==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CONTRACTILE PROTEIN 09-OCT-98 1YAG . COMPND 2 MOLECULE: PROTEIN (ACTIN); . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR S.VOROBIEV,B.STROKOPYTOV,C.FRIEDEN,S.C.ALMO . 497 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21624.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 352 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 13.3 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 . 1 0.2 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 . 38 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 125 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.0 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 2 1 1 2 0 1 1 1 3 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 1 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 PARALLEL BRIDGES PER LADDER . 0 4 1 4 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 0 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 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 0 245 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-135.4 42.2 -6.5 1.3 2 5 A V - 0 0 77 1,-0.1 2,-0.1 95,-0.0 96,-0.0 -0.714 360.0-121.6 -82.8 130.7 38.6 -6.7 0.2 3 6 A A - 0 0 39 -2,-0.4 2,-0.2 1,-0.1 17,-0.1 -0.425 22.5-120.9 -73.5 151.8 36.4 -4.9 2.8 4 7 A A - 0 0 7 94,-0.2 15,-2.9 340,-0.1 2,-0.4 -0.598 25.6-120.8 -85.9 156.1 33.7 -7.0 4.4 5 8 A L E -Ab 18 100A 0 94,-2.9 96,-2.9 13,-0.2 2,-0.4 -0.799 23.5-159.1 -97.6 143.4 30.1 -5.8 3.9 6 9 A V E +Ab 17 101A 0 11,-2.3 11,-1.6 -2,-0.4 2,-0.4 -0.992 12.2 177.2-125.7 124.1 28.1 -4.9 7.1 7 10 A I E -Ab 16 102A 0 94,-2.5 96,-1.1 -2,-0.4 2,-0.7 -0.988 15.4-165.3-132.3 126.9 24.3 -4.8 7.0 8 11 A D E -A 15 0A 10 7,-2.9 7,-2.0 -2,-0.4 2,-1.5 -0.930 17.2-150.8-109.0 107.7 22.0 -4.2 10.0 9 12 A N E -A 14 0A 7 -2,-0.7 5,-0.2 94,-0.3 96,-0.1 -0.598 18.6-174.2 -86.6 87.5 18.6 -5.2 8.9 10 13 A G - 0 0 13 -2,-1.5 58,-0.1 3,-1.1 20,-0.0 -0.342 35.0-122.1 -74.8 158.9 16.2 -3.1 10.9 11 14 A S S S+ 0 0 15 1,-0.1 57,-0.3 145,-0.1 -1,-0.1 0.857 113.4 19.2 -66.5 -36.6 12.4 -3.6 10.8 12 15 A G S S+ 0 0 11 1,-0.3 18,-2.8 17,-0.1 2,-0.4 0.859 132.0 28.5-100.8 -50.0 12.1 0.0 9.5 13 16 A M E - C 0 29A 70 16,-0.3 -3,-1.1 17,-0.1 2,-0.4 -0.948 61.7-146.9-123.9 134.0 15.5 1.0 8.2 14 17 A C E -AC 9 28A 0 14,-3.4 14,-2.2 -2,-0.4 2,-0.5 -0.804 13.4-160.8 -92.4 133.3 18.3 -1.0 6.6 15 18 A K E +AC 8 27A 28 -7,-2.0 -7,-2.9 -2,-0.4 2,-0.3 -0.984 20.1 170.4-114.0 121.2 21.8 0.3 7.4 16 19 A A E +AC 7 26A 0 10,-3.5 10,-2.8 -2,-0.5 9,-0.5 -0.963 10.2 114.7-135.0 151.1 24.4 -1.0 5.0 17 20 A G E -A 6 0A 0 -11,-1.6 -11,-2.3 -2,-0.3 2,-0.4 -0.964 56.9 -59.3 179.3-163.4 28.0 -0.2 4.2 18 21 A F E > -A 5 0A 21 5,-0.3 3,-2.0 -2,-0.3 -13,-0.2 -0.887 50.7-106.5-111.0 136.4 31.6 -1.4 4.2 19 22 A A T 3 S+ 0 0 13 -15,-2.9 323,-0.1 -2,-0.4 322,-0.1 -0.336 107.7 36.8 -58.0 133.9 33.5 -2.5 7.3 20 23 A G T 3 S+ 0 0 11 1,-0.5 -1,-0.2 318,-0.1 2,-0.2 0.165 88.8 114.7 107.5 -19.6 36.1 0.2 8.3 21 24 A D < - 0 0 34 -3,-2.0 -1,-0.5 477,-0.2 477,-0.1 -0.585 70.0-132.1 -80.8 149.1 33.8 3.1 7.4 22 25 A D S S+ 0 0 103 -2,-0.2 -1,-0.1 -3,-0.1 316,-0.1 0.593 85.6 16.7 -80.4 -7.5 32.7 5.2 10.3 23 26 A A S S- 0 0 32 -5,-0.1 -5,-0.3 314,-0.1 2,-0.2 -0.989 94.2 -80.7-157.6 159.3 29.0 5.1 9.2 24 27 A P - 0 0 14 0, 0.0 -7,-0.3 0, 0.0 3,-0.1 -0.494 30.1-151.6 -67.7 127.6 26.6 3.2 7.0 25 28 A R S S+ 0 0 164 -9,-0.5 2,-0.4 -2,-0.2 -8,-0.2 0.824 85.3 37.7 -65.9 -35.8 26.9 4.4 3.3 26 29 A A E +C 16 0A 7 -10,-2.8 -10,-3.5 2,-0.0 2,-0.4 -0.984 60.4 170.6-124.4 129.5 23.3 3.4 2.6 27 30 A V E +C 15 0A 45 -2,-0.4 -12,-0.2 -12,-0.2 -14,-0.0 -0.972 24.5 148.0-134.2 113.8 20.4 3.9 5.1 28 31 A F E -C 14 0A 1 -14,-2.2 -14,-3.4 -2,-0.4 24,-0.1 -0.978 51.3 -75.5-149.0 158.7 17.0 3.2 3.5 29 32 A P E -C 13 0A 17 0, 0.0 2,-2.1 0, 0.0 23,-0.4 -0.286 40.0-124.8 -57.6 135.7 13.5 1.9 4.3 30 33 A S + 0 0 0 -18,-2.8 38,-0.3 21,-0.1 2,-0.3 -0.509 66.9 128.1 -81.7 72.7 13.3 -1.9 4.6 31 34 A I - 0 0 1 -2,-2.1 21,-1.9 35,-0.1 2,-0.5 -0.968 46.7-156.6-132.9 145.6 10.5 -2.1 2.0 32 35 A V E -FG 51 65B 0 33,-2.4 33,-1.9 -2,-0.3 2,-0.4 -0.989 17.8-162.4-120.4 127.8 9.9 -4.2 -1.2 33 36 A G E -FG 50 64B 0 17,-3.6 17,-2.6 -2,-0.5 31,-0.2 -0.896 7.4-174.2-113.6 143.6 7.5 -2.7 -3.7 34 37 A R E - G 0 63B 58 29,-1.0 29,-2.7 -2,-0.4 15,-0.1 -0.994 31.7-105.4-135.3 141.3 5.8 -4.5 -6.5 35 38 A P E - G 0 62B 25 0, 0.0 3,-0.4 0, 0.0 27,-0.2 -0.431 13.6-151.6 -66.3 136.5 3.6 -3.2 -9.3 36 39 A R S S+ 0 0 166 25,-1.5 2,-0.4 1,-0.3 26,-0.1 0.901 99.1 10.9 -70.2 -41.9 -0.1 -3.9 -8.9 37 40 A H S S- 0 0 85 24,-0.5 -1,-0.3 7,-0.1 2,-0.1 -0.906 89.7-146.6-137.5 103.7 -0.3 -3.8 -12.7 38 41 A Q - 0 0 63 -2,-0.4 8,-0.2 -3,-0.4 7,-0.2 -0.405 15.6-153.5 -73.4 149.8 3.2 -3.7 -14.4 39 42 A G - 0 0 35 6,-2.9 -1,-0.1 2,-0.2 6,-0.1 -0.287 24.3-126.2-109.8-166.1 3.7 -1.8 -17.6 40 43 A I S S+ 0 0 95 -2,-0.1 2,-0.3 2,-0.1 6,-0.1 0.233 82.1 68.7-124.8 8.9 6.0 -1.8 -20.7 41 44 A M S > S- 0 0 133 1,-0.0 3,-2.2 0, 0.0 4,-0.5 -0.880 89.6 -79.3-135.5 164.8 7.1 1.8 -20.4 42 45 A V T 3 S+ 0 0 86 -2,-0.3 -2,-0.1 1,-0.3 -1,-0.0 -0.371 116.8 8.4 -60.5 121.1 9.2 4.4 -18.5 43 46 A G T 3 S+ 0 0 65 -2,-0.2 -1,-0.3 -4,-0.0 0, 0.0 0.563 108.2 94.0 84.4 8.2 7.3 5.6 -15.5 44 47 A M S < S- 0 0 118 -3,-2.2 -2,-0.2 17,-0.0 -7,-0.1 0.539 106.7 -91.1-106.6 -11.4 4.6 2.9 -15.9 45 48 A G + 0 0 2 -4,-0.5 -6,-2.9 -7,-0.2 -3,-0.1 0.868 61.8 160.8 97.0 64.9 6.0 0.2 -13.6 46 49 A Q + 0 0 85 -8,-0.2 2,-0.3 -5,-0.2 -4,-0.1 0.617 50.0 83.2 -90.2 -18.5 8.2 -1.9 -15.9 47 50 A K S S- 0 0 108 1,-0.1 -8,-0.1 0, 0.0 3,-0.1 -0.719 75.5-135.5 -93.6 142.5 10.3 -3.5 -13.2 48 51 A D S S+ 0 0 134 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.550 84.9 10.6 -72.2 -7.3 9.1 -6.6 -11.2 49 52 A S - 0 0 41 -15,-0.1 2,-0.3 2,-0.0 -15,-0.2 -0.968 56.3-159.9-169.8 151.5 10.2 -5.1 -7.9 50 53 A Y E -F 33 0B 7 -17,-2.6 -17,-3.6 -2,-0.3 2,-0.4 -0.960 13.1-159.3-132.1 149.2 11.5 -1.9 -6.2 51 54 A V E > -F 32 0B 6 -2,-0.3 3,-0.8 -19,-0.2 4,-0.4 -0.969 47.1 -22.2-133.9 148.7 13.3 -1.6 -2.9 52 55 A G T 3> S+ 0 0 0 -21,-1.9 4,-2.4 -2,-0.4 3,-0.3 -0.224 120.7 5.0 66.1-140.8 13.9 1.2 -0.5 53 56 A D H 3> S+ 0 0 95 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.860 131.8 52.3 -49.9 -42.6 13.6 4.8 -1.3 54 57 A E H <> S+ 0 0 73 -3,-0.8 4,-1.9 2,-0.2 -1,-0.2 0.896 108.1 49.0 -64.0 -43.3 12.4 4.1 -4.8 55 58 A A H 4 S+ 0 0 0 -4,-0.4 -1,-0.2 -3,-0.3 -2,-0.2 0.926 113.4 50.2 -62.2 -41.0 9.6 1.8 -3.7 56 59 A Q H >< S+ 0 0 30 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.935 110.9 46.1 -62.3 -47.7 8.6 4.5 -1.3 57 60 A S H 3< S+ 0 0 89 -4,-2.8 3,-0.4 1,-0.3 -1,-0.2 0.769 109.2 55.8 -69.5 -25.1 8.6 7.3 -3.9 58 61 A K T >X S+ 0 0 69 -4,-1.9 3,-1.1 1,-0.2 4,-0.9 -0.064 70.1 131.1 -98.2 34.9 6.7 5.2 -6.4 59 62 A R G X4 + 0 0 81 -3,-1.1 3,-0.8 1,-0.2 -1,-0.2 0.865 58.1 67.6 -51.0 -47.8 3.9 4.5 -3.8 60 63 A G G 34 S+ 0 0 66 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.807 114.1 26.7 -47.2 -36.7 1.1 5.4 -6.2 61 64 A I G <4 S+ 0 0 71 -3,-1.1 -25,-1.5 -25,-0.0 -24,-0.5 0.460 111.3 72.1-111.5 -0.5 1.7 2.4 -8.4 62 65 A L E << -G 35 0B 2 -4,-0.9 2,-0.6 -3,-0.8 -29,-0.1 -0.737 67.5-131.4-115.8 164.7 3.3 -0.2 -6.1 63 66 A T E -G 34 0B 60 -29,-2.7 -29,-1.0 -2,-0.3 2,-0.2 -0.946 33.1-146.2-112.9 106.8 2.2 -2.5 -3.3 64 67 A L E -G 33 0B 44 -2,-0.6 2,-0.3 -31,-0.2 -31,-0.2 -0.454 16.7-173.9 -78.8 143.2 4.7 -2.1 -0.4 65 68 A R E -G 32 0B 130 -33,-1.9 -33,-2.4 -2,-0.2 -2,-0.0 -0.995 19.2-148.1-139.0 145.9 5.8 -4.9 1.9 66 69 A Y - 0 0 114 -2,-0.3 -35,-0.1 -35,-0.2 8,-0.1 -0.917 8.8-172.1-114.1 102.7 7.9 -5.0 5.1 67 70 A P + 0 0 0 0, 0.0 7,-3.6 0, 0.0 8,-1.1 0.563 69.9 69.6 -70.7 -11.2 9.7 -8.5 5.3 68 71 A I E -H 73 0C 5 -38,-0.3 2,-0.5 -57,-0.3 5,-0.2 -0.954 59.6-179.5-115.4 119.4 11.0 -7.7 8.8 69 72 A E E > S-H 72 0C 106 3,-2.9 3,-1.8 -2,-0.5 -57,-0.0 -0.975 75.4 -14.6-120.2 119.2 8.6 -7.6 11.8 70 73 A H T 3 S- 0 0 62 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.854 128.7 -55.8 57.7 36.7 10.0 -6.8 15.3 71 74 A G T 3 S+ 0 0 11 1,-0.2 34,-0.7 -3,-0.1 2,-0.4 0.405 117.0 113.0 79.5 -3.3 13.5 -7.5 14.0 72 75 A I E < S-H 69 0C 37 -3,-1.8 -3,-2.9 32,-0.1 2,-0.4 -0.878 71.6-121.1-105.7 132.6 12.5 -11.0 12.8 73 76 A V E +H 68 0C 17 -2,-0.4 -5,-0.3 -5,-0.2 3,-0.1 -0.574 36.6 167.8 -71.2 123.9 12.4 -11.9 9.0 74 77 A T + 0 0 73 -7,-3.6 2,-0.3 -2,-0.4 -6,-0.2 0.436 66.2 46.3-116.6 -4.0 8.9 -13.0 8.2 75 78 A N > - 0 0 36 -8,-1.1 4,-1.8 1,-0.1 -1,-0.2 -0.825 60.1-177.3-141.1 97.9 9.0 -13.0 4.3 76 79 A W H > S+ 0 0 60 -2,-0.3 4,-2.3 2,-0.2 5,-0.2 0.827 81.5 55.6 -68.9 -34.1 12.0 -14.7 2.9 77 80 A D H > S+ 0 0 113 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.959 113.9 43.0 -61.6 -47.9 11.3 -14.0 -0.8 78 81 A D H > S+ 0 0 3 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.828 110.4 55.9 -67.8 -32.3 11.1 -10.3 0.0 79 82 A M H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.919 105.4 51.6 -66.7 -40.9 14.1 -10.4 2.3 80 83 A E H X S+ 0 0 66 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.851 107.6 53.3 -63.7 -34.2 16.2 -11.9 -0.5 81 84 A K H X S+ 0 0 79 -4,-1.4 4,-2.6 2,-0.2 -1,-0.2 0.906 109.6 48.0 -67.6 -41.8 15.1 -9.0 -2.8 82 85 A I H X S+ 0 0 0 -4,-2.0 4,-3.0 2,-0.2 -2,-0.2 0.945 114.0 46.6 -63.5 -44.1 16.1 -6.5 -0.3 83 86 A W H X S+ 0 0 1 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.925 111.9 50.2 -62.9 -44.8 19.5 -8.2 0.2 84 87 A H H X S+ 0 0 90 -4,-2.9 4,-2.4 1,-0.2 5,-0.4 0.958 113.5 46.4 -57.1 -50.1 20.0 -8.5 -3.6 85 88 A H H X>S+ 0 0 21 -4,-2.6 4,-2.6 1,-0.2 5,-1.7 0.928 109.7 55.0 -57.0 -48.3 19.2 -4.8 -4.0 86 89 A T H <>S+ 0 0 0 -4,-3.0 5,-3.1 3,-0.2 6,-0.4 0.925 115.0 38.2 -53.5 -49.2 21.5 -3.9 -1.0 87 90 A F H <>S+ 0 0 0 -4,-2.5 6,-2.1 3,-0.2 5,-1.1 0.994 127.4 30.7 -65.9 -61.5 24.5 -5.6 -2.6 88 91 A Y H <5S+ 0 0 85 -4,-2.4 -3,-0.2 4,-0.3 -2,-0.2 0.831 132.9 23.8 -71.7 -36.9 24.1 -4.8 -6.3 89 92 A N T <5S+ 0 0 98 -4,-2.6 -3,-0.2 -5,-0.4 -1,-0.1 0.775 129.8 33.1-102.4 -31.3 22.3 -1.4 -6.2 90 93 A E T - 0 0 28 -2,-0.3 3,-1.6 1,-0.1 4,-0.1 -0.762 25.2-140.8 -85.7 128.0 28.9 -8.6 -6.0 95 98 A P G > S+ 0 0 0 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 0.790 95.8 69.9 -59.5 -32.6 28.5 -10.5 -2.7 96 99 A E G 3 S+ 0 0 72 1,-0.3 29,-0.1 30,-0.2 28,-0.0 0.660 96.9 57.1 -62.6 -12.1 30.6 -13.5 -3.8 97 100 A E G < S+ 0 0 119 -3,-1.6 -1,-0.3 1,-0.1 29,-0.1 0.455 105.6 52.9 -97.9 -0.6 33.5 -11.2 -3.6 98 101 A H S < S- 0 0 25 -3,-2.2 30,-0.4 -4,-0.1 -94,-0.2 -0.987 77.8-115.9-143.2 143.6 33.1 -10.1 0.1 99 102 A P - 0 0 25 0, 0.0 -94,-2.9 0, 0.0 2,-0.5 -0.497 40.6-146.4 -66.6 144.8 32.8 -11.5 3.6 100 103 A V E -bd 5 129A 0 28,-2.5 30,-1.6 -96,-0.2 2,-0.6 -0.973 15.1-166.1-123.4 127.7 29.3 -10.5 4.8 101 104 A L E -bd 6 130A 0 -96,-2.9 -94,-2.5 -2,-0.5 2,-0.3 -0.956 13.5-177.7-110.2 119.3 28.4 -9.6 8.4 102 105 A L E -bd 7 131A 0 28,-2.5 30,-2.5 -2,-0.6 2,-0.3 -0.758 16.0-136.4-110.4 159.6 24.6 -9.4 9.1 103 106 A T E - d 0 132A 4 -96,-1.1 2,-0.3 -2,-0.3 -94,-0.3 -0.737 16.1-164.1-110.9 163.0 22.9 -8.5 12.4 104 107 A E E - 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0 0 0 -2,-0.3 4,-1.6 -24,-0.2 3,-0.3 -0.759 61.8 -55.2-149.0-162.3 8.6 0.8 19.3 179 182 A G H > S+ 0 0 1 -26,-2.8 4,-2.2 1,-0.2 5,-0.2 0.842 125.9 56.9 -54.4 -39.8 9.0 3.8 17.0 180 183 A R H > S+ 0 0 78 -26,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.938 108.5 48.2 -59.5 -44.2 6.3 2.7 14.6 181 184 A D H > S+ 0 0 36 -27,-0.4 4,-1.9 -3,-0.3 -1,-0.2 0.839 109.7 52.8 -63.8 -34.9 3.8 2.6 17.5 182 185 A L H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.876 108.2 49.3 -69.9 -38.6 4.9 6.1 18.6 183 186 A T H X S+ 0 0 2 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.941 112.6 47.9 -64.0 -48.3 4.4 7.6 15.2 184 187 A D H X S+ 0 0 65 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.877 112.5 50.2 -59.7 -38.5 0.9 6.1 15.0 185 188 A Y H X S+ 0 0 31 -4,-1.9 4,-2.2 2,-0.2 5,-0.2 0.896 110.0 47.7 -68.4 -41.2 0.2 7.4 18.5 186 189 A L H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 5,-0.2 0.838 108.4 57.6 -66.9 -31.7 1.3 10.9 17.8 187 190 A M H X S+ 0 0 28 -4,-2.0 4,-1.3 2,-0.2 10,-0.2 0.860 108.9 46.3 -64.5 -37.5 -0.9 10.7 14.6 188 191 A K H X S+ 0 0 104 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.923 115.5 41.9 -72.8 -48.1 -3.9 9.9 16.9 189 192 A I H < S+ 0 0 4 -4,-2.2 -2,-0.2 2,-0.2 4,-0.2 0.788 114.8 51.3 -73.5 -26.3 -3.4 12.7 19.5 190 193 A L H ><>S+ 0 0 0 -4,-2.0 3,-1.4 -5,-0.2 5,-1.4 0.892 108.6 53.8 -73.1 -38.0 -2.5 15.2 16.8 191 194 A S H ><5S+ 0 0 46 -4,-1.3 3,-1.0 1,-0.3 -2,-0.2 0.837 104.6 53.9 -63.1 -34.4 -5.7 14.2 15.1 192 195 A E T 3<5S+ 0 0 135 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.497 95.8 67.1 -81.3 -1.3 -7.6 14.8 18.2 193 196 A R T < 5S- 0 0 93 -3,-1.4 -1,-0.2 -4,-0.2 -2,-0.2 0.518 130.5 -90.0 -91.0 -6.9 -6.3 18.4 18.4 194 197 A G T < 5S+ 0 0 69 -3,-1.0 2,-0.2 1,-0.4 -3,-0.2 0.502 91.6 115.7 112.7 7.9 -8.2 19.1 15.3 195 198 A Y < - 0 0 63 -5,-1.4 2,-0.5 2,-0.0 -1,-0.4 -0.641 55.7-127.4-107.2 166.5 -5.7 18.2 12.6 196 199 A S + 0 0 90 -2,-0.2 2,-0.3 -4,-0.1 -5,-0.0 -0.936 35.3 148.0-124.0 123.1 -5.6 15.5 9.9 197 200 A F + 0 0 9 -2,-0.5 -6,-0.1 -10,-0.2 -7,-0.1 -0.923 22.0 123.9-146.7 114.8 -3.0 12.9 9.1 198 201 A S + 0 0 97 -2,-0.3 2,-0.1 -7,-0.0 -1,-0.1 0.446 53.4 80.7-145.4 -21.7 -4.0 9.5 7.8 199 202 A T S > S- 0 0 73 1,-0.1 4,-2.8 4,-0.0 5,-0.1 -0.334 90.7-103.9 -84.0 172.6 -2.2 9.0 4.5 200 203 A T H > S+ 0 0 65 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.851 121.6 49.0 -67.0 -35.2 1.4 7.8 4.3 201 204 A A H > S+ 0 0 51 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.862 114.1 47.0 -73.4 -34.7 2.8 11.4 3.4 202 205 A E H >> S+ 0 0 55 2,-0.2 4,-2.2 1,-0.2 3,-0.5 0.931 111.7 49.7 -70.7 -44.8 0.8 12.7 6.3 203 206 A R H 3X S+ 0 0 59 -4,-2.8 4,-2.1 1,-0.3 -2,-0.2 0.845 108.0 54.7 -61.1 -33.5 2.1 9.9 8.5 204 207 A E H 3X S+ 0 0 53 -4,-2.0 4,-1.6 2,-0.2 -1,-0.3 0.803 105.9 52.8 -69.1 -29.5 5.6 10.8 7.3 205 208 A I H S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 5,-1.0 0.911 111.9 50.8 -66.7 -40.7 7.1 16.0 14.0 210 213 A K H X5S+ 0 0 14 -4,-2.8 4,-0.8 1,-0.2 -2,-0.2 0.944 112.8 43.7 -60.7 -50.8 8.0 13.1 16.3 211 214 A E H <5S+ 0 0 100 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.632 125.4 33.3 -72.3 -13.8 11.7 13.1 15.4 212 215 A K H <5S+ 0 0 139 -4,-1.0 -2,-0.2 -3,-0.3 -3,-0.2 0.749 129.0 21.9-113.7 -32.2 12.0 16.9 15.6 213 216 A L H <5S+ 0 0 24 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.655 94.9 97.6-111.9 -21.3 9.7 18.3 18.3 214 217 A C << + 0 0 4 -5,-1.0 2,-0.3 -4,-0.8 38,-0.2 -0.228 43.8 168.2 -70.4 158.7 8.9 15.4 20.7 215 218 A Y - 0 0 28 36,-2.2 2,-0.6 88,-0.2 90,-0.2 -0.981 37.8-103.9-162.7 161.5 10.7 14.9 24.0 216 219 A V - 0 0 4 88,-3.1 2,-0.2 -2,-0.3 93,-0.1 -0.842 36.0-131.2 -96.8 126.9 10.5 12.9 27.2 217 220 A A - 0 0 1 -2,-0.6 3,-0.4 35,-0.4 4,-0.1 -0.546 2.6-142.8 -75.3 138.7 9.3 14.9 30.2 218 221 A L S S+ 0 0 89 1,-0.3 2,-0.4 -2,-0.2 -1,-0.1 0.933 99.9 15.7 -65.2 -45.0 11.3 14.6 33.4 219 222 A D S > S- 0 0 48 1,-0.2 4,-2.3 -3,-0.0 -1,-0.3 -0.893 76.2-161.4-131.6 100.9 8.1 14.7 35.4 220 223 A F H > S+ 0 0 40 -2,-0.4 4,-2.8 -3,-0.4 -1,-0.2 0.911 86.4 47.8 -44.3 -63.4 5.1 14.0 33.2 221 224 A E H > S+ 0 0 123 1,-0.3 4,-1.4 2,-0.2 5,-0.2 0.919 115.4 43.1 -46.4 -59.1 2.4 15.4 35.6 222 225 A Q H > S+ 0 0 104 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.840 113.8 53.8 -62.7 -29.7 4.2 18.6 36.3 223 226 A E H < S+ 0 0 32 -4,-2.3 4,-0.4 2,-0.2 3,-0.2 0.915 102.2 58.8 -69.2 -43.6 5.1 19.0 32.6 224 227 A M H >< S+ 0 0 55 -4,-2.8 3,-1.9 1,-0.2 4,-0.5 0.944 109.0 40.8 -48.6 -60.7 1.5 18.7 31.5 225 228 A Q H 3X S+ 0 0 107 -4,-1.4 4,-2.6 1,-0.3 5,-0.3 0.719 101.8 70.0 -66.2 -21.7 0.1 21.6 33.4 226 229 A T T 3< S+ 0 0 41 -4,-0.9 6,-0.4 1,-0.3 -1,-0.3 0.610 104.5 44.3 -70.2 -10.5 3.2 23.7 32.6 227 230 A A T <4 S+ 0 0 16 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.478 108.7 60.3-103.8 -15.3 1.7 23.6 29.1 228 231 A A T 4 S+ 0 0 80 -4,-0.5 -2,-0.2 -5,-0.2 -3,-0.1 0.933 114.9 29.8 -77.7 -47.9 -1.7 24.3 30.6 229 232 A Q S < S+ 0 0 159 -4,-2.6 2,-0.3 2,-0.0 -3,-0.1 0.571 126.8 36.3 -89.2 -11.5 -0.7 27.7 32.2 230 233 A S - 0 0 51 -5,-0.3 3,-0.2 -4,-0.1 0, 0.0 -0.872 57.9-143.0-138.4 169.1 1.9 28.6 29.6 231 234 A S S S+ 0 0 87 -2,-0.3 3,-0.1 1,-0.1 -4,-0.1 -0.128 73.5 113.0-119.0 30.4 2.7 28.5 25.9 232 235 A S S S+ 0 0 85 -6,-0.4 -1,-0.1 1,-0.2 -5,-0.1 0.738 77.0 44.6 -72.9 -28.5 6.4 27.9 26.9 233 236 A I S S+ 0 0 21 -7,-0.2 2,-0.3 -3,-0.2 -1,-0.2 0.523 89.2 107.7 -96.3 -10.4 6.4 24.4 25.6 234 237 A E - 0 0 68 -3,-0.1 2,-0.3 12,-0.1 14,-0.2 -0.532 43.4-178.0 -78.4 133.8 4.7 25.1 22.3 235 238 A K E -N 247 0E 118 12,-2.1 12,-2.2 -2,-0.3 2,-0.4 -0.867 23.7-123.6-122.5 156.4 6.7 25.0 19.1 236 239 A S E -N 246 0E 81 -2,-0.3 2,-0.5 10,-0.2 10,-0.3 -0.840 17.6-156.1-105.2 143.1 5.3 25.7 15.6 237 240 A Y E -N 245 0E 30 8,-3.6 8,-3.1 -2,-0.4 2,-0.8 -0.972 9.4-143.1-121.8 121.2 5.6 23.2 12.8 238 241 A E E -N 244 0E 134 -2,-0.5 6,-0.3 6,-0.3 5,-0.1 -0.719 21.5-142.0 -85.3 113.8 5.6 24.4 9.2 239 242 A L > - 0 0 18 4,-3.3 3,-1.6 -2,-0.8 -1,-0.0 -0.124 24.7-106.6 -67.8 165.8 3.7 21.8 7.1 240 243 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.828 120.6 60.9 -63.2 -30.7 4.8 20.9 3.5 241 244 A D T 3 S- 0 0 108 2,-0.1 2,-0.3 1,-0.1 3,-0.1 0.292 120.7-107.9 -80.1 12.7 1.8 22.9 2.3 242 245 A G S < S+ 0 0 40 -3,-1.6 -3,-0.1 1,-0.3 -1,-0.1 -0.097 82.2 127.3 88.9 -39.9 3.1 26.1 3.9 243 246 A Q - 0 0 101 -2,-0.3 -4,-3.3 -5,-0.1 2,-0.4 -0.220 51.7-144.2 -52.4 137.0 0.5 26.0 6.6 244 247 A V E -N 238 0E 80 -6,-0.3 2,-0.3 -3,-0.1 -6,-0.3 -0.859 17.1-171.1-109.8 142.8 2.0 26.3 10.0 245 248 A I E -N 237 0E 3 -8,-3.1 -8,-3.6 -2,-0.4 2,-0.5 -0.821 19.8-124.7-128.0 170.4 0.8 24.5 13.1 246 249 A T E -N 236 0E 39 -2,-0.3 2,-0.5 -10,-0.3 -10,-0.2 -0.959 15.9-166.1-121.5 118.9 1.4 24.4 16.8 247 250 A I E +N 235 0E 0 -12,-2.2 -12,-2.1 -2,-0.5 -57,-0.0 -0.872 19.1 164.5 -99.9 134.6 2.4 21.3 18.6 248 251 A G > - 0 0 1 -2,-0.5 3,-1.3 -14,-0.2 4,-0.2 0.396 63.9 -9.1-114.2-108.3 2.1 21.6 22.4 249 252 A N T >> S+ 0 0 38 1,-0.3 4,-2.2 2,-0.2 3,-1.3 0.623 114.4 80.7 -73.8 -14.6 2.0 18.8 25.0 250 253 A E H 3> S+ 0 0 5 1,-0.3 4,-1.6 2,-0.2 -1,-0.3 0.752 79.8 76.8 -61.4 -19.1 1.7 16.1 22.4 251 254 A R H <4 S+ 0 0 40 -3,-1.3 -36,-2.2 1,-0.2 -1,-0.3 0.904 110.8 18.8 -55.1 -46.3 5.4 16.8 22.3 252 255 A F H <> S+ 0 0 0 -3,-1.3 4,-0.9 -38,-0.2 -35,-0.4 0.616 115.5 70.4-103.0 -15.0 6.0 14.9 25.5 253 256 A R H < S+ 0 0 57 -4,-2.2 4,-0.4 2,-0.2 -3,-0.2 0.862 95.1 54.3 -70.5 -36.8 2.8 12.8 25.6 254 257 A A T >< S+ 0 0 1 -4,-1.6 3,-1.4 1,-0.2 4,-0.2 0.957 110.1 42.3 -64.8 -53.9 3.7 10.6 22.7 255 258 A P G >4 S+ 0 0 0 0, 0.0 3,-2.4 0, 0.0 4,-0.5 0.736 97.2 79.3 -67.4 -18.0 7.1 9.3 23.9 256 259 A E G >X S+ 0 0 5 -4,-0.9 4,-1.9 1,-0.3 3,-1.2 0.780 76.0 74.7 -60.0 -23.6 5.5 8.9 27.4 257 260 A A G <4 S+ 0 0 0 -3,-1.4 -1,-0.3 -4,-0.4 7,-0.1 0.787 84.4 66.0 -59.9 -24.8 4.0 5.7 26.0 258 261 A L G <4 S+ 0 0 3 -3,-2.4 13,-2.6 1,-0.2 -1,-0.3 0.864 108.9 37.2 -63.6 -35.1 7.6 4.2 26.3 259 262 A F T <4 S+ 0 0 4 -3,-1.2 11,-0.5 -4,-0.5 -2,-0.2 0.755 132.4 28.1 -87.9 -24.6 7.3 4.6 30.1 260 263 A H >< + 0 0 89 -4,-1.9 3,-2.3 9,-0.1 -1,-0.2 -0.655 60.8 177.4-137.1 77.1 3.6 3.6 30.3 261 264 A P G > >S+ 0 0 2 0, 0.0 3,-2.5 0, 0.0 5,-1.6 0.661 70.7 87.7 -53.6 -14.9 2.6 1.3 27.4 262 265 A S G > 5S+ 0 0 82 1,-0.3 3,-2.0 6,-0.2 5,-0.1 0.793 71.7 72.7 -56.1 -27.0 -0.8 1.2 29.0 263 266 A V G < 5S+ 0 0 53 -3,-2.3 -1,-0.3 1,-0.3 -6,-0.1 0.535 97.0 49.0 -68.1 -3.9 -1.6 4.3 27.0 264 267 A L G < 5S- 0 0 53 -3,-2.5 -1,-0.3 2,-0.2 -2,-0.2 -0.047 125.0-101.4-120.8 27.2 -1.8 2.1 23.9 265 268 A G T < 5S+ 0 0 72 -3,-2.0 2,-0.5 1,-0.3 -3,-0.2 0.638 83.6 143.1 61.2 11.1 -4.1 -0.4 25.6 266 269 A L < - 0 0 49 -5,-1.6 2,-1.2 -6,-0.1 -1,-0.3 -0.731 45.7-154.5 -89.4 122.6 -0.8 -2.3 25.9 267 270 A E + 0 0 195 -2,-0.5 2,-0.3 -3,-0.1 -1,-0.0 -0.742 52.6 111.7 -99.1 87.6 -0.2 -4.2 29.1 268 271 A S S S- 0 0 41 -2,-1.2 -6,-0.2 -93,-0.0 2,-0.1 -0.970 72.6 -98.2-151.7 150.4 3.5 -4.3 29.3 269 272 A A - 0 0 37 -2,-0.3 -9,-0.1 1,-0.1 -2,-0.0 -0.419 46.0-110.4 -70.5 151.2 6.0 -2.7 31.7 270 273 A G > - 0 0 5 -11,-0.5 4,-2.5 1,-0.1 -11,-0.3 -0.137 36.1 -91.8 -72.7 178.7 7.6 0.5 30.4 271 274 A I H > S+ 0 0 2 -13,-2.6 4,-1.4 2,-0.2 -12,-0.1 0.810 123.7 50.5 -65.3 -30.5 11.2 0.8 29.5 272 275 A D H > S+ 0 0 15 2,-0.2 4,-2.0 -14,-0.2 -1,-0.2 0.975 114.6 42.0 -71.7 -50.6 12.4 1.9 32.9 273 276 A Q H > S+ 0 0 69 1,-0.2 4,-3.1 -14,-0.2 -2,-0.2 0.873 113.7 53.2 -62.1 -38.1 10.7 -0.9 34.8 274 277 A T H X S+ 0 0 7 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.855 106.3 52.9 -67.7 -34.6 11.7 -3.5 32.2 275 278 A T H X S+ 0 0 1 -4,-1.4 4,-2.4 -5,-0.2 -1,-0.2 0.935 112.2 45.2 -65.0 -44.6 15.3 -2.4 32.5 276 279 A Y H X S+ 0 0 61 -4,-2.0 4,-2.9 1,-0.2 5,-0.2 0.972 111.7 53.1 -61.1 -51.7 15.1 -3.0 36.3 277 280 A N H X S+ 0 0 55 -4,-3.1 4,-0.6 1,-0.2 -1,-0.2 0.867 110.8 46.8 -48.9 -45.6 13.3 -6.3 35.8 278 281 A S H >< S+ 0 0 0 -4,-2.2 3,-1.4 2,-0.2 4,-0.3 0.938 111.0 50.2 -64.7 -49.3 16.0 -7.6 33.5 279 282 A I H >< S+ 0 0 0 -4,-2.4 3,-1.9 1,-0.3 -2,-0.2 0.913 107.2 56.9 -57.1 -40.1 18.8 -6.5 35.8 280 283 A M H 3< S+ 0 0 79 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.678 98.5 59.9 -66.3 -18.9 17.0 -8.3 38.6 281 284 A K T << S+ 0 0 111 -3,-1.4 -1,-0.3 -4,-0.6 2,-0.2 0.476 95.8 86.6 -86.4 -2.2 17.0 -11.5 36.7 282 285 A C S < S- 0 0 2 -3,-1.9 5,-0.1 -4,-0.3 -3,-0.0 -0.645 93.2 -86.7 -99.3 157.9 20.8 -11.3 36.7 283 286 A D >> - 0 0 94 -2,-0.2 3,-1.7 1,-0.1 4,-1.4 -0.243 39.0-117.2 -57.7 142.1 23.3 -12.5 39.2 284 287 A V H 3> S+ 0 0 93 1,-0.3 4,-0.8 2,-0.2 3,-0.3 0.861 111.8 58.8 -49.3 -45.4 24.0 -10.1 42.0 285 288 A D H 34 S+ 0 0 126 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.731 110.6 45.2 -59.5 -21.0 27.7 -9.7 41.2 286 289 A V H X> S+ 0 0 12 -3,-1.7 4,-1.9 2,-0.1 3,-0.5 0.755 94.6 75.2 -94.7 -29.2 26.7 -8.5 37.8 287 290 A R H 3X S+ 0 0 57 -4,-1.4 4,-3.0 -3,-0.3 5,-0.2 0.833 90.3 56.3 -55.0 -40.5 23.9 -6.0 38.7 288 291 A K H 3X S+ 0 0 153 -4,-0.8 4,-1.1 1,-0.2 -1,-0.2 0.888 110.4 44.9 -60.4 -41.8 26.2 -3.2 40.0 289 292 A E H <4 S+ 0 0 67 -3,-0.5 4,-0.3 -4,-0.3 -1,-0.2 0.826 112.9 51.4 -73.1 -34.1 28.0 -3.1 36.7 290 293 A L H >< S+ 0 0 0 -4,-1.9 3,-2.1 1,-0.2 -142,-0.4 0.961 108.1 50.5 -68.7 -48.9 24.7 -3.2 34.7 291 294 A Y H 3< S+ 0 0 4 -4,-3.0 34,-2.5 1,-0.3 3,-0.4 0.804 112.1 49.9 -56.6 -31.0 23.2 -0.4 36.7 292 295 A G T 3< S+ 0 0 10 -4,-1.1 -1,-0.3 32,-0.3 -2,-0.2 0.477 114.8 43.6 -88.4 0.1 26.3 1.6 36.0 293 296 A N < + 0 0 29 -3,-2.1 -145,-2.3 -4,-0.3 2,-1.0 -0.399 63.2 158.2-143.4 59.5 26.3 0.9 32.2 294 297 A I E -jm 148 326D 1 31,-2.1 33,-3.0 -3,-0.4 2,-0.5 -0.768 27.1-162.2 -86.6 104.8 22.7 1.3 30.9 295 298 A V E -jm 149 327D 1 -147,-2.2 -145,-3.0 -2,-1.0 2,-0.4 -0.808 7.0-149.6-101.5 126.7 23.4 1.9 27.2 296 299 A M E +j 150 0D 0 31,-2.9 2,-0.3 -2,-0.5 -145,-0.2 -0.763 22.8 165.8 -92.4 133.2 20.8 3.3 24.9 297 300 A S E +j 151 0D 0 -147,-2.5 -145,-2.0 -2,-0.4 36,-0.2 -0.973 30.1 54.1-142.3 155.6 20.7 2.4 21.2 298 301 A G S > S- 0 0 11 34,-2.5 3,-1.6 -2,-0.3 -145,-0.2 0.029 83.4 -84.7 103.0 150.9 18.2 2.8 18.4 299 302 A G G > S+ 0 0 37 1,-0.3 3,-1.8 34,-0.2 -146,-0.2 0.829 121.2 62.2 -60.1 -33.9 16.2 5.7 16.8 300 303 A T G 3 S+ 0 0 7 -148,-1.7 3,-0.4 1,-0.3 -1,-0.3 0.564 96.1 59.2 -73.8 -5.4 13.5 5.5 19.4 301 304 A T G < S+ 0 0 1 -3,-1.6 -1,-0.3 -149,-0.5 -2,-0.2 0.289 80.9 91.9 -99.4 8.1 15.9 6.3 22.2 302 305 A M < + 0 0 72 -3,-1.8 -1,-0.2 -4,-0.1 -2,-0.1 0.590 52.1 123.7 -79.0 -8.4 16.7 9.6 20.4 303 306 A F S > S- 0 0 12 -3,-0.4 3,-2.1 -4,-0.1 4,-0.3 -0.299 70.5-114.4 -56.8 123.0 14.1 11.6 22.3 304 307 A P T 3 S+ 0 0 85 0, 0.0 -88,-3.1 0, 0.0 -1,-0.1 -0.327 102.4 25.7 -56.9 138.3 15.6 14.6 24.1 305 308 A G T 3> S+ 0 0 24 -90,-0.2 4,-2.2 -3,-0.1 5,-0.2 0.249 87.6 111.0 91.9 -14.3 15.2 14.1 27.9 306 309 A I H <> S+ 0 0 2 -3,-2.1 4,-2.3 2,-0.2 5,-0.2 0.881 78.3 46.9 -63.4 -39.5 15.0 10.3 27.7 307 310 A A H > S+ 0 0 18 -4,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.922 113.1 49.1 -67.7 -43.0 18.4 9.7 29.4 308 311 A E H > S+ 0 0 121 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.874 113.7 46.9 -64.2 -37.1 17.6 12.2 32.2 309 312 A R H X S+ 0 0 8 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.886 112.7 48.8 -72.8 -38.8 14.2 10.5 32.7 310 313 A M H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.887 108.1 54.6 -67.1 -39.2 15.7 7.0 32.8 311 314 A Q H X S+ 0 0 63 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.941 112.2 44.3 -58.7 -45.8 18.4 8.1 35.2 312 315 A K H X S+ 0 0 88 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.938 115.7 45.3 -65.5 -48.9 15.7 9.3 37.6 313 316 A E H X S+ 0 0 45 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.897 116.0 45.1 -65.7 -40.3 13.4 6.3 37.2 314 317 A I H X S+ 0 0 0 -4,-2.8 4,-2.8 2,-0.2 3,-0.5 0.901 108.8 56.5 -71.0 -39.0 16.2 3.7 37.6 315 318 A T H < S+ 0 0 72 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.898 106.5 52.4 -57.0 -39.8 17.7 5.5 40.5 316 319 A A H < S+ 0 0 74 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.782 114.4 40.8 -67.8 -29.8 14.3 5.2 42.3 317 320 A L H < S+ 0 0 60 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.773 105.6 75.9 -89.6 -28.6 14.2 1.5 41.6 318 321 A A S < S- 0 0 10 -4,-2.8 6,-0.1 1,-0.1 2,-0.0 -0.293 99.6 -82.1 -79.7 162.5 17.8 0.7 42.4 319 322 A P > - 0 0 70 0, 0.0 3,-2.3 0, 0.0 -1,-0.1 -0.421 42.4-116.9 -62.7 147.4 19.3 0.5 45.9 320 323 A S T 3 S+ 0 0 133 1,-0.3 -2,-0.1 -4,-0.1 -3,-0.0 0.793 114.8 55.2 -52.9 -35.4 20.2 4.0 47.2 321 324 A S T 3 S+ 0 0 116 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.508 87.0 108.7 -77.8 -6.6 23.9 3.1 47.4 322 325 A M < - 0 0 43 -3,-2.3 2,-0.7 -7,-0.1 -4,-0.1 -0.554 67.9-135.0 -78.7 129.4 23.9 2.1 43.7 323 326 A K - 0 0 147 -2,-0.3 2,-0.5 -35,-0.1 -2,-0.1 -0.740 25.7-166.5 -82.3 118.6 25.7 4.2 41.1 324 327 A V + 0 0 12 -2,-0.7 2,-0.4 -32,-0.1 -32,-0.3 -0.908 8.9 178.1-106.2 130.3 23.2 4.4 38.2 325 328 A K - 0 0 80 -34,-2.5 -31,-2.1 -2,-0.5 2,-0.5 -0.990 16.0-158.1-138.1 130.6 24.5 5.7 34.9 326 329 A I E -m 294 0D 21 -2,-0.4 2,-0.6 -33,-0.2 -31,-0.2 -0.916 7.9-161.7-106.7 127.6 22.7 6.1 31.5 327 330 A I E +m 295 0D 24 -33,-3.0 -31,-2.9 -2,-0.5 -185,-0.0 -0.939 12.3 174.8-111.9 119.1 24.9 6.3 28.3 328 331 A A - 0 0 32 -2,-0.6 -31,-0.1 -33,-0.2 -33,-0.1 -0.775 18.2-153.5-127.7 84.8 23.2 7.8 25.3 329 332 A P > - 0 0 12 0, 0.0 3,-1.7 0, 0.0 6,-0.1 -0.295 18.0-131.7 -56.8 137.2 25.6 8.1 22.4 330 333 A P T 3 S+ 0 0 109 0, 0.0 3,-0.3 0, 0.0 -28,-0.0 0.806 108.6 52.6 -61.6 -25.9 24.7 10.8 20.0 331 334 A E T > S+ 0 0 53 1,-0.2 3,-2.9 2,-0.1 4,-0.5 0.199 70.3 125.3 -93.5 16.5 25.2 8.3 17.1 332 335 A R T < + 0 0 26 -3,-1.7 -34,-2.5 1,-0.3 4,-0.4 0.604 59.9 70.3 -57.0 -12.5 22.9 5.7 18.6 333 336 A K T 3 S+ 0 0 95 -3,-0.3 -1,-0.3 1,-0.2 -34,-0.2 0.788 115.1 28.5 -72.4 -23.4 20.8 5.4 15.4 334 337 A Y S <> S+ 0 0 75 -3,-2.9 4,-3.0 -36,-0.1 5,-0.3 0.315 87.9 109.3-116.7 6.8 23.9 3.8 13.9 335 338 A S H > S+ 0 0 1 -4,-0.5 4,-2.2 1,-0.2 -194,-0.2 0.847 81.3 50.0 -49.9 -44.3 25.5 2.2 17.0 336 339 A V H > S+ 0 0 11 -4,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.969 113.9 44.4 -61.7 -52.2 24.6 -1.3 15.9 337 340 A W H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.926 113.1 50.6 -58.4 -48.2 26.1 -0.7 12.4 338 341 A I H X S+ 0 0 4 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.881 107.1 54.9 -57.9 -41.1 29.2 1.0 13.7 339 342 A G H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 0.912 110.4 46.4 -59.5 -42.2 29.8 -1.9 16.1 340 343 A G H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.913 108.9 54.6 -66.2 -43.3 29.7 -4.3 13.2 341 344 A S H X S+ 0 0 0 -4,-2.7 4,-0.6 2,-0.2 -2,-0.2 0.910 112.8 43.4 -56.0 -44.7 32.0 -2.1 11.1 342 345 A I H >X S+ 0 0 1 -4,-2.6 3,-1.2 2,-0.2 4,-0.8 0.970 113.8 50.4 -65.9 -52.6 34.6 -2.2 13.9 343 346 A L H >< S+ 0 0 11 -4,-2.6 3,-1.1 1,-0.3 -2,-0.2 0.919 110.5 47.9 -50.8 -52.2 34.2 -5.9 14.6 344 347 A A H 3< S+ 0 0 4 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.626 108.6 56.1 -69.0 -12.8 34.6 -7.0 11.0 345 348 A S H << S+ 0 0 25 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.578 79.9 113.4 -94.9 -10.3 37.7 -4.8 10.5 346 349 A L XX - 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