==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN STORAGE/TRANSPORT 03-APR-07 2PEG . COMPND 2 MOLECULE: HEMOGLOBIN SUBUNIT ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: TREMATOMUS BERNACCHII; . AUTHOR A.VERGARA,M.FRANZESE,A.MERLINO,L.VITAGLIANO,L.MAZZARELLA . 281 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14451.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 207 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 . 1 0.4 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 . 4 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 161 57.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 1 0 0 2 1 0 1 0 2 3 0 0 1 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 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 1 A S 0 0 145 0, 0.0 2,-0.5 0, 0.0 128,-0.1 0.000 360.0 360.0 360.0 152.6 4.3 -18.7 -4.7 2 2 A L - 0 0 30 72,-0.2 2,-0.1 126,-0.1 123,-0.0 -0.672 360.0-151.7 -82.8 124.1 8.0 -19.7 -4.7 3 3 A S > - 0 0 51 -2,-0.5 4,-2.7 1,-0.1 5,-0.2 -0.339 33.6-101.6 -85.9 171.4 9.1 -21.8 -7.6 4 4 A D H > S+ 0 0 133 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.909 127.4 54.7 -60.8 -33.3 12.0 -24.3 -7.5 5 5 A K H > S+ 0 0 167 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.909 108.7 47.1 -60.7 -46.5 14.0 -21.6 -9.2 6 6 A D H > S+ 0 0 9 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.892 112.1 50.4 -62.2 -44.3 13.2 -19.1 -6.4 7 7 A K H X S+ 0 0 33 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.930 110.7 48.2 -63.7 -43.0 14.0 -21.6 -3.7 8 8 A A H X S+ 0 0 58 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.2 0.913 111.6 50.5 -63.0 -40.8 17.3 -22.4 -5.2 9 9 A A H X S+ 0 0 32 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.914 111.4 47.7 -64.9 -41.6 18.2 -18.7 -5.6 10 10 A V H X S+ 0 0 3 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.926 112.9 48.1 -66.9 -44.4 17.3 -17.9 -2.0 11 11 A R H X S+ 0 0 109 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.907 112.9 48.9 -62.3 -40.8 19.3 -20.9 -0.7 12 12 A A H X S+ 0 0 46 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.907 113.7 46.0 -64.5 -42.9 22.4 -19.9 -2.8 13 13 A L H X S+ 0 0 7 -4,-2.6 4,-2.8 2,-0.2 3,-0.5 0.952 113.6 48.0 -65.1 -47.5 22.2 -16.3 -1.6 14 14 A W H X S+ 0 0 43 -4,-2.8 4,-2.8 1,-0.3 -1,-0.2 0.875 106.3 58.4 -61.2 -36.6 21.8 -17.3 2.0 15 15 A S H < S+ 0 0 103 -4,-2.1 -1,-0.3 -5,-0.3 4,-0.3 0.899 113.2 41.0 -56.3 -40.0 24.7 -19.7 1.6 16 16 A K H < S+ 0 0 117 -4,-1.4 3,-0.2 -3,-0.5 -2,-0.2 0.888 127.8 26.6 -78.4 -41.1 26.8 -16.6 0.6 17 17 A I H >< S+ 0 0 0 -4,-2.8 3,-2.5 1,-0.2 -3,-0.2 0.616 91.4 95.8-101.5 -11.0 25.6 -14.0 3.0 18 18 A G G >< S+ 0 0 22 -4,-2.8 3,-1.8 -5,-0.3 4,-0.2 0.730 73.5 69.5 -51.0 -32.0 24.5 -16.1 6.0 19 19 A K G 3 S+ 0 0 174 1,-0.3 3,-0.3 -4,-0.3 -1,-0.3 0.795 101.8 46.6 -58.4 -29.9 27.8 -15.7 7.8 20 20 A S G <> S+ 0 0 35 -3,-2.5 4,-2.7 1,-0.2 -1,-0.3 0.171 74.6 119.9 -99.2 18.9 26.9 -12.0 8.3 21 21 A A H <> S+ 0 0 13 -3,-1.8 4,-2.7 1,-0.2 5,-0.2 0.882 73.6 51.8 -51.3 -46.3 23.3 -12.6 9.6 22 22 A D H > S+ 0 0 78 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.929 112.2 44.7 -60.1 -46.3 23.9 -11.0 12.9 23 23 A A H > S+ 0 0 46 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.886 111.1 54.4 -66.1 -38.8 25.3 -7.8 11.4 24 24 A I H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.945 111.1 46.1 -60.4 -44.7 22.5 -7.7 8.8 25 25 A G H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 5,-0.3 0.900 109.8 51.3 -67.6 -40.6 19.9 -7.9 11.6 26 26 A N H X S+ 0 0 43 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.954 115.7 43.8 -59.3 -45.6 21.5 -5.2 13.8 27 27 A D H X S+ 0 0 25 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.901 114.1 48.5 -67.7 -41.7 21.6 -2.9 10.8 28 28 A A H X S+ 0 0 1 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.904 112.8 47.8 -66.9 -41.8 18.1 -3.6 9.5 29 29 A L H X S+ 0 0 2 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.889 110.7 52.2 -65.4 -41.4 16.5 -3.2 13.0 30 30 A S H X S+ 0 0 8 -4,-1.9 4,-1.8 -5,-0.3 -2,-0.2 0.904 112.1 45.9 -60.0 -48.0 18.5 0.1 13.5 31 31 A R H X S+ 0 0 4 -4,-2.2 4,-3.4 2,-0.2 5,-0.5 0.897 109.2 54.8 -63.6 -45.8 17.2 1.5 10.1 32 32 A M H X S+ 0 0 8 -4,-2.2 4,-3.0 1,-0.2 7,-0.3 0.968 108.8 47.1 -55.5 -51.9 13.7 0.5 10.7 33 33 A I H < S+ 0 0 5 -4,-2.3 7,-0.3 1,-0.2 -1,-0.2 0.884 119.1 40.2 -59.3 -39.7 13.4 2.3 14.0 34 34 A V H < S+ 0 0 64 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.924 122.4 37.7 -74.0 -48.5 15.0 5.4 12.6 35 35 A V H < S+ 0 0 25 -4,-3.4 -2,-0.2 1,-0.3 -3,-0.2 0.806 125.4 36.8 -80.3 -26.7 13.2 5.6 9.2 36 36 A Y S >< S- 0 0 40 -4,-3.0 3,-2.5 -5,-0.5 4,-0.3 -0.725 70.6-178.2-126.2 78.3 9.8 4.3 10.3 37 37 A P G > S+ 0 0 78 0, 0.0 3,-1.1 0, 0.0 4,-0.5 0.684 72.7 76.0 -52.7 -20.5 9.4 5.8 13.8 38 38 A Q G 3 S+ 0 0 104 1,-0.2 3,-0.2 2,-0.1 4,-0.2 0.686 91.6 58.5 -67.4 -11.7 6.0 4.1 14.3 39 39 A T G X S+ 0 0 1 -3,-2.5 3,-1.2 -7,-0.3 4,-0.3 0.694 83.1 79.9 -90.2 -16.2 8.0 1.0 15.0 40 40 A K G X S+ 0 0 94 -3,-1.1 3,-2.1 -7,-0.3 -1,-0.2 0.855 78.9 70.5 -59.9 -35.1 10.0 2.3 17.9 41 41 A T G > S+ 0 0 91 -4,-0.5 3,-1.3 1,-0.3 -1,-0.3 0.812 88.6 61.9 -55.3 -32.1 7.2 1.8 20.3 42 42 A Y G < S+ 0 0 67 -3,-1.2 -1,-0.3 1,-0.3 3,-0.2 0.675 109.9 40.8 -69.2 -14.1 7.5 -2.0 20.2 43 43 A F G X S+ 0 0 26 -3,-2.1 3,-1.7 -4,-0.3 -1,-0.3 0.208 78.5 111.2-119.5 17.5 11.0 -1.8 21.6 44 44 A S T < + 0 0 87 -3,-1.3 -1,-0.1 1,-0.3 -2,-0.1 0.604 64.9 72.2 -70.2 -11.4 10.5 0.9 24.2 45 45 A H T 3 S+ 0 0 138 -3,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.620 81.2 93.1 -77.9 -10.5 11.0 -1.5 27.0 46 46 A W S < S- 0 0 37 -3,-1.7 3,-0.2 1,-0.1 -3,-0.1 -0.621 80.7-133.0 -83.9 140.3 14.7 -1.6 26.1 47 47 A P S S+ 0 0 112 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.916 93.8 25.9 -57.5 -40.1 16.9 0.9 28.0 48 48 A D + 0 0 62 2,-0.1 7,-0.4 1,-0.0 8,-0.3 -0.964 56.9 173.1-135.3 122.9 18.5 2.0 24.7 49 49 A V + 0 0 24 -2,-0.5 -6,-0.1 -3,-0.2 -1,-0.0 -0.370 40.4 114.8-122.1 55.1 17.0 1.9 21.3 50 50 A T S > S- 0 0 72 1,-0.1 3,-1.9 -17,-0.0 6,-0.3 -0.806 81.5 -94.7-117.7 165.3 19.5 3.6 19.0 51 51 A P T 3 S+ 0 0 63 0, 0.0 -21,-0.1 0, 0.0 -20,-0.1 0.848 127.5 48.4 -44.7 -37.7 21.6 2.4 16.1 52 52 A G T 3 S+ 0 0 69 -22,-0.1 5,-0.1 4,-0.1 -4,-0.0 0.755 86.3 127.1 -75.5 -23.1 24.5 1.9 18.5 53 53 A S <> - 0 0 0 -3,-1.9 4,-1.7 1,-0.1 5,-0.1 0.124 58.1-142.9 -40.6 134.0 22.4 0.0 21.2 54 54 A P H > S+ 0 0 85 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.805 103.9 55.7 -68.4 -27.4 23.5 -3.3 22.6 55 55 A H H > S+ 0 0 62 -7,-0.4 4,-2.2 2,-0.2 5,-0.2 0.859 105.3 50.8 -69.3 -39.2 19.8 -4.4 22.7 56 56 A I H > S+ 0 0 1 -8,-0.3 4,-2.4 -6,-0.3 -1,-0.2 0.899 110.9 50.0 -62.8 -45.0 19.4 -3.7 19.1 57 57 A K H X S+ 0 0 122 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.920 111.5 46.4 -61.6 -49.5 22.4 -5.8 18.4 58 58 A A H X S+ 0 0 55 -4,-2.2 4,-1.1 1,-0.2 3,-0.5 0.919 115.6 45.6 -62.1 -44.0 21.3 -8.8 20.4 59 59 A H H X S+ 0 0 41 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.862 102.8 64.5 -70.4 -33.7 17.8 -8.7 18.9 60 60 A G H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.840 100.0 54.1 -55.5 -33.3 19.1 -8.3 15.4 61 61 A K H X S+ 0 0 81 -4,-1.1 4,-1.6 -3,-0.5 -1,-0.2 0.901 109.1 48.1 -67.6 -41.5 20.7 -11.8 15.8 62 62 A K H X S+ 0 0 135 -4,-1.1 4,-1.9 2,-0.2 -2,-0.2 0.907 108.8 52.6 -67.7 -40.0 17.3 -13.1 16.7 63 63 A V H X S+ 0 0 28 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.936 113.9 42.3 -59.8 -47.9 15.5 -11.5 13.7 64 64 A M H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.746 108.5 59.1 -74.2 -21.8 18.0 -12.9 11.2 65 65 A G H X S+ 0 0 38 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.886 105.4 50.2 -68.6 -36.9 17.9 -16.3 13.0 66 66 A G H X S+ 0 0 18 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.868 110.7 49.2 -64.4 -37.2 14.1 -16.2 12.2 67 67 A I H X S+ 0 0 15 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.929 110.0 50.9 -67.2 -41.0 15.0 -15.4 8.6 68 68 A A H X S+ 0 0 32 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.929 109.9 50.2 -61.4 -41.3 17.5 -18.3 8.6 69 69 A L H X S+ 0 0 62 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.942 108.1 53.2 -59.8 -46.3 14.6 -20.5 10.0 70 70 A A H < S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.912 107.0 51.7 -55.9 -42.4 12.4 -19.2 7.1 71 71 A V H >< S+ 0 0 12 -4,-2.5 3,-1.4 1,-0.2 -1,-0.2 0.943 111.3 46.9 -61.6 -45.9 15.1 -20.3 4.6 72 72 A S H 3< S+ 0 0 75 -4,-2.3 3,-0.3 1,-0.3 -1,-0.2 0.865 118.3 42.5 -64.6 -30.6 15.2 -23.8 6.1 73 73 A K T >< S+ 0 0 97 -4,-2.4 3,-2.7 1,-0.2 7,-0.3 0.139 76.5 126.4-100.4 18.4 11.4 -23.9 6.1 74 74 A I T < + 0 0 5 -3,-1.4 3,-0.5 1,-0.3 -1,-0.2 0.736 65.3 61.9 -50.5 -28.8 11.1 -22.4 2.6 75 75 A D T 3 S+ 0 0 98 -3,-0.3 -1,-0.3 1,-0.3 2,-0.1 0.723 123.1 15.8 -73.0 -19.2 8.9 -25.3 1.4 76 76 A D <> + 0 0 79 -3,-2.7 4,-2.6 -6,-0.2 -1,-0.3 -0.559 65.3 170.0-157.5 82.0 6.2 -24.5 3.9 77 77 A L H > S+ 0 0 20 -3,-0.5 4,-2.9 1,-0.2 5,-0.2 0.868 77.2 60.7 -64.4 -37.2 6.5 -21.1 5.4 78 78 A K H 4 S+ 0 0 104 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.941 113.2 35.0 -58.6 -50.3 3.1 -21.2 7.1 79 79 A T H >4 S+ 0 0 94 1,-0.2 3,-0.8 2,-0.2 4,-0.4 0.930 118.1 53.2 -71.5 -42.3 3.9 -24.3 9.2 80 80 A G H 3< S+ 0 0 22 -4,-2.6 3,-0.2 -7,-0.3 -2,-0.2 0.844 118.3 33.7 -64.2 -32.7 7.5 -23.3 9.7 81 81 A L T 3X S+ 0 0 3 -4,-2.9 4,-2.4 -5,-0.2 -1,-0.2 0.336 83.7 109.0-108.0 12.1 6.8 -19.8 11.0 82 82 A M H <> S+ 0 0 61 -3,-0.8 4,-2.5 -4,-0.5 5,-0.2 0.877 78.9 49.8 -54.0 -42.4 3.5 -20.5 12.8 83 83 A E H > S+ 0 0 173 -4,-0.4 4,-2.0 -3,-0.2 -1,-0.2 0.917 112.2 47.7 -69.1 -38.5 5.0 -20.1 16.3 84 84 A L H > S+ 0 0 47 -4,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.865 110.4 53.6 -69.0 -32.0 6.6 -16.8 15.4 85 85 A S H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.939 108.9 48.6 -64.0 -46.9 3.3 -15.7 13.9 86 86 A E H X>S+ 0 0 67 -4,-2.5 4,-2.8 1,-0.2 5,-0.9 0.902 111.6 50.7 -58.2 -41.4 1.5 -16.6 17.1 87 87 A Q H X>S+ 0 0 76 -4,-2.0 5,-2.8 3,-0.2 4,-0.7 0.905 113.2 42.4 -66.5 -43.2 4.0 -14.7 19.1 88 88 A H H <5S+ 0 0 43 -4,-2.2 6,-2.3 3,-0.2 5,-0.4 0.905 120.9 42.8 -72.1 -37.1 3.9 -11.5 17.1 89 89 A A H <5S+ 0 0 9 -4,-2.8 -2,-0.2 4,-0.2 -3,-0.2 0.945 129.4 19.5 -73.7 -50.5 0.0 -11.6 16.8 90 90 A Y H <5S+ 0 0 123 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.1 0.852 131.1 31.0 -93.7 -41.5 -0.9 -12.5 20.4 91 91 A K T < - 0 0 84 -2,-0.5 3,-1.8 1,-0.2 4,-0.1 -0.462 23.5-135.3 -61.4 126.6 0.7 -4.4 13.8 96 96 A P G > S+ 0 0 54 0, 0.0 3,-1.4 0, 0.0 4,-0.5 0.624 94.8 79.9 -61.2 -15.8 1.2 -6.7 10.7 97 97 A A G 3 S+ 0 0 42 1,-0.2 4,-0.5 2,-0.1 3,-0.3 0.733 85.8 64.8 -62.8 -20.9 1.7 -3.7 8.4 98 98 A N G <> S+ 0 0 16 -3,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.651 78.4 78.5 -81.8 -12.3 5.2 -3.5 9.7 99 99 A F H <> S+ 0 0 19 -3,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.939 95.1 48.2 -62.4 -43.9 6.5 -6.8 8.3 100 100 A K H > S+ 0 0 134 -4,-0.5 4,-2.0 -3,-0.3 -1,-0.2 0.817 108.4 57.4 -66.0 -26.2 6.9 -5.4 4.8 101 101 A I H > S+ 0 0 18 -4,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.951 108.4 43.6 -68.0 -48.1 8.8 -2.5 6.4 102 102 A L H X S+ 0 0 31 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.912 111.3 56.9 -64.7 -37.3 11.4 -4.6 8.1 103 103 A N H X S+ 0 0 18 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.924 106.6 48.4 -59.4 -45.5 11.7 -6.7 4.9 104 104 A H H X S+ 0 0 17 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.914 110.6 51.2 -62.1 -41.1 12.5 -3.6 2.9 105 105 A C H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.874 107.9 52.6 -64.5 -36.0 15.1 -2.6 5.5 106 106 A I H X S+ 0 0 3 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.926 109.2 49.4 -64.2 -43.6 16.6 -6.1 5.2 107 107 A L H X S+ 0 0 4 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.945 111.2 50.1 -59.6 -44.8 16.9 -5.7 1.4 108 108 A V H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.937 112.5 46.5 -58.4 -48.5 18.6 -2.3 1.8 109 109 A V H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.930 111.5 50.0 -61.6 -46.8 21.1 -3.8 4.3 110 110 A I H X S+ 0 0 3 -4,-2.7 4,-3.1 1,-0.2 -1,-0.2 0.920 110.6 52.4 -59.2 -39.7 21.9 -6.8 2.2 111 111 A S H < S+ 0 0 0 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.916 109.8 47.4 -63.8 -40.2 22.4 -4.4 -0.8 112 112 A T H < S+ 0 0 8 -4,-2.3 147,-0.2 1,-0.2 -1,-0.2 0.865 121.7 36.9 -68.7 -33.3 24.9 -2.2 1.2 113 113 A M H < S+ 0 0 46 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.775 128.3 27.5 -89.9 -30.2 26.8 -5.3 2.4 114 114 A F X + 0 0 16 -4,-3.1 4,-2.9 -5,-0.2 -1,-0.2 -0.430 61.8 155.3-132.4 60.8 26.8 -7.6 -0.6 115 115 A P T 4 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 140,-0.1 0.861 79.0 50.0 -54.7 -35.1 26.5 -5.4 -3.7 116 116 A K T 4 S+ 0 0 164 1,-0.2 3,-0.2 -3,-0.1 -2,-0.1 0.923 116.6 37.8 -71.6 -46.7 28.1 -8.2 -5.8 117 117 A E T 4 S+ 0 0 64 1,-0.2 2,-2.2 -7,-0.1 -1,-0.2 0.827 100.8 77.1 -74.8 -32.2 25.9 -11.0 -4.7 118 118 A F < + 0 0 0 -4,-2.9 -1,-0.2 -8,-0.2 137,-0.1 -0.393 66.7 162.2 -84.8 67.0 22.7 -9.1 -4.5 119 119 A T > - 0 0 51 -2,-2.2 4,-2.7 -3,-0.2 5,-0.1 -0.199 56.9 -99.0 -75.2 171.1 21.9 -9.0 -8.2 120 120 A P H > S+ 0 0 17 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.895 127.1 51.6 -60.6 -37.4 18.5 -8.2 -9.7 121 121 A E H > S+ 0 0 68 2,-0.2 4,-1.4 1,-0.2 5,-0.2 0.903 111.1 46.2 -68.8 -35.7 17.9 -11.9 -10.1 122 122 A A H > S+ 0 0 15 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.905 113.3 53.1 -66.8 -40.4 18.8 -12.6 -6.4 123 123 A H H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 5,-0.3 0.915 104.2 52.1 -62.6 -46.8 16.6 -9.6 -5.5 124 124 A V H X S+ 0 0 32 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.959 115.5 41.6 -59.7 -47.1 13.4 -10.8 -7.3 125 125 A S H X S+ 0 0 3 -4,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.910 115.7 49.3 -69.5 -37.6 13.5 -14.3 -5.6 126 126 A L H X S+ 0 0 12 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.871 110.6 50.9 -68.9 -35.5 14.4 -12.9 -2.2 127 127 A D H X S+ 0 0 30 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.904 110.5 47.6 -66.3 -43.0 11.6 -10.3 -2.5 128 128 A K H X S+ 0 0 83 -4,-2.4 4,-2.1 -5,-0.3 -2,-0.2 0.931 113.7 50.4 -61.3 -42.3 9.1 -13.1 -3.3 129 129 A F H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.942 110.6 47.4 -58.4 -51.6 10.5 -15.1 -0.4 130 130 A L H X S+ 0 0 2 -4,-3.0 4,-2.9 1,-0.2 -1,-0.2 0.877 110.0 53.4 -62.9 -34.8 10.2 -12.1 2.1 131 131 A S H X S+ 0 0 66 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.928 110.2 47.6 -62.8 -41.9 6.6 -11.5 0.9 132 132 A G H X S+ 0 0 23 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.892 110.7 51.8 -63.0 -39.0 5.9 -15.1 1.7 133 133 A V H X S+ 0 0 4 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.938 110.4 48.3 -63.8 -45.5 7.6 -14.7 5.1 134 134 A A H X S+ 0 0 16 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.907 111.8 49.1 -61.5 -41.2 5.4 -11.6 5.8 135 135 A L H < S+ 0 0 130 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.882 112.1 49.4 -66.2 -38.0 2.2 -13.5 4.7 136 136 A A H >< S+ 0 0 6 -4,-2.3 3,-1.5 1,-0.2 4,-0.3 0.890 109.3 51.0 -67.9 -40.5 3.3 -16.5 7.0 137 137 A L H 3< S+ 0 0 23 -4,-2.6 3,-0.4 1,-0.3 -1,-0.2 0.809 106.8 56.0 -67.8 -25.4 3.9 -14.1 9.9 138 138 A A T >< S+ 0 0 30 -4,-1.5 3,-1.9 -5,-0.2 4,-0.5 0.561 79.6 101.6 -81.1 -4.8 0.5 -12.7 9.3 139 139 A E G X S+ 0 0 68 -3,-1.5 3,-0.5 1,-0.3 -1,-0.2 0.837 83.1 40.8 -45.7 -48.5 -1.1 -16.2 9.6 140 140 A R G 3 S+ 0 0 81 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.1 0.321 93.1 88.7 -88.3 7.7 -2.4 -15.9 13.2 141 141 A Y G < 0 0 51 -3,-1.9 -1,-0.2 1,-0.1 -2,-0.1 0.814 360.0 360.0 -80.1 -30.3 -3.6 -12.4 12.8 142 142 A R < 0 0 305 -3,-0.5 -1,-0.1 -4,-0.5 0, 0.0 -0.974 360.0 360.0-162.5 360.0 -7.2 -12.9 11.6 143 !* 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 1 B V 0 0 79 0, 0.0 2,-0.6 0, 0.0 127,-0.0 0.000 360.0 360.0 360.0 149.9 7.0 18.2 4.1 145 2 B E - 0 0 169 0, 0.0 2,-0.1 0, 0.0 73,-0.0 -0.942 360.0-140.1-112.2 102.5 8.9 20.9 6.0 146 3 B W - 0 0 22 -2,-0.6 2,-0.2 71,-0.1 72,-0.0 -0.382 4.5-138.0 -69.7 138.5 12.6 20.1 5.2 147 4 B T > - 0 0 73 -2,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.569 26.1-114.0 -83.7 160.2 15.2 20.3 7.9 148 5 B D H > S+ 0 0 135 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.895 119.2 56.1 -61.1 -36.3 18.5 21.9 6.9 149 6 B K H > S+ 0 0 121 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.895 105.5 50.3 -63.5 -38.6 20.1 18.6 7.5 150 7 B E H > S+ 0 0 35 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.924 109.8 50.4 -64.4 -43.2 17.7 16.8 5.0 151 8 B R H X S+ 0 0 86 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.919 112.2 48.1 -61.0 -41.5 18.5 19.4 2.4 152 9 B S H X S+ 0 0 79 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.907 111.4 49.3 -67.3 -41.7 22.2 18.9 2.9 153 10 B I H X S+ 0 0 21 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.945 114.3 44.6 -61.7 -49.1 21.9 15.1 2.7 154 11 B I H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 5,-0.2 0.902 113.6 50.6 -64.7 -40.7 19.9 15.1 -0.5 155 12 B S H X S+ 0 0 70 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.935 112.1 47.5 -62.3 -45.5 22.1 17.7 -2.0 156 13 B D H X S+ 0 0 84 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.947 110.7 50.6 -60.8 -49.2 25.2 15.7 -1.2 157 14 B I H < S+ 0 0 7 -4,-2.7 3,-0.5 1,-0.2 4,-0.5 0.932 113.2 45.6 -55.0 -51.9 23.8 12.3 -2.5 158 15 B F H >< S+ 0 0 10 -4,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.820 109.1 54.8 -65.4 -30.7 22.8 13.9 -5.8 159 16 B S H 3< S+ 0 0 82 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.764 114.9 40.0 -74.9 -23.8 26.1 15.7 -6.3 160 17 B H T 3< S+ 0 0 121 -4,-1.5 2,-0.3 -3,-0.5 -1,-0.2 0.376 91.6 105.1-104.1 3.5 28.1 12.4 -5.9 161 18 B M < - 0 0 15 -3,-0.5 2,-0.9 -4,-0.5 3,-0.1 -0.676 65.1-140.2 -86.6 137.9 25.8 10.1 -7.8 162 19 B D >> - 0 0 94 -2,-0.3 4,-3.0 1,-0.2 3,-1.3 -0.857 16.0-165.8 -95.4 104.2 26.9 9.0 -11.3 163 20 B Y H 3> S+ 0 0 29 -2,-0.9 4,-2.4 1,-0.3 -1,-0.2 0.816 83.0 59.7 -59.8 -34.2 23.5 9.1 -13.2 164 21 B D H 34 S+ 0 0 103 1,-0.2 -1,-0.3 2,-0.2 40,-0.1 0.708 115.8 33.4 -69.7 -20.9 24.8 7.2 -16.1 165 22 B D H <> S+ 0 0 61 -3,-1.3 4,-1.3 2,-0.1 -2,-0.2 0.837 123.1 42.1 -98.4 -48.8 25.6 4.3 -13.9 166 23 B I H X S+ 0 0 1 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.880 109.1 58.4 -68.2 -39.6 22.9 4.5 -11.3 167 24 B G H X S+ 0 0 1 -4,-2.4 4,-2.1 -5,-0.3 5,-0.2 0.942 108.9 40.9 -57.9 -55.7 20.0 5.3 -13.7 168 25 B P H > S+ 0 0 20 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.892 115.5 53.2 -62.3 -37.4 20.2 2.2 -15.9 169 26 B K H X S+ 0 0 109 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.931 108.9 47.9 -63.6 -45.7 20.9 -0.0 -12.9 170 27 B A H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.915 116.0 43.6 -63.3 -45.0 17.8 1.2 -11.0 171 28 B L H X S+ 0 0 6 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.908 114.6 47.7 -69.8 -43.8 15.5 0.8 -14.0 172 29 B S H X S+ 0 0 3 -4,-2.8 4,-1.5 -5,-0.2 -1,-0.2 0.905 112.8 50.9 -65.4 -34.6 16.9 -2.6 -15.1 173 30 B R H X S+ 0 0 21 -4,-2.3 4,-2.7 -5,-0.3 3,-0.4 0.938 110.1 49.5 -64.6 -43.8 16.6 -3.8 -11.5 174 31 B C H X S+ 0 0 4 -4,-2.4 4,-2.4 1,-0.2 7,-0.3 0.907 108.9 52.8 -59.2 -43.1 13.0 -2.5 -11.5 175 32 B L H < S+ 0 0 3 -4,-2.6 7,-0.3 1,-0.2 -1,-0.2 0.773 115.1 40.8 -66.6 -26.2 12.2 -4.4 -14.7 176 33 B I H < S+ 0 0 16 -4,-1.5 -2,-0.2 -3,-0.4 -1,-0.2 0.833 118.4 43.8 -88.7 -37.4 13.5 -7.7 -13.3 177 34 B V H < S+ 0 0 5 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.844 131.8 23.1 -77.6 -33.5 12.1 -7.5 -9.8 178 35 B Y S >< S+ 0 0 26 -4,-2.4 3,-2.6 -5,-0.3 -1,-0.3 -0.675 78.5 179.9-131.0 72.9 8.6 -6.2 -11.0 179 36 B P G > + 0 0 55 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.632 67.3 78.9 -58.2 -14.3 8.6 -7.5 -14.5 180 37 B W G > S+ 0 0 118 1,-0.3 3,-0.8 2,-0.2 4,-0.2 0.708 84.7 66.6 -66.7 -12.2 5.2 -6.2 -15.4 181 38 B T G X S+ 0 0 7 -3,-2.6 3,-1.3 -7,-0.3 4,-0.3 0.638 79.0 81.4 -80.0 -12.5 7.0 -2.8 -15.9 182 39 B Q G X S+ 0 0 74 -3,-1.6 3,-2.6 -7,-0.3 4,-0.6 0.844 70.6 80.4 -60.1 -32.0 8.9 -4.2 -18.8 183 40 B R G X S+ 0 0 142 -3,-0.8 3,-0.7 -4,-0.3 -1,-0.2 0.823 88.3 57.1 -47.4 -30.7 5.8 -3.6 -21.0 184 41 B H G < S+ 0 0 42 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.685 107.5 43.5 -77.6 -16.8 6.8 0.1 -21.3 185 42 B F G < S+ 0 0 46 -3,-2.6 -1,-0.2 -4,-0.3 -2,-0.2 0.293 90.5 75.8-113.8 8.6 10.2 -0.5 -22.7 186 43 B S < 0 0 109 -3,-0.7 -1,-0.2 1,-0.6 -2,-0.1 -0.113 360.0 360.0 -98.4 26.9 9.4 -3.1 -25.2 187 44 B G 0 0 91 -3,-0.1 -1,-0.6 0, 0.0 -2,-0.1 0.134 360.0 360.0 111.4 360.0 8.2 0.2 -26.7 188 ! 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 0.0 189 50 B N > 0 0 124 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 176.3 15.8 -11.9 -20.3 190 51 B A H > + 0 0 25 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.928 360.0 48.9 -54.4 -49.6 17.6 -10.3 -17.4 191 52 B E H > S+ 0 0 154 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.937 112.7 49.4 -55.0 -49.7 20.9 -10.1 -19.3 192 53 B A H > S+ 0 0 55 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.894 111.5 48.3 -54.7 -49.0 19.1 -8.5 -22.2 193 54 B I H >< S+ 0 0 18 -4,-2.7 3,-0.9 1,-0.2 -2,-0.2 0.937 106.9 56.0 -60.7 -48.8 17.3 -6.0 -20.0 194 55 B I H 3< S+ 0 0 81 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.834 115.4 37.3 -57.6 -31.9 20.4 -4.9 -18.2 195 56 B G H 3< S+ 0 0 65 -4,-1.5 2,-0.3 -5,-0.2 -1,-0.2 0.543 84.0 124.3 -99.3 -2.9 22.1 -4.0 -21.5 196 57 B N S+ 0 0 74 -2,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.763 94.3 55.5 -61.5 -30.3 20.0 1.0 -24.4 198 59 B N H > S+ 0 0 112 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.916 108.7 47.2 -69.7 -42.9 16.3 2.1 -24.3 199 60 B V H > S+ 0 0 3 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.943 113.3 49.8 -61.8 -44.5 16.1 1.0 -20.7 200 61 B A H X S+ 0 0 24 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.900 107.3 53.9 -61.2 -43.3 19.3 2.8 -20.0 201 62 B A H X S+ 0 0 49 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.923 111.5 43.3 -59.6 -47.6 18.2 6.0 -21.6 202 63 B H H X S+ 0 0 43 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.891 110.0 57.2 -69.0 -35.3 15.0 6.3 -19.6 203 64 B G H X S+ 0 0 2 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.882 109.1 46.7 -59.3 -37.9 16.9 5.3 -16.4 204 65 B I H X S+ 0 0 39 -4,-2.0 4,-2.1 1,-0.2 5,-0.2 0.909 110.1 53.0 -71.5 -39.6 19.2 8.2 -16.9 205 66 B K H X S+ 0 0 142 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.873 104.0 57.7 -60.0 -41.4 16.2 10.5 -17.7 206 67 B V H X S+ 0 0 29 -4,-2.7 4,-1.4 2,-0.2 -1,-0.2 0.940 107.6 46.2 -55.5 -47.7 14.6 9.5 -14.4 207 68 B L H X S+ 0 0 1 -4,-1.5 4,-1.2 1,-0.2 -2,-0.2 0.887 113.2 47.5 -65.0 -40.7 17.7 10.7 -12.4 208 69 B H H X S+ 0 0 103 -4,-2.1 4,-0.9 1,-0.2 -1,-0.2 0.865 108.8 57.6 -67.1 -32.7 17.9 14.0 -14.3 209 70 B G H < S+ 0 0 8 -4,-2.4 4,-0.5 -5,-0.2 3,-0.4 0.854 103.1 52.0 -62.7 -33.1 14.2 14.3 -13.7 210 71 B L H >X S+ 0 0 11 -4,-1.4 4,-1.9 1,-0.2 3,-0.8 0.798 96.6 71.6 -73.4 -27.7 14.7 14.0 -9.9 211 72 B D H 3X S+ 0 0 58 -4,-1.2 4,-2.4 1,-0.3 -1,-0.2 0.857 90.9 54.8 -60.5 -35.7 17.3 16.8 -10.1 212 73 B R H 3X S+ 0 0 116 -4,-0.9 4,-1.1 -3,-0.4 -1,-0.3 0.826 108.2 51.5 -69.3 -24.7 14.7 19.5 -10.8 213 74 B G H <4 S+ 0 0 0 -3,-0.8 3,-0.4 -4,-0.5 6,-0.2 0.905 107.9 50.6 -72.9 -40.1 13.0 18.3 -7.6 214 75 B V H >< S+ 0 0 27 -4,-1.9 3,-0.6 1,-0.2 -2,-0.2 0.861 105.7 58.2 -62.9 -36.8 16.3 18.6 -5.7 215 76 B K H 3< S+ 0 0 187 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.800 121.5 23.3 -63.9 -35.6 16.6 22.2 -7.1 216 77 B N T >< + 0 0 58 -4,-1.1 3,-2.3 -3,-0.4 -1,-0.3 -0.596 67.0 172.5-134.7 82.7 13.3 23.3 -5.5 217 78 B M T < S+ 0 0 13 -3,-0.6 3,-0.4 1,-0.3 -1,-0.1 0.663 78.3 55.8 -64.2 -15.1 12.4 21.1 -2.7 218 79 B D T 3 S+ 0 0 107 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.473 107.3 46.9 -99.6 5.6 9.5 23.2 -1.7 219 80 B N S <> S+ 0 0 86 -3,-2.3 4,-2.2 -6,-0.2 -1,-0.2 -0.086 70.2 126.9-132.3 38.8 7.7 23.1 -5.0 220 81 B I H > S+ 0 0 6 -3,-0.4 4,-1.9 1,-0.2 5,-0.1 0.908 70.3 51.3 -65.9 -47.7 7.8 19.3 -5.9 221 82 B A H 4 S+ 0 0 72 1,-0.2 4,-0.5 2,-0.2 3,-0.3 0.961 115.5 45.0 -59.8 -41.3 4.2 18.6 -6.5 222 83 B A H >4 S+ 0 0 57 1,-0.2 3,-1.1 2,-0.2 4,-0.4 0.913 109.0 57.2 -66.4 -39.9 4.0 21.6 -8.9 223 84 B T H 3< S+ 0 0 26 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.806 111.1 40.7 -58.8 -36.7 7.3 20.6 -10.6 224 85 B Y T 3X S+ 0 0 3 -4,-1.9 4,-2.5 -3,-0.3 -1,-0.2 0.354 83.0 102.9 -98.0 5.7 6.1 17.1 -11.5 225 86 B A H <> S+ 0 0 47 -3,-1.1 4,-2.0 -4,-0.5 -1,-0.2 0.927 86.6 42.6 -55.3 -50.4 2.6 18.0 -12.6 226 87 B D H > S+ 0 0 135 -4,-0.4 4,-2.1 -3,-0.2 -1,-0.2 0.901 113.6 49.2 -64.9 -43.6 3.4 17.9 -16.3 227 88 B L H > S+ 0 0 44 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.827 108.8 57.2 -64.3 -30.7 5.5 14.7 -16.1 228 89 B S H X S+ 0 0 4 -4,-2.5 4,-2.3 1,-0.2 5,-0.3 0.955 107.2 46.3 -64.6 -47.4 2.7 13.2 -14.1 229 90 B T H X>S+ 0 0 40 -4,-2.0 4,-2.1 2,-0.2 5,-0.7 0.883 110.2 53.8 -61.0 -41.3 0.2 13.8 -16.9 230 91 B L H X>S+ 0 0 61 -4,-2.1 5,-2.0 3,-0.2 4,-1.7 0.967 110.5 45.4 -57.4 -57.2 2.5 12.5 -19.5 231 92 B H H <5S+ 0 0 26 -4,-2.2 6,-3.0 3,-0.2 -2,-0.2 0.853 124.2 33.4 -59.6 -37.5 3.1 9.1 -17.7 232 93 B S H X5S+ 0 0 38 -4,-2.3 4,-1.3 4,-0.2 -2,-0.2 0.973 126.6 35.7 -82.0 -58.7 -0.6 8.6 -17.0 233 94 B E H <5S+ 0 0 131 -4,-2.1 -3,-0.2 -5,-0.3 -2,-0.2 0.887 134.2 19.5 -61.5 -48.6 -2.3 10.2 -20.0 234 95 B K T < - 0 0 85 -2,-0.4 3,-1.6 1,-0.1 4,-0.4 -0.425 17.8-129.0 -64.8 135.5 0.2 2.5 -13.5 239 100 B P T >> S+ 0 0 73 0, 0.0 3,-0.9 0, 0.0 4,-0.5 0.799 105.4 65.9 -61.9 -21.5 0.6 4.8 -10.6 240 101 B D H >> S+ 0 0 89 1,-0.2 4,-1.5 2,-0.1 3,-0.7 0.807 87.3 72.8 -66.5 -25.0 1.8 1.9 -8.4 241 102 B N H <> S+ 0 0 11 -3,-1.6 4,-2.5 1,-0.2 -1,-0.2 0.779 84.6 63.8 -61.1 -29.7 4.9 1.6 -10.6 242 103 B F H <4 S+ 0 0 23 -3,-0.9 -1,-0.2 -4,-0.4 -2,-0.1 0.887 104.0 46.9 -65.0 -37.4 6.6 4.8 -9.2 243 104 B K H << S+ 0 0 106 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.908 111.1 51.5 -69.6 -42.1 6.9 3.4 -5.7 244 105 B L H < 0 0 19 -4,-1.5 4,-1.5 1,-0.2 -2,-0.2 0.955 360.0 360.0 -59.1 -48.2 8.3 0.1 -7.1 245 106 B L < 0 0 30 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.902 360.0 360.0 -63.4 360.0 10.9 2.0 -9.1 246 ! 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 0.0 247 108 B D > 0 0 34 0, 0.0 4,-2.1 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 -35.3 12.5 1.2 -3.9 248 109 B C H > + 0 0 0 -4,-1.5 4,-2.5 2,-0.2 5,-0.2 0.880 360.0 51.1 -71.1 -37.4 14.8 0.0 -6.7 249 110 B I H > S+ 0 0 8 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.945 111.7 48.1 -62.4 -47.6 16.6 3.4 -6.9 250 111 B T H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.919 112.3 48.7 -58.6 -43.7 17.1 3.3 -3.1 251 112 B I H X S+ 0 0 2 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.891 112.3 46.9 -67.8 -37.9 18.4 -0.3 -3.3 252 113 B V H X S+ 0 0 9 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.914 113.3 49.4 -70.8 -40.0 20.9 0.5 -6.1 253 114 B L H X S+ 0 0 0 -4,-2.7 4,-3.4 1,-0.2 5,-0.3 0.900 108.0 53.9 -61.7 -43.0 22.1 3.6 -4.3 254 115 B A H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.2 7,-0.2 0.905 108.4 50.6 -57.3 -41.6 22.5 1.6 -1.1 255 116 B A H < S+ 0 0 26 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.870 114.4 43.5 -65.5 -38.3 24.7 -0.8 -3.1 256 117 B K H < S+ 0 0 102 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.943 120.4 39.8 -72.1 -50.6 26.8 2.1 -4.4 257 118 B M H >< S+ 0 0 35 -4,-3.4 3,-2.0 1,-0.2 -2,-0.2 0.689 84.5 179.9 -75.4 -19.6 27.1 4.0 -1.2 258 119 B G G >< S- 0 0 14 -4,-2.1 3,-2.3 -5,-0.3 -1,-0.2 -0.222 70.5 -2.4 53.8-133.5 27.6 0.9 1.0 259 120 B H G 3 S+ 0 0 116 1,-0.3 -1,-0.3 -147,-0.2 -2,-0.1 0.711 124.4 72.0 -67.7 -11.8 28.0 1.9 4.7 260 121 B A G < S+ 0 0 60 -3,-2.0 2,-2.0 1,-0.2 -1,-0.3 0.637 77.6 85.2 -71.6 -15.8 27.8 5.6 3.9 261 122 B F S < S+ 0 0 0 -3,-2.3 -1,-0.2 -7,-0.2 -149,-0.1 -0.478 73.4 177.6 -84.0 68.8 24.1 4.9 3.2 262 123 B T > - 0 0 59 -2,-2.0 4,-2.8 1,-0.1 5,-0.2 -0.105 46.0 -99.5 -68.1 171.0 23.3 5.3 6.9 263 124 B A H > S+ 0 0 15 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.919 126.2 51.0 -56.7 -43.6 19.9 5.2 8.4 264 125 B E H > S+ 0 0 93 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.868 111.5 48.4 -64.2 -35.6 19.7 9.0 8.4 265 126 B T H > S+ 0 0 18 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.913 110.8 49.0 -68.3 -46.0 20.7 9.0 4.8 266 127 B Q H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.3 0.913 110.3 53.3 -60.4 -44.8 18.2 6.4 3.8 267 128 B G H X S+ 0 0 21 -4,-2.8 4,-2.0 -5,-0.2 -2,-0.2 0.922 112.1 42.6 -58.0 -45.8 15.4 8.4 5.7 268 129 B A H X S+ 0 0 3 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.936 117.2 47.8 -67.7 -43.6 16.1 11.7 3.9 269 130 B F H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.945 113.6 45.6 -63.7 -48.8 16.5 10.0 0.5 270 131 B Q H X S+ 0 0 29 -4,-3.0 4,-2.4 -5,-0.2 -1,-0.2 0.858 110.3 55.1 -63.6 -35.4 13.4 7.9 0.8 271 132 B K H X S+ 0 0 65 -4,-2.0 4,-1.8 -5,-0.3 -1,-0.2 0.937 108.7 47.8 -64.8 -42.0 11.4 10.9 2.1 272 133 B F H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.934 113.2 47.9 -62.6 -46.2 12.4 12.9 -1.0 273 134 B L H X S+ 0 0 18 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.909 107.5 56.9 -63.4 -35.6 11.4 10.0 -3.3 274 135 B A H < S+ 0 0 61 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.920 106.6 48.5 -58.6 -45.2 8.1 9.6 -1.5 275 136 B V H < S+ 0 0 44 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.907 114.0 46.1 -63.1 -41.0 7.2 13.2 -2.2 276 137 B V H < 0 0 4 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.921 360.0 360.0 -66.3 -44.2 8.1 12.8 -5.9 277 138 B V < 0 0 22 -4,-2.9 4,-2.8 2,-0.2 5,-0.2 0.880 360.0 360.0 -60.0 360.0 6.2 9.5 -6.2 278 ! 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 0.0 279 140 B A 0 0 27 0, 0.0 -2,-0.2 0, 0.0 -3,-0.1 0.000 360.0 360.0 360.0 -40.9 3.3 14.0 -7.3 280 141 B L + 0 0 23 -4,-2.6 -3,-0.2 1,-0.2 -48,-0.1 0.926 360.0 40.2 -68.3 -45.7 3.8 11.6 -10.2 281 142 B G S S- 0 0 13 -4,-2.8 -1,-0.2 -5,-0.2 -4,-0.1 0.566 108.7-129.6 -80.6 -8.2 1.2 9.1 -9.1 282 143 B K - 0 0 94 -5,-0.2 2,-0.1 1,-0.1 -2,-0.1 0.954 32.7-166.2 58.0 56.4 -1.0 12.0 -8.2 283 144 B Q - 0 0 111 -6,-0.1 2,-0.4 1,-0.1 -1,-0.1 -0.430 23.8-107.2 -72.2 147.9 -1.9 10.9 -4.6 284 145 B Y 0 0 228 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.0 -0.641 360.0 360.0 -77.9 125.8 -4.8 12.6 -2.7 285 146 B H 0 0 218 -2,-0.4 -1,-0.2 0, 0.0 -2,-0.0 0.340 360.0 360.0-155.4 360.0 -3.6 14.8 0.1