==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 22-DEC-10 3ASX . COMPND 2 MOLECULE: SQUALENE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.SHIMIZU,M.SUZUKI,S.KATAKURA,K.YAMAZAKI,N.HIGASHIHASHI,M.IC . 335 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14996.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 259 77.3 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 . 9 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 14.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 192 57.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 1 3 1 0 0 2 1 1 0 3 1 0 1 0 2 0 1 2 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 36 A L 0 0 221 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -13.6 -0.5 12.1 47.9 2 37 A S > - 0 0 49 1,-0.1 4,-0.8 0, 0.0 5,-0.1 -0.628 360.0-109.6-122.8 175.4 -2.6 9.1 46.6 3 38 A S H > S+ 0 0 108 -2,-0.2 4,-0.8 2,-0.2 3,-0.1 0.953 117.5 30.5 -62.0 -55.5 -5.2 6.3 47.3 4 39 A S H > S+ 0 0 17 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.628 112.4 63.1 -89.1 -16.7 -2.8 3.3 47.0 5 40 A L H > S+ 0 0 13 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.762 101.7 54.3 -72.6 -27.6 0.4 5.1 48.1 6 41 A K H X S+ 0 0 171 -4,-0.8 4,-2.0 2,-0.2 -2,-0.2 0.877 107.4 48.6 -72.4 -37.0 -1.3 5.6 51.5 7 42 A T H X S+ 0 0 33 -4,-0.8 4,-2.5 2,-0.2 -2,-0.2 0.805 108.9 55.7 -69.2 -31.2 -1.9 1.8 51.7 8 43 A C H X S+ 0 0 0 -4,-1.1 4,-2.7 2,-0.2 -2,-0.2 0.957 109.7 43.9 -63.1 -52.7 1.8 1.4 50.8 9 44 A Y H X S+ 0 0 19 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.870 111.0 55.8 -60.8 -35.7 2.9 3.5 53.7 10 45 A K H X S+ 0 0 105 -4,-2.0 4,-1.7 2,-0.2 3,-0.3 0.964 111.0 43.8 -55.1 -56.1 0.3 1.6 55.9 11 46 A Y H X S+ 0 0 18 -4,-2.5 4,-2.0 1,-0.2 5,-0.3 0.872 108.1 60.2 -57.5 -42.0 2.1 -1.7 54.9 12 47 A L H X S+ 0 0 0 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.897 109.0 42.5 -52.2 -46.4 5.5 0.0 55.5 13 48 A N H < S+ 0 0 73 -4,-2.0 4,-0.4 -3,-0.3 -1,-0.2 0.805 113.0 53.9 -72.6 -33.5 4.6 0.7 59.2 14 49 A Q H < S+ 0 0 66 -4,-1.7 -2,-0.2 1,-0.2 -3,-0.1 0.986 114.5 36.3 -63.2 -63.8 3.0 -2.8 59.7 15 50 A T H < S+ 0 0 23 -4,-2.0 -1,-0.2 2,-0.1 -2,-0.2 0.716 130.5 27.2 -59.5 -25.3 5.9 -5.0 58.6 16 51 A S S < S- 0 0 34 -4,-0.9 -3,-0.1 -5,-0.3 -2,-0.1 0.983 74.1-173.2 -79.9 -85.9 8.7 -2.7 59.9 17 52 A R + 0 0 177 -4,-0.4 3,-0.3 -5,-0.1 -1,-0.2 -0.997 60.8 19.7-130.7 -21.1 8.0 -0.9 62.4 18 53 A S S > S+ 0 0 94 1,-0.2 3,-0.7 2,-0.1 4,-0.4 0.672 113.4 66.7 -89.5 -19.1 10.2 1.8 64.0 19 54 A F T >> S+ 0 0 54 1,-0.2 4,-2.0 2,-0.2 3,-0.6 0.664 76.4 87.3 -74.3 -21.5 12.4 2.2 60.9 20 55 A A H 3> S+ 0 0 2 -3,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.816 84.6 55.8 -46.3 -40.1 9.4 3.6 58.9 21 56 A A H <> S+ 0 0 70 -3,-0.7 4,-1.5 2,-0.2 -1,-0.2 0.869 104.7 50.9 -64.5 -41.6 10.2 7.2 60.2 22 57 A V H <4 S+ 0 0 15 -3,-0.6 4,-0.5 -4,-0.4 -1,-0.2 0.907 112.1 47.8 -64.5 -45.1 13.8 7.1 58.9 23 58 A I H >< S+ 0 0 1 -4,-2.0 3,-1.9 1,-0.2 -2,-0.2 0.954 110.2 51.7 -57.7 -48.5 12.5 6.0 55.5 24 59 A Q H 3< S+ 0 0 58 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.744 102.9 61.0 -68.3 -18.1 9.8 8.8 55.5 25 60 A A T 3< S+ 0 0 62 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.667 76.0 118.6 -78.9 -15.1 12.5 11.4 56.3 26 61 A L S < S- 0 0 5 -3,-1.9 5,-0.3 -4,-0.5 2,-0.1 -0.300 72.4-106.1 -54.2 136.5 14.4 10.6 53.1 27 62 A D > - 0 0 66 3,-0.1 3,-1.8 4,-0.1 4,-0.3 -0.340 61.4 -41.7 -66.4 137.3 14.5 13.8 50.9 28 63 A G T > S+ 0 0 61 1,-0.3 3,-1.0 2,-0.2 4,-0.5 -0.089 125.6 1.2 59.7-135.5 12.5 14.3 47.7 29 64 A E T 3> S+ 0 0 108 1,-0.2 4,-1.6 2,-0.1 -1,-0.3 0.670 119.5 76.3 -65.8 -15.5 12.0 11.4 45.3 30 65 A M H <> S+ 0 0 2 -3,-1.8 4,-2.8 1,-0.2 5,-0.4 0.847 84.2 64.2 -66.9 -30.9 14.0 9.1 47.6 31 66 A R H <> S+ 0 0 76 -3,-1.0 4,-2.3 -5,-0.3 -1,-0.2 0.936 109.0 35.3 -59.3 -54.2 11.2 8.6 50.0 32 67 A N H > S+ 0 0 58 -4,-0.5 4,-2.7 2,-0.2 5,-0.2 0.896 117.6 52.3 -69.3 -40.8 8.8 6.9 47.7 33 68 A A H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 5,-0.2 0.939 114.6 41.8 -67.4 -39.8 11.5 5.0 45.7 34 69 A V H X S+ 0 0 2 -4,-2.8 4,-3.2 -5,-0.2 -1,-0.2 0.947 114.1 52.5 -70.6 -44.6 13.0 3.5 48.9 35 70 A C H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.4 -2,-0.2 0.936 113.0 43.8 -55.3 -47.3 9.6 2.8 50.5 36 71 A I H X S+ 0 0 1 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.878 112.3 52.5 -66.2 -38.4 8.4 0.9 47.4 37 72 A F H X S+ 0 0 1 -4,-2.0 4,-2.6 -5,-0.2 5,-0.2 0.926 108.3 52.5 -64.1 -43.2 11.8 -0.9 47.1 38 73 A Y H X S+ 0 0 55 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.937 111.6 44.8 -54.0 -47.3 11.4 -1.9 50.7 39 74 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.851 111.9 52.1 -68.8 -36.3 7.8 -3.3 50.1 40 75 A V H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.930 110.9 47.7 -66.5 -45.0 8.9 -5.1 46.9 41 76 A L H X S+ 0 0 15 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.886 108.8 54.7 -61.9 -41.4 11.8 -6.8 48.8 42 77 A R H X S+ 0 0 65 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.944 110.4 46.7 -58.5 -43.9 9.3 -7.7 51.7 43 78 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.929 113.7 47.1 -61.7 -45.7 7.1 -9.5 49.0 44 79 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.946 112.5 50.0 -61.0 -46.4 10.1 -11.3 47.4 45 80 A D H X S+ 0 0 31 -4,-2.9 4,-2.5 2,-0.2 -1,-0.2 0.858 106.5 56.0 -59.0 -37.2 11.4 -12.4 50.8 46 81 A T H X S+ 0 0 1 -4,-1.8 4,-0.8 -5,-0.2 -1,-0.2 0.897 109.3 46.6 -67.6 -37.6 7.9 -13.7 51.7 47 82 A L H >< S+ 0 0 0 -4,-1.9 3,-0.6 1,-0.2 -2,-0.2 0.918 113.9 47.3 -64.0 -48.9 8.0 -15.9 48.7 48 83 A E H 3< S+ 0 0 20 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.876 114.7 47.0 -59.9 -40.3 11.5 -17.1 49.3 49 84 A D H 3< S+ 0 0 63 -4,-2.5 2,-0.8 -5,-0.2 -1,-0.2 0.615 82.1 108.2 -82.4 -9.8 10.7 -17.9 53.0 50 85 A D X< - 0 0 1 -4,-0.8 3,-1.6 -3,-0.6 8,-0.0 -0.550 47.2-169.4 -81.2 108.1 7.5 -19.7 52.5 51 86 A M T 3 S+ 0 0 135 -2,-0.8 -1,-0.2 1,-0.3 4,-0.1 0.592 80.9 66.5 -72.2 -9.6 8.0 -23.4 53.3 52 87 A T T 3 S+ 0 0 89 2,-0.1 2,-0.5 26,-0.0 -1,-0.3 0.433 80.7 85.9 -93.0 -2.9 4.6 -24.4 51.9 53 88 A I S < S- 0 0 13 -3,-1.6 2,-0.0 -6,-0.2 26,-0.0 -0.897 84.8-124.5 -97.4 129.7 5.5 -23.4 48.3 54 89 A S >> - 0 0 57 -2,-0.5 4,-2.7 1,-0.1 3,-0.7 -0.330 17.4-114.9 -71.5 157.7 7.1 -26.4 46.6 55 90 A V H 3> S+ 0 0 72 1,-0.2 4,-2.4 2,-0.2 -1,-0.1 0.926 115.6 58.3 -59.9 -41.7 10.5 -25.9 45.0 56 91 A E H 34 S+ 0 0 158 1,-0.2 -1,-0.2 2,-0.2 -3,-0.0 0.805 115.3 35.3 -62.3 -30.1 9.0 -26.5 41.5 57 92 A K H <> S+ 0 0 121 -3,-0.7 4,-1.5 2,-0.1 -1,-0.2 0.785 116.1 55.7 -83.8 -31.7 6.5 -23.6 41.9 58 93 A K H X S+ 0 0 11 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.903 98.2 60.8 -73.1 -37.8 9.0 -21.4 43.9 59 94 A V H X S+ 0 0 41 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.930 108.0 41.9 -60.4 -54.2 11.8 -21.4 41.3 60 95 A P H > S+ 0 0 61 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.908 113.7 54.5 -57.6 -41.4 9.7 -19.8 38.5 61 96 A L H X S+ 0 0 22 -4,-1.5 4,-0.9 2,-0.2 -2,-0.2 0.939 112.5 42.5 -54.4 -50.8 8.1 -17.4 41.0 62 97 A L H >< S+ 0 0 0 -4,-3.1 3,-0.6 1,-0.2 4,-0.4 0.936 116.9 48.2 -64.4 -47.0 11.6 -16.2 42.2 63 98 A H H 3< S+ 0 0 74 -4,-3.0 3,-0.3 -5,-0.3 -1,-0.2 0.863 119.5 37.0 -60.4 -43.1 12.9 -16.0 38.6 64 99 A N H >X S+ 0 0 76 -4,-2.6 4,-1.5 -5,-0.2 3,-1.2 0.447 84.7 101.7 -94.1 0.2 9.9 -14.1 37.2 65 100 A F H < S+ 0 0 19 -4,-1.5 3,-1.6 -3,-0.4 -1,-0.2 0.788 87.9 70.1 -60.5 -27.5 5.4 -9.3 37.9 69 104 A L T 3< S+ 0 0 0 -4,-1.0 -1,-0.3 1,-0.2 29,-0.2 0.763 101.6 45.6 -52.8 -31.9 6.2 -5.7 38.9 70 105 A Y T < S+ 0 0 98 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.2 0.295 94.6 89.9 -96.0 3.0 5.1 -4.7 35.3 71 106 A Q X - 0 0 87 -3,-1.6 3,-0.8 -4,-0.2 23,-0.1 -0.870 62.4-159.7-110.6 99.2 1.9 -6.9 35.3 72 107 A P T 3 S+ 0 0 74 0, 0.0 -1,-0.2 0, 0.0 23,-0.1 0.816 88.5 41.4 -54.1 -32.9 -1.1 -4.9 36.7 73 108 A D T 3 S+ 0 0 144 2,-0.0 17,-0.1 17,-0.0 -5,-0.0 0.774 82.0 120.4 -86.3 -23.3 -3.1 -8.0 37.6 74 109 A W < + 0 0 40 -3,-0.8 2,-0.3 -6,-0.2 20,-0.1 -0.039 31.3 150.4 -48.5 134.0 -0.5 -10.3 39.2 75 110 A R - 0 0 119 15,-0.1 2,-0.4 16,-0.1 13,-0.2 -0.961 39.1-133.1-151.5 168.8 -1.0 -11.5 42.8 76 111 A F + 0 0 21 11,-1.2 3,-0.1 -2,-0.3 14,-0.1 -0.950 20.3 176.4-126.8 112.3 -0.3 -14.5 45.2 77 112 A M + 0 0 117 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.324 62.2 69.3 -98.2 3.7 -3.2 -15.7 47.4 78 113 A E + 0 0 127 6,-0.0 2,-0.3 9,-0.0 -1,-0.2 -0.642 60.3 129.5-135.7 74.2 -1.8 -18.7 49.2 79 114 A S - 0 0 1 -2,-0.3 5,-0.1 -3,-0.1 -32,-0.1 -0.975 36.8-165.2-132.4 142.2 0.9 -17.8 51.7 80 115 A K + 0 0 153 -2,-0.3 -1,-0.1 3,-0.0 4,-0.0 0.517 57.2 106.0-107.1 -4.2 1.3 -18.8 55.4 81 116 A E S > S- 0 0 74 -35,-0.1 3,-0.9 1,-0.1 -2,-0.1 -0.150 80.1-108.0 -67.1 164.8 4.0 -16.2 56.5 82 117 A K T 3 S+ 0 0 176 1,-0.2 2,-0.6 2,-0.1 3,-0.4 0.981 115.1 46.1 -56.4 -65.2 3.2 -13.1 58.7 83 118 A D T >> S+ 0 0 25 1,-0.2 3,-2.1 2,-0.1 4,-0.5 0.066 71.0 132.1 -72.4 24.7 3.5 -10.3 56.0 84 119 A R H <> + 0 0 102 -3,-0.9 4,-2.6 -2,-0.6 3,-0.4 0.673 57.7 75.2 -53.9 -22.4 1.4 -12.3 53.5 85 120 A Q H 3> S+ 0 0 87 -3,-0.4 4,-3.2 2,-0.2 -1,-0.3 0.830 85.2 61.1 -58.2 -39.8 -0.7 -9.1 52.9 86 121 A V H <4 S+ 0 0 1 -3,-2.1 7,-0.2 2,-0.2 -1,-0.2 0.874 111.5 41.1 -55.8 -38.0 2.2 -7.6 50.8 87 122 A L H >< S+ 0 0 0 -4,-0.5 3,-1.6 -3,-0.4 -11,-1.2 0.926 114.4 49.3 -73.8 -48.2 1.6 -10.6 48.4 88 123 A E H 3< S+ 0 0 51 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.914 123.0 34.9 -58.1 -40.9 -2.2 -10.6 48.6 89 124 A D T >X S+ 0 0 34 -4,-3.2 4,-1.3 1,-0.2 3,-0.7 -0.065 78.6 125.2-105.4 32.8 -2.2 -6.9 47.8 90 125 A F H <> + 0 0 0 -3,-1.6 4,-3.4 1,-0.2 5,-0.4 0.849 64.5 68.8 -55.8 -31.4 0.9 -6.9 45.5 91 126 A P H 3> S+ 0 0 23 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.934 99.4 49.5 -63.8 -31.9 -1.2 -5.2 42.8 92 127 A T H <> S+ 0 0 24 -3,-0.7 4,-1.8 1,-0.2 -2,-0.2 0.912 113.6 45.4 -66.4 -42.7 -1.2 -2.0 44.9 93 128 A I H X S+ 0 0 0 -4,-1.3 4,-2.2 -7,-0.2 -1,-0.2 0.922 113.5 48.3 -67.6 -44.2 2.5 -2.2 45.5 94 129 A S H X S+ 0 0 0 -4,-3.4 4,-2.6 2,-0.2 -2,-0.2 0.868 107.0 57.2 -71.1 -27.7 3.3 -2.8 41.8 95 130 A L H X S+ 0 0 75 -4,-2.3 4,-1.0 -5,-0.4 -1,-0.2 0.958 109.6 45.9 -61.4 -44.0 0.9 0.1 40.8 96 131 A E H < S+ 0 0 16 -4,-1.8 4,-0.4 1,-0.2 3,-0.4 0.872 109.4 55.1 -69.9 -35.5 3.1 2.3 43.0 97 132 A F H >< S+ 0 0 0 -4,-2.2 3,-1.8 1,-0.2 -1,-0.2 0.944 106.0 51.4 -54.6 -51.8 6.2 0.8 41.5 98 133 A R H 3< S+ 0 0 62 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.688 104.2 58.5 -68.0 -14.9 5.0 1.7 38.0 99 134 A N T 3< S+ 0 0 101 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.529 86.1 99.9 -86.7 -7.6 4.4 5.4 39.1 100 135 A L S < S- 0 0 20 -3,-1.8 5,-0.0 -4,-0.4 -3,-0.0 -0.419 93.1 -85.8 -73.4 157.0 8.0 5.9 40.1 101 136 A A >> - 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0 0 82 -5,-3.0 2,-0.5 -6,-0.2 -1,-0.2 -0.823 36.2-167.7-106.1 143.3 16.7 -23.2 59.2 194 229 A E + 0 0 54 -2,-0.4 -67,-0.5 1,-0.1 4,-0.1 -0.967 24.1 148.9-133.6 116.0 20.5 -23.3 59.0 195 230 A F + 0 0 45 -2,-0.5 -1,-0.1 -14,-0.2 -13,-0.1 0.549 41.0 105.0-118.5 -21.4 22.5 -20.3 57.8 196 231 A W S S- 0 0 6 -15,-0.1 2,-0.3 1,-0.1 -69,-0.1 -0.448 86.4 -98.7 -61.9 139.0 25.8 -20.7 59.7 197 232 A P >> - 0 0 0 0, 0.0 4,-2.6 0, 0.0 3,-1.6 -0.462 21.4-141.8 -73.2 132.9 28.3 -21.8 57.2 198 233 A Q H 3> S+ 0 0 72 -71,-2.6 4,-2.4 -2,-0.3 -70,-0.2 0.842 98.0 61.7 -56.5 -40.1 29.0 -25.5 57.3 199 234 A E H 34 S+ 0 0 90 -71,-2.8 -1,-0.3 1,-0.2 -70,-0.1 0.718 112.6 37.1 -59.3 -30.5 32.8 -25.1 56.7 200 235 A V H X4 S+ 0 0 0 -3,-1.6 3,-1.4 -72,-0.4 4,-0.3 0.867 118.2 45.6 -88.3 -52.0 33.1 -23.1 60.0 201 236 A W H >X S+ 0 0 25 -4,-2.6 4,-2.0 1,-0.3 3,-1.8 0.826 104.5 64.0 -64.7 -26.4 30.7 -24.9 62.3 202 237 A S T 3< S+ 0 0 53 -4,-2.4 -1,-0.3 1,-0.3 -3,-0.1 0.602 90.6 65.3 -77.9 -10.8 31.9 -28.4 61.2 203 238 A R T <4 S+ 0 0 134 -3,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.577 114.0 33.1 -76.1 -8.0 35.4 -27.6 62.7 204 239 A Y T <4 S+ 0 0 32 -3,-1.8 2,-0.3 1,-0.4 -2,-0.2 0.782 126.2 5.0-111.9 -43.5 33.6 -27.5 66.1 205 240 A V < - 0 0 15 -4,-2.0 -1,-0.4 14,-0.1 3,-0.1 -0.928 62.6-115.3-147.6 165.8 30.7 -30.0 66.1 206 241 A K S S+ 0 0 187 -2,-0.3 2,-0.3 1,-0.2 -4,-0.1 0.782 99.6 20.7 -80.3 -29.2 29.1 -32.7 64.0 207 242 A K S > S- 0 0 137 1,-0.1 3,-1.3 -6,-0.1 4,-0.3 -0.978 73.9-126.2-139.4 149.6 25.8 -31.1 63.4 208 243 A L G > S+ 0 0 2 -2,-0.3 3,-1.6 1,-0.3 4,-0.2 0.897 109.5 63.1 -68.1 -39.9 24.8 -27.4 63.7 209 244 A G G > S+ 0 0 24 1,-0.2 3,-1.7 2,-0.1 4,-0.3 0.724 84.9 80.3 -49.7 -22.1 22.0 -28.2 66.1 210 245 A D G X S+ 0 0 23 -3,-1.3 3,-1.7 1,-0.3 6,-0.3 0.791 75.8 70.3 -62.9 -29.1 24.7 -29.4 68.5 211 246 A F G < S+ 0 0 1 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.1 0.620 90.2 62.8 -60.6 -15.9 25.6 -25.8 69.7 212 247 A A G < S+ 0 0 49 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.634 85.2 92.5 -84.8 -13.3 22.2 -25.8 71.5 213 248 A K S X S- 0 0 94 -3,-1.7 3,-2.1 -4,-0.3 4,-0.2 -0.663 80.7-129.2 -84.1 139.2 23.3 -28.7 73.8 214 249 A P G > S+ 0 0 106 0, 0.0 3,-1.7 0, 0.0 4,-0.2 0.803 103.0 60.9 -57.8 -36.7 24.9 -27.6 77.1 215 250 A E G 3 S+ 0 0 129 1,-0.3 3,-0.2 2,-0.1 4,-0.1 0.619 105.6 49.8 -67.9 -14.3 28.0 -29.8 76.8 216 251 A N G X> S+ 0 0 28 -3,-2.1 4,-2.3 -6,-0.3 3,-0.6 0.303 74.5 111.8-103.8 10.4 29.0 -28.0 73.6 217 252 A I H <> S+ 0 0 34 -3,-1.7 4,-2.2 1,-0.3 5,-0.2 0.831 77.0 50.6 -59.0 -34.2 28.7 -24.4 74.9 218 253 A D H 3> S+ 0 0 92 -4,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.897 113.1 45.1 -73.8 -35.5 32.4 -23.7 74.8 219 254 A L H <> S+ 0 0 45 -3,-0.6 4,-2.0 2,-0.2 -2,-0.2 0.848 111.1 55.2 -72.4 -34.2 32.7 -24.9 71.2 220 255 A A H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.919 107.9 47.4 -65.2 -47.5 29.6 -22.9 70.3 221 256 A V H X S+ 0 0 15 -4,-2.2 4,-2.8 2,-0.2 49,-0.3 0.847 109.2 54.3 -64.7 -36.0 31.0 -19.7 71.7 222 257 A Q H X S+ 0 0 51 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.933 112.0 44.6 -61.3 -42.9 34.4 -20.2 69.8 223 258 A C H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.926 111.4 52.9 -69.8 -46.0 32.4 -20.6 66.6 224 259 A L H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.937 111.4 47.0 -46.9 -53.5 30.3 -17.6 67.4 225 260 A N H X S+ 0 0 0 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.834 110.4 52.6 -61.4 -34.6 33.5 -15.5 68.0 226 261 A E H X S+ 0 0 10 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.927 112.3 44.3 -70.5 -40.8 35.0 -16.8 64.7 227 262 A L H X S+ 0 0 1 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.884 112.0 52.8 -70.6 -36.4 31.8 -15.8 62.7 228 263 A I H X S+ 0 0 0 -4,-2.8 4,-2.1 -5,-0.3 -1,-0.2 0.903 106.6 53.3 -61.3 -36.9 31.7 -12.4 64.5 229 264 A T H X S+ 0 0 1 -4,-1.7 4,-0.7 1,-0.2 -2,-0.2 0.908 107.5 52.4 -66.7 -39.5 35.4 -11.9 63.5 230 265 A N H >< S+ 0 0 20 -4,-1.8 3,-1.5 1,-0.2 4,-0.2 0.951 108.1 49.8 -58.1 -52.1 34.4 -12.6 59.9 231 266 A A H >< S+ 0 0 0 -4,-2.4 3,-2.1 1,-0.3 4,-0.3 0.845 100.4 64.1 -57.5 -40.2 31.6 -10.0 60.0 232 267 A L H >< S+ 0 0 0 -4,-2.1 3,-1.6 1,-0.3 -1,-0.3 0.753 85.3 76.7 -58.3 -23.4 34.0 -7.3 61.4 233 268 A H T << S+ 0 0 95 -3,-1.5 4,-0.4 -4,-0.7 -1,-0.3 0.701 88.6 58.0 -61.3 -17.3 35.9 -7.5 58.1 234 269 A H T <> S+ 0 0 18 -3,-2.1 4,-1.9 -4,-0.2 -1,-0.2 0.588 82.0 86.4 -85.9 -12.0 33.2 -5.5 56.4 235 270 A I H <> S+ 0 0 0 -3,-1.6 4,-2.7 -4,-0.3 5,-0.2 0.882 81.0 57.3 -65.0 -39.6 33.5 -2.5 58.8 236 271 A P H > S+ 0 0 17 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.958 111.8 44.6 -55.5 -43.1 36.3 -0.7 56.8 237 272 A D H > S+ 0 0 38 -4,-0.4 4,-3.1 2,-0.2 -2,-0.2 0.853 109.8 55.0 -60.8 -40.6 34.0 -0.7 53.8 238 273 A V H X S+ 0 0 2 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.938 110.0 46.4 -59.9 -43.0 31.1 0.4 55.9 239 274 A I H X S+ 0 0 17 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.952 113.9 47.6 -64.6 -51.3 33.2 3.4 57.1 240 275 A T H X S+ 0 0 37 -4,-2.8 4,-0.9 1,-0.2 -2,-0.2 0.929 114.0 49.8 -51.1 -48.5 34.3 4.2 53.4 241 276 A Y H >< S+ 0 0 9 -4,-3.1 3,-0.8 1,-0.2 4,-0.4 0.935 114.1 41.3 -59.1 -50.9 30.7 3.9 52.4 242 277 A L H >< S+ 0 0 0 -4,-2.7 3,-1.4 1,-0.2 -1,-0.2 0.881 107.1 64.0 -69.0 -32.8 29.2 6.2 55.1 243 278 A S H 3< S+ 0 0 48 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.752 100.8 54.0 -62.3 -21.2 32.2 8.8 54.7 244 279 A R T << S+ 0 0 63 -4,-0.9 -85,-0.3 -3,-0.8 -1,-0.3 0.592 82.0 106.6 -90.7 -14.0 31.0 9.5 51.1 245 280 A L < + 0 0 9 -3,-1.4 -87,-0.1 -4,-0.4 3,-0.0 -0.512 36.7 173.2 -75.9 133.8 27.4 10.3 51.9 246 281 A R + 0 0 190 -89,-0.2 2,-0.5 -2,-0.2 -1,-0.1 0.552 54.3 86.8-115.0 -18.4 26.5 14.1 51.6 247 282 A N > - 0 0 16 1,-0.1 4,-3.2 2,-0.0 5,-0.2 -0.792 66.8-148.8 -88.9 128.1 22.8 14.0 52.1 248 283 A Q H > S+ 0 0 104 -2,-0.5 4,-2.2 1,-0.2 5,-0.2 0.872 97.1 47.6 -59.8 -47.3 21.7 14.1 55.7 249 284 A S H > S+ 0 0 11 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.854 115.1 47.6 -67.9 -34.9 18.6 12.1 55.4 250 285 A V H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.1 5,-0.2 0.911 110.3 53.0 -63.5 -50.9 20.5 9.4 53.3 251 286 A F H X S+ 0 0 12 -4,-3.2 4,-2.7 2,-0.2 5,-0.2 0.912 111.6 44.8 -44.8 -50.8 23.4 9.4 56.0 252 287 A N H X S+ 0 0 41 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.908 112.2 52.0 -69.7 -42.1 20.9 8.7 58.8 253 288 A F H < S+ 0 0 16 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.883 118.7 36.7 -59.4 -41.0 19.1 6.0 56.9 254 289 A C H X S+ 0 0 12 -4,-2.3 4,-0.9 2,-0.1 -2,-0.2 0.813 118.3 48.7 -80.2 -36.2 22.4 4.2 56.1 255 290 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 -5,-0.2 5,-0.3 0.846 98.7 66.1 -78.7 -34.5 24.1 4.8 59.4 256 291 A I H X S+ 0 0 11 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.907 103.9 43.1 -57.5 -49.9 21.4 3.8 61.8 257 292 A P H > S+ 0 0 30 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.910 113.3 53.9 -65.3 -31.1 21.3 0.1 60.8 258 293 A Q H X S+ 0 0 6 -4,-0.9 4,-2.5 1,-0.2 -2,-0.2 0.920 108.9 46.0 -72.5 -40.7 25.1 -0.1 60.8 259 294 A V H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.860 112.4 52.6 -69.8 -32.9 25.6 1.3 64.4 260 295 A M H X S+ 0 0 32 -4,-1.8 4,-1.7 -5,-0.3 -1,-0.2 0.905 110.1 47.6 -64.1 -44.2 22.8 -1.1 65.6 261 296 A A H X S+ 0 0 6 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.898 109.9 53.7 -60.8 -42.0 24.6 -4.1 64.1 262 297 A I H X S+ 0 0 4 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.924 111.0 44.3 -56.5 -46.0 27.9 -2.9 65.6 263 298 A A H X S+ 0 0 1 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.806 112.9 53.9 -69.7 -32.2 26.3 -2.8 69.1 264 299 A T H X S+ 0 0 10 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.924 107.3 49.2 -69.0 -45.4 24.6 -6.2 68.5 265 300 A L H X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.863 110.9 50.0 -59.4 -41.7 27.9 -7.8 67.5 266 301 A A H < S+ 0 0 0 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.901 111.2 50.1 -62.8 -43.2 29.5 -6.4 70.7 267 302 A A H < S+ 0 0 30 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.843 115.7 42.4 -60.5 -36.2 26.5 -7.8 72.7 268 303 A C H >< S+ 0 0 1 -4,-1.9 3,-2.2 -5,-0.1 -1,-0.2 0.726 85.4 115.4 -83.2 -21.6 26.9 -11.2 71.1 269 304 A Y T 3< S- 0 0 0 -4,-1.6 3,-0.1 1,-0.3 -44,-0.0 -0.288 97.9 -12.5 -64.2 127.9 30.7 -11.4 71.3 270 305 A N T 3 S+ 0 0 56 -49,-0.3 2,-0.8 1,-0.2 -1,-0.3 0.693 101.5 147.2 55.1 27.1 31.8 -14.2 73.6 271 306 A N X - 0 0 49 -3,-2.2 3,-1.6 1,-0.2 4,-0.3 -0.781 40.7-167.1-105.5 105.4 28.2 -14.4 74.8 272 307 A Q G > S+ 0 0 105 -2,-0.8 3,-2.0 1,-0.2 4,-0.3 0.815 83.4 76.4 -48.8 -34.7 26.8 -17.9 75.8 273 308 A Q G >> S+ 0 0 71 1,-0.3 4,-1.5 2,-0.2 3,-1.4 0.723 76.3 75.2 -59.7 -21.7 23.3 -16.4 75.8 274 309 A V G <4 S+ 0 0 0 -3,-1.6 -88,-0.7 1,-0.2 -1,-0.3 0.838 98.3 48.0 -50.7 -34.2 23.3 -16.6 71.9 275 310 A F G <4 S+ 0 0 10 -3,-2.0 -1,-0.2 -4,-0.3 -2,-0.2 0.488 115.8 42.6 -90.4 -0.1 22.8 -20.3 72.3 276 311 A K T <4 S- 0 0 126 -3,-1.4 2,-0.3 -4,-0.3 -2,-0.2 0.465 123.1 -36.0-120.2 -9.0 19.9 -19.9 74.9 277 312 A G S < S- 0 0 24 -4,-1.5 2,-0.8 -3,-0.0 -91,-0.3 -0.965 83.1 -38.4 174.0-163.5 17.8 -17.1 73.4 278 313 A A - 0 0 64 -2,-0.3 2,-0.5 -92,-0.1 -4,-0.1 -0.811 43.9-155.5-100.5 104.1 17.5 -13.9 71.6 279 314 A V + 0 0 17 -2,-0.8 2,-0.3 -96,-0.4 -11,-0.1 -0.704 26.6 169.5 -77.0 120.3 20.3 -11.4 72.5 280 315 A K - 0 0 163 -2,-0.5 2,-0.2 -13,-0.1 3,-0.1 -0.945 37.8-110.4-133.8 152.0 19.0 -7.9 71.7 281 316 A I - 0 0 29 -2,-0.3 -17,-0.1 1,-0.1 5,-0.0 -0.606 48.5 -98.6 -82.8 144.7 20.2 -4.4 72.4 282 317 A R > - 0 0 171 -2,-0.2 4,-2.4 1,-0.1 3,-0.3 -0.286 28.7-116.2 -59.2 145.5 17.9 -2.5 75.0 283 318 A K H > S+ 0 0 180 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.902 115.4 48.2 -47.5 -51.9 15.3 -0.1 73.6 284 319 A G H > S+ 0 0 37 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.837 110.1 51.6 -65.4 -33.2 16.9 2.9 75.2 285 320 A Q H > S+ 0 0 44 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.929 110.8 49.2 -63.1 -49.5 20.3 1.9 74.0 286 321 A A H X S+ 0 0 23 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.911 109.8 51.8 -51.1 -49.2 18.8 1.6 70.4 287 322 A V H X S+ 0 0 71 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.908 110.5 47.6 -58.6 -43.2 17.1 5.1 70.7 288 323 A T H X S+ 0 0 68 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.887 110.3 51.6 -70.0 -39.4 20.4 6.7 71.7 289 324 A L H X S+ 0 0 10 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.940 109.8 50.6 -57.1 -48.2 22.3 5.1 68.9 290 325 A M H < S+ 0 0 61 -4,-2.6 -2,-0.2 1,-0.2 3,-0.2 0.911 112.2 46.5 -55.2 -42.7 19.7 6.3 66.4 291 326 A M H < S+ 0 0 115 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.840 115.1 46.0 -73.4 -33.4 19.9 9.9 67.7 292 327 A D H < S+ 0 0 78 -4,-2.1 2,-2.1 1,-0.2 3,-0.4 0.708 89.1 86.6 -81.0 -23.5 23.6 10.0 67.7 293 328 A A < + 0 0 0 -4,-1.6 -38,-0.2 -3,-0.2 -37,-0.2 -0.451 56.2 105.6 -82.2 69.4 24.3 8.5 64.3 294 329 A T S S+ 0 0 47 -2,-2.1 2,-0.3 1,-0.2 -1,-0.2 0.336 74.9 31.0-131.8 3.1 24.1 11.6 62.2 295 330 A N S > S- 0 0 68 -3,-0.4 4,-2.1 1,-0.1 -1,-0.2 -0.982 78.7-108.7-158.7 159.1 27.7 12.5 61.3 296 331 A M H > S+ 0 0 32 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.902 112.3 53.3 -64.2 -45.7 31.0 10.7 60.6 297 332 A P H > S+ 0 0 97 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.917 113.0 45.4 -56.9 -37.3 32.9 11.6 63.7 298 333 A A H > S+ 0 0 28 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.876 114.2 48.1 -73.7 -39.5 30.1 10.3 65.9 299 334 A V H X S+ 0 0 1 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.900 112.2 49.4 -60.8 -46.3 29.6 7.1 63.9 300 335 A K H X S+ 0 0 44 -4,-3.1 4,-2.6 -5,-0.2 -2,-0.2 0.905 110.2 50.8 -63.0 -35.8 33.3 6.4 64.0 301 336 A A H X S+ 0 0 47 -4,-1.8 4,-2.4 -5,-0.3 5,-0.2 0.896 109.7 50.6 -67.1 -39.4 33.4 7.0 67.8 302 337 A I H X S+ 0 0 10 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.950 112.6 47.3 -59.4 -48.6 30.5 4.6 68.3 303 338 A I H X S+ 0 0 3 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.942 113.1 47.2 -57.2 -48.9 32.4 2.0 66.1 304 339 A Y H X S+ 0 0 52 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.905 111.4 51.1 -65.6 -43.2 35.7 2.5 68.0 305 340 A Q H X S+ 0 0 128 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.919 114.2 42.8 -59.4 -46.5 34.0 2.3 71.5 306 341 A Y H X S+ 0 0 40 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.884 114.2 51.0 -69.9 -36.0 32.3 -1.0 70.7 307 342 A M H X S+ 0 0 0 -4,-2.6 4,-2.8 -5,-0.2 -2,-0.2 0.884 109.5 50.7 -66.5 -41.2 35.4 -2.5 69.0 308 343 A E H X S+ 0 0 99 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.871 108.9 53.1 -61.4 -37.8 37.5 -1.6 72.0 309 344 A E H X S+ 0 0 92 -4,-1.6 4,-0.8 -5,-0.2 -2,-0.2 0.910 111.9 43.4 -61.1 -46.3 35.0 -3.3 74.2 310 345 A I H >X S+ 0 0 0 -4,-2.0 3,-0.9 1,-0.2 4,-0.5 0.927 111.9 55.5 -64.7 -40.9 35.1 -6.4 72.1 311 346 A Y H >< S+ 0 0 56 -4,-2.8 3,-1.2 1,-0.3 -2,-0.2 0.907 107.3 47.2 -57.8 -48.7 38.9 -6.1 72.0 312 347 A H H 3< S+ 0 0 134 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.656 110.1 56.1 -71.7 -10.6 39.2 -6.1 75.8 313 348 A R H << S+ 0 0 91 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 0.443 76.6 121.2 -94.6 -8.0 36.8 -9.1 76.0 314 349 A I << - 0 0 13 -3,-1.2 2,-0.4 -4,-0.5 -3,-0.0 -0.433 61.6-133.6 -67.3 120.2 38.9 -11.4 73.7 315 350 A P > - 0 0 36 0, 0.0 3,-1.9 0, 0.0 6,-0.2 -0.646 10.1-134.1 -74.0 131.7 39.9 -14.6 75.5 316 351 A D T 3 S+ 0 0 137 -2,-0.4 6,-0.1 1,-0.3 5,-0.1 0.804 106.8 49.9 -50.2 -33.9 43.6 -15.4 75.0 317 352 A S T 3 S+ 0 0 106 4,-0.1 -1,-0.3 3,-0.0 -3,-0.0 0.533 78.0 119.3 -86.9 -5.9 42.7 -19.0 74.3 318 353 A D X - 0 0 7 -3,-1.9 3,-1.9 1,-0.2 4,-0.3 -0.412 68.3-134.3 -53.1 129.7 39.9 -18.2 71.8 319 354 A P T 3 S+ 0 0 76 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.688 105.2 44.5 -64.0 -14.1 41.1 -19.8 68.5 320 355 A S T >> S+ 0 0 2 1,-0.1 4,-2.9 2,-0.1 3,-0.8 0.319 81.1 115.8-102.6 7.4 40.3 -16.6 66.5 321 356 A S H <> S+ 0 0 15 -3,-1.9 4,-2.4 1,-0.3 5,-0.2 0.861 76.9 41.4 -56.2 -45.5 41.9 -14.3 69.0 322 357 A S H 3> S+ 0 0 84 -4,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.806 114.7 52.6 -74.8 -24.9 44.7 -12.9 66.9 323 358 A K H <> S+ 0 0 84 -3,-0.8 4,-2.2 2,-0.2 5,-0.3 0.907 110.4 49.5 -67.1 -42.8 42.4 -12.6 63.8 324 359 A T H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.920 113.0 45.1 -59.4 -45.0 40.0 -10.7 66.0 325 360 A R H X S+ 0 0 64 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.907 111.4 54.6 -68.2 -39.4 42.7 -8.3 67.3 326 361 A Q H X S+ 0 0 122 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.925 110.4 43.2 -59.2 -46.9 44.1 -7.8 63.8 327 362 A I H X S+ 0 0 9 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.894 114.2 51.7 -69.4 -34.8 40.8 -6.7 62.2 328 363 A I H X S+ 0 0 0 -4,-2.0 4,-2.5 -5,-0.3 -2,-0.2 0.954 110.0 49.7 -65.5 -41.0 40.1 -4.5 65.2 329 364 A S H X S+ 0 0 42 -4,-2.6 4,-2.5 1,-0.2 5,-0.4 0.937 110.7 50.2 -61.2 -50.2 43.6 -2.9 64.8 330 365 A T H X S+ 0 0 52 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.936 110.3 48.9 -50.3 -53.0 42.9 -2.3 61.1 331 366 A I H < S+ 0 0 1 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.936 115.8 44.4 -55.4 -49.1 39.6 -0.6 61.8 332 367 A R H >< S+ 0 0 85 -4,-2.5 3,-0.5 -5,-0.2 -2,-0.2 0.925 123.5 31.3 -58.2 -52.3 41.2 1.7 64.5 333 368 A T H 3< S+ 0 0 109 -4,-2.5 -3,-0.2 1,-0.2 -2,-0.2 0.883 108.0 62.9 -85.1 -46.2 44.3 2.7 62.7 334 369 A Q T 3< 0 0 110 -4,-2.2 -1,-0.2 -5,-0.4 -2,-0.1 0.146 360.0 360.0 -69.0 20.9 43.3 2.7 59.0 335 370 A N < 0 0 112 -3,-0.5 -3,-0.1 -5,-0.0 -2,-0.1 0.087 360.0 360.0 -27.5 360.0 40.9 5.5 60.3