==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CONTRACTILE PROTEIN 19-SEP-08 3EKU . COMPND 2 MOLECULE: ACTIN-5C; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR U.B.NAIR,P.B.JOEL,Q.WAN,S.LOWEY,M.A.ROULD,K.M.TRYBUS . 362 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16371.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 264 72.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 12.2 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 . 4 1.1 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 . 1 0.3 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 . 21 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 107 29.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.8 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 3 1 0 1 0 2 2 0 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 4 1 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 0 0 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 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 4 A E 0 0 136 0, 0.0 3,-0.1 0, 0.0 88,-0.0 0.000 360.0 360.0 360.0 171.3 46.7 -8.9 12.8 2 5 A V - 0 0 102 1,-0.1 2,-0.4 86,-0.1 87,-0.1 0.069 360.0 -63.4 -85.4-152.7 48.8 -5.7 12.7 3 6 A A - 0 0 29 85,-0.2 2,-0.1 -2,-0.0 -1,-0.1 -0.783 40.3-127.5-101.5 141.2 52.3 -5.3 14.1 4 7 A A - 0 0 10 -2,-0.4 15,-1.9 85,-0.2 2,-0.4 -0.490 27.9-129.0 -75.8 155.9 53.2 -5.6 17.8 5 8 A L E -Ab 18 91A 0 85,-2.7 87,-3.2 13,-0.2 2,-0.7 -0.928 13.8-147.4-108.7 136.6 55.1 -2.5 18.9 6 9 A V E -Ab 17 92A 0 11,-2.5 11,-1.4 -2,-0.4 2,-0.6 -0.908 16.2-176.0-108.3 110.2 58.4 -3.2 20.8 7 10 A V E -Ab 16 93A 1 85,-2.8 87,-1.5 -2,-0.7 2,-0.8 -0.905 6.5-169.0-111.2 111.1 59.1 -0.6 23.4 8 11 A D E -A 15 0A 7 7,-3.7 7,-3.0 -2,-0.6 2,-0.6 -0.853 10.1-158.3-100.7 103.8 62.5 -0.9 25.2 9 12 A N E -A 14 0A 8 -2,-0.8 2,-0.2 85,-0.4 5,-0.2 -0.729 17.1-179.9 -85.9 119.9 62.5 1.4 28.2 10 13 A G - 0 0 11 3,-0.6 49,-0.1 -2,-0.6 86,-0.0 -0.629 39.8-115.0-114.3 173.9 66.0 2.3 29.3 11 14 A S S S+ 0 0 20 -2,-0.2 48,-0.3 136,-0.1 3,-0.1 0.835 114.8 13.0 -76.2 -33.3 67.6 4.4 32.1 12 15 A G S S+ 0 0 16 1,-0.3 18,-2.6 17,-0.1 2,-0.3 0.773 134.3 25.1-108.9 -43.7 69.2 6.8 29.6 13 16 A M E - C 0 29A 70 16,-0.3 -3,-0.6 17,-0.1 2,-0.4 -0.915 61.5-147.4-126.4 151.4 67.5 6.0 26.3 14 17 A C E -AC 9 28A 1 14,-2.8 14,-1.7 -2,-0.3 2,-0.4 -0.945 13.3-158.9-116.3 137.8 64.2 4.5 25.2 15 18 A K E +AC 8 27A 29 -7,-3.0 -7,-3.7 -2,-0.4 2,-0.3 -0.961 14.7 172.4-119.1 135.6 64.0 2.5 22.0 16 19 A A E +AC 7 26A 0 10,-2.6 10,-2.3 -2,-0.4 9,-0.7 -0.996 12.7 118.3-143.8 147.8 60.7 1.9 20.2 17 20 A G E -A 6 0A 0 -11,-1.4 -11,-2.5 -2,-0.3 2,-0.5 -0.947 55.4 -58.3-176.8-163.2 59.7 0.3 16.9 18 21 A F E > -A 5 0A 32 5,-0.3 3,-2.3 -2,-0.3 -13,-0.2 -0.893 48.6-110.7-111.2 131.5 57.7 -2.4 15.1 19 22 A A T 3 S+ 0 0 18 -15,-1.9 3,-0.1 -2,-0.5 -15,-0.1 -0.317 106.8 42.4 -53.8 131.9 58.2 -6.1 15.6 20 23 A G T 3 S+ 0 0 58 1,-0.6 -1,-0.3 309,-0.2 2,-0.2 0.047 89.4 102.9 115.3 -26.9 59.7 -7.4 12.4 21 24 A D < - 0 0 52 -3,-2.3 -1,-0.6 1,-0.1 311,-0.1 -0.502 69.2-136.9 -83.7 160.4 62.2 -4.5 11.8 22 25 A D S S+ 0 0 139 -2,-0.2 307,-0.1 1,-0.1 -1,-0.1 0.327 86.2 34.7-100.6 7.7 65.9 -5.1 12.6 23 26 A A S S- 0 0 49 -5,-0.2 -5,-0.3 305,-0.1 -1,-0.1 -0.975 93.1 -96.8-157.5 143.7 66.4 -1.8 14.3 24 27 A P - 0 0 18 0, 0.0 -7,-0.3 0, 0.0 3,-0.1 -0.399 25.4-140.1 -64.1 138.6 64.2 0.5 16.5 25 28 A R S S+ 0 0 166 -9,-0.7 2,-0.3 1,-0.2 -8,-0.2 0.757 83.6 25.1 -70.3 -27.1 62.4 3.3 14.6 26 29 A A E -C 16 0A 11 -10,-2.3 -10,-2.6 2,-0.0 2,-0.4 -1.000 55.9-178.9-145.0 143.3 63.0 5.8 17.4 27 30 A V E +C 15 0A 53 -2,-0.3 -12,-0.2 -12,-0.2 -14,-0.0 -0.973 18.2 164.0-141.5 120.6 65.4 6.3 20.2 28 31 A F E -C 14 0A 2 -14,-1.7 -14,-2.8 -2,-0.4 15,-0.1 -0.945 41.8 -83.7-138.6 159.5 65.1 9.3 22.6 29 32 A P E -C 13 0A 12 0, 0.0 2,-1.5 0, 0.0 -16,-0.3 -0.280 38.0-122.8 -61.0 142.1 66.4 10.4 26.0 30 33 A S S S+ 0 0 1 -18,-2.6 29,-0.4 12,-0.1 2,-0.3 -0.407 70.1 113.4 -86.8 61.8 64.5 9.1 29.1 31 34 A I - 0 0 7 -2,-1.5 12,-1.8 26,-0.2 2,-0.4 -0.977 45.0-162.8-135.4 148.5 63.6 12.5 30.6 32 35 A V E -FG 42 56B 0 24,-1.8 24,-2.3 -2,-0.3 2,-0.4 -0.970 12.5-158.3-126.4 141.6 60.4 14.4 31.3 33 36 A G E +FG 41 55B 0 8,-3.0 8,-1.8 -2,-0.4 22,-0.2 -0.979 11.3 177.2-130.8 136.4 60.2 18.1 32.0 34 37 A R E - G 0 54B 73 20,-1.2 20,-3.1 -2,-0.4 6,-0.2 -0.871 47.5 -68.9-127.8 161.0 57.7 20.4 33.7 35 38 A P E G 0 53B 77 0, 0.0 18,-0.2 0, 0.0 -1,-0.1 -0.185 360.0 360.0 -50.7 136.0 57.6 24.1 34.5 36 39 A R 0 0 189 16,-2.1 17,-0.1 -3,-0.0 16,-0.0 0.679 360.0 360.0 -83.8 360.0 60.0 25.0 37.3 37 ! 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 38 50 A K 0 0 140 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 179.4 52.5 22.7 27.3 39 51 A D + 0 0 139 1,-0.1 2,-0.3 -5,-0.1 0, 0.0 0.820 360.0 22.2 -79.6 -33.9 52.7 21.2 30.8 40 52 A S - 0 0 28 -6,-0.2 2,-0.3 13,-0.0 -6,-0.2 -0.941 59.4-160.3-136.3 158.6 55.4 18.6 30.1 41 53 A Y E -F 33 0B 40 -8,-1.8 -8,-3.0 -2,-0.3 2,-0.4 -0.986 9.9-157.5-135.8 143.9 58.2 18.0 27.6 42 54 A V E > -F 32 0B 4 -2,-0.3 3,-0.6 -10,-0.2 2,-0.3 -0.982 48.5 -13.9-131.0 134.9 60.0 14.7 26.7 43 55 A G T >> S- 0 0 1 -12,-1.8 3,-1.5 -2,-0.4 4,-0.9 -0.601 117.8 -3.4 90.7-146.0 63.4 13.9 25.3 44 56 A D H 3> S+ 0 0 106 1,-0.3 4,-1.6 -2,-0.3 3,-0.4 0.811 132.1 54.4 -57.1 -35.5 65.8 16.3 23.5 45 57 A E H <4 S+ 0 0 73 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.623 102.2 58.6 -77.0 -12.1 63.4 19.2 23.8 46 58 A A H <4 S+ 0 0 0 -3,-1.5 -1,-0.2 2,-0.1 -2,-0.2 0.707 107.7 47.5 -85.3 -22.3 63.1 18.6 27.5 47 59 A Q H >< S+ 0 0 42 -4,-0.9 3,-1.7 -3,-0.4 -2,-0.2 0.834 103.6 57.8 -84.8 -37.0 66.9 19.2 27.8 48 60 A S T 3< S+ 0 0 93 -4,-1.6 -1,-0.2 1,-0.3 3,-0.1 0.570 109.2 49.6 -70.4 -7.0 67.0 22.3 25.7 49 61 A K T >> S+ 0 0 66 -5,-0.1 4,-1.7 1,-0.1 3,-1.1 -0.004 71.8 126.2-118.4 25.9 64.6 23.8 28.2 50 62 A R T <4 + 0 0 73 -3,-1.7 3,-0.3 1,-0.3 5,-0.2 0.892 69.9 55.5 -49.8 -48.1 66.6 22.7 31.3 51 63 A G T 34 S+ 0 0 55 1,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.741 117.5 32.9 -61.5 -25.9 66.7 26.3 32.7 52 64 A I T <4 S+ 0 0 106 -3,-1.1 -16,-2.1 -17,-0.0 2,-0.4 0.528 115.1 64.2-107.6 -8.7 62.9 26.7 32.6 53 65 A L E < S-G 35 0B 3 -4,-1.7 2,-0.9 -3,-0.3 -13,-0.0 -0.907 73.4-132.5-120.7 145.4 61.9 23.1 33.4 54 66 A T E -G 34 0B 58 -20,-3.1 -20,-1.2 -2,-0.4 2,-0.2 -0.844 35.0-146.9 -92.9 106.3 62.5 20.8 36.3 55 67 A L E -G 33 0B 30 -2,-0.9 2,-0.3 -22,-0.2 -22,-0.2 -0.512 16.6-172.0 -80.6 143.2 63.7 17.6 34.7 56 68 A K E -G 32 0B 80 -24,-2.3 -24,-1.8 -2,-0.2 10,-0.0 -0.933 18.9-143.1-130.5 153.1 63.0 14.1 36.1 57 69 A Y - 0 0 111 -2,-0.3 -26,-0.2 -26,-0.2 8,-0.1 -0.856 11.1-169.5-122.1 93.8 64.3 10.7 35.1 58 70 A P S S+ 0 0 0 0, 0.0 7,-3.4 0, 0.0 8,-0.9 0.730 76.9 53.3 -52.1 -31.1 61.5 8.1 35.4 59 71 A I E +H 64 0C 4 -29,-0.4 2,-0.5 -48,-0.3 5,-0.2 -0.919 67.3 170.9-116.4 109.1 63.9 5.2 35.0 60 72 A E E > S-H 63 0C 103 3,-1.9 3,-1.6 -2,-0.6 -48,-0.0 -0.971 73.1 -9.2-120.3 128.0 66.8 5.1 37.4 61 73 A H T 3 S- 0 0 73 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.730 130.3 -59.2 59.8 22.2 69.1 2.1 37.6 62 74 A G T 3 S+ 0 0 14 1,-0.2 34,-0.5 85,-0.1 2,-0.3 0.094 112.9 107.5 98.7 -23.0 66.6 0.3 35.4 63 75 A I E < S-H 60 0C 36 -3,-1.6 -3,-1.9 32,-0.1 2,-0.5 -0.710 72.8-117.7 -95.1 141.5 63.5 0.6 37.6 64 76 A V E +H 59 0C 17 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.634 37.0 170.9 -73.7 124.0 60.5 2.8 36.9 65 77 A T + 0 0 74 -7,-3.4 2,-0.4 -2,-0.5 -1,-0.2 0.635 65.3 40.0-109.1 -22.2 60.4 5.2 39.8 66 78 A N > - 0 0 51 -8,-0.9 4,-1.8 1,-0.1 -1,-0.3 -0.940 58.8-172.8-133.7 111.6 57.8 7.7 38.6 67 79 A W H > S+ 0 0 39 -2,-0.4 4,-2.9 2,-0.2 5,-0.2 0.827 83.8 58.8 -73.6 -35.2 54.7 6.5 36.8 68 80 A D H > S+ 0 0 135 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.935 112.1 44.6 -59.0 -42.3 53.2 9.8 35.7 69 81 A D H > S+ 0 0 4 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.900 111.4 50.9 -67.0 -43.3 56.5 10.4 33.9 70 82 A M H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 3,-0.3 0.931 107.0 55.0 -60.6 -44.7 56.7 7.0 32.4 71 83 A E H X S+ 0 0 52 -4,-2.9 4,-2.0 1,-0.3 -1,-0.2 0.853 108.2 50.0 -55.6 -35.9 53.1 7.4 31.1 72 84 A K H X S+ 0 0 32 -4,-1.2 4,-2.0 2,-0.2 -1,-0.3 0.819 107.7 52.7 -73.6 -33.0 54.3 10.6 29.4 73 85 A I H X S+ 0 0 0 -4,-1.7 4,-1.8 -3,-0.3 -2,-0.2 0.905 112.4 45.3 -68.4 -40.5 57.3 8.8 27.9 74 86 A W H X S+ 0 0 1 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.873 111.0 51.9 -71.0 -36.3 54.9 6.2 26.4 75 87 A H H X>S+ 0 0 71 -4,-2.0 4,-2.4 -5,-0.2 5,-0.6 0.912 112.9 46.9 -63.8 -40.6 52.4 8.8 25.2 76 88 A H H X>S+ 0 0 17 -4,-2.0 5,-2.6 1,-0.2 4,-0.8 0.821 110.2 52.9 -68.4 -34.6 55.4 10.5 23.5 77 89 A T H <>S+ 0 0 1 -4,-1.8 5,-3.1 3,-0.2 6,-0.3 0.893 116.5 38.6 -68.5 -41.6 56.6 7.2 22.1 78 90 A F H <5S+ 0 0 0 -4,-2.3 6,-2.7 3,-0.2 5,-0.4 0.959 129.4 23.5 -74.8 -55.8 53.2 6.4 20.5 79 91 A Y H <5S+ 0 0 90 -4,-2.4 -3,-0.2 4,-0.3 -2,-0.1 0.832 133.0 30.7 -85.1 -35.5 51.9 9.7 19.3 80 92 A N T < - 0 0 24 -2,-0.3 3,-2.1 1,-0.1 30,-0.0 -0.863 23.2-150.1 -95.8 116.6 47.2 4.5 18.0 86 98 A P G > S+ 0 0 0 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.766 93.3 65.9 -58.5 -25.1 48.1 2.1 20.8 87 99 A E G 3 S+ 0 0 87 1,-0.3 29,-0.1 30,-0.2 28,-0.0 0.519 99.5 53.9 -75.7 -1.7 44.6 0.6 20.8 88 100 A E G < S+ 0 0 124 -3,-2.1 -1,-0.3 1,-0.1 -85,-0.2 0.138 106.3 59.8-114.6 17.4 45.4 -0.8 17.3 89 101 A H S < S- 0 0 17 -3,-1.4 30,-0.5 -87,-0.1 2,-0.3 -0.985 75.5-126.8-150.7 134.6 48.6 -2.5 18.3 90 102 A P - 0 0 30 0, 0.0 -85,-2.7 0, 0.0 2,-0.5 -0.611 37.1-143.9 -75.3 140.2 49.7 -5.2 20.7 91 103 A V E -bd 5 120A 0 28,-3.0 30,-1.5 -2,-0.3 2,-0.6 -0.925 15.6-163.8-116.1 129.5 52.6 -3.8 22.8 92 104 A L E -bd 6 121A 0 -87,-3.2 -85,-2.8 -2,-0.5 2,-0.3 -0.933 15.2-169.5-107.8 116.8 55.7 -5.6 24.1 93 105 A L E -bd 7 122A 0 28,-3.4 30,-2.7 -2,-0.6 2,-0.3 -0.741 11.1-140.1-104.3 153.0 57.4 -3.7 26.9 94 106 A T E - d 0 123A 2 -87,-1.5 -85,-0.4 -2,-0.3 2,-0.3 -0.789 19.5-176.7-109.7 157.8 60.8 -4.5 28.3 95 107 A E E - d 0 124A 8 28,-2.2 30,-2.7 -2,-0.3 -32,-0.1 -0.950 29.6 -97.7-146.8 164.6 61.8 -4.4 31.9 96 108 A A > - 0 0 2 -34,-0.5 3,-0.7 -2,-0.3 -34,-0.0 -0.466 51.0 -90.7 -82.4 157.1 65.0 -4.9 34.0 97 109 A P T 3 S+ 0 0 4 0, 0.0 -1,-0.1 0, 0.0 26,-0.0 -0.325 104.5 12.9 -66.2 149.9 65.6 -8.2 35.8 98 110 A L T 3 S+ 0 0 93 1,-0.2 3,-0.1 -3,-0.1 -2,-0.0 0.836 85.8 163.1 55.9 39.8 64.3 -8.6 39.4 99 111 A N < - 0 0 9 -3,-0.7 -1,-0.2 1,-0.1 5,-0.1 -0.549 50.1 -74.1 -89.9 158.2 62.0 -5.6 39.4 100 112 A P >> - 0 0 62 0, 0.0 4,-1.3 0, 0.0 3,-1.3 -0.210 35.2-136.6 -49.6 126.1 59.2 -5.0 41.9 101 113 A K H 3> S+ 0 0 115 1,-0.3 4,-1.0 2,-0.2 -2,-0.1 0.826 105.0 60.7 -54.0 -34.5 56.2 -7.2 41.2 102 114 A A H 3> S+ 0 0 54 1,-0.2 4,-1.5 2,-0.2 3,-0.3 0.849 98.9 56.8 -63.7 -34.2 54.0 -4.2 41.9 103 115 A N H <> S+ 0 0 17 -3,-1.3 4,-2.2 1,-0.2 3,-0.2 0.932 100.5 56.4 -62.7 -46.8 55.7 -2.3 39.0 104 116 A R H X S+ 0 0 0 -4,-1.3 4,-1.6 1,-0.2 -1,-0.2 0.798 107.1 50.6 -55.3 -31.9 54.8 -5.1 36.5 105 117 A E H X S+ 0 0 62 -4,-1.0 4,-2.8 -3,-0.3 -1,-0.2 0.869 108.0 51.2 -75.4 -38.0 51.1 -4.6 37.4 106 118 A K H X S+ 0 0 91 -4,-1.5 4,-2.6 -3,-0.2 5,-0.2 0.843 107.8 53.4 -68.3 -34.1 51.2 -0.9 36.9 107 119 A M H X S+ 0 0 4 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.959 112.0 44.9 -63.8 -49.8 52.7 -1.3 33.5 108 120 A T H X S+ 0 0 0 -4,-1.6 4,-1.8 1,-0.2 5,-0.2 0.941 114.7 48.6 -57.7 -50.4 49.9 -3.7 32.5 109 121 A Q H X>S+ 0 0 77 -4,-2.8 4,-3.1 1,-0.2 5,-0.6 0.885 111.0 48.8 -58.5 -45.7 47.2 -1.4 34.0 110 122 A I H X>S+ 0 0 20 -4,-2.6 4,-1.8 1,-0.2 5,-1.3 0.916 110.8 51.4 -62.2 -43.8 48.5 1.8 32.3 111 123 A M H <5S+ 0 0 0 -4,-2.2 6,-2.7 -5,-0.2 -1,-0.2 0.833 121.7 31.9 -63.1 -34.7 48.7 0.0 28.9 112 124 A F H X5S+ 0 0 10 -4,-1.8 4,-0.7 4,-0.2 -2,-0.2 0.917 128.0 34.0 -90.1 -50.8 45.1 -1.2 29.2 113 125 A E H <5S+ 0 0 115 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.778 131.0 30.9 -77.6 -27.5 43.3 1.5 31.2 114 126 A T T < -d 95 0A 28 -2,-0.4 4,-1.4 -30,-0.2 3,-0.4 -0.472 27.5-138.5 -66.8 127.5 63.2 -9.1 30.8 125 137 A Q H > S+ 0 0 18 -30,-2.7 4,-1.7 -2,-0.2 3,-0.4 0.920 96.7 55.9 -53.2 -53.7 65.7 -7.3 28.7 126 138 A A H > S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.826 105.1 53.2 -53.1 -37.0 68.6 -9.6 29.2 127 139 A V H > S+ 0 0 19 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.924 105.4 53.8 -67.1 -41.0 66.7 -12.6 27.9 128 140 A L H X S+ 0 0 1 -4,-1.4 4,-2.4 -3,-0.4 -1,-0.2 0.879 105.7 54.9 -59.1 -38.3 65.7 -10.8 24.7 129 141 A S H X S+ 0 0 2 -4,-1.7 4,-1.3 2,-0.2 -1,-0.2 0.867 105.6 51.0 -63.2 -39.2 69.4 -10.1 24.1 130 142 A L H >X>S+ 0 0 0 -4,-1.5 5,-1.9 -3,-0.2 3,-0.6 0.943 110.0 49.9 -64.5 -45.2 70.3 -13.8 24.3 131 143 A Y H ><5S+ 0 0 58 -4,-2.1 3,-1.9 1,-0.3 -2,-0.2 0.918 105.7 57.1 -57.8 -43.7 67.5 -14.5 21.8 132 144 A A H 3<5S+ 0 0 24 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.828 103.6 53.3 -55.8 -34.6 68.9 -11.8 19.5 133 145 A S H <<5S- 0 0 28 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.581 122.0-111.0 -77.2 -10.5 72.3 -13.7 19.5 134 146 A G T <<5S+ 0 0 69 -3,-1.9 2,-0.3 -4,-0.5 -3,-0.2 0.760 78.6 115.8 86.8 27.1 70.4 -16.8 18.5 135 147 A R < - 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0 0 57 -5,-2.0 2,-0.3 -6,-0.1 -1,-0.3 -0.145 66.9-124.1 -93.0-167.1 90.6 20.9 30.8 187 199 A S + 0 0 75 -2,-0.1 2,-0.5 -3,-0.1 3,-0.2 -0.783 34.9 158.8-149.9 101.9 87.3 21.8 32.4 188 200 A F + 0 0 13 -10,-0.5 -6,-0.2 -2,-0.3 -7,-0.1 -0.933 27.9 119.5-125.8 103.5 84.3 19.7 31.9 189 201 A T + 0 0 93 -2,-0.5 2,-0.1 -7,-0.0 -1,-0.1 0.523 45.9 88.3-138.7 -20.4 81.7 20.2 34.6 190 202 A T S > S- 0 0 63 -3,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.456 80.0-114.2 -89.0 161.7 78.4 21.4 33.1 191 203 A T H > S+ 0 0 64 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.826 120.6 53.6 -59.2 -32.6 75.4 19.5 31.8 192 204 A E H > S+ 0 0 135 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.907 111.2 45.0 -67.8 -41.4 76.3 21.0 28.4 193 205 A E H > S+ 0 0 53 1,-0.2 4,-2.6 2,-0.2 3,-0.3 0.826 103.8 63.2 -72.1 -31.6 79.8 19.7 28.7 194 206 A R H X S+ 0 0 49 -4,-2.6 4,-1.7 1,-0.3 -1,-0.2 0.873 100.1 54.6 -60.8 -35.4 78.6 16.3 30.0 195 207 A E H X S+ 0 0 64 -4,-1.2 4,-1.0 1,-0.2 -1,-0.3 0.859 109.7 48.1 -65.5 -33.1 77.0 15.9 26.6 196 208 A I H X S+ 0 0 59 -4,-0.8 4,-1.7 -3,-0.3 -2,-0.2 0.897 110.6 47.9 -74.6 -41.6 80.3 16.5 25.0 197 209 A V H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.783 106.1 59.6 -70.6 -25.2 82.3 14.1 27.1 198 210 A R H X S+ 0 0 81 -4,-1.7 4,-1.7 -5,-0.3 -1,-0.2 0.884 106.7 48.0 -68.2 -35.7 79.7 11.5 26.5 199 211 A D H X S+ 0 0 45 -4,-1.0 4,-1.5 2,-0.2 -2,-0.2 0.874 110.5 50.1 -71.4 -37.8 80.5 11.8 22.8 200 212 A I H X>S+ 0 0 2 -4,-1.7 4,-3.2 1,-0.2 5,-0.5 0.944 109.9 51.9 -63.4 -46.9 84.2 11.6 23.4 201 213 A K H X5S+ 0 0 11 -4,-2.6 4,-0.9 1,-0.2 -2,-0.2 0.864 111.2 46.8 -56.0 -41.6 83.7 8.5 25.5 202 214 A E H <5S+ 0 0 103 -4,-1.7 -1,-0.2 1,-0.1 -2,-0.2 0.755 121.6 35.5 -74.8 -26.2 81.7 6.8 22.7 203 215 A K H <5S+ 0 0 130 -4,-1.5 -2,-0.2 -3,-0.4 -3,-0.2 0.793 129.1 22.1 -99.1 -34.3 84.2 7.7 19.9 204 216 A L H <5S+ 0 0 29 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.1 0.497 93.1 100.9-118.4 -1.7 87.7 7.5 21.4 205 217 A C << + 0 0 5 -4,-0.9 2,-0.3 -5,-0.5 38,-0.2 -0.435 40.2 166.1 -84.0 159.2 87.5 5.3 24.5 206 218 A Y - 0 0 29 36,-2.1 2,-0.6 88,-0.2 90,-0.2 -0.975 37.4-105.5-164.2 160.7 88.7 1.7 24.6 207 219 A V - 0 0 5 88,-2.7 2,-0.1 -2,-0.3 36,-0.1 -0.848 33.5-134.5 -98.2 122.2 89.5 -1.1 27.0 208 220 A A - 0 0 1 -2,-0.6 3,-0.3 35,-0.3 4,-0.1 -0.420 6.9-138.1 -71.5 149.6 93.2 -1.9 27.4 209 221 A L S S+ 0 0 99 1,-0.3 2,-0.3 -2,-0.1 -1,-0.1 0.798 99.8 19.2 -76.8 -28.4 94.2 -5.6 27.4 210 222 A D S > S- 0 0 70 1,-0.2 4,-2.4 2,-0.0 -1,-0.3 -0.884 73.0-155.6-144.1 107.9 96.6 -4.8 30.2 211 223 A F H > S+ 0 0 46 -2,-0.3 4,-2.5 -3,-0.3 5,-0.2 0.930 91.2 45.8 -46.7 -64.9 96.1 -1.6 32.2 212 224 A E H > S+ 0 0 152 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.903 113.4 48.4 -50.2 -50.5 99.7 -1.1 33.5 213 225 A Q H > S+ 0 0 100 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.933 112.6 49.6 -58.9 -42.6 101.3 -1.8 30.1 214 226 A E H X S+ 0 0 39 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.866 111.1 50.2 -64.0 -34.8 98.9 0.6 28.5 215 227 A M H X S+ 0 0 54 -4,-2.5 4,-1.0 -5,-0.2 -1,-0.2 0.909 111.4 48.2 -68.6 -41.5 99.7 3.2 31.2 216 228 A A H X S+ 0 0 50 -4,-2.9 4,-0.9 1,-0.2 3,-0.3 0.892 110.4 51.0 -65.6 -41.1 103.4 2.7 30.6 217 229 A T H < S+ 0 0 42 -4,-2.8 4,-0.4 1,-0.2 3,-0.4 0.896 113.2 45.4 -63.7 -38.9 103.1 3.1 26.9 218 230 A A H < S+ 0 0 21 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.638 108.2 57.6 -79.7 -15.6 101.1 6.3 27.3 219 231 A A H < S+ 0 0 86 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.2 0.638 117.6 30.6 -89.1 -14.5 103.5 7.7 29.9 220 232 A S S < S+ 0 0 102 -4,-0.9 2,-0.3 -3,-0.4 -2,-0.2 0.274 123.8 35.0-125.3 7.5 106.5 7.5 27.6 221 233 A S - 0 0 57 -4,-0.4 3,-0.1 -5,-0.1 -1,-0.0 -0.932 59.4-138.6-152.7 171.5 105.0 8.0 24.2 222 234 A S S > S+ 0 0 77 -2,-0.3 3,-1.3 1,-0.1 -4,-0.1 0.269 72.3 109.4-118.2 6.8 102.2 9.9 22.4 223 235 A S T 3 S+ 0 0 81 -6,-0.3 -1,-0.1 1,-0.3 -5,-0.1 0.696 78.4 47.7 -57.6 -24.9 101.3 6.9 20.2 224 236 A L T 3 S+ 0 0 29 -7,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.557 86.9 114.1 -95.3 -8.7 97.9 6.3 22.0 225 237 A E < - 0 0 94 -3,-1.3 2,-0.3 12,-0.1 14,-0.2 -0.272 43.7-170.1 -65.9 145.9 96.8 10.0 21.9 226 238 A K E -N 238 0E 97 12,-1.9 12,-3.0 2,-0.0 2,-0.3 -0.988 16.4-130.1-136.3 144.8 93.7 11.1 19.9 227 239 A S E -N 237 0E 89 -2,-0.3 2,-0.4 10,-0.2 10,-0.2 -0.706 17.6-166.5 -97.3 148.5 92.5 14.6 19.1 228 240 A Y E -N 236 0E 37 8,-2.8 8,-3.1 -2,-0.3 2,-0.5 -1.000 11.0-143.2-134.2 135.2 89.0 15.7 19.6 229 241 A E E -N 235 0E 137 -2,-0.4 6,-0.2 6,-0.2 2,-0.1 -0.861 8.6-145.3-105.2 127.9 87.5 18.9 18.2 230 242 A L > - 0 0 25 4,-3.0 3,-2.3 -2,-0.5 -34,-0.0 -0.474 32.0-107.1 -81.9 159.0 85.0 21.0 20.1 231 243 A K T 3 S+ 0 0 115 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.900 121.7 58.3 -53.4 -41.9 82.2 22.8 18.2 232 244 A D T 3 S- 0 0 128 1,-0.1 -1,-0.3 2,-0.1 -2,-0.0 0.310 124.5-105.7 -72.4 10.8 84.0 26.2 18.8 233 245 A G S < S+ 0 0 40 -3,-2.3 2,-0.2 1,-0.3 -2,-0.1 0.272 71.2 144.7 86.6 -12.4 87.0 24.6 17.0 234 246 A Q - 0 0 95 -5,-0.1 -4,-3.0 1,-0.1 2,-0.6 -0.426 40.2-144.9 -65.4 131.1 89.2 24.0 20.0 235 247 A V E -N 229 0E 86 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.855 19.3-176.4 -99.6 125.1 91.3 20.9 19.6 236 248 A I E -N 228 0E 3 -8,-3.1 -8,-2.8 -2,-0.6 2,-0.4 -0.935 17.2-134.4-121.6 144.9 91.9 18.9 22.7 237 249 A T E -N 227 0E 57 -2,-0.4 2,-0.5 -10,-0.2 -10,-0.2 -0.786 10.4-159.9-101.2 140.6 94.0 15.7 23.1 238 250 A I E +N 226 0E 4 -12,-3.0 -12,-1.9 -2,-0.4 -57,-0.0 -0.976 20.0 161.5-120.6 120.4 93.0 12.6 25.0 239 251 A G S > S- 0 0 9 -2,-0.5 3,-1.9 -14,-0.2 4,-0.3 0.540 70.1 -4.3-103.5-110.9 95.7 10.2 26.1 240 252 A N T >> S+ 0 0 23 1,-0.3 4,-2.8 2,-0.2 3,-0.7 0.631 117.2 79.5 -65.2 -8.8 95.4 7.5 28.8 241 253 A E H 3> S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.821 79.5 72.2 -64.9 -27.6 91.9 8.8 29.6 242 254 A R H <4 S+ 0 0 33 -3,-1.9 -36,-2.1 1,-0.2 -1,-0.2 0.891 116.6 16.4 -53.2 -43.8 90.9 6.8 26.6 243 255 A F H <> S+ 0 0 0 -3,-0.7 4,-1.2 -4,-0.3 -35,-0.3 0.689 116.5 68.5-104.9 -22.4 91.4 3.5 28.4 244 256 A R H < S+ 0 0 40 -4,-2.8 4,-0.4 1,-0.2 -3,-0.2 0.820 98.0 57.9 -65.5 -29.2 91.4 4.8 32.1 245 257 A C T >< S+ 0 0 0 -4,-1.7 3,-1.4 -5,-0.2 -1,-0.2 0.978 110.1 36.9 -66.6 -59.4 87.7 5.6 31.7 246 258 A P G >4 S+ 0 0 0 0, 0.0 3,-1.9 0, 0.0 4,-0.4 0.695 100.0 80.3 -70.0 -11.9 86.3 2.2 30.8 247 259 A E G >X S+ 0 0 8 -4,-1.2 4,-2.0 1,-0.3 3,-1.0 0.750 75.7 75.1 -62.9 -22.9 88.8 0.5 33.1 248 260 A A G <4 S+ 0 0 0 -3,-1.4 -1,-0.3 -4,-0.4 7,-0.2 0.676 84.1 65.6 -62.4 -19.3 86.4 1.5 36.0 249 261 A L G <4 S+ 0 0 0 -3,-1.9 13,-1.8 1,-0.2 -1,-0.3 0.873 110.4 35.0 -70.3 -36.8 84.2 -1.4 34.8 250 262 A F T <4 S+ 0 0 8 -3,-1.0 11,-0.6 -4,-0.4 -2,-0.2 0.743 131.7 33.0 -87.4 -26.8 86.8 -3.9 35.7 251 263 A Q >< + 0 0 79 -4,-2.0 3,-1.9 9,-0.1 -1,-0.3 -0.727 64.2 178.9-133.0 83.4 88.0 -1.9 38.8 252 264 A P G > >S+ 0 0 1 0, 0.0 3,-2.5 0, 0.0 5,-1.7 0.718 72.1 81.2 -55.6 -23.3 85.0 -0.0 40.3 253 265 A S G > 5S+ 0 0 58 1,-0.3 3,-2.7 3,-0.2 -5,-0.1 0.775 73.7 72.9 -56.1 -29.1 87.4 1.3 43.0 254 266 A F G < 5S+ 0 0 84 -3,-1.9 -1,-0.3 1,-0.3 -6,-0.1 0.710 104.1 43.1 -59.5 -16.0 88.6 4.0 40.6 255 267 A L G < 5S- 0 0 44 -3,-2.5 -1,-0.3 2,-0.2 -2,-0.2 0.184 126.0-100.9-112.4 12.5 85.1 5.4 41.3 256 268 A G T < 5S+ 0 0 69 -3,-2.7 2,-0.4 1,-0.3 -3,-0.2 0.610 80.2 137.8 78.1 10.4 85.2 4.8 45.1 257 269 A M < - 0 0 49 -5,-1.7 -1,-0.3 1,-0.1 -2,-0.2 -0.748 44.5-162.1 -94.8 137.2 83.0 1.8 44.6 258 270 A E + 0 0 173 -2,-0.4 -1,-0.1 -3,-0.1 -5,-0.1 0.603 57.9 109.9 -90.4 -12.9 83.7 -1.4 46.6 259 271 A A S S- 0 0 47 -7,-0.1 -6,-0.2 1,-0.1 2,-0.1 -0.175 75.7-105.9 -58.3 154.1 81.6 -3.7 44.2 260 272 A C - 0 0 39 1,-0.1 -9,-0.1 -8,-0.1 -1,-0.1 -0.472 41.3 -91.7 -83.7 160.0 83.6 -6.1 42.1 261 273 A G > - 0 0 1 -11,-0.6 4,-2.0 -2,-0.1 -11,-0.3 0.157 38.2 -96.3 -59.8 179.8 84.1 -5.5 38.3 262 274 A I H > S+ 0 0 3 -13,-1.8 4,-1.9 2,-0.2 5,-0.2 0.872 123.0 52.6 -68.4 -37.0 82.0 -6.8 35.4 263 275 A H H > S+ 0 0 19 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.920 113.4 42.8 -64.5 -44.5 84.2 -9.8 34.9 264 276 A E H > S+ 0 0 80 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.833 112.3 53.5 -72.0 -32.8 84.0 -10.9 38.5 265 277 A T H X S+ 0 0 11 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.851 108.8 50.3 -69.9 -34.2 80.2 -10.2 38.7 266 278 A T H >X S+ 0 0 1 -4,-1.9 4,-1.9 2,-0.2 3,-0.5 0.953 111.2 47.9 -65.9 -51.2 79.7 -12.4 35.6 267 279 A Y H 3X S+ 0 0 56 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.877 108.7 55.1 -56.7 -41.5 81.8 -15.2 37.2 268 280 A N H 3X S+ 0 0 56 -4,-2.2 4,-0.9 1,-0.2 -1,-0.2 0.821 106.5 50.3 -65.3 -30.7 79.8 -14.8 40.4 269 281 A S H << S+ 0 0 0 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.868 109.2 52.2 -73.3 -36.1 76.5 -15.3 38.6 270 282 A I H >< S+ 0 0 0 -4,-1.9 3,-1.8 1,-0.2 -2,-0.2 0.934 107.5 51.5 -63.9 -44.1 77.8 -18.4 36.9 271 283 A M H 3< S+ 0 0 72 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.753 99.9 63.0 -65.6 -25.5 78.9 -19.9 40.3 272 284 A K T 3< S+ 0 0 124 -4,-0.9 -1,-0.3 -110,-0.2 2,-0.2 0.454 95.7 87.6 -77.7 1.2 75.4 -19.3 41.7 273 285 A C S < S- 0 0 7 -3,-1.8 5,-0.1 1,-0.1 -3,-0.0 -0.663 98.8 -80.0-103.0 158.1 74.2 -21.7 39.0 274 286 A D >> - 0 0 103 -2,-0.2 3,-3.0 1,-0.2 4,-0.7 -0.309 42.3-127.1 -53.0 122.4 73.8 -25.5 39.0 275 287 A V T 34 S+ 0 0 95 1,-0.3 4,-0.4 2,-0.2 3,-0.3 0.714 104.7 73.1 -47.2 -21.0 77.4 -26.8 38.3 276 288 A D T 34 S+ 0 0 121 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.674 104.6 33.3 -72.4 -15.8 75.9 -28.8 35.5 277 289 A I T <> S+ 0 0 7 -3,-3.0 4,-1.8 -7,-0.1 -1,-0.2 0.408 86.8 96.1-119.1 -0.9 75.3 -25.7 33.2 278 290 A R H X S+ 0 0 57 -4,-0.7 4,-2.5 -3,-0.3 5,-0.2 0.849 84.4 56.4 -59.4 -33.1 78.3 -23.5 34.2 279 291 A K H > S+ 0 0 124 -4,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.949 105.4 49.2 -63.3 -48.7 80.2 -24.9 31.2 280 292 A D H 4 S+ 0 0 69 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.842 113.6 49.0 -57.4 -35.5 77.4 -23.8 28.7 281 293 A L H >< S+ 0 0 0 -4,-1.8 3,-0.9 2,-0.2 -142,-0.5 0.881 108.3 51.9 -72.2 -41.8 77.5 -20.4 30.4 282 294 A Y H >< S+ 0 0 3 -4,-2.5 34,-2.2 1,-0.3 3,-0.5 0.879 112.7 45.3 -62.4 -39.8 81.3 -20.0 30.1 283 295 A A T 3< S+ 0 0 28 -4,-2.2 -1,-0.3 32,-0.3 -2,-0.2 0.441 118.9 46.9 -83.2 -0.4 81.2 -20.8 26.4 284 296 A N T < + 0 0 37 -3,-0.9 -145,-2.4 -5,-0.2 2,-0.9 -0.363 64.3 150.8-141.6 59.2 78.3 -18.5 26.0 285 297 A T E < -jm 139 317D 0 31,-2.1 33,-2.9 -3,-0.5 2,-0.5 -0.824 29.5-161.7 -94.8 106.6 78.9 -15.2 27.8 286 298 A V E -jm 140 318D 2 -147,-2.2 -145,-3.1 -2,-0.9 2,-0.2 -0.811 8.1-145.0-100.3 123.0 77.0 -12.6 25.8 287 299 A L E +j 141 0D 1 31,-2.6 2,-0.3 -2,-0.5 -145,-0.2 -0.572 25.0 173.5 -81.1 141.6 77.7 -8.8 26.0 288 300 A S E +j 142 0D 0 -147,-2.4 -145,-2.3 -2,-0.2 36,-0.1 -0.990 29.6 43.3-148.2 153.5 74.7 -6.5 25.7 289 301 A G S > S- 0 0 8 34,-2.2 3,-1.4 -2,-0.3 -145,-0.2 0.019 86.4 -77.9 95.4 156.9 74.0 -2.8 26.0 290 302 A G G > S+ 0 0 33 34,-0.3 3,-1.4 1,-0.3 -146,-0.2 0.803 123.0 62.9 -62.8 -30.5 75.8 0.4 24.9 291 303 A T G > S+ 0 0 9 -148,-1.7 3,-0.5 1,-0.3 -1,-0.3 0.626 94.0 61.2 -72.9 -11.5 78.4 0.2 27.6 292 304 A T G < S+ 0 0 1 -3,-1.4 -1,-0.3 -149,-0.5 -2,-0.2 0.259 82.4 91.1 -94.6 12.4 79.7 -3.1 26.3 293 305 A M G < + 0 0 58 -3,-1.4 -1,-0.2 4,-0.1 -2,-0.1 0.587 50.4 121.4 -83.3 -13.0 80.6 -1.2 23.1 294 306 A Y S X S- 0 0 16 -3,-0.5 3,-1.7 -4,-0.1 4,-0.3 -0.232 73.4-108.7 -54.3 134.1 84.2 -0.2 24.0 295 307 A P T 3 S+ 0 0 86 0, 0.0 -88,-2.7 0, 0.0 -1,-0.1 -0.407 104.4 21.8 -62.0 142.4 86.7 -1.5 21.5 296 308 A G T 3> S+ 0 0 38 -90,-0.2 4,-1.4 -3,-0.1 5,-0.2 0.314 86.1 115.0 84.3 -9.0 88.8 -4.2 23.2 297 309 A I H <> S+ 0 0 2 -3,-1.7 4,-2.6 1,-0.2 5,-0.2 0.874 73.5 54.4 -62.9 -37.8 86.2 -5.1 25.9 298 310 A A H > S+ 0 0 24 -4,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.960 108.9 44.6 -61.9 -54.7 85.6 -8.6 24.5 299 311 A D H > S+ 0 0 114 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.797 114.9 51.3 -61.0 -29.0 89.2 -9.8 24.5 300 312 A R H X S+ 0 0 14 -4,-1.4 4,-2.7 2,-0.2 5,-0.2 0.905 109.1 48.7 -74.8 -42.4 89.6 -8.2 28.0 301 313 A M H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.913 111.1 53.2 -61.0 -41.0 86.6 -10.1 29.3 302 314 A Q H X S+ 0 0 64 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.935 111.9 43.3 -57.6 -51.5 88.1 -13.2 27.8 303 315 A K H X S+ 0 0 86 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.905 117.7 44.7 -63.2 -45.4 91.4 -12.8 29.5 304 316 A E H X S+ 0 0 37 -4,-2.7 4,-1.1 2,-0.2 -2,-0.2 0.897 113.8 47.4 -68.8 -43.4 89.9 -11.8 32.9 305 317 A I H >X S+ 0 0 0 -4,-3.0 4,-2.3 -5,-0.2 3,-0.8 0.934 110.1 55.4 -62.9 -44.4 87.2 -14.5 33.0 306 318 A T H 3< S+ 0 0 67 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.881 104.3 52.9 -54.4 -42.6 89.8 -17.1 32.0 307 319 A A H 3< S+ 0 0 80 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.789 113.8 44.3 -65.9 -27.2 92.0 -16.1 35.0 308 320 A L H << S+ 0 0 58 -4,-1.1 -2,-0.2 -3,-0.8 -1,-0.2 0.802 104.7 69.4 -86.9 -33.3 89.0 -16.6 37.3 309 321 A A S < S- 0 0 10 -4,-2.3 6,-0.0 1,-0.2 4,-0.0 -0.406 99.9 -75.9 -86.5 162.5 87.7 -20.0 35.9 310 322 A P > - 0 0 68 0, 0.0 3,-2.7 0, 0.0 -1,-0.2 -0.271 42.8-118.6 -56.8 140.8 89.3 -23.4 36.1 311 323 A S T 3 S+ 0 0 124 1,-0.3 -2,-0.1 -4,-0.1 -3,-0.0 0.746 114.4 57.8 -52.2 -29.0 92.2 -23.8 33.7 312 324 A T T 3 S+ 0 0 124 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.397 85.4 112.2 -84.8 4.6 90.3 -26.7 32.0 313 325 A M < - 0 0 32 -3,-2.7 2,-0.7 -7,-0.1 -4,-0.1 -0.634 65.0-135.4 -87.3 134.2 87.3 -24.4 31.2 314 326 A K - 0 0 169 -2,-0.3 2,-0.4 2,-0.0 -2,-0.1 -0.762 26.5-165.1 -87.4 115.2 86.4 -23.3 27.6 315 327 A I + 0 0 14 -2,-0.7 2,-0.3 -32,-0.1 -32,-0.3 -0.815 13.3 172.8-105.6 143.1 85.7 -19.6 27.7 316 328 A K - 0 0 113 -34,-2.2 -31,-2.1 -2,-0.4 2,-0.6 -0.900 15.4-160.5-152.7 118.9 84.0 -17.6 24.9 317 329 A I E -m 285 0D 22 -2,-0.3 2,-0.6 -33,-0.2 -31,-0.2 -0.885 10.4-157.3-101.4 120.2 82.8 -14.0 24.9 318 330 A I E -m 286 0D 22 -33,-2.9 -31,-2.6 -2,-0.6 -2,-0.0 -0.876 11.8-179.6 -99.7 120.0 80.2 -13.2 22.3 319 331 A A - 0 0 32 -2,-0.6 4,-0.1 -33,-0.2 -31,-0.1 -0.677 16.3-152.5-121.3 78.2 80.1 -9.5 21.4 320 332 A P > - 0 0 15 0, 0.0 3,-1.4 0, 0.0 6,-0.1 -0.114 16.8-129.6 -47.1 138.2 77.3 -9.0 18.7 321 333 A P T 3 S+ 0 0 109 0, 0.0 3,-0.3 0, 0.0 0, 0.0 0.894 107.7 43.8 -60.6 -40.2 78.0 -6.0 16.5 322 334 A E T > S+ 0 0 92 1,-0.2 3,-2.0 2,-0.1 4,-0.3 -0.028 73.9 128.1 -96.7 33.4 74.6 -4.5 17.0 323 335 A R T < + 0 0 23 -3,-1.4 -34,-2.2 1,-0.3 4,-0.3 0.524 56.1 77.3 -67.9 -3.7 74.6 -5.1 20.8 324 336 A K T 3 S+ 0 0 91 -3,-0.3 -34,-0.3 1,-0.2 -1,-0.3 0.670 114.6 21.6 -77.3 -12.4 73.6 -1.5 21.5 325 337 A Y S <> S+ 0 0 77 -3,-2.0 4,-2.9 -36,-0.1 -2,-0.2 0.238 86.7 114.6-135.0 11.2 70.1 -2.6 20.4 326 338 A S H > S+ 0 0 4 -4,-0.3 4,-3.3 1,-0.2 5,-0.2 0.845 77.2 57.5 -54.1 -36.4 70.1 -6.3 20.9 327 339 A V H > S+ 0 0 11 -4,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.975 111.0 40.7 -58.9 -55.9 67.5 -6.0 23.7 328 340 A W H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.916 116.1 52.0 -57.8 -45.6 65.1 -4.2 21.3 329 341 A I H X S+ 0 0 24 -4,-2.9 4,-2.6 1,-0.3 -1,-0.2 0.919 106.1 52.4 -58.6 -46.4 66.0 -6.6 18.5 330 342 A G H X S+ 0 0 0 -4,-3.3 4,-2.8 1,-0.3 -1,-0.3 0.852 109.5 51.8 -58.4 -32.3 65.4 -9.6 20.7 331 343 A G H X S+ 0 0 0 -4,-1.6 4,-2.5 -5,-0.2 -1,-0.3 0.885 106.8 51.8 -70.2 -38.9 62.0 -8.1 21.4 332 344 A S H X S+ 0 0 6 -4,-2.1 4,-0.7 1,-0.2 -2,-0.2 0.903 113.6 45.6 -62.8 -40.9 61.3 -7.7 17.7 333 345 A I H >< S+ 0 0 67 -4,-2.6 3,-0.6 2,-0.2 -2,-0.2 0.946 114.5 46.4 -67.3 -50.1 62.2 -11.4 17.3 334 346 A L H >< S+ 0 0 19 -4,-2.8 3,-2.1 1,-0.2 6,-0.2 0.905 104.5 59.1 -60.9 -47.1 60.1 -12.6 20.3 335 347 A A H 3< S+ 0 0 4 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.776 108.3 47.6 -55.9 -27.4 56.9 -10.6 19.5 336 348 A S T << S+ 0 0 75 -4,-0.7 2,-0.3 -3,-0.6 -1,-0.3 0.396 84.0 119.7 -95.9 3.8 56.7 -12.4 16.1 337 349 A L X> - 0 0 71 -3,-2.1 3,-1.3 -4,-0.2 4,-1.3 -0.540 61.3-142.5 -73.6 127.4 57.3 -15.9 17.5 338 350 A S G >4 S+ 0 0 105 -2,-0.3 3,-0.7 1,-0.3 4,-0.5 0.916 104.9 49.6 -52.5 -47.7 54.4 -18.3 16.8 339 351 A T G 34 S+ 0 0 107 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.665 106.6 59.1 -68.5 -14.4 54.9 -19.9 20.2 340 352 A F G X> S+ 0 0 10 -3,-1.3 3,-2.8 -6,-0.2 4,-0.8 0.773 82.2 80.5 -86.0 -25.6 54.9 -16.4 21.8 341 353 A Q G X< S+ 0 0 86 -4,-1.3 3,-0.6 -3,-0.7 -1,-0.2 0.827 86.7 59.1 -49.1 -38.3 51.4 -15.4 20.6 342 354 A Q G 34 S+ 0 0 141 -4,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.546 98.8 61.1 -71.3 -5.9 49.8 -17.3 23.4 343 355 A M G <4 S+ 0 0 64 -3,-2.8 -1,-0.2 2,-0.1 -2,-0.2 0.797 74.3 107.8 -91.3 -31.2 51.7 -15.2 26.0 344 356 A W S << S- 0 0 21 -4,-0.8 2,-0.8 -3,-0.6 -223,-0.2 -0.068 75.2-123.7 -42.9 146.7 50.3 -11.8 25.0 345 357 A I E -E 120 0A 0 -225,-2.8 -225,-1.5 3,-0.0 -1,-0.1 -0.893 28.7-146.6 -98.2 109.2 47.9 -10.6 27.7 346 358 A S E > -E 119 0A 32 -2,-0.8 4,-1.0 -227,-0.2 -227,-0.2 -0.378 21.1-118.8 -73.4 157.3 44.7 -9.9 25.9 347 359 A K H > S+ 0 0 100 -229,-1.8 4,-2.6 1,-0.2 5,-0.2 0.836 119.6 57.0 -64.0 -28.5 42.5 -7.1 27.1 348 360 A Q H > S+ 0 0 144 -230,-0.3 4,-2.0 1,-0.2 5,-0.2 0.955 104.1 49.6 -65.0 -48.5 39.9 -9.8 27.6 349 361 A E H > S+ 0 0 62 1,-0.2 4,-1.1 2,-0.2 5,-0.3 0.690 113.0 50.9 -63.4 -17.3 42.3 -11.7 29.9 350 362 A Y H X S+ 0 0 14 -4,-1.0 4,-1.9 3,-0.2 -2,-0.2 0.884 106.4 50.0 -85.8 -44.2 42.8 -8.3 31.7 351 363 A D H < S+ 0 0 123 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.1 0.859 120.3 38.1 -62.5 -36.3 39.1 -7.5 32.2 352 364 A E H < S+ 0 0 171 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.978 130.0 25.1 -78.2 -63.8 38.5 -10.9 33.7 353 365 A S H < S- 0 0 59 -4,-1.1 3,-0.3 -5,-0.2 -3,-0.2 0.741 98.8-146.0 -76.7 -25.4 41.7 -11.6 35.7 354 366 A G >< - 0 0 16 -4,-1.9 3,-2.4 -5,-0.3 4,-0.2 -0.264 48.6 -39.1 86.2-177.3 42.7 -8.0 36.4 355 367 A P G > S+ 0 0 38 0, 0.0 3,-2.3 0, 0.0 4,-0.2 0.833 129.1 72.2 -51.6 -35.0 46.2 -6.5 36.6 356 368 A S G > S+ 0 0 60 -3,-0.3 3,-1.0 1,-0.3 4,-0.3 0.563 73.7 85.1 -59.4 -8.2 47.3 -9.6 38.5 357 369 A I G X> S+ 0 0 12 -3,-2.4 4,-1.8 1,-0.2 3,-0.9 0.726 75.8 72.0 -66.3 -20.4 47.1 -11.5 35.2 358 370 A V H <>>S+ 0 0 0 -3,-2.3 4,-2.0 1,-0.2 5,-1.9 0.847 89.9 56.2 -64.0 -36.1 50.6 -10.2 34.6 359 371 A H H <45S+ 0 0 70 -3,-1.0 -1,-0.2 4,-0.3 -2,-0.2 0.641 109.0 49.0 -73.1 -12.6 52.1 -12.6 37.2 360 372 A R H <45S+ 0 0 126 -3,-0.9 -2,-0.2 -4,-0.3 -1,-0.2 0.913 125.6 20.6 -91.1 -52.3 50.6 -15.6 35.4 361 373 A K H <5S+ 0 0 36 -4,-1.8 -2,-0.2 -18,-0.0 -3,-0.2 0.742 138.4 29.3 -89.2 -25.7 51.6 -15.0 31.7 362 374 A C T <5 0 0 13 -4,-2.0 -3,-0.2 -5,-0.4 -4,-0.1 0.885 360.0 360.0 -99.6 -52.7 54.5 -12.6 32.4 363 375 A F < 0 0 73 -5,-1.9 -4,-0.3 -240,-0.1 -3,-0.1 0.442 360.0 360.0 137.2 360.0 56.1 -13.5 35.8