S+ 0 0 2 -13,-3.3 3,-1.1 1,-0.2 4,-0.6 0.854 99.8 57.5 -64.1 -33.8 29.7 55.8 99.5 340 171 B N H 3> S+ 0 0 4 -3,-0.4 4,-2.8 -14,-0.3 3,-0.5 0.902 89.0 72.9 -63.8 -40.0 30.3 55.9 103.2 341 172 B H H 3X S+ 0 0 64 -4,-1.0 4,-2.3 1,-0.2 -1,-0.2 0.787 89.3 65.5 -44.9 -29.7 28.4 59.2 103.5 342 173 B F H <>>S+ 0 0 1 -3,-1.1 5,-2.3 -4,-0.5 4,-1.7 0.989 110.1 31.0 -59.7 -62.1 25.2 57.2 102.9 343 174 B Y H <5S+ 0 0 96 -4,-0.6 5,-0.2 -3,-0.5 -2,-0.2 0.898 116.5 66.2 -60.9 -39.7 25.4 55.2 106.1 344 175 B E H <5S- 0 0 49 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.938 130.8 -20.9 -45.7 -69.5 27.1 58.2 107.7 345 176 B K H <5S+ 0 0 152 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 -0.153 127.1 58.5-144.4 46.9 24.2 60.7 107.6 346 177 B L T ><5S+ 0 0 10 -4,-1.7 3,-1.8 -3,-0.1 4,-0.3 0.538 91.8 54.8-138.1 -52.8 21.6 59.7 105.0 347 178 B L G > S- 0 0 12 -59,-0.2 4,-1.8 -62,-0.1 5,-0.1 -0.102 83.7-112.2 -66.8 171.1 3.9 63.1 109.0 356 187 B N H > S+ 0 0 117 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.973 111.9 53.7 -69.2 -58.2 2.8 59.9 107.5 357 188 B A H > S+ 0 0 13 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.860 112.5 47.7 -45.4 -42.8 2.9 60.8 103.8 358 189 B A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.3 0.927 112.1 48.9 -65.1 -47.8 6.5 61.9 104.3 359 190 B K H X S+ 0 0 78 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.920 111.8 50.7 -59.1 -43.4 7.4 58.7 106.2 360 191 B Q H >X S+ 0 0 122 -4,-3.4 4,-1.9 2,-0.2 3,-0.9 0.991 112.8 42.4 -57.3 -66.1 5.8 56.7 103.4 361 192 B E H 3X S+ 0 0 38 -4,-2.5 4,-3.1 1,-0.3 5,-0.2 0.902 112.3 58.0 -45.3 -47.6 7.6 58.3 100.6 362 193 B A H 3X S+ 0 0 0 -4,-2.8 4,-3.7 1,-0.2 -1,-0.3 0.834 103.3 51.3 -53.4 -42.0 10.8 58.2 102.7 363 194 B E H X S+ 0 0 0 -4,-2.6 4,-3.6 -5,-0.2 3,-1.0 0.985 106.4 46.2 -60.7 -59.8 21.4 50.7 95.0 373 204 B I H 3X S+ 0 0 7 -4,-2.3 4,-1.2 1,-0.3 -1,-0.2 0.663 112.5 56.8 -57.8 -13.2 24.3 50.2 97.5 374 205 B E H 3X S+ 0 0 139 -4,-0.8 4,-1.3 2,-0.2 -1,-0.3 0.819 111.4 38.4 -86.2 -35.9 23.4 46.5 97.0 375 206 B Q H S+ 0 0 82 -4,-1.3 5,-1.2 1,-0.2 3,-0.5 0.891 111.3 49.1 -53.8 -39.1 28.0 43.2 93.8 379 210 B E H ><5S+ 0 0 2 -4,-1.3 3,-2.7 3,-0.2 -1,-0.2 0.909 101.9 61.6 -67.4 -39.5 29.5 45.2 90.9 380 211 B W H 3<5S+ 0 0 13 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.790 113.7 36.7 -55.9 -28.4 32.5 46.2 93.0 381 212 B N T 3<5S- 0 0 67 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 -0.008 119.1-111.9-111.3 23.1 33.3 42.5 93.4 382 213 B A T < 5 0 0 11 -3,-2.7 -3,-0.2 -5,-0.1 -344,-0.1 0.934 360.0 360.0 43.6 74.8 32.2 41.7 89.8 383 214 B Q < 0 0 143 -5,-1.2 -4,-0.1 -345,-0.0 -5,-0.0 0.859 360.0 360.0 -95.9 360.0 29.1 39.6 90.6