==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-JUL-01 1H7L . COMPND 2 MOLECULE: SPORE COAT POLYSACCHARIDE BIOSYNTHESIS PROTEIN . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR N.TARBOURIECH,S.J.CHARNOCK,G.J.DAVIES . 239 3 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11745.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 172 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 33 13.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 9.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 20 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 26.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+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 1 1 0 3 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 1 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 PARALLEL BRIDGES PER LADDER . 1 0 3 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 0 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 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 2 A P 0 0 53 0, 0.0 89,-0.4 0, 0.0 30,-0.2 0.000 360.0 360.0 360.0 146.2 -2.4 34.1 35.0 2 3 A K + 0 0 49 28,-0.7 89,-2.5 87,-0.2 88,-1.3 0.872 360.0 39.0 -52.6 -46.3 -3.6 32.1 38.0 3 4 A V E -ab 31 91A 0 27,-1.6 29,-2.1 86,-0.2 2,-0.6 -0.918 61.4-158.1-118.5 138.6 -0.9 29.4 37.6 4 5 A S E -ab 32 92A 0 87,-2.8 89,-2.4 -2,-0.4 2,-0.5 -0.962 12.9-162.1-111.1 118.6 2.7 29.5 36.6 5 6 A V E -ab 33 93A 0 27,-2.7 29,-3.0 -2,-0.6 2,-0.7 -0.866 4.5-160.9 -99.0 123.1 4.0 26.2 35.3 6 7 A I E +ab 34 94A 0 87,-2.5 89,-2.5 -2,-0.5 2,-0.4 -0.910 12.1 178.4-112.7 110.4 7.8 25.9 35.4 7 8 A M E -ab 35 95A 0 27,-2.8 29,-3.0 -2,-0.7 2,-0.4 -0.888 14.3-153.1-114.2 139.2 9.4 23.3 33.1 8 9 A T E -ab 36 96A 15 87,-1.4 89,-0.9 -2,-0.4 2,-0.4 -0.874 13.0-165.8-109.0 144.4 13.0 22.5 32.6 9 10 A S E +a 37 0A 2 27,-2.3 29,-2.7 -2,-0.4 2,-0.2 -0.996 18.2 158.5-133.6 132.7 14.4 21.0 29.5 10 11 A Y S S- 0 0 96 -2,-0.4 27,-0.0 27,-0.2 -2,-0.0 -0.675 70.4 -41.7-155.8 101.8 17.7 19.4 28.5 11 12 A N S S+ 0 0 56 -2,-0.2 3,-0.1 1,-0.1 31,-0.0 0.816 83.9 126.9 58.7 42.4 18.2 17.1 25.6 12 13 A K >> + 0 0 65 1,-0.1 4,-2.6 2,-0.0 3,-2.0 -0.470 20.6 157.0-121.7 60.3 15.2 14.8 25.8 13 14 A S T 34 + 0 0 19 1,-0.3 4,-0.4 2,-0.2 -1,-0.1 0.772 69.7 56.1 -59.3 -27.7 14.0 15.3 22.1 14 15 A D T 34 S+ 0 0 135 1,-0.1 -1,-0.3 -3,-0.1 4,-0.0 0.551 120.9 25.7 -83.1 -7.6 12.1 12.1 22.1 15 16 A Y T X> S+ 0 0 105 -3,-2.0 4,-1.7 82,-0.1 3,-0.7 0.613 97.3 83.4-122.3 -27.7 9.9 13.0 25.1 16 17 A V H 3X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.839 87.6 55.5 -60.3 -35.8 9.7 16.8 25.4 17 18 A A H 3> S+ 0 0 33 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.873 107.7 49.5 -64.7 -37.1 6.8 17.3 22.9 18 19 A K H <> S+ 0 0 126 -3,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.900 112.7 49.5 -65.7 -39.2 4.5 14.9 24.7 19 20 A S H X S+ 0 0 0 -4,-1.7 4,-1.2 78,-0.3 82,-0.4 0.955 114.2 42.2 -64.0 -56.3 5.3 16.7 27.9 20 21 A I H >X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 3,-0.7 0.933 113.5 52.3 -59.4 -46.8 4.7 20.2 26.5 21 22 A S H 3X S+ 0 0 59 -4,-2.6 4,-1.8 -5,-0.3 -1,-0.2 0.877 104.0 57.7 -58.2 -37.0 1.6 19.1 24.7 22 23 A S H 3< S+ 0 0 10 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.810 111.0 43.8 -62.9 -32.0 0.1 17.5 27.9 23 24 A I H X< S+ 0 0 0 -4,-1.2 3,-1.8 -3,-0.7 -2,-0.2 0.927 112.0 50.6 -77.2 -49.9 0.4 21.0 29.6 24 25 A L H 3< S+ 0 0 25 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.754 108.4 54.2 -62.3 -23.9 -1.0 23.0 26.7 25 26 A S T 3< S+ 0 0 75 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.1 0.338 79.1 137.1 -92.7 8.8 -4.0 20.7 26.4 26 27 A Q < - 0 0 9 -3,-1.8 78,-0.2 1,-0.1 -3,-0.1 -0.206 60.4-131.9 -56.9 142.9 -5.0 21.1 30.1 27 28 A T S S+ 0 0 76 76,-2.2 2,-0.7 1,-0.1 -1,-0.1 0.705 102.2 64.3 -66.9 -26.7 -8.7 21.6 30.8 28 29 A F + 0 0 38 75,-0.4 78,-0.1 1,-0.1 -2,-0.1 -0.947 69.1 177.4 -96.7 115.2 -7.7 24.6 33.1 29 30 A S + 0 0 76 -2,-0.7 2,-1.9 1,-0.1 -1,-0.1 0.497 43.5 104.4-102.3 -5.9 -6.2 27.0 30.6 30 31 A D + 0 0 83 -29,-0.0 -27,-1.6 2,-0.0 -28,-0.7 -0.446 60.8 99.4 -82.2 71.5 -5.3 30.0 32.8 31 32 A F E -a 3 0A 6 -2,-1.9 2,-0.4 -29,-0.2 -27,-0.2 -0.931 62.9-130.9-146.2 161.8 -1.6 29.6 33.1 32 33 A E E -a 4 0A 10 -29,-2.1 -27,-2.7 -2,-0.3 2,-0.6 -0.961 23.4-148.3-109.9 143.3 1.8 30.7 31.8 33 34 A L E -ac 5 57A 0 23,-2.5 25,-3.1 -2,-0.4 2,-0.6 -0.935 4.4-158.7-115.2 110.4 4.3 28.0 30.8 34 35 A F E -ac 6 58A 0 -29,-3.0 -27,-2.8 -2,-0.6 2,-0.7 -0.771 2.3-165.5 -83.2 122.0 8.0 28.7 31.3 35 36 A I E -ac 7 59A 0 23,-2.2 25,-2.5 -2,-0.6 2,-0.9 -0.915 6.4-171.6-106.3 106.5 10.1 26.4 29.2 36 37 A M E -ac 8 60A 1 -29,-3.0 -27,-2.3 -2,-0.7 2,-0.4 -0.834 5.5-170.1-101.8 96.4 13.6 26.8 30.6 37 38 A D E -ac 9 61A 0 23,-2.6 25,-2.3 -2,-0.9 2,-0.5 -0.750 19.1-144.3 -90.4 133.7 15.9 25.1 28.2 38 39 A D - 0 0 6 -29,-2.7 23,-0.1 -2,-0.4 -1,-0.1 -0.192 64.3 -73.3 -94.7 47.1 19.4 24.6 29.4 39 40 A N S S- 0 0 43 -2,-0.5 -1,-0.1 23,-0.1 -29,-0.1 0.950 73.7-172.3 64.3 57.4 21.0 25.1 26.0 40 41 A S - 0 0 9 1,-0.1 -1,-0.1 -31,-0.1 -3,-0.0 -0.153 26.3 -81.6 -74.9 169.5 20.0 21.7 24.5 41 42 A N > - 0 0 74 1,-0.1 4,-2.3 3,-0.1 3,-0.3 -0.046 45.4 -97.6 -65.3 169.5 21.1 20.1 21.1 42 43 A E H > S+ 0 0 152 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.880 120.6 56.2 -57.0 -45.4 19.5 21.0 17.7 43 44 A E H > S+ 0 0 116 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.905 111.0 44.8 -55.4 -44.5 17.2 18.0 17.6 44 45 A T H > S+ 0 0 0 -3,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.936 111.6 50.9 -69.4 -47.7 15.6 19.1 21.0 45 46 A L H X S+ 0 0 28 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.880 108.7 53.1 -57.6 -37.2 15.3 22.7 20.1 46 47 A N H < S+ 0 0 76 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.875 107.5 49.7 -73.2 -31.9 13.6 21.8 16.9 47 48 A V H < S+ 0 0 43 -4,-1.5 4,-0.3 -3,-0.2 -1,-0.2 0.833 115.4 45.3 -68.7 -31.3 11.0 19.6 18.6 48 49 A I H >X S+ 0 0 2 -4,-1.9 3,-1.9 1,-0.1 4,-0.6 0.882 94.2 83.5 -80.2 -35.4 10.3 22.5 21.1 49 50 A R G >< S+ 0 0 132 -4,-2.6 3,-2.1 1,-0.3 4,-0.3 0.785 85.1 50.5 -36.1 -59.6 10.2 25.2 18.3 50 51 A P G >4 S+ 0 0 78 0, 0.0 3,-1.2 0, 0.0 -1,-0.3 0.764 101.8 64.0 -58.2 -26.0 6.6 24.9 17.1 51 52 A F G X4 S+ 0 0 44 -3,-1.9 3,-2.1 -4,-0.3 6,-0.2 0.747 84.4 75.7 -72.9 -18.4 5.3 25.1 20.7 52 53 A L G << S+ 0 0 59 -3,-2.1 -1,-0.2 -4,-0.6 5,-0.1 0.694 80.2 72.6 -68.7 -13.5 6.7 28.7 21.0 53 54 A N G < S+ 0 0 146 -3,-1.2 2,-0.4 -4,-0.3 -1,-0.3 0.616 73.5 96.1 -76.4 -8.0 3.7 29.8 18.9 54 55 A D S X S- 0 0 41 -3,-2.1 3,-1.7 1,-0.1 -30,-0.0 -0.695 76.1-140.3 -84.3 129.6 1.4 29.2 21.9 55 56 A N T 3 S+ 0 0 159 -2,-0.4 -1,-0.1 1,-0.3 -3,-0.0 0.640 97.6 62.3 -70.4 -12.5 0.9 32.7 23.6 56 57 A R T 3 S+ 0 0 52 -24,-0.1 -23,-2.5 -32,-0.0 2,-0.3 0.619 84.7 97.9 -82.9 -11.8 1.0 31.2 27.0 57 58 A V E < -c 33 0A 18 -3,-1.7 2,-0.5 -6,-0.2 -23,-0.2 -0.630 51.4-170.0 -84.3 134.9 4.6 29.9 26.5 58 59 A R E -c 34 0A 67 -25,-3.1 -23,-2.2 -2,-0.3 2,-0.4 -0.937 14.6-164.4-123.0 102.6 7.6 31.8 27.8 59 60 A F E +c 35 0A 59 -2,-0.5 2,-0.4 -25,-0.2 -23,-0.2 -0.741 12.6 174.3 -95.9 133.0 10.7 30.3 26.4 60 61 A Y E -c 36 0A 84 -25,-2.5 -23,-2.6 -2,-0.4 2,-0.5 -1.000 10.3-164.1-137.0 135.1 14.2 31.0 27.8 61 62 A Q E -c 37 0A 87 -2,-0.4 -23,-0.2 -25,-0.2 -25,-0.1 -0.971 12.3-141.5-122.8 127.1 17.4 29.4 26.7 62 63 A S - 0 0 22 -25,-2.3 -23,-0.1 -2,-0.5 -25,-0.0 -0.234 13.8-132.7 -73.5 174.9 20.6 29.5 28.8 63 64 A D + 0 0 146 -25,-0.0 -1,-0.1 2,-0.0 -25,-0.1 0.090 54.4 147.6-110.6 17.2 24.1 29.8 27.2 64 65 A I + 0 0 23 5,-0.1 2,-0.3 6,-0.0 -2,-0.0 -0.245 17.7 167.3 -59.5 134.9 25.5 27.0 29.4 65 66 A S + 0 0 86 1,-0.1 4,-0.5 -2,-0.0 3,-0.1 -0.945 31.5 10.9-155.9 130.5 28.2 24.9 27.9 66 67 A G S > S- 0 0 41 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 0.030 84.4 -70.4 94.9 165.6 30.7 22.3 29.0 67 68 A V H > S+ 0 0 39 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.865 124.1 55.5 -67.1 -38.8 31.4 20.2 32.1 68 69 A K H >> S+ 0 0 147 1,-0.2 4,-0.8 2,-0.2 3,-0.7 0.968 113.8 39.5 -57.4 -53.9 32.6 23.1 34.3 69 70 A E H 3> S+ 0 0 85 -4,-0.5 4,-0.6 1,-0.2 3,-0.5 0.874 112.9 56.9 -64.8 -35.2 29.4 25.1 33.8 70 71 A R H 3< S+ 0 0 23 -4,-2.2 5,-0.4 1,-0.2 -1,-0.2 0.701 116.0 35.5 -71.7 -18.7 27.2 22.0 33.9 71 72 A T H << S+ 0 0 16 -4,-1.3 -1,-0.2 -3,-0.7 -2,-0.2 0.378 92.3 87.4-115.2 2.3 28.5 21.1 37.4 72 73 A E H < S+ 0 0 117 -4,-0.8 2,-0.3 -3,-0.5 -2,-0.1 0.849 105.0 4.8 -69.1 -39.8 29.0 24.5 38.9 73 74 A K S < S- 0 0 88 -4,-0.6 2,-1.2 107,-0.1 107,-0.2 -0.945 90.1 -87.3-136.0 167.5 25.4 24.5 40.2 74 75 A T > - 0 0 0 105,-3.1 4,-2.1 -2,-0.3 3,-0.5 -0.665 50.7-154.0 -72.0 102.3 22.4 22.2 40.3 75 76 A R H > S+ 0 0 20 -2,-1.2 4,-2.4 -5,-0.4 -1,-0.2 0.877 84.4 48.6 -55.4 -47.2 21.2 23.4 36.8 76 77 A Y H > S+ 0 0 49 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.842 110.8 52.8 -69.7 -26.0 17.5 22.8 37.0 77 78 A A H > S+ 0 0 0 -3,-0.5 4,-2.7 2,-0.2 100,-0.3 0.911 109.1 48.9 -70.4 -44.2 17.4 24.6 40.4 78 79 A A H X S+ 0 0 3 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.899 114.2 47.3 -58.4 -42.5 19.2 27.6 38.9 79 80 A L H X S+ 0 0 4 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.924 112.0 48.7 -66.8 -43.0 16.7 27.6 36.1 80 81 A I H X S+ 0 0 1 -4,-2.7 4,-3.1 1,-0.2 5,-0.2 0.929 109.5 52.3 -60.8 -46.3 13.7 27.2 38.3 81 82 A N H X S+ 0 0 11 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.855 109.2 50.8 -56.8 -38.7 14.8 30.0 40.5 82 83 A Q H X S+ 0 0 92 -4,-1.6 4,-0.8 2,-0.2 -1,-0.2 0.915 112.1 45.9 -64.5 -47.9 15.1 32.2 37.4 83 84 A A H >X S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.2 4,-1.0 0.903 107.2 58.6 -58.7 -45.3 11.6 31.3 36.3 84 85 A I H >< S+ 0 0 0 -4,-3.1 3,-0.7 1,-0.3 -1,-0.2 0.880 102.4 54.6 -57.0 -34.6 10.3 31.9 39.8 85 86 A E H 3< S+ 0 0 143 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.741 112.8 41.6 -72.3 -23.4 11.6 35.5 39.6 86 87 A M H << S+ 0 0 55 -3,-1.1 -1,-0.2 -4,-0.8 -2,-0.2 0.436 91.3 121.1 -95.3 -7.0 9.7 36.1 36.4 87 88 A A << - 0 0 17 -4,-1.0 -83,-0.1 -3,-0.7 5,-0.0 -0.344 36.5-179.6 -72.0 144.1 6.5 34.3 37.5 88 89 A E + 0 0 143 3,-0.1 -1,-0.1 -85,-0.1 -84,-0.1 0.506 46.8 109.6-109.5 -15.3 3.1 36.1 37.7 89 90 A G - 0 0 3 1,-0.1 -86,-0.2 2,-0.1 -87,-0.2 -0.230 62.3-143.3 -69.4 151.9 0.9 33.2 38.9 90 91 A E S S+ 0 0 93 -88,-1.3 73,-2.7 -89,-0.4 2,-0.4 0.772 94.0 48.3 -77.2 -31.3 -0.6 32.9 42.4 91 92 A Y E S-bD 3 162A 2 -89,-2.5 -87,-2.8 71,-0.2 2,-0.4 -0.937 76.6-154.7-113.7 137.4 -0.0 29.1 42.3 92 93 A I E +bD 4 161A 0 69,-3.3 69,-2.2 -2,-0.4 2,-0.3 -0.893 16.6 170.6-111.1 142.7 3.3 27.6 41.3 93 94 A T E -bD 5 160A 0 -89,-2.4 -87,-2.5 -2,-0.4 2,-0.3 -0.977 20.0-132.0-151.0 155.3 3.8 24.2 39.8 94 95 A Y E +b 6 0A 0 65,-0.9 2,-0.3 62,-0.3 -87,-0.2 -0.813 19.6 171.9-113.5 151.5 6.6 22.2 38.2 95 96 A A E -b 7 0A 1 -89,-2.5 -87,-1.4 -2,-0.3 2,-0.3 -0.984 13.4-151.6-148.6 157.9 7.2 20.0 35.1 96 97 A T E > -b 8 0A 23 -2,-0.3 3,-1.2 -89,-0.2 -87,-0.1 -0.847 34.5-102.1-128.9 170.7 10.0 18.3 33.4 97 98 A D T 3 S+ 0 0 3 -89,-0.9 -78,-0.3 -2,-0.3 -79,-0.1 0.467 118.3 39.9 -75.7 1.0 10.7 17.3 29.8 98 99 A D T 3 S+ 0 0 56 -79,-0.1 114,-0.6 -80,-0.1 2,-0.4 0.210 96.1 91.7-130.8 16.5 9.9 13.6 30.4 99 100 A N E < -E 211 0A 1 -3,-1.2 2,-0.5 112,-0.1 112,-0.2 -0.887 61.7-147.1-112.5 139.4 6.9 13.9 32.6 100 101 A I E -E 210 0A 17 110,-3.3 110,-2.2 -2,-0.4 2,-0.4 -0.883 6.5-141.1-111.1 126.2 3.3 14.0 31.3 101 102 A Y E -E 209 0A 5 -2,-0.5 108,-0.2 -82,-0.4 107,-0.1 -0.725 22.9-123.5 -76.6 133.5 0.4 15.9 33.0 102 103 A M > - 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0 0 92 0, 0.0 2,-0.3 0, 0.0 3,-0.1 -0.176 16.0-150.0 -78.1 164.0 0.2 7.3 46.5 143 146 A A + 0 0 1 1,-0.1 -18,-0.1 60,-0.0 3,-0.1 -0.755 46.2 133.6-129.0 80.6 -0.9 10.5 48.2 144 147 A A + 0 0 82 -2,-0.3 2,-0.4 1,-0.1 -1,-0.1 0.586 58.7 47.4-107.6 -14.7 -2.9 9.2 51.2 145 148 A Q S S- 0 0 131 -3,-0.1 2,-0.3 59,-0.1 -1,-0.1 -0.952 76.4-112.8-138.4 153.4 -1.5 11.3 54.0 146 149 A V - 0 0 66 -2,-0.4 2,-0.4 56,-0.1 56,-0.2 -0.602 46.8-159.8 -72.5 131.9 -0.6 14.8 55.1 147 150 A T B -I 201 0B 20 54,-2.1 54,-2.9 -2,-0.3 3,-0.2 -0.966 41.1-177.9-134.4 134.0 3.1 14.9 55.5 148 151 A W S S+ 0 0 71 -2,-0.4 2,-0.2 52,-0.2 92,-0.1 0.285 88.4 63.8 -93.7 4.3 5.7 17.0 57.2 149 152 A N + 0 0 21 1,-0.1 -1,-0.2 52,-0.1 44,-0.1 -0.509 55.6 147.9-132.0 70.3 8.5 14.7 55.6 150 153 A A >> + 0 0 0 42,-0.2 3,-2.8 -3,-0.2 4,-1.5 0.785 27.1 119.3 -76.5 -34.5 8.3 15.1 51.8 151 154 A P T 34 S- 0 0 0 0, 0.0 4,-0.1 0, 0.0 38,-0.1 -0.090 95.3 -10.2 -46.0 124.2 11.9 14.6 50.8 152 155 A a T 34 S+ 0 0 44 2,-0.4 -2,-0.1 1,-0.1 3,-0.1 0.375 124.4 80.0 67.1 -2.3 12.4 11.7 48.5 153 156 A A T <4 S+ 0 0 49 -3,-2.8 2,-0.4 1,-0.2 -1,-0.1 0.642 94.4 44.1 -99.4 -17.8 8.8 10.6 49.2 154 157 A I S < S- 0 0 10 -4,-1.5 -2,-0.4 -29,-0.0 -1,-0.2 -0.984 83.8-127.7-130.2 135.0 7.2 13.1 46.8 155 158 A D > - 0 0 51 -2,-0.4 3,-1.7 -3,-0.1 4,-0.2 -0.519 20.3-110.4 -89.5 152.6 8.4 13.9 43.3 156 159 A H G > S+ 0 0 17 1,-0.2 3,-0.9 -2,-0.2 -62,-0.3 0.863 115.3 44.5 -25.6 -67.4 9.2 17.2 41.5 157 160 A C G 3 S+ 0 0 1 1,-0.2 -1,-0.2 -64,-0.1 -61,-0.0 0.467 99.4 73.7 -77.2 4.7 6.2 17.1 39.1 158 161 A S G < S+ 0 0 4 -3,-1.7 -34,-2.4 -35,-0.1 2,-0.3 0.414 82.9 78.8-102.5 9.6 3.6 16.1 41.7 159 162 A V E < - F 0 123A 0 -3,-0.9 -65,-0.9 -36,-0.2 2,-0.3 -0.817 43.8-177.9-126.9 154.0 3.2 19.4 43.6 160 163 A M E +DF 93 122A 0 -38,-2.1 -38,-2.9 -2,-0.3 2,-0.3 -0.979 17.6 174.6-142.5 139.1 1.5 22.8 43.4 161 164 A H E -DF 92 121A 3 -69,-2.2 -69,-3.3 -2,-0.3 -40,-0.2 -0.966 34.9 -91.5-144.2 162.8 1.9 25.5 46.0 162 165 A R E >> -D 91 0A 34 -42,-2.1 3,-1.1 -2,-0.3 4,-0.7 -0.371 34.5-122.1 -69.6 146.0 1.0 29.1 46.8 163 166 A Y H >> S+ 0 0 69 -73,-2.7 3,-1.2 1,-0.2 4,-1.0 0.884 109.1 70.3 -55.1 -31.4 3.4 31.8 45.7 164 167 A S H 3> S+ 0 0 60 -74,-0.3 4,-1.8 1,-0.3 3,-0.3 0.835 86.7 64.6 -62.6 -29.9 3.6 32.9 49.4 165 168 A V H <> S+ 0 0 0 -3,-1.1 4,-2.4 1,-0.2 -1,-0.3 0.909 96.8 56.3 -56.1 -42.1 5.4 29.7 50.3 166 169 A L H - 0 0 42 -107,-0.2 3,-1.9 1,-0.2 -107,-0.1 -0.257 60.7-139.3 -55.9 129.3 24.4 23.9 45.6 181 184 A P G > S+ 0 0 26 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 0.557 94.0 80.5 -70.9 -4.8 25.7 21.0 43.4 182 185 A A G 3 S+ 0 0 12 1,-0.3 44,-1.7 2,-0.1 3,-0.2 0.614 94.9 49.5 -70.8 -13.2 26.0 18.7 46.4 183 186 A F G < S+ 0 0 2 -3,-1.9 3,-0.5 42,-0.2 -1,-0.3 0.030 74.1 122.9-112.7 27.1 22.2 18.2 45.9 184 187 A Y S X S+ 0 0 31 -3,-1.3 3,-0.6 1,-0.2 -1,-0.1 0.827 73.8 45.2 -55.1 -44.7 22.3 17.5 42.2 185 188 A R T 3 S+ 0 0 166 1,-0.2 -1,-0.2 41,-0.2 3,-0.1 0.729 127.1 28.4 -74.7 -24.6 20.6 14.1 42.3 186 189 A I T 3> + 0 0 24 -3,-0.5 4,-1.8 1,-0.1 -1,-0.2 -0.237 69.4 141.5-135.3 51.3 17.9 15.2 44.7 187 190 A G H <> S+ 0 0 2 -3,-0.6 4,-1.7 1,-0.2 -9,-0.3 0.852 76.3 51.8 -62.8 -36.9 17.3 18.9 44.1 188 191 A D H > S+ 0 0 26 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.916 106.7 54.7 -68.0 -40.9 13.6 18.6 44.5 189 192 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.903 108.2 49.7 -56.8 -39.8 14.0 16.8 47.8 190 193 A R H X S+ 0 0 32 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.842 110.0 49.5 -70.3 -36.1 16.2 19.7 49.1 191 194 A F H X S+ 0 0 1 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.921 111.8 49.4 -65.9 -44.5 13.6 22.2 48.0 192 195 A F H X S+ 0 0 2 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.878 105.5 58.2 -61.2 -37.2 11.0 20.2 49.8 193 196 A W H < S+ 0 0 28 -4,-2.3 4,-0.3 2,-0.2 -1,-0.2 0.924 107.4 46.8 -57.4 -47.1 13.2 20.0 52.9 194 197 A R H >< S+ 0 0 15 -4,-1.8 3,-1.7 1,-0.2 -2,-0.2 0.958 112.7 48.8 -60.0 -49.4 13.2 23.8 53.0 195 198 A V H >X S+ 0 0 2 -4,-2.3 3,-2.7 1,-0.3 4,-2.3 0.901 102.6 63.0 -57.6 -41.5 9.4 24.0 52.6 196 199 A N T 3< S+ 0 0 0 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.495 85.2 74.6 -67.6 -6.5 8.9 21.4 55.3 197 200 A H T <4 S+ 0 0 29 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.618 120.1 10.8 -72.3 -12.6 10.4 23.8 57.8 198 201 A F T <4 S+ 0 0 51 -3,-2.7 -2,-0.2 1,-0.4 -3,-0.1 0.615 125.6 41.7-138.7 -25.2 7.1 25.7 57.5 199 202 A Y < - 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0 0 54 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.181 60.0 -61.5 -74.4 176.0 31.0 17.1 44.5 224 239 A P - 0 0 116 0, 0.0 2,-0.6 0, 0.0 0, 0.0 -0.513 61.4-122.0 -60.7 132.9 30.0 14.2 46.9 225 240 A Q - 0 0 58 -2,-0.2 -42,-0.2 -3,-0.1 -43,-0.1 -0.705 16.3-144.0 -90.5 118.2 26.2 13.9 46.8 226 241 A R - 0 0 111 -44,-1.7 2,-0.2 -2,-0.6 -41,-0.2 -0.218 28.3-138.5 -64.0 167.0 24.3 14.2 50.0 227 242 A N > - 0 0 86 1,-0.1 4,-1.4 -42,-0.0 5,-0.1 -0.766 19.8 -96.9-135.7 176.4 21.3 11.9 50.3 228 243 A a H >> S+ 0 0 39 -2,-0.2 4,-3.1 1,-0.2 3,-0.9 0.945 113.9 55.7 -57.2 -58.1 17.7 11.4 51.3 229 244 A R H 3> S+ 0 0 202 1,-0.3 4,-3.5 2,-0.2 5,-0.3 0.913 105.2 55.5 -45.1 -44.5 18.2 9.8 54.7 230 245 A E H 3> S+ 0 0 78 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.921 114.2 39.5 -56.3 -42.5 20.3 12.9 55.7 231 246 A L H