==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 17-NOV-03 1RIQ . COMPND 2 MOLECULE: ALANYL-TRNA SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR M.A.SWAIRJO,F.J.OTERO,X.-L.YANG,M.A.LOVATO,R.J.SKENE, . 448 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20754.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 314 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 1 0.2 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 . 19 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 167 37.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 4 0 0 0 2 2 0 1 1 0 2 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 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 0 0 PARALLEL BRIDGES PER LADDER . 0 3 2 1 0 0 1 1 1 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 . 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A S 0 0 118 0, 0.0 230,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -11.7 -1.7 -2.2 46.9 2 2 A L - 0 0 50 228,-0.1 2,-0.1 4,-0.0 227,-0.0 0.783 360.0-120.7 67.7 118.6 -3.8 -3.7 49.7 3 3 A S > - 0 0 28 1,-0.1 4,-2.3 235,-0.1 5,-0.2 -0.437 23.3-110.4 -84.6 161.7 -6.3 -1.5 51.6 4 4 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.907 120.9 53.2 -57.1 -40.6 -6.2 -0.8 55.3 5 5 A H H > S+ 0 0 28 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.874 107.9 48.6 -64.0 -38.2 -9.3 -3.0 55.6 6 6 A E H > S+ 0 0 104 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.873 111.3 50.5 -69.8 -36.9 -7.8 -5.9 53.8 7 7 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.898 107.5 53.3 -67.9 -39.7 -4.6 -5.7 56.0 8 8 A R H X S+ 0 0 16 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.950 113.8 43.1 -59.2 -47.0 -6.7 -5.7 59.1 9 9 A E H X S+ 0 0 92 -4,-1.9 4,-2.6 1,-0.2 5,-0.3 0.855 111.4 53.1 -67.8 -38.6 -8.5 -8.9 58.0 10 10 A L H X S+ 0 0 56 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.926 109.7 50.3 -62.7 -44.2 -5.4 -10.6 56.8 11 11 A F H X S+ 0 0 0 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.934 114.6 41.6 -60.1 -49.8 -3.7 -10.0 60.2 12 12 A L H X S+ 0 0 14 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.935 116.6 46.9 -66.7 -46.8 -6.6 -11.4 62.2 13 13 A S H X S+ 0 0 29 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.899 108.1 58.9 -63.5 -37.0 -7.3 -14.4 60.0 14 14 A F H X S+ 0 0 17 -4,-2.5 4,-0.6 -5,-0.3 -1,-0.2 0.939 110.1 40.6 -56.8 -50.3 -3.6 -15.2 59.9 15 15 A F H <>S+ 0 0 0 -4,-1.7 5,-2.9 1,-0.2 -1,-0.2 0.790 108.1 61.5 -72.3 -25.4 -3.4 -15.5 63.7 16 16 A E H ><5S+ 0 0 79 -4,-1.8 3,-1.8 1,-0.2 -1,-0.2 0.949 103.1 51.2 -63.0 -44.3 -6.7 -17.4 63.8 17 17 A K H 3<5S+ 0 0 179 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.724 104.5 59.1 -64.3 -19.0 -5.1 -20.1 61.6 18 18 A K T 3<5S- 0 0 58 -4,-0.6 -1,-0.3 -3,-0.2 -2,-0.2 0.013 131.4 -95.2 -96.1 26.3 -2.3 -20.1 64.2 19 19 A G T < 5S+ 0 0 53 -3,-1.8 2,-0.3 1,-0.2 41,-0.3 0.588 78.3 144.5 75.5 10.8 -4.8 -21.0 66.9 20 20 A H < - 0 0 7 -5,-2.9 2,-0.5 -8,-0.1 41,-0.3 -0.650 49.9-127.5 -85.9 138.7 -5.4 -17.5 68.1 21 21 A T E -a 61 0A 58 39,-2.6 41,-2.1 -2,-0.3 2,-0.4 -0.717 23.8-127.7 -82.8 126.7 -8.9 -16.6 69.3 22 22 A R E -a 62 0A 85 -2,-0.5 2,-0.5 39,-0.2 41,-0.2 -0.626 28.4-161.6 -74.7 127.9 -10.1 -13.4 67.5 23 23 A V - 0 0 32 39,-2.8 41,-0.4 -2,-0.4 3,-0.1 -0.960 18.5-117.1-119.2 126.6 -11.2 -11.0 70.2 24 24 A K - 0 0 179 -2,-0.5 2,-0.2 1,-0.1 41,-0.1 -0.165 43.6 -93.2 -54.2 149.3 -13.5 -8.0 69.5 25 25 A S - 0 0 14 39,-0.2 -1,-0.1 1,-0.1 40,-0.1 -0.475 41.1-122.1 -67.3 133.9 -11.9 -4.6 70.2 26 26 A A - 0 0 25 -2,-0.2 40,-0.5 1,-0.1 -1,-0.1 -0.368 40.2 -88.5 -71.5 157.8 -12.7 -3.4 73.7 27 27 A P - 0 0 62 0, 0.0 12,-0.2 0, 0.0 -1,-0.1 -0.284 32.3-114.4 -66.2 156.4 -14.5 -0.1 73.9 28 28 A L S S+ 0 0 0 250,-0.2 11,-2.4 10,-0.1 40,-0.1 0.822 104.7 68.5 -59.9 -30.3 -12.3 3.1 74.0 29 29 A V S S- 0 0 29 253,-0.2 2,-0.3 9,-0.2 9,-0.1 -0.819 91.9-124.8 -95.6 122.5 -13.7 3.7 77.4 30 30 A P > - 0 0 17 0, 0.0 3,-0.7 0, 0.0 -2,-0.1 -0.512 12.5-144.7 -67.2 125.3 -12.4 1.2 80.1 31 31 A E T 3 S+ 0 0 173 -2,-0.3 -2,-0.0 1,-0.2 0, 0.0 0.899 91.0 13.3 -57.1 -46.3 -15.4 -0.4 81.8 32 32 A N T 3 S+ 0 0 145 1,-0.1 -1,-0.2 -3,-0.0 -3,-0.0 -0.343 100.9 89.7-134.2 57.5 -13.7 -0.6 85.2 33 33 A D X + 0 0 58 -3,-0.7 3,-1.4 3,-0.2 -1,-0.1 -0.517 39.8 177.8-150.6 76.0 -10.6 1.5 85.4 34 34 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.646 79.1 61.5 -54.5 -18.4 -11.3 5.1 86.5 35 35 A T T 3 S+ 0 0 121 1,-0.1 2,-0.7 2,-0.0 -2,-0.0 0.788 93.8 65.3 -82.3 -28.8 -7.6 6.0 86.4 36 36 A L < - 0 0 28 -3,-1.4 -3,-0.2 1,-0.2 3,-0.1 -0.856 65.9-163.0 -97.3 116.5 -7.1 5.4 82.7 37 37 A L S S+ 0 0 35 -2,-0.7 2,-0.3 1,-0.2 -1,-0.2 0.927 71.1 2.6 -64.9 -44.5 -9.1 7.8 80.5 38 38 A F S S- 0 0 4 -9,-0.1 2,-0.2 30,-0.1 -9,-0.2 -0.995 80.6 -96.4-145.3 149.0 -8.9 5.8 77.3 39 39 A V + 0 0 3 -11,-2.4 29,-2.3 -2,-0.3 3,-0.1 -0.445 39.6 175.9 -62.2 126.1 -7.5 2.5 76.0 40 40 A N + 0 0 28 27,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.577 57.0 28.6-111.6 -13.9 -4.2 3.3 74.4 41 41 A A S > S- 0 0 18 25,-0.1 3,-1.3 1,-0.1 -1,-0.2 -0.994 76.9-110.7-148.1 155.3 -2.9 -0.2 73.4 42 42 A G T 3 S+ 0 0 1 -2,-0.3 4,-0.2 1,-0.2 -16,-0.1 0.814 113.3 55.7 -51.0 -35.9 -4.1 -3.6 72.4 43 43 A X T >> S+ 0 0 22 1,-0.2 3,-2.2 2,-0.1 4,-0.6 0.707 80.9 89.8 -74.2 -21.7 -2.9 -5.2 75.6 44 44 A V G X4 S+ 0 0 34 -3,-1.3 3,-1.6 1,-0.3 4,-0.3 0.877 87.7 47.3 -43.1 -54.8 -4.8 -2.9 78.0 45 45 A P G 34 S+ 0 0 37 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.641 114.4 49.5 -66.9 -9.6 -8.0 -5.1 78.1 46 46 A F G X> S+ 0 0 4 -3,-2.2 4,-2.5 -4,-0.2 3,-0.7 0.345 79.5 105.8-106.2 1.8 -5.9 -8.2 78.7 47 47 A K H S+ 0 0 71 -4,-0.3 6,-1.0 1,-0.2 5,-0.7 0.773 113.0 51.7 -58.5 -26.1 -5.5 -8.6 84.3 49 49 A V H X45S+ 0 0 15 -3,-0.7 3,-1.7 4,-0.2 -1,-0.2 0.873 106.2 52.1 -77.9 -38.7 -5.0 -11.7 82.3 50 50 A F H 3<5S+ 0 0 12 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.816 107.4 55.4 -64.2 -28.4 -1.3 -11.1 81.7 51 51 A L T 3<5S- 0 0 61 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.285 115.0-118.0 -86.6 8.8 -1.1 -10.7 85.5 52 52 A G T < 5S+ 0 0 60 -3,-1.7 -3,-0.2 -5,-0.2 -2,-0.1 0.283 89.3 110.8 73.2 -15.1 -2.6 -14.1 86.0 53 53 A L S S-K 74 0B 18 3,-1.0 3,-1.8 -3,-0.1 -1,-0.1 -0.991 92.7 -6.9-159.7 161.7 -3.7 11.2 78.1 72 72 A G T 3 S- 0 0 54 -2,-0.3 3,-0.4 1,-0.2 -36,-0.0 -0.167 121.2 -13.9 53.9-136.9 -1.2 10.3 80.8 73 73 A K T 3 S+ 0 0 200 1,-0.2 -1,-0.2 -3,-0.0 2,-0.0 0.379 137.2 56.9 -79.8 1.3 2.2 8.9 79.7 74 74 A H E < S+K 71 0B 36 -3,-1.8 -3,-1.0 -6,-0.1 2,-0.6 -0.508 70.7 140.4-132.2 62.5 0.9 8.2 76.2 75 75 A N E +K 70 0B 49 -3,-0.4 -5,-0.3 -5,-0.3 3,-0.2 -0.916 11.7 158.3-112.6 108.0 -0.3 11.7 75.1 76 76 A D >> + 0 0 21 -7,-2.4 3,-1.3 -2,-0.6 4,-1.2 0.435 43.2 108.9-105.7 -1.8 0.4 12.6 71.5 77 77 A L T 34 S+ 0 0 14 -8,-0.4 3,-0.4 1,-0.3 -1,-0.1 0.806 73.4 57.5 -44.2 -43.0 -2.2 15.3 71.1 78 78 A E T 34 S+ 0 0 146 1,-0.2 -1,-0.3 -3,-0.2 4,-0.1 0.870 110.5 43.5 -59.3 -38.4 0.3 18.1 71.0 79 79 A Q T X> S+ 0 0 69 -3,-1.3 3,-1.9 -4,-0.1 4,-0.6 0.667 82.4 118.8 -82.7 -18.3 2.1 16.6 68.0 80 80 A V T 3< S+ 0 0 0 -4,-1.2 7,-0.1 -3,-0.4 188,-0.1 -0.295 82.4 16.9 -57.0 120.6 -1.0 15.7 66.1 81 81 A G T 34 S+ 0 0 0 2,-0.5 -1,-0.3 5,-0.4 186,-0.2 -0.098 110.0 77.7 109.8 -32.9 -1.0 17.6 62.8 82 82 A Y T <4 S+ 0 0 87 -3,-1.9 2,-0.3 -4,-0.1 -2,-0.2 0.553 98.4 37.2 -86.6 -10.1 2.7 18.6 62.8 83 83 A T S < S- 0 0 38 -4,-0.6 -2,-0.5 3,-0.1 151,-0.0 -0.831 76.7-126.4-131.5 170.8 4.0 15.2 61.7 84 84 A S S S+ 0 0 29 -2,-0.3 151,-2.5 1,-0.1 152,-0.4 0.283 104.5 50.0-102.2 8.8 2.7 12.5 59.3 85 85 A R S S+ 0 0 22 149,-0.1 2,-0.4 150,-0.1 -1,-0.1 0.458 84.5 97.0-123.5 -7.1 2.8 9.7 61.8 86 86 A H + 0 0 46 -7,-0.2 -5,-0.4 -10,-0.0 2,-0.3 -0.740 44.0 169.0 -96.4 136.8 1.0 11.0 64.9 87 87 A H - 0 0 10 -2,-0.4 -18,-0.2 1,-0.2 -11,-0.2 -0.910 36.4-151.9-136.6 160.1 -2.6 10.3 65.7 88 88 A T S S+ 0 0 0 1,-0.3 -19,-1.9 -2,-0.3 2,-0.4 0.835 96.3 32.7 -92.5 -58.8 -5.1 10.7 68.5 89 89 A F E S+B 68 0A 0 182,-0.4 -1,-0.3 -21,-0.2 2,-0.3 -0.750 78.2 146.2 -97.7 139.0 -7.2 7.7 67.4 90 90 A F E -B 67 0A 24 -23,-2.0 -23,-2.5 -2,-0.4 2,-0.5 -0.984 43.1-108.8-164.4 162.4 -5.6 4.7 65.7 91 91 A E E -B 66 0A 0 -2,-0.3 131,-3.1 -25,-0.2 2,-0.5 -0.883 23.1-161.2-106.0 128.1 -5.9 0.9 65.3 92 92 A X E -BC 65 221A 34 -27,-2.3 -27,-2.4 -2,-0.5 2,-0.4 -0.927 6.1-153.9-108.4 121.3 -3.3 -1.4 66.8 93 93 A L E +BC 64 220A 0 127,-3.2 127,-2.5 -2,-0.5 2,-0.3 -0.760 27.8 169.5 -90.9 140.0 -3.1 -5.0 65.4 94 94 A G E -B 63 0A 1 -31,-2.2 -31,-1.9 -2,-0.4 2,-0.4 -1.000 33.3-153.6-155.8 153.9 -1.8 -7.5 67.9 95 95 A N E -B 62 0A 1 -2,-0.3 123,-1.0 -33,-0.2 2,-0.4 -0.985 23.4-164.9-125.7 136.7 -1.2 -11.1 68.9 96 96 A F E -BD 61 217A 0 -35,-3.4 -35,-2.5 -2,-0.4 2,-0.4 -0.959 13.3-162.9-129.1 144.5 -1.0 -12.2 72.5 97 97 A S E -BD 60 216A 0 119,-2.1 119,-1.9 -2,-0.4 2,-0.8 -0.993 5.7-160.5-125.9 128.8 0.2 -15.2 74.3 98 98 A F S S- 0 0 24 -39,-2.8 117,-0.2 -2,-0.4 -48,-0.0 -0.805 81.0 -40.2-110.3 85.8 -0.9 -15.9 77.9 99 99 A G S S+ 0 0 30 -2,-0.8 116,-0.2 115,-0.5 -1,-0.1 0.673 123.2 98.2 69.4 16.8 1.7 -18.3 79.3 100 100 A D S S+ 0 0 50 1,-0.4 -1,-0.1 -41,-0.3 -3,-0.1 0.546 80.3 1.8-102.1-112.9 1.6 -20.1 76.0 101 101 A Y - 0 0 9 -42,-0.1 -1,-0.4 1,-0.1 -2,-0.2 -0.301 67.8-171.4 -73.2 164.1 4.2 -19.7 73.2 102 102 A F > - 0 0 41 -3,-0.1 4,-2.6 95,-0.0 5,-0.2 -0.204 46.8 -30.1-129.1-139.2 7.1 -17.3 73.7 103 103 A K H > S+ 0 0 6 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.903 125.4 52.7 -51.6 -57.9 10.0 -15.7 71.6 104 104 A K H > S+ 0 0 90 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.940 117.7 37.4 -46.9 -58.2 10.6 -18.4 69.1 105 105 A E H > S+ 0 0 58 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.899 114.0 55.3 -63.9 -43.6 7.0 -18.6 68.0 106 106 A A H X S+ 0 0 1 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.943 112.4 43.9 -56.6 -45.4 6.4 -14.9 68.3 107 107 A I H X S+ 0 0 0 -4,-3.2 4,-2.5 -5,-0.2 5,-0.2 0.902 112.9 51.1 -67.4 -40.1 9.3 -14.2 66.0 108 108 A E H X S+ 0 0 60 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.900 112.0 46.9 -63.9 -41.6 8.3 -16.9 63.5 109 109 A Y H X S+ 0 0 26 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.914 114.0 46.5 -66.5 -44.3 4.7 -15.7 63.2 110 110 A A H X S+ 0 0 1 -4,-2.0 4,-2.5 -5,-0.3 5,-0.2 0.932 114.0 48.0 -64.4 -45.2 5.7 -12.1 62.7 111 111 A W H X S+ 0 0 33 -4,-2.5 4,-2.4 -5,-0.2 5,-0.4 0.922 112.7 49.7 -62.0 -43.4 8.4 -13.0 60.2 112 112 A E H X>S+ 0 0 70 -4,-2.4 4,-2.8 -5,-0.2 5,-0.7 0.956 111.6 47.1 -61.6 -50.0 5.9 -15.1 58.3 113 113 A F H X>S+ 0 0 0 -4,-2.7 5,-2.8 1,-0.2 4,-1.5 0.937 115.4 45.3 -58.0 -48.5 3.2 -12.5 58.2 114 114 A V H <5S+ 0 0 0 -4,-2.5 6,-2.5 3,-0.2 -1,-0.2 0.894 124.9 29.6 -63.7 -42.9 5.5 -9.7 57.0 115 115 A T H <5S+ 0 0 18 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.823 130.7 31.6 -89.8 -32.1 7.3 -11.7 54.3 116 116 A E H <5S+ 0 0 124 -4,-2.8 -3,-0.2 -5,-0.4 -2,-0.2 0.628 130.6 27.0-101.9 -20.2 4.7 -14.2 53.2 117 117 A V T < - 0 0 65 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 -0.352 21.0-135.9 -61.3 134.0 11.1 -8.2 50.6 122 122 A K G > S+ 0 0 112 1,-0.2 3,-1.5 2,-0.2 -2,-0.0 0.834 100.3 59.6 -64.0 -33.1 13.4 -9.7 53.2 123 123 A E G 3 S+ 0 0 102 1,-0.3 -1,-0.2 23,-0.0 -3,-0.0 0.716 102.3 53.9 -70.2 -16.9 16.5 -7.7 52.2 124 124 A K G < S+ 0 0 86 -3,-1.0 54,-3.5 2,-0.0 2,-0.4 0.255 94.4 96.4 -97.1 11.2 14.7 -4.5 53.0 125 125 A L E < -E 177 0A 2 -3,-1.5 2,-0.3 52,-0.2 52,-0.2 -0.808 48.7-179.6-106.6 144.4 13.8 -5.7 56.5 126 126 A Y E -E 176 0A 38 50,-2.4 50,-3.4 -2,-0.4 2,-0.3 -0.944 7.2-159.7-135.6 155.9 15.7 -4.9 59.7 127 127 A V E -Ef 175 151A 1 23,-1.8 25,-2.9 -2,-0.3 2,-0.4 -0.979 4.4-151.0-139.2 150.5 15.1 -6.0 63.3 128 128 A S E +Ef 174 152A 0 46,-2.1 46,-0.7 -2,-0.3 2,-0.3 -0.917 15.0 177.6-120.5 147.4 16.2 -4.7 66.7 129 129 A V E - f 0 153A 0 23,-2.4 25,-2.6 -2,-0.4 2,-0.2 -0.940 41.2 -86.2-141.6 162.5 16.8 -6.7 69.9 130 130 A Y E > - f 0 154A 23 42,-0.5 3,-2.1 -2,-0.3 7,-0.2 -0.554 39.6-123.5 -71.4 134.5 17.9 -5.9 73.4 131 131 A K T 3 S+ 0 0 96 23,-2.7 -1,-0.1 1,-0.3 24,-0.1 0.805 111.9 42.7 -48.8 -35.0 21.7 -6.0 73.6 132 132 A D T 3 S+ 0 0 100 22,-0.3 2,-1.8 1,-0.1 -1,-0.3 0.504 86.5 96.8 -93.9 -1.0 21.5 -8.6 76.4 133 133 A D <> + 0 0 9 -3,-2.1 4,-1.9 1,-0.2 -1,-0.1 -0.592 42.0 163.6 -86.4 76.1 18.8 -10.7 74.9 134 134 A E H > S+ 0 0 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100.9 55.4 -63.6 -40.5 -0.9 0.6 55.3 227 227 A S H <>S+ 0 0 0 -4,-1.8 5,-2.7 2,-0.2 -1,-0.2 0.835 107.7 50.7 -62.7 -30.9 1.2 3.6 54.2 228 228 A V H ><5S+ 0 0 27 -4,-1.1 3,-1.4 -3,-0.3 -2,-0.2 0.974 113.1 42.6 -70.5 -53.6 4.1 1.3 53.4 229 229 A L H 3<5S+ 0 0 27 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.812 116.2 49.5 -62.7 -30.6 2.0 -1.1 51.3 230 230 A Q T 3<5S- 0 0 28 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.396 111.3-119.5 -90.1 3.3 0.2 1.7 49.5 231 231 A G T < 5 + 0 0 67 -3,-1.4 2,-0.3 -4,-0.2 -3,-0.2 0.839 63.2 141.7 64.2 36.3 3.4 3.6 48.7 232 232 A K < - 0 0 75 -5,-2.7 -1,-0.2 -6,-0.2 -2,-0.1 -0.711 51.1-145.3-105.2 160.2 2.6 6.8 50.6 233 233 A N S S+ 0 0 69 -2,-0.3 2,-0.3 1,-0.1 -149,-0.1 0.088 84.0 47.4-110.2 24.0 5.0 8.9 52.7 234 234 A S S > S- 0 0 4 -7,-0.1 3,-1.2 1,-0.1 -149,-0.1 -0.971 72.4-133.4-160.1 144.1 2.3 9.8 55.3 235 235 A N G > S+ 0 0 4 -151,-2.5 3,-1.1 -2,-0.3 7,-0.1 0.773 107.1 65.5 -69.9 -24.8 -0.3 7.9 57.3 236 236 A F G 3 S+ 0 0 0 -152,-0.4 9,-0.3 1,-0.2 -1,-0.2 0.544 93.7 59.6 -76.0 -5.5 -2.8 10.7 56.3 237 237 A E G < S+ 0 0 63 -3,-1.2 -1,-0.2 -153,-0.2 -2,-0.2 0.414 79.0 112.1-103.1 2.4 -2.6 9.6 52.6 238 238 A I S X> S- 0 0 0 -3,-1.1 4,-3.1 -4,-0.1 3,-2.1 -0.282 83.8 -98.5 -73.6 162.9 -3.8 6.1 53.0 239 239 A D T 34 S+ 0 0 59 1,-0.3 -1,-0.1 2,-0.2 -236,-0.1 0.830 120.5 46.6 -48.7 -43.8 -7.2 4.9 51.6 240 240 A I T 34 S+ 0 0 6 1,-0.1 -1,-0.3 2,-0.1 86,-0.1 0.397 123.0 31.9 -86.2 5.3 -9.1 5.2 54.9 241 241 A I T X> S+ 0 0 0 -3,-2.1 3,-2.2 -6,-0.1 4,-1.0 0.671 97.7 74.1-126.3 -37.9 -7.8 8.6 55.8 242 242 A F H 3X S+ 0 0 60 -4,-3.1 4,-2.7 1,-0.3 3,-0.4 0.813 89.6 64.5 -50.1 -35.5 -7.2 10.7 52.7 243 243 A P H 3> S+ 0 0 35 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.825 100.6 52.9 -59.7 -27.5 -10.9 11.2 52.1 244 244 A L H <> S+ 0 0 2 -3,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.829 107.7 49.6 -75.9 -31.6 -11.0 13.2 55.4 245 245 A I H X S+ 0 0 0 -4,-1.0 4,-2.0 -3,-0.4 3,-0.3 0.951 111.0 50.3 -68.0 -48.1 -8.1 15.4 54.2 246 246 A Q H X S+ 0 0 90 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.815 105.6 57.2 -58.3 -31.8 -10.1 15.9 50.9 247 247 A F H X S+ 0 0 19 -4,-1.4 4,-2.4 -5,-0.2 -1,-0.2 0.927 106.5 49.3 -63.9 -45.2 -13.2 16.8 53.1 248 248 A G H X S+ 0 0 0 -4,-1.6 4,-1.8 -3,-0.3 6,-0.3 0.885 109.7 50.7 -61.4 -42.2 -11.2 19.5 54.7 249 249 A E H X>S+ 0 0 38 -4,-2.0 4,-3.6 2,-0.2 5,-0.5 0.927 111.0 49.9 -61.1 -47.2 -10.0 20.9 51.3 250 250 A E H <5S+ 0 0 162 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.939 113.4 42.4 -58.8 -53.1 -13.6 20.9 50.0 251 251 A V H <5S+ 0 0 46 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.803 125.4 36.8 -67.0 -27.8 -15.1 22.8 53.0 252 252 A S H <5S- 0 0 20 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.757 95.3-133.0 -95.3 -29.2 -12.2 25.2 53.1 253 253 A G T <5 + 0 0 49 -4,-3.6 2,-0.2 1,-0.3 -3,-0.2 0.539 66.6 124.2 85.3 6.0 -11.4 25.7 49.5 254 254 A K < - 0 0 85 -5,-0.5 -1,-0.3 -6,-0.3 2,-0.3 -0.656 58.1-125.4 -97.8 155.1 -7.7 25.1 50.3 255 255 A K > - 0 0 116 -2,-0.2 3,-0.7 -3,-0.1 4,-0.4 -0.793 15.9-124.4-104.0 146.4 -5.4 22.5 48.7 256 256 A Y T 3 S+ 0 0 40 -2,-0.3 4,-0.1 1,-0.2 -11,-0.0 -0.702 93.2 32.4 -83.9 133.9 -3.3 19.9 50.6 257 257 A G T 3 S+ 0 0 56 -2,-0.4 -1,-0.2 2,-0.3 3,-0.1 0.593 94.2 88.3 98.0 11.8 0.4 20.0 49.7 258 258 A E S < S+ 0 0 149 -3,-0.7 2,-0.4 1,-0.4 -2,-0.1 0.804 93.0 16.1-106.4 -45.0 0.9 23.7 49.1 259 259 A K > - 0 0 120 -4,-0.4 4,-2.3 1,-0.1 -1,-0.4 -0.988 64.1-134.4-134.8 141.2 1.7 25.3 52.5 260 260 A F H > S+ 0 0 123 -2,-0.4 4,-2.5 1,-0.2 5,-0.2 0.943 106.1 51.0 -60.0 -51.2 2.8 23.6 55.7 261 261 A E H > S+ 0 0 98 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.865 111.1 51.1 -57.0 -34.7 0.4 25.5 58.0 262 262 A T H > S+ 0 0 18 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.953 109.7 48.2 -66.4 -48.8 -2.4 24.6 55.7 263 263 A D H X S+ 0 0 22 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.849 108.7 55.2 -58.6 -39.0 -1.5 20.8 55.8 264 264 A V H X S+ 0 0 5 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.960 109.3 47.1 -59.3 -50.3 -1.2 21.0 59.5 265 265 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.908 113.7 46.7 -58.1 -46.1 -4.8 22.3 59.7 266 266 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.871 112.4 50.5 -66.9 -36.4 -6.2 19.7 57.3 267 267 A R H X S+ 0 0 16 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.863 108.2 52.6 -68.7 -37.5 -4.4 16.9 59.1 268 268 A V H X S+ 0 0 0 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.951 111.1 47.0 -62.1 -49.7 -5.7 18.0 62.5 269 269 A I H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.957 113.0 48.3 -57.3 -52.4 -9.3 18.0 61.2 270 270 A A H X S+ 0 0 0 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.908 117.0 42.4 -54.6 -47.3 -8.9 14.6 59.5 271 271 A D H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 -182,-0.4 0.907 114.8 48.1 -68.5 -45.2 -7.4 13.0 62.7 272 272 A H H X S+ 0 0 1 -4,-3.2 4,-2.8 -5,-0.2 5,-0.3 0.822 103.0 62.5 -69.3 -27.6 -9.7 14.6 65.1 273 273 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.3 -1,-0.2 0.931 105.6 47.8 -60.6 -43.4 -12.8 13.7 63.1 274 274 A R H X S+ 0 0 4 -4,-1.2 4,-2.1 -5,-0.2 5,-0.3 0.926 112.6 48.8 -62.3 -44.9 -11.9 10.0 63.7 275 275 A A H X S+ 0 0 2 -4,-1.7 4,-2.4 1,-0.2 5,-0.3 0.930 112.0 46.2 -64.2 -46.3 -11.3 10.6 67.4 276 276 A I H X S+ 0 0 2 -4,-2.8 4,-2.8 2,-0.2 5,-0.4 0.942 112.0 52.2 -63.9 -43.7 -14.5 12.4 68.1 277 277 A T H X S+ 0 0 1 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.955 116.0 37.5 -56.7 -55.4 -16.6 9.9 66.1 278 278 A F H X S+ 0 0 3 -4,-2.1 4,-1.5 1,-0.2 -250,-0.2 0.894 117.6 51.2 -66.1 -39.1 -15.3 6.8 67.9 279 279 A A H <>S+ 0 0 1 -4,-2.4 5,-2.3 -5,-0.3 -1,-0.2 0.906 115.4 40.9 -65.3 -43.0 -15.2 8.4 71.3 280 280 A I H ><5S+ 0 0 1 -4,-2.8 3,-1.7 -5,-0.3 -2,-0.2 0.885 112.3 55.6 -73.5 -35.9 -18.7 9.7 71.1 281 281 A S H 3<5S+ 0 0 27 -4,-2.4 -1,-0.2 -5,-0.4 -2,-0.2 0.803 105.1 54.2 -65.9 -27.8 -20.0 6.5 69.6 282 282 A D T 3<5S- 0 0 44 -4,-1.5 -1,-0.3 -5,-0.2 -253,-0.2 0.217 132.3 -88.2 -90.9 16.1 -18.5 4.6 72.6 283 283 A G T < 5S+ 0 0 51 -3,-1.7 2,-0.3 1,-0.3 -3,-0.2 0.294 77.3 142.4 104.2 -12.9 -20.4 6.8 75.1 284 284 A V < - 0 0 7 -5,-2.3 -1,-0.3 -6,-0.2 -2,-0.1 -0.495 31.4-162.4 -70.1 126.5 -18.2 9.8 75.7 285 285 A I - 0 0 89 -2,-0.3 11,-0.1 59,-0.0 10,-0.1 -0.922 29.1-107.6-107.9 128.9 -20.3 13.0 76.1 286 286 A P + 0 0 13 0, 0.0 2,-0.2 0, 0.0 7,-0.2 -0.345 59.6 141.5 -57.8 129.1 -18.4 16.3 75.8 287 287 A S - 0 0 39 5,-0.8 9,-0.3 3,-0.1 -3,-0.0 -0.835 62.9 -92.1-152.2-172.4 -18.0 18.0 79.2 288 288 A N S S+ 0 0 57 -2,-0.2 157,-2.4 156,-0.1 2,-0.3 0.166 98.4 55.4 -99.6 19.3 -15.7 20.0 81.4 289 289 A E S >> S- 0 0 72 155,-0.2 3,-0.9 159,-0.0 4,-0.7 -0.997 99.4 -30.1-153.4 145.6 -14.1 17.1 83.2 290 290 A G H 3> S- 0 0 33 153,-0.4 4,-1.6 -2,-0.3 3,-0.4 -0.188 121.1 -2.2 56.9-132.6 -12.3 13.8 82.5 291 291 A R H 3> S+ 0 0 66 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.891 134.2 56.6 -59.9 -41.1 -13.0 11.9 79.4 292 292 A G H <> S+ 0 0 6 -3,-0.9 4,-1.7 1,-0.2 -5,-0.8 0.841 105.3 50.9 -60.8 -34.9 -15.6 14.4 78.3 293 293 A Y H X S+ 0 0 6 -4,-0.7 4,-2.7 -3,-0.4 -1,-0.2 0.870 104.3 57.0 -73.8 -34.9 -13.1 17.3 78.5 294 294 A V H X S+ 0 0 1 -4,-1.6 4,-2.5 1,-0.2 -2,-0.2 0.965 111.0 43.4 -58.7 -51.2 -10.5 15.4 76.4 295 295 A I H X S+ 0 0 2 -4,-1.8 4,-2.9 1,-0.2 -1,-0.2 0.867 112.0 54.6 -61.9 -36.1 -13.1 15.1 73.5 296 296 A R H X S+ 0 0 28 -4,-1.7 4,-2.9 -9,-0.3 -1,-0.2 0.913 110.2 46.0 -63.7 -42.9 -14.2 18.7 74.1 297 297 A R H X S+ 0 0 14 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.914 113.4 48.7 -64.9 -44.5 -10.6 19.9 73.7 298 298 A I H X S+ 0 0 3 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.927 113.3 48.0 -60.9 -45.0 -10.2 17.8 70.6 299 299 A L H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.931 113.7 46.7 -60.7 -47.2 -13.4 19.1 69.2 300 300 A R H X S+ 0 0 6 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.870 109.8 53.4 -65.1 -38.2 -12.4 22.7 70.0 301 301 A R H X S+ 0 0 16 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.911 109.8 48.1 -64.8 -39.6 -9.0 22.3 68.5 302 302 A A H X S+ 0 0 1 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.897 111.4 49.9 -66.8 -40.0 -10.5 21.0 65.3 303 303 A X H X S+ 0 0 8 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.907 109.8 52.4 -64.0 -41.3 -13.0 23.9 65.2 304 304 A R H X S+ 0 0 5 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.892 111.1 45.2 -63.0 -42.2 -10.1 26.4 65.7 305 305 A F H X S+ 0 0 3 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.889 112.0 51.6 -70.7 -38.1 -8.0 24.9 62.8 306 306 A G H <>S+ 0 0 0 -4,-2.3 5,-2.5 1,-0.2 3,-0.3 0.927 112.0 47.0 -62.9 -42.2 -11.0 24.9 60.5 307 307 A Y H ><5S+ 0 0 71 -4,-2.5 3,-1.4 1,-0.2 -1,-0.2 0.874 106.8 57.8 -64.5 -36.9 -11.6 28.6 61.5 308 308 A K H 3<5S+ 0 0 68 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.817 105.3 51.6 -62.1 -30.2 -7.9 29.2 60.9 309 309 A L T 3<5S- 0 0 11 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.499 129.2 -98.9 -83.6 -7.5 -8.5 27.9 57.3 310 310 A G T < 5S+ 0 0 42 -3,-1.4 2,-0.6 -4,-0.3 -3,-0.2 0.547 70.8 149.2 102.3 7.5 -11.4 30.3 56.9 311 311 A I < - 0 0 13 -5,-2.5 -1,-0.3 -6,-0.2 -2,-0.1 -0.680 21.3-176.4 -78.2 119.5 -14.4 28.0 57.6 312 312 A E + 0 0 97 -2,-0.6 -1,-0.2 -3,-0.1 45,-0.1 0.604 57.3 49.4 -93.6 -14.4 -17.0 30.2 59.1 313 313 A N S S- 0 0 116 1,-0.1 2,-0.1 40,-0.0 37,-0.0 -0.679 99.0 -73.0-120.6 174.0 -19.8 27.7 59.9 314 314 A P + 0 0 22 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.426 57.9 151.2 -64.3 142.4 -20.1 24.4 61.7 315 315 A F >> + 0 0 5 -4,-0.1 3,-1.1 -2,-0.1 4,-0.9 0.485 46.5 82.5-146.7 -22.0 -18.6 21.7 59.5 316 316 A L H >> S+ 0 0 1 1,-0.2 4,-1.4 2,-0.2 3,-1.2 0.902 85.1 64.4 -59.6 -40.8 -17.3 18.8 61.7 317 317 A Y H 3> S+ 0 0 42 1,-0.3 4,-0.6 2,-0.2 -1,-0.2 0.776 100.9 52.2 -55.8 -25.4 -20.7 17.2 62.0 318 318 A K H <> S+ 0 0 100 -3,-1.1 4,-0.9 1,-0.2 3,-0.3 0.789 103.6 58.1 -79.5 -27.6 -20.6 16.6 58.2 319 319 A G H < + 0 0 13 -4,-2.0 3,-1.5 -7,-0.1 4,-0.2 -0.666 65.6 166.2-129.7 76.2 -17.2 -1.3 62.8 332 332 A P T > + 0 0 71 0, 0.0 3,-1.8 0, 0.0 4,-0.5 0.750 69.4 73.3 -62.5 -25.1 -20.8 -1.8 61.8 333 333 A E T >> S+ 0 0 84 1,-0.3 4,-0.8 2,-0.2 3,-0.6 0.730 79.2 76.6 -63.2 -21.2 -22.1 -0.5 65.1 334 334 A L H <> S+ 0 0 2 -3,-1.5 4,-0.8 1,-0.2 -1,-0.3 0.760 86.1 62.0 -62.2 -22.6 -21.1 3.0 64.0 335 335 A E H <4 S+ 0 0 75 -3,-1.8 4,-0.4 1,-0.2 3,-0.4 0.885 98.8 53.0 -72.2 -35.1 -24.2 3.1 61.8 336 336 A L H <4 S+ 0 0 170 -3,-0.6 -1,-0.2 -4,-0.5 4,-0.2 0.696 117.1 39.3 -71.4 -16.9 -26.6 2.8 64.7 337 337 A S H X S+ 0 0 17 -4,-0.8 4,-3.4 -3,-0.2 5,-0.3 0.477 86.0 103.6-108.9 -3.1 -24.8 5.8 66.4 338 338 A R H X S+ 0 0 56 -4,-0.8 4,-2.8 -3,-0.4 5,-0.2 0.890 87.7 36.5 -42.5 -60.5 -24.3 7.9 63.2 339 339 A E H > S+ 0 0 118 -4,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.868 116.6 53.3 -66.6 -38.4 -27.1 10.4 63.8 340 340 A F H > S+ 0 0 110 -4,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.931 113.9 42.3 -62.4 -45.5 -26.6 10.4 67.6 341 341 A V H X S+ 0 0 1 -4,-3.4 4,-2.6 1,-0.2 5,-0.2 0.950 112.7 53.1 -66.9 -46.7 -22.9 11.3 67.1 342 342 A K H X S+ 0 0 51 -4,-2.8 4,-2.3 -5,-0.3 -1,-0.2 0.875 109.8 50.3 -55.3 -37.8 -23.6 13.7 64.3 343 343 A G H X S+ 0 0 42 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.920 108.9 49.2 -68.2 -45.4 -26.1 15.5 66.7 344 344 A I H X S+ 0 0 43 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.927 113.9 47.2 -58.9 -46.5 -23.7 15.8 69.6 345 345 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.936 112.9 47.0 -62.8 -48.9 -21.0 17.2 67.3 346 346 A K H X S+ 0 0 83 -4,-2.3 4,-2.8 -5,-0.2 5,-0.3 0.919 112.5 51.2 -59.2 -44.3 -23.3 19.7 65.6 347 347 A G H X S+ 0 0 38 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.923 110.1 48.4 -59.1 -46.5 -24.6 20.8 69.0 348 348 A E H X S+ 0 0 15 -4,-2.4 4,-2.1 2,-0.2 5,-0.3 0.957 112.8 48.8 -59.7 -51.5 -21.2 21.3 70.4 349 349 A E H X S+ 0 0 2 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.929 111.5 47.0 -56.1 -50.5 -20.1 23.4 67.4 350 350 A K H < S+ 0 0 133 -4,-2.8 4,-0.4 1,-0.2 -1,-0.2 0.818 112.0 54.8 -62.9 -27.7 -23.2 25.6 67.4 351 351 A R H < S+ 0 0 182 -4,-1.7 4,-0.3 -5,-0.3 -1,-0.2 0.888 122.0 22.5 -72.8 -41.8 -22.7 26.1 71.1 352 352 A F H X S+ 0 0 37 -4,-2.1 4,-3.0 -5,-0.1 5,-0.2 0.639 95.4 93.0-104.7 -12.8 -19.1 27.3 71.0 353 353 A I H X S+ 0 0 36 -4,-2.7 4,-2.3 -5,-0.3 5,-0.2 0.863 90.0 43.8 -50.7 -48.6 -18.5 28.7 67.5 354 354 A K H > S+ 0 0 169 -4,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.932 116.4 48.2 -65.2 -42.2 -19.3 32.3 68.2 355 355 A T H > S+ 0 0 57 -4,-0.3 4,-2.9 2,-0.2 -2,-0.2 0.871 108.2 55.3 -64.3 -36.7 -17.3 32.3 71.4 356 356 A L H X S+ 0 0 5 -4,-3.0 4,-2.2 2,-0.2 -1,-0.2 0.948 111.1 44.9 -61.3 -46.9 -14.4 30.6 69.6 357 357 A K H X S+ 0 0 52 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.927 114.5 47.0 -63.5 -45.3 -14.4 33.5 67.1 358 358 A A H X S+ 0 0 38 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.919 113.2 50.4 -62.9 -40.8 -14.7 36.2 69.7 359 359 A G H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.860 105.6 55.3 -65.5 -36.9 -12.0 34.5 71.7 360 360 A X H X S+ 0 0 12 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.860 106.9 50.8 -65.3 -34.8 -9.6 34.3 68.7 361 361 A E H X S+ 0 0 148 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.913 111.9 48.4 -68.4 -39.3 -10.0 38.1 68.3 362 362 A Y H X S+ 0 0 48 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.949 112.9 45.9 -63.9 -50.4 -9.1 38.6 71.9 363 363 A I H X S+ 0 0 1 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.914 113.3 48.0 -61.1 -45.4 -6.1 36.3 71.9 364 364 A Q H X S+ 0 0 56 -4,-2.1 4,-3.2 1,-0.2 5,-0.2 0.898 109.7 55.7 -62.2 -39.5 -4.6 37.7 68.7 365 365 A E H X S+ 0 0 121 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.932 111.6 40.6 -58.6 -50.7 -5.2 41.2 70.1 366 366 A V H X S+ 0 0 16 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.802 114.1 55.8 -70.8 -26.3 -3.2 40.6 73.3 367 367 A I H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.2 3,-0.5 0.968 110.3 42.6 -68.2 -51.0 -0.6 38.7 71.3 368 368 A Q H X S+ 0 0 94 -4,-3.2 4,-1.2 1,-0.3 -2,-0.2 0.840 113.0 53.8 -64.5 -31.8 -0.0 41.6 68.9 369 369 A K H X S+ 0 0 92 -4,-1.9 4,-1.6 -5,-0.2 -1,-0.3 0.769 109.1 52.0 -71.7 -26.2 -0.0 44.0 71.8 370 370 A A H <>S+ 0 0 0 -4,-1.2 5,-2.5 -3,-0.5 3,-0.2 0.985 111.7 40.0 -74.7 -61.1 2.6 41.8 73.5 371 371 A L H <5S+ 0 0 66 -4,-2.2 3,-0.5 1,-0.2 -2,-0.2 0.738 114.6 57.4 -62.9 -17.7 5.2 41.6 70.7 372 372 A E H <5S+ 0 0 146 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.935 109.7 41.8 -75.0 -46.9 4.5 45.3 69.9 373 373 A E T <5S- 0 0 101 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.182 122.9-106.9 -84.2 16.0 5.4 46.4 73.5 374 374 A G T 5 + 0 0 46 -3,-0.5 -3,-0.2 1,-0.2 -4,-0.1 0.583 68.5 149.9 71.3 10.4 8.4 44.0 73.4 375 375 A R < - 0 0 87 -5,-2.5 -1,-0.2 -6,-0.2 3,-0.1 -0.351 37.6-154.2 -74.3 159.1 6.9 41.4 75.8 376 376 A K + 0 0 162 1,-0.1 31,-1.2 30,-0.1 2,-0.3 0.452 69.2 21.1-112.6 -2.4 7.8 37.7 75.4 377 377 A T E S-l 407 0C 57 29,-0.2 2,-0.4 -7,-0.1 31,-0.2 -0.954 78.7 -98.2-155.0 171.2 4.8 35.9 76.9 378 378 A L E -l 408 0C 3 29,-2.5 31,-2.6 -2,-0.3 -11,-0.0 -0.789 45.8-116.9 -95.2 139.3 1.1 36.3 77.8 379 379 A S > - 0 0 42 -2,-0.4 4,-1.9 29,-0.2 5,-0.1 -0.195 22.8-109.6 -70.2 169.0 0.5 37.2 81.4 380 380 A G H > S+ 0 0 3 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.862 120.6 57.9 -66.5 -33.2 -1.4 34.9 83.7 381 381 A K H > S+ 0 0 123 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.934 107.4 43.9 -61.9 -47.7 -4.2 37.5 83.6 382 382 A E H > S+ 0 0 28 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.848 114.7 51.0 -66.4 -34.7 -4.6 37.3 79.8 383 383 A V H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.952 110.3 48.9 -67.1 -47.0 -4.4 33.5 80.0 384 384 A F H X S+ 0 0 17 -4,-3.2 4,-4.0 1,-0.2 5,-0.5 0.900 109.2 53.4 -58.7 -42.2 -7.1 33.4 82.6 385 385 A T H X>S+ 0 0 38 -4,-2.3 4,-2.1 1,-0.2 5,-1.3 0.915 111.2 44.4 -60.0 -45.2 -9.3 35.7 80.6 386 386 A A H <5S+ 0 0 2 -4,-2.0 6,-2.4 3,-0.2 -1,-0.2 0.875 120.7 42.7 -67.3 -34.8 -9.0 33.5 77.5 387 387 A Y H <5S+ 0 0 4 -4,-2.4 59,-0.4 4,-0.2 4,-0.2 0.893 126.9 28.0 -75.9 -44.3 -9.6 30.4 79.7 388 388 A D H <5S+ 0 0 78 -4,-4.0 -3,-0.2 -5,-0.2 -2,-0.2 0.849 128.5 36.1 -90.9 -40.1 -12.4 31.8 81.9 389 389 A T T <5S+ 0 0 86 -4,-2.1 -3,-0.2 -5,-0.5 -2,-0.1 0.900 131.2 27.8 -81.3 -44.6 -14.1 34.4 79.7 390 390 A Y S - 0 0 2 0, 0.0 4,-1.9 0, 0.0 3,-0.2 -0.309 23.1-118.8 -59.6 147.8 -8.6 25.2 77.0 394 394 A V H > S+ 0 0 12 47,-0.5 4,-2.0 1,-0.2 5,-0.2 0.906 113.3 52.5 -57.8 -42.9 -5.1 26.0 78.3 395 395 A D H > S+ 0 0 74 47,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.864 108.1 51.5 -62.5 -36.2 -3.3 23.9 75.7 396 396 A L H > S+ 0 0 6 -3,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.894 108.1 51.8 -68.3 -38.1 -5.2 25.6 72.9 397 397 A I H X S+ 0 0 1 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.924 111.1 47.6 -62.9 -44.5 -4.2 29.1 74.2 398 398 A D H X S+ 0 0 34 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.921 108.4 53.9 -62.7 -45.7 -0.5 28.0 74.4 399 399 A E H X S+ 0 0 22 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.904 110.6 47.5 -56.8 -42.7 -0.6 26.6 70.8 400 400 A I H < S+ 0 0 0 -4,-2.0 3,-0.5 1,-0.2 4,-0.3 0.949 113.0 46.4 -65.2 -50.2 -1.9 29.8 69.5 401 401 A A H ><>S+ 0 0 0 -4,-2.4 5,-2.1 1,-0.2 3,-1.6 0.872 107.2 60.1 -59.8 -37.3 0.6 32.0 71.3 402 402 A R H ><5S+ 0 0 159 -4,-2.7 3,-2.7 1,-0.3 -1,-0.2 0.862 90.9 67.2 -59.9 -37.0 3.4 29.6 70.2 403 403 A E T 3<5S+ 0 0 70 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 0.679 107.0 42.8 -59.0 -15.7 2.6 30.3 66.5 404 404 A K T < 5S- 0 0 84 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.154 122.9-103.5-115.2 16.0 3.9 33.8 67.2 405 405 A G T < 5S+ 0 0 70 -3,-2.7 2,-0.2 1,-0.3 -3,-0.2 0.473 82.9 125.2 77.8 1.7 6.9 32.9 69.3 406 406 A L < - 0 0 11 -5,-2.1 -1,-0.3 -6,-0.1 -29,-0.2 -0.607 43.4-157.0 -94.7 154.5 5.2 33.8 72.6 407 407 A G E -l 377 0C 23 -31,-1.2 -29,-2.5 -2,-0.2 2,-0.4 -0.640 22.0-105.1-118.4 178.7 4.7 31.6 75.6 408 408 A I E -l 378 0C 22 -31,-0.2 2,-1.5 -2,-0.2 -29,-0.2 -0.905 29.0-116.4-111.7 137.7 2.2 31.6 78.4 409 409 A D > - 0 0 67 -31,-2.6 4,-1.7 -2,-0.4 5,-0.2 -0.541 33.9-177.6 -72.4 92.0 3.1 32.7 81.9 410 410 A L H > S+ 0 0 130 -2,-1.5 4,-1.5 1,-0.2 -1,-0.2 0.802 80.8 43.3 -61.1 -37.6 2.6 29.5 83.8 411 411 A E H > S+ 0 0 125 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.741 113.5 52.3 -82.4 -23.4 3.4 30.9 87.3 412 412 A G H > S+ 0 0 19 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.778 109.0 51.0 -79.0 -26.7 1.4 34.0 86.6 413 413 A F H X S+ 0 0 8 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.886 108.0 52.5 -75.1 -40.5 -1.6 31.8 85.6 414 414 A Q H X S+ 0 0 16 -4,-1.5 4,-1.8 2,-0.2 5,-0.2 0.958 109.3 48.0 -59.3 -53.3 -1.3 29.8 88.8 415 415 A C H X S+ 0 0 55 -4,-1.8 4,-2.4 1,-0.3 3,-0.3 0.917 112.7 49.4 -55.7 -43.2 -1.4 32.9 91.1 416 416 A E H X S+ 0 0 12 -4,-1.5 4,-2.0 1,-0.2 -1,-0.3 0.848 107.5 54.6 -65.4 -32.8 -4.4 34.1 89.1 417 417 A L H X S+ 0 0 16 -4,-2.1 4,-1.0 1,-0.2 -1,-0.2 0.819 110.3 47.1 -69.5 -29.1 -6.1 30.7 89.5 418 418 A E H X S+ 0 0 60 -4,-1.8 4,-2.9 -3,-0.3 5,-0.3 0.874 108.2 55.0 -77.4 -40.5 -5.6 31.1 93.3 419 419 A E H X S+ 0 0 86 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.913 107.7 48.7 -59.7 -44.0 -6.9 34.6 93.4 420 420 A Q H X S+ 0 0 60 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.873 112.0 51.3 -64.6 -34.6 -10.1 33.6 91.7 421 421 A R H X S+ 0 0 57 -4,-1.0 4,-2.3 2,-0.2 -2,-0.2 0.966 112.5 42.8 -63.1 -56.1 -10.4 30.8 94.2 422 422 A E H < S+ 0 0 113 -4,-2.9 4,-0.5 1,-0.2 5,-0.3 0.828 117.8 49.9 -58.6 -33.9 -9.8 33.0 97.3 423 423 A R H < S+ 0 0 91 -4,-2.3 4,-0.5 -5,-0.3 3,-0.5 0.875 109.5 48.8 -73.2 -41.4 -12.2 35.5 95.6 424 424 A A H < S+ 0 0 72 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.830 111.1 50.8 -68.6 -33.0 -14.8 32.8 94.9 425 425 A R S < S+ 0 0 178 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.603 131.1 14.4 -80.3 -12.1 -14.7 31.6 98.5 426 426 A K 0 0 151 -4,-0.5 -3,-0.2 -3,-0.5 -2,-0.2 0.634 360.0 360.0-122.9 -72.9 -15.1 35.2 99.8 427 427 A H 0 0 182 -4,-0.5 -3,-0.2 -5,-0.3 -4,-0.1 0.844 360.0 360.0 -44.5 360.0 -16.3 37.8 97.3 428 ! 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 0.0 429 437 A P 0 0 147 0, 0.0 2,-0.4 0, 0.0 20,-0.1 0.000 360.0 360.0 360.0 118.8 -17.0 17.1 90.4 430 438 A V - 0 0 48 18,-0.5 2,-0.4 2,-0.0 14,-0.0 -0.977 360.0-165.2-132.5 121.1 -13.3 17.9 90.4 431 439 A Y - 0 0 190 -2,-0.4 2,-0.4 18,-0.1 18,-0.1 -0.852 11.9-175.7-104.2 138.9 -11.3 18.5 93.6 432 440 A S - 0 0 14 -2,-0.4 2,-0.1 8,-0.0 5,-0.1 -0.997 24.4-126.5-140.7 140.0 -7.8 20.0 93.4 433 441 A H > - 0 0 107 -2,-0.4 3,-1.3 1,-0.1 4,-0.3 -0.473 39.7-105.7 -74.2 147.6 -5.0 20.8 95.8 434 442 A L T 3 S+ 0 0 63 1,-0.2 -1,-0.1 2,-0.2 -16,-0.0 -0.507 112.2 36.6 -71.7 148.7 -3.8 24.4 95.8 435 443 A K T 3 S+ 0 0 165 -2,-0.1 -1,-0.2 -21,-0.1 4,-0.2 0.206 113.8 65.5 90.0 -15.6 -0.4 24.7 94.1 436 444 A E S <> S+ 0 0 91 -3,-1.3 4,-3.1 2,-0.1 5,-0.3 0.437 72.3 93.5-111.5 -10.2 -1.8 22.0 91.8 437 445 A L H > S+ 0 0 6 -4,-0.3 4,-2.6 1,-0.2 5,-0.1 0.907 83.9 51.3 -51.8 -48.9 -4.5 24.3 90.3 438 446 A G H 4 S+ 0 0 17 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.941 113.6 44.5 -54.7 -49.5 -2.4 25.3 87.4 439 447 A K H >4 S+ 0 0 148 1,-0.2 3,-1.6 -4,-0.2 4,-0.3 0.946 114.1 48.4 -59.6 -51.9 -1.6 21.6 86.5 440 448 A T H >X S+ 0 0 33 -4,-3.1 3,-2.4 1,-0.3 4,-0.7 0.859 99.3 68.4 -57.9 -38.2 -5.2 20.5 87.0 441 449 A S T 3< S+ 0 0 1 -4,-2.6 -47,-0.5 1,-0.3 -1,-0.3 0.669 90.2 64.0 -58.9 -17.0 -6.5 23.4 84.8 442 450 A A T <4 S+ 0 0 18 -3,-1.6 -1,-0.3 -4,-0.5 -47,-0.2 0.658 111.8 34.9 -79.6 -17.4 -4.8 21.7 81.8 443 451 A F T <4 S+ 0 0 96 -3,-2.4 -153,-0.4 -4,-0.3 2,-0.3 0.359 117.0 51.5-119.1 3.3 -7.2 18.8 82.1 444 452 A V S < S- 0 0 9 -4,-0.7 -155,-0.2 -155,-0.1 2,-0.2 -0.937 82.3-108.6-136.3 158.0 -10.4 20.4 83.3 445 453 A G >> - 0 0 2 -157,-2.4 3,-1.3 -2,-0.3 4,-1.0 -0.508 37.0-106.7 -83.6 158.4 -12.5 23.3 82.1 446 454 A A T 34 S+ 0 0 23 -59,-0.4 3,-0.3 1,-0.3 -1,-0.1 0.805 120.3 56.2 -54.1 -32.5 -12.6 26.6 84.1 447 455 A A T 34 S+ 0 0 86 1,-0.2 -1,-0.3 -56,-0.0 -59,-0.0 0.770 98.3 60.8 -71.4 -27.8 -16.1 25.8 85.3 448 456 A A T <4 0 0 22 -3,-1.3 -18,-0.5 1,-0.3 -1,-0.2 0.806 360.0 360.0 -67.4 -33.3 -15.0 22.4 86.8 449 457 A L < 0 0 70 -4,-1.0 -1,-0.3 -3,-0.3 -18,-0.1 -0.590 360.0 360.0-101.7 360.0 -12.6 24.3 89.1