==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER NUCLEOTIDE BINDING PROTEIN 03-DEC-09 3KXI . COMPND 2 MOLECULE: GTP-BINDING PROTEIN (HFLX); . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS; . AUTHOR B.HUANG,X.LI,X.C.ZHANG,Z.RAO . 326 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17760.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 239 73.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 43 13.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 2.8 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 . 1 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 . 28 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 131 40.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 1 2 2 0 1 0 0 2 0 1 0 0 0 1 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 3 1 2 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 . 1 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 M 0 0 185 0, 0.0 25,-0.2 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 -13.5 2.8 1.1 -14.7 2 2 A K - 0 0 88 22,-0.3 24,-3.3 23,-0.1 2,-0.3 -0.008 360.0-123.1 -43.0 142.4 2.1 -2.6 -15.4 3 3 A T E -a 26 0A 33 22,-0.2 56,-1.7 24,-0.1 55,-0.9 -0.720 30.5-164.5 -94.2 145.9 -0.1 -4.4 -12.9 4 4 A A E -ab 27 59A 0 22,-2.6 24,-1.5 -2,-0.3 25,-1.2 -0.958 23.5-140.9-135.6 146.6 1.1 -7.5 -11.2 5 5 A A E -ab 29 60A 0 54,-2.2 56,-2.7 -2,-0.3 2,-0.5 -0.938 29.4-152.2-102.8 115.5 -0.1 -10.5 -9.2 6 6 A L E -ab 30 61A 0 23,-3.0 25,-2.6 -2,-0.6 2,-0.5 -0.766 12.7-169.4 -96.2 127.3 2.4 -11.2 -6.5 7 7 A F E +ab 31 62A 5 54,-2.5 56,-3.0 -2,-0.5 2,-0.3 -0.969 30.7 137.6-111.9 120.4 2.9 -14.7 -5.0 8 8 A V E -a 32 0A 0 23,-2.5 25,-1.3 -2,-0.5 2,-0.2 -0.978 51.1-101.5-157.2 159.8 5.1 -14.7 -1.9 9 9 A S - 0 0 34 54,-0.3 3,-0.5 -2,-0.3 4,-0.1 -0.504 36.6-115.0 -80.4 158.0 5.6 -16.1 1.6 10 10 A K S > S+ 0 0 126 1,-0.2 3,-1.6 2,-0.2 4,-0.5 0.907 115.9 63.5 -56.3 -41.3 4.6 -14.0 4.6 11 11 A E T 3 S+ 0 0 157 1,-0.3 -1,-0.2 2,-0.1 3,-0.1 0.858 116.7 25.4 -52.6 -42.0 8.3 -14.1 5.5 12 12 A F T 3> S+ 0 0 82 -3,-0.5 4,-2.4 1,-0.1 -1,-0.3 0.037 90.8 109.4-113.6 27.0 9.3 -12.2 2.4 13 13 A E H <> S+ 0 0 40 -3,-1.6 4,-2.2 2,-0.2 5,-0.2 0.937 83.0 40.4 -71.7 -47.8 6.0 -10.3 1.7 14 14 A E H > S+ 0 0 117 -4,-0.5 4,-1.4 1,-0.2 -1,-0.2 0.775 115.7 56.6 -72.2 -22.1 7.1 -6.8 2.5 15 15 A E H > S+ 0 0 25 2,-0.2 4,-1.8 1,-0.1 -2,-0.2 0.947 108.6 43.9 -67.2 -51.4 10.4 -7.6 0.8 16 16 A A H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.880 109.5 55.8 -64.1 -42.4 8.7 -8.6 -2.5 17 17 A I H X S+ 0 0 41 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.925 109.1 47.0 -57.3 -47.1 6.3 -5.6 -2.5 18 18 A A H X S+ 0 0 29 -4,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.899 115.7 45.9 -61.8 -41.8 9.2 -3.2 -2.2 19 19 A L H X S+ 0 0 6 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.874 111.0 51.5 -70.1 -39.4 11.1 -5.0 -5.0 20 20 A V H <>S+ 0 0 0 -4,-3.1 5,-1.7 2,-0.2 -2,-0.2 0.893 112.3 45.5 -67.1 -40.4 8.1 -5.3 -7.3 21 21 A E H ><5S+ 0 0 112 -4,-2.3 3,-1.8 -5,-0.2 -1,-0.2 0.832 106.3 61.0 -72.1 -31.2 7.3 -1.6 -7.0 22 22 A G H 3<5S+ 0 0 25 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.906 101.8 53.9 -53.3 -41.8 11.1 -1.1 -7.6 23 23 A A T 3<5S- 0 0 1 -4,-1.6 -1,-0.3 2,-0.1 -2,-0.2 0.137 125.0-105.9 -83.7 19.9 10.4 -2.8 -10.9 24 24 A N T < 5S+ 0 0 76 -3,-1.8 2,-0.4 1,-0.2 -22,-0.3 0.851 74.3 140.1 59.0 38.2 7.7 -0.3 -11.7 25 25 A Y < - 0 0 7 -5,-1.7 2,-0.8 -24,-0.1 -22,-0.2 -0.921 51.2-136.3-109.9 139.2 4.8 -2.7 -11.1 26 26 A K E -a 3 0A 125 -24,-3.3 -22,-2.6 -2,-0.4 2,-1.2 -0.854 20.7-139.8 -88.7 110.8 1.6 -1.9 -9.5 27 27 A V E +a 4 0A 17 -2,-0.8 -22,-0.1 -24,-0.2 3,-0.1 -0.602 32.0 167.5 -75.1 99.0 0.8 -4.8 -7.1 28 28 A T E + 0 0 57 -24,-1.5 2,-0.3 -2,-1.2 -1,-0.2 0.694 65.8 15.0 -86.8 -20.6 -2.9 -5.2 -7.5 29 29 A S E -a 5 0A 23 -25,-1.2 -23,-3.0 -3,-0.1 2,-0.3 -0.976 60.8-159.3-157.7 140.3 -3.1 -8.5 -5.7 30 30 A I E -a 6 0A 58 -2,-0.3 2,-0.4 -25,-0.2 -23,-0.2 -0.910 7.9-170.5-119.5 148.0 -0.9 -10.6 -3.4 31 31 A Y E -a 7 0A 55 -25,-2.6 -23,-2.5 -2,-0.3 2,-0.3 -0.998 23.1-122.7-139.4 134.0 -1.2 -14.4 -2.7 32 32 A K E -a 8 0A 144 -2,-0.4 -23,-0.2 -25,-0.2 -25,-0.0 -0.559 34.6-110.3 -74.7 135.3 0.6 -16.5 -0.0 33 33 A L - 0 0 30 -25,-1.3 -23,-0.2 -2,-0.3 -1,-0.1 -0.297 23.6-127.0 -62.9 153.2 2.7 -19.4 -1.3 34 34 A P - 0 0 42 0, 0.0 2,-2.2 0, 0.0 -1,-0.1 0.221 27.8-123.7 -95.5 13.6 1.2 -22.8 -0.5 35 35 A K S S+ 0 0 199 1,-0.0 -2,-0.1 0, 0.0 -26,-0.0 -0.425 101.4 57.4 77.8 -65.9 4.2 -24.4 1.2 36 36 A S S S- 0 0 99 -2,-2.2 2,-0.1 -3,-0.0 3,-0.1 -0.877 90.6-138.3 -97.6 106.0 4.2 -27.3 -1.2 37 37 A P - 0 0 53 0, 0.0 6,-0.2 0, 0.0 5,-0.1 -0.395 27.5 -97.0 -64.8 135.7 4.5 -25.9 -4.8 38 38 A N B > -D 42 0B 46 4,-3.1 4,-1.6 1,-0.1 5,-0.0 -0.221 27.8-131.6 -46.6 134.3 2.4 -27.4 -7.6 39 39 A V T 4 S+ 0 0 105 2,-0.2 -1,-0.1 1,-0.1 4,-0.0 0.731 103.1 26.5 -67.7 -21.6 4.4 -30.0 -9.5 40 40 A K T 4 S+ 0 0 108 3,-0.2 34,-0.3 33,-0.0 33,-0.3 0.830 139.2 18.3-105.2 -50.8 3.3 -28.4 -12.8 41 41 A F T 4 S- 0 0 10 2,-0.3 2,-4.0 32,-0.1 -2,-0.2 0.244 82.6-141.1-110.5 11.1 2.5 -24.7 -12.1 42 42 A Y B < S+D 38 0B 29 -4,-1.6 -4,-3.1 -5,-0.1 -1,-0.1 -0.226 83.1 60.1 57.8 -60.3 4.3 -24.2 -8.8 43 43 A I S S- 0 0 0 -2,-4.0 -2,-0.3 -6,-0.2 2,-0.2 -0.110 109.5 -62.1 -81.1-173.0 1.5 -22.0 -7.6 44 44 A Q > - 0 0 77 1,-0.1 4,-2.8 -7,-0.1 5,-0.2 -0.495 35.8-140.3 -77.4 139.4 -2.2 -22.9 -7.2 45 45 A Y H > S+ 0 0 120 2,-0.2 4,-2.3 -2,-0.2 5,-0.1 0.952 103.8 44.4 -62.7 -51.9 -4.2 -24.0 -10.3 46 46 A D H > S+ 0 0 89 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.934 116.5 47.0 -58.6 -45.9 -7.3 -22.2 -9.3 47 47 A K H > S+ 0 0 65 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.879 111.4 51.7 -65.5 -37.5 -5.3 -19.1 -8.3 48 48 A L H X S+ 0 0 0 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.856 109.0 52.6 -63.2 -36.9 -3.4 -19.3 -11.6 49 49 A Q H X S+ 0 0 26 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.939 103.6 53.2 -66.1 -50.1 -6.7 -19.5 -13.5 50 50 A Q H X S+ 0 0 113 -4,-2.3 4,-0.9 1,-0.3 -1,-0.2 0.875 112.8 47.5 -53.2 -37.6 -8.2 -16.4 -11.9 51 51 A I H < S+ 0 0 0 -4,-1.4 3,-0.3 2,-0.2 -1,-0.3 0.863 105.8 57.5 -71.3 -38.6 -5.0 -14.7 -13.1 52 52 A K H < S+ 0 0 68 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.833 118.2 33.6 -57.1 -31.6 -5.2 -16.2 -16.5 53 53 A N H < S+ 0 0 110 -4,-1.8 2,-1.2 -5,-0.1 -1,-0.2 0.480 89.2 102.3-110.0 -4.9 -8.6 -14.6 -16.8 54 54 A D >< - 0 0 53 -4,-0.9 3,-2.0 -3,-0.3 -1,-0.1 -0.696 51.2-166.7 -84.7 96.6 -8.2 -11.3 -14.9 55 55 A E T 3 S+ 0 0 189 -2,-1.2 -1,-0.2 1,-0.3 -4,-0.1 0.641 82.8 73.0 -58.6 -14.6 -7.8 -8.7 -17.7 56 56 A E T 3 S+ 0 0 138 1,-0.1 2,-0.5 -3,-0.0 -1,-0.3 0.328 86.3 79.7 -79.5 7.1 -6.6 -6.3 -14.9 57 57 A I < + 0 0 3 -3,-2.0 -53,-0.1 -6,-0.2 3,-0.1 -0.939 43.3 168.4-127.0 114.4 -3.3 -8.3 -14.7 58 58 A S S S+ 0 0 46 -55,-0.9 24,-1.6 -2,-0.5 2,-0.4 0.772 71.6 32.0 -86.9 -29.9 -0.5 -7.9 -17.2 59 59 A T E -bc 4 82A 5 -56,-1.7 -54,-2.2 22,-0.2 2,-0.6 -0.986 58.8-149.9-139.9 138.3 2.1 -9.8 -15.2 60 60 A L E -bc 5 83A 0 22,-3.2 24,-3.0 -2,-0.4 2,-0.5 -0.940 22.0-170.0-105.5 119.3 2.4 -12.8 -12.8 61 61 A I E -bc 6 84A 0 -56,-2.7 -54,-2.5 -2,-0.6 2,-0.6 -0.937 8.1-170.8-116.2 126.1 5.2 -12.5 -10.3 62 62 A I E -b 7 0A 0 22,-3.2 2,-2.7 -2,-0.5 24,-0.5 -0.946 18.7-145.2-117.2 111.9 6.4 -15.3 -8.1 63 63 A F S S+ 0 0 12 -56,-3.0 -54,-0.3 -2,-0.6 2,-0.3 -0.313 75.1 71.5 -77.4 61.4 8.9 -14.4 -5.4 64 64 A E S S- 0 0 81 -2,-2.7 22,-3.3 -56,-0.1 2,-0.8 -0.910 93.0 -88.6-154.5 177.1 10.7 -17.8 -5.6 65 65 A Q - 0 0 90 -2,-0.3 2,-0.2 20,-0.2 -2,-0.1 -0.838 41.2-159.7-101.8 104.6 13.0 -19.6 -8.1 66 66 A L - 0 0 4 -2,-0.8 21,-0.1 -4,-0.2 19,-0.1 -0.491 13.3-127.5 -78.7 148.0 11.0 -21.6 -10.6 67 67 A K >> - 0 0 105 -2,-0.2 3,-1.6 1,-0.1 4,-1.4 -0.599 33.9 -95.8 -91.3 160.5 12.6 -24.4 -12.6 68 68 A P H 3> S+ 0 0 35 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.826 123.1 55.1 -41.3 -49.2 12.4 -24.6 -16.4 69 69 A R H 3> S+ 0 0 80 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.817 105.1 54.1 -61.1 -32.5 9.4 -26.9 -16.4 70 70 A H H <> S+ 0 0 4 -3,-1.6 4,-3.1 2,-0.2 5,-0.3 0.956 109.8 46.0 -63.4 -51.8 7.4 -24.4 -14.3 71 71 A F H X S+ 0 0 1 -4,-1.4 4,-2.6 1,-0.2 5,-0.3 0.932 111.2 53.8 -55.1 -48.8 8.1 -21.6 -16.8 72 72 A I H X S+ 0 0 54 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.920 115.9 38.1 -51.7 -50.8 7.2 -23.8 -19.7 73 73 A N H X S+ 0 0 28 -4,-2.1 4,-2.3 -33,-0.3 5,-0.2 0.945 115.8 49.1 -70.2 -51.0 3.8 -24.7 -18.2 74 74 A I H X S+ 0 0 0 -4,-3.1 4,-0.8 -34,-0.3 -1,-0.2 0.863 110.6 53.9 -58.2 -36.3 2.9 -21.4 -16.7 75 75 A R H < S+ 0 0 86 -4,-2.6 3,-0.4 -5,-0.3 -1,-0.2 0.905 106.8 51.3 -65.5 -41.1 3.7 -19.7 -20.0 76 76 A R H >< S+ 0 0 108 -4,-1.5 3,-0.5 -5,-0.3 -2,-0.2 0.963 112.0 45.3 -57.7 -54.2 1.4 -22.1 -21.8 77 77 A E H 3< S+ 0 0 42 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.600 114.3 52.7 -69.8 -11.3 -1.5 -21.4 -19.5 78 78 A L T 3< S- 0 0 5 -4,-0.8 2,-0.4 -3,-0.4 -1,-0.3 -0.520 74.0-175.1-123.9 64.2 -0.8 -17.7 -19.7 79 79 A K S < S+ 0 0 181 -3,-0.5 2,-0.2 1,-0.2 3,-0.1 -0.455 77.5 1.5 -61.3 114.3 -0.7 -16.8 -23.4 80 80 A G S S+ 0 0 87 -2,-0.4 2,-0.2 1,-0.3 -1,-0.2 -0.281 107.4 100.0 104.6 -48.2 0.3 -13.2 -23.6 81 81 A K S S- 0 0 41 -2,-0.2 -1,-0.3 -6,-0.1 2,-0.3 -0.535 71.3-127.3 -75.2 137.2 0.7 -12.4 -19.9 82 82 A E E -c 59 0A 98 -24,-1.6 -22,-3.2 -2,-0.2 2,-0.5 -0.604 14.5-150.7 -89.0 145.4 4.3 -12.4 -18.7 83 83 A V E -c 60 0A 2 -2,-0.3 2,-0.5 -24,-0.2 -22,-0.2 -0.966 10.0-170.1-117.1 126.4 5.5 -14.5 -15.7 84 84 A L E -c 61 0A 2 -24,-3.0 -22,-3.2 -2,-0.5 2,-0.2 -0.945 1.5-168.8-111.3 131.1 8.5 -13.4 -13.5 85 85 A D > - 0 0 0 -2,-0.5 4,-2.3 -24,-0.2 -20,-0.2 -0.451 50.6 -80.5 -97.7-173.9 10.1 -15.5 -10.9 86 86 A K H > S+ 0 0 36 -22,-3.3 4,-2.4 -24,-0.5 5,-0.3 0.914 129.0 50.2 -55.3 -47.0 12.6 -14.1 -8.4 87 87 A I H > S+ 0 0 0 -23,-0.3 4,-2.6 1,-0.2 5,-0.2 0.966 113.0 43.8 -56.8 -58.0 15.5 -14.2 -10.8 88 88 A L H > S+ 0 0 22 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.847 112.0 56.4 -59.0 -34.8 13.7 -12.4 -13.7 89 89 A L H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 3,-0.2 0.963 109.7 42.3 -60.6 -55.8 12.3 -9.9 -11.2 90 90 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.916 112.2 56.0 -57.6 -43.3 15.6 -8.8 -9.8 91 91 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 -5,-0.3 -1,-0.2 0.862 105.5 51.3 -58.5 -37.0 17.1 -8.7 -13.3 92 92 A E H X S+ 0 0 32 -4,-1.9 4,-1.7 -3,-0.2 -1,-0.3 0.870 109.7 51.0 -67.6 -36.1 14.3 -6.3 -14.3 93 93 A I H X S+ 0 0 6 -4,-1.7 4,-0.9 2,-0.2 -2,-0.2 0.933 108.9 49.6 -63.7 -47.7 15.2 -4.1 -11.4 94 94 A F H >X S+ 0 0 0 -4,-2.7 4,-3.2 1,-0.2 3,-1.2 0.918 107.9 55.2 -60.1 -43.1 18.9 -4.1 -12.3 95 95 A A H 3< S+ 0 0 38 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.887 103.9 54.5 -56.3 -43.0 17.9 -3.1 -15.9 96 96 A L H 3< S+ 0 0 55 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.712 120.0 32.4 -61.5 -22.9 16.0 -0.1 -14.6 97 97 A H H << S+ 0 0 42 -3,-1.2 2,-0.3 -4,-0.9 -2,-0.2 0.730 89.9 104.3-108.3 -30.9 19.1 1.1 -12.7 98 98 A A < + 0 0 8 -4,-3.2 124,-0.1 -5,-0.2 125,-0.1 -0.375 30.0 163.9 -63.6 119.2 22.0 0.0 -14.9 99 99 A G + 0 0 58 -2,-0.3 2,-0.3 123,-0.2 -1,-0.2 0.698 52.0 86.0-101.9 -29.0 23.5 2.9 -16.8 100 100 A S S > S- 0 0 38 1,-0.1 4,-2.9 121,-0.1 3,-0.2 -0.546 74.5-136.5 -81.4 134.7 26.8 1.3 -17.8 101 101 A K H > S+ 0 0 118 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.891 108.8 56.5 -48.4 -42.3 27.2 -0.8 -20.9 102 102 A E H > S+ 0 0 43 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.915 109.4 43.8 -60.0 -43.4 29.2 -3.3 -18.7 103 103 A A H > S+ 0 0 0 -3,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.901 113.3 52.2 -67.6 -40.6 26.3 -3.6 -16.2 104 104 A K H X S+ 0 0 111 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.872 108.9 50.6 -61.5 -39.6 23.8 -3.9 -19.1 105 105 A M H X S+ 0 0 21 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.830 106.8 54.1 -68.4 -34.9 25.9 -6.7 -20.6 106 106 A Q H X S+ 0 0 27 -4,-1.7 4,-1.7 -5,-0.2 112,-0.3 0.839 110.4 47.5 -66.3 -33.1 26.0 -8.5 -17.3 107 107 A I H X S+ 0 0 4 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.917 112.1 47.5 -75.9 -43.4 22.2 -8.4 -17.2 108 108 A E H X S+ 0 0 70 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.958 111.1 52.7 -60.5 -51.4 21.8 -9.6 -20.8 109 109 A L H X S+ 0 0 16 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.902 111.2 45.9 -46.9 -51.1 24.3 -12.4 -20.2 110 110 A A H X S+ 0 0 12 -4,-1.7 4,-1.2 2,-0.2 -1,-0.2 0.868 111.4 51.3 -66.5 -38.5 22.4 -13.7 -17.1 111 111 A R H X S+ 0 0 91 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.907 112.0 47.6 -63.8 -42.0 19.0 -13.4 -18.8 112 112 A L H X S+ 0 0 22 -4,-2.6 4,-3.3 1,-0.2 3,-0.4 0.947 111.9 49.0 -63.6 -49.0 20.3 -15.5 -21.7 113 113 A K H < S+ 0 0 105 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.717 111.5 51.2 -63.6 -21.0 21.9 -18.0 -19.4 114 114 A Y H X S+ 0 0 23 -4,-1.2 4,-0.6 -5,-0.2 -1,-0.2 0.755 114.7 41.3 -88.6 -26.3 18.5 -18.2 -17.6 115 115 A E H X S+ 0 0 38 -4,-1.7 4,-2.6 -3,-0.4 5,-0.4 0.855 99.5 74.9 -83.1 -39.7 16.5 -18.8 -20.7 116 116 A L H X S+ 0 0 26 -4,-3.3 4,-2.6 1,-0.3 -2,-0.2 0.843 100.2 42.3 -39.9 -51.3 19.1 -21.2 -22.2 117 117 A P H > S+ 0 0 55 0, 0.0 4,-2.5 0, 0.0 -1,-0.3 0.892 112.0 53.7 -67.1 -42.8 18.0 -24.0 -19.8 118 118 A I H X S+ 0 0 10 -4,-0.6 4,-0.8 -3,-0.3 -2,-0.2 0.843 116.7 39.4 -58.1 -38.2 14.3 -23.3 -20.2 119 119 A I H < S+ 0 0 26 -4,-2.6 -1,-0.2 2,-0.2 -3,-0.2 0.841 111.6 57.0 -81.5 -36.8 14.7 -23.5 -23.9 120 120 A K H < S+ 0 0 114 -4,-2.6 -2,-0.2 -5,-0.4 -1,-0.1 0.872 95.2 65.5 -62.1 -38.4 17.1 -26.5 -23.8 121 121 A E H < 0 0 111 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.953 360.0 360.0 -49.8 -54.2 14.6 -28.5 -21.8 122 122 A T < 0 0 118 -4,-0.8 -2,-0.3 -5,-0.1 -1,-0.2 0.944 360.0 360.0 -62.1 360.0 12.5 -28.4 -25.0 123 ! 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 0.0 124 142 A V > 0 0 102 0, 0.0 4,-2.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -46.4 14.6 -24.4 -31.6 125 143 A E H > + 0 0 142 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.930 360.0 54.4 -59.2 -46.8 18.1 -25.8 -32.3 126 144 A S H > S+ 0 0 87 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.865 109.1 48.2 -56.4 -36.8 18.6 -22.6 -34.3 127 145 A T H > S+ 0 0 57 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.929 111.7 48.5 -68.7 -47.3 17.6 -20.7 -31.2 128 146 A I H X S+ 0 0 24 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.962 110.9 50.2 -53.4 -55.6 19.9 -22.7 -29.0 129 147 A K H X S+ 0 0 108 -4,-3.4 4,-2.3 1,-0.2 -1,-0.2 0.873 112.1 49.9 -50.8 -40.8 22.8 -22.2 -31.4 130 148 A F H X S+ 0 0 102 -4,-1.6 4,-2.5 -5,-0.3 5,-0.2 0.950 108.7 49.6 -66.1 -51.4 22.0 -18.5 -31.3 131 149 A Y H X S+ 0 0 42 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.901 111.6 50.6 -52.4 -45.2 21.9 -18.2 -27.6 132 150 A K H X S+ 0 0 105 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.947 111.1 47.6 -58.3 -50.5 25.2 -20.0 -27.4 133 151 A R H X S+ 0 0 162 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.856 114.7 46.8 -60.1 -36.9 26.7 -17.6 -29.9 134 152 A R H X S+ 0 0 107 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.886 109.5 52.8 -75.2 -40.4 25.3 -14.6 -28.1 135 153 A I H X S+ 0 0 12 -4,-2.8 4,-2.2 -5,-0.2 -2,-0.2 0.917 111.9 47.0 -58.7 -44.6 26.5 -15.8 -24.7 136 154 A N H X S+ 0 0 95 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.907 111.5 50.1 -64.1 -44.7 30.0 -16.2 -26.0 137 155 A K H X S+ 0 0 130 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.928 111.1 49.4 -61.3 -45.0 30.0 -12.8 -27.7 138 156 A L H X S+ 0 0 6 -4,-2.7 4,-3.0 1,-0.2 5,-0.2 0.913 110.5 50.1 -61.2 -43.3 28.8 -11.1 -24.5 139 157 A M H X S+ 0 0 89 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.909 111.3 48.5 -62.9 -40.6 31.5 -12.9 -22.4 140 158 A K H X S+ 0 0 161 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.899 112.1 49.9 -65.4 -40.5 34.2 -11.8 -24.9 141 159 A E H X S+ 0 0 60 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.935 114.4 43.4 -60.4 -49.9 32.8 -8.2 -24.7 142 160 A L H X S+ 0 0 16 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.897 111.9 55.5 -62.3 -40.9 32.9 -8.3 -20.9 143 161 A E H X S+ 0 0 93 -4,-3.0 4,-1.7 -5,-0.2 -2,-0.2 0.882 108.6 46.6 -59.1 -40.7 36.3 -9.9 -21.0 144 162 A S H X S+ 0 0 62 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.821 109.1 54.3 -76.0 -30.7 37.7 -7.1 -23.2 145 163 A I H X S+ 0 0 32 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.931 107.3 51.7 -62.2 -46.9 36.1 -4.4 -20.9 146 164 A K H X S+ 0 0 113 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.899 112.0 46.2 -54.1 -45.5 37.9 -6.0 -18.0 147 165 A I H X S+ 0 0 86 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.939 109.2 54.4 -64.5 -48.2 41.2 -5.9 -19.9 148 166 A F H < S+ 0 0 139 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.901 106.6 54.1 -49.4 -45.3 40.6 -2.3 -20.9 149 167 A K H >< S+ 0 0 94 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.882 108.9 44.6 -61.2 -45.8 40.1 -1.3 -17.2 150 168 A E H 3< S+ 0 0 147 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.827 114.7 50.4 -68.8 -31.2 43.4 -2.7 -16.0 151 169 A K T 3< S+ 0 0 187 -4,-2.0 2,-0.3 -5,-0.2 -1,-0.2 0.308 108.6 65.9 -90.9 8.4 45.2 -1.2 -18.9 152 170 A S S < S- 0 0 44 -3,-1.0 2,-0.2 -5,-0.1 0, 0.0 -0.833 80.7-112.9-127.2 167.4 43.6 2.2 -18.3 153 171 A I - 0 0 152 -2,-0.3 2,-1.8 1,-0.1 3,-0.2 -0.585 45.4 -83.8 -99.6 159.2 43.7 4.9 -15.6 154 172 A E + 0 0 171 -2,-0.2 -1,-0.1 1,-0.2 -5,-0.0 -0.428 53.0 172.5 -62.5 85.7 41.0 6.0 -13.2 155 173 A S + 0 0 105 -2,-1.8 -1,-0.2 2,-0.0 -2,-0.0 0.984 3.5 167.4 -60.3 -64.0 39.3 8.5 -15.5 156 174 A N - 0 0 89 -3,-0.2 -2,-0.1 1,-0.0 -1,-0.0 0.927 31.1-139.6 46.2 69.7 36.2 9.3 -13.4 157 175 A K - 0 0 200 1,-0.1 2,-0.1 0, 0.0 -1,-0.0 0.053 15.6-113.5 -50.2 164.4 34.9 12.3 -15.2 158 176 A R - 0 0 230 4,-0.0 2,-0.4 2,-0.0 -1,-0.1 -0.286 22.3-131.3 -91.9-178.1 33.5 15.2 -13.2 159 177 A N - 0 0 83 1,-0.1 4,-0.0 -2,-0.1 0, 0.0 -1.000 12.5-136.7-139.7 139.8 29.9 16.5 -13.0 160 178 A N S S+ 0 0 164 -2,-0.4 -1,-0.1 1,-0.1 -2,-0.0 0.953 100.2 33.0 -52.5 -49.7 28.4 20.0 -13.3 161 179 A I S S- 0 0 37 -3,-0.1 38,-0.1 36,-0.0 -1,-0.1 -0.880 96.1-106.9-114.2 137.3 26.3 19.2 -10.3 162 180 A P - 0 0 22 0, 0.0 38,-2.4 0, 0.0 2,-0.5 -0.409 34.3-147.3 -57.6 131.5 27.2 17.0 -7.3 163 181 A S E -e 200 0C 7 36,-0.2 67,-2.5 65,-0.1 68,-1.4 -0.929 10.0-164.3-109.3 127.8 25.3 13.8 -7.5 164 182 A I E -ef 201 231C 0 36,-2.9 38,-1.7 -2,-0.5 2,-0.4 -0.924 9.6-149.9-114.4 110.5 24.2 12.1 -4.3 165 183 A G E -ef 202 232C 0 66,-1.9 68,-2.2 -2,-0.6 2,-0.7 -0.623 7.7-139.6 -84.0 132.5 23.2 8.4 -4.5 166 184 A I E +ef 203 233C 0 36,-3.0 38,-1.6 -2,-0.4 2,-0.2 -0.825 31.8 174.1 -93.5 118.4 20.6 7.0 -2.1 167 185 A V E + f 0 234C 1 66,-2.6 68,-3.1 -2,-0.7 2,-0.2 -0.737 14.3 107.7-123.4 168.1 21.6 3.6 -1.0 168 186 A G - 0 0 0 37,-0.3 39,-1.6 -2,-0.2 68,-0.1 -0.709 63.9 -52.8 142.1 163.3 20.3 1.0 1.5 169 187 A Y B > -j 207 0D 26 66,-0.5 3,-1.7 37,-0.3 5,-0.5 -0.149 68.8 -83.3 -64.5 161.3 18.5 -2.3 1.8 170 188 A T T 3 S+ 0 0 8 37,-1.3 -1,-0.1 1,-0.3 -151,-0.1 -0.420 117.8 20.0 -68.2 141.7 15.2 -3.0 0.1 171 189 A N T 3 S+ 0 0 40 -3,-0.1 -1,-0.3 -2,-0.1 -2,-0.1 0.530 92.3 110.8 73.1 7.5 12.2 -1.7 2.1 172 190 A S S < S- 0 0 4 -3,-1.7 66,-0.2 63,-0.1 99,-0.2 0.736 98.3 -99.7 -78.8 -25.2 14.6 0.6 4.0 173 191 A G S > S+ 0 0 9 -4,-0.3 4,-2.8 62,-0.1 5,-0.2 0.545 75.3 141.4 118.0 14.8 13.0 3.5 2.3 174 192 A K H > S+ 0 0 16 -5,-0.5 4,-2.5 1,-0.2 5,-0.2 0.936 81.3 38.5 -48.2 -57.4 15.4 4.4 -0.5 175 193 A T H > S+ 0 0 57 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.954 112.8 55.2 -62.0 -53.4 12.6 5.2 -2.9 176 194 A S H > S+ 0 0 60 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.894 112.2 45.9 -46.7 -44.3 10.4 6.9 -0.4 177 195 A L H X S+ 0 0 4 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.954 110.5 50.1 -67.8 -51.2 13.2 9.2 0.4 178 196 A F H X S+ 0 0 2 -4,-2.5 4,-1.8 -5,-0.2 -2,-0.2 0.919 113.8 50.1 -49.9 -44.7 14.2 10.0 -3.1 179 197 A N H <>S+ 0 0 38 -4,-3.2 5,-1.5 2,-0.2 4,-0.3 0.941 111.2 43.5 -62.2 -52.3 10.5 10.8 -3.7 180 198 A S H <5S+ 0 0 14 -4,-2.6 3,-0.3 1,-0.2 -1,-0.2 0.827 115.5 51.8 -66.8 -28.9 10.0 13.1 -0.8 181 199 A L H <5S+ 0 0 17 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.805 119.0 34.4 -73.1 -32.6 13.3 14.8 -1.6 182 200 A T T <5S- 0 0 11 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.214 105.2-128.4-106.2 13.2 12.4 15.4 -5.3 183 201 A G T 5 + 0 0 59 -4,-0.3 -3,-0.2 -3,-0.3 -4,-0.1 0.893 67.4 123.2 35.1 65.0 8.7 15.9 -4.5 184 202 A L < 0 0 59 -5,-1.5 -5,-0.1 -6,-0.1 -1,-0.1 0.573 360.0 360.0-110.1 -99.3 7.5 13.3 -7.1 185 203 A T 0 0 161 -9,-0.0 -9,-0.1 0, 0.0 -5,-0.1 -0.133 360.0 360.0-171.2 360.0 5.3 10.4 -6.2 186 ! 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 0.0 187 216 A P 0 0 121 0, 0.0 2,-2.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 177.5 12.4 8.3 -11.9 188 217 A K + 0 0 115 16,-0.1 15,-2.7 2,-0.0 2,-0.4 -0.300 360.0 30.2 75.3 -58.7 15.9 6.9 -11.1 189 218 A R E +G 202 0C 134 -2,-2.5 2,-0.3 13,-0.2 13,-0.2 -0.998 65.4 163.9-139.9 136.0 17.8 10.3 -11.3 190 219 A Y E -G 201 0C 109 11,-3.0 11,-3.2 -2,-0.4 2,-0.5 -0.927 27.5-139.1-159.4 128.0 16.6 13.8 -10.6 191 220 A A E -G 200 0C 20 -2,-0.3 9,-0.3 9,-0.3 -28,-0.1 -0.784 24.9-172.9 -93.5 125.9 18.2 17.2 -10.0 192 221 A I E -G 199 0C 14 7,-3.0 7,-2.2 -2,-0.5 2,-0.7 -0.925 22.5-124.7-122.0 141.5 16.7 19.3 -7.2 193 222 A P E -G 198 0C 100 0, 0.0 2,-0.6 0, 0.0 5,-0.2 -0.750 23.9-179.0 -89.0 112.2 17.4 22.9 -6.1 194 223 A I E > -G 197 0C 2 3,-2.2 3,-1.6 -2,-0.7 2,-0.2 -0.954 66.6 -47.3-107.7 114.5 18.4 23.3 -2.4 195 224 A N T 3 S- 0 0 104 -2,-0.6 125,-0.0 1,-0.2 0, 0.0 -0.446 120.2 -23.3 59.3-128.1 18.9 27.1 -1.8 196 225 A N T 3 S+ 0 0 156 -2,-0.2 2,-0.4 -3,-0.0 -1,-0.2 0.273 126.2 77.8 -97.0 9.6 21.1 28.6 -4.5 197 226 A R E < - G 0 194C 90 -3,-1.6 -3,-2.2 2,-0.0 2,-0.3 -0.972 69.0-141.2-127.7 136.3 22.7 25.3 -5.4 198 227 A K E - G 0 193C 109 -2,-0.4 2,-0.4 -5,-0.2 -2,-0.0 -0.698 16.4-165.6 -97.3 146.9 21.4 22.4 -7.5 199 228 A I E - G 0 192C 1 -7,-2.2 -7,-3.0 -2,-0.3 2,-0.5 -0.993 16.8-134.1-139.7 126.4 22.0 18.8 -6.7 200 229 A M E -eG 163 191C 43 -38,-2.4 -36,-2.9 -2,-0.4 2,-0.4 -0.703 24.0-160.2 -82.9 122.3 21.6 15.6 -8.7 201 230 A L E -eG 164 190C 2 -11,-3.2 -11,-3.0 -2,-0.5 2,-0.5 -0.810 4.2-163.7-103.1 144.7 19.8 12.8 -6.8 202 231 A V E -eG 165 189C 21 -38,-1.7 -36,-3.0 -2,-0.4 2,-1.0 -0.974 16.9-149.1-129.5 117.5 19.9 9.1 -7.7 203 232 A D E -e 166 0C 16 -15,-2.7 -36,-0.1 -2,-0.5 2,-0.1 -0.790 36.5-159.2 -76.8 108.9 17.6 6.4 -6.5 204 233 A T - 0 0 13 -38,-1.6 2,-0.3 -2,-1.0 19,-0.1 -0.339 25.4 -89.9 -87.1 165.1 20.1 3.6 -6.6 205 234 A V - 0 0 4 17,-0.2 -37,-0.3 1,-0.1 -1,-0.1 -0.613 56.5-124.7 -68.1 137.2 19.6 -0.1 -6.7 206 235 A G - 0 0 4 -2,-0.3 2,-0.4 1,-0.1 -37,-0.3 0.081 24.1 -84.1 -74.0-173.8 19.4 -1.3 -3.1 207 236 A F B -j 169 0D 0 -39,-1.6 -37,-1.3 16,-0.0 2,-0.4 -0.809 54.7-148.4 -81.4 138.5 21.3 -3.8 -1.1 208 237 A I - 0 0 15 -2,-0.4 3,-0.5 -39,-0.2 2,-0.2 -0.942 2.8-132.4-122.9 133.9 19.5 -7.0 -1.9 209 238 A R S S+ 0 0 75 -2,-0.4 0, 0.0 1,-0.2 0, 0.0 -0.581 81.5 2.2 -84.2 145.4 19.0 -10.0 0.3 210 239 A G S S- 0 0 59 -2,-0.2 -1,-0.2 1,-0.2 0, 0.0 0.906 77.1-167.5 48.9 55.6 19.6 -13.6 -0.8 211 240 A I - 0 0 38 -3,-0.5 -1,-0.2 1,-0.1 5,-0.1 -0.638 24.3-116.4 -74.3 123.5 20.8 -12.7 -4.3 212 241 A P > - 0 0 11 0, 0.0 3,-1.8 0, 0.0 4,-0.2 -0.403 18.0-120.9 -64.4 136.0 20.9 -15.9 -6.4 213 242 A P G > S+ 0 0 109 0, 0.0 3,-1.8 0, 0.0 4,-0.5 0.837 107.5 68.6 -38.4 -50.5 24.4 -16.9 -7.7 214 243 A Q G 3 S+ 0 0 91 1,-0.3 4,-0.2 2,-0.1 3,-0.2 0.818 111.6 28.9 -41.2 -42.4 23.2 -16.7 -11.3 215 244 A I G <> S+ 0 0 0 -3,-1.8 4,-2.4 1,-0.1 -1,-0.3 0.130 84.1 105.8-117.5 20.7 22.9 -12.9 -11.1 216 245 A V H <> S+ 0 0 60 -3,-1.8 4,-3.6 -4,-0.2 5,-0.2 0.932 84.0 51.0 -64.9 -45.3 25.5 -11.8 -8.5 217 246 A D H > S+ 0 0 104 -4,-0.5 4,-2.4 1,-0.2 5,-0.3 0.934 110.5 48.9 -56.2 -49.2 27.8 -10.4 -11.2 218 247 A A H > S+ 0 0 1 -112,-0.3 4,-2.0 -4,-0.2 -1,-0.2 0.923 115.1 46.0 -56.6 -45.1 24.9 -8.5 -12.7 219 248 A F H X S+ 0 0 15 -4,-2.4 4,-3.1 2,-0.2 5,-0.3 0.955 111.3 50.1 -62.9 -51.8 24.0 -7.1 -9.3 220 249 A F H X S+ 0 0 77 -4,-3.6 4,-2.7 1,-0.2 -2,-0.2 0.922 113.7 44.7 -53.9 -50.0 27.6 -6.2 -8.3 221 250 A V H X S+ 0 0 18 -4,-2.4 4,-0.5 -5,-0.2 -1,-0.2 0.881 114.2 49.6 -65.9 -40.1 28.3 -4.3 -11.5 222 251 A T H >< S+ 0 0 4 -4,-2.0 3,-1.2 -5,-0.3 4,-0.2 0.959 114.9 43.7 -61.2 -52.3 24.9 -2.5 -11.3 223 252 A L H >< S+ 0 0 2 -4,-3.1 3,-2.5 1,-0.2 4,-0.2 0.887 102.9 66.9 -59.2 -41.1 25.4 -1.5 -7.7 224 253 A S H >< S+ 0 0 20 -4,-2.7 3,-1.7 1,-0.3 -1,-0.2 0.661 81.2 77.8 -59.3 -16.7 29.1 -0.5 -8.3 225 254 A E G X< S+ 0 0 44 -3,-1.2 3,-1.3 -4,-0.5 -1,-0.3 0.739 79.8 71.7 -65.5 -20.2 27.8 2.4 -10.5 226 255 A A G X S+ 0 0 4 -3,-2.5 3,-2.0 1,-0.2 -1,-0.3 0.769 79.6 75.5 -62.3 -26.9 27.1 4.1 -7.2 227 256 A K G < S+ 0 0 67 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.704 83.7 64.5 -62.8 -20.6 30.8 4.5 -6.7 228 257 A Y G < S+ 0 0 120 -3,-1.3 -1,-0.3 -4,-0.2 2,-0.2 0.279 82.3 107.8 -88.2 12.3 30.9 7.4 -9.2 229 258 A S S < S- 0 0 11 -3,-2.0 -65,-0.2 1,-0.1 3,-0.1 -0.500 70.9-137.4 -82.1 158.3 28.6 9.4 -6.9 230 259 A D S S+ 0 0 54 -67,-2.5 2,-0.3 1,-0.3 -66,-0.2 0.858 85.9 0.8 -83.3 -39.9 30.0 12.4 -5.1 231 260 A A E -f 164 0C 0 -68,-1.4 -66,-1.9 33,-0.1 2,-0.4 -0.920 67.6-141.7-138.8 167.5 28.2 11.5 -1.9 232 261 A L E -fh 165 266C 0 33,-1.9 35,-1.7 -2,-0.3 2,-0.7 -0.998 3.8-150.4-134.6 133.3 25.9 8.8 -0.6 233 262 A I E -fh 166 267C 0 -68,-2.2 -66,-2.6 -2,-0.4 2,-0.6 -0.909 18.3-153.5 -97.3 113.4 22.9 8.8 1.7 234 263 A L E -fh 167 268C 0 33,-1.2 35,-3.2 -2,-0.7 2,-0.3 -0.793 7.9-153.7 -89.3 117.3 22.7 5.5 3.5 235 264 A V E - h 0 269C 0 -68,-3.1 -66,-0.5 -2,-0.6 2,-0.4 -0.736 12.6-171.4 -93.2 139.9 19.1 4.7 4.5 236 265 A I E - h 0 270C 1 33,-2.2 35,-2.8 -2,-0.3 2,-1.0 -0.991 26.5-121.4-136.9 139.9 18.5 2.5 7.5 237 266 A D E > - h 0 271C 9 -2,-0.4 3,-1.8 33,-0.2 35,-0.2 -0.668 18.7-167.5 -84.7 101.2 15.3 0.8 8.9 238 267 A S T 3 S+ 0 0 8 33,-2.7 -1,-0.2 -2,-1.0 34,-0.1 0.706 79.7 76.1 -61.1 -18.1 15.0 2.1 12.5 239 268 A T T 3 S+ 0 0 64 32,-0.4 -1,-0.3 -3,-0.0 2,-0.3 0.451 72.5 106.3 -77.7 0.4 12.3 -0.6 13.1 240 269 A F S < S- 0 0 38 -3,-1.8 2,-0.0 1,-0.1 -4,-0.0 -0.594 78.7-114.2 -74.5 139.2 15.0 -3.3 13.3 241 270 A S > - 0 0 63 -2,-0.3 4,-3.1 1,-0.1 5,-0.2 -0.356 40.2 -97.1 -64.1 156.7 15.9 -4.7 16.7 242 271 A E H > S+ 0 0 52 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.845 124.7 53.3 -49.0 -42.0 19.4 -3.8 17.8 243 272 A N H > S+ 0 0 120 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.966 114.3 39.4 -58.6 -54.8 20.7 -7.2 16.7 244 273 A L H > S+ 0 0 78 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.843 112.6 58.9 -63.3 -33.5 19.3 -6.8 13.1 245 274 A L H X S+ 0 0 0 -4,-3.1 4,-2.0 2,-0.2 -1,-0.2 0.909 105.9 48.0 -59.9 -43.5 20.3 -3.2 13.3 246 275 A I H X S+ 0 0 63 -4,-2.5 4,-2.6 -5,-0.2 5,-0.2 0.924 110.0 53.0 -63.2 -44.6 23.9 -4.2 13.8 247 276 A E H X S+ 0 0 131 -4,-2.1 4,-3.2 1,-0.2 5,-0.2 0.930 108.3 49.8 -53.8 -49.2 23.6 -6.7 10.9 248 277 A T H X S+ 0 0 12 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.926 112.8 45.5 -60.0 -48.0 22.4 -4.0 8.5 249 278 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 5,-0.3 0.950 115.4 46.9 -60.4 -51.8 25.2 -1.6 9.4 250 279 A Q H X S+ 0 0 68 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.944 116.7 44.5 -52.7 -51.2 27.8 -4.2 9.2 251 280 A S H X S+ 0 0 36 -4,-3.2 4,-2.5 -5,-0.2 -2,-0.2 0.864 110.5 54.9 -64.1 -38.6 26.4 -5.5 5.9 252 281 A S H X S+ 0 0 0 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.939 112.9 39.5 -64.5 -48.3 26.0 -2.1 4.4 253 282 A F H X S+ 0 0 12 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.742 111.9 59.1 -76.8 -22.6 29.5 -1.0 4.9 254 283 A E H X S+ 0 0 107 -4,-1.6 4,-2.3 -5,-0.3 -2,-0.2 0.960 110.3 41.7 -63.6 -52.0 30.8 -4.4 3.9 255 284 A I H X S+ 0 0 34 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.896 113.2 54.3 -61.4 -42.7 29.1 -4.1 0.5 256 285 A L H <>S+ 0 0 2 -4,-2.2 5,-2.9 1,-0.2 -1,-0.2 0.904 111.8 42.6 -61.9 -43.5 30.2 -0.5 0.2 257 286 A R H ><5S+ 0 0 200 -4,-2.1 3,-1.2 3,-0.2 -1,-0.2 0.878 112.5 58.4 -67.4 -36.4 33.8 -1.4 0.7 258 287 A E H 3<5S+ 0 0 131 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.931 106.6 44.2 -55.1 -51.7 33.2 -4.3 -1.5 259 288 A I T 3<5S- 0 0 2 -4,-2.7 -1,-0.3 -5,-0.1 -2,-0.2 0.304 125.9 -99.7 -84.5 10.0 32.1 -2.2 -4.5 260 289 A G T < 5 + 0 0 37 -3,-1.2 2,-0.6 1,-0.2 -3,-0.2 0.867 63.0 159.0 78.4 38.8 35.0 0.2 -3.9 261 290 A V < + 0 0 7 -5,-2.9 2,-0.3 -6,-0.1 -1,-0.2 -0.854 16.6 156.1 -89.7 123.8 33.4 3.1 -2.1 262 291 A S + 0 0 99 -2,-0.6 33,-0.0 -35,-0.2 -5,-0.0 -0.996 55.1 3.4-149.7 144.2 36.2 5.0 -0.3 263 292 A G S S+ 0 0 56 33,-0.7 -1,-0.0 -2,-0.3 -2,-0.0 0.724 88.4 136.5 53.9 24.4 36.8 8.5 1.1 264 293 A K - 0 0 28 32,-0.2 -1,-0.2 -33,-0.0 -33,-0.1 -0.891 62.1-112.3-104.7 129.8 33.3 9.4 0.0 265 294 A P - 0 0 12 0, 0.0 -33,-1.9 0, 0.0 2,-0.5 -0.371 34.3-161.8 -60.7 132.4 31.1 11.5 2.4 266 295 A I E -hi 232 298C 0 31,-1.6 33,-1.0 -35,-0.2 2,-0.8 -0.959 11.9-160.9-124.6 115.5 28.3 9.4 3.7 267 296 A L E -hi 233 300C 0 -35,-1.7 -33,-1.2 -2,-0.5 2,-0.5 -0.827 17.7-151.3 -89.2 104.8 25.2 10.9 5.3 268 297 A V E -hi 234 301C 0 32,-2.4 34,-3.0 -2,-0.8 2,-0.6 -0.665 10.4-166.4 -81.1 123.5 23.5 8.1 7.4 269 298 A T E -hi 235 302C 0 -35,-3.2 -33,-2.2 -2,-0.5 2,-1.0 -0.941 13.2-153.0-114.7 118.4 19.7 8.4 7.7 270 299 A L E -hi 236 303C 0 32,-2.6 34,-3.2 -2,-0.6 3,-0.3 -0.796 31.9-166.2 -87.5 102.6 17.9 6.3 10.3 271 300 A N E +h 237 0C 3 -35,-2.8 -33,-2.7 -2,-1.0 -32,-0.4 -0.510 52.1 43.2-100.0 157.7 14.4 6.1 8.6 272 301 A K > + 0 0 39 32,-0.4 3,-2.0 -2,-0.2 33,-0.2 0.691 57.8 149.0 86.1 25.5 10.9 5.1 9.7 273 302 A I T 3 + 0 0 27 31,-1.9 32,-0.2 -3,-0.3 7,-0.1 0.607 58.2 77.5 -67.7 -11.4 11.1 6.8 13.1 274 303 A D T 3 S+ 0 0 55 1,-0.3 2,-1.4 30,-0.2 -1,-0.3 0.659 77.5 76.6 -72.0 -15.0 7.3 7.5 12.9 275 304 A K S < S- 0 0 146 -3,-2.0 2,-0.3 2,-0.0 -1,-0.3 -0.531 83.4-170.8 -89.9 64.6 7.0 3.8 13.9 276 305 A I + 0 0 139 -2,-1.4 -2,-0.1 1,-0.2 -3,-0.1 -0.424 30.8 164.5 -66.7 120.3 7.9 4.8 17.4 277 306 A N - 0 0 88 -2,-0.3 -1,-0.2 -4,-0.1 -3,-0.0 0.267 66.1-101.8-110.0 6.1 8.6 2.0 19.9 278 307 A G S S+ 0 0 64 3,-0.0 4,-0.2 4,-0.0 3,-0.1 0.513 100.0 104.3 85.1 8.9 10.3 4.4 22.3 279 308 A D > + 0 0 55 1,-0.1 4,-2.6 2,-0.1 5,-0.3 0.198 35.2 114.6-110.6 17.0 13.8 3.3 21.2 280 309 A L H > S+ 0 0 63 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.948 78.0 44.7 -50.8 -67.2 14.9 6.2 19.1 281 310 A Y H > S+ 0 0 207 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.898 115.3 49.6 -43.9 -53.7 17.8 7.6 21.2 282 311 A K H > S+ 0 0 114 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.943 117.1 39.2 -52.6 -55.9 19.2 4.0 21.8 283 312 A K H X S+ 0 0 7 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.864 114.5 54.6 -66.3 -37.5 19.1 3.1 18.1 284 313 A L H X S+ 0 0 40 -4,-3.6 4,-2.0 -5,-0.3 -1,-0.2 0.902 111.4 43.5 -65.6 -41.6 20.3 6.5 17.0 285 314 A D H X S+ 0 0 82 -4,-2.7 4,-2.7 -5,-0.3 5,-0.2 0.870 113.2 53.2 -70.0 -36.6 23.4 6.4 19.2 286 315 A L H X S+ 0 0 42 -4,-2.0 4,-2.4 -5,-0.3 5,-0.3 0.960 111.0 45.1 -61.4 -53.4 24.0 2.7 18.2 287 316 A V H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.902 115.2 48.5 -57.6 -43.1 23.9 3.5 14.5 288 317 A E H X S+ 0 0 71 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.942 112.7 45.7 -67.2 -48.0 26.1 6.6 14.9 289 318 A K H X S+ 0 0 126 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.943 116.3 45.4 -57.1 -49.9 28.8 4.9 17.0 290 319 A L H X S+ 0 0 19 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.846 110.1 53.8 -68.5 -36.9 29.0 1.9 14.8 291 320 A S H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.3 3,-0.3 0.956 108.5 49.5 -60.4 -52.8 29.1 3.9 11.6 292 321 A K H < S+ 0 0 93 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.912 112.5 49.4 -48.8 -46.7 32.0 5.9 12.8 293 322 A E H < S+ 0 0 147 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.831 117.0 40.0 -64.3 -34.1 33.7 2.7 13.8 294 323 A L H < S+ 0 0 58 -4,-1.8 2,-0.3 -3,-0.3 -2,-0.2 0.803 120.5 14.6 -90.1 -32.2 33.1 1.0 10.4 295 324 A Y < - 0 0 30 -4,-2.7 3,-0.3 -5,-0.2 -1,-0.1 -0.944 64.3-121.3-146.1 161.1 33.7 3.9 7.9 296 325 A S S S+ 0 0 95 -2,-0.3 -33,-0.7 1,-0.3 -32,-0.2 -0.937 81.8 36.6-156.6 139.9 35.1 7.3 7.2 297 326 A P + 0 0 44 0, 0.0 -31,-1.6 0, 0.0 2,-0.8 0.275 64.3 177.7 -89.9 129.2 34.2 10.0 6.3 298 327 A I E -i 266 0C 22 -3,-0.3 -31,-0.2 -33,-0.2 3,-0.1 -0.859 10.6-166.3 -87.1 109.8 30.8 9.8 7.9 299 328 A F E - 0 0 35 -33,-1.0 2,-0.3 -2,-0.8 -32,-0.2 0.963 61.6 -38.7 -60.1 -56.0 29.3 13.2 7.1 300 329 A D E -i 267 0C 36 -34,-0.8 -32,-2.4 -3,-0.1 2,-0.4 -0.972 44.6-130.9-164.8 160.8 26.4 12.9 9.6 301 330 A V E +i 268 0C 8 -2,-0.3 -32,-0.2 -34,-0.2 -13,-0.1 -0.989 34.2 174.8-118.8 126.2 23.9 10.5 11.2 302 331 A I E -i 269 0C 5 -34,-3.0 -32,-2.6 -2,-0.4 2,-0.3 -0.991 30.0-128.7-140.6 135.2 20.3 11.7 11.3 303 332 A P E +i 270 0C 20 0, 0.0 2,-0.3 0, 0.0 -32,-0.2 -0.621 41.4 164.8 -77.5 139.5 16.9 10.3 12.3 304 333 A I - 0 0 5 -34,-3.2 -31,-1.9 -2,-0.3 -32,-0.4 -0.953 39.5-145.4-149.2 166.5 14.2 10.7 9.7 305 334 A S >> - 0 0 1 -2,-0.3 4,-3.0 -34,-0.2 5,-0.7 -0.771 12.2-176.7-135.7 93.0 10.8 9.7 8.5 306 335 A A T 45S+ 0 0 7 -2,-0.3 -1,-0.1 2,-0.2 -133,-0.1 0.860 88.3 49.6 -54.2 -37.9 10.7 9.7 4.7 307 336 A L T 45S+ 0 0 108 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.985 122.3 28.6 -64.2 -60.3 7.0 8.8 4.9 308 337 A K T 45S- 0 0 123 1,-0.0 -2,-0.2 -4,-0.0 -1,-0.2 0.555 94.5-137.4 -83.8 -10.3 5.9 11.5 7.4 309 338 A R T ><5 + 0 0 137 -4,-3.0 3,-1.0 1,-0.1 4,-0.2 0.821 48.5 153.1 60.7 34.6 8.6 14.0 6.3 310 339 A T T 3 S+ 0 0 46 -6,-0.1 4,-1.5 1,-0.1 -1,-0.3 -0.213 84.1 124.3-125.7 40.9 12.9 15.9 9.9 312 341 A L H <> + 0 0 37 -3,-1.0 4,-2.8 2,-0.2 5,-0.2 0.864 66.1 56.7 -74.0 -41.6 13.0 17.1 6.3 313 342 A E H > S+ 0 0 120 -4,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.949 110.7 44.6 -56.2 -52.2 14.2 20.6 6.7 314 343 A L H > S+ 0 0 67 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.886 111.2 54.2 -61.3 -41.4 17.3 19.5 8.6 315 344 A L H X S+ 0 0 3 -4,-1.5 4,-3.2 1,-0.2 5,-0.2 0.952 108.2 48.8 -56.1 -51.2 18.0 16.7 6.1 316 345 A R H X S+ 0 0 78 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.818 111.0 53.0 -57.6 -31.9 17.9 19.3 3.3 317 346 A D H X S+ 0 0 86 -4,-1.7 4,-3.5 -5,-0.2 5,-0.2 0.946 110.4 44.6 -67.7 -51.4 20.3 21.4 5.4 318 347 A K H X S+ 0 0 41 -4,-2.9 4,-3.2 1,-0.2 -2,-0.2 0.936 115.8 48.4 -56.5 -48.8 22.8 18.5 5.8 319 348 A I H X S+ 0 0 1 -4,-3.2 4,-2.6 2,-0.2 -1,-0.2 0.883 113.3 48.2 -59.4 -40.5 22.4 17.7 2.1 320 349 A Y H X S+ 0 0 53 -4,-2.1 4,-3.6 -5,-0.2 5,-0.3 0.973 112.6 46.5 -63.6 -54.6 23.0 21.4 1.4 321 350 A Q H X S+ 0 0 101 -4,-3.5 4,-2.4 1,-0.2 -2,-0.2 0.904 114.2 49.5 -51.7 -46.4 26.0 21.6 3.6 322 351 A L H X S+ 0 0 0 -4,-3.2 4,-1.7 -5,-0.2 -1,-0.2 0.925 112.9 46.5 -57.8 -47.5 27.3 18.4 2.1 323 352 A A H X S+ 0 0 3 -4,-2.6 4,-0.9 2,-0.2 3,-0.4 0.948 111.4 50.3 -61.5 -51.6 26.7 19.8 -1.4 324 353 A T H >< S+ 0 0 48 -4,-3.6 3,-0.7 1,-0.2 4,-0.3 0.891 109.1 54.1 -50.4 -42.9 28.3 23.1 -0.5 325 354 A Q H >< S+ 0 0 104 -4,-2.4 3,-0.6 -5,-0.3 -1,-0.2 0.877 113.7 40.8 -58.8 -39.4 31.2 21.1 0.8 326 355 A L H 3< S+ 0 0 51 -4,-1.7 -1,-0.2 -3,-0.4 -2,-0.2 0.445 91.5 86.9 -91.7 -1.9 31.5 19.2 -2.6 327 356 A S T << 0 0 47 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.1 0.592 360.0 360.0 -76.0 -9.2 30.9 22.3 -4.7 328 357 A L < 0 0 193 -3,-0.6 -1,-0.1 -4,-0.3 -4,-0.0 -0.907 360.0 360.0-117.6 360.0 34.7 23.1 -4.6