==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 16-DEC-11 3V5P . COMPND 2 MOLECULE: CALMODULIN-DOMAIN PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: TOXOPLASMA GONDII; . AUTHOR E.A.MERRITT,E.T.LARSON . 450 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21981.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 321 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 45 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 2 0.4 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 . 22 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 196 43.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 3 1 0 0 0 4 1 0 2 1 0 1 0 0 0 1 0 0 0 0 0 0 1 0 0 1 RESIDUES PER ALPHA HELIX . 1 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 . 2 0 2 0 1 1 1 1 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 . 1 0 1 1 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 43 A S 0 0 170 0, 0.0 2,-1.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -74.6 10.6 8.1 54.2 2 44 A T - 0 0 117 1,-0.0 74,-0.0 74,-0.0 0, 0.0 -0.620 360.0-138.0 -72.0 90.4 11.3 11.2 52.1 3 45 A A - 0 0 64 -2,-1.6 2,-0.4 1,-0.1 74,-0.3 -0.168 8.0-133.5 -62.7 145.9 14.6 9.9 50.9 4 46 A I >> - 0 0 80 1,-0.1 3,-0.8 72,-0.1 4,-0.7 -0.827 6.3-136.9-105.6 134.8 17.7 12.2 50.7 5 47 A F H >> S+ 0 0 20 -2,-0.4 4,-2.1 1,-0.2 3,-1.3 0.916 102.3 47.0 -54.1 -51.2 20.0 12.3 47.7 6 48 A S H 34 S+ 0 0 35 1,-0.3 -1,-0.2 2,-0.2 5,-0.0 0.579 99.7 66.9 -79.2 -10.9 23.3 12.3 49.6 7 49 A D H <4 S+ 0 0 120 -3,-0.8 -1,-0.3 1,-0.1 -2,-0.2 0.736 116.2 30.3 -69.6 -25.4 22.3 9.5 51.9 8 50 A R H << S+ 0 0 102 -3,-1.3 21,-2.7 -4,-0.7 2,-0.4 0.772 122.0 42.5-103.4 -34.3 22.4 7.3 48.8 9 51 A Y E < -A 28 0A 14 -4,-2.1 2,-0.4 19,-0.2 19,-0.2 -0.918 54.5-159.3-124.5 143.8 25.0 8.9 46.5 10 52 A K E -A 27 0A 101 17,-2.1 17,-2.3 -2,-0.4 2,-0.3 -0.930 28.8-118.9-112.8 142.1 28.5 10.4 46.9 11 53 A G E +A 26 0A 56 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.622 30.2 175.7 -79.1 138.9 29.9 12.8 44.3 12 54 A Q E - 0 0 71 13,-3.1 2,-0.3 1,-0.4 14,-0.2 0.783 59.2 -30.8-108.4 -52.6 33.1 11.6 42.6 13 55 A R E -A 25 0A 152 12,-1.4 12,-3.1 0, 0.0 -1,-0.4 -0.957 65.2 -84.7-160.2 174.1 33.8 14.2 39.9 14 56 A V E -A 24 0A 80 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.686 21.4-172.7 -90.1 140.2 32.3 16.8 37.6 15 57 A L E - 0 0 82 8,-2.9 2,-0.3 1,-0.4 9,-0.2 0.613 52.6-105.5-101.4 -22.0 31.0 15.8 34.1 16 58 A G E -A 23 0A 30 7,-1.3 7,-2.9 2,-0.0 2,-0.5 -0.863 45.0 -40.0 134.3-162.8 30.4 19.3 33.0 17 59 A K E +A 22 0A 89 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.884 51.2 167.9-108.8 128.0 27.6 21.8 32.4 18 60 A G E > -A 21 0A 16 3,-2.0 3,-0.6 -2,-0.5 2,-0.1 -0.631 48.9 -59.7-119.5-174.6 24.4 20.9 30.7 19 61 A S T 3 S+ 0 0 24 -2,-0.2 -1,-0.1 1,-0.2 143,-0.0 -0.485 120.1 8.9 -68.1 139.5 21.1 22.7 30.3 20 62 A F T 3 S- 0 0 19 -2,-0.1 21,-0.5 141,-0.1 2,-0.3 0.133 131.6 -16.1 76.6 -14.6 19.3 23.6 33.6 21 63 A G E < S-AB 18 40A 2 -3,-0.6 -3,-2.0 19,-0.2 2,-0.2 -0.982 81.3 -60.1 171.5-177.7 22.3 22.7 35.8 22 64 A E E -AB 17 39A 67 17,-0.8 17,-2.5 -2,-0.3 2,-0.5 -0.565 39.5-134.4 -88.6 153.1 25.6 20.9 36.3 23 65 A V E -AB 16 38A 26 -7,-2.9 -8,-2.9 15,-0.2 -7,-1.3 -0.940 19.2-168.1-112.9 126.7 26.2 17.2 35.9 24 66 A I E -AB 14 37A 11 13,-2.8 13,-3.0 -2,-0.5 2,-0.5 -0.911 23.8-126.7-111.4 136.6 28.2 15.3 38.5 25 67 A L E -AB 13 36A 4 -12,-3.1 -13,-3.1 -2,-0.4 -12,-1.4 -0.768 43.2-178.6 -77.8 124.6 29.5 11.7 38.3 26 68 A C E -AB 11 35A 3 9,-3.4 9,-2.2 -2,-0.5 2,-0.4 -0.767 20.7-144.7-126.0 166.9 28.2 10.0 41.4 27 69 A K E -AB 10 34A 64 -17,-2.3 -17,-2.1 -2,-0.2 7,-0.2 -0.993 23.4-116.4-140.5 129.5 28.4 6.6 43.0 28 70 A D E > -A 9 0A 11 5,-2.7 4,-1.6 -2,-0.4 -19,-0.2 -0.464 25.1-140.3 -60.9 126.6 25.8 4.6 45.0 29 71 A K T 4 S+ 0 0 104 -21,-2.7 -1,-0.1 -2,-0.2 -20,-0.1 0.595 95.0 30.0 -70.7 -13.0 27.3 4.2 48.6 30 72 A I T 4 S+ 0 0 156 -22,-0.3 -1,-0.2 3,-0.1 -21,-0.1 0.782 128.4 31.0-110.8 -49.8 26.1 0.6 48.9 31 73 A T T 4 S- 0 0 100 2,-0.1 -2,-0.1 1,-0.0 -3,-0.0 0.644 92.5-129.3 -89.2 -17.1 26.0 -1.0 45.5 32 74 A G < + 0 0 35 -4,-1.6 2,-0.3 1,-0.3 -3,-0.1 0.594 49.7 157.6 75.2 13.0 28.9 0.9 43.8 33 75 A Q - 0 0 100 -6,-0.1 -5,-2.7 1,-0.0 2,-0.3 -0.560 35.4-138.1 -72.3 129.6 26.8 1.9 40.8 34 76 A E E +B 27 0A 73 -2,-0.3 54,-0.3 -7,-0.2 2,-0.3 -0.630 29.4 170.8 -82.5 144.2 28.1 4.9 38.9 35 77 A C E -B 26 0A 2 -9,-2.2 -9,-3.4 -2,-0.3 2,-0.5 -0.981 35.8-118.5-150.9 156.0 25.5 7.4 37.7 36 78 A A E -BC 25 86A 15 50,-2.3 50,-3.1 -2,-0.3 2,-0.6 -0.891 30.7-161.5 -95.8 126.4 25.4 10.9 36.1 37 79 A V E -BC 24 85A 0 -13,-3.0 -13,-2.8 -2,-0.5 2,-0.6 -0.945 6.0-158.0-115.2 115.0 23.4 13.3 38.4 38 80 A K E -BC 23 84A 19 46,-2.5 46,-2.8 -2,-0.6 2,-0.6 -0.829 11.6-157.0 -89.4 125.9 22.1 16.5 37.0 39 81 A V E -BC 22 83A 9 -17,-2.5 -17,-0.8 -2,-0.6 2,-0.6 -0.910 3.9-162.6-111.0 113.8 21.5 19.0 39.8 40 82 A I E -BC 21 82A 0 42,-2.5 42,-1.9 -2,-0.6 2,-0.7 -0.889 14.3-138.7-103.5 118.9 19.0 21.8 39.0 41 83 A S E > - C 0 81A 9 -2,-0.6 4,-2.4 -21,-0.5 3,-0.3 -0.683 5.2-157.1 -77.5 113.5 19.1 24.8 41.3 42 84 A K T 4 S+ 0 0 59 38,-2.2 -1,-0.2 -2,-0.7 39,-0.1 0.826 94.9 53.8 -58.4 -35.8 15.5 25.9 42.2 43 85 A R T 4 S+ 0 0 102 37,-0.6 -1,-0.2 1,-0.2 3,-0.1 0.864 116.6 36.7 -64.9 -38.0 16.8 29.4 42.9 44 86 A Q T 4 S+ 0 0 108 -3,-0.3 2,-0.5 1,-0.2 -2,-0.2 0.737 118.1 49.3 -89.3 -27.1 18.5 29.7 39.5 45 87 A V S < S- 0 0 14 -4,-2.4 2,-0.2 -25,-0.1 -1,-0.2 -0.970 74.6-144.7-124.6 117.8 15.9 27.8 37.3 46 88 A K - 0 0 61 -2,-0.5 115,-2.2 115,-0.2 2,-0.3 -0.564 18.3-122.8 -80.7 141.3 12.2 28.6 37.5 47 89 A Q B -E 160 0B 73 -2,-0.2 113,-0.3 113,-0.2 112,-0.1 -0.616 12.8-162.9 -80.1 141.9 9.6 25.8 37.1 48 90 A K S S+ 0 0 84 111,-3.2 2,-0.2 -2,-0.3 112,-0.2 0.636 75.1 44.4 -93.4 -18.9 6.9 26.1 34.3 49 91 A T S S- 0 0 35 110,-0.9 2,-0.1 1,-0.1 -2,-0.0 -0.772 89.5 -96.2-124.3 165.1 4.6 23.4 35.9 50 92 A D >> - 0 0 89 -2,-0.2 4,-1.6 1,-0.1 3,-0.9 -0.323 43.6-101.7 -76.5 165.0 3.3 22.5 39.3 51 93 A K H 3> S+ 0 0 53 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.895 119.5 54.1 -54.9 -46.6 5.0 19.8 41.5 52 94 A E H 3> S+ 0 0 133 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.741 106.6 52.9 -65.7 -24.5 2.4 17.1 40.7 53 95 A S H <> S+ 0 0 45 -3,-0.9 4,-1.9 2,-0.2 -1,-0.2 0.878 110.1 46.7 -76.3 -41.5 2.9 17.6 37.0 54 96 A L H X S+ 0 0 7 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.907 110.5 53.6 -64.6 -44.4 6.7 17.2 37.2 55 97 A L H X S+ 0 0 89 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.886 109.8 48.1 -56.2 -41.9 6.4 14.1 39.5 56 98 A R H X S+ 0 0 193 -4,-1.2 4,-1.7 2,-0.2 -1,-0.2 0.876 111.1 48.9 -72.7 -39.5 4.1 12.4 36.9 57 99 A E H X S+ 0 0 32 -4,-1.9 4,-2.9 2,-0.2 -1,-0.2 0.934 113.0 49.6 -60.7 -44.8 6.4 13.2 34.0 58 100 A V H X S+ 0 0 6 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.902 107.1 52.8 -64.1 -44.5 9.3 11.8 36.1 59 101 A Q H X S+ 0 0 104 -4,-2.5 4,-0.7 1,-0.2 -1,-0.2 0.862 113.4 45.9 -56.6 -37.8 7.4 8.6 37.0 60 102 A L H >X S+ 0 0 58 -4,-1.7 4,-1.0 2,-0.2 3,-0.8 0.933 110.4 51.9 -71.0 -47.3 6.8 8.1 33.2 61 103 A L H >< S+ 0 0 26 -4,-2.9 3,-0.5 1,-0.2 11,-0.4 0.873 104.9 56.7 -58.6 -39.4 10.4 8.8 32.2 62 104 A K H 3< S+ 0 0 63 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.807 109.9 46.2 -59.7 -31.7 11.7 6.3 34.8 63 105 A Q H << S+ 0 0 135 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.632 92.2 96.8 -87.5 -17.2 9.6 3.6 33.1 64 106 A L << - 0 0 18 -4,-1.0 2,-0.3 -3,-0.5 8,-0.3 -0.465 51.6-174.1 -78.4 149.2 10.5 4.4 29.5 65 107 A D + 0 0 105 -2,-0.1 5,-0.1 6,-0.1 6,-0.1 -0.938 16.4 144.8-149.7 120.3 13.3 2.4 27.8 66 108 A H > - 0 0 23 3,-0.4 3,-1.6 -2,-0.3 53,-0.1 -0.979 48.8-122.9-155.4 143.3 14.9 2.8 24.4 67 109 A P T 3 S+ 0 0 65 0, 0.0 4,-0.1 0, 0.0 52,-0.1 0.729 111.2 45.4 -65.0 -21.8 18.5 2.3 23.1 68 110 A N T 3 S+ 0 0 11 82,-0.1 83,-2.7 47,-0.1 2,-0.4 0.200 101.5 79.3-105.1 15.8 18.9 5.9 21.8 69 111 A I B < S-f 151 0C 15 -3,-1.6 -3,-0.4 81,-0.3 83,-0.2 -0.978 87.2-106.1-126.5 132.9 17.4 7.7 24.9 70 112 A M - 0 0 60 81,-2.3 2,-0.5 -2,-0.4 -2,-0.1 -0.249 35.4-123.1 -54.3 139.6 19.1 8.3 28.2 71 113 A K - 0 0 35 -4,-0.1 16,-2.3 -6,-0.1 2,-0.5 -0.769 20.4-156.3 -86.6 128.7 18.0 6.0 31.0 72 114 A L E +D 86 0A 11 -2,-0.5 14,-0.3 -11,-0.4 3,-0.1 -0.940 17.8 171.5-102.4 125.7 16.6 7.9 34.1 73 115 A Y E + 0 0 69 12,-2.7 2,-0.3 -2,-0.5 13,-0.2 0.784 57.3 8.0 -97.7 -41.6 16.8 5.8 37.3 74 116 A E E -D 85 0A 50 11,-1.9 11,-2.3 2,-0.0 2,-0.3 -0.927 47.0-157.6-147.8 164.9 15.9 8.2 40.1 75 117 A F E -D 84 0A 31 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.975 13.5-179.9-149.7 129.3 14.6 11.7 41.2 76 118 A F E -D 83 0A 20 7,-1.8 7,-2.3 -2,-0.3 2,-0.4 -0.919 7.7-164.4-128.6 156.6 15.1 13.6 44.5 77 119 A E E +D 82 0A 83 -74,-0.3 5,-0.2 -2,-0.3 2,-0.2 -0.982 14.2 164.2-140.9 127.7 13.9 17.0 45.7 78 120 A D - 0 0 61 3,-1.9 3,-0.1 -2,-0.4 -74,-0.0 -0.551 57.9 -68.6-121.1-166.4 15.2 18.9 48.7 79 121 A K S S+ 0 0 203 1,-0.2 3,-0.0 -2,-0.2 0, 0.0 0.941 128.2 14.8 -46.2 -58.0 14.9 22.5 49.9 80 122 A G S S+ 0 0 26 -38,-0.1 -38,-2.2 -39,-0.0 -37,-0.6 0.436 119.2 44.2-106.4 -0.7 17.0 24.0 47.1 81 123 A Y E -C 41 0A 43 -40,-0.2 -3,-1.9 -39,-0.1 2,-0.4 -0.943 50.4-142.2-147.9 158.7 17.4 21.4 44.4 82 124 A F E -CD 40 77A 2 -42,-1.9 -42,-2.5 -2,-0.3 2,-0.5 -0.961 23.4-157.2-113.8 142.1 16.2 18.7 42.0 83 125 A Y E -CD 39 76A 11 -7,-2.3 -7,-1.8 -2,-0.4 2,-0.6 -0.977 5.0-167.3-122.5 118.9 18.5 15.7 41.4 84 126 A L E -CD 38 75A 18 -46,-2.8 -46,-2.5 -2,-0.5 2,-0.6 -0.931 9.7-161.2-105.5 119.4 18.0 13.7 38.2 85 127 A V E +CD 37 74A 0 -11,-2.3 -12,-2.7 -2,-0.6 -11,-1.9 -0.903 23.9 153.1-107.9 115.0 20.0 10.4 38.4 86 128 A G E -CD 36 72A 2 -50,-3.1 -50,-2.3 -2,-0.6 -14,-0.2 -0.711 48.2 -67.1-130.6-177.6 20.7 8.7 35.1 87 129 A E - 0 0 56 -16,-2.3 2,-0.4 -2,-0.2 -52,-0.1 -0.471 50.9-126.9 -68.6 141.0 23.0 6.3 33.3 88 130 A V - 0 0 32 -54,-0.3 2,-0.4 -2,-0.1 -1,-0.1 -0.783 20.3-161.1 -93.3 133.9 26.5 7.8 32.6 89 131 A Y - 0 0 26 -2,-0.4 53,-0.2 1,-0.1 3,-0.2 -0.945 10.1-172.0-117.1 142.0 27.9 7.8 29.0 90 132 A T + 0 0 76 51,-1.5 52,-0.2 -2,-0.4 51,-0.2 0.289 64.6 87.4-118.0 3.3 31.5 8.2 28.3 91 133 A G S S- 0 0 20 49,-2.0 50,-0.2 1,-0.2 51,-0.1 0.549 81.1-144.5 -84.3 -8.3 31.7 8.7 24.5 92 134 A G - 0 0 38 48,-0.4 48,-2.6 -3,-0.2 -1,-0.2 -0.179 44.7 -19.8 75.2-169.6 31.2 12.5 24.6 93 135 A E B >> -G 139 0C 43 46,-0.2 4,-1.3 1,-0.1 3,-0.8 -0.497 58.9-125.7 -75.6 139.5 29.3 14.6 22.2 94 136 A L H >> S+ 0 0 2 44,-2.4 4,-2.5 41,-0.5 3,-0.7 0.890 106.6 55.0 -47.3 -50.8 28.7 13.2 18.7 95 137 A F H 3> S+ 0 0 0 1,-0.3 4,-2.1 40,-0.2 -1,-0.2 0.794 103.4 54.4 -62.9 -31.8 30.2 16.2 16.8 96 138 A D H <4 S+ 0 0 63 -3,-0.8 4,-0.5 2,-0.2 -1,-0.3 0.837 111.5 46.1 -70.3 -32.3 33.6 15.9 18.7 97 139 A E H X< S+ 0 0 54 -4,-1.3 3,-0.8 -3,-0.7 -2,-0.2 0.899 110.6 53.3 -71.7 -43.0 33.8 12.3 17.6 98 140 A I H >< S+ 0 0 0 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.903 105.0 53.2 -59.7 -42.1 32.8 13.2 14.0 99 141 A I T 3< S+ 0 0 20 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.684 101.5 62.2 -70.5 -16.5 35.6 15.8 13.7 100 142 A S T < S+ 0 0 90 -3,-0.8 2,-0.3 -4,-0.5 -1,-0.3 0.388 86.4 100.7 -83.8 0.5 38.1 13.1 14.8 101 143 A R < - 0 0 61 -3,-1.7 3,-0.1 -4,-0.2 -3,-0.0 -0.686 64.3-150.7 -91.4 142.5 37.3 11.0 11.7 102 144 A K S S+ 0 0 100 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.891 86.7 20.9 -71.4 -41.2 39.4 10.9 8.6 103 145 A R + 0 0 131 -3,-0.1 2,-0.3 177,-0.0 -1,-0.2 -0.958 59.3 179.3-135.3 152.5 36.3 10.2 6.5 104 146 A F + 0 0 0 -2,-0.3 172,-3.8 -3,-0.1 2,-0.2 -0.951 12.4 177.9-153.2 122.8 32.5 10.6 6.8 105 147 A S > - 0 0 2 -2,-0.3 4,-2.4 170,-0.3 3,-0.4 -0.582 48.6 -90.0-121.9 179.7 29.9 9.7 4.2 106 148 A E H > S+ 0 0 14 168,-0.5 4,-2.5 1,-0.2 5,-0.1 0.794 125.2 59.1 -61.3 -29.2 26.1 9.6 3.7 107 149 A V H > S+ 0 0 27 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.852 107.9 44.6 -67.3 -35.7 26.1 6.1 5.2 108 150 A D H > S+ 0 0 27 -3,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.892 114.3 49.1 -72.5 -42.0 27.7 7.5 8.3 109 151 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.863 112.3 49.8 -62.2 -38.1 25.2 10.5 8.3 110 152 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.893 107.9 50.4 -70.6 -44.1 22.3 8.1 7.8 111 153 A R H X S+ 0 0 127 -4,-1.8 4,-1.2 158,-0.3 -1,-0.2 0.871 112.8 49.1 -63.9 -36.9 23.2 5.7 10.6 112 154 A I H X S+ 0 0 7 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.944 114.2 43.3 -61.9 -52.4 23.5 8.7 12.9 113 155 A I H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 5,-0.2 0.816 107.9 58.6 -70.7 -32.7 20.1 10.2 11.9 114 156 A R H X S+ 0 0 116 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.886 107.3 49.5 -61.1 -40.4 18.2 6.8 12.0 115 157 A Q H X S+ 0 0 36 -4,-1.2 4,-2.0 -5,-0.2 -2,-0.2 0.928 111.8 46.7 -62.6 -46.8 19.2 6.5 15.6 116 158 A V H X S+ 0 0 1 -4,-1.7 4,-2.6 1,-0.2 3,-0.3 0.964 114.8 46.4 -65.1 -49.8 18.0 10.0 16.5 117 159 A L H X S+ 0 0 0 -4,-2.8 4,-3.3 1,-0.2 -1,-0.2 0.860 110.5 53.8 -56.3 -39.9 14.7 9.6 14.6 118 160 A S H X S+ 0 0 37 -4,-2.2 4,-1.4 -5,-0.2 -1,-0.2 0.864 111.5 45.1 -65.6 -36.2 14.2 6.2 16.2 119 161 A G H X S+ 0 0 0 -4,-2.0 4,-1.8 -3,-0.3 -2,-0.2 0.901 115.4 47.7 -70.3 -41.8 14.7 7.7 19.7 120 162 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.941 107.6 55.2 -65.7 -46.8 12.4 10.6 18.8 121 163 A T H X S+ 0 0 9 -4,-3.3 4,-2.0 1,-0.2 -1,-0.2 0.881 109.2 47.8 -54.6 -43.8 9.7 8.4 17.4 122 164 A Y H X S+ 0 0 54 -4,-1.4 4,-1.0 2,-0.2 -1,-0.2 0.896 111.5 48.8 -63.9 -42.7 9.5 6.4 20.6 123 165 A M H <>S+ 0 0 4 -4,-1.8 5,-2.6 2,-0.2 3,-0.2 0.879 110.5 51.3 -68.7 -36.1 9.3 9.4 22.8 124 166 A H H ><5S+ 0 0 32 -4,-2.7 3,-1.9 1,-0.2 -2,-0.2 0.880 103.0 58.3 -67.7 -41.1 6.6 10.9 20.7 125 167 A K H 3<5S+ 0 0 150 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.827 109.2 47.4 -49.6 -34.8 4.6 7.7 20.9 126 168 A N T 3<5S- 0 0 48 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.2 0.187 121.0-110.7 -96.5 14.2 4.8 8.4 24.7 127 169 A K T < 5S+ 0 0 197 -3,-1.9 2,-0.5 1,-0.2 -3,-0.2 0.692 73.0 135.0 70.5 23.6 3.7 12.1 24.3 128 170 A I < - 0 0 1 -5,-2.6 2,-0.4 -8,-0.1 -1,-0.2 -0.911 34.6-166.4-108.0 130.7 7.1 13.6 25.3 129 171 A V - 0 0 26 -2,-0.5 26,-0.9 1,-0.2 29,-0.3 -0.892 12.9-162.6-113.4 140.0 8.6 16.4 23.2 130 172 A H + 0 0 2 -2,-0.4 2,-0.6 24,-0.2 27,-0.4 0.931 13.0 177.9 -83.0 -58.5 12.2 17.6 23.4 131 173 A R S S+ 0 0 27 56,-0.2 46,-0.3 1,-0.1 -1,-0.1 -0.111 72.0 61.8 81.6 -37.1 12.0 21.0 21.8 132 174 A D + 0 0 33 -2,-0.6 2,-0.2 21,-0.1 -1,-0.1 -0.176 67.5 155.3-116.1 37.3 15.7 21.7 22.4 133 175 A L + 0 0 2 42,-0.1 20,-0.1 3,-0.1 64,-0.1 -0.481 14.2 143.7 -67.8 132.2 17.3 19.0 20.3 134 176 A K > - 0 0 9 -2,-0.2 3,-2.4 62,-0.0 4,-0.2 -0.954 65.3 -90.2-161.4 163.6 20.8 19.9 19.2 135 177 A P G > S+ 0 0 9 0, 0.0 3,-1.7 0, 0.0 -41,-0.5 0.811 122.0 62.8 -50.5 -35.8 24.2 18.2 18.7 136 178 A E G 3 S+ 0 0 40 1,-0.3 -3,-0.1 -43,-0.1 35,-0.0 0.676 99.6 55.0 -63.5 -21.1 25.2 19.0 22.3 137 179 A N G < S+ 0 0 3 -3,-2.4 15,-2.8 -5,-0.1 2,-0.7 0.294 90.1 88.5 -94.8 8.1 22.2 16.8 23.5 138 180 A L E < - H 0 151C 0 -3,-1.7 -44,-2.4 13,-0.2 2,-0.3 -0.905 60.2-178.0-113.1 102.8 23.5 13.8 21.5 139 181 A L E -GH 93 150C 36 11,-2.5 11,-3.3 -2,-0.7 2,-0.4 -0.692 26.0-126.1-102.2 151.4 25.9 11.7 23.5 140 182 A L E - H 0 149C 13 -48,-2.6 -49,-2.0 -2,-0.3 -48,-0.4 -0.852 21.0-131.1 -98.2 134.7 27.9 8.6 22.4 141 183 A E S S- 0 0 64 7,-3.1 -51,-1.5 -2,-0.4 2,-0.2 0.840 76.9 -25.6 -59.8 -41.8 27.3 5.7 24.8 142 184 A S S S- 0 0 41 -52,-0.2 -51,-0.1 6,-0.2 5,-0.1 -0.876 77.3 -79.4-154.4-171.8 31.0 4.9 25.1 143 185 A K S S+ 0 0 178 -2,-0.2 4,-0.1 3,-0.1 -2,-0.0 0.549 83.8 121.8 -76.0 -8.0 34.4 5.3 23.3 144 186 A S S > S- 0 0 80 2,-0.1 3,-0.8 1,-0.1 -2,-0.2 0.039 71.4-117.6 -58.4 164.5 33.7 2.3 21.0 145 187 A K T 3 S+ 0 0 104 1,-0.3 2,-0.7 2,-0.0 -1,-0.1 0.941 113.2 40.7 -68.8 -51.0 33.7 2.5 17.2 146 188 A D T 3 S+ 0 0 94 2,-0.0 -1,-0.3 0, 0.0 2,-0.2 -0.319 87.8 167.6 -94.0 50.2 30.1 1.4 16.7 147 189 A A < - 0 0 18 -3,-0.8 2,-0.1 -2,-0.7 -4,-0.0 -0.448 33.0-126.5 -73.8 131.7 28.8 3.5 19.6 148 190 A N - 0 0 70 -2,-0.2 -7,-3.1 1,-0.1 2,-0.3 -0.463 23.1-119.9 -69.9 147.5 25.1 4.1 20.0 149 191 A I E - H 0 140C 1 -9,-0.2 2,-0.4 -2,-0.1 -9,-0.2 -0.703 22.4-159.9 -84.4 141.6 23.8 7.6 20.3 150 192 A R E - H 0 139C 27 -11,-3.3 -11,-2.5 -2,-0.3 2,-0.4 -0.977 10.1-142.7-126.5 117.5 22.0 8.6 23.5 151 193 A I E -fH 69 138C 1 -83,-2.7 -81,-2.3 -2,-0.4 2,-0.3 -0.623 19.9-157.9 -79.6 129.2 19.7 11.7 23.4 152 194 A I + 0 0 28 -15,-2.8 -15,-0.0 -2,-0.4 -81,-0.0 -0.755 61.2 29.5-105.5 156.9 19.8 13.6 26.7 153 195 A D >> + 0 0 21 -2,-0.3 3,-1.3 1,-0.2 4,-0.5 0.486 64.8 162.9 77.8 12.1 17.2 16.1 28.1 154 196 A F T 34 S+ 0 0 14 1,-0.2 -1,-0.2 -3,-0.2 -24,-0.2 -0.384 71.9 10.8 -57.7 130.6 13.9 14.7 26.7 155 197 A G T >> S+ 0 0 1 -26,-0.9 4,-0.6 1,-0.1 3,-0.5 0.083 98.1 100.6 93.8 -21.9 11.0 16.2 28.7 156 198 A L H X> S+ 0 0 15 -3,-1.3 4,-2.0 1,-0.2 3,-1.0 0.841 72.4 61.8 -68.8 -35.2 12.8 18.8 30.7 157 199 A S H 3< S+ 0 0 2 -4,-0.5 -1,-0.2 -27,-0.4 5,-0.1 0.785 97.4 60.0 -65.9 -27.5 11.9 21.9 28.6 158 200 A T H <4 S+ 0 0 53 -3,-0.5 -1,-0.3 -29,-0.3 -2,-0.2 0.834 116.6 31.1 -62.9 -33.8 8.2 21.3 29.3 159 201 A H H << S+ 0 0 5 -3,-1.0 -111,-3.2 -4,-0.6 -110,-0.9 0.666 117.2 50.5-104.7 -20.0 8.8 21.7 33.1 160 202 A F B < S-E 47 0B 2 -4,-2.0 2,-0.4 -113,-0.3 -113,-0.2 -0.910 76.2-121.2-126.0 150.2 11.7 24.2 33.4 161 203 A E - 0 0 97 -115,-2.2 -115,-0.2 -2,-0.3 -141,-0.1 -0.752 32.0-116.3 -94.5 130.6 12.4 27.6 31.8 162 204 A A - 0 0 46 -2,-0.4 2,-0.1 -5,-0.1 -116,-0.1 -0.204 33.1-102.6 -61.6 149.5 15.5 28.1 29.6 163 205 A S - 0 0 48 5,-0.1 -1,-0.1 1,-0.1 -118,-0.1 -0.443 17.0-150.4 -68.5 146.2 18.2 30.5 30.7 164 206 A K + 0 0 172 -2,-0.1 2,-0.3 3,-0.0 -1,-0.1 0.323 65.5 108.5 -96.9 6.5 18.3 33.9 28.9 165 207 A K S >> S- 0 0 125 1,-0.1 3,-2.1 2,-0.0 4,-0.7 -0.700 71.8-134.4 -92.5 136.3 22.0 34.1 29.4 166 208 A M G >4 S+ 0 0 28 -2,-0.3 3,-0.7 1,-0.3 4,-0.3 0.815 102.9 64.0 -63.3 -34.7 24.2 33.7 26.3 167 209 A K G 34 S+ 0 0 77 1,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.648 109.4 42.2 -59.9 -18.6 26.7 31.4 28.1 168 210 A D G <4 S+ 0 0 46 -3,-2.1 -1,-0.2 1,-0.1 -2,-0.2 0.548 115.3 47.6-102.2 -14.8 23.7 28.9 28.4 169 211 A K XX + 0 0 47 -4,-0.7 3,-0.8 -3,-0.7 4,-0.5 0.011 69.1 140.7-123.4 29.0 22.2 29.3 25.0 170 212 A I T 34 S+ 0 0 7 -4,-0.3 245,-0.1 1,-0.2 244,-0.0 -0.582 81.8 8.1 -65.2 126.5 25.3 29.0 22.7 171 213 A G T >4 S+ 0 0 13 -2,-0.3 3,-0.6 243,-0.2 4,-0.5 0.185 97.7 108.7 89.7 -16.1 24.2 27.0 19.6 172 214 A T G X> + 0 0 40 -3,-0.8 3,-1.3 1,-0.2 4,-0.9 0.877 67.6 63.9 -63.5 -36.9 20.5 26.9 20.5 173 215 A A G 3< S+ 0 0 8 -4,-0.5 3,-0.4 1,-0.3 -1,-0.2 0.816 93.6 58.7 -62.4 -35.2 19.4 29.3 17.8 174 216 A Y G <4 S+ 0 0 10 -3,-0.6 -1,-0.3 1,-0.2 34,-0.2 0.775 112.9 38.7 -66.5 -22.7 20.4 27.2 14.7 175 217 A Y T <4 S+ 0 0 11 -3,-1.3 -1,-0.2 -4,-0.5 2,-0.2 0.584 83.3 109.5-109.8 -12.0 18.1 24.3 15.8 176 218 A I < - 0 0 35 -4,-0.9 -44,-0.1 -3,-0.4 14,-0.1 -0.474 68.2-121.1 -74.3 133.2 14.9 25.8 17.2 177 219 A A >> - 0 0 0 -46,-0.3 3,-1.3 -2,-0.2 4,-1.0 -0.484 19.9-121.2 -72.0 143.2 11.7 25.3 15.0 178 220 A P H 3> S+ 0 0 0 0, 0.0 4,-1.0 0, 0.0 3,-0.3 0.809 110.7 59.9 -56.5 -34.5 10.1 28.6 14.0 179 221 A E H 3>>S+ 0 0 16 1,-0.2 4,-1.1 2,-0.2 5,-0.6 0.769 97.6 59.0 -67.3 -28.4 6.8 27.6 15.7 180 222 A V H <45S+ 0 0 19 -3,-1.3 -1,-0.2 1,-0.2 3,-0.2 0.866 101.1 57.3 -64.1 -36.8 8.5 27.4 19.1 181 223 A L H <5S+ 0 0 65 -4,-1.0 -2,-0.2 -3,-0.3 -1,-0.2 0.861 111.2 41.3 -59.1 -39.0 9.5 31.1 18.6 182 224 A H H <5S- 0 0 116 -4,-1.0 -1,-0.2 2,-0.1 -2,-0.2 0.573 114.4-113.7 -92.0 -14.2 5.8 32.0 18.2 183 225 A G T <5S+ 0 0 52 -4,-1.1 2,-0.7 -3,-0.2 -3,-0.2 0.169 85.2 98.5 110.4 -17.5 4.4 29.8 21.0 184 226 A T < + 0 0 128 -5,-0.6 2,-0.3 2,-0.0 -2,-0.1 -0.898 51.6 142.4-103.6 104.4 2.2 27.2 19.3 185 227 A Y + 0 0 77 -2,-0.7 2,-0.2 -5,-0.1 -5,-0.0 -0.962 22.8 174.5-143.8 158.3 4.3 24.0 19.0 186 228 A D > - 0 0 71 -2,-0.3 3,-2.0 -55,-0.0 4,-0.2 -0.665 59.5 -56.2-143.8-163.4 4.0 20.3 19.3 187 229 A E T >> S+ 0 0 79 1,-0.3 3,-1.6 -2,-0.2 4,-0.6 0.728 117.5 77.3 -64.8 -22.5 6.2 17.2 18.6 188 230 A K H >> S+ 0 0 31 1,-0.2 4,-1.8 2,-0.2 3,-0.7 0.747 77.5 76.8 -57.2 -21.2 6.9 18.2 15.0 189 231 A C H <> S+ 0 0 0 -3,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.875 90.5 55.2 -59.3 -33.3 9.4 20.7 16.4 190 232 A D H <> S+ 0 0 0 -3,-1.6 4,-1.6 -4,-0.2 -1,-0.2 0.791 102.6 54.5 -68.9 -29.6 11.8 17.8 17.0 191 233 A V H S- 0 0 53 202,-0.1 4,-1.9 203,-0.1 5,-0.2 -0.845 89.5 -85.3-142.6-179.7 24.6 36.9 15.9 213 255 A E H > S+ 0 0 37 200,-0.5 4,-2.0 -2,-0.2 5,-0.2 0.899 123.6 48.5 -59.9 -42.1 21.8 35.2 17.8 214 256 A Y H > S+ 0 0 164 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.888 108.9 53.5 -69.8 -38.4 19.0 37.5 16.6 215 257 A D H > S+ 0 0 50 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.869 108.8 50.0 -57.4 -42.0 20.2 37.3 12.9 216 258 A I H X S+ 0 0 7 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.941 110.0 49.6 -63.5 -47.9 20.0 33.5 13.1 217 259 A L H X S+ 0 0 37 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.860 106.8 55.9 -61.5 -38.0 16.4 33.6 14.6 218 260 A K H X S+ 0 0 88 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.893 110.0 46.1 -59.0 -41.6 15.3 36.0 11.9 219 261 A K H X S+ 0 0 105 -4,-1.6 4,-1.8 2,-0.2 5,-0.4 0.890 113.1 49.6 -65.7 -43.3 16.5 33.5 9.3 220 262 A V H < S+ 0 0 0 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.939 110.4 50.1 -60.7 -46.5 14.8 30.6 11.1 221 263 A E H < S+ 0 0 81 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.874 109.1 49.7 -66.1 -38.5 11.5 32.5 11.4 222 264 A K H < S- 0 0 145 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.840 98.6-151.4 -65.8 -34.7 11.4 33.4 7.7 223 265 A G < + 0 0 8 -4,-1.8 2,-0.3 1,-0.2 -3,-0.1 0.455 43.3 134.0 84.1 3.7 12.1 29.7 7.1 224 266 A K + 0 0 176 -5,-0.4 2,-0.3 25,-0.0 -1,-0.2 -0.645 19.2 152.2 -93.5 145.0 14.0 29.8 3.8 225 267 A Y - 0 0 47 -2,-0.3 2,-0.3 -17,-0.1 -17,-0.1 -0.967 23.4-143.3-160.4 162.9 17.2 28.0 3.0 226 268 A T - 0 0 79 -2,-0.3 3,-0.2 -19,-0.3 -2,-0.0 -0.879 22.2-141.1-134.2 163.7 19.0 26.5 -0.0 227 269 A F + 0 0 28 -2,-0.3 5,-0.1 1,-0.1 13,-0.0 -0.237 69.1 118.1-107.0 36.2 21.2 23.6 -1.1 228 270 A E + 0 0 164 4,-0.1 -1,-0.1 3,-0.1 5,-0.0 0.424 37.0 109.9 -90.9 -0.3 23.3 26.1 -3.3 229 271 A L S > S- 0 0 60 -3,-0.2 3,-2.4 1,-0.1 4,-0.4 -0.569 79.4-120.7 -74.6 140.6 26.6 25.5 -1.4 230 272 A P G > S+ 0 0 115 0, 0.0 3,-1.4 0, 0.0 4,-0.4 0.790 107.2 69.4 -61.6 -26.1 29.0 23.6 -3.7 231 273 A Q G 3 S+ 0 0 27 1,-0.2 3,-0.3 2,-0.2 48,-0.1 0.553 87.5 69.2 -67.0 -5.2 29.3 20.6 -1.2 232 274 A W G X S+ 0 0 2 -3,-2.4 3,-2.2 1,-0.2 -1,-0.2 0.751 80.4 73.0 -82.5 -25.3 25.7 19.7 -2.0 233 275 A K T < S+ 0 0 97 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.2 0.791 95.8 54.2 -55.4 -29.4 26.5 18.6 -5.6 234 276 A K T 3 S+ 0 0 60 -4,-0.4 2,-0.3 -3,-0.3 -1,-0.3 0.409 95.4 90.1 -85.5 1.6 28.2 15.5 -4.0 235 277 A V S < S- 0 0 12 -3,-2.2 5,-0.0 1,-0.1 -3,-0.0 -0.779 82.2-102.2-108.1 145.4 25.0 14.6 -2.0 236 278 A S > - 0 0 19 -2,-0.3 4,-1.0 1,-0.1 3,-0.4 -0.176 21.5-128.9 -59.6 149.9 22.1 12.3 -3.0 237 279 A E H > S+ 0 0 117 1,-0.2 4,-2.4 2,-0.2 3,-0.2 0.853 107.6 58.6 -67.1 -36.5 18.8 13.8 -4.2 238 280 A S H > S+ 0 0 19 1,-0.2 4,-1.5 2,-0.2 27,-0.4 0.725 100.5 57.0 -69.9 -22.8 16.8 11.6 -1.8 239 281 A A H > S+ 0 0 0 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.860 108.8 45.5 -73.0 -39.1 18.7 13.1 1.2 240 282 A K H X S+ 0 0 29 -4,-1.0 4,-3.3 2,-0.2 5,-0.2 0.922 108.7 56.5 -67.8 -47.7 17.7 16.6 0.2 241 283 A D H X S+ 0 0 49 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.892 109.0 47.0 -47.1 -47.4 14.1 15.4 -0.3 242 284 A L H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 5,-0.2 0.940 111.6 50.8 -61.9 -47.2 14.2 14.2 3.3 243 285 A I H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.897 108.7 51.9 -57.0 -44.5 15.7 17.5 4.5 244 286 A R H < S+ 0 0 99 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.895 111.3 47.5 -58.6 -42.3 12.9 19.4 2.6 245 287 A K H >< S+ 0 0 85 -4,-1.9 10,-1.3 -5,-0.2 3,-0.9 0.885 113.7 46.3 -67.7 -38.5 10.3 17.3 4.3 246 288 A M H 3< S+ 0 0 0 -4,-2.4 -51,-0.2 1,-0.2 -2,-0.2 0.784 115.7 46.9 -74.4 -28.4 11.8 17.7 7.8 247 289 A L T 3< S+ 0 0 6 -4,-2.2 2,-0.4 -5,-0.2 -1,-0.2 -0.118 77.8 139.1-104.8 35.3 12.2 21.5 7.3 248 290 A T < - 0 0 44 -3,-0.9 6,-0.2 1,-0.1 -3,-0.1 -0.684 52.2-136.7 -80.4 132.0 8.7 22.1 6.0 249 291 A Y S S+ 0 0 90 -2,-0.4 -70,-0.2 4,-0.1 -1,-0.1 0.919 85.7 64.2 -64.0 -53.5 7.5 25.3 7.5 250 292 A V S >> S- 0 0 78 1,-0.2 3,-1.6 2,-0.1 4,-0.9 -0.620 79.2-143.8 -75.2 117.9 3.9 24.5 8.5 251 293 A P G >4 S+ 0 0 30 0, 0.0 3,-0.9 0, 0.0 -1,-0.2 0.861 97.0 56.7 -55.5 -40.5 4.1 21.7 11.1 252 294 A S G 34 S+ 0 0 87 1,-0.3 4,-0.1 -3,-0.0 -2,-0.1 0.758 110.8 46.3 -63.7 -21.4 1.0 19.8 10.0 253 295 A M G <4 S+ 0 0 133 -3,-1.6 -1,-0.3 2,-0.1 2,-0.2 0.594 93.8 99.2 -92.4 -14.0 2.7 19.5 6.5 254 296 A R S << S- 0 0 3 -4,-0.9 -8,-0.2 -3,-0.9 -9,-0.1 -0.509 84.6-103.2 -75.9 142.1 6.0 18.5 8.0 255 297 A I - 0 0 28 -10,-1.3 -1,-0.1 -2,-0.2 -7,-0.1 -0.265 35.8-116.4 -63.6 146.7 6.9 14.8 7.9 256 298 A S > - 0 0 35 1,-0.1 4,-1.9 -4,-0.1 5,-0.1 -0.349 20.0-115.0 -76.7 163.9 6.6 12.8 11.2 257 299 A A H > S+ 0 0 3 2,-0.2 4,-1.5 1,-0.2 -136,-0.1 0.949 118.0 51.7 -61.3 -49.5 9.5 11.2 12.9 258 300 A R H > S+ 0 0 120 1,-0.2 4,-0.7 2,-0.2 3,-0.4 0.913 112.0 44.7 -53.9 -49.0 7.9 7.8 12.3 259 301 A D H >4 S+ 0 0 92 1,-0.2 3,-0.6 2,-0.2 4,-0.3 0.827 106.1 60.5 -70.5 -30.3 7.5 8.5 8.6 260 302 A A H >< S+ 0 0 0 -4,-1.9 3,-0.9 1,-0.2 6,-0.3 0.813 98.0 60.4 -65.6 -29.0 11.0 9.9 8.2 261 303 A L H 3< S+ 0 0 26 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.825 105.6 47.5 -62.1 -34.7 12.3 6.5 9.4 262 304 A D T << S+ 0 0 88 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.398 85.5 124.7 -87.3 0.9 10.6 5.0 6.3 263 305 A H S <> S- 0 0 14 -3,-0.9 4,-2.2 -4,-0.3 3,-0.3 -0.302 75.0-114.2 -62.4 146.3 12.0 7.6 3.9 264 306 A E H > S+ 0 0 135 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.877 113.8 56.6 -42.6 -49.5 14.0 6.2 0.9 265 307 A W H > S+ 0 0 0 -27,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.909 108.9 42.8 -56.3 -51.9 17.2 7.8 2.2 266 308 A I H > S+ 0 0 0 -6,-0.3 4,-0.8 -3,-0.3 -1,-0.2 0.908 118.4 47.5 -60.3 -43.2 17.2 6.2 5.6 267 309 A Q H < S+ 0 0 90 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.841 117.2 41.2 -66.5 -37.9 16.2 2.9 3.9 268 310 A T H < S+ 0 0 75 -4,-3.3 -2,-0.2 -5,-0.2 3,-0.2 0.915 118.2 43.1 -76.7 -43.9 18.8 3.0 1.2 269 311 A Y H < S+ 0 0 51 -4,-2.5 2,-0.3 -5,-0.3 -158,-0.3 0.379 98.0 72.3 -95.3 2.5 21.8 4.3 3.2 270 312 A T < 0 0 18 -4,-0.8 -1,-0.2 -5,-0.2 -4,-0.0 -0.523 360.0 360.0-111.2 63.8 21.5 2.2 6.3 271 313 A K 0 0 194 -2,-0.3 -1,-0.1 -3,-0.2 -2,-0.1 -0.163 360.0 360.0-141.3 360.0 22.6 -1.1 4.8 272 ! 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 0.0 273 320 A V 0 0 120 0, 0.0 -166,-0.0 0, 0.0 -168,-0.0 0.000 360.0 360.0 360.0 72.8 29.5 6.3 -1.6 274 321 A P - 0 0 92 0, 0.0 -168,-0.5 0, 0.0 2,-0.3 -0.179 360.0 -97.6 -72.0 165.1 32.3 9.0 -1.4 275 322 A S - 0 0 31 -170,-0.1 2,-1.7 1,-0.1 -170,-0.3 -0.671 26.8-129.5 -82.2 137.7 33.6 10.7 1.7 276 323 A L > + 0 0 12 -172,-3.8 4,-2.1 -2,-0.3 3,-0.4 -0.503 40.5 165.8 -86.9 68.6 32.2 14.2 2.4 277 324 A D H > S+ 0 0 111 -2,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.889 72.0 48.8 -54.5 -49.6 35.6 15.8 2.9 278 325 A N H > S+ 0 0 82 -3,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.841 109.3 54.1 -62.7 -34.2 34.4 19.4 2.6 279 326 A A H > S+ 0 0 1 -3,-0.4 4,-2.6 2,-0.2 5,-0.2 0.946 107.7 48.9 -64.6 -48.8 31.6 18.7 5.2 280 327 A I H X S+ 0 0 5 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.903 111.0 51.9 -54.9 -44.4 34.1 17.3 7.8 281 328 A L H X S+ 0 0 93 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.885 112.6 44.3 -59.0 -43.1 36.2 20.4 7.2 282 329 A N H X S+ 0 0 32 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.848 112.4 51.4 -73.7 -37.5 33.2 22.8 7.8 283 330 A I H X S+ 0 0 0 -4,-2.6 4,-3.1 2,-0.2 5,-0.2 0.885 109.6 51.1 -63.6 -42.8 32.0 20.8 10.8 284 331 A R H X S+ 0 0 107 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.904 112.8 45.0 -62.3 -44.8 35.4 21.0 12.4 285 332 A Q H X S+ 0 0 131 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.898 114.7 49.6 -62.5 -42.0 35.6 24.8 11.8 286 333 A F H X S+ 0 0 20 -4,-2.3 4,-2.3 -82,-0.2 -2,-0.2 0.923 112.0 46.3 -67.3 -44.7 32.0 25.1 13.1 287 334 A Q H X S+ 0 0 13 -4,-3.1 4,-2.2 2,-0.2 5,-0.2 0.921 112.4 51.7 -62.4 -44.3 32.7 23.1 16.3 288 335 A G H X S+ 0 0 10 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.907 110.7 48.3 -59.0 -44.3 36.0 25.0 16.9 289 336 A T H X S+ 0 0 11 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.923 112.6 46.7 -61.7 -47.8 34.1 28.3 16.6 290 337 A Q H X S+ 0 0 16 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.863 113.0 49.1 -64.5 -40.5 31.3 27.3 19.0 291 338 A K H X S+ 0 0 55 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.841 111.3 48.5 -70.6 -38.5 33.6 25.9 21.7 292 339 A L H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.944 113.2 47.5 -66.4 -46.5 35.9 29.0 21.7 293 340 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.912 115.0 46.8 -57.5 -45.8 32.9 31.3 22.0 294 341 A Q H X S+ 0 0 36 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.896 112.3 48.9 -63.5 -46.4 31.5 29.2 24.8 295 342 A A H X S+ 0 0 2 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.868 109.2 54.7 -62.0 -36.6 34.9 29.0 26.6 296 343 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.970 109.8 44.7 -61.9 -51.9 35.2 32.8 26.3 297 344 A L H X S+ 0 0 24 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.837 113.8 50.6 -62.7 -33.1 31.8 33.4 28.0 298 345 A L H X S+ 0 0 42 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.848 108.3 52.7 -74.4 -34.2 32.5 30.9 30.7 299 346 A Y H X S+ 0 0 17 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.939 109.9 47.5 -61.2 -49.9 35.9 32.4 31.4 300 347 A M H X S+ 0 0 18 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.917 113.1 49.7 -59.9 -43.7 34.4 35.9 31.8 301 348 A G H X S+ 0 0 16 -4,-2.0 4,-3.2 2,-0.2 -1,-0.2 0.922 109.4 49.9 -59.2 -48.7 31.7 34.4 34.1 302 349 A S H X S+ 0 0 34 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.835 110.4 52.1 -60.5 -36.0 34.2 32.5 36.3 303 350 A K H X S+ 0 0 76 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.882 112.5 43.5 -68.0 -42.4 36.2 35.8 36.7 304 351 A L H X S+ 0 0 92 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.903 116.2 49.4 -67.9 -40.7 33.1 37.7 37.8 305 352 A T H X S+ 0 0 34 -4,-3.2 4,-3.1 2,-0.2 -2,-0.2 0.926 112.0 46.8 -62.1 -47.0 32.1 34.8 40.1 306 353 A S H X S+ 0 0 14 -4,-2.7 4,-1.9 2,-0.2 5,-0.2 0.813 110.3 53.6 -68.3 -30.5 35.5 34.6 41.6 307 354 A Q H X S+ 0 0 67 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.920 113.8 43.0 -65.3 -44.1 35.6 38.4 42.1 308 355 A D H X S+ 0 0 83 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.953 118.1 43.8 -61.6 -53.5 32.3 38.2 43.9 309 356 A E H X S+ 0 0 5 -4,-3.1 4,-2.5 2,-0.2 -2,-0.2 0.758 108.6 56.2 -74.0 -27.5 33.2 35.1 46.0 310 357 A T H X S+ 0 0 46 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.934 112.5 42.4 -65.2 -49.4 36.8 36.3 47.0 311 358 A K H X S+ 0 0 140 -4,-1.3 4,-1.8 -5,-0.2 -2,-0.2 0.909 116.6 50.2 -62.2 -41.5 35.4 39.5 48.5 312 359 A E H X S+ 0 0 57 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.896 111.8 45.8 -65.2 -41.5 32.6 37.5 50.1 313 360 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.870 109.9 54.9 -73.4 -35.9 34.8 34.9 51.6 314 361 A T H X S+ 0 0 55 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.896 109.1 46.9 -61.9 -43.2 37.3 37.5 53.0 315 362 A A H X S+ 0 0 57 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.849 113.5 49.2 -68.1 -36.6 34.5 39.3 54.8 316 363 A I H X S+ 0 0 7 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.919 115.0 44.0 -64.7 -47.0 33.2 36.0 56.2 317 364 A F H X S+ 0 0 0 -4,-2.8 4,-1.1 2,-0.2 -2,-0.2 0.837 111.8 53.7 -70.2 -34.1 36.7 35.0 57.3 318 365 A H H < S+ 0 0 123 -4,-2.5 3,-0.4 2,-0.2 -2,-0.2 0.935 110.7 45.8 -62.1 -47.9 37.4 38.5 58.7 319 366 A K H < S+ 0 0 185 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.856 111.6 52.2 -64.5 -36.2 34.2 38.4 60.9 320 367 A M H < S+ 0 0 46 -4,-1.9 2,-2.4 1,-0.2 -1,-0.2 0.702 86.4 90.1 -71.8 -21.1 35.1 34.9 62.0 321 368 A D < + 0 0 15 -4,-1.1 3,-0.4 -3,-0.4 -1,-0.2 -0.483 48.2 161.0 -75.0 72.9 38.6 36.2 63.0 322 369 A K S S+ 0 0 101 -2,-2.4 -1,-0.2 1,-0.2 -2,-0.1 0.666 73.2 58.5 -70.8 -17.7 37.4 37.0 66.5 323 370 A N S S- 0 0 124 4,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.825 95.9-144.6 -72.3 -37.2 41.1 37.0 67.5 324 371 A G + 0 0 62 -3,-0.4 -2,-0.1 3,-0.2 -3,-0.1 0.478 65.5 121.1 79.2 6.0 41.8 39.8 64.9 325 372 A D S S- 0 0 72 2,-0.2 3,-0.1 1,-0.1 -3,-0.1 0.471 84.0-114.1 -83.7 -3.3 45.2 38.0 64.4 326 373 A G S S+ 0 0 28 1,-0.3 43,-0.8 -8,-0.1 44,-0.5 0.424 84.5 96.0 85.9 1.3 44.7 37.4 60.6 327 374 A Q - 0 0 108 41,-0.3 2,-0.3 42,-0.1 -1,-0.3 -0.851 48.6-171.7-129.1 157.6 44.5 33.6 61.1 328 375 A L - 0 0 22 -2,-0.3 -7,-0.1 -3,-0.1 2,-0.0 -0.964 24.5-110.3-144.4 157.1 41.9 30.8 61.6 329 376 A D > - 0 0 105 -2,-0.3 4,-1.6 1,-0.1 5,-0.1 -0.219 36.3-107.2 -74.0 173.2 41.7 27.1 62.4 330 377 A R H > S+ 0 0 110 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.821 120.3 56.5 -66.9 -34.1 40.8 24.4 60.0 331 378 A A H > S+ 0 0 70 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.907 110.2 41.4 -66.1 -45.6 37.4 24.1 61.9 332 379 A E H > S+ 0 0 65 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.867 109.9 58.2 -70.7 -38.7 36.5 27.8 61.4 333 380 A L H X S+ 0 0 11 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.852 107.6 49.1 -57.4 -37.1 37.8 27.8 57.8 334 381 A I H X S+ 0 0 12 -4,-1.5 4,-2.8 2,-0.2 -1,-0.2 0.892 109.1 51.2 -68.6 -42.8 35.2 25.0 57.1 335 382 A E H X S+ 0 0 39 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.888 115.4 42.6 -61.5 -42.5 32.3 26.9 58.8 336 383 A G H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.890 114.2 49.0 -71.6 -44.0 33.1 30.0 56.7 337 384 A Y H X S+ 0 0 0 -4,-2.2 4,-1.1 -5,-0.2 -2,-0.2 0.932 113.9 48.2 -59.8 -44.6 33.6 28.1 53.4 338 385 A K H X S+ 0 0 64 -4,-2.8 4,-1.0 1,-0.2 -2,-0.2 0.871 109.5 52.7 -60.3 -40.5 30.3 26.3 54.2 339 386 A E H X S+ 0 0 59 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.821 105.3 54.2 -65.7 -34.2 28.6 29.7 54.9 340 387 A L H X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.809 106.9 53.9 -64.2 -30.5 29.9 30.9 51.5 341 388 A M H < S+ 0 0 32 -4,-1.1 -2,-0.2 -3,-0.2 -1,-0.2 0.687 104.9 52.3 -82.0 -22.8 28.2 27.9 50.0 342 389 A R H < S+ 0 0 164 -4,-1.0 -2,-0.2 -3,-0.2 -1,-0.2 0.946 111.6 45.0 -72.3 -54.3 24.7 28.6 51.6 343 390 A M H < S+ 0 0 102 -4,-1.6 -2,-0.2 2,-0.0 -3,-0.1 0.943 116.3 50.5 -54.3 -54.0 24.6 32.2 50.3 344 391 A K < - 0 0 32 -4,-1.8 0, 0.0 -5,-0.2 0, 0.0 -0.264 66.9-160.4 -79.8 170.0 25.7 31.2 46.8 345 392 A G + 0 0 29 -2,-0.0 -301,-0.1 -304,-0.0 -304,-0.1 -0.102 62.7 92.8-147.4 42.4 24.1 28.3 44.8 346 393 A Q + 0 0 76 1,-0.1 2,-1.7 -5,-0.1 3,-0.2 0.679 54.5 93.8-110.4 -27.1 26.6 27.3 42.1 347 394 A D > + 0 0 22 1,-0.2 3,-0.6 -6,-0.1 -1,-0.1 -0.533 30.9 154.8 -79.7 84.0 28.7 24.5 43.7 348 395 A A G > S+ 0 0 13 -2,-1.7 3,-0.9 1,-0.2 -1,-0.2 0.803 73.4 66.2 -67.1 -31.7 26.9 21.3 42.6 349 396 A S G 3 S+ 0 0 59 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.607 105.1 41.7 -68.2 -15.1 30.3 19.6 43.1 350 397 A M G < + 0 0 15 -3,-0.6 2,-0.8 1,-0.1 -1,-0.3 -0.364 66.4 139.4-130.4 54.2 30.1 20.2 46.9 351 398 A L < + 0 0 41 -3,-0.9 2,-0.2 4,-0.1 -345,-0.1 -0.382 62.4 60.4 -94.3 54.7 26.5 19.4 47.8 352 399 A D S >> S- 0 0 65 -2,-0.8 4,-1.3 1,-0.1 3,-0.7 -0.873 84.4-118.5-175.3 143.9 27.5 17.6 51.0 353 400 A A H 3> S+ 0 0 50 1,-0.3 4,-1.2 -2,-0.2 3,-0.1 0.836 114.8 53.3 -59.0 -37.7 29.4 18.5 54.3 354 401 A S H 3> S+ 0 0 53 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.786 102.6 58.7 -66.0 -30.7 32.1 15.9 53.6 355 402 A A H <> S+ 0 0 24 -3,-0.7 4,-1.7 1,-0.2 -1,-0.2 0.868 103.6 51.7 -68.2 -36.8 32.8 17.4 50.1 356 403 A V H X S+ 0 0 5 -4,-1.3 4,-2.3 1,-0.2 -1,-0.2 0.865 105.3 55.0 -69.4 -38.4 33.6 20.8 51.6 357 404 A E H X S+ 0 0 67 -4,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.840 108.3 50.4 -60.8 -34.3 36.1 19.3 54.0 358 405 A H H X S+ 0 0 117 -4,-1.2 4,-2.2 2,-0.2 -2,-0.2 0.872 109.4 48.1 -75.8 -39.8 38.0 17.6 51.1 359 406 A E H X S+ 0 0 39 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.933 112.3 50.6 -62.4 -46.6 38.2 20.8 49.0 360 407 A V H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.929 111.1 48.8 -55.0 -47.2 39.5 22.7 52.1 361 408 A D H X S+ 0 0 49 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.871 108.3 53.4 -62.8 -39.3 42.1 19.9 52.7 362 409 A Q H X S+ 0 0 103 -4,-2.2 4,-0.7 2,-0.2 -1,-0.2 0.841 113.3 44.7 -60.6 -34.1 43.1 20.1 49.0 363 410 A V H < S+ 0 0 4 -4,-1.8 3,-0.4 -3,-0.2 -2,-0.2 0.894 109.8 52.9 -77.9 -43.2 43.7 23.9 49.5 364 411 A L H < S+ 0 0 76 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.854 106.5 54.6 -60.5 -35.3 45.5 23.6 52.9 365 412 A D H < 0 0 131 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.790 360.0 360.0 -70.5 -28.1 47.9 21.1 51.2 366 413 A A < 0 0 87 -4,-0.7 -2,-0.1 -3,-0.4 -3,-0.1 0.770 360.0 360.0 -83.2 360.0 48.6 23.8 48.5 367 ! 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 0.0 368 423 A E >> 0 0 143 0, 0.0 3,-1.5 0, 0.0 4,-1.1 0.000 360.0 360.0 360.0 83.2 46.4 32.9 57.5 369 424 A Y H 3> + 0 0 24 -43,-0.8 4,-2.1 1,-0.3 5,-0.1 0.655 360.0 68.0 -58.6 -23.4 43.0 33.2 55.7 370 425 A S H 3> S+ 0 0 72 -44,-0.5 4,-1.6 2,-0.2 -1,-0.3 0.901 103.9 43.3 -60.1 -46.2 44.2 35.6 53.0 371 426 A E H <> S+ 0 0 45 -3,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.894 112.2 53.9 -67.7 -41.4 46.5 33.0 51.4 372 427 A F H X S+ 0 0 15 -4,-1.1 4,-2.5 1,-0.2 -2,-0.2 0.852 106.8 53.3 -58.0 -38.5 43.8 30.3 51.7 373 428 A V H X S+ 0 0 4 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.905 107.3 50.2 -66.2 -42.5 41.3 32.5 49.9 374 429 A T H X S+ 0 0 77 -4,-1.6 4,-2.1 1,-0.2 5,-0.2 0.949 115.7 42.0 -59.6 -49.9 43.7 33.1 46.9 375 430 A V H X S+ 0 0 46 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.905 111.5 54.1 -67.5 -44.2 44.3 29.4 46.5 376 431 A A H < S+ 0 0 0 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.867 116.9 38.8 -56.5 -38.5 40.7 28.3 47.0 377 432 A M H X S+ 0 0 2 -4,-1.8 4,-1.9 2,-0.2 3,-0.3 0.744 109.7 56.5 -88.8 -29.5 39.5 30.7 44.3 378 433 A D H X S+ 0 0 81 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.856 101.6 61.9 -65.8 -35.9 42.4 30.2 41.7 379 434 A R H < S+ 0 0 80 -4,-1.9 4,-0.4 -5,-0.2 -1,-0.2 0.794 106.9 44.6 -54.2 -33.8 41.3 26.5 41.9 380 435 A K H > S+ 0 0 48 -4,-0.3 4,-0.7 -3,-0.3 3,-0.3 0.936 118.2 39.9 -76.0 -50.6 37.9 27.6 40.5 381 436 A T H X S+ 0 0 18 -4,-1.9 4,-2.0 1,-0.2 3,-0.5 0.840 105.5 61.4 -74.5 -38.3 39.1 29.9 37.8 382 437 A L H X S+ 0 0 67 -4,-2.8 4,-3.0 1,-0.2 5,-0.3 0.797 97.0 62.2 -64.8 -26.5 42.1 28.1 36.4 383 438 A L H > S+ 0 0 122 -4,-0.4 4,-1.0 -3,-0.3 -1,-0.2 0.921 113.4 35.6 -58.5 -45.4 39.8 25.1 35.5 384 439 A S H X S+ 0 0 6 -4,-0.7 4,-1.1 -3,-0.5 -2,-0.2 0.727 116.5 56.0 -78.8 -25.7 38.0 27.6 33.1 385 440 A R H X S+ 0 0 71 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.904 107.2 46.9 -73.8 -44.2 41.3 29.4 32.2 386 441 A E H X S+ 0 0 120 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.890 111.3 53.3 -63.8 -36.4 43.1 26.2 31.0 387 442 A R H X S+ 0 0 75 -4,-1.0 4,-2.0 -5,-0.3 -1,-0.2 0.805 105.1 54.7 -69.5 -30.7 40.0 25.3 29.0 388 443 A L H X S+ 0 0 0 -4,-1.1 4,-2.5 2,-0.2 -1,-0.2 0.947 110.2 45.1 -62.9 -51.6 40.0 28.8 27.3 389 444 A E H X S+ 0 0 57 -4,-1.8 4,-2.9 1,-0.2 -2,-0.2 0.905 112.2 51.9 -60.8 -44.3 43.6 28.3 26.2 390 445 A R H X S+ 0 0 156 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.898 111.2 47.7 -58.5 -41.9 42.8 24.8 25.0 391 446 A A H X S+ 0 0 13 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.867 110.6 51.9 -69.3 -37.3 39.9 26.1 23.0 392 447 A F H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.945 111.2 46.9 -59.6 -49.5 42.1 28.9 21.5 393 448 A R H < S+ 0 0 113 -4,-2.9 6,-0.3 1,-0.2 -2,-0.2 0.884 112.4 50.7 -61.2 -38.8 44.7 26.3 20.4 394 449 A M H < S+ 0 0 127 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.918 110.9 48.2 -63.5 -45.0 41.9 24.1 19.0 395 450 A F H < S+ 0 0 22 -4,-2.3 2,-2.3 1,-0.2 -2,-0.2 0.895 99.2 69.6 -63.9 -40.6 40.5 27.1 17.0 396 451 A D >< + 0 0 7 -4,-2.4 3,-2.2 1,-0.2 -1,-0.2 -0.407 65.1 166.2 -77.1 66.3 43.9 28.0 15.7 397 452 A S T 3 S+ 0 0 102 -2,-2.3 -1,-0.2 1,-0.3 -2,-0.1 0.698 70.7 53.7 -61.8 -24.1 44.1 24.8 13.5 398 453 A D T 3 S- 0 0 112 -3,-0.2 -1,-0.3 0, 0.0 -2,-0.1 0.373 106.6-125.4 -90.1 3.7 47.1 26.1 11.5 399 454 A N < + 0 0 137 -3,-2.2 -2,-0.1 -6,-0.3 -3,-0.0 0.819 64.2 141.0 53.5 34.5 49.1 26.7 14.6 400 455 A S - 0 0 61 2,-0.2 -1,-0.1 1,-0.1 3,-0.1 0.733 60.6-131.9 -71.0 -25.0 49.7 30.4 13.6 401 456 A G S S+ 0 0 20 1,-0.2 38,-0.5 -5,-0.2 2,-0.3 0.288 74.5 91.0 87.3 -6.2 49.4 31.5 17.3 402 457 A K E -I 438 0D 77 36,-0.2 2,-0.4 37,-0.1 36,-0.2 -0.872 61.5-149.9-128.6 148.7 47.0 34.3 16.1 403 458 A I E -I 437 0D 0 34,-2.4 34,-2.2 -2,-0.3 -7,-0.0 -0.981 29.4-134.5-113.2 128.4 43.2 34.9 15.6 404 459 A S E > -I 436 0D 35 -2,-0.4 4,-2.5 32,-0.2 32,-0.2 -0.230 23.0-105.5 -75.2 171.5 42.5 37.5 12.8 405 460 A S H > S+ 0 0 41 30,-1.5 4,-1.9 2,-0.2 5,-0.1 0.831 121.7 54.3 -66.6 -36.0 40.0 40.3 13.0 406 461 A T H > S+ 0 0 110 29,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.931 111.1 46.9 -61.3 -44.8 37.5 38.4 10.8 407 462 A E H > S+ 0 0 66 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.896 109.0 51.9 -68.0 -43.7 37.7 35.5 13.2 408 463 A L H X S+ 0 0 0 -4,-2.5 4,-3.5 1,-0.2 5,-0.3 0.902 108.2 54.4 -56.9 -41.5 37.3 37.6 16.3 409 464 A A H X S+ 0 0 47 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.909 110.3 45.4 -59.3 -44.4 34.2 39.1 14.6 410 465 A T H X S+ 0 0 74 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.923 116.6 45.8 -61.7 -46.4 32.7 35.6 14.1 411 466 A I H X S+ 0 0 0 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.908 116.0 43.8 -67.7 -45.7 33.6 34.5 17.7 412 467 A F H <>S+ 0 0 1 -4,-3.5 5,-2.7 2,-0.2 4,-0.4 0.805 111.5 56.0 -72.1 -28.6 32.3 37.7 19.3 413 468 A G H ><5S+ 0 0 15 -4,-2.0 3,-1.0 -5,-0.3 -200,-0.5 0.944 110.1 44.3 -62.4 -48.6 29.2 37.5 17.1 414 469 A V H 3<5S+ 0 0 24 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.795 115.7 49.3 -64.3 -30.2 28.5 34.0 18.3 415 470 A S T 3<5S- 0 0 2 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.413 110.6-123.8 -89.0 -2.6 29.2 35.2 21.9 416 471 A D T < 5 + 0 0 90 -3,-1.0 2,-0.6 -4,-0.4 -3,-0.2 0.852 57.1 151.2 59.9 38.0 26.9 38.2 21.5 417 472 A V < - 0 0 25 -5,-2.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.913 54.0-107.0 -97.9 125.4 29.6 40.8 22.4 418 473 A D > - 0 0 82 -2,-0.6 4,-2.3 -3,-0.1 5,-0.3 -0.185 18.9-130.0 -59.4 137.1 28.9 44.0 20.6 419 474 A S H > S+ 0 0 58 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.915 108.0 44.6 -56.5 -51.4 31.1 44.9 17.6 420 475 A E H > S+ 0 0 137 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.858 111.7 56.9 -59.1 -36.5 31.9 48.4 18.8 421 476 A T H > S+ 0 0 66 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.940 108.8 40.9 -67.0 -48.3 32.5 47.2 22.3 422 477 A W H X S+ 0 0 5 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.847 112.0 55.3 -73.8 -29.9 35.2 44.6 21.6 423 478 A K H X S+ 0 0 100 -4,-1.7 4,-2.2 -5,-0.3 -1,-0.2 0.906 107.8 50.6 -64.2 -42.4 37.1 46.8 19.0 424 479 A S H X S+ 0 0 73 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.879 109.7 51.3 -57.4 -42.1 37.3 49.5 21.7 425 480 A V H X S+ 0 0 13 -4,-1.5 4,-1.2 2,-0.2 3,-0.3 0.913 108.5 50.8 -64.1 -43.0 38.7 46.8 24.1 426 481 A L H X S+ 0 0 8 -4,-2.3 4,-2.9 1,-0.2 3,-0.4 0.899 106.3 54.9 -60.8 -43.5 41.4 45.7 21.5 427 482 A S H < S+ 0 0 77 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.821 108.6 49.9 -57.4 -32.8 42.5 49.4 21.1 428 483 A E H < S+ 0 0 136 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.739 113.6 44.4 -80.5 -25.6 43.0 49.5 24.8 429 484 A V H < S+ 0 0 27 -4,-1.2 2,-0.3 -3,-0.4 -2,-0.2 0.856 134.8 8.6 -82.6 -42.2 45.1 46.3 24.9 430 485 A D >< - 0 0 50 -4,-2.9 3,-1.5 -5,-0.1 -1,-0.3 -0.797 60.3-171.5-147.2 98.1 47.2 47.1 21.8 431 486 A K T 3 S+ 0 0 89 -2,-0.3 -4,-0.1 1,-0.3 -1,-0.1 0.687 91.8 42.5 -65.5 -19.7 47.0 50.6 20.3 432 487 A N T 3 S+ 0 0 149 2,-0.0 -1,-0.3 -5,-0.0 -5,-0.1 0.294 80.4 151.4-106.9 7.7 49.1 49.5 17.3 433 488 A N < - 0 0 42 -3,-1.5 4,-0.1 -7,-0.2 2,-0.0 -0.021 38.9-147.1 -52.9 142.8 47.6 46.1 16.6 434 489 A D - 0 0 124 2,-0.3 -1,-0.1 1,-0.0 -29,-0.1 -0.261 61.0 -71.2-108.7 44.4 47.7 44.9 13.0 435 490 A G S S+ 0 0 29 1,-0.2 -30,-1.5 -31,-0.1 2,-0.3 0.673 108.4 77.7 82.7 19.9 44.4 42.9 12.7 436 491 A E E -I 404 0D 69 -32,-0.2 2,-0.4 -31,-0.1 -2,-0.3 -0.990 55.4-154.3-157.3 152.0 45.4 39.9 14.8 437 492 A V E -I 403 0D 0 -34,-2.2 -34,-2.4 -2,-0.3 2,-0.1 -0.976 10.4-142.2-128.4 141.0 45.7 38.8 18.4 438 493 A D E > -I 402 0D 54 -2,-0.4 4,-2.3 -36,-0.2 5,-0.2 -0.318 45.6 -88.2 -83.4 179.5 47.8 36.1 20.2 439 494 A F H > S+ 0 0 11 -38,-0.5 4,-2.7 1,-0.2 5,-0.2 0.884 124.8 50.0 -59.7 -44.8 46.3 34.2 23.1 440 495 A D H > S+ 0 0 79 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.876 111.6 49.4 -68.8 -33.6 47.4 36.6 25.9 441 496 A E H > S+ 0 0 39 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.937 110.8 50.4 -65.4 -47.4 45.9 39.6 24.0 442 497 A F H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.941 112.5 47.0 -51.8 -51.6 42.7 37.7 23.5 443 498 A Q H X S+ 0 0 17 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.903 109.6 53.5 -58.6 -44.0 42.6 36.8 27.2 444 499 A Q H X S+ 0 0 66 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.877 107.6 52.3 -57.8 -39.7 43.3 40.5 28.0 445 500 A M H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.928 108.5 48.8 -63.5 -44.7 40.4 41.5 25.9 446 501 A L H < S+ 0 0 0 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.883 107.3 56.4 -63.7 -37.9 38.0 39.2 27.7 447 502 A L H ><>S+ 0 0 34 -4,-2.2 5,-2.3 1,-0.2 3,-1.1 0.923 108.8 46.5 -58.1 -44.9 39.2 40.5 31.0 448 503 A K H ><5S+ 0 0 65 -4,-1.8 3,-1.1 4,-0.2 -1,-0.2 0.784 105.4 61.1 -67.7 -28.3 38.3 44.0 30.0 449 504 A L T 3<5S+ 0 0 39 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.503 106.0 46.4 -79.9 -5.1 34.9 42.8 28.7 450 505 A C T < 5S- 0 0 11 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 -0.086 127.7 -94.2-122.8 35.6 34.0 41.6 32.3 451 506 A G T < 5 0 0 64 -3,-1.1 -3,-0.2 1,-0.1 -2,-0.1 0.787 360.0 360.0 65.6 34.4 35.2 44.8 34.0 452 507 A N < 0 0 82 -5,-2.3 -4,-0.2 -6,-0.1 -3,-0.1 -0.223 360.0 360.0-132.1 360.0 38.7 43.7 34.9