==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-NOV-07 2ZCQ . COMPND 2 MOLECULE: DEHYDROSQUALENE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR C.I.LIU,W.Y.JENG,A.H.WANG,E.OLDFIELD . 284 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13779.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 77.8 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 . 7 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 171 60.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 0 2 3 0 0 0 3 0 2 1 0 2 0 0 0 0 1 1 1 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 M 0 0 153 0, 0.0 2,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 117.8 8.4 50.1 65.1 2 2 A T >> - 0 0 86 1,-0.1 4,-1.2 4,-0.0 3,-0.8 -0.418 360.0-110.7 -75.8 154.5 5.9 47.8 63.4 3 3 A M H 3> S+ 0 0 132 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.845 117.1 60.1 -55.2 -40.8 7.2 45.0 61.1 4 4 A M H 3> S+ 0 0 47 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.913 104.0 53.5 -54.6 -38.6 5.8 46.6 58.0 5 5 A D H <> S+ 0 0 53 -3,-0.8 4,-2.6 1,-0.2 -1,-0.3 0.870 103.1 57.8 -62.3 -36.1 8.1 49.6 58.9 6 6 A M H X S+ 0 0 96 -4,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.937 105.7 48.7 -60.3 -44.4 10.9 47.1 59.1 7 7 A N H X S+ 0 0 15 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.904 110.6 50.0 -63.2 -40.4 10.3 46.1 55.5 8 8 A F H X S+ 0 0 2 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.889 107.4 55.5 -65.8 -35.4 10.2 49.7 54.4 9 9 A K H X S+ 0 0 132 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.867 104.6 52.9 -64.2 -34.5 13.5 50.3 56.2 10 10 A Y H X S+ 0 0 30 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.869 109.1 50.0 -67.5 -34.2 15.1 47.5 54.3 11 11 A C H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.914 111.2 48.0 -69.0 -42.6 13.9 49.2 51.1 12 12 A H H X S+ 0 0 35 -4,-2.3 4,-3.5 2,-0.2 5,-0.2 0.930 108.0 55.1 -61.6 -48.6 15.3 52.4 52.2 13 13 A K H X S+ 0 0 131 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.916 109.3 48.6 -51.5 -45.2 18.6 50.8 53.1 14 14 A I H X S+ 0 0 5 -4,-1.9 4,-2.2 1,-0.2 5,-0.3 0.938 112.8 46.4 -63.5 -45.1 18.8 49.4 49.6 15 15 A M H X S+ 0 0 1 -4,-2.5 4,-2.0 1,-0.2 8,-0.3 0.923 108.0 56.2 -64.5 -42.6 18.0 52.8 48.0 16 16 A K H < S+ 0 0 107 -4,-3.5 -1,-0.2 1,-0.2 -2,-0.2 0.918 112.6 43.4 -52.7 -46.0 20.6 54.6 50.2 17 17 A K H < S+ 0 0 151 -4,-1.9 3,-0.3 -5,-0.2 -1,-0.2 0.860 118.0 39.0 -71.0 -44.4 23.3 52.2 49.0 18 18 A H H < S+ 0 0 53 -4,-2.2 2,-0.2 1,-0.2 -1,-0.2 0.658 128.0 26.2 -87.3 -12.6 22.7 52.0 45.3 19 19 A S X + 0 0 10 -4,-2.0 4,-2.0 -5,-0.3 -1,-0.2 -0.635 49.1 170.9-153.9 93.6 21.8 55.6 44.8 20 20 A K H > S+ 0 0 128 -3,-0.3 4,-2.1 -2,-0.2 -1,-0.1 0.831 87.5 55.7 -67.2 -29.9 23.0 58.4 47.1 21 21 A S H > S+ 0 0 16 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.983 114.0 33.4 -65.3 -61.6 21.5 60.9 44.6 22 22 A F H > S+ 0 0 34 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.832 119.2 53.8 -66.1 -35.0 17.9 59.7 44.4 23 23 A S H X S+ 0 0 6 -4,-2.0 4,-1.9 -8,-0.3 -1,-0.2 0.945 107.4 52.4 -63.1 -46.2 18.1 58.7 48.1 24 24 A Y H < S+ 0 0 55 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.879 117.6 37.1 -57.0 -42.6 19.3 62.2 48.8 25 25 A A H >< S+ 0 0 0 -4,-1.9 3,-1.7 1,-0.1 -2,-0.2 0.978 116.6 45.6 -75.0 -60.1 16.3 63.8 46.9 26 26 A F H >< S+ 0 0 18 -4,-2.7 3,-2.2 1,-0.3 -3,-0.2 0.742 96.1 71.3 -61.0 -29.0 13.4 61.5 47.7 27 27 A D T 3< S+ 0 0 37 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.1 0.648 87.5 70.5 -64.0 -8.3 13.9 61.2 51.4 28 28 A L T < S+ 0 0 77 -3,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.620 80.6 97.7 -82.2 -12.0 12.8 64.8 51.5 29 29 A L S < S- 0 0 4 -3,-2.2 5,-0.1 1,-0.1 208,-0.0 -0.293 90.4 -85.0 -74.3 156.4 9.2 63.8 50.7 30 30 A P >> - 0 0 58 0, 0.0 4,-2.0 0, 0.0 3,-0.7 -0.285 51.6 -96.2 -60.9 153.8 6.5 63.3 53.3 31 31 A E H 3> S+ 0 0 95 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.811 118.7 47.5 -33.5 -68.2 6.4 59.9 55.0 32 32 A D H 3> S+ 0 0 131 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.868 115.9 48.1 -51.3 -40.0 3.8 58.0 53.0 33 33 A Q H <> S+ 0 0 35 -3,-0.7 4,-1.8 2,-0.2 -1,-0.2 0.889 110.7 45.3 -73.3 -40.6 5.3 59.1 49.8 34 34 A R H X S+ 0 0 66 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.922 109.2 57.6 -71.7 -37.1 9.0 58.3 50.4 35 35 A K H X S+ 0 0 34 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.935 107.8 48.7 -52.3 -48.0 8.0 54.9 51.8 36 36 A A H X S+ 0 0 4 -4,-1.6 4,-2.4 -5,-0.3 -1,-0.2 0.896 111.3 48.6 -59.5 -44.0 6.3 54.2 48.5 37 37 A V H X S+ 0 0 5 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.886 109.1 53.3 -64.8 -41.0 9.4 55.4 46.5 38 38 A W H X S+ 0 0 15 -4,-2.9 4,-3.5 2,-0.2 -2,-0.2 0.942 112.2 45.4 -56.6 -52.1 11.8 53.2 48.7 39 39 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.926 115.4 44.9 -58.2 -51.7 9.7 50.1 47.9 40 40 A I H X S+ 0 0 1 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.861 114.9 49.5 -63.5 -35.0 9.4 50.8 44.2 41 41 A Y H X S+ 0 0 30 -4,-2.5 4,-3.1 -5,-0.2 -2,-0.2 0.968 109.5 50.9 -68.6 -49.8 13.0 51.6 44.0 42 42 A A H X S+ 0 0 0 -4,-3.5 4,-2.6 1,-0.2 5,-0.3 0.929 109.5 51.8 -53.1 -47.3 14.0 48.4 45.9 43 43 A V H X S+ 0 0 1 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.962 112.8 44.2 -55.0 -53.2 11.8 46.4 43.5 44 44 A C H X S+ 0 0 16 -4,-2.1 4,-2.9 1,-0.2 -1,-0.2 0.888 111.3 54.1 -61.4 -39.3 13.5 47.9 40.5 45 45 A R H X S+ 0 0 53 -4,-3.1 4,-3.3 1,-0.2 5,-0.3 0.897 107.3 50.2 -61.1 -41.5 16.9 47.6 42.0 46 46 A K H X S+ 0 0 37 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.926 112.8 47.9 -62.3 -43.3 16.5 43.9 42.6 47 47 A I H >< S+ 0 0 0 -4,-2.1 3,-0.5 -5,-0.3 4,-0.3 0.988 115.0 43.7 -59.7 -59.3 15.3 43.5 39.0 48 48 A D H >X S+ 0 0 31 -4,-2.9 4,-2.1 1,-0.3 3,-0.9 0.880 119.8 41.5 -52.5 -49.5 18.2 45.5 37.5 49 49 A D H 3X>S+ 0 0 22 -4,-3.3 5,-2.2 1,-0.2 4,-1.0 0.715 97.4 73.2 -76.6 -21.0 20.9 43.8 39.7 50 50 A S H <<5S+ 0 0 1 -4,-2.1 6,-3.0 -3,-0.5 10,-0.3 0.541 120.4 18.9 -69.0 -0.8 19.5 40.3 39.4 51 51 A I H <45S+ 0 0 8 -3,-0.9 -2,-0.2 -4,-0.3 4,-0.2 0.530 120.1 57.0-137.8 -28.9 20.9 40.6 35.9 52 52 A D H <5S+ 0 0 51 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.1 0.517 133.2 3.1 -90.1 -3.1 23.5 43.3 35.7 53 53 A V T <5S+ 0 0 88 -4,-1.0 -3,-0.2 -5,-0.2 -4,-0.1 0.473 140.0 37.9-146.4 -38.1 25.6 41.8 38.5 54 54 A Y S - 0 0 61 -6,-3.0 4,-1.6 1,-0.1 3,-0.4 -0.796 34.9-176.1-146.3 101.3 20.4 35.1 37.2 57 57 A I H > S+ 0 0 58 -2,-0.3 4,-1.1 1,-0.2 5,-0.1 0.662 83.0 70.0 -70.7 -15.3 17.1 34.8 35.3 58 58 A Q H > S+ 0 0 121 2,-0.2 4,-1.4 1,-0.2 3,-0.5 0.959 103.2 42.0 -64.7 -48.8 15.8 32.3 37.8 59 59 A F H >> S+ 0 0 39 -3,-0.4 4,-2.8 1,-0.3 3,-0.9 0.957 108.7 59.7 -59.6 -52.9 15.5 35.1 40.4 60 60 A L H 3X S+ 0 0 1 -4,-1.6 4,-2.2 1,-0.3 -1,-0.3 0.781 107.0 47.5 -48.5 -29.2 14.1 37.4 37.8 61 61 A N H 3X S+ 0 0 59 -4,-1.1 4,-1.8 -3,-0.5 -1,-0.3 0.820 107.6 55.9 -81.5 -31.7 11.3 34.9 37.4 62 62 A Q H < + 0 0 129 -4,-2.5 3,-1.4 -5,-0.2 -1,-0.2 -0.563 63.3 171.0-134.3 69.8 -4.4 39.3 44.7 74 74 A P T 3 S+ 0 0 44 0, 0.0 -1,-0.1 0, 0.0 21,-0.1 0.753 81.0 47.7 -49.2 -29.9 -3.5 42.6 46.5 75 75 A Y T 3 S+ 0 0 152 2,-0.1 2,-0.3 -5,-0.1 -5,-0.1 -0.209 92.1 85.9-113.7 43.2 -5.2 41.4 49.6 76 76 A E S < S- 0 0 122 -3,-1.4 2,-0.3 -6,-0.1 -3,-0.1 -0.969 80.6-106.4-136.2 148.6 -3.9 37.9 50.3 77 77 A Y - 0 0 122 -2,-0.3 2,-0.3 2,-0.0 -2,-0.1 -0.599 40.3-164.7 -76.1 136.5 -0.8 36.8 52.1 78 78 A H - 0 0 17 -2,-0.3 2,-1.0 6,-0.1 -12,-0.0 -0.917 26.3-138.7-122.6 150.0 1.8 35.6 49.6 79 79 A H - 0 0 158 -2,-0.3 -2,-0.0 -13,-0.0 -13,-0.0 -0.783 36.8-149.2-102.9 82.3 5.0 33.5 50.2 80 80 A F - 0 0 20 -2,-1.0 4,-0.3 1,-0.1 -17,-0.1 -0.270 7.2-145.2 -57.9 135.3 7.0 35.6 47.7 81 81 A Q S S+ 0 0 93 -19,-0.4 -18,-0.2 2,-0.1 -1,-0.1 0.750 84.5 34.5 -74.6 -25.5 9.8 33.7 46.0 82 82 A S S S- 0 0 27 -20,-0.4 2,-0.3 1,-0.1 -19,-0.1 0.899 127.5 -11.9 -95.1 -81.4 12.5 36.4 45.7 83 83 A D > - 0 0 18 1,-0.1 4,-1.6 -21,-0.1 3,-0.4 -0.741 54.5-163.8-135.1 89.6 12.8 39.0 48.6 84 84 A R H > S+ 0 0 102 -2,-0.3 4,-2.0 -4,-0.3 5,-0.2 0.705 85.1 56.3 -36.6 -45.3 9.8 38.9 51.0 85 85 A R H > S+ 0 0 114 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.987 109.1 43.6 -59.3 -61.0 10.6 42.3 52.6 86 86 A I H > S+ 0 0 4 -3,-0.4 4,-3.1 1,-0.2 -2,-0.2 0.879 115.5 48.8 -50.0 -47.4 10.5 44.3 49.4 87 87 A M H X S+ 0 0 2 -4,-1.6 4,-3.4 2,-0.2 -1,-0.2 0.852 109.2 52.5 -65.0 -36.9 7.3 42.6 48.1 88 88 A M H X S+ 0 0 20 -4,-2.0 4,-2.3 -3,-0.3 -1,-0.2 0.926 112.2 45.7 -64.6 -43.7 5.6 43.1 51.4 89 89 A A H X S+ 0 0 0 -4,-2.3 4,-3.2 2,-0.2 -2,-0.2 0.934 115.3 47.4 -63.9 -46.1 6.4 46.8 51.2 90 90 A L H X S+ 0 0 0 -4,-3.1 4,-3.1 1,-0.2 -2,-0.2 0.958 111.9 49.4 -61.4 -48.7 5.3 46.9 47.5 91 91 A Q H X S+ 0 0 8 -4,-3.4 4,-1.1 1,-0.2 -1,-0.2 0.900 111.1 50.9 -57.6 -39.2 2.1 45.0 48.3 92 92 A H H >< S+ 0 0 54 -4,-2.3 3,-0.8 -5,-0.2 -2,-0.2 0.952 110.2 48.8 -64.3 -46.8 1.5 47.5 51.1 93 93 A V H >X S+ 0 0 8 -4,-3.2 4,-2.6 1,-0.2 3,-2.0 0.938 108.3 55.0 -56.3 -45.1 2.0 50.4 48.7 94 94 A A H 3< S+ 0 0 21 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.748 96.0 64.6 -63.8 -22.0 -0.3 48.9 46.2 95 95 A Q T << S+ 0 0 51 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.370 118.3 26.6 -81.5 7.4 -3.2 48.6 48.7 96 96 A H T <4 S+ 0 0 130 -3,-2.0 2,-0.3 1,-0.3 -2,-0.2 0.538 121.3 45.3-134.0 -34.7 -3.2 52.4 48.9 97 97 A K S < S- 0 0 80 -4,-2.6 2,-0.3 -5,-0.2 -1,-0.3 -0.843 83.6-104.7-119.3 154.4 -1.9 53.7 45.6 98 98 A N - 0 0 114 -2,-0.3 2,-0.4 45,-0.1 46,-0.1 -0.604 38.4-163.2 -75.7 133.2 -2.5 52.9 41.9 99 99 A I - 0 0 27 -2,-0.3 2,-1.4 -5,-0.2 3,-0.2 -0.973 19.5-138.3-124.1 134.8 0.4 50.9 40.5 100 100 A A >> + 0 0 28 -2,-0.4 3,-1.2 1,-0.2 4,-1.0 -0.725 24.3 179.8 -88.7 88.1 1.1 50.4 36.8 101 101 A F H >> S+ 0 0 24 -2,-1.4 4,-2.3 1,-0.3 3,-1.1 0.921 75.8 64.0 -59.4 -40.4 2.0 46.7 36.9 102 102 A Q H 3> S+ 0 0 108 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.795 97.4 60.1 -53.1 -28.0 2.6 46.6 33.2 103 103 A S H <> S+ 0 0 6 -3,-1.2 4,-2.0 2,-0.2 -1,-0.3 0.898 103.2 46.5 -69.4 -39.3 5.4 49.0 33.8 104 104 A F H < S+ 0 0 102 -4,-2.1 3,-2.0 -5,-0.3 4,-0.3 0.999 97.3 53.9 -59.9 -62.9 16.0 40.2 30.6 113 113 A K H 3< S+ 0 0 144 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.710 92.2 75.3 -43.0 -25.6 17.2 41.2 27.1 114 114 A D T 3< S+ 0 0 5 -4,-0.7 -1,-0.3 -3,-0.2 3,-0.3 0.289 85.2 69.6 -73.1 12.0 20.3 42.4 28.9 115 115 A Q S < S+ 0 0 68 -3,-2.0 2,-1.7 1,-0.3 -1,-0.2 0.876 106.6 28.6 -92.1 -69.2 21.2 38.8 29.1 116 116 A H S S- 0 0 139 -4,-0.3 -1,-0.3 2,-0.0 2,-0.1 -0.653 98.7-160.3 -91.4 82.2 22.0 37.9 25.5 117 117 A F + 0 0 43 -2,-1.7 2,-0.4 -3,-0.3 -3,-0.1 -0.398 18.8 177.2 -68.6 137.0 23.1 41.5 24.8 118 118 A T - 0 0 104 -2,-0.1 -2,-0.0 -5,-0.1 63,-0.0 -0.981 32.1-110.5-143.0 124.3 23.3 42.9 21.3 119 119 A M - 0 0 52 -2,-0.4 2,-0.5 1,-0.1 3,-0.1 0.152 35.8-101.4 -48.1 166.5 24.2 46.4 20.4 120 120 A F - 0 0 19 64,-0.4 66,-2.6 62,-0.4 67,-0.3 -0.835 18.8-158.5 -98.7 132.5 21.7 48.9 19.1 121 121 A E S S+ 0 0 103 -2,-0.5 66,-2.5 64,-0.2 67,-0.3 0.959 79.3 24.0 -70.3 -51.2 21.8 49.6 15.4 122 122 A T S >> S- 0 0 60 64,-0.1 4,-1.6 63,-0.1 3,-1.0 -0.769 77.7-115.8-120.2 160.7 20.1 52.9 15.9 123 123 A D H 3> S+ 0 0 12 -2,-0.3 4,-3.9 1,-0.3 5,-0.2 0.761 112.7 69.4 -58.7 -25.9 19.5 55.5 18.5 124 124 A A H 3> S+ 0 0 68 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.915 102.0 42.3 -60.5 -43.6 15.8 54.5 18.3 125 125 A E H <> S+ 0 0 81 -3,-1.0 4,-1.9 2,-0.2 -1,-0.2 0.856 113.5 53.1 -70.4 -36.4 16.6 51.2 19.9 126 126 A L H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.962 111.7 46.6 -59.4 -50.9 18.9 53.0 22.4 127 127 A F H X S+ 0 0 69 -4,-3.9 4,-1.3 1,-0.2 -2,-0.2 0.872 110.3 51.5 -59.2 -40.3 16.0 55.3 23.2 128 128 A G H X S+ 0 0 43 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.821 107.2 53.6 -69.6 -30.7 13.5 52.4 23.5 129 129 A Y H X S+ 0 0 23 -4,-1.9 4,-2.1 1,-0.2 5,-0.3 0.935 105.1 54.9 -68.2 -42.6 15.9 50.7 25.9 130 130 A C H X>S+ 0 0 2 -4,-2.4 5,-1.7 1,-0.2 4,-1.2 0.850 108.0 52.0 -58.8 -29.6 15.9 54.0 27.9 131 131 A Y H ><>S+ 0 0 58 -4,-1.3 5,-2.3 3,-0.2 3,-0.5 0.982 109.3 45.1 -69.6 -53.6 12.2 53.6 28.0 132 132 A G H 3<5S+ 0 0 2 -4,-2.3 -22,-0.2 1,-0.2 -2,-0.2 0.786 120.7 41.4 -61.8 -25.0 12.0 50.1 29.3 133 133 A V H 3<5S- 0 0 16 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.661 138.6 -3.0 -98.0 -15.0 14.6 50.7 31.9 134 134 A A T XX5S+ 0 0 12 -4,-1.2 4,-2.1 -3,-0.5 3,-0.7 0.601 117.9 65.4-145.0 -45.2 13.6 54.1 33.2 135 135 A G H 3> S+ 0 0 35 -3,-0.7 4,-2.7 -6,-0.3 -1,-0.2 0.877 105.5 52.1 -70.8 -39.7 9.9 53.7 36.4 138 138 A G H X S+ 0 0 10 -4,-2.1 4,-1.2 1,-0.2 -2,-0.2 0.897 109.2 52.3 -61.3 -37.6 8.8 57.3 36.0 139 139 A E H < S+ 0 0 21 -4,-1.9 3,-0.3 -5,-0.2 -2,-0.2 0.908 109.3 46.6 -67.6 -41.4 5.4 55.8 35.0 140 140 A V H < S+ 0 0 3 -4,-2.0 4,-0.4 1,-0.2 -2,-0.2 0.924 114.1 50.3 -64.9 -40.4 5.2 53.6 38.2 141 141 A L H >X S+ 0 0 22 -4,-2.7 4,-1.7 1,-0.2 3,-0.9 0.712 90.1 84.5 -69.1 -20.3 6.3 56.6 40.3 142 142 A T H 3X S+ 0 0 0 -4,-1.2 4,-0.8 -3,-0.3 3,-0.5 0.917 84.7 50.8 -53.1 -55.4 3.7 59.0 38.8 143 143 A P H 34 S+ 0 0 1 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.807 113.8 51.8 -53.6 -25.4 0.6 58.1 41.0 144 144 A I H <4 S+ 0 0 2 -3,-0.9 -2,-0.2 -4,-0.4 -3,-0.1 0.848 115.3 34.9 -77.8 -38.9 3.0 58.7 43.9 145 145 A L H < S+ 0 0 10 -4,-1.7 89,-2.2 -3,-0.5 2,-0.3 0.192 116.4 56.8-102.3 12.9 4.4 62.1 43.0 146 146 A S < - 0 0 5 -4,-0.8 87,-0.1 87,-0.2 3,-0.1 -0.872 51.1-159.6-140.7 172.0 1.3 63.6 41.5 147 147 A D S S+ 0 0 113 85,-0.4 2,-1.0 -2,-0.3 -1,-0.1 0.552 93.5 57.2-117.1 -36.9 -2.4 64.3 42.1 148 148 A H - 0 0 125 84,-0.4 2,-2.7 -6,-0.1 5,-0.3 -0.662 66.6-174.3-101.3 74.7 -3.3 64.5 38.4 149 149 A E + 0 0 72 -2,-1.0 2,-0.2 -3,-0.1 84,-0.0 -0.481 36.3 142.5 -70.6 81.3 -2.3 61.1 37.1 150 150 A T S > S- 0 0 58 -2,-2.7 4,-2.6 82,-0.1 3,-0.3 -0.707 70.7 -92.7-117.9 171.4 -3.2 62.2 33.6 151 151 A H H > S+ 0 0 145 -2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.915 125.0 53.1 -50.0 -48.1 -1.6 61.6 30.2 152 152 A Q H > S+ 0 0 98 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.892 110.2 47.2 -59.3 -39.4 0.5 64.8 30.5 153 153 A T H > S+ 0 0 1 -5,-0.3 4,-2.8 -3,-0.3 3,-0.3 0.965 113.5 46.7 -68.5 -48.0 1.9 63.7 33.9 154 154 A Y H X S+ 0 0 58 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.903 112.4 51.8 -58.5 -40.9 2.7 60.2 32.8 155 155 A D H X S+ 0 0 38 -4,-2.8 4,-1.8 -5,-0.3 -1,-0.2 0.826 112.6 44.4 -65.6 -34.7 4.4 61.5 29.7 156 156 A V H X S+ 0 0 0 -4,-1.7 4,-3.3 -3,-0.3 5,-0.2 0.951 113.1 49.2 -74.8 -50.0 6.5 64.0 31.6 157 157 A A H X S+ 0 0 3 -4,-2.8 4,-3.2 1,-0.2 -2,-0.2 0.919 112.4 51.8 -51.9 -46.5 7.6 61.5 34.3 158 158 A R H X S+ 0 0 57 -4,-2.6 4,-2.9 -5,-0.3 -1,-0.2 0.940 110.7 44.8 -57.4 -53.3 8.4 59.1 31.5 159 159 A R H X S+ 0 0 75 -4,-1.8 4,-3.1 2,-0.2 5,-0.3 0.925 111.3 53.9 -60.6 -42.2 10.6 61.5 29.6 160 160 A L H X S+ 0 0 21 -4,-3.3 4,-3.4 1,-0.2 5,-0.3 0.985 110.6 48.7 -51.2 -55.6 12.2 62.6 32.9 161 161 A G H X S+ 0 0 8 -4,-3.2 4,-1.9 1,-0.2 -2,-0.2 0.877 111.4 47.2 -49.9 -48.9 13.0 58.9 33.3 162 162 A E H X S+ 0 0 58 -4,-2.9 4,-1.6 2,-0.2 -1,-0.2 0.885 113.9 48.8 -64.6 -37.8 14.4 58.4 29.9 163 163 A S H X S+ 0 0 2 -4,-3.1 4,-1.9 2,-0.2 5,-0.3 0.932 108.4 52.0 -66.9 -48.8 16.5 61.5 30.2 164 164 A L H X S+ 0 0 22 -4,-3.4 4,-2.0 -5,-0.3 -1,-0.2 0.906 109.9 51.3 -57.0 -35.8 17.9 60.5 33.6 165 165 A Q H X S+ 0 0 20 -4,-1.9 4,-2.5 -5,-0.3 -1,-0.2 0.840 104.1 56.0 -70.6 -34.1 18.8 57.1 32.1 166 166 A L H X S+ 0 0 4 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.880 109.9 46.5 -63.3 -39.2 20.7 58.8 29.1 167 167 A I H X S+ 0 0 0 -4,-1.9 4,-1.4 2,-0.2 5,-0.2 0.919 108.7 56.4 -66.4 -42.4 22.8 60.6 31.7 168 168 A N H >X S+ 0 0 31 -4,-2.0 4,-1.8 1,-0.3 3,-0.8 0.937 109.9 44.4 -54.4 -47.8 23.2 57.3 33.5 169 169 A I H 3< S+ 0 0 3 -4,-2.5 4,-0.4 1,-0.2 -1,-0.3 0.813 106.4 62.4 -65.9 -31.0 24.6 55.8 30.3 170 170 A L H 3< S+ 0 0 1 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.762 109.6 39.9 -69.2 -22.0 26.8 58.9 29.8 171 171 A R H << S+ 0 0 26 -4,-1.4 3,-0.4 -3,-0.8 4,-0.3 0.813 112.8 54.2 -92.3 -39.0 28.6 58.2 33.0 172 172 A D X + 0 0 11 -4,-1.8 4,-3.9 -5,-0.2 5,-0.4 0.220 64.9 116.0 -86.9 13.9 29.0 54.5 32.8 173 173 A V H > S+ 0 0 13 -4,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.943 86.7 38.9 -47.7 -59.2 30.6 54.0 29.4 174 174 A G H > S+ 0 0 3 -3,-0.4 4,-3.5 87,-0.3 5,-0.3 0.952 116.9 48.6 -54.7 -57.4 33.7 52.5 30.9 175 175 A E H > S+ 0 0 48 -4,-0.3 4,-1.3 1,-0.3 -1,-0.2 0.864 115.4 47.4 -48.2 -43.6 31.9 50.5 33.6 176 176 A D H <>S+ 0 0 26 -4,-3.9 5,-3.3 2,-0.2 -1,-0.3 0.837 110.6 51.1 -68.2 -38.4 29.6 49.3 30.8 177 177 A F H ><5S+ 0 0 48 -4,-2.7 3,-2.4 -5,-0.4 -2,-0.2 0.942 106.5 53.2 -68.8 -44.3 32.6 48.5 28.5 178 178 A E H 3<5S+ 0 0 107 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.900 110.1 50.0 -54.0 -38.0 34.3 46.5 31.3 179 179 A N T 3<5S- 0 0 91 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.289 125.1-107.1 -82.3 7.1 31.0 44.5 31.5 180 180 A E T < 5S+ 0 0 171 -3,-2.4 2,-0.4 1,-0.2 -3,-0.2 0.848 79.2 122.9 69.8 37.8 31.0 44.0 27.8 181 181 A R < - 0 0 51 -5,-3.3 2,-0.5 -8,-0.2 -1,-0.2 -0.989 36.0-177.0-137.3 130.4 28.2 46.5 26.9 182 182 A I - 0 0 33 -2,-0.4 -62,-0.4 1,-0.1 -9,-0.0 -0.992 1.1-178.4-123.2 122.6 28.1 49.5 24.7 183 183 A Y + 0 0 16 -2,-0.5 -1,-0.1 -14,-0.1 3,-0.1 0.632 54.1 98.1 -97.4 -17.0 24.9 51.5 24.6 184 184 A F S S- 0 0 3 -15,-0.1 -64,-0.4 1,-0.1 2,-0.1 -0.432 87.2-105.5 -63.3 149.3 25.8 54.2 22.0 185 185 A S > - 0 0 0 1,-0.1 4,-2.0 -66,-0.1 -64,-0.2 -0.409 12.0-128.3 -79.0 160.9 24.3 52.9 18.7 186 186 A K H > S+ 0 0 107 -66,-2.6 4,-3.4 2,-0.2 5,-0.4 0.878 112.3 57.9 -71.7 -37.5 26.5 51.5 15.9 187 187 A Q H > S+ 0 0 52 -66,-2.5 4,-2.6 -67,-0.3 5,-0.2 0.985 114.9 35.6 -52.9 -58.7 24.9 53.9 13.6 188 188 A R H > S+ 0 0 36 -67,-0.3 4,-1.1 1,-0.2 -1,-0.2 0.807 116.5 54.7 -69.1 -25.8 26.0 56.7 15.8 189 189 A L H <>S+ 0 0 15 -4,-2.0 5,-2.2 2,-0.2 -1,-0.2 0.868 113.1 42.4 -73.6 -35.3 29.3 55.0 16.7 190 190 A K H ><5S+ 0 0 132 -4,-3.4 3,-3.0 3,-0.2 -2,-0.2 0.952 109.1 57.8 -72.3 -53.3 30.2 54.7 13.0 191 191 A Q H 3<5S+ 0 0 90 -4,-2.6 -1,-0.2 -5,-0.4 -2,-0.2 0.769 112.4 41.6 -49.0 -32.0 29.0 58.1 12.1 192 192 A Y T 3<5S- 0 0 54 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.331 108.6-126.4-101.8 9.2 31.4 59.6 14.6 193 193 A E T < 5 + 0 0 144 -3,-3.0 2,-0.3 1,-0.2 -3,-0.2 0.956 59.6 140.5 46.1 66.3 34.2 57.3 13.7 194 194 A V < - 0 0 21 -5,-2.2 2,-0.4 13,-0.1 -1,-0.2 -0.989 39.4-160.4-138.2 147.1 34.8 56.0 17.2 195 195 A D > - 0 0 85 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.999 9.4-154.2-126.7 131.1 35.6 52.7 18.7 196 196 A I H > S+ 0 0 2 -2,-0.4 4,-2.6 2,-0.2 -1,-0.1 0.925 96.1 50.8 -70.8 -45.7 34.9 52.2 22.4 197 197 A A H > S+ 0 0 35 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.910 114.2 46.9 -56.7 -42.4 37.5 49.5 22.9 198 198 A E H > S+ 0 0 84 2,-0.2 4,-1.2 1,-0.2 3,-0.5 0.913 112.1 47.3 -67.8 -46.3 40.1 51.7 21.2 199 199 A V H X S+ 0 0 1 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.891 105.6 62.6 -63.1 -35.5 39.2 54.9 23.2 200 200 A Y H < S+ 0 0 49 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.843 112.8 35.3 -56.1 -38.1 39.3 52.7 26.3 201 201 A Q H < S+ 0 0 128 -4,-1.1 -2,-0.2 -3,-0.5 -3,-0.1 0.941 127.4 29.6 -75.3 -84.8 43.0 52.0 25.7 202 202 A N H < S- 0 0 118 -4,-1.2 -2,-0.2 1,-0.2 -3,-0.2 0.335 111.1-116.3 -62.1 2.5 44.5 55.2 24.2 203 203 A G < - 0 0 30 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.1 -0.084 47.0 -35.5 86.2 172.4 42.1 57.6 26.0 204 204 A V + 0 0 51 55,-0.2 2,-0.2 -4,-0.1 56,-0.1 0.046 55.7 175.0 -60.3 177.5 39.5 60.0 24.8 205 205 A N > - 0 0 54 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 -0.743 48.2 -83.0-160.0-157.0 39.9 62.0 21.6 206 206 A N H > S+ 0 0 120 -2,-0.2 4,-2.2 2,-0.2 5,-0.2 0.715 120.3 61.1 -99.7 -22.2 37.6 64.4 19.8 207 207 A H H > S+ 0 0 80 2,-0.2 4,-2.3 3,-0.2 5,-0.1 0.950 113.0 39.4 -64.2 -48.7 35.6 61.8 17.9 208 208 A Y H > S+ 0 0 2 2,-0.2 4,-4.2 1,-0.2 5,-0.4 0.983 114.6 51.7 -63.8 -59.6 34.4 60.4 21.1 209 209 A I H X S+ 0 0 32 -4,-1.1 4,-2.0 1,-0.2 -1,-0.2 0.841 111.9 47.5 -49.2 -39.8 34.0 63.8 22.9 210 210 A D H X S+ 0 0 88 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.967 115.4 44.9 -65.3 -51.8 31.9 65.0 20.0 211 211 A L H >X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 3,-0.7 0.958 112.3 51.5 -54.5 -52.8 29.8 61.9 20.0 212 212 A W H 3X S+ 0 0 0 -4,-4.2 4,-2.3 1,-0.3 -1,-0.2 0.875 112.1 48.0 -52.4 -38.8 29.6 62.0 23.8 213 213 A E H 3X S+ 0 0 48 -4,-2.0 4,-2.6 -5,-0.4 -1,-0.3 0.759 101.3 63.9 -74.8 -26.4 28.4 65.6 23.5 214 214 A Y H X S+ 0 0 37 -4,-1.7 4,-2.3 2,-0.2 3,-0.7 0.977 112.9 51.1 -54.7 -61.7 19.9 65.4 23.7 219 219 A A H 3X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.3 -2,-0.2 0.846 113.0 45.6 -40.9 -53.8 19.8 64.5 27.4 220 220 A E H 3X S+ 0 0 52 -4,-2.9 4,-2.4 2,-0.2 -1,-0.3 0.797 110.2 53.9 -62.7 -37.0 20.0 68.2 28.5 221 221 A K H < S+ 0 0 13 -4,-2.1 3,-2.2 1,-0.2 4,-0.2 0.936 103.7 54.4 -53.2 -46.7 11.7 71.2 34.1 228 228 A D H >< S+ 0 0 123 -4,-2.2 3,-0.5 1,-0.3 -1,-0.2 0.935 113.1 42.5 -51.4 -48.2 9.3 73.6 32.3 229 229 A Q G >< S+ 0 0 58 -4,-1.5 3,-2.0 1,-0.2 -1,-0.3 0.229 79.7 117.8 -84.6 17.4 6.5 71.1 32.8 230 230 A I G X + 0 0 7 -3,-2.2 3,-2.0 1,-0.3 -1,-0.2 0.742 58.4 73.5 -58.6 -25.7 7.5 70.3 36.4 231 231 A K G < S+ 0 0 156 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.621 71.9 83.6 -66.9 -9.5 4.2 71.6 37.9 232 232 A V G < S+ 0 0 16 -3,-2.0 -84,-0.4 -80,-0.1 -85,-0.4 0.703 87.5 75.0 -65.9 -10.8 2.4 68.6 36.5 233 233 A F S < S- 0 0 6 -3,-2.0 -87,-0.2 -4,-0.2 5,-0.1 -0.671 102.2 -82.6-100.5 156.7 3.8 67.1 39.8 234 234 A S > - 0 0 5 -89,-2.2 4,-2.9 -2,-0.2 -1,-0.2 -0.058 41.7-111.9 -50.6 156.0 2.5 67.7 43.3 235 235 A I T 4 S+ 0 0 107 1,-0.2 -1,-0.1 2,-0.2 -2,-0.1 0.914 120.3 43.8 -60.0 -46.4 3.7 70.9 45.1 236 236 A E T > S+ 0 0 70 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.849 114.7 51.6 -68.4 -31.5 5.8 69.0 47.6 237 237 A A H > S+ 0 0 0 1,-0.2 4,-3.5 2,-0.1 5,-0.3 0.909 95.1 72.1 -71.5 -40.3 7.0 66.7 44.8 238 238 A Q H X S+ 0 0 24 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.855 99.7 39.8 -41.6 -61.6 8.2 69.5 42.5 239 239 A P H > S+ 0 0 22 0, 0.0 4,-3.5 0, 0.0 5,-0.2 0.936 118.2 49.2 -60.0 -46.5 11.3 70.8 44.3 240 240 A I H X S+ 0 0 15 -4,-0.9 4,-3.1 2,-0.2 -2,-0.2 0.939 112.4 47.4 -56.8 -48.1 12.3 67.3 45.2 241 241 A I H X S+ 0 0 2 -4,-3.5 4,-2.8 1,-0.2 -1,-0.2 0.913 112.9 50.3 -62.0 -40.2 11.9 66.1 41.6 242 242 A E H X S+ 0 0 7 -4,-2.8 4,-3.8 -5,-0.3 5,-0.3 0.943 112.1 45.6 -62.7 -46.3 13.8 69.2 40.5 243 243 A L H X S+ 0 0 2 -4,-3.5 4,-3.4 2,-0.2 5,-0.3 0.916 111.8 53.1 -63.5 -40.1 16.7 68.5 43.0 244 244 A A H X S+ 0 0 3 -4,-3.1 4,-1.4 -5,-0.2 -2,-0.2 0.941 116.0 40.3 -58.7 -47.1 16.6 64.8 41.9 245 245 A A H X S+ 0 0 1 -4,-2.8 4,-3.2 2,-0.2 -2,-0.2 0.910 117.8 44.4 -71.0 -44.8 17.0 65.8 38.3 246 246 A R H X S+ 0 0 67 -4,-3.8 4,-1.9 1,-0.2 -2,-0.2 0.928 112.9 53.9 -67.6 -37.5 19.5 68.7 38.8 247 247 A I H < S+ 0 0 0 -4,-3.4 -1,-0.2 -5,-0.3 -2,-0.2 0.860 115.9 39.7 -61.3 -32.9 21.5 66.5 41.2 248 248 A Y H >< S+ 0 0 10 -4,-1.4 3,-1.6 -5,-0.3 -2,-0.2 0.887 112.1 53.7 -83.4 -39.9 21.6 63.8 38.5 249 249 A I H >< S+ 0 0 20 -4,-3.2 3,-1.9 1,-0.3 4,-0.5 0.753 93.4 72.5 -66.9 -24.1 22.1 66.1 35.5 250 250 A E T >X S+ 0 0 39 -4,-1.9 4,-1.4 1,-0.3 3,-0.6 0.748 79.2 79.3 -58.7 -25.3 25.1 67.6 37.3 251 251 A I H <> S+ 0 0 4 -3,-1.6 4,-1.6 1,-0.2 -1,-0.3 0.721 82.9 62.3 -57.4 -22.9 26.8 64.3 36.5 252 252 A L H <> S+ 0 0 0 -3,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.942 102.2 48.2 -70.4 -45.6 27.4 65.6 32.9 253 253 A D H <> S+ 0 0 82 -3,-0.6 4,-3.1 -4,-0.5 -2,-0.2 0.817 111.4 53.5 -61.2 -32.9 29.6 68.4 34.2 254 254 A E H X S+ 0 0 31 -4,-1.4 4,-1.4 2,-0.2 -1,-0.2 0.826 106.1 49.7 -72.8 -35.7 31.5 65.8 36.3 255 255 A V H <>S+ 0 0 5 -4,-1.6 5,-3.3 -3,-0.2 6,-0.5 0.904 114.1 48.8 -68.9 -38.1 32.2 63.6 33.4 256 256 A R H ><5S+ 0 0 53 -4,-2.1 3,-3.2 3,-0.2 -2,-0.2 0.988 107.2 52.1 -62.2 -60.1 33.5 66.7 31.6 257 257 A Q H 3<5S+ 0 0 156 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.803 110.1 50.1 -45.4 -36.3 35.7 67.8 34.5 258 258 A A T ><5S- 0 0 36 -4,-1.4 3,-0.5 -5,-0.1 -1,-0.3 0.142 122.6-108.1 -92.4 19.4 37.3 64.4 34.6 259 259 A N T < 5 - 0 0 116 -3,-3.2 -55,-0.2 1,-0.2 -3,-0.2 0.837 65.2 -62.8 57.1 42.4 37.9 64.6 30.8 260 260 A Y T 3 > - 0 0 123 -2,-0.6 4,-2.0 1,-0.2 3,-1.6 -0.041 20.5-118.2 -45.2 140.9 29.8 64.9 46.4 270 270 A K H 3> S+ 0 0 146 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.832 115.8 61.7 -52.1 -30.0 27.1 64.9 49.0 271 271 A R H 3> S+ 0 0 161 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.826 103.3 46.9 -67.8 -31.0 28.3 68.5 49.7 272 272 A K H <> S+ 0 0 69 -3,-1.6 4,-3.1 2,-0.2 5,-0.4 0.876 106.0 58.7 -76.3 -35.0 27.4 69.7 46.2 273 273 A K H X S+ 0 0 13 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.889 107.9 48.4 -57.4 -35.8 24.0 67.8 46.5 274 274 A A H X S+ 0 0 34 -4,-1.6 4,-2.1 -5,-0.2 -1,-0.2 0.906 109.4 51.7 -69.8 -39.7 23.6 70.2 49.5 275 275 A K H X S+ 0 0 80 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.919 113.3 43.6 -62.0 -46.4 24.6 73.2 47.4 276 276 A L H X S+ 0 0 9 -4,-3.1 4,-1.2 2,-0.2 5,-0.3 0.875 108.2 58.5 -65.7 -40.1 22.1 72.3 44.6 277 277 A F H X S+ 0 0 59 -4,-2.1 4,-2.3 -5,-0.4 3,-0.5 0.932 108.9 48.7 -54.6 -41.9 19.5 71.6 47.3 278 278 A H H X S+ 0 0 143 -4,-2.1 4,-1.0 1,-0.2 -2,-0.2 0.963 106.1 52.0 -60.7 -59.7 20.2 75.2 48.3 279 279 A E H X S+ 0 0 107 -4,-2.2 4,-0.6 1,-0.2 -1,-0.2 0.626 117.1 42.1 -55.1 -17.2 19.9 76.9 44.9 280 280 A I H X S+ 0 0 4 -4,-1.2 4,-1.0 -3,-0.5 -1,-0.2 0.819 104.7 59.4 -99.1 -42.6 16.5 75.2 44.4 281 281 A N H < S+ 0 0 72 -4,-2.3 -2,-0.2 -5,-0.3 -3,-0.1 0.602 100.2 60.8 -63.5 -13.7 14.9 75.6 47.8 282 282 A S H < S+ 0 0 86 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.965 100.9 50.8 -71.0 -68.4 15.3 79.3 47.4 283 283 A K H < 0 0 124 -4,-0.6 -2,-0.2 1,-0.3 -1,-0.2 0.716 360.0 360.0 -37.2 -27.8 13.0 79.2 44.3 284 284 A Y < 0 0 92 -4,-1.0 -1,-0.3 -45,-0.0 -2,-0.1 -0.521 360.0 360.0-118.3 360.0 10.7 77.3 46.6