==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 30-AUG-10 3OO7 . COMPND 2 MOLECULE: ABC TRANSPORTER BINDING PROTEIN ACBH; . SOURCE 2 ORGANISM_SCIENTIFIC: ACTINOPLANES; . AUTHOR A.VAHEDI-FARIDI,H.BULUT,A.LICHT . 388 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16123.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 278 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 7.2 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 16 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 152 39.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 1 2 3 2 2 0 3 0 1 1 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 1 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 PARALLEL BRIDGES PER LADDER . 2 1 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 2 0 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 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 17 A G 0 0 79 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 38.1 0.4 -17.2 -13.3 2 18 A P - 0 0 80 0, 0.0 2,-0.3 0, 0.0 31,-0.2 -0.318 360.0-151.9 -65.9 150.7 -0.4 -13.5 -13.0 3 19 A I E -a 33 0A 2 29,-2.6 31,-2.2 284,-0.1 2,-0.3 -0.790 8.3-131.6-110.3 165.5 -1.7 -12.2 -9.7 4 20 A T E -a 34 0A 46 -2,-0.3 54,-1.1 279,-0.3 53,-0.5 -0.880 16.0-151.8-110.1 156.8 -3.9 -9.2 -9.0 5 21 A F E -ab 35 58A 0 29,-2.7 31,-2.8 -2,-0.3 2,-0.5 -0.963 7.3-143.8-134.3 116.8 -3.1 -6.6 -6.4 6 22 A G E -ab 36 59A 0 52,-2.8 54,-2.3 -2,-0.5 2,-0.4 -0.685 29.3-171.6 -79.5 123.4 -5.7 -4.5 -4.6 7 23 A S E -a 37 0A 1 29,-2.7 31,-2.1 -2,-0.5 36,-0.1 -0.959 35.5-173.0-130.8 128.5 -4.2 -1.0 -4.0 8 24 A N + 0 0 10 -2,-0.4 2,-2.0 29,-0.2 3,-0.3 0.252 59.2 114.9 -92.5 9.0 -5.2 2.0 -2.1 9 25 A Y + 0 0 16 1,-0.2 -1,-0.1 5,-0.1 9,-0.1 -0.542 30.7 142.4 -79.1 79.0 -2.3 4.0 -3.6 10 26 A S + 0 0 32 -2,-2.0 -1,-0.2 28,-0.1 29,-0.1 0.695 33.6 95.6 -98.4 -18.8 -4.6 6.4 -5.6 11 27 A D S > S- 0 0 119 -3,-0.3 4,-2.2 1,-0.1 5,-0.3 -0.434 86.5-111.6 -68.8 151.7 -2.6 9.7 -5.3 12 28 A E H > S+ 0 0 172 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.885 108.8 46.2 -53.0 -50.5 -0.4 10.3 -8.4 13 29 A A H > S+ 0 0 56 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.942 117.5 38.7 -64.2 -53.0 3.0 10.0 -6.7 14 30 A P H > S+ 0 0 41 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.841 113.9 57.1 -68.4 -33.5 2.5 6.8 -4.7 15 31 A K H X S+ 0 0 91 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.967 109.8 44.8 -57.3 -49.4 0.5 5.2 -7.5 16 32 A A H X S+ 0 0 60 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.913 114.5 49.3 -61.4 -41.4 3.4 5.7 -9.8 17 33 A A H X S+ 0 0 12 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.865 111.4 47.6 -68.0 -37.5 5.8 4.4 -7.2 18 34 A F H X S+ 0 0 2 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.894 110.5 52.3 -70.7 -37.6 3.8 1.3 -6.5 19 35 A A H X S+ 0 0 43 -4,-2.3 4,-1.5 -5,-0.2 -2,-0.2 0.943 111.7 46.4 -63.6 -44.7 3.4 0.6 -10.2 20 36 A S H X S+ 0 0 44 -4,-2.3 4,-2.2 1,-0.2 3,-0.2 0.917 109.3 55.8 -59.4 -43.3 7.1 0.8 -10.6 21 37 A L H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.852 106.6 49.9 -59.2 -40.0 7.6 -1.4 -7.5 22 38 A M H X S+ 0 0 6 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.809 105.5 56.2 -69.5 -33.0 5.5 -4.1 -9.1 23 39 A Q H X S+ 0 0 137 -4,-1.5 4,-2.4 -3,-0.2 -2,-0.2 0.949 110.4 46.0 -61.8 -44.6 7.5 -4.0 -12.4 24 40 A Q H X S+ 0 0 67 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.900 109.3 55.2 -65.3 -34.2 10.6 -4.7 -10.3 25 41 A A H X S+ 0 0 0 -4,-1.9 4,-3.0 2,-0.2 6,-0.5 0.883 109.5 46.2 -67.4 -36.8 8.7 -7.4 -8.4 26 42 A T H X S+ 0 0 40 -4,-2.1 4,-3.4 2,-0.2 -1,-0.2 0.940 110.9 53.5 -68.4 -43.0 7.9 -9.2 -11.7 27 43 A T H < S+ 0 0 123 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.901 117.4 37.5 -59.0 -39.0 11.5 -8.7 -12.9 28 44 A S H < S+ 0 0 79 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.939 132.4 24.0 -80.2 -44.2 12.7 -10.4 -9.7 29 45 A T H < S- 0 0 28 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.605 92.5-129.0 -99.2 -13.7 10.1 -13.1 -9.2 30 46 A T < + 0 0 116 -4,-3.4 -4,-0.2 -5,-0.3 -3,-0.1 0.317 66.0 133.4 73.2 -4.9 8.8 -13.5 -12.8 31 47 A V - 0 0 10 -6,-0.5 -1,-0.2 -5,-0.1 -2,-0.2 -0.667 52.9-138.5 -81.3 113.3 5.3 -13.1 -11.4 32 48 A P - 0 0 56 0, 0.0 -29,-2.6 0, 0.0 2,-0.4 -0.427 19.2-154.4 -67.7 147.4 3.2 -10.7 -13.5 33 49 A V E -a 3 0A 28 -31,-0.2 2,-0.6 -2,-0.1 -29,-0.2 -0.977 14.2-159.4-133.3 126.8 1.0 -8.3 -11.5 34 50 A T E -a 4 0A 73 -31,-2.2 -29,-2.7 -2,-0.4 2,-0.7 -0.940 19.8-147.0-102.3 116.7 -2.2 -6.5 -12.4 35 51 A V E -a 5 0A 47 -2,-0.6 2,-0.8 -31,-0.2 -29,-0.2 -0.744 9.4-164.9 -90.3 114.8 -2.7 -3.5 -10.1 36 52 A N E -a 6 0A 65 -31,-2.8 -29,-2.7 -2,-0.7 2,-0.4 -0.885 12.9-160.5-100.6 108.8 -6.3 -2.7 -9.3 37 53 A T E -a 7 0A 49 -2,-0.8 2,-0.4 -31,-0.2 -29,-0.2 -0.766 11.3-177.1 -97.1 137.2 -6.5 0.8 -7.8 38 54 A T - 0 0 53 -31,-2.1 -28,-0.1 -2,-0.4 5,-0.1 -0.960 45.7 -82.7-129.4 139.8 -9.4 2.1 -5.8 39 55 A D > - 0 0 90 -2,-0.4 4,-2.9 1,-0.1 5,-0.2 -0.147 48.1-119.5 -37.0 135.0 -9.8 5.6 -4.4 40 56 A H H > S+ 0 0 72 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.916 108.0 40.5 -52.3 -59.1 -7.9 5.6 -1.2 41 57 A N H > S+ 0 0 94 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.900 115.3 51.6 -59.0 -43.2 -10.7 6.4 1.3 42 58 A T H > S+ 0 0 70 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.924 103.7 59.7 -56.3 -50.6 -13.2 4.2 -0.5 43 59 A F H >< S+ 0 0 8 -4,-2.9 3,-0.7 2,-0.2 4,-0.2 0.934 112.4 36.6 -44.5 -62.8 -10.8 1.3 -0.4 44 60 A Q H >< S+ 0 0 38 -4,-1.6 3,-3.7 1,-0.2 4,-0.4 0.968 111.4 58.5 -56.4 -58.8 -10.6 1.3 3.4 45 61 A N H 3< S+ 0 0 134 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.755 115.5 39.6 -43.3 -28.2 -14.2 2.2 4.0 46 62 A N T S+ 0 0 2 -3,-3.7 4,-2.5 -4,-0.2 5,-0.2 0.825 76.4 47.0 -47.0 -47.9 -12.2 -3.2 3.5 48 64 A S H > S+ 0 0 44 -4,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.941 117.4 42.0 -63.1 -49.3 -14.5 -5.7 5.3 49 65 A N H > S+ 0 0 109 -3,-0.2 4,-1.6 2,-0.2 3,-0.4 0.932 112.5 55.8 -62.8 -44.7 -16.8 -6.2 2.4 50 66 A Y H >< S+ 0 0 37 -4,-3.3 3,-0.7 1,-0.2 -2,-0.2 0.939 108.2 47.8 -54.6 -47.9 -13.9 -6.3 -0.0 51 67 A L H 3< S+ 0 0 0 -4,-2.5 230,-0.4 1,-0.2 -1,-0.2 0.783 113.2 47.0 -65.0 -31.0 -12.2 -9.2 1.9 52 68 A Q H 3< S+ 0 0 107 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.657 113.3 51.7 -89.0 -12.9 -15.4 -11.3 2.2 53 69 A G S << S- 0 0 38 -4,-1.6 -3,-0.1 -3,-0.7 -2,-0.1 0.725 124.5 -48.0 -87.7-113.3 -16.3 -10.9 -1.5 54 70 A T - 0 0 137 -4,-0.1 -3,-0.1 229,-0.0 -2,-0.1 -0.625 70.0-176.4-127.4 74.3 -13.8 -11.6 -4.3 55 71 A P - 0 0 10 0, 0.0 228,-0.3 0, 0.0 4,-0.1 -0.184 29.2 -95.4 -70.0 163.1 -10.6 -9.8 -3.2 56 72 A D - 0 0 22 226,-0.2 -51,-0.2 2,-0.2 226,-0.1 -0.139 41.7 -96.7 -70.7 173.2 -7.3 -9.6 -5.2 57 73 A S S S+ 0 0 5 -53,-0.5 2,-0.3 225,-0.2 -52,-0.2 0.809 107.2 4.9 -62.7 -33.5 -4.4 -12.0 -4.7 58 74 A L E S-b 5 0A 0 -54,-1.1 -52,-2.8 220,-0.2 2,-0.3 -0.927 74.1-160.8-144.2 162.5 -2.7 -9.4 -2.4 59 75 A A E -bC 6 277A 0 218,-2.1 218,-2.2 -2,-0.3 2,-0.3 -0.999 24.1-106.3-151.2 157.0 -3.7 -6.0 -0.9 60 76 A T E + C 0 276A 1 -54,-2.3 216,-0.2 -2,-0.3 2,-0.2 -0.580 55.0 133.4 -77.1 133.0 -2.5 -2.8 0.6 61 77 A W E - C 0 275A 3 214,-2.2 214,-2.9 -2,-0.3 2,-0.3 -0.818 37.2-127.0-152.9-157.6 -3.2 -2.5 4.3 62 78 A F E - C 0 274A 15 212,-0.3 5,-0.3 -2,-0.2 212,-0.2 -0.982 28.2 -82.8-159.1 166.2 -1.5 -1.4 7.6 63 79 A A S S+ 0 0 1 210,-2.1 2,-0.3 -2,-0.3 3,-0.2 -0.280 75.6 66.1 -72.1 153.8 -0.6 -2.5 11.1 64 80 A G S > S- 0 0 11 33,-0.4 4,-1.7 1,-0.2 283,-0.3 -0.841 93.9 -29.2 138.3-159.5 -3.2 -2.0 13.9 65 81 A Y H > S+ 0 0 39 281,-2.8 4,-2.5 -2,-0.3 -1,-0.2 0.901 127.4 49.2 -63.3 -48.2 -6.5 -3.0 15.2 66 82 A R H > S+ 0 0 64 280,-0.5 4,-3.4 282,-0.2 5,-0.3 0.912 106.0 57.3 -63.8 -38.6 -8.2 -3.9 11.9 67 83 A L H > S+ 0 0 2 -5,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.947 113.2 40.4 -52.7 -52.7 -5.3 -6.0 10.8 68 84 A Q H X S+ 0 0 40 -4,-1.7 4,-2.1 2,-0.2 33,-0.2 0.866 113.9 54.8 -68.0 -33.6 -5.7 -8.2 13.9 69 85 A F H X S+ 0 0 89 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.955 110.0 44.6 -63.6 -50.3 -9.5 -8.1 13.6 70 86 A F H <>S+ 0 0 7 -4,-3.4 5,-2.3 1,-0.2 6,-0.5 0.878 113.9 52.2 -65.0 -30.8 -9.5 -9.4 10.1 71 87 A A H ><5S+ 0 0 6 -4,-1.9 3,-0.9 -5,-0.3 -1,-0.2 0.842 107.5 49.8 -70.7 -39.8 -7.0 -12.0 11.0 72 88 A A H 3<5S+ 0 0 71 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.863 107.8 56.0 -69.1 -32.0 -9.0 -13.3 14.0 73 89 A Q T 3<5S- 0 0 99 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.475 116.4-114.1 -73.9 -12.9 -12.0 -13.6 11.8 74 90 A G T < 5S+ 0 0 38 -3,-0.9 -3,-0.2 -4,-0.2 -2,-0.1 0.705 81.3 123.4 84.5 22.0 -10.2 -15.8 9.3 75 91 A L < + 0 0 14 -5,-2.3 205,-2.4 -6,-0.2 206,-0.5 0.599 62.6 63.4 -88.2 -12.3 -10.3 -13.3 6.4 76 92 A L B S-F 279 0B 4 -6,-0.5 -2,-0.1 203,-0.3 -1,-0.1 -0.941 78.1-127.8-119.0 140.3 -6.5 -13.3 6.0 77 93 A T - 0 0 27 201,-3.0 201,-0.4 -2,-0.4 2,-0.2 -0.606 31.6-120.6 -79.0 131.6 -4.1 -16.1 5.0 78 94 A P - 0 0 51 0, 0.0 28,-0.2 0, 0.0 3,-0.2 -0.495 19.3-160.5 -71.1 145.1 -1.2 -16.5 7.5 79 95 A I > + 0 0 0 26,-2.7 4,-2.2 -2,-0.2 3,-0.2 -0.161 41.4 136.2-123.3 39.3 2.3 -16.0 5.9 80 96 A D H > S+ 0 0 53 25,-0.3 4,-1.3 1,-0.2 -1,-0.1 0.821 75.9 55.7 -55.1 -33.3 4.6 -17.7 8.3 81 97 A D H > S+ 0 0 67 2,-0.2 4,-0.9 1,-0.2 3,-0.4 0.925 103.8 51.9 -68.9 -40.5 6.4 -19.2 5.4 82 98 A V H >> S+ 0 0 0 1,-0.2 4,-1.6 -3,-0.2 3,-1.2 0.936 110.2 51.4 -56.4 -44.0 7.0 -15.8 3.8 83 99 A W H 3X S+ 0 0 8 -4,-2.2 4,-2.2 1,-0.3 -1,-0.2 0.756 95.5 66.3 -69.2 -27.4 8.5 -14.8 7.1 84 100 A D H 3< S+ 0 0 133 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.810 111.5 39.4 -58.8 -30.4 10.8 -17.8 7.3 85 101 A K H << S+ 0 0 157 -3,-1.2 -2,-0.2 -4,-0.9 3,-0.2 0.849 126.6 29.1 -88.8 -36.8 12.5 -16.2 4.3 86 102 A I H >< S+ 0 0 7 -4,-1.6 3,-2.6 1,-0.2 4,-0.4 0.590 89.3 98.0-102.8 -8.8 12.4 -12.5 5.1 87 103 A G G >< S+ 0 0 12 -4,-2.2 3,-1.2 1,-0.3 -1,-0.2 0.747 74.4 63.8 -57.1 -28.0 12.5 -12.5 8.9 88 104 A G G 3 S+ 0 0 77 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.579 96.6 61.0 -73.5 -7.9 16.3 -11.9 9.2 89 105 A T G < S+ 0 0 46 -3,-2.6 227,-3.6 207,-0.1 2,-0.3 0.661 99.6 64.4 -91.6 -13.7 15.7 -8.5 7.6 90 106 A F S < S- 0 0 2 -3,-1.2 225,-0.1 -4,-0.4 -1,-0.0 -0.858 71.1-132.9-122.1 146.3 13.5 -7.2 10.3 91 107 A N > - 0 0 41 223,-0.5 4,-2.0 -2,-0.3 5,-0.1 -0.071 41.7 -86.8 -84.0-176.9 13.8 -6.3 14.0 92 108 A D H > S+ 0 0 119 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.844 124.7 49.6 -62.7 -35.9 11.5 -7.2 16.9 93 109 A A H > S+ 0 0 6 244,-0.3 4,-2.1 2,-0.2 247,-0.3 0.909 110.5 50.2 -69.0 -46.2 9.2 -4.2 16.5 94 110 A A H 4 S+ 0 0 1 1,-0.2 4,-0.4 2,-0.2 -2,-0.2 0.878 112.3 50.1 -56.3 -41.8 8.7 -4.9 12.8 95 111 A K H >< S+ 0 0 48 -4,-2.0 3,-1.2 1,-0.2 4,-0.3 0.948 109.9 48.3 -64.1 -45.7 7.9 -8.5 13.7 96 112 A S H >< S+ 0 0 56 -4,-2.3 3,-1.4 1,-0.3 -2,-0.2 0.862 106.6 54.7 -65.1 -43.5 5.3 -7.7 16.4 97 113 A L T 3< S+ 0 0 13 -4,-2.1 -33,-0.4 1,-0.2 -1,-0.3 0.590 105.7 56.8 -66.3 -9.2 3.4 -5.2 14.3 98 114 A S T < S+ 0 0 0 -3,-1.2 8,-2.7 -4,-0.4 9,-1.7 0.432 93.3 87.0-103.9 0.2 3.0 -7.9 11.6 99 115 A K B < -G 105 0C 67 -3,-1.4 6,-0.2 -4,-0.3 2,-0.1 -0.613 65.7-132.6-104.7 158.3 1.3 -10.6 13.7 100 116 A G > - 0 0 6 4,-2.9 3,-1.9 -2,-0.2 -32,-0.1 -0.405 43.5 -90.8 -91.5 177.7 -2.2 -11.4 14.8 101 117 A L T 3 S+ 0 0 119 1,-0.3 -1,-0.0 -33,-0.2 -32,-0.0 0.831 126.5 62.4 -59.1 -30.6 -3.4 -12.3 18.3 102 118 A D T 3 S- 0 0 84 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.224 116.6-112.2 -83.0 13.8 -2.6 -15.9 17.4 103 119 A G S < S+ 0 0 44 -3,-1.9 2,-0.2 1,-0.2 -2,-0.1 0.421 78.0 125.2 74.4 -8.1 1.1 -15.2 16.9 104 120 A H - 0 0 72 1,-0.0 -4,-2.9 2,-0.0 2,-0.3 -0.599 64.6-112.3 -79.2 157.0 1.0 -15.9 13.2 105 121 A Y B +G 99 0C 31 -6,-0.2 -26,-2.7 -2,-0.2 -25,-0.3 -0.672 41.4 159.8 -87.6 140.4 2.2 -13.3 10.7 106 122 A Y + 0 0 12 -8,-2.7 172,-0.6 -2,-0.3 2,-0.3 0.446 56.9 59.2-133.5 -15.6 -0.4 -11.7 8.4 107 123 A L E -D 277 0A 0 -9,-1.7 170,-0.2 170,-0.1 -1,-0.1 -0.908 55.0-155.5-121.6 146.2 1.4 -8.5 7.2 108 124 A V E -D 276 0A 0 168,-2.3 168,-1.5 -2,-0.3 2,-0.1 -0.973 29.0-146.7-114.2 109.5 4.5 -7.6 5.3 109 125 A P E +D 275 0A 0 0, 0.0 166,-0.3 0, 0.0 3,-0.1 -0.388 22.2 177.2 -73.4 158.5 5.5 -4.0 6.4 110 126 A L E - 0 0 0 164,-2.5 204,-0.9 1,-0.4 2,-0.3 0.670 56.8 -13.2-127.3 -49.9 7.1 -1.6 4.0 111 127 A Y E -DE 274 313A 10 163,-1.2 163,-2.2 202,-0.2 -1,-0.4 -0.994 47.3-178.6-154.2 159.1 7.6 1.8 5.6 112 128 A N E - E 0 312A 3 200,-2.2 200,-2.9 -2,-0.3 161,-0.2 -0.827 14.1-144.7-145.4-178.8 6.7 4.1 8.5 113 129 A Y - 0 0 32 159,-0.4 2,-0.2 -2,-0.2 198,-0.1 -0.960 26.6-103.0-145.8 162.5 7.4 7.6 9.8 114 130 A P - 0 0 0 0, 0.0 123,-2.4 0, 0.0 2,-0.6 -0.586 4.2-147.6-105.2 154.1 7.8 9.1 13.3 115 131 A W E +H 236 0D 6 155,-1.1 142,-0.3 121,-0.3 155,-0.3 -0.973 51.1 135.7-105.8 109.6 5.9 11.1 15.8 116 132 A V E -H 235 0D 0 119,-1.8 119,-1.8 -2,-0.6 2,-0.7 -0.834 59.9 -80.0-149.8 173.9 8.6 13.1 17.6 117 133 A V E -HI 234 255D 0 138,-2.8 138,-2.2 -2,-0.2 117,-0.3 -0.816 43.1-153.6 -95.9 116.7 9.4 16.6 18.9 118 134 A F E +HI 233 254D 0 115,-3.4 115,-1.6 -2,-0.7 2,-0.3 -0.568 20.7 162.5 -90.4 143.8 10.6 19.0 16.1 119 135 A Y E - I 0 253D 17 134,-1.8 134,-2.5 -2,-0.2 2,-0.6 -0.966 41.2-100.5-150.6 164.8 12.8 22.1 16.7 120 136 A N E > - I 0 252D 6 111,-0.5 4,-2.1 -2,-0.3 3,-0.4 -0.818 23.7-150.2 -92.4 117.0 15.1 24.5 14.9 121 137 A K H > S+ 0 0 65 130,-3.3 4,-2.4 -2,-0.6 5,-0.2 0.915 95.8 51.4 -50.7 -49.1 18.8 23.7 15.2 122 138 A S H > S+ 0 0 35 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.818 108.8 52.6 -60.7 -34.6 20.0 27.3 14.9 123 139 A V H > S+ 0 0 19 -3,-0.4 4,-2.5 2,-0.2 5,-0.2 0.929 110.0 46.2 -67.3 -46.7 17.6 28.4 17.6 124 140 A F H X>S+ 0 0 10 -4,-2.1 5,-2.4 2,-0.2 4,-1.0 0.897 115.1 49.0 -62.0 -40.7 18.7 25.8 20.1 125 141 A Q H <5S+ 0 0 148 -4,-2.4 3,-0.3 -5,-0.2 -2,-0.2 0.960 114.7 42.6 -65.6 -48.2 22.4 26.7 19.3 126 142 A S H <5S+ 0 0 94 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.902 120.4 40.1 -67.3 -40.0 21.9 30.4 19.7 127 143 A K H <5S- 0 0 103 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.559 111.1-115.9 -87.9 -5.9 19.8 30.4 22.9 128 144 A G T <5 + 0 0 51 -4,-1.0 2,-0.4 -3,-0.3 -3,-0.2 0.885 54.7 161.4 75.7 41.9 21.7 27.6 24.5 129 145 A Y < - 0 0 12 -5,-2.4 2,-0.4 -6,-0.2 -1,-0.2 -0.765 25.1-151.7 -96.6 136.2 19.0 25.0 24.6 130 146 A E - 0 0 159 -2,-0.4 11,-0.1 7,-0.1 -5,-0.0 -0.873 28.5-100.5-106.9 140.2 20.0 21.4 25.1 131 147 A V - 0 0 76 -2,-0.4 2,-0.5 1,-0.1 7,-0.1 -0.456 44.4-128.5 -54.9 123.0 18.1 18.4 23.8 132 148 A P - 0 0 6 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 -0.671 27.9-178.0 -85.8 128.9 16.2 17.0 26.8 133 149 A A + 0 0 81 -2,-0.5 126,-2.1 125,-0.1 2,-0.3 0.710 69.7 41.7 -88.1 -27.1 16.4 13.3 27.7 134 150 A S B > S-j 259 0E 48 124,-0.2 4,-2.7 1,-0.1 126,-0.2 -0.865 82.9-114.2-122.2 160.7 14.0 13.4 30.7 135 151 A W H > S+ 0 0 27 124,-2.2 4,-3.3 -2,-0.3 5,-0.3 0.924 116.6 57.4 -55.1 -46.5 10.7 15.0 31.6 136 152 A E H > S+ 0 0 169 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.915 111.4 40.1 -51.9 -53.5 12.5 17.0 34.3 137 153 A A H > S+ 0 0 38 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.891 113.5 56.5 -62.1 -38.7 14.9 18.6 31.7 138 154 A F H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.943 111.1 42.2 -63.0 -43.4 11.9 18.9 29.2 139 155 A I H X S+ 0 0 14 -4,-3.3 4,-3.0 2,-0.2 -1,-0.2 0.937 112.7 53.6 -68.9 -42.6 9.9 21.0 31.6 140 156 A A H X S+ 0 0 58 -4,-2.4 4,-2.5 -5,-0.3 -2,-0.2 0.903 111.4 46.8 -56.6 -43.5 13.0 23.0 32.7 141 157 A L H X S+ 0 0 14 -4,-2.9 4,-2.7 2,-0.2 -1,-0.2 0.908 110.6 51.3 -66.7 -42.7 13.6 23.8 29.0 142 158 A A H X S+ 0 0 2 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.905 110.8 49.6 -60.6 -39.3 9.9 24.7 28.5 143 159 A R H X S+ 0 0 154 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.953 110.2 50.1 -66.0 -43.5 10.2 27.0 31.5 144 160 A K H X S+ 0 0 104 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.897 108.0 53.9 -61.0 -40.4 13.3 28.6 30.0 145 161 A M H <>S+ 0 0 0 -4,-2.7 5,-2.4 2,-0.2 -1,-0.2 0.950 108.2 49.9 -59.6 -44.7 11.6 29.1 26.7 146 162 A Q H ><5S+ 0 0 93 -4,-2.3 3,-2.2 1,-0.2 -2,-0.2 0.935 110.8 47.8 -59.8 -49.0 8.7 30.9 28.4 147 163 A S H 3<5S+ 0 0 84 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.932 108.6 55.9 -57.5 -39.7 11.1 33.2 30.3 148 164 A D T 3<5S- 0 0 54 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.490 123.6-110.7 -71.9 -3.3 12.9 33.8 27.0 149 165 A G T < 5S+ 0 0 69 -3,-2.2 2,-0.4 1,-0.2 -3,-0.2 0.803 75.4 129.2 78.7 34.8 9.5 34.9 25.7 150 166 A L < - 0 0 28 -5,-2.4 -1,-0.2 -8,-0.1 80,-0.2 -0.965 66.9-116.3-128.4 131.8 8.9 31.9 23.4 151 167 A V E -k 230 0F 52 78,-1.2 80,-3.1 -2,-0.4 81,-0.5 -0.531 29.2-153.4 -58.5 111.7 5.9 29.6 23.1 152 168 A P E S+ 0 0 4 0, 0.0 80,-1.7 0, 0.0 2,-0.6 0.975 77.3 25.5 -60.0 -51.0 7.5 26.3 24.2 153 169 A L E S-kl 232 209F 7 55,-2.0 57,-2.8 78,-0.2 80,-0.2 -0.910 72.0-145.9-122.0 106.0 5.2 24.0 22.2 154 170 A A - 0 0 2 78,-2.9 80,-0.5 -2,-0.6 2,-0.3 -0.465 35.2-176.2 -57.4 138.6 3.4 25.1 19.1 155 171 A F + 0 0 17 56,-0.2 2,-0.3 78,-0.1 61,-0.1 -0.997 18.7 173.8-151.4 142.0 0.2 23.2 19.4 156 172 A A + 0 0 0 -2,-0.3 58,-0.2 1,-0.1 61,-0.1 -0.999 14.6 161.8-150.9 144.2 -3.0 22.7 17.3 157 173 A D > + 0 0 0 56,-3.2 3,-1.9 59,-0.5 57,-0.2 0.311 47.7 106.9-149.4 10.8 -6.2 20.5 17.5 158 174 A K T 3 S+ 0 0 121 58,-1.9 59,-0.2 55,-1.0 56,-0.1 0.867 83.5 60.2 -56.6 -35.1 -8.9 22.0 15.2 159 175 A D T 3 S- 0 0 57 57,-0.5 2,-1.7 1,-0.1 -1,-0.3 0.587 101.3-143.6 -66.6 -13.3 -8.1 19.0 12.9 160 176 A G S < S+ 0 0 5 -3,-1.9 4,-0.4 1,-0.2 3,-0.3 -0.199 83.7 69.7 82.2 -49.8 -9.1 16.8 15.8 161 177 A W S >> S+ 0 0 58 -2,-1.7 3,-1.0 1,-0.2 4,-0.6 0.811 79.5 74.1 -74.3 -29.2 -6.5 14.0 15.2 162 178 A P T >4 S+ 0 0 4 0, 0.0 3,-1.0 0, 0.0 4,-0.5 0.835 92.3 53.4 -57.1 -36.5 -3.3 15.9 16.2 163 179 A A T >> S+ 0 0 0 -3,-0.3 4,-1.8 1,-0.2 3,-0.9 0.764 91.5 74.9 -72.3 -21.3 -3.9 15.8 20.0 164 180 A L H <> S+ 0 0 0 -3,-1.0 4,-2.6 -4,-0.4 -1,-0.2 0.834 89.5 60.7 -57.1 -33.7 -4.4 12.0 19.9 165 181 A G H S+ 0 0 5 -3,-0.9 4,-2.4 -4,-0.5 5,-0.3 0.922 110.3 49.2 -66.3 -41.7 0.0 13.6 22.8 167 183 A F H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.949 112.4 49.3 -57.0 -50.7 -2.4 11.1 24.5 168 184 A D H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.938 112.6 45.4 -53.8 -52.3 -0.5 8.2 22.9 169 185 A I H X S+ 0 0 4 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.905 112.2 50.6 -69.3 -33.8 3.0 9.4 23.8 170 186 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 5,-0.3 0.947 112.9 47.5 -66.4 -40.8 2.0 10.2 27.4 171 187 A N H X>S+ 0 0 0 -4,-2.5 4,-3.0 -5,-0.3 5,-1.4 0.938 112.8 47.6 -64.8 -48.2 0.5 6.7 27.8 172 188 A L H <5S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 5,-0.2 0.807 115.1 46.7 -59.0 -39.3 3.5 5.0 26.2 173 189 A R H <5S+ 0 0 3 -4,-2.0 88,-1.4 -5,-0.2 87,-0.4 0.799 125.1 28.5 -74.9 -30.3 5.9 6.9 28.5 174 190 A I H <5S+ 0 0 18 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.841 136.4 19.2-100.7 -42.4 3.9 6.4 31.7 175 191 A N T <5S- 0 0 22 -4,-3.0 4,-0.4 -5,-0.3 -3,-0.2 0.564 102.8-127.2-108.3 -18.8 2.1 3.1 31.4 176 192 A G >< - 0 0 1 -5,-1.4 4,-1.8 1,-0.1 -1,-0.2 -0.113 28.5 -67.7 95.1 173.8 4.0 1.4 28.6 177 193 A Y H > S+ 0 0 33 -5,-0.2 4,-2.4 2,-0.2 5,-0.2 0.888 124.4 52.4 -71.5 -49.2 3.2 -0.2 25.3 178 194 A D H > S+ 0 0 114 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.901 112.5 47.3 -57.8 -38.5 1.3 -3.3 26.5 179 195 A Y H > S+ 0 0 35 -4,-0.4 4,-3.2 2,-0.2 -1,-0.2 0.889 109.5 52.2 -69.7 -43.8 -1.1 -1.1 28.6 180 196 A H H X S+ 0 0 0 -4,-1.8 4,-3.1 2,-0.2 -2,-0.2 0.958 112.0 46.7 -57.1 -48.3 -1.7 1.4 25.7 181 197 A I H X S+ 0 0 28 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.945 111.4 51.2 -62.5 -44.4 -2.6 -1.5 23.4 182 198 A K H X>S+ 0 0 104 -4,-2.4 5,-2.9 1,-0.2 6,-0.8 0.939 110.8 49.0 -55.0 -51.8 -4.9 -3.0 26.1 183 199 A L H ><5S+ 0 0 0 -4,-3.2 3,-1.3 1,-0.2 -2,-0.2 0.947 110.5 50.9 -52.1 -50.0 -6.6 0.4 26.5 184 200 A M H 3<5S+ 0 0 1 -4,-3.1 165,-0.4 1,-0.3 -1,-0.2 0.833 113.8 43.7 -58.7 -36.5 -7.0 0.6 22.7 185 201 A K H 3<5S- 0 0 34 -4,-2.4 -1,-0.3 -3,-0.2 -2,-0.2 0.505 115.7-118.0 -84.8 -2.6 -8.6 -2.8 22.5 186 202 A H T <<5S+ 0 0 46 -3,-1.3 -3,-0.2 -4,-0.8 -2,-0.1 0.836 78.0 128.6 64.5 36.4 -10.7 -2.0 25.6 187 203 A E S - 0 0 48 0, 0.0 3,-2.4 0, 0.0 6,-0.2 -0.523 15.8-120.7 -81.7 151.8 -11.4 0.6 30.9 190 206 A W T 3 S+ 0 0 2 1,-0.3 189,-0.1 -2,-0.2 187,-0.1 0.638 113.1 63.5 -62.8 -14.4 -11.1 4.3 30.1 191 207 A T T 3 S+ 0 0 71 186,-0.1 -1,-0.3 4,-0.1 5,-0.1 0.417 75.4 124.6 -86.1 -5.6 -11.8 5.0 33.8 192 208 A D S X> S- 0 0 50 -3,-2.4 4,-1.3 1,-0.1 3,-1.3 -0.305 71.7-124.1 -55.5 141.2 -8.5 3.1 34.8 193 209 A P H 3> S+ 0 0 81 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.726 109.1 70.2 -64.1 -24.1 -6.2 5.3 36.9 194 210 A G H 3> S+ 0 0 4 2,-0.2 4,-1.3 1,-0.2 -4,-0.1 0.911 101.7 47.4 -55.1 -37.6 -3.4 4.8 34.4 195 211 A V H <> S+ 0 0 0 -3,-1.3 4,-2.1 -6,-0.2 3,-0.2 0.916 107.3 54.7 -69.9 -43.5 -5.6 7.0 32.1 196 212 A T H X S+ 0 0 42 -4,-1.3 4,-2.9 1,-0.2 -1,-0.2 0.888 106.1 53.6 -55.2 -42.5 -6.1 9.6 34.9 197 213 A K H X S+ 0 0 116 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.863 105.1 54.2 -58.5 -41.4 -2.3 9.7 35.3 198 214 A V H X S+ 0 0 0 -4,-1.3 4,-2.2 -3,-0.2 -2,-0.2 0.971 112.9 41.3 -58.6 -51.1 -2.0 10.5 31.5 199 215 A F H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.912 113.2 54.6 -66.8 -38.0 -4.4 13.5 31.8 200 216 A D H X S+ 0 0 63 -4,-2.9 4,-1.3 1,-0.2 -1,-0.2 0.925 110.1 45.9 -57.8 -48.8 -2.8 14.6 35.1 201 217 A Q H X S+ 0 0 42 -4,-2.8 4,-2.1 1,-0.2 3,-0.3 0.900 111.1 54.5 -58.8 -40.3 0.6 14.6 33.4 202 218 A W H X S+ 0 0 0 -4,-2.2 4,-3.3 1,-0.2 -2,-0.2 0.833 97.8 63.1 -65.0 -35.4 -1.0 16.5 30.5 203 219 A R H X S+ 0 0 101 -4,-2.2 4,-0.6 1,-0.2 -1,-0.2 0.921 108.0 42.9 -55.6 -43.3 -2.4 19.1 32.9 204 220 A E H >< S+ 0 0 83 -4,-1.3 3,-1.0 -3,-0.3 4,-0.3 0.939 114.9 49.1 -64.4 -51.7 1.2 20.0 33.6 205 221 A L H >< S+ 0 0 2 -4,-2.1 3,-2.4 1,-0.2 4,-0.2 0.862 100.2 66.6 -52.1 -43.3 2.3 19.8 29.9 206 222 A A H >< S+ 0 0 26 -4,-3.3 3,-1.1 1,-0.3 -1,-0.2 0.744 85.5 70.0 -57.9 -26.2 -0.6 22.0 28.9 207 223 A A T << S+ 0 0 63 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.733 106.0 41.9 -57.9 -25.9 0.9 25.0 30.7 208 224 A Y T < S+ 0 0 16 -3,-2.4 -55,-2.0 -4,-0.3 2,-0.3 0.335 94.2 99.0-108.5 4.9 3.5 25.0 28.0 209 225 A Q B < S-l 153 0F 24 -3,-1.1 -55,-0.2 -4,-0.2 4,-0.1 -0.734 85.0 -90.6 -95.9 140.3 1.4 24.4 24.9 210 226 A Q > - 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0 0 0 70,-2.9 2,-0.1 -2,-0.7 72,-0.1 -0.677 35.0-142.1-139.6 81.1 5.3 5.1 13.9 272 288 A P - 0 0 2 0, 0.0 2,-0.5 0, 0.0 -159,-0.4 -0.281 19.5-155.9 -51.9 120.2 2.3 4.3 11.6 273 289 A T - 0 0 0 -161,-0.2 -210,-2.1 67,-0.1 2,-0.3 -0.878 6.9-159.1-111.4 119.6 3.4 1.4 9.4 274 290 A D E +CD 62 111A 29 -163,-2.2 -164,-2.5 -2,-0.5 -163,-1.2 -0.756 28.5 138.2 -92.7 154.2 1.9 0.6 6.0 275 291 A G E -CD 61 109A 1 -214,-2.9 -214,-2.2 -2,-0.3 2,-0.3 -0.695 42.4 -82.6-164.5-152.9 2.2 -2.9 4.5 276 292 A F E -CD 60 108A 0 -168,-1.5 -168,-2.3 -216,-0.2 2,-0.3 -0.983 25.9-162.1-143.2 149.6 0.5 -5.7 2.6 277 293 A I E -CD 59 107A 0 -218,-2.2 -218,-2.1 -2,-0.3 -170,-0.1 -0.808 20.8-126.7-127.4 164.7 -1.8 -8.6 3.4 278 294 A L - 0 0 2 -172,-0.6 -201,-3.0 -201,-0.4 -220,-0.2 -0.860 26.8-139.2-118.5 96.1 -2.9 -11.8 1.7 279 295 A P B > -F 76 0B 1 0, 0.0 3,-1.9 0, 0.0 -203,-0.3 -0.300 8.4-138.7 -59.5 125.1 -6.7 -12.1 1.5 280 296 A K T 3 S+ 0 0 142 -205,-2.4 -204,-0.2 1,-0.3 5,-0.1 0.868 105.0 48.8 -48.6 -41.7 -7.8 -15.7 2.3 281 297 A K T 3 S+ 0 0 110 -206,-0.5 -1,-0.3 -230,-0.4 -224,-0.1 0.445 91.2 107.9 -81.7 -2.8 -10.4 -15.5 -0.5 282 298 A G < - 0 0 14 -3,-1.9 2,-0.2 -225,-0.2 3,-0.2 -0.219 68.3-121.2 -67.8 164.9 -7.8 -14.1 -2.9 283 299 A K S S+ 0 0 160 -228,-0.3 -279,-0.3 1,-0.2 -1,-0.1 -0.676 79.5 30.7-111.1 159.2 -6.6 -16.4 -5.7 284 300 A N > + 0 0 66 -2,-0.2 4,-1.8 1,-0.1 -1,-0.2 0.940 61.7 171.1 63.4 59.9 -3.1 -17.6 -6.7 285 301 A A H > S+ 0 0 41 2,-0.2 4,-2.2 -3,-0.2 5,-0.1 0.761 70.4 57.1 -70.4 -37.1 -1.6 -17.7 -3.2 286 302 A A H > S+ 0 0 65 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.934 113.6 41.3 -60.1 -46.0 1.7 -19.4 -4.0 287 303 A A H > S+ 0 0 6 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.871 111.9 56.7 -67.3 -41.8 2.5 -16.7 -6.5 288 304 A A H X S+ 0 0 0 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.893 104.7 52.1 -55.2 -44.4 1.2 -14.1 -4.1 289 305 A K H X S+ 0 0 44 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.846 103.9 56.9 -65.4 -33.7 3.7 -15.2 -1.5 290 306 A K H X S+ 0 0 106 -4,-1.2 4,-1.6 1,-0.2 -1,-0.2 0.901 108.5 47.0 -63.9 -40.8 6.6 -14.9 -3.9 291 307 A V H X S+ 0 0 0 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.881 109.4 54.3 -67.1 -36.7 5.7 -11.3 -4.5 292 308 A L H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.865 104.8 53.8 -66.9 -37.2 5.4 -10.7 -0.7 293 309 A Q H < S+ 0 0 63 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.892 109.9 47.4 -61.3 -43.3 8.9 -12.1 -0.2 294 310 A Y H >< S+ 0 0 19 -4,-1.6 3,-0.7 1,-0.2 6,-0.4 0.942 109.8 53.8 -61.4 -46.7 10.3 -9.6 -2.8 295 311 A I H 3< S+ 0 0 0 -4,-2.6 2,-1.3 1,-0.3 -2,-0.2 0.874 97.4 67.5 -55.7 -35.1 8.3 -6.9 -1.0 296 312 A G T 3< S+ 0 0 0 -4,-2.0 2,-0.3 -5,-0.1 -1,-0.3 -0.129 87.3 96.1 -80.6 44.5 10.0 -7.8 2.3 297 313 A T S <> S- 0 0 26 -2,-1.3 4,-2.0 -3,-0.7 18,-0.1 -0.920 80.8-122.1-133.6 155.1 13.4 -6.7 1.1 298 314 A A H > S+ 0 0 23 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.846 114.6 57.5 -58.7 -37.6 15.6 -3.5 1.5 299 315 A E H > S+ 0 0 123 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.922 105.9 48.2 -60.3 -44.6 15.6 -3.4 -2.3 300 316 A A H > S+ 0 0 0 -6,-0.4 4,-2.6 2,-0.2 5,-0.2 0.940 113.2 48.7 -62.4 -44.1 11.8 -3.2 -2.5 301 317 A E H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.926 111.6 46.6 -62.7 -48.7 11.7 -0.5 0.1 302 318 A A H X S+ 0 0 22 -4,-2.6 4,-0.6 1,-0.2 -1,-0.2 0.895 113.4 50.9 -62.3 -40.4 14.4 1.8 -1.4 303 319 A A H >< S+ 0 0 12 -4,-2.1 3,-1.0 -5,-0.2 4,-0.2 0.945 112.8 44.0 -63.9 -47.5 12.7 1.4 -4.8 304 320 A F H >< S+ 0 0 5 -4,-2.6 3,-0.6 1,-0.2 -2,-0.2 0.892 113.7 51.9 -65.9 -33.0 9.3 2.3 -3.5 305 321 A L H >< S+ 0 0 0 -4,-2.4 3,-2.1 1,-0.2 -1,-0.2 0.498 73.6 107.9 -86.9 2.3 10.6 5.2 -1.5 306 322 A K T << S+ 0 0 121 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.1 0.795 94.3 26.8 -44.9 -42.9 12.6 7.0 -4.2 307 323 A T T < S+ 0 0 83 -3,-0.6 2,-0.6 -4,-0.2 -1,-0.3 0.253 100.0 100.2-109.9 8.1 10.2 9.9 -4.5 308 324 A D < - 0 0 32 -3,-2.1 14,-0.0 1,-0.1 -3,-0.0 -0.881 50.2-171.5 -98.5 117.3 8.9 9.7 -0.9 309 325 A H S S+ 0 0 110 -2,-0.6 15,-0.2 14,-0.1 18,-0.2 0.488 76.2 27.3 -92.2 -1.2 10.5 12.3 1.2 310 326 A W S S+ 0 0 39 16,-0.1 -198,-0.1 -72,-0.1 -73,-0.1 0.718 94.6 83.6-127.5 -47.7 9.3 11.3 4.7 311 327 A D - 0 0 22 -198,-0.1 2,-0.3 -200,-0.1 -198,-0.2 -0.302 58.7-158.5 -59.7 148.3 8.5 7.6 5.1 312 328 A V E -E 112 0A 1 -200,-2.9 -200,-2.2 18,-0.1 -202,-0.1 -0.980 18.1-110.4-133.7 144.1 11.4 5.2 5.8 313 329 A G E -E 111 0A 6 -2,-0.3 -202,-0.2 -202,-0.2 -203,-0.1 -0.264 14.2-141.0 -66.6 159.3 11.8 1.4 5.3 314 330 A L + 0 0 23 -204,-0.9 -223,-0.5 -205,-0.1 -220,-0.1 0.540 60.7 120.7-100.8 -6.2 11.9 -1.0 8.2 315 331 A A S > S- 0 0 5 -205,-0.3 3,-1.8 -18,-0.1 -225,-0.2 -0.338 77.8 -94.2 -57.8 134.7 14.6 -3.3 6.8 316 332 A N T 3 S- 0 0 90 -227,-3.6 -1,-0.1 1,-0.3 -18,-0.1 -0.250 102.3 -1.4 -54.9 128.3 17.6 -3.5 9.1 317 333 A G T 3 S+ 0 0 75 1,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.414 87.0 151.7 75.2 0.1 20.4 -1.1 8.1 318 334 A L < + 0 0 22 -3,-1.8 2,-0.4 13,-0.1 -1,-0.2 -0.540 12.9 166.5 -73.6 117.0 18.6 0.4 5.1 319 335 A I - 0 0 84 -2,-0.5 -1,-0.0 -7,-0.1 9,-0.0 -0.915 30.8-143.5-124.0 97.1 19.7 3.9 4.4 320 336 A A > - 0 0 2 -2,-0.4 3,-1.9 1,-0.1 8,-0.1 -0.319 16.1-121.0 -66.0 144.7 18.4 4.5 0.9 321 337 A P T 3 S+ 0 0 132 0, 0.0 -1,-0.1 0, 0.0 -19,-0.0 0.658 112.6 53.8 -57.8 -18.2 20.5 6.7 -1.5 322 338 A T T 3 S+ 0 0 64 -20,-0.1 -2,-0.0 2,-0.0 2,-0.0 0.514 80.9 119.8 -97.0 -3.1 17.5 9.1 -1.7 323 339 A Y < - 0 0 12 -3,-1.9 2,-0.1 4,-0.1 -14,-0.1 -0.309 51.3-146.2 -65.2 143.3 17.0 9.7 2.0 324 340 A N > - 0 0 36 -15,-0.2 4,-2.5 1,-0.0 5,-0.1 -0.292 37.1 -92.1 -91.6-178.6 17.3 13.2 3.4 325 341 A D H > S+ 0 0 121 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.840 126.5 54.1 -67.8 -33.1 18.6 13.9 6.9 326 342 A I H > S+ 0 0 10 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.950 111.4 47.3 -64.9 -45.7 15.2 13.9 8.6 327 343 A Q H > S+ 0 0 1 -18,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.947 109.9 52.3 -59.9 -47.3 14.7 10.4 7.0 328 344 A K H X S+ 0 0 94 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.905 112.9 43.1 -58.1 -46.3 18.1 9.2 8.1 329 345 A K H X S+ 0 0 68 -4,-2.4 4,-2.7 1,-0.2 5,-0.3 0.890 109.3 59.3 -69.4 -33.2 17.5 10.2 11.7 330 346 A S H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.2 5,-0.3 0.913 105.2 49.8 -55.7 -47.2 14.0 8.7 11.5 331 347 A V H X S+ 0 0 27 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.937 112.0 47.6 -56.9 -49.5 15.5 5.3 10.6 332 348 A A H X S+ 0 0 51 -4,-1.7 4,-0.8 -5,-0.2 -2,-0.2 0.944 116.4 41.7 -60.3 -47.5 17.9 5.5 13.5 333 349 A E H < S+ 0 0 37 -4,-2.7 3,-0.3 2,-0.2 4,-0.3 0.857 116.1 46.6 -73.5 -39.0 15.3 6.5 16.1 334 350 A I H >< S+ 0 0 16 -4,-2.6 3,-1.7 -5,-0.3 -1,-0.2 0.907 108.6 58.2 -66.2 -40.0 12.4 4.2 15.0 335 351 A G H 3< S+ 0 0 41 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.735 99.5 59.5 -64.5 -20.0 14.9 1.3 14.8 336 352 A K T 3< S+ 0 0 139 -4,-0.8 2,-0.4 -3,-0.3 -1,-0.3 0.546 82.4 100.1 -87.9 -5.6 15.8 1.8 18.5 337 353 A C < - 0 0 7 -3,-1.7 -244,-0.3 -4,-0.3 -69,-0.2 -0.689 63.5-149.8 -84.4 132.5 12.2 1.2 19.7 338 354 A K S S+ 0 0 128 -71,-0.8 2,-0.3 -2,-0.4 -70,-0.1 0.758 87.9 9.9 -60.5 -39.3 11.4 -2.3 21.1 339 355 A S E -m 268 0G 20 -72,-1.2 -70,-0.8 -243,-0.1 2,-0.4 -0.989 69.4-148.8-145.9 147.4 7.8 -1.8 19.9 340 356 A V E -m 269 0G 4 -2,-0.3 -70,-0.2 -247,-0.3 2,-0.1 -0.973 9.7-150.6-122.5 126.0 6.1 0.7 17.7 341 357 A S E -m 270 0G 0 -72,-2.9 -70,-2.9 -2,-0.4 3,-0.1 -0.441 15.6-131.7 -85.3 174.7 2.4 1.8 18.0 342 358 A Q - 0 0 3 1,-0.2 -72,-0.1 -72,-0.2 4,-0.1 0.303 51.2 -87.5-116.8 14.4 0.4 2.9 15.0 343 359 A F >> - 0 0 13 1,-0.1 3,-1.8 2,-0.1 4,-1.6 0.214 48.4 -87.3 78.8 144.6 -1.3 6.2 16.2 344 360 A M H 3> S+ 0 0 0 1,-0.3 4,-1.7 2,-0.2 3,-0.2 0.858 124.0 63.6 -51.0 -39.9 -4.6 6.0 18.0 345 361 A K H 34 S+ 0 0 100 1,-0.2 -1,-0.3 2,-0.2 8,-0.1 0.714 114.8 31.6 -62.0 -20.2 -6.7 6.1 14.8 346 362 A R H <4 S+ 0 0 57 -3,-1.8 -281,-2.8 -4,-0.1 -280,-0.5 0.598 114.0 58.9-108.5 -23.2 -5.2 2.7 13.7 347 363 A D H < S+ 0 0 13 -4,-1.6 2,-0.2 -283,-0.3 -2,-0.2 0.658 114.1 28.2 -82.3 -21.5 -4.7 1.1 17.1 348 364 A T S < S- 0 0 1 -4,-1.7 -282,-0.2 -5,-0.2 -283,-0.2 -0.655 104.9 -73.6-123.3-177.7 -8.3 1.2 18.2 349 365 A V > - 0 0 27 -165,-0.4 4,-2.4 -2,-0.2 3,-0.4 -0.509 43.6-115.2 -78.2 155.4 -11.6 1.2 16.2 350 366 A P H > S+ 0 0 50 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.883 114.2 56.6 -60.2 -42.3 -12.5 4.4 14.3 351 367 A D H > S+ 0 0 109 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.908 110.8 46.0 -50.9 -42.4 -15.6 5.0 16.4 352 368 A M H > S+ 0 0 0 -3,-0.4 4,-2.7 2,-0.2 5,-0.2 0.964 113.2 46.5 -70.0 -46.9 -13.4 5.0 19.5 353 369 A A H X S+ 0 0 1 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.921 114.0 50.8 -58.6 -45.5 -10.7 7.2 18.1 354 370 A N H X S+ 0 0 87 -4,-3.2 4,-1.0 -5,-0.2 -1,-0.2 0.867 108.6 50.7 -60.2 -37.7 -13.4 9.5 16.8 355 371 A A H X S+ 0 0 15 -4,-2.2 4,-1.6 -5,-0.2 3,-0.4 0.932 108.8 52.5 -68.0 -37.2 -15.0 9.6 20.3 356 372 A M H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.794 97.9 66.7 -69.2 -24.8 -11.6 10.5 21.8 357 373 A I H X S+ 0 0 20 -4,-1.5 4,-1.5 1,-0.2 -1,-0.2 0.923 106.8 38.5 -63.8 -44.6 -11.1 13.4 19.5 358 374 A K H X S+ 0 0 116 -4,-1.0 4,-1.8 -3,-0.4 -1,-0.2 0.870 115.0 52.5 -72.5 -43.5 -14.0 15.4 20.9 359 375 A L H X S+ 0 0 15 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.860 109.3 50.8 -61.9 -34.2 -13.3 14.4 24.5 360 376 A I H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.892 106.2 54.2 -72.2 -32.9 -9.7 15.5 24.1 361 377 A Q H X S+ 0 0 34 -4,-1.5 4,-1.9 -5,-0.2 -2,-0.2 0.907 108.5 51.8 -64.9 -32.9 -10.8 18.9 22.7 362 378 A Q H X S+ 0 0 87 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.926 109.1 47.4 -72.2 -41.4 -12.9 19.2 25.9 363 379 A F H < S+ 0 0 0 -4,-2.1 3,-0.3 1,-0.2 -2,-0.2 0.954 110.3 53.6 -62.9 -45.1 -9.9 18.4 28.2 364 380 A I H < S+ 0 0 32 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.860 107.4 51.7 -57.4 -36.9 -7.9 20.9 26.2 365 381 A D H < S+ 0 0 112 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.859 132.3 11.3 -66.1 -41.3 -10.6 23.6 26.8 366 382 A Q < - 0 0 125 -4,-1.9 2,-2.8 -3,-0.3 -1,-0.3 -0.619 69.9-169.8-139.9 79.5 -10.6 22.9 30.6 367 383 A P + 0 0 46 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.298 43.5 128.6 -71.0 71.3 -7.7 20.8 31.7 368 384 A T S > S- 0 0 49 -2,-2.8 4,-2.3 -5,-0.1 5,-0.1 -0.737 73.6-106.3-123.6 165.8 -9.0 20.3 35.2 369 385 A P H > S+ 0 0 78 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.884 119.9 52.3 -59.8 -39.6 -9.7 17.3 37.5 370 386 A E H > S+ 0 0 135 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.904 108.8 49.3 -65.7 -37.9 -13.4 17.6 37.0 371 387 A T H > S+ 0 0 11 -5,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.915 109.1 53.9 -67.7 -36.9 -13.1 17.6 33.2 372 388 A I H X S+ 0 0 4 -4,-2.3 4,-3.3 1,-0.2 5,-0.3 0.940 106.6 50.6 -60.7 -45.2 -10.8 14.5 33.5 373 389 A A H X S+ 0 0 49 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.887 113.8 46.1 -58.8 -41.5 -13.5 12.7 35.5 374 390 A T H X S+ 0 0 52 -4,-1.9 4,-2.9 2,-0.2 -1,-0.2 0.882 112.9 49.1 -66.9 -46.3 -16.0 13.6 32.8 375 391 A V H X S+ 0 0 0 -4,-3.0 4,-3.0 2,-0.2 5,-0.2 0.952 112.0 47.7 -60.4 -49.6 -13.8 12.6 29.9 376 392 A Q H X S+ 0 0 13 -4,-3.3 4,-2.6 1,-0.2 -2,-0.2 0.925 114.9 46.2 -58.9 -46.6 -12.9 9.2 31.5 377 393 A K H X S+ 0 0 122 -4,-2.0 4,-2.6 -5,-0.3 5,-0.2 0.937 114.3 46.8 -61.3 -48.6 -16.5 8.5 32.1 378 394 A S H X S+ 0 0 42 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.915 113.4 49.7 -60.7 -41.8 -17.7 9.6 28.7 379 395 A A H X S+ 0 0 0 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.933 112.1 47.0 -65.0 -45.4 -14.9 7.6 27.0 380 396 A E H X S+ 0 0 10 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.912 111.2 50.7 -65.2 -42.4 -15.7 4.4 28.9 381 397 A D H X S+ 0 0 80 -4,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.898 112.3 48.4 -59.2 -43.3 -19.4 4.7 28.2 382 398 A Q H X S+ 0 0 89 -4,-2.2 4,-2.0 -5,-0.2 3,-0.5 0.951 111.0 50.3 -59.4 -50.6 -18.6 5.1 24.5 383 399 A A H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 -2,-0.2 0.791 103.3 60.5 -57.1 -36.8 -16.3 2.1 24.6 384 400 A K H < S+ 0 0 117 -4,-1.9 -1,-0.2 1,-0.2 4,-0.2 0.895 112.6 37.0 -60.8 -38.6 -18.9 -0.0 26.2 385 401 A T H < S+ 0 0 79 -4,-1.3 3,-0.2 -3,-0.5 -2,-0.2 0.778 118.5 51.0 -83.9 -27.7 -21.3 0.4 23.3 386 402 A I H < S+ 0 0 36 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.922 116.3 37.5 -79.0 -39.9 -18.5 0.3 20.7 387 403 A F < 0 0 42 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.321 360.0 360.0 -95.8 12.9 -16.8 -2.9 21.9 388 404 A R 0 0 261 -3,-0.2 -1,-0.2 -4,-0.2 -2,-0.1 0.962 360.0 360.0 -61.6 360.0 -20.0 -4.8 22.8