==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE/RNA 28-JUN-00 1F7V . COMPND 2 MOLECULE: TRNA(ARG); . SOURCE 2 SYNTHETIC: YES; . AUTHOR B.DELAGOUTTE,D.MORAS,J.CAVARELLI . 606 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28491.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 481 79.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 5.0 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 36 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 278 45.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.7 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 1 2 1 0 3 1 1 3 2 2 1 0 1 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 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 0 0 PARALLEL BRIDGES PER LADDER . 2 1 1 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 2 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 2 A A 0 0 136 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 165.2 -14.7 52.1 47.8 2 3 A S > - 0 0 78 0, 0.0 4,-2.5 0, 0.0 5,-0.1 -0.498 360.0 -35.0-149.2-141.1 -11.1 52.7 46.6 3 4 A T H > S+ 0 0 41 2,-0.3 4,-1.6 1,-0.2 5,-0.1 0.892 129.0 45.7 -67.0 -47.5 -7.4 52.6 47.6 4 5 A A H > S+ 0 0 72 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.803 118.4 50.2 -65.9 -23.9 -7.4 53.4 51.3 5 6 A N H > S+ 0 0 80 2,-0.2 4,-2.4 1,-0.2 3,-0.3 0.878 102.0 57.0 -78.9 -43.0 -10.3 50.9 51.3 6 7 A M H X S+ 0 0 62 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.874 103.9 56.5 -56.1 -38.4 -8.5 48.1 49.4 7 8 A I H X S+ 0 0 17 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.883 107.1 47.7 -60.4 -42.0 -5.9 48.3 52.1 8 9 A S H X S+ 0 0 71 -4,-0.8 4,-1.9 -3,-0.3 -2,-0.2 0.936 111.4 49.4 -65.6 -47.8 -8.5 47.6 54.8 9 10 A Q H < S+ 0 0 96 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.881 115.3 46.5 -57.6 -38.0 -10.0 44.8 52.8 10 11 A L H >< S+ 0 0 0 -4,-2.4 3,-0.8 -5,-0.2 -1,-0.2 0.766 109.9 51.5 -76.8 -27.5 -6.5 43.4 52.5 11 12 A K H 3< S+ 0 0 103 -4,-1.9 16,-0.3 1,-0.2 -2,-0.2 0.741 113.7 44.9 -79.6 -25.0 -5.6 43.9 56.2 12 13 A K T 3< S+ 0 0 198 -4,-1.9 2,-0.5 -5,-0.1 -1,-0.2 -0.252 94.6 108.2-110.1 41.1 -8.7 42.1 57.3 13 14 A L < - 0 0 38 -3,-0.8 2,-0.6 -5,-0.0 3,-0.2 -0.967 44.9-174.5-126.1 115.9 -8.1 39.3 54.7 14 15 A S + 0 0 82 -2,-0.5 7,-0.1 1,-0.2 37,-0.1 -0.546 24.0 152.4-107.1 64.5 -7.0 35.8 55.7 15 16 A I + 0 0 11 -2,-0.6 -1,-0.2 35,-0.1 39,-0.2 0.713 57.2 85.3 -63.6 -20.6 -6.5 34.4 52.2 16 17 A A S S- 0 0 4 -3,-0.2 35,-0.1 1,-0.1 36,-0.1 -0.470 90.7-105.9 -80.2 155.2 -3.9 32.2 53.9 17 18 A E > - 0 0 101 34,-0.3 4,-3.2 -2,-0.1 5,-0.4 -0.213 42.6 -86.1 -76.0 170.9 -5.1 28.9 55.6 18 19 A P T 4 S+ 0 0 133 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.678 130.6 42.7 -50.8 -17.3 -5.4 28.4 59.4 19 20 A A T >4 S+ 0 0 60 2,-0.1 3,-0.5 3,-0.0 -3,-0.1 0.895 122.8 30.2 -95.4 -54.5 -1.7 27.5 59.4 20 21 A V G >> S+ 0 0 27 1,-0.2 3,-2.3 2,-0.1 4,-0.7 0.785 106.9 70.5 -78.5 -28.7 -0.0 30.0 57.0 21 22 A A G 3< S+ 0 0 16 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.1 0.704 84.9 71.4 -61.2 -18.5 -2.4 32.9 57.8 22 23 A K G <4 S+ 0 0 90 -3,-0.5 -1,-0.3 -5,-0.4 -2,-0.1 0.384 100.3 48.4 -76.7 5.0 -0.7 33.0 61.2 23 24 A D T <4 S+ 0 0 61 -3,-2.3 2,-0.5 9,-0.0 -2,-0.2 0.593 89.8 92.9-112.5 -27.3 2.1 34.4 59.1 24 25 A S < + 0 0 12 -4,-0.7 3,-0.1 1,-0.1 -8,-0.0 -0.603 40.5 160.3 -75.8 119.9 0.1 37.0 57.2 25 26 A H >> + 0 0 11 -2,-0.5 3,-2.1 4,-0.2 4,-0.8 -0.488 4.9 169.0-139.4 63.7 0.3 40.3 59.1 26 27 A P T 34 S+ 0 0 11 0, 0.0 3,-0.3 0, 0.0 7,-0.3 0.769 74.5 65.6 -47.2 -31.4 -0.7 42.9 56.5 27 28 A D T 34 S+ 0 0 74 -16,-0.3 3,-0.1 1,-0.2 -16,-0.1 0.797 118.4 17.4 -66.9 -30.1 -0.9 45.4 59.3 28 29 A V T <4 S+ 0 0 25 -3,-2.1 2,-0.3 1,-0.2 -1,-0.2 0.152 119.9 61.1-131.3 20.0 2.8 45.4 60.2 29 30 A N >X - 0 0 6 -4,-0.8 4,-1.9 -3,-0.3 3,-0.9 -0.797 57.3-164.2-150.2 100.2 4.5 43.8 57.1 30 31 A I H 3> S+ 0 0 16 -2,-0.3 4,-2.2 1,-0.3 5,-0.1 0.833 92.5 57.4 -54.8 -34.5 4.1 45.6 53.8 31 32 A V H 3> S+ 0 0 7 500,-0.6 4,-2.6 1,-0.2 -1,-0.3 0.855 104.8 51.1 -68.0 -33.3 5.2 42.5 51.9 32 33 A D H <> S+ 0 0 0 -3,-0.9 4,-3.0 2,-0.2 -1,-0.2 0.919 105.8 55.5 -67.7 -42.3 2.4 40.5 53.5 33 34 A L H X S+ 0 0 3 -4,-1.9 4,-2.8 -7,-0.3 -2,-0.2 0.950 111.7 44.3 -53.2 -49.5 -0.0 43.2 52.4 34 35 A M H X S+ 0 0 0 -4,-2.2 4,-3.3 2,-0.2 5,-0.3 0.899 108.7 56.5 -62.5 -41.4 1.3 42.7 48.9 35 36 A R H X S+ 0 0 16 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.931 110.4 46.5 -56.1 -44.2 1.2 38.9 49.3 36 37 A N H X S+ 0 0 0 -4,-3.0 4,-3.0 2,-0.2 5,-0.3 0.989 114.6 45.8 -59.6 -60.7 -2.5 39.3 50.1 37 38 A Y H X S+ 0 0 7 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.940 114.4 46.8 -46.5 -61.3 -3.2 41.6 47.2 38 39 A I H X S+ 0 0 0 -4,-3.3 4,-2.9 1,-0.2 -1,-0.2 0.864 114.5 48.8 -51.8 -41.0 -1.3 39.5 44.7 39 40 A S H X S+ 0 0 0 -4,-2.2 4,-2.2 -5,-0.3 5,-0.2 0.969 110.8 48.2 -64.3 -55.2 -3.0 36.4 45.9 40 41 A Q H X S+ 0 0 30 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.925 118.5 41.5 -50.8 -50.3 -6.5 37.8 45.8 41 42 A E H X S+ 0 0 17 -4,-2.7 4,-1.4 -5,-0.3 -1,-0.2 0.924 112.8 50.2 -67.2 -48.3 -6.0 39.1 42.3 42 43 A L H X S+ 0 0 0 -4,-2.9 4,-3.3 -5,-0.3 6,-0.3 0.804 108.4 56.1 -62.5 -27.5 -4.1 36.2 40.8 43 44 A S H X S+ 0 0 31 -4,-2.2 4,-3.1 -5,-0.2 -1,-0.2 0.961 104.3 51.7 -67.0 -49.4 -6.9 33.9 42.1 44 45 A K H < S+ 0 0 144 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.811 118.4 39.9 -56.0 -30.2 -9.5 36.0 40.2 45 46 A I H < S+ 0 0 33 -4,-1.4 -2,-0.2 -5,-0.1 -1,-0.2 0.901 123.9 33.8 -86.2 -44.7 -7.4 35.5 37.1 46 47 A S H < S- 0 0 26 -4,-3.3 -3,-0.2 2,-0.2 -2,-0.2 0.793 91.2-130.2 -84.3 -32.4 -6.2 31.9 37.5 47 48 A G < + 0 0 70 -4,-3.1 2,-0.2 1,-0.4 -4,-0.1 0.273 65.0 132.3 96.3 -10.6 -9.2 30.2 39.1 48 49 A V S S- 0 0 23 -6,-0.3 -1,-0.4 -5,-0.2 -2,-0.2 -0.543 70.1 -97.2 -78.5 138.8 -6.8 28.7 41.7 49 50 A D >> - 0 0 83 -2,-0.2 3,-1.4 1,-0.2 4,-1.1 -0.271 28.2-132.3 -53.9 135.2 -7.7 29.0 45.4 50 51 A S H 3> S+ 0 0 22 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.780 105.7 63.7 -63.3 -28.0 -5.9 32.0 46.9 51 52 A S H 34 S+ 0 0 25 1,-0.2 -34,-0.3 2,-0.2 -1,-0.3 0.732 103.4 50.3 -67.8 -20.6 -4.7 29.8 49.8 52 53 A L H <4 S+ 0 0 101 -3,-1.4 4,-0.2 2,-0.1 -1,-0.2 0.804 113.1 44.9 -84.0 -32.9 -2.8 27.8 47.2 53 54 A I H >X S+ 0 0 0 -4,-1.1 3,-1.7 2,-0.1 4,-0.6 0.918 99.7 68.1 -76.7 -47.5 -1.2 30.9 45.7 54 55 A F G >< S+ 0 0 7 -4,-2.7 3,-1.9 1,-0.3 -2,-0.1 0.891 103.8 40.9 -40.6 -63.6 -0.1 32.7 48.9 55 56 A P G 34 S+ 0 0 66 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.628 107.9 65.2 -66.0 -9.9 2.6 30.3 50.0 56 57 A A G <4 S+ 0 0 4 -3,-1.7 2,-0.5 -4,-0.2 -2,-0.2 0.557 78.3 100.6 -87.4 -8.8 3.7 29.9 46.4 57 58 A L << - 0 0 11 -3,-1.9 2,-0.4 -4,-0.6 13,-0.2 -0.678 60.3-163.5 -79.5 122.5 4.8 33.6 46.4 58 59 A E E -A 69 0A 77 11,-3.9 11,-2.0 -2,-0.5 2,-0.2 -0.869 20.6-123.2-113.1 143.2 8.6 33.8 46.9 59 60 A W E -A 68 0A 125 -2,-0.4 9,-0.2 9,-0.2 8,-0.1 -0.559 44.8-109.7 -75.2 146.7 10.7 36.8 47.8 60 61 A T - 0 0 23 7,-0.7 3,-0.1 -2,-0.2 -1,-0.1 -0.273 5.5-127.3 -82.2 165.3 13.4 37.3 45.1 61 62 A N S S+ 0 0 111 1,-0.2 2,-0.3 -2,-0.0 -1,-0.1 0.974 94.7 9.7 -69.3 -60.1 17.1 36.8 45.1 62 63 A T S > S- 0 0 71 1,-0.0 3,-1.4 0, 0.0 -1,-0.2 -0.844 81.7-111.6-119.4 157.3 18.1 40.2 43.9 63 64 A M T 3 S+ 0 0 34 -2,-0.3 3,-0.4 1,-0.3 465,-0.0 0.437 106.8 76.8 -72.3 5.1 15.9 43.2 43.5 64 65 A E T 3 S+ 0 0 169 1,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.762 89.8 54.0 -84.7 -24.1 16.2 43.0 39.7 65 66 A R S < S- 0 0 126 -3,-1.4 2,-0.2 1,-0.3 46,-0.2 0.372 120.8 -93.5 -90.9 5.3 13.7 40.1 39.4 66 67 A G - 0 0 0 -3,-0.4 -1,-0.3 44,-0.1 46,-0.2 -0.719 37.7 -79.0 116.5-168.9 11.0 41.9 41.3 67 68 A D S S+ 0 0 14 44,-3.3 -7,-0.7 1,-0.5 2,-0.3 0.695 110.5 3.1-104.8 -29.8 9.8 42.0 44.9 68 69 A L E -AB 59 111A 0 43,-1.3 43,-2.6 -9,-0.2 -1,-0.5 -0.941 68.9-175.9-147.6 161.3 8.0 38.7 44.9 69 70 A L E -AB 58 110A 14 -11,-2.0 -11,-3.9 -2,-0.3 41,-0.2 -0.975 15.1-140.0-155.7 164.2 7.6 36.0 42.3 70 71 A I E - B 0 109A 0 39,-1.5 39,-1.3 -2,-0.3 2,-0.8 -0.990 12.0-139.1-136.6 127.7 5.7 32.8 41.8 71 72 A P E >> - B 0 108A 17 0, 0.0 3,-1.7 0, 0.0 4,-0.5 -0.754 15.6-151.1 -82.0 111.0 7.0 29.6 40.1 72 73 A I G >4 S+ 0 0 3 35,-3.0 3,-2.7 -2,-0.8 4,-0.4 0.914 92.2 65.9 -50.5 -45.8 4.0 28.5 38.1 73 74 A P G >4 S+ 0 0 73 0, 0.0 3,-1.6 0, 0.0 -1,-0.3 0.812 91.5 65.9 -45.6 -31.7 5.1 24.8 38.4 74 75 A R G <4 S+ 0 0 117 -3,-1.7 -2,-0.2 1,-0.3 -4,-0.0 0.800 89.3 62.9 -64.3 -28.9 4.4 25.1 42.1 75 76 A L G << S- 0 0 22 -3,-2.7 -1,-0.3 -4,-0.5 -3,-0.1 0.611 98.1-141.7 -73.0 -9.0 0.7 25.6 41.5 76 77 A R < - 0 0 222 -3,-1.6 2,-1.0 -4,-0.4 -2,-0.1 0.925 26.8-178.2 48.2 55.9 0.7 22.1 40.1 77 78 A I > - 0 0 59 -5,-0.3 3,-2.2 1,-0.1 -1,-0.2 -0.773 32.6-113.7 -89.8 104.8 -1.9 22.9 37.3 78 79 A K T 3 S- 0 0 209 -2,-1.0 3,-0.1 1,-0.3 -1,-0.1 -0.008 86.8 -9.6 -42.1 127.2 -2.4 19.6 35.5 79 80 A G T 3 S+ 0 0 93 1,-0.2 -1,-0.3 0, 0.0 2,-0.0 0.470 100.0 140.0 62.0 3.9 -1.2 19.5 31.9 80 81 A A < - 0 0 41 -3,-2.2 -1,-0.2 1,-0.1 -4,-0.0 -0.290 53.6-131.5 -76.7 161.7 -0.6 23.2 31.9 81 82 A N >> - 0 0 80 1,-0.2 4,-2.4 -3,-0.1 3,-1.0 -0.917 14.0-158.0-115.5 101.7 2.4 25.0 30.3 82 83 A P H 3> S+ 0 0 33 0, 0.0 4,-3.4 0, 0.0 5,-0.2 0.848 88.5 57.4 -43.4 -51.3 3.9 27.4 32.9 83 84 A K H 3> S+ 0 0 135 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.869 112.4 41.6 -54.8 -39.2 5.6 29.6 30.3 84 85 A D H <> S+ 0 0 87 -3,-1.0 4,-3.2 2,-0.2 -1,-0.2 0.955 114.0 50.6 -73.7 -50.6 2.3 30.3 28.6 85 86 A L H X S+ 0 0 21 -4,-2.4 4,-3.2 2,-0.2 5,-0.5 0.923 107.9 54.6 -51.1 -48.8 0.3 30.7 31.8 86 87 A A H X S+ 0 0 0 -4,-3.4 4,-3.5 1,-0.2 -1,-0.2 0.962 112.2 43.3 -48.5 -59.3 2.9 33.2 33.1 87 88 A V H X S+ 0 0 59 -4,-1.6 4,-2.6 -5,-0.2 -1,-0.2 0.904 117.2 46.8 -52.5 -50.1 2.5 35.3 30.0 88 89 A Q H X S+ 0 0 108 -4,-3.2 4,-1.0 1,-0.2 -2,-0.2 0.990 118.5 38.6 -57.8 -65.0 -1.3 35.0 30.0 89 90 A W H < S+ 0 0 19 -4,-3.2 4,-0.4 1,-0.2 3,-0.4 0.854 116.8 54.6 -55.7 -36.9 -1.8 35.7 33.7 90 91 A A H >< S+ 0 0 7 -4,-3.5 3,-1.4 -5,-0.5 -1,-0.2 0.950 105.7 47.9 -64.1 -51.9 0.9 38.4 33.6 91 92 A E H 3< S+ 0 0 167 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.627 116.4 46.7 -65.9 -13.4 -0.4 40.5 30.7 92 93 A K T 3< S+ 0 0 150 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.404 84.0 124.0-107.2 -1.4 -3.8 40.5 32.4 93 94 A F < - 0 0 15 -3,-1.4 2,-0.5 -4,-0.4 9,-0.2 -0.477 60.5-129.2 -74.5 125.0 -2.7 41.3 35.9 94 95 A P - 0 0 52 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 -0.559 24.1-178.6 -70.4 111.1 -4.2 44.4 37.6 95 96 A C >> + 0 0 38 -2,-0.5 4,-2.0 3,-0.1 3,-0.7 0.923 16.0 164.0 -79.6 -44.9 -1.4 46.7 39.0 96 97 A G T 34 S- 0 0 60 1,-0.2 -1,-0.1 2,-0.2 -93,-0.0 -0.268 72.0 -45.1 59.2-150.1 -3.6 49.4 40.6 97 98 A D T 34 S+ 0 0 86 1,-0.1 20,-0.3 19,-0.0 -1,-0.2 0.614 136.6 64.5 -87.7 -13.2 -1.6 51.5 43.0 98 99 A F T <4 S+ 0 0 1 -3,-0.7 16,-2.7 15,-0.1 2,-0.2 0.994 97.7 44.3 -71.1 -68.3 0.0 48.5 44.6 99 100 A L E < -C 113 0A 3 -4,-2.0 14,-0.3 14,-0.3 3,-0.1 -0.535 55.5-160.2 -85.3 145.9 2.1 47.0 41.8 100 101 A E E S- 0 0 87 12,-4.7 2,-0.3 1,-0.4 13,-0.2 0.820 76.9 -21.4 -88.9 -37.5 4.4 48.8 39.4 101 102 A K E -C 112 0A 70 11,-1.2 11,-2.7 -6,-0.1 2,-0.5 -0.951 48.9-146.2-170.6 150.4 4.5 46.0 36.9 102 103 A V E -C 111 0A 20 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.992 23.8-175.9-122.8 128.2 4.0 42.3 36.5 103 104 A E E -C 110 0A 85 7,-1.5 7,-2.4 -2,-0.5 2,-0.1 -0.981 21.7-134.4-134.7 126.1 6.2 40.6 34.0 104 105 A A E +C 109 0A 36 -2,-0.4 2,-0.2 5,-0.2 5,-0.2 -0.443 27.2 175.9 -70.7 147.7 6.1 37.0 32.9 105 106 A N E > -C 108 0A 90 3,-2.7 3,-2.0 1,-0.5 -2,-0.0 -0.764 56.3 -50.8-158.2 104.7 9.6 35.4 32.8 106 107 A G T 3 S- 0 0 34 1,-0.3 -1,-0.5 -2,-0.2 -19,-0.2 -0.319 120.9 -21.8 58.8-147.2 10.0 31.7 31.9 107 108 A P T 3 S+ 0 0 36 0, 0.0 -35,-3.0 0, 0.0 2,-0.3 0.239 127.6 87.6 -77.8 18.3 7.7 29.6 34.1 108 109 A F E < -BC 71 105A 70 -3,-2.0 -3,-2.7 -37,-0.2 2,-0.4 -0.786 63.1-150.3-117.8 161.7 7.6 32.5 36.6 109 110 A I E -BC 70 104A 0 -39,-1.3 -39,-1.5 -2,-0.3 2,-0.3 -0.986 20.2-153.6-128.3 117.6 5.6 35.7 37.1 110 111 A Q E -BC 69 103A 14 -7,-2.4 -7,-1.5 -2,-0.4 2,-0.5 -0.666 1.4-154.0 -94.5 149.3 7.4 38.6 38.8 111 112 A F E -BC 68 102A 0 -43,-2.6 -44,-3.3 -2,-0.3 -43,-1.3 -0.973 3.0-163.9-126.6 117.9 5.8 41.3 40.8 112 113 A F E - 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0 0 71 1,-0.1 4,-1.9 2,-0.0 3,-1.3 -0.748 16.4-146.3-144.3 92.4 49.0 33.4 96.6 208 209 A E H 3> S+ 0 0 98 1,-0.3 4,-0.7 -2,-0.3 -1,-0.1 0.619 98.3 45.7 -28.2 -36.0 46.2 35.2 98.6 209 210 A E H >> S+ 0 0 144 2,-0.2 4,-1.7 1,-0.2 3,-0.6 0.908 110.1 50.1 -82.4 -42.3 47.8 38.6 98.0 210 211 A A H <> S+ 0 0 25 -3,-1.3 4,-1.9 1,-0.3 8,-0.3 0.839 103.8 63.9 -61.4 -32.2 48.6 38.3 94.3 211 212 A L H 3< S+ 0 0 19 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.885 103.9 46.5 -57.9 -40.3 44.9 37.2 94.0 212 213 A V H << S+ 0 0 104 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.892 103.3 61.2 -71.6 -40.2 43.9 40.6 95.1 213 214 A K H < S- 0 0 194 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.935 138.8 -18.2 -49.9 -53.0 46.3 42.5 92.8 214 215 A D X - 0 0 75 -4,-1.9 4,-2.3 1,-0.1 5,-0.3 -0.633 64.4-164.4-159.2 93.2 44.5 40.9 89.8 215 216 A P H > S+ 0 0 31 0, 0.0 4,-3.6 0, 0.0 5,-0.2 0.903 90.3 47.2 -42.8 -55.2 42.4 37.9 90.6 216 217 A I H > S+ 0 0 52 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.911 110.4 47.7 -60.1 -51.2 42.2 36.9 86.9 217 218 A H H > S+ 0 0 135 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.955 119.8 41.3 -56.8 -48.6 45.8 37.3 85.9 218 219 A H H X S+ 0 0 20 -4,-2.3 4,-2.6 -8,-0.3 -2,-0.2 0.944 114.5 50.3 -62.9 -51.2 46.9 35.3 89.0 219 220 A L H X S+ 0 0 25 -4,-3.6 4,-3.4 -5,-0.3 -1,-0.2 0.885 110.5 50.6 -56.5 -40.3 44.1 32.7 88.7 220 221 A F H X S+ 0 0 47 -4,-3.0 4,-3.2 2,-0.2 -1,-0.2 0.923 108.2 51.8 -64.7 -42.4 45.0 32.2 85.0 221 222 A D H X S+ 0 0 61 -4,-2.2 4,-2.4 -5,-0.3 -2,-0.2 0.920 112.0 48.6 -58.3 -40.4 48.6 31.7 86.0 222 223 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 5,-0.4 0.976 110.8 48.5 -61.0 -57.1 47.2 29.1 88.5 223 224 A Y H X S+ 0 0 21 -4,-3.4 4,-1.7 1,-0.2 -2,-0.2 0.920 112.4 50.6 -47.7 -52.1 45.1 27.4 85.9 224 225 A V H X S+ 0 0 32 -4,-3.2 4,-1.0 2,-0.2 -1,-0.2 0.926 114.8 40.4 -52.7 -56.7 48.1 27.3 83.5 225 226 A R H >X S+ 0 0 111 -4,-2.4 4,-1.7 2,-0.2 3,-1.5 0.965 113.1 51.1 -60.1 -58.9 50.6 25.8 85.9 226 227 A I H 3X S+ 0 0 0 -4,-2.5 4,-1.5 1,-0.3 -1,-0.2 0.823 110.7 53.0 -51.1 -32.3 48.3 23.3 87.6 227 228 A N H 3X S+ 0 0 34 -4,-1.7 4,-1.5 -5,-0.4 -1,-0.3 0.769 100.9 58.5 -76.2 -25.6 47.3 22.1 84.1 228 229 A K H < S+ 0 0 108 -4,-1.5 3,-1.6 2,-0.2 -2,-0.2 0.963 114.5 46.4 -71.4 -54.3 50.0 16.9 81.5 232 233 A E H 3< S+ 0 0 164 -4,-3.6 -2,-0.2 1,-0.3 -3,-0.2 0.888 116.0 44.5 -57.0 -44.9 53.6 16.4 82.6 233 234 A E T >< S+ 0 0 35 -4,-3.0 3,-1.4 -5,-0.2 -1,-0.3 0.185 81.4 162.7 -89.3 19.1 52.8 13.6 85.1 234 235 A G T < S- 0 0 50 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.1 0.489 71.6 -13.0 2.8-103.3 50.5 11.8 82.6 235 236 A D T 3 S+ 0 0 172 -4,-0.1 -1,-0.2 7,-0.0 4,-0.1 0.232 116.0 90.2-103.5 12.7 50.0 8.2 83.8 236 237 A S < + 0 0 92 -3,-1.4 3,-0.1 2,-0.1 -2,-0.1 0.941 65.2 62.2 -72.4 -94.0 52.8 8.1 86.4 237 238 A I S S- 0 0 57 -4,-0.2 5,-0.2 1,-0.1 2,-0.1 -0.031 93.1-107.0 -39.9 124.5 51.8 9.1 89.9 238 239 A P >> - 0 0 100 0, 0.0 3,-3.0 0, 0.0 4,-1.1 -0.363 37.1-104.0 -60.4 129.3 49.1 6.8 91.3 239 240 A L G >4 S+ 0 0 114 1,-0.3 3,-1.7 2,-0.2 7,-0.3 0.677 117.6 53.1 -16.1 -75.7 45.7 8.4 91.4 240 241 A E G 34 S+ 0 0 156 1,-0.3 -1,-0.3 5,-0.1 9,-0.1 0.806 122.1 34.2 -39.5 -38.2 45.4 9.1 95.2 241 242 A Q G <4 S+ 0 0 129 -3,-3.0 -1,-0.3 4,-0.0 -2,-0.2 0.557 101.8 94.2 -97.9 -10.6 48.8 10.9 94.9 242 243 A S S S+ 0 0 2 2,-0.2 4,-1.8 3,-0.2 5,-0.2 0.952 112.1 51.8 -68.5 -50.2 47.3 15.9 90.7 244 245 A N H >> S+ 0 0 73 1,-0.2 4,-2.4 2,-0.2 3,-1.1 0.958 113.0 43.8 -50.5 -59.1 44.3 14.8 88.7 245 246 A G H 3> S+ 0 0 4 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.872 109.6 57.4 -55.1 -37.8 43.0 12.4 91.4 246 247 A K H 3X S+ 0 0 56 -4,-1.7 4,-1.9 -7,-0.3 -1,-0.3 0.823 108.1 48.6 -62.3 -30.4 43.8 15.1 94.0 247 248 A A H S+ 0 0 76 -4,-2.6 4,-1.9 1,-0.2 5,-1.6 0.825 115.1 41.9 -46.5 -37.3 35.0 16.9 99.6 254 255 A M H <5S+ 0 0 6 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.972 116.5 43.1 -74.7 -60.5 32.4 19.3 98.1 255 256 A E H <5S+ 0 0 85 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.671 117.1 55.2 -59.7 -14.4 29.8 16.9 96.9 256 257 A D H <5S- 0 0 123 -4,-2.1 -1,-0.2 -5,-0.4 -2,-0.2 0.890 122.0-102.9 -85.9 -46.5 30.5 15.2 100.2 257 258 A G T <5 + 0 0 27 -4,-1.9 -3,-0.2 -5,-0.3 5,-0.1 0.157 53.2 165.8 144.9 -20.9 29.8 18.2 102.4 258 259 A D >>< - 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0 0 34 -5,-1.4 3,-0.5 -4,-0.2 4,-0.4 -0.502 35.9-147.8 -70.7 132.5 7.1 14.4 79.0 391 392 A E G > S+ 0 0 118 -2,-0.2 3,-1.1 1,-0.2 -1,-0.2 0.932 98.9 53.6 -64.3 -43.7 4.6 16.5 76.9 392 393 A W G > S+ 0 0 9 1,-0.2 3,-3.7 2,-0.2 -1,-0.2 0.641 81.3 89.9 -66.6 -17.0 7.1 19.4 76.9 393 394 A A G X S+ 0 0 15 -3,-0.5 3,-1.6 1,-0.3 -1,-0.2 0.879 83.4 58.3 -47.3 -40.1 9.9 17.2 75.5 394 395 A K G < S+ 0 0 163 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.530 97.3 63.1 -69.5 -4.5 8.6 18.2 72.1 395 396 A D G < S+ 0 0 55 -3,-3.7 -29,-2.4 -32,-0.1 2,-0.4 0.201 81.4 101.9-104.6 14.3 9.2 21.8 73.0 396 397 A L E < -g 366 0B 18 -3,-1.6 2,-0.3 -31,-0.2 -29,-0.2 -0.802 48.6-177.0-100.4 141.0 12.9 21.5 73.4 397 398 A Q E -g 367 0B 69 -31,-2.1 -29,-3.6 -2,-0.4 2,-0.6 -0.999 19.6-144.7-142.7 141.7 15.3 22.7 70.7 398 399 A H E -g 368 0B 43 -2,-0.3 2,-0.8 -31,-0.2 -29,-0.2 -0.908 10.2-169.2-108.5 116.6 19.1 22.6 70.2 399 400 A V - 0 0 2 -31,-2.9 -29,-0.4 -2,-0.6 -231,-0.0 -0.886 20.5-178.1-105.8 103.8 20.7 25.6 68.4 400 401 A N - 0 0 30 -2,-0.8 2,-0.3 -31,-0.2 -29,-0.2 -0.150 10.4-170.3 -92.4-171.7 24.3 24.7 67.7 401 402 A F - 0 0 13 66,-0.2 -29,-2.2 65,-0.1 66,-0.4 -0.943 27.1 -95.6-175.4 153.0 27.2 26.4 66.1 402 403 A G - 0 0 0 64,-3.4 2,-0.3 66,-0.4 66,-0.2 -0.239 45.8-104.9 -72.6 166.3 30.7 25.8 64.8 403 404 A M - 0 0 72 64,-0.2 67,-1.7 -240,-0.0 2,-0.7 -0.647 15.7-120.6-100.8 153.0 33.8 26.4 66.8 404 405 A V E -m 470 0F 6 -2,-0.3 3,-0.3 65,-0.2 2,-0.3 -0.789 37.1-150.8 -86.2 117.1 36.4 29.2 66.8 405 406 A Q E +m 471 0F 73 65,-2.6 67,-3.1 -2,-0.7 3,-0.1 -0.651 66.9 56.6 -94.2 149.7 39.7 27.4 66.2 406 407 A G + 0 0 32 -2,-0.3 2,-0.6 1,-0.2 -1,-0.2 0.629 70.0 121.0 106.4 19.5 43.1 28.6 67.4 407 408 A M + 0 0 32 -3,-0.3 2,-0.3 7,-0.1 -1,-0.2 -0.942 26.7 145.2-118.3 109.1 42.4 28.8 71.1 408 409 A S > - 0 0 21 -2,-0.6 6,-1.4 1,-0.1 5,-1.2 -0.918 34.8-164.0-149.3 120.0 44.6 26.6 73.3 409 410 A T T > 5S+ 0 0 35 -2,-0.3 3,-1.0 1,-0.2 -1,-0.1 0.913 99.7 50.2 -66.7 -42.7 46.0 27.2 76.8 410 411 A R T 3 5S+ 0 0 179 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.609 113.7 47.4 -71.5 -10.2 48.6 24.5 76.5 411 412 A K T 3 5S- 0 0 146 -3,-0.5 -1,-0.3 0, 0.0 -2,-0.2 0.423 107.5-127.4-106.3 -3.5 49.6 26.0 73.1 412 413 A G T < 5S+ 0 0 60 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.454 82.5 113.3 71.5 -0.6 49.7 29.5 74.6 413 414 A T < + 0 0 62 -5,-1.2 -4,-0.2 2,-0.0 -1,-0.1 0.606 43.7 120.8 -76.6 -12.9 47.4 30.7 71.8 414 415 A V + 0 0 20 -6,-1.4 2,-0.3 -7,-0.1 -7,-0.1 -0.165 37.7 179.5 -53.8 142.3 44.6 31.3 74.4 415 416 A V - 0 0 32 -259,-0.1 -256,-1.6 4,-0.0 -2,-0.0 -0.923 26.5-123.7-149.4 118.1 43.3 34.9 74.5 416 417 A F B > -I 158 0D 29 -2,-0.3 4,-2.0 -258,-0.2 -258,-0.3 -0.217 16.8-126.2 -60.8 153.1 40.5 35.9 77.0 417 418 A L H > S+ 0 0 1 -260,-3.0 4,-2.7 2,-0.2 5,-0.2 0.921 109.3 58.9 -68.5 -43.1 37.4 37.5 75.6 418 419 A D H > S+ 0 0 47 -261,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.864 111.0 44.6 -53.2 -35.5 37.6 40.5 77.9 419 420 A N H > S+ 0 0 89 2,-0.2 4,-3.7 3,-0.2 5,-0.3 0.889 106.4 56.9 -76.5 -41.1 41.0 41.1 76.3 420 421 A I H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.956 112.7 44.5 -52.3 -50.7 39.9 40.5 72.7 421 422 A L H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.967 115.4 46.2 -55.9 -58.5 37.4 43.3 73.3 422 423 A E H X S+ 0 0 61 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.912 112.1 49.6 -52.4 -51.8 39.8 45.6 75.0 423 424 A E H X S+ 0 0 62 -4,-3.7 4,-1.9 1,-0.2 -1,-0.2 0.897 113.2 47.7 -57.5 -42.5 42.6 45.1 72.4 424 425 A T H X S+ 0 0 0 -4,-2.3 4,-3.0 -5,-0.3 5,-0.3 0.892 107.4 56.3 -65.9 -40.7 40.0 45.8 69.6 425 426 A K H X S+ 0 0 29 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.910 107.8 48.5 -56.2 -45.5 38.7 48.9 71.4 426 427 A E H X S+ 0 0 100 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.931 111.6 48.3 -63.6 -46.8 42.2 50.4 71.5 427 428 A K H X S+ 0 0 104 -4,-1.9 4,-1.8 1,-0.2 3,-0.3 0.928 112.5 48.4 -60.0 -45.8 42.8 49.7 67.9 428 429 A M H X S+ 0 0 5 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.833 106.4 59.9 -63.8 -29.7 39.5 51.2 66.9 429 430 A H H X S+ 0 0 16 -4,-1.8 4,-1.2 -5,-0.3 -1,-0.2 0.890 103.6 50.0 -65.6 -37.8 40.4 54.2 69.2 430 431 A E H >X S+ 0 0 94 -4,-1.7 4,-0.9 -3,-0.3 3,-0.6 0.928 109.2 48.3 -68.3 -44.7 43.5 54.9 67.0 431 432 A V H >< S+ 0 0 47 -4,-1.8 3,-0.6 1,-0.2 4,-0.3 0.874 108.5 58.6 -62.8 -32.1 41.6 54.9 63.7 432 433 A M H >< S+ 0 0 7 -4,-1.8 3,-0.8 1,-0.2 -1,-0.2 0.815 102.9 51.3 -64.2 -33.3 39.1 57.2 65.4 433 434 A K H << S+ 0 0 88 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.675 85.9 85.6 -79.4 -17.9 41.9 59.7 66.2 434 435 A K T << S+ 0 0 174 -4,-0.9 2,-0.6 -3,-0.6 -1,-0.2 0.724 87.7 57.3 -55.9 -20.2 43.0 59.8 62.6 435 436 A N <> + 0 0 85 -3,-0.8 4,-3.5 -4,-0.3 -1,-0.2 -0.772 67.4 178.7-116.5 85.9 40.3 62.4 62.0 436 437 A E H > S+ 0 0 166 -2,-0.6 4,-3.0 2,-0.2 5,-0.3 0.951 76.8 53.1 -48.4 -70.7 41.0 65.3 64.3 437 438 A N H > S+ 0 0 117 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.849 120.9 34.7 -33.0 -55.7 38.1 67.7 63.3 438 439 A K H >4 S+ 0 0 88 1,-0.2 3,-2.2 2,-0.2 4,-0.3 0.964 113.3 57.2 -68.1 -54.2 35.6 64.8 63.8 439 440 A Y H >< S+ 0 0 55 -4,-3.5 3,-2.4 1,-0.3 -2,-0.2 0.863 98.8 63.3 -43.8 -44.9 37.3 63.2 66.8 440 441 A A H 3< S+ 0 0 80 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.805 95.2 59.9 -52.5 -34.1 37.2 66.4 68.7 441 442 A Q T << S+ 0 0 81 -3,-2.2 2,-0.5 -4,-0.6 -1,-0.3 0.441 83.5 99.5 -79.2 1.3 33.4 66.3 68.6 442 443 A I < - 0 0 13 -3,-2.4 164,-0.0 -4,-0.3 -3,-0.0 -0.776 55.7-162.1 -93.7 130.4 33.2 63.0 70.5 443 444 A E S S+ 0 0 160 -2,-0.5 -1,-0.1 1,-0.2 3,-0.1 0.833 86.7 23.7 -77.7 -35.9 32.5 63.2 74.3 444 445 A H > + 0 0 99 1,-0.1 4,-2.7 2,-0.1 5,-0.3 -0.570 62.5 172.1-134.2 73.5 33.7 59.8 75.2 445 446 A P H > S+ 0 0 23 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.845 83.9 51.8 -46.1 -41.6 36.2 58.5 72.6 446 447 A E H > S+ 0 0 87 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.961 110.3 45.5 -63.2 -54.0 37.0 55.5 74.9 447 448 A E H > S+ 0 0 117 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.923 117.2 45.6 -56.4 -45.6 33.3 54.5 75.3 448 449 A V H X S+ 0 0 20 -4,-2.7 4,-3.0 2,-0.2 -1,-0.2 0.902 108.5 55.2 -65.8 -42.6 32.7 54.8 71.6 449 450 A A H X S+ 0 0 0 -4,-2.7 4,-3.3 -5,-0.3 5,-0.2 0.920 108.1 50.1 -57.2 -43.3 35.8 53.0 70.6 450 451 A D H X S+ 0 0 22 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.855 110.5 49.6 -64.7 -34.9 34.7 50.1 72.7 451 452 A L H X S+ 0 0 45 -4,-1.5 4,-1.8 -5,-0.2 150,-0.3 0.908 112.7 47.6 -69.3 -41.5 31.3 50.1 71.0 452 453 A V H X S+ 0 0 7 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.961 112.9 47.7 -64.0 -50.2 32.9 50.3 67.6 453 454 A G H X S+ 0 0 0 -4,-3.3 4,-2.9 1,-0.2 -1,-0.2 0.886 109.0 53.6 -58.9 -40.4 35.3 47.4 68.4 454 455 A I H X S+ 0 0 9 -4,-2.1 4,-3.3 1,-0.2 5,-0.3 0.897 106.7 51.7 -62.2 -40.1 32.5 45.2 69.8 455 456 A S H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 5,-0.3 0.927 109.9 51.5 -61.8 -41.7 30.5 45.7 66.6 456 457 A A H X S+ 0 0 3 -4,-2.1 4,-2.1 1,-0.2 29,-0.3 0.972 114.1 42.2 -55.8 -57.5 33.6 44.6 64.8 457 458 A V H X S+ 0 0 0 -4,-2.9 4,-0.5 1,-0.2 -2,-0.2 0.912 117.3 46.0 -56.4 -51.7 34.0 41.5 66.9 458 459 A M H >X S+ 0 0 2 -4,-3.3 4,-2.2 2,-0.2 3,-1.5 0.967 113.7 46.5 -59.9 -55.9 30.3 40.5 67.0 459 460 A I H 3X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.3 -2,-0.2 0.930 104.2 59.4 -54.8 -52.6 29.6 41.0 63.3 460 461 A Q H 3< S+ 0 0 9 -4,-2.1 -1,-0.3 -5,-0.3 4,-0.2 0.677 113.8 41.7 -51.7 -17.2 32.7 39.1 62.0 461 462 A D H X< S+ 0 0 4 -3,-1.5 3,-0.6 -4,-0.5 -1,-0.2 0.809 115.0 47.3 -96.6 -40.4 31.3 36.1 64.0 462 463 A M H 3< S+ 0 0 1 -4,-2.2 88,-0.2 1,-0.2 -2,-0.2 0.505 88.2 89.6 -80.5 -5.0 27.6 36.5 63.0 463 464 A Q T 3< S+ 0 0 71 -4,-1.8 2,-0.2 -5,-0.2 -1,-0.2 0.876 89.2 41.4 -62.3 -39.4 28.4 37.0 59.3 464 465 A G S < S- 0 0 29 -3,-0.6 83,-0.2 -4,-0.2 84,-0.1 -0.698 105.4 -74.6-108.5 164.9 28.2 33.3 58.4 465 466 A K > - 0 0 111 -2,-0.2 3,-2.1 1,-0.1 -63,-0.2 -0.194 45.5-112.7 -56.1 141.7 25.8 30.6 59.6 466 467 A R T 3 S+ 0 0 27 1,-0.3 -64,-3.4 78,-0.1 -65,-0.1 0.855 111.9 63.7 -39.0 -53.9 26.3 29.3 63.1 467 468 A I T 3 S+ 0 0 78 -66,-0.4 -1,-0.3 -67,-0.1 -64,-0.2 0.712 82.0 99.8 -47.8 -31.3 27.4 25.9 62.0 468 469 A N < - 0 0 76 -3,-2.1 -66,-0.4 -66,-0.2 2,-0.2 -0.353 64.1-144.3 -66.0 138.1 30.5 27.2 60.3 469 470 A N - 0 0 81 -67,-0.1 2,-0.3 -2,-0.1 -65,-0.2 -0.477 18.7-168.6 -90.5 168.2 33.9 27.0 62.0 470 471 A Y E -m 404 0F 23 -67,-1.7 -65,-2.6 -2,-0.2 2,-0.5 -0.963 23.9-113.3-162.5 146.1 36.5 29.8 61.7 471 472 A E E -m 405 0F 98 -2,-0.3 -65,-0.2 -67,-0.2 2,-0.1 -0.681 37.1-116.3 -82.4 123.5 40.1 30.4 62.5 472 473 A F + 0 0 26 -67,-3.1 2,-0.3 -2,-0.5 3,-0.1 -0.385 45.5 166.0 -59.4 128.5 40.8 33.1 65.1 473 474 A K >> - 0 0 107 -2,-0.1 3,-2.2 1,-0.1 4,-0.8 -0.935 39.4-141.5-150.0 122.7 42.6 36.0 63.4 474 475 A W H >> S+ 0 0 81 -2,-0.3 4,-2.6 1,-0.3 3,-1.1 0.847 103.3 63.9 -52.3 -36.7 43.2 39.4 64.9 475 476 A E H 3> S+ 0 0 126 1,-0.3 4,-1.3 2,-0.2 -1,-0.3 0.777 97.0 59.1 -60.2 -23.6 42.7 40.9 61.4 476 477 A R H <4 S+ 0 0 91 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.807 113.5 35.9 -73.2 -30.7 39.1 39.6 61.6 477 478 A M H << S+ 0 0 3 -3,-1.1 -2,-0.2 -4,-0.8 -1,-0.2 0.734 119.7 50.3 -92.3 -25.4 38.5 41.6 64.7 478 479 A L H < S+ 0 0 42 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.617 81.2 105.6 -92.0 -12.8 40.5 44.6 63.7 479 480 A S < + 0 0 53 -4,-1.3 6,-0.2 -5,-0.2 -51,-0.0 -0.413 30.9 168.5 -71.9 141.3 39.2 45.3 60.2 480 481 A F + 0 0 90 -2,-0.1 2,-0.3 6,-0.1 4,-0.3 0.464 52.5 86.1-126.3 -10.5 37.0 48.3 59.6 481 482 A E S S+ 0 0 157 2,-0.1 2,-0.1 5,-0.1 6,-0.0 -0.727 86.8 8.8 -96.4 144.9 36.9 48.6 55.9 482 483 A G S S- 0 0 46 -2,-0.3 2,-1.8 2,-0.1 5,-0.3 -0.417 126.5 -8.1 84.9-166.5 34.4 46.6 53.7 483 484 A D S S+ 0 0 70 -2,-0.1 2,-0.3 4,-0.1 -2,-0.1 -0.444 97.0 127.9 -68.3 87.0 31.5 44.6 55.3 484 485 A T S >> S- 0 0 14 -2,-1.8 4,-1.3 -4,-0.3 3,-1.3 -0.909 77.0 -98.3-137.2 162.6 32.5 44.9 58.9 485 486 A G H >> S+ 0 0 0 -29,-0.3 4,-2.3 -2,-0.3 3,-0.7 0.933 123.8 57.7 -45.6 -54.6 30.8 46.0 62.1 486 487 A P H 3> S+ 0 0 8 0, 0.0 4,-3.3 0, 0.0 -1,-0.3 0.812 99.5 59.9 -46.2 -36.9 32.5 49.5 61.7 487 488 A Y H <> S+ 0 0 52 -3,-1.3 4,-2.2 -5,-0.3 -2,-0.2 0.956 108.2 42.4 -57.8 -53.0 30.8 49.8 58.3 488 489 A L H < S+ 0 0 24 -4,-1.4 3,-2.3 2,-0.2 6,-0.2 0.978 113.9 43.4 -60.7 -58.5 20.1 64.7 60.6 500 501 A R H >< S+ 0 0 74 -4,-2.9 3,-1.1 1,-0.3 -2,-0.2 0.899 106.5 64.6 -52.8 -42.1 22.0 67.0 63.0 501 502 A N T 3< S+ 0 0 99 -4,-3.3 -1,-0.3 -5,-0.3 -2,-0.2 0.652 110.3 37.6 -57.5 -16.8 23.2 68.8 59.9 502 503 A A T X + 0 0 20 -3,-2.3 3,-1.7 -4,-0.4 -1,-0.3 -0.414 63.3 147.7-135.4 59.6 19.6 69.8 59.2 503 504 A S T < + 0 0 93 -3,-1.1 -1,-0.1 1,-0.3 -2,-0.1 0.825 60.9 85.8 -60.5 -31.0 18.0 70.5 62.6 504 505 A G T 3 S+ 0 0 81 -4,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.727 91.3 51.1 -42.7 -27.0 15.9 73.0 60.7 505 506 A I S < S- 0 0 24 -3,-1.7 2,-0.3 -6,-0.2 -3,-0.1 -0.918 75.9-157.9-118.5 144.0 13.6 70.2 60.0 506 507 A T >> - 0 0 63 -2,-0.4 3,-1.7 1,-0.1 4,-1.0 -0.849 31.3-103.7-122.7 158.6 12.1 67.7 62.5 507 508 A Q H >> S+ 0 0 63 -2,-0.3 4,-1.8 1,-0.3 3,-0.7 0.798 113.7 63.3 -43.5 -46.5 10.6 64.2 62.4 508 509 A E H 3> S+ 0 0 107 1,-0.3 4,-0.5 2,-0.2 -1,-0.3 0.865 106.8 46.7 -50.2 -38.1 7.0 65.3 62.7 509 510 A K H <4 S+ 0 0 110 -3,-1.7 3,-0.3 1,-0.2 -1,-0.3 0.774 104.9 61.8 -75.7 -27.7 7.4 67.0 59.3 510 511 A W H X< S+ 0 0 9 -4,-1.0 3,-1.9 -3,-0.7 -2,-0.2 0.906 95.8 58.0 -64.1 -46.7 9.1 63.9 57.8 511 512 A I H 3< S+ 0 0 47 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.773 111.3 43.4 -56.8 -28.0 6.1 61.7 58.3 512 513 A N T 3< S+ 0 0 139 -4,-0.5 -1,-0.3 -3,-0.3 -2,-0.2 -0.091 86.8 135.3-110.1 33.8 4.1 64.1 56.1 513 514 A A S < S- 0 0 13 -3,-1.9 2,-1.9 65,-0.2 3,-0.1 -0.341 71.8 -99.9 -76.9 161.8 6.7 64.7 53.5 514 515 A D > - 0 0 82 61,-0.4 3,-2.8 1,-0.2 -1,-0.1 -0.601 41.0-173.2 -83.7 82.8 5.8 64.6 49.8 515 516 A F G > S+ 0 0 14 -2,-1.9 3,-1.9 1,-0.3 -1,-0.2 0.638 72.8 79.0 -52.1 -17.1 7.0 61.1 49.2 516 517 A S G 3 S+ 0 0 51 1,-0.3 3,-0.4 2,-0.1 -1,-0.3 0.758 80.5 70.0 -65.0 -20.7 6.5 61.5 45.5 517 518 A L G < S+ 0 0 39 -3,-2.8 -1,-0.3 1,-0.2 3,-0.3 0.433 78.5 80.5 -76.0 3.4 9.8 63.4 45.5 518 519 A L < + 0 0 1 -3,-1.9 -1,-0.2 1,-0.2 9,-0.1 -0.205 55.5 126.0-103.3 44.0 11.6 60.1 46.2 519 520 A K + 0 0 98 -3,-0.4 -1,-0.2 4,-0.1 -2,-0.1 0.522 32.2 111.7 -79.6 -11.8 11.5 59.0 42.5 520 521 A E S >> S- 0 0 43 -3,-0.3 4,-2.5 1,-0.1 3,-0.6 -0.381 75.4-119.6 -70.4 145.7 15.2 58.3 41.9 521 522 A P H 3> S+ 0 0 91 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.916 114.8 52.9 -44.5 -54.8 16.3 54.7 41.3 522 523 A A H 3> S+ 0 0 23 1,-0.3 4,-1.9 2,-0.2 41,-0.2 0.865 111.0 47.0 -51.8 -42.0 18.6 54.8 44.3 523 524 A A H <> S+ 0 0 0 -3,-0.6 4,-2.5 2,-0.2 -1,-0.3 0.876 111.6 51.5 -69.5 -37.4 15.7 56.0 46.4 524 525 A K H X S+ 0 0 71 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.958 109.0 48.6 -63.6 -52.6 13.4 53.3 45.0 525 526 A L H X S+ 0 0 53 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.931 114.5 47.9 -52.5 -46.3 15.8 50.5 45.7 526 527 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 -5,-0.3 -1,-0.2 0.882 110.6 50.5 -63.8 -39.9 16.3 51.8 49.2 527 528 A I H X S+ 0 0 1 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.977 111.2 47.4 -62.1 -55.0 12.5 52.2 49.8 528 529 A R H < S+ 0 0 29 -4,-2.9 3,-0.4 1,-0.2 4,-0.3 0.901 110.2 55.3 -51.8 -42.4 11.8 48.6 48.7 529 530 A L H >< S+ 0 0 7 -4,-2.3 3,-2.0 -5,-0.3 4,-0.5 0.932 101.7 57.4 -55.2 -49.6 14.7 47.6 50.9 530 531 A L H >< S+ 0 0 0 -4,-2.3 3,-0.8 1,-0.3 -1,-0.2 0.817 100.1 57.0 -52.6 -38.3 13.0 49.3 53.9 531 532 A G T 3< S+ 0 0 3 -4,-1.4 -500,-0.6 -3,-0.4 4,-0.3 0.496 95.9 66.3 -78.1 -0.3 9.8 47.2 53.6 532 533 A Q T <> S+ 0 0 48 -3,-2.0 4,-2.9 -4,-0.3 3,-0.3 0.652 71.5 88.1 -93.0 -18.7 11.6 43.9 53.9 533 534 A Y H <> S+ 0 0 3 -3,-0.8 4,-2.5 -4,-0.5 5,-0.2 0.888 87.3 54.8 -48.3 -44.8 12.9 44.2 57.5 534 535 A P H > S+ 0 0 6 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.937 110.5 44.3 -57.0 -47.5 9.6 42.6 58.8 535 536 A D H > S+ 0 0 12 -4,-0.3 4,-2.5 -3,-0.3 5,-0.3 0.943 110.4 57.8 -60.8 -44.8 10.0 39.6 56.5 536 537 A V H X S+ 0 0 20 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.903 106.3 47.4 -50.5 -49.2 13.7 39.4 57.6 537 538 A L H X S+ 0 0 1 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.913 111.8 48.8 -63.0 -43.5 12.9 39.1 61.3 538 539 A R H < S+ 0 0 37 -4,-1.8 4,-0.3 1,-0.2 -1,-0.2 0.870 114.6 45.9 -65.1 -35.8 10.2 36.4 60.8 539 540 A N H >X S+ 0 0 34 -4,-2.5 4,-2.5 1,-0.2 3,-1.1 0.864 107.3 60.1 -71.8 -35.2 12.7 34.5 58.6 540 541 A A H 3X>S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.3 5,-0.6 0.857 102.6 51.1 -59.1 -37.8 15.3 35.1 61.2 541 542 A I H 3<5S+ 0 0 27 -4,-1.7 -1,-0.3 2,-0.2 -2,-0.2 0.582 109.7 50.9 -79.8 -8.1 13.2 33.3 63.8 542 543 A K H <45S+ 0 0 162 -3,-1.1 -2,-0.2 -4,-0.3 -1,-0.2 0.864 120.9 31.4 -91.2 -44.0 12.8 30.3 61.4 543 544 A T H <5S- 0 0 44 -4,-2.5 -2,-0.2 2,-0.1 -3,-0.2 0.653 89.7-145.6 -86.5 -17.9 16.6 30.0 60.7 544 545 A H T <5 + 0 0 9 -4,-2.1 -3,-0.2 -5,-0.3 -78,-0.1 0.871 51.6 143.1 53.9 34.9 17.8 31.2 64.1 545 546 A E >>< - 0 0 19 -5,-0.6 3,-1.6 -6,-0.2 4,-0.7 -0.929 50.0-158.5-113.6 119.6 20.7 32.7 62.1 546 547 A P H >> S+ 0 0 2 0, 0.0 4,-2.7 0, 0.0 3,-1.1 0.880 97.5 65.4 -59.2 -32.7 22.2 36.1 63.1 547 548 A T H 3> S+ 0 0 17 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.785 87.2 67.5 -59.7 -27.8 23.4 36.1 59.5 548 549 A T H <> S+ 0 0 25 -3,-1.6 4,-0.8 1,-0.2 -1,-0.3 0.898 111.7 34.2 -59.3 -37.8 19.8 36.3 58.3 549 550 A V H < S+ 0 0 69 -4,-1.9 3,-1.7 2,-0.2 -1,-0.2 0.986 112.0 45.3 -64.6 -53.2 24.9 54.5 47.4 563 564 A C H >X S+ 0 0 0 -4,-2.9 3,-3.5 1,-0.3 4,-3.0 0.915 101.6 68.0 -51.5 -47.7 22.1 57.0 47.9 564 565 A Y H 3< S+ 0 0 70 -4,-3.2 -1,-0.3 1,-0.3 -2,-0.2 0.728 97.9 53.9 -45.3 -29.3 24.3 59.1 50.2 565 566 A D T << S+ 0 0 119 -3,-1.7 -1,-0.3 -4,-0.8 -2,-0.2 0.360 123.0 22.3 -91.0 6.0 26.4 60.0 47.2 566 567 A V T <4 S+ 0 0 85 -3,-3.5 2,-0.8 1,-0.2 -2,-0.2 0.565 109.4 64.9-141.2 -28.2 23.5 61.2 45.1 567 568 A L < - 0 0 8 -4,-3.0 2,-0.2 -5,-0.2 -1,-0.2 -0.819 66.9-167.8-108.2 95.6 20.6 62.3 47.2 568 569 A W - 0 0 162 -2,-0.8 12,-0.1 1,-0.2 -3,-0.1 -0.533 20.3-166.1 -81.8 147.2 21.6 65.3 49.3 569 570 A V S > S+ 0 0 8 -2,-0.2 3,-0.5 11,-0.1 -1,-0.2 0.744 72.9 76.7 -96.6 -33.5 19.5 66.5 52.1 570 571 A A T 3 S+ 0 0 36 1,-0.2 3,-0.1 7,-0.0 -2,-0.1 -0.452 94.1 20.1 -81.4 149.5 21.4 69.7 52.3 571 572 A G T 3 S+ 0 0 83 1,-0.2 2,-0.2 -2,-0.1 -1,-0.2 0.842 98.5 119.5 65.3 37.4 21.1 72.6 49.9 572 573 A Q S < S- 0 0 73 -3,-0.5 -1,-0.2 1,-0.0 2,-0.2 -0.767 74.7 -80.0-126.5 170.7 17.7 71.6 48.7 573 574 A T > - 0 0 83 -2,-0.2 4,-3.0 1,-0.1 3,-0.4 -0.500 47.1-115.7 -69.6 139.1 14.1 72.9 48.6 574 575 A E H > S+ 0 0 142 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.819 116.2 56.6 -45.6 -34.2 12.5 72.4 52.0 575 576 A E H > S+ 0 0 120 2,-0.2 4,-1.5 1,-0.2 -61,-0.4 0.960 112.8 36.1 -66.0 -51.7 10.1 70.0 50.3 576 577 A L H > S+ 0 0 24 -3,-0.4 4,-2.3 1,-0.2 5,-0.2 0.825 114.4 58.8 -70.8 -31.8 12.7 67.7 48.8 577 578 A A H X S+ 0 0 8 -4,-3.0 4,-1.3 1,-0.2 -1,-0.2 0.826 108.2 45.0 -66.3 -32.8 14.9 68.1 51.9 578 579 A T H X S+ 0 0 15 -4,-1.5 4,-1.2 -5,-0.3 -1,-0.2 0.836 110.0 56.6 -78.9 -34.5 12.1 66.7 54.1 579 580 A A H X S+ 0 0 0 -4,-1.5 4,-1.3 1,-0.2 3,-0.3 0.943 112.4 38.8 -62.2 -49.7 11.4 64.0 51.7 580 581 A R H X S+ 0 0 15 -4,-2.3 4,-3.3 1,-0.2 5,-0.4 0.827 110.6 59.9 -73.2 -30.3 14.9 62.6 51.8 581 582 A L H X S+ 0 0 1 -4,-1.3 4,-1.4 -5,-0.2 -1,-0.2 0.792 106.5 48.9 -66.5 -26.0 15.2 63.2 55.5 582 583 A A H X S+ 0 0 0 -4,-1.2 4,-2.3 -3,-0.3 -1,-0.2 0.826 112.7 48.3 -79.8 -33.7 12.3 60.9 55.9 583 584 A L H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.950 118.7 36.8 -70.7 -52.5 14.0 58.3 53.7 584 585 A Y H X S+ 0 0 7 -4,-3.3 4,-3.3 2,-0.2 5,-0.2 0.878 115.6 58.7 -67.3 -36.7 17.3 58.4 55.4 585 586 A G H X S+ 0 0 3 -4,-1.4 4,-2.5 -5,-0.4 -2,-0.2 0.962 109.2 40.8 -56.1 -55.1 15.5 58.8 58.7 586 587 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.927 113.4 55.7 -59.3 -45.3 13.6 55.6 58.3 587 588 A A H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.932 108.5 47.3 -53.9 -48.3 16.7 53.9 56.9 588 589 A R H X S+ 0 0 14 -4,-3.3 4,-2.6 1,-0.2 -1,-0.2 0.940 110.1 53.0 -59.9 -46.6 18.6 54.9 60.1 589 590 A Q H X S+ 0 0 16 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.916 110.1 47.6 -55.7 -45.8 15.7 53.6 62.3 590 591 A V H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.937 113.0 47.3 -62.0 -46.0 15.7 50.2 60.6 591 592 A L H X S+ 0 0 2 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.841 111.8 52.6 -61.9 -35.1 19.5 49.9 60.9 592 593 A Y H X S+ 0 0 57 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.978 109.9 48.0 -62.7 -56.0 19.2 51.0 64.5 593 594 A N H X S+ 0 0 12 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.915 113.8 45.9 -50.5 -53.2 16.6 48.3 65.1 594 595 A G H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.912 111.2 51.1 -60.1 -46.2 18.6 45.5 63.4 595 596 A M H X>S+ 0 0 0 -4,-2.3 5,-2.5 1,-0.2 4,-1.0 0.939 112.8 46.0 -58.7 -47.4 21.9 46.4 65.1 596 597 A R H ><5S+ 0 0 130 -4,-2.6 3,-1.6 3,-0.2 -1,-0.2 0.952 108.4 56.4 -60.4 -47.1 20.2 46.4 68.5 597 598 A L H 3<5S+ 0 0 7 -4,-2.8 -424,-0.3 1,-0.3 -1,-0.2 0.930 107.9 48.4 -48.8 -50.5 18.5 43.1 67.7 598 599 A L H 3<5S- 0 0 1 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.677 124.8-106.9 -64.2 -18.5 21.9 41.6 67.0 599 600 A G T <<5S+ 0 0 6 -3,-1.6 -3,-0.2 -4,-1.0 -2,-0.1 0.523 77.0 127.6 104.8 5.7 23.2 43.0 70.3 600 601 A L < - 0 0 1 -5,-2.5 -1,-0.2 -6,-0.2 -148,-0.1 -0.190 56.3-124.6 -83.0-177.1 25.4 45.8 69.0 601 602 A T - 0 0 42 -150,-0.3 -146,-0.1 -2,-0.0 -147,-0.1 -0.888 19.4-134.3-135.4 103.4 25.1 49.5 70.2 602 603 A P - 0 0 15 0, 0.0 2,-0.4 0, 0.0 -113,-0.1 -0.181 20.7-145.5 -54.6 147.2 24.6 52.1 67.5 603 604 A V - 0 0 5 -114,-0.2 3,-0.1 1,-0.1 -155,-0.0 -0.941 14.3-153.7-120.1 143.6 26.9 55.2 67.9 604 605 A E S S+ 0 0 79 -2,-0.4 2,-0.3 1,-0.2 -107,-0.2 0.800 84.4 17.4 -80.1 -35.0 26.0 58.8 67.0 605 606 A R 0 0 87 -109,-0.1 -1,-0.2 -108,-0.0 -111,-0.1 -0.997 360.0 360.0-141.6 146.2 29.6 59.8 66.4 606 607 A M 0 0 47 -2,-0.3 -165,-0.1 -3,-0.1 -157,-0.0 -0.856 360.0 360.0-156.9 360.0 32.9 58.0 65.7