==== 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 OXIDOREDUCTASE 12-FEB-08 3C8M . COMPND 2 MOLECULE: HOMOSERINE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA VOLCANIUM GSS1; . AUTHOR J.OSIPIUK,R.HENDRICKS,J.ABDULLAH,A.JOACHIMIAK,MIDWEST CENTER . 324 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15374.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 227 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 10.8 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 . 2 0.6 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 . 23 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 100 30.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 1 1 0 1 0 2 1 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 2 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 PARALLEL BRIDGES PER LADDER . 0 1 1 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 X 0 0 219 0, 0.0 2,-0.6 0, 0.0 32,-0.2 0.000 360.0 360.0 360.0 -55.6 48.9 59.2 -10.9 2 2 A K E -a 33 0A 111 30,-2.7 32,-2.1 2,-0.0 2,-0.5 -0.774 360.0-156.2 -92.4 123.3 48.6 59.2 -7.0 3 3 A T E -a 34 0A 54 -2,-0.6 2,-0.5 30,-0.2 32,-0.2 -0.839 5.3-166.4-101.7 128.5 51.1 56.9 -5.2 4 4 A I E -a 35 0A 12 30,-2.5 32,-2.6 -2,-0.5 2,-0.4 -0.953 13.2-142.5-113.6 126.7 50.3 55.6 -1.7 5 5 A N E -a 36 0A 34 -2,-0.5 80,-2.6 30,-0.2 81,-1.7 -0.761 19.9-167.9 -96.8 131.3 53.1 54.1 0.3 6 6 A L E -ab 37 86A 0 30,-3.2 32,-2.8 -2,-0.4 33,-1.0 -0.868 21.2-156.8-119.6 149.5 52.4 51.0 2.5 7 7 A S E -ab 39 87A 1 79,-2.2 81,-2.7 -2,-0.3 2,-0.5 -0.995 21.8-158.0-120.4 122.1 54.1 49.1 5.3 8 8 A I E -ab 40 88A 0 31,-2.9 33,-1.8 -2,-0.5 2,-0.6 -0.878 7.1-167.1-107.8 122.7 52.7 45.6 5.5 9 9 A F E +ab 41 89A 11 79,-2.6 81,-3.1 -2,-0.5 33,-0.2 -0.946 61.0 33.0-114.0 114.4 53.0 43.6 8.7 10 10 A G - 0 0 7 31,-3.1 32,-0.2 -2,-0.6 81,-0.1 0.336 49.8-160.8 108.8 121.6 52.2 39.9 8.3 11 11 A L + 0 0 6 4,-0.2 31,-0.1 29,-0.1 80,-0.1 -0.158 51.4 119.7-123.5 36.3 52.7 37.5 5.3 12 12 A G S > S- 0 0 43 78,-0.5 4,-2.7 4,-0.1 5,-0.4 0.101 90.8 -57.9 -78.7-159.8 50.3 34.7 6.2 13 13 A N H > S+ 0 0 122 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.874 139.9 40.5 -58.3 -38.2 47.4 33.8 4.0 14 14 A V H > S+ 0 0 33 2,-0.2 4,-2.3 76,-0.2 -1,-0.2 0.960 117.4 45.5 -73.6 -49.8 45.9 37.4 4.1 15 15 A G H > S+ 0 0 0 75,-0.3 4,-1.8 1,-0.2 -2,-0.2 0.891 114.2 48.4 -64.7 -40.4 49.1 39.4 3.9 16 16 A L H X S+ 0 0 21 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.905 112.7 47.5 -66.8 -45.3 50.6 37.3 1.1 17 17 A N H X S+ 0 0 23 -4,-1.4 4,-2.6 -5,-0.4 -1,-0.2 0.845 106.6 59.8 -61.7 -33.8 47.3 37.5 -1.0 18 18 A L H X S+ 0 0 1 -4,-2.3 4,-3.1 2,-0.2 -2,-0.2 0.925 102.9 51.3 -59.5 -44.2 47.3 41.2 -0.3 19 19 A L H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.918 110.5 48.8 -54.7 -45.6 50.7 41.5 -2.1 20 20 A R H X S+ 0 0 74 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.924 112.4 48.5 -60.2 -45.0 49.3 39.6 -5.1 21 21 A I H X S+ 0 0 18 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.917 107.8 54.4 -64.2 -44.1 46.2 41.9 -5.1 22 22 A I H X S+ 0 0 0 -4,-3.1 4,-2.9 1,-0.2 13,-0.3 0.919 107.7 51.0 -56.9 -44.7 48.4 45.0 -4.9 23 23 A R H X S+ 0 0 106 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.937 114.5 41.8 -59.1 -45.9 50.4 43.9 -8.0 24 24 A S H X S+ 0 0 59 -4,-2.0 4,-2.1 1,-0.2 5,-0.2 0.893 114.3 52.4 -69.0 -39.5 47.2 43.3 -10.1 25 25 A F H X S+ 0 0 34 -4,-3.0 4,-2.8 2,-0.2 -2,-0.2 0.926 106.8 52.1 -60.6 -48.7 45.6 46.4 -8.8 26 26 A N H < S+ 0 0 48 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.904 115.5 43.0 -55.1 -39.8 48.6 48.6 -9.7 27 27 A E H < S+ 0 0 142 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.851 127.9 25.0 -69.2 -38.3 48.4 47.1 -13.2 28 28 A E H < S+ 0 0 157 -4,-2.1 -3,-0.2 -5,-0.1 -2,-0.2 0.637 82.5 117.7-112.6 -24.6 44.6 47.2 -13.8 29 29 A N < - 0 0 34 -4,-2.8 3,-0.3 -5,-0.2 4,-0.0 -0.216 43.1-159.4 -61.7 143.7 42.9 49.9 -11.7 30 30 A R S S+ 0 0 243 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 -0.012 74.9 91.8-101.1 22.1 41.0 52.8 -13.4 31 31 A L S S- 0 0 103 2,-0.2 -1,-0.2 -30,-0.0 3,-0.1 0.420 96.8-117.0-103.3 -2.4 41.2 54.8 -10.2 32 32 A G S S+ 0 0 40 -3,-0.3 -30,-2.7 1,-0.2 2,-0.3 0.807 73.3 125.6 68.7 31.1 44.4 56.7 -10.8 33 33 A L E -a 2 0A 13 -32,-0.2 2,-0.4 -8,-0.1 -1,-0.2 -0.862 39.2-173.1-120.0 152.6 46.2 55.0 -7.9 34 34 A K E -a 3 0A 110 -32,-2.1 -30,-2.5 -2,-0.3 2,-0.6 -0.980 15.4-147.5-139.6 134.3 49.4 53.1 -7.4 35 35 A F E -a 4 0A 1 -2,-0.4 2,-0.4 -13,-0.3 -30,-0.2 -0.923 12.6-166.8-104.2 121.8 50.3 51.4 -4.1 36 36 A N E -a 5 0A 27 -32,-2.6 -30,-3.2 -2,-0.6 2,-0.5 -0.876 11.1-144.9-104.6 131.7 54.0 51.2 -3.4 37 37 A V E +a 6 0A 0 -2,-0.4 15,-2.6 15,-0.4 -30,-0.2 -0.875 22.8 170.9 -97.2 128.2 55.2 48.9 -0.6 38 38 A V E + 0 0 5 -32,-2.8 11,-2.7 -2,-0.5 2,-0.3 0.561 67.9 25.7-107.2 -14.8 58.2 50.2 1.5 39 39 A F E -aC 7 48A 0 -33,-1.0 -31,-2.9 9,-0.2 2,-0.4 -0.989 55.5-179.7-152.4 135.3 58.3 47.6 4.2 40 40 A V E -aC 8 47A 2 7,-2.2 7,-2.9 -2,-0.3 2,-0.4 -0.997 9.9-179.4-132.6 139.0 57.1 44.0 4.7 41 41 A A E +aC 9 46A 9 -33,-1.8 -31,-3.1 -2,-0.4 5,-0.2 -0.996 9.7 171.5-132.3 146.6 57.5 41.9 7.8 42 42 A D - 0 0 22 3,-2.5 49,-0.0 -2,-0.4 -2,-0.0 -0.601 59.2 -77.2-125.6-159.1 56.6 38.3 8.8 43 43 A S S S+ 0 0 115 -2,-0.2 3,-0.1 1,-0.2 48,-0.0 0.699 130.0 32.5 -76.5 -14.7 57.5 36.5 12.0 44 44 A L S S+ 0 0 135 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.753 119.2 38.0-108.2 -28.6 61.1 35.9 10.9 45 45 A H - 0 0 23 2,-0.0 -3,-2.5 28,-0.0 2,-0.3 -0.889 46.2-168.6-134.3 149.9 62.0 38.9 8.7 46 46 A S E -C 41 0A 35 -2,-0.3 28,-0.7 -5,-0.2 2,-0.4 -0.910 19.9-177.1-140.2 109.3 61.5 42.7 8.5 47 47 A Y E -CD 40 73A 11 -7,-2.9 -7,-2.2 -2,-0.3 2,-0.4 -0.926 7.7-171.3-118.7 133.1 62.6 44.3 5.2 48 48 A Y E +CD 39 72A 25 24,-2.6 24,-0.9 -2,-0.4 2,-0.3 -0.940 16.0 151.1-118.2 141.0 62.6 48.0 4.2 49 49 A N > - 0 0 52 -11,-2.7 3,-0.7 -2,-0.4 -2,-0.0 -0.898 52.6-118.1-161.0 142.8 63.2 49.5 0.8 50 50 A E T 3 S+ 0 0 135 1,-0.3 2,-0.2 -2,-0.3 -11,-0.1 0.795 116.0 16.2 -45.0 -33.8 62.0 52.7 -0.9 51 51 A R T 3 S- 0 0 162 -13,-0.1 -1,-0.3 -15,-0.1 -13,-0.2 -0.665 83.0-155.5-146.7 82.9 60.4 50.4 -3.5 52 52 A I < - 0 0 8 -15,-2.6 2,-1.0 -3,-0.7 -15,-0.4 -0.354 24.8-121.1 -58.9 140.4 60.1 46.8 -2.4 53 53 A D > - 0 0 80 1,-0.2 4,-1.9 2,-0.1 5,-0.1 -0.783 29.1-168.3 -83.7 101.0 59.9 44.4 -5.3 54 54 A I H > S+ 0 0 19 -2,-1.0 4,-2.5 1,-0.2 5,-0.2 0.897 82.0 54.6 -64.6 -42.8 56.5 42.9 -4.5 55 55 A G H > S+ 0 0 17 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.887 108.7 49.2 -56.1 -42.4 56.8 40.1 -7.0 56 56 A K H > S+ 0 0 84 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.869 109.3 51.7 -64.2 -41.8 60.1 39.0 -5.5 57 57 A V H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.923 111.7 47.4 -59.0 -48.3 58.7 39.0 -2.0 58 58 A I H X S+ 0 0 11 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.956 113.9 47.8 -56.0 -50.8 55.8 36.8 -3.1 59 59 A S H X S+ 0 0 31 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.910 113.8 45.4 -59.9 -46.0 58.2 34.4 -4.9 60 60 A Y H <>S+ 0 0 56 -4,-2.7 5,-3.0 1,-0.2 4,-0.4 0.915 113.6 49.7 -69.0 -40.1 60.6 34.1 -2.0 61 61 A K H ><5S+ 0 0 64 -4,-2.6 3,-0.9 -5,-0.2 -2,-0.2 0.898 110.8 50.1 -63.1 -41.6 57.8 33.7 0.5 62 62 A E H 3<5S+ 0 0 116 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.889 113.0 46.5 -62.5 -36.5 56.2 30.9 -1.7 63 63 A K T 3<5S- 0 0 144 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.526 113.6-119.9 -83.7 -3.6 59.5 29.2 -2.0 64 64 A G T < 5S+ 0 0 69 -3,-0.9 -3,-0.2 -4,-0.4 -2,-0.1 0.971 82.1 112.8 57.8 56.6 60.1 29.5 1.8 65 65 A S > < + 0 0 35 -5,-3.0 3,-0.9 -6,-0.1 -4,-0.2 -0.067 12.1 129.6-152.7 43.3 63.2 31.5 1.2 66 66 A L G > + 0 0 7 -6,-0.3 3,-2.0 1,-0.2 -5,-0.1 0.722 66.3 80.7 -64.7 -23.7 62.8 35.1 2.5 67 67 A D G 3 S+ 0 0 131 1,-0.3 -1,-0.2 -7,-0.1 -2,-0.1 0.887 85.7 59.3 -41.1 -45.4 66.0 34.5 4.4 68 68 A S G < S+ 0 0 73 -3,-0.9 2,-0.4 -8,-0.1 -1,-0.3 0.250 77.5 115.3 -78.5 11.5 67.8 35.2 1.1 69 69 A L < - 0 0 14 -3,-2.0 -3,-0.0 1,-0.1 -12,-0.0 -0.715 52.0-155.7 -89.5 134.8 66.4 38.8 0.6 70 70 A E + 0 0 192 -2,-0.4 3,-0.1 -23,-0.0 -1,-0.1 0.321 47.0 122.3-101.3 14.3 69.0 41.5 0.7 71 71 A Y S S- 0 0 41 1,-0.2 -22,-0.1 -22,-0.0 -25,-0.1 -0.187 74.8 -78.4 -70.4 159.6 67.0 44.6 1.8 72 72 A E E -D 48 0A 101 -24,-0.9 -24,-2.6 -25,-0.1 2,-0.5 -0.270 44.9-142.1 -48.6 139.3 67.6 46.7 4.8 73 73 A S E +D 47 0A 86 -26,-0.2 2,-0.3 -3,-0.1 -26,-0.2 -0.960 30.3 161.0-106.8 131.8 66.4 45.1 8.0 74 74 A I - 0 0 11 -28,-0.7 2,-0.0 -2,-0.5 0, 0.0 -0.976 39.2-101.8-143.1 154.1 64.8 47.4 10.6 75 75 A S > - 0 0 54 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.260 38.5-103.7 -70.5 165.5 62.5 46.8 13.6 76 76 A A H > S+ 0 0 38 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.912 122.3 52.0 -56.2 -44.0 58.7 47.5 13.4 77 77 A S H > S+ 0 0 55 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.898 110.4 47.8 -64.0 -44.0 59.2 50.8 15.5 78 78 A E H >> S+ 0 0 100 1,-0.2 3,-0.9 2,-0.2 4,-0.5 0.921 110.2 52.8 -56.9 -46.5 62.0 52.0 13.2 79 79 A A H >< S+ 0 0 0 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.893 102.2 59.0 -59.1 -38.5 59.8 51.2 10.1 80 80 A L H 3< S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.787 102.7 54.8 -64.5 -24.9 56.9 53.2 11.6 81 81 A A H << S+ 0 0 64 -4,-0.9 -1,-0.3 -3,-0.9 -2,-0.2 0.546 90.0 92.9 -85.1 -9.3 59.2 56.3 11.6 82 82 A R S << S- 0 0 71 -3,-1.5 2,-0.7 -4,-0.5 -44,-0.0 -0.308 93.5 -86.3 -76.2 167.5 60.1 56.0 7.9 83 83 A D S S+ 0 0 128 -2,-0.0 2,-0.3 -45,-0.0 -1,-0.1 -0.657 75.2 114.6 -85.3 118.4 58.0 58.0 5.4 84 84 A F - 0 0 4 -2,-0.7 -78,-0.2 -4,-0.2 3,-0.1 -0.933 56.5-125.8-163.5 179.1 54.9 56.2 4.2 85 85 A D S S+ 0 0 60 -80,-2.6 28,-2.0 1,-0.3 2,-0.4 0.856 77.2 23.5-105.0 -48.3 51.1 56.6 4.4 86 86 A I E -be 6 113A 4 -81,-1.7 -79,-2.2 26,-0.2 2,-0.4 -0.985 54.4-145.6-137.7 134.3 49.3 53.5 5.8 87 87 A V E -be 7 114A 0 26,-2.9 28,-2.7 -2,-0.4 2,-0.6 -0.790 14.2-154.1 -88.8 132.7 50.2 50.5 8.0 88 88 A V E -be 8 115A 0 -81,-2.7 -79,-2.6 -2,-0.4 2,-0.9 -0.964 5.0-157.5-106.4 122.9 48.5 47.2 7.2 89 89 A D E +be 9 116A 0 26,-2.6 28,-3.0 -2,-0.6 29,-0.8 -0.841 35.0 145.8-101.0 99.8 48.2 44.9 10.3 90 90 A A + 0 0 18 -81,-3.1 -78,-0.5 -2,-0.9 -75,-0.3 -0.142 35.9 128.8-119.8 34.5 47.8 41.3 9.0 91 91 A T S S- 0 0 30 1,-0.1 2,-0.1 -81,-0.1 -81,-0.1 -0.374 71.0 -78.4 -83.7 163.6 49.8 39.8 12.0 92 92 A P - 0 0 112 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.387 53.8-109.6 -60.3 141.1 48.6 37.0 14.3 93 93 A A - 0 0 59 -2,-0.1 2,-0.1 -3,-0.1 -3,-0.0 -0.544 27.7-135.5 -78.0 130.2 46.1 38.1 16.9 94 94 A S - 0 0 25 -2,-0.3 -1,-0.1 1,-0.1 -3,-0.0 -0.387 19.3-117.5 -74.0 164.5 47.3 38.2 20.5 95 95 A A S S+ 0 0 84 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.0 0.909 108.8 28.2 -69.5 -37.4 45.2 36.9 23.3 96 96 A D S S- 0 0 80 28,-0.0 -1,-0.2 27,-0.0 -3,-0.0 0.536 96.4-124.4-111.8 -7.1 44.7 40.2 25.1 97 97 A G S > S+ 0 0 0 27,-0.1 4,-2.3 26,-0.0 5,-0.1 0.406 74.7 118.6 82.5 -3.2 45.0 42.9 22.5 98 98 A K H > S+ 0 0 130 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.894 72.9 50.6 -65.8 -43.1 47.9 44.8 24.2 99 99 A K H > S+ 0 0 95 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.911 112.7 48.3 -62.6 -36.7 50.5 44.4 21.4 100 100 A E H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.937 111.2 50.0 -68.1 -45.9 47.9 45.6 18.9 101 101 A L H X S+ 0 0 27 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.953 112.6 46.2 -54.9 -51.2 47.0 48.6 21.0 102 102 A A H X S+ 0 0 59 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.898 112.7 51.9 -62.0 -38.3 50.7 49.6 21.5 103 103 A F H X S+ 0 0 28 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.903 110.7 45.4 -65.1 -43.8 51.3 49.1 17.7 104 104 A Y H X S+ 0 0 1 -4,-2.6 4,-3.0 2,-0.2 5,-0.3 0.918 110.7 54.8 -69.2 -39.3 48.4 51.4 16.6 105 105 A K H X S+ 0 0 69 -4,-2.6 4,-2.4 -5,-0.3 -2,-0.2 0.954 111.4 44.2 -56.1 -48.1 49.4 54.0 19.2 106 106 A E H X S+ 0 0 59 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.868 113.3 52.5 -68.1 -35.1 52.9 54.1 17.8 107 107 A T H <>S+ 0 0 0 -4,-2.1 5,-2.2 2,-0.2 3,-0.3 0.949 111.7 43.8 -61.5 -52.2 51.6 54.1 14.2 108 108 A F H ><5S+ 0 0 2 -4,-3.0 3,-1.6 1,-0.2 -2,-0.2 0.894 111.2 54.9 -62.9 -42.2 49.2 57.1 14.8 109 109 A E H 3<5S+ 0 0 94 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.809 105.4 53.4 -61.8 -29.0 51.9 59.0 16.7 110 110 A N T 3<5S- 0 0 57 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.408 124.2-107.0 -86.4 1.2 54.2 58.6 13.7 111 111 A G T < 5S+ 0 0 23 -3,-1.6 2,-0.3 1,-0.3 -3,-0.2 0.760 76.4 125.2 83.9 29.1 51.5 60.1 11.5 112 112 A K < - 0 0 14 -5,-2.2 -1,-0.3 26,-0.0 -26,-0.2 -0.851 53.5-127.4-117.2 152.2 50.2 57.0 9.6 113 113 A D E -e 86 0A 12 -28,-2.0 -26,-2.9 -2,-0.3 2,-0.4 -0.462 23.7-131.9 -83.8 167.5 46.7 55.4 9.3 114 114 A V E -ef 87 140A 0 25,-2.3 27,-2.1 -28,-0.2 2,-0.4 -0.982 18.5-174.6-123.8 138.5 46.0 51.8 10.0 115 115 A V E -ef 88 141A 0 -28,-2.7 -26,-2.6 -2,-0.4 2,-0.4 -0.998 25.1-170.0-121.7 122.5 44.1 49.1 8.0 116 116 A T E +e 89 0A 0 25,-2.3 29,-0.4 -2,-0.4 28,-0.4 -0.928 38.9 176.9-121.2 144.7 43.8 45.9 10.1 117 117 A A + 0 0 25 -28,-3.0 2,-0.5 -2,-0.4 -27,-0.2 0.360 69.9 93.2-107.9 -3.3 42.7 42.4 9.6 118 118 A N - 0 0 6 -29,-0.8 4,-0.4 1,-0.1 3,-0.2 -0.802 55.9-169.1 -94.7 123.2 43.6 41.5 13.2 119 119 A K > + 0 0 39 -2,-0.5 4,-2.4 1,-0.2 5,-0.2 0.563 62.1 90.0 -91.2 -6.3 40.7 41.9 15.6 120 120 A S H > S+ 0 0 0 1,-0.2 4,-1.1 2,-0.2 5,-0.2 0.874 87.5 44.7 -64.5 -47.2 42.5 41.6 19.0 121 121 A G H >> S+ 0 0 0 1,-0.2 4,-3.2 -3,-0.2 3,-0.5 0.943 117.2 47.0 -60.8 -46.3 43.3 45.3 19.6 122 122 A L H 3> S+ 0 0 0 -4,-0.4 4,-0.6 1,-0.2 -2,-0.2 0.846 110.2 51.6 -67.5 -34.1 39.8 46.3 18.6 123 123 A A H 3< S+ 0 0 0 -4,-2.4 110,-0.8 1,-0.1 -1,-0.2 0.718 124.8 26.2 -75.5 -19.0 38.0 43.7 20.6 124 124 A N H << S+ 0 0 28 -4,-1.1 -2,-0.2 -3,-0.5 -3,-0.2 0.721 133.3 25.7-113.9 -31.2 39.8 44.6 23.8 125 125 A F H X + 0 0 43 -4,-3.2 4,-2.6 -5,-0.2 5,-0.2 -0.157 68.1 139.6-133.4 39.0 40.9 48.2 23.6 126 126 A W H X S+ 0 0 20 -4,-0.6 4,-2.9 105,-0.4 5,-0.3 0.930 76.0 46.0 -52.4 -52.4 38.4 50.0 21.2 127 127 A P H > S+ 0 0 32 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.893 114.1 49.2 -65.9 -33.6 38.0 53.3 23.1 128 128 A E H > S+ 0 0 58 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.915 112.2 48.0 -66.7 -44.5 41.8 53.6 23.7 129 129 A I H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.951 112.9 48.0 -59.9 -49.8 42.5 52.9 20.0 130 130 A X H X S+ 0 0 49 -4,-2.9 4,-2.4 -5,-0.2 -1,-0.2 0.870 110.6 52.1 -62.9 -35.0 39.9 55.5 18.9 131 131 A E H X S+ 0 0 89 -4,-2.1 4,-3.1 -5,-0.3 -1,-0.2 0.924 109.9 47.9 -66.3 -43.5 41.3 58.1 21.3 132 132 A Y H X S+ 0 0 71 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.907 113.0 49.5 -61.2 -42.2 44.8 57.7 20.0 133 133 A A H X>S+ 0 0 6 -4,-2.6 5,-2.9 2,-0.2 4,-0.6 0.931 114.3 44.5 -58.6 -47.9 43.5 58.0 16.4 134 134 A R H ><5S+ 0 0 150 -4,-2.4 3,-1.1 3,-0.2 -2,-0.2 0.935 112.4 52.0 -63.0 -49.3 41.5 61.1 17.4 135 135 A S H 3<5S+ 0 0 61 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.839 117.7 38.2 -52.0 -43.7 44.5 62.6 19.3 136 136 A N H 3<5S- 0 0 47 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.438 108.4-121.4 -95.3 0.9 46.8 62.1 16.4 137 137 A N T <<5 + 0 0 143 -3,-1.1 2,-0.2 -4,-0.6 -3,-0.2 0.890 68.8 130.5 58.3 42.3 44.3 63.0 13.7 138 138 A R < - 0 0 105 -5,-2.9 2,-0.3 -6,-0.2 -1,-0.2 -0.727 48.1-130.4-120.0 172.9 44.7 59.6 12.0 139 139 A R - 0 0 122 -2,-0.2 -25,-2.3 -3,-0.1 2,-0.4 -0.878 10.4-162.8-124.7 153.3 42.2 56.9 10.8 140 140 A I E -f 114 0A 19 -2,-0.3 2,-0.3 -27,-0.2 -25,-0.2 -0.999 5.3-173.1-134.3 135.3 41.7 53.2 11.2 141 141 A R E +f 115 0A 27 -27,-2.1 -25,-2.3 -2,-0.4 3,-0.0 -0.922 7.6 179.9-124.9 158.7 39.6 50.8 9.1 142 142 A Y > + 0 0 22 -2,-0.3 3,-1.9 -27,-0.2 4,-0.4 -0.093 23.8 144.7-154.1 37.9 39.0 47.2 9.8 143 143 A E G > S+ 0 0 2 1,-0.3 3,-1.2 172,-0.2 10,-0.2 0.890 76.6 54.8 -47.9 -47.0 36.8 45.6 7.1 144 144 A A G 3 S+ 0 0 10 -28,-0.4 4,-0.4 1,-0.2 -1,-0.3 0.587 89.0 78.0 -73.4 -7.0 38.5 42.3 7.3 145 145 A T G < S+ 0 0 6 -3,-1.9 2,-0.4 -29,-0.4 -1,-0.2 0.751 100.6 32.5 -74.1 -24.7 38.0 41.8 11.0 146 146 A V S < S+ 0 0 0 -3,-1.2 7,-0.2 -4,-0.4 -1,-0.2 -0.991 128.9 1.6-137.2 131.0 34.4 40.7 10.8 147 147 A A S > S- 0 0 1 25,-0.5 3,-2.8 -2,-0.4 141,-0.1 0.736 92.0-126.6 65.2 27.9 32.7 38.7 8.0 148 148 A G T 3 S- 0 0 11 -4,-0.4 -2,-0.2 1,-0.3 4,-0.1 -0.051 80.9 -4.2 45.4-119.4 36.0 38.4 6.0 149 149 A G T 3 S+ 0 0 20 159,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.398 103.6 109.3 -87.9 2.7 35.6 39.6 2.4 150 150 A V S < S- 0 0 2 -3,-2.8 -4,-0.1 -7,-0.1 154,-0.1 -0.719 81.6-112.3 -81.8 121.3 31.8 40.3 2.6 151 151 A P + 0 0 68 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.305 64.1 135.6 -55.7 130.6 31.4 44.1 2.5 152 152 A L > + 0 0 0 -4,-0.1 4,-2.7 -6,-0.1 5,-0.2 0.448 68.7 36.1-141.1 -61.2 30.0 45.1 6.0 153 153 A F H > S+ 0 0 2 -7,-0.2 4,-2.6 2,-0.2 5,-0.1 0.926 122.7 45.6 -71.5 -42.4 31.7 48.1 7.4 154 154 A S H > S+ 0 0 17 2,-0.2 4,-1.8 1,-0.2 5,-0.4 0.862 112.0 55.0 -62.4 -35.6 32.0 49.8 4.0 155 155 A F H >>S+ 0 0 39 2,-0.2 4,-2.2 1,-0.2 5,-0.9 0.953 113.0 40.9 -60.8 -50.3 28.4 48.7 3.4 156 156 A I H X5S+ 0 0 16 -4,-2.7 4,-0.5 1,-0.2 -2,-0.2 0.914 118.3 47.3 -59.2 -42.9 27.3 50.5 6.6 157 157 A D H <5S+ 0 0 43 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.666 130.2 14.7 -79.6 -23.0 29.6 53.5 5.9 158 158 A Y H <5S+ 0 0 121 -4,-1.8 -3,-0.2 -3,-0.2 -2,-0.2 0.525 125.1 46.2-131.2 -13.5 28.7 54.2 2.3 159 159 A S H <5S+ 0 0 76 -4,-2.2 -3,-0.2 -5,-0.4 -2,-0.1 0.664 119.1 29.5-110.4 -22.5 25.5 52.3 1.3 160 160 A V S >< + 0 0 1 81,-0.3 4,-1.1 1,-0.1 81,-0.2 -0.869 58.5 175.9-132.0 95.6 32.0 32.6 12.8 174 174 A L H > + 0 0 30 -2,-0.4 4,-2.7 1,-0.2 5,-0.2 0.828 68.4 59.9 -76.6 -36.8 32.1 29.6 10.4 175 175 A T H > S+ 0 0 27 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.935 108.1 44.5 -64.2 -46.2 34.2 27.0 12.2 176 176 A I H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.907 115.0 49.8 -64.9 -38.9 31.8 26.6 15.2 177 177 A N H X S+ 0 0 3 -4,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.869 106.6 55.2 -67.3 -35.4 28.9 26.6 12.9 178 178 A Y H X S+ 0 0 28 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.953 110.3 46.4 -57.2 -50.5 30.5 23.9 10.8 179 179 A F H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.916 110.9 52.1 -60.1 -43.6 30.8 21.8 13.9 180 180 A I H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.939 112.2 45.6 -56.0 -48.7 27.2 22.5 14.9 181 181 A R H X S+ 0 0 51 -4,-2.4 4,-0.5 2,-0.2 -1,-0.2 0.865 112.9 49.1 -68.2 -38.8 25.9 21.4 11.5 182 182 A E H >< S+ 0 0 18 -4,-2.5 3,-1.0 2,-0.2 5,-0.5 0.917 110.8 50.7 -66.5 -42.2 28.1 18.2 11.3 183 183 A L H >X S+ 0 0 27 -4,-2.6 3,-1.5 1,-0.3 4,-0.6 0.858 104.3 58.2 -59.6 -36.8 26.9 17.3 14.8 184 184 A A H 3< S+ 0 0 10 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.685 92.2 68.9 -68.7 -15.0 23.4 17.8 13.6 185 185 A N T << S- 0 0 74 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.255 127.5-101.6 -80.3 13.5 24.2 15.1 10.9 186 186 A K T <4 S+ 0 0 198 -3,-1.5 2,-0.3 62,-0.2 -2,-0.2 0.930 75.9 144.7 60.3 54.5 24.2 12.8 13.9 187 187 A R < - 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