==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 05-FEB-09 3G5T . COMPND 2 MOLECULE: TRANS-ACONITATE 3-METHYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR E.S.BURGIE,C.A.BINGMAN,G.E.WESENBERG,G.N.PHILLIPS JR., . 299 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13886.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 199 66.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 25 8.4 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 . 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 . 13 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 27.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 2 2 2 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 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 PARALLEL BRIDGES PER LADDER . 0 0 0 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 S > 0 0 9 0, 0.0 3,-1.3 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 141.0 39.2 46.3 7.8 2 2 A S G >> + 0 0 93 1,-0.2 3,-1.4 2,-0.2 4,-0.5 0.705 360.0 79.1 -59.7 -21.1 40.7 43.7 10.0 3 3 A T G >4 S+ 0 0 7 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.908 87.2 55.9 -53.3 -40.8 38.2 45.0 12.6 4 4 A F G <4 S+ 0 0 5 -3,-1.3 69,-0.4 1,-0.3 -1,-0.3 0.689 103.2 56.5 -72.6 -12.0 35.5 42.9 10.9 5 5 A S G <4 S+ 0 0 43 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.472 78.2 121.4 -91.2 -4.9 37.7 39.8 11.3 6 6 A A S X< S- 0 0 28 -3,-1.5 3,-1.7 -4,-0.5 -3,-0.0 -0.288 71.3-127.6 -59.6 144.0 37.9 40.1 15.1 7 7 A S T 3 S+ 0 0 114 1,-0.3 -1,-0.2 65,-0.1 -3,-0.0 0.812 110.8 44.0 -60.8 -29.7 36.6 37.2 16.9 8 8 A D T 3 S+ 0 0 86 2,-0.1 -1,-0.3 3,-0.0 2,-0.2 0.170 77.3 129.3-105.5 17.0 34.4 39.5 18.9 9 9 A F < - 0 0 9 -3,-1.7 2,-2.0 1,-0.1 3,-0.2 -0.535 68.2-120.2 -66.2 133.1 33.2 41.7 16.1 10 10 A N > + 0 0 60 -2,-0.2 4,-1.9 1,-0.2 -1,-0.1 -0.520 47.3 162.1 -84.0 78.7 29.4 41.8 16.6 11 11 A S H > S+ 0 0 8 -2,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.803 71.9 60.4 -67.3 -28.1 28.4 40.3 13.2 12 12 A E H > S+ 0 0 135 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.933 106.8 44.9 -64.9 -44.8 25.0 39.5 14.5 13 13 A R H > S+ 0 0 70 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.875 109.2 57.6 -66.9 -35.6 24.3 43.2 15.3 14 14 A Y H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 3,-0.3 0.970 109.3 45.5 -53.6 -50.6 25.7 44.1 11.9 15 15 A S H < S+ 0 0 49 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.892 117.3 43.5 -63.1 -40.2 23.1 41.8 10.3 16 16 A S H < S+ 0 0 85 -4,-2.1 -1,-0.2 1,-0.1 -2,-0.2 0.744 125.2 29.3 -75.4 -26.2 20.3 43.1 12.4 17 17 A S H < S+ 0 0 19 -4,-2.1 -2,-0.2 -3,-0.3 -3,-0.2 0.528 93.3 93.3-121.7 -8.8 21.1 46.8 12.2 18 18 A R S < S- 0 0 26 -4,-2.1 2,-0.1 -5,-0.3 224,-0.0 -0.614 76.3-106.9 -85.9 150.0 22.8 47.6 8.9 19 19 A P - 0 0 1 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.432 29.5-159.5 -73.4 146.7 20.9 48.7 5.9 20 20 A S - 0 0 57 -2,-0.1 30,-0.1 1,-0.0 29,-0.0 -0.418 28.2 -85.5-111.2-168.1 20.3 46.5 2.9 21 21 A Y - 0 0 7 28,-0.2 2,-0.1 -2,-0.2 209,-0.1 -0.729 34.3-108.7-119.8 151.4 19.4 47.5 -0.6 22 22 A P >> - 0 0 42 0, 0.0 4,-1.7 0, 0.0 3,-1.0 -0.388 20.0-123.4 -85.0 151.4 16.3 48.2 -2.5 23 23 A S H 3> S+ 0 0 66 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.839 109.6 62.0 -55.6 -36.3 14.5 46.1 -5.1 24 24 A D H 3> S+ 0 0 141 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.861 104.0 49.7 -61.4 -35.4 14.6 49.0 -7.7 25 25 A F H <> S+ 0 0 7 -3,-1.0 4,-2.3 2,-0.2 -2,-0.2 0.931 110.7 48.5 -68.3 -44.9 18.4 48.9 -7.5 26 26 A Y H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.893 108.9 53.6 -61.4 -38.8 18.5 45.1 -8.1 27 27 A K H X S+ 0 0 117 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.909 107.9 51.3 -60.9 -41.6 16.1 45.5 -11.0 28 28 A X H X S+ 0 0 17 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.915 108.3 51.9 -59.4 -45.9 18.5 48.0 -12.5 29 29 A I H X S+ 0 0 1 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.914 110.0 48.5 -58.2 -44.0 21.4 45.6 -12.1 30 30 A D H < S+ 0 0 13 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.858 108.3 53.6 -66.7 -33.3 19.5 42.9 -13.8 31 31 A E H < S+ 0 0 109 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.857 113.0 46.2 -66.3 -32.9 18.6 45.3 -16.6 32 32 A Y H < S+ 0 0 14 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.923 95.8 85.9 -72.5 -48.4 22.3 46.0 -17.0 33 33 A H < - 0 0 9 -4,-2.5 2,-0.4 -5,-0.1 110,-0.1 -0.299 61.5-161.9 -61.6 136.5 23.6 42.4 -16.8 34 34 A D - 0 0 79 108,-0.5 2,-0.2 81,-0.2 110,-0.1 -0.953 42.0 -3.7-116.5 141.6 23.7 40.4 -20.1 35 35 A G S S+ 0 0 58 -2,-0.4 107,-0.0 108,-0.1 80,-0.0 -0.485 93.3 18.7 95.4-157.9 23.9 36.7 -20.7 36 36 A E - 0 0 109 -2,-0.2 3,-0.1 1,-0.1 -2,-0.1 -0.029 42.9-156.8 -63.7 160.9 24.3 33.6 -18.6 37 37 A R + 0 0 36 1,-0.1 25,-2.5 3,-0.0 26,-0.2 -0.387 50.2 122.4-133.3 45.8 23.6 33.3 -14.9 38 38 A K S S+ 0 0 100 1,-0.3 25,-1.3 23,-0.2 2,-0.4 0.843 78.2 19.2 -78.3 -37.3 25.6 30.3 -13.8 39 39 A L E -a 63 0A 27 23,-0.2 76,-1.7 74,-0.1 77,-1.4 -0.967 52.4-178.7-149.0 125.5 27.7 32.0 -11.1 40 40 A L E -ab 64 116A 0 23,-1.8 25,-2.6 -2,-0.4 2,-0.5 -0.985 13.3-165.7-113.6 128.1 27.4 35.2 -9.0 41 41 A V E -ab 65 117A 0 75,-2.5 77,-2.2 -2,-0.4 2,-0.7 -0.990 4.6-164.9-118.4 123.1 30.2 36.0 -6.6 42 42 A D E > -ab 66 118A 0 23,-2.7 25,-2.6 -2,-0.5 3,-0.5 -0.937 14.6-159.5-106.1 105.1 29.7 38.7 -3.9 43 43 A V E 3 S+ b 0 119A 0 75,-2.5 77,-0.7 -2,-0.7 25,-0.2 -0.525 74.0 21.9 -86.3 159.5 33.1 39.6 -2.4 44 44 A G T 3 S+ 0 0 0 23,-0.5 24,-0.2 52,-0.3 -1,-0.2 0.899 81.8 166.0 50.8 41.0 33.5 41.3 1.0 45 45 A C X> - 0 0 0 22,-2.6 4,-1.0 -3,-0.5 3,-0.7 0.615 17.4-167.3 -71.3 -15.2 30.1 39.8 1.6 46 46 A G T 34 S- 0 0 0 1,-0.2 2,-0.5 21,-0.2 -1,-0.2 -0.340 71.4 -15.0 60.2-144.8 30.0 40.3 5.3 47 47 A P T 34 S- 0 0 3 0, 0.0 -1,-0.2 0, 0.0 27,-0.1 -0.065 113.4 -80.1 -84.6 39.9 27.1 38.3 6.9 48 48 A G T <>>S+ 0 0 1 -3,-0.7 4,-2.6 -2,-0.5 5,-0.6 0.712 78.1 157.3 75.6 25.8 25.5 37.9 3.5 49 49 A T H X5S+ 0 0 22 -4,-1.0 4,-0.6 1,-0.2 -28,-0.2 0.894 82.3 12.4 -51.1 -62.2 24.0 41.4 3.4 50 50 A A H >5S+ 0 0 0 -5,-0.4 4,-2.8 2,-0.1 -1,-0.2 0.796 123.1 67.4 -83.4 -30.7 23.7 41.6 -0.4 51 51 A T H >5S+ 0 0 0 -6,-0.3 4,-1.2 1,-0.2 -2,-0.2 0.917 104.9 39.7 -57.7 -50.5 24.4 37.9 -1.1 52 52 A L H X5S+ 0 0 9 -4,-2.6 4,-0.6 1,-0.2 -1,-0.2 0.879 114.6 54.6 -71.6 -35.0 21.2 36.6 0.5 53 53 A Q H >X - 0 0 0 1,-0.2 4,-2.3 26,-0.1 5,-0.2 -0.700 52.2-171.6 -91.5 113.5 36.3 37.3 8.1 71 71 A A H > S+ 0 0 56 -2,-0.7 4,-2.4 2,-0.2 5,-0.2 0.843 92.0 59.0 -59.8 -35.4 35.4 34.0 9.6 72 72 A T H > S+ 0 0 26 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.956 109.6 41.9 -60.1 -48.6 33.2 35.9 12.1 73 73 A X H > S+ 0 0 0 -69,-0.4 4,-2.3 1,-0.2 -2,-0.2 0.917 113.6 51.8 -64.2 -44.1 31.1 37.4 9.3 74 74 A I H X S+ 0 0 7 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.884 105.3 56.3 -65.9 -36.6 30.9 34.2 7.3 75 75 A K H X S+ 0 0 152 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.930 108.3 47.1 -61.2 -44.0 29.7 32.3 10.3 76 76 A T H X S+ 0 0 10 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.931 109.8 53.6 -61.0 -43.5 26.8 34.7 10.8 77 77 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.916 109.8 48.9 -55.4 -44.0 26.0 34.5 7.0 78 78 A E H X S+ 0 0 87 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.856 106.7 55.3 -66.6 -36.3 25.8 30.7 7.4 79 79 A V H X S+ 0 0 98 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.943 111.0 44.7 -59.4 -46.1 23.6 30.9 10.4 80 80 A I H X S+ 0 0 55 -4,-2.4 4,-0.8 2,-0.2 3,-0.5 0.935 111.6 52.5 -66.0 -43.6 21.1 33.0 8.4 81 81 A K H >< S+ 0 0 42 -4,-2.5 3,-1.4 1,-0.2 7,-0.3 0.947 109.1 50.2 -53.8 -47.9 21.4 30.7 5.4 82 82 A E H 3< S+ 0 0 137 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.758 101.1 63.9 -68.2 -22.9 20.6 27.7 7.7 83 83 A G H 3< S+ 0 0 61 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.719 119.8 22.4 -69.8 -23.8 17.6 29.5 9.1 84 84 A S << 0 0 53 -3,-1.4 4,-1.6 -4,-0.8 -1,-0.3 -0.545 360.0 360.0-138.4 67.7 15.9 29.5 5.6 85 85 A P 0 0 95 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 0.784 360.0 360.0 -66.1 360.0 17.6 26.6 3.8 86 ! 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 87 87 A T 0 0 95 0, 0.0 3,-0.2 0, 0.0 -6,-0.1 0.000 360.0 360.0 360.0 -31.4 15.3 30.1 0.1 88 88 A Y > + 0 0 24 -4,-1.6 3,-2.1 -7,-0.3 -7,-0.0 0.019 360.0 126.2-119.9 30.5 19.1 29.9 0.1 89 89 A K T 3 S+ 0 0 179 1,-0.3 -1,-0.2 -5,-0.1 -8,-0.0 0.740 79.1 46.3 -65.8 -24.5 19.8 26.5 -1.3 90 90 A N T 3 S+ 0 0 28 -3,-0.2 -26,-2.7 -27,-0.1 2,-0.4 0.157 94.4 97.6-101.0 14.3 22.0 27.8 -4.1 91 91 A V E < +c 64 0A 0 -3,-2.1 2,-0.3 -28,-0.2 -26,-0.2 -0.904 45.5 171.5-108.7 131.1 24.0 30.1 -1.8 92 92 A S E -c 65 0A 43 -28,-2.1 -26,-2.6 -2,-0.4 2,-0.4 -0.948 19.4-141.3-131.0 159.8 27.4 29.2 -0.3 93 93 A F E -c 66 0A 11 -2,-0.3 2,-0.3 -28,-0.2 -26,-0.2 -0.946 15.3-173.6-126.5 144.6 30.0 31.2 1.7 94 94 A K E -c 67 0A 82 -28,-2.5 -26,-1.8 -2,-0.4 2,-0.7 -0.982 27.9-126.1-137.2 142.7 33.8 31.1 1.5 95 95 A I E +c 68 0A 110 -2,-0.3 2,-0.3 -28,-0.2 -26,-0.2 -0.794 60.7 124.6 -86.1 115.0 36.7 32.6 3.4 96 96 A S - 0 0 9 -28,-1.7 -52,-0.3 -2,-0.7 -26,-0.1 -0.945 62.2-101.6-167.9 146.3 38.7 34.3 0.8 97 97 A S > - 0 0 30 -2,-0.3 3,-1.8 -28,-0.1 -29,-0.1 -0.323 42.8-108.1 -64.9 157.5 40.2 37.6 -0.1 98 98 A S T 3 S+ 0 0 11 1,-0.3 -1,-0.1 -55,-0.1 -55,-0.1 0.621 120.9 46.3 -68.8 -12.3 38.3 39.6 -2.8 99 99 A D T 3 S+ 0 0 56 35,-0.1 2,-0.6 1,-0.0 -1,-0.3 0.280 95.9 87.5-108.2 8.5 41.1 39.0 -5.3 100 100 A D < + 0 0 51 -3,-1.8 3,-0.2 1,-0.1 -1,-0.0 -0.942 40.0 165.6-114.7 108.9 41.4 35.2 -4.5 101 101 A F > + 0 0 1 -2,-0.6 3,-2.2 1,-0.2 4,-0.2 0.025 34.8 123.4-110.9 28.6 39.0 33.0 -6.5 102 102 A K G > + 0 0 149 1,-0.3 3,-2.2 2,-0.2 7,-0.2 0.788 62.7 73.2 -60.8 -27.4 40.8 29.6 -5.7 103 103 A F G 3 S+ 0 0 50 1,-0.3 -1,-0.3 -3,-0.2 3,-0.1 0.656 81.1 72.4 -63.3 -13.7 37.5 28.4 -4.3 104 104 A L G < S- 0 0 31 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.703 116.6 -96.7 -68.8 -16.2 36.3 28.1 -8.0 105 105 A G X> - 0 0 28 -3,-2.2 4,-2.4 -4,-0.2 3,-2.4 -0.072 32.5 -81.5 105.8 155.3 38.6 25.1 -8.4 106 106 A A T 34 S+ 0 0 97 1,-0.3 -1,-0.1 2,-0.2 -2,-0.1 0.782 129.1 48.4 -63.8 -32.3 42.0 24.6 -9.8 107 107 A D T 34 S+ 0 0 118 1,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.459 116.9 38.1 -87.6 -1.9 40.7 24.6 -13.2 108 108 A S T X4 S+ 0 0 26 -3,-2.4 3,-1.9 -6,-0.1 5,-0.4 0.632 82.2 108.9-119.5 -25.4 38.5 27.7 -13.1 109 109 A V T 3< S+ 0 0 27 -4,-2.4 -7,-0.1 1,-0.3 29,-0.1 -0.361 97.1 1.5 -58.0 133.2 40.4 30.2 -10.9 110 110 A D T 3 S+ 0 0 96 24,-0.1 -1,-0.3 1,-0.1 28,-0.2 0.716 103.6 111.4 61.0 28.2 41.8 33.1 -13.0 111 111 A K S < S- 0 0 120 -3,-1.9 27,-0.2 27,-0.1 -2,-0.1 -0.023 89.8-107.1-124.3 27.4 40.1 31.6 -16.1 112 112 A Q S S+ 0 0 66 25,-2.5 29,-0.2 28,-0.1 26,-0.2 0.903 74.1 133.0 57.6 53.8 37.4 34.2 -16.8 113 113 A K + 0 0 108 -5,-0.4 26,-0.2 25,-0.3 -74,-0.1 0.781 29.3 97.7-105.7 -34.0 34.4 32.1 -15.7 114 114 A I E - d 0 139A 0 24,-2.7 26,-2.5 1,-0.1 3,-0.1 -0.322 52.7-153.9 -72.3 145.9 32.1 34.1 -13.4 115 115 A D E S+ 0 0 3 -76,-1.7 29,-2.2 1,-0.3 2,-0.3 0.858 78.0 9.9 -81.8 -40.0 29.0 35.9 -14.7 116 116 A X E -bd 40 144A 0 -77,-1.4 -75,-2.5 27,-0.2 2,-0.4 -0.982 58.3-167.4-145.9 133.3 28.7 38.6 -12.2 117 117 A I E -bd 41 145A 0 27,-2.6 29,-2.3 -2,-0.3 2,-0.3 -0.990 12.0-170.2-116.3 129.5 31.0 39.9 -9.4 118 118 A T E -bd 42 146A 0 -77,-2.2 -75,-2.5 -2,-0.4 2,-0.3 -0.905 11.5-171.2-115.9 150.7 29.6 42.3 -6.8 119 119 A A E -bd 43 147A 1 27,-2.1 29,-1.8 -2,-0.3 2,-0.5 -0.900 14.9-175.1-140.4 104.9 31.5 44.3 -4.1 120 120 A V E - d 0 148A 0 -77,-0.7 29,-0.2 -2,-0.3 -70,-0.1 -0.893 64.3 -18.6-117.3 121.7 29.2 46.0 -1.7 121 121 A E S S+ 0 0 12 27,-2.8 -1,-0.2 -2,-0.5 28,-0.1 0.857 124.9 74.2 53.8 40.7 30.3 48.3 1.1 122 122 A C > + 0 0 1 26,-0.4 3,-2.3 -3,-0.2 4,-0.3 0.528 55.1 90.6-149.0 -20.1 33.8 47.0 0.9 123 123 A A G > S+ 0 0 4 1,-0.3 3,-1.3 25,-0.3 8,-0.1 0.754 81.0 68.3 -70.4 -18.2 35.8 48.1 -2.1 124 124 A H G 3 S+ 0 0 7 1,-0.3 -1,-0.3 3,-0.1 62,-0.2 0.667 97.3 55.8 -65.1 -20.4 37.1 51.1 -0.3 125 125 A W G < S+ 0 0 45 -3,-2.3 -1,-0.3 2,-0.1 -2,-0.2 0.545 99.8 82.3 -83.3 -11.5 39.1 48.6 1.8 126 126 A F S < S- 0 0 14 -3,-1.3 2,-1.0 -4,-0.3 3,-0.1 -0.472 91.3-109.6 -90.3 163.5 40.7 47.1 -1.3 127 127 A D > - 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0 0 48 -2,-0.4 3,-2.4 80,-0.2 4,-0.2 -0.888 16.6-142.1 -97.0 123.4 23.9 63.0 -1.8 211 211 A A G > S+ 0 0 0 -2,-0.6 3,-2.0 1,-0.3 4,-0.2 0.774 96.6 70.8 -58.0 -29.8 21.2 62.2 0.7 212 212 A E G > S+ 0 0 102 1,-0.3 3,-2.0 2,-0.2 -1,-0.3 0.745 79.8 77.9 -61.4 -18.8 20.5 66.0 1.2 213 213 A D G X S+ 0 0 20 -3,-2.4 3,-2.3 1,-0.3 7,-0.4 0.744 76.3 73.7 -60.9 -24.2 19.0 66.0 -2.2 214 214 A V G < S+ 0 0 25 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.751 91.6 57.8 -58.2 -24.7 15.9 64.4 -0.7 215 215 A R G < S+ 0 0 87 -3,-2.0 2,-0.5 -4,-0.2 -1,-0.3 0.418 99.9 67.5 -81.6 2.3 15.2 67.9 0.8 216 216 A D <> - 0 0 57 -3,-2.3 4,-2.1 1,-0.1 5,-0.2 -0.940 59.8-164.7-136.0 105.6 15.2 69.5 -2.7 217 217 A K H > S+ 0 0 180 -2,-0.5 4,-1.9 1,-0.2 -1,-0.1 0.788 92.3 55.2 -59.3 -30.7 12.5 68.7 -5.2 218 218 A V H > S+ 0 0 70 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.934 106.6 49.2 -69.4 -48.3 14.6 70.2 -8.0 219 219 A K H > S+ 0 0 107 1,-0.2 4,-0.7 2,-0.2 -2,-0.2 0.917 112.1 48.8 -59.4 -40.7 17.6 68.0 -7.4 220 220 A L H >< S+ 0 0 72 -4,-2.1 3,-0.7 -7,-0.4 -1,-0.2 0.912 111.7 49.4 -67.1 -40.0 15.3 64.8 -7.3 221 221 A H H 3< S+ 0 0 166 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.857 113.2 47.2 -64.1 -32.9 13.6 65.8 -10.5 222 222 A Q H 3< S+ 0 0 133 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.380 70.6 134.4-100.9 4.6 16.9 66.4 -12.3 223 223 A H << - 0 0 55 -3,-0.7 3,-0.3 -4,-0.7 -14,-0.0 -0.385 41.8-156.2 -50.3 125.7 19.0 63.3 -11.5 224 224 A T S S+ 0 0 147 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.0 0.431 75.8 36.4 -75.0 1.5 20.7 62.1 -14.8 225 225 A K S S- 0 0 60 -17,-0.1 -1,-0.2 -20,-0.0 -2,-0.0 0.012 100.1 -93.4-163.3 37.5 21.2 58.5 -13.7 226 226 A K - 0 0 141 -3,-0.3 -2,-0.1 1,-0.1 3,-0.0 0.918 51.3-145.8 42.9 73.8 19.0 56.2 -11.4 227 227 A P - 0 0 30 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.256 16.7-108.8 -68.9 151.6 20.5 56.9 -8.0 228 228 A L - 0 0 1 -79,-0.1 2,-0.8 2,-0.0 -19,-0.1 -0.735 34.9-159.3 -77.3 113.0 20.8 54.2 -5.4 229 229 A L - 0 0 62 -2,-0.7 2,-0.8 2,-0.1 -204,-0.1 -0.860 13.9-179.0-104.6 101.4 18.2 55.3 -2.8 230 230 A I + 0 0 4 -2,-0.8 59,-1.7 59,-0.4 2,-0.4 -0.919 19.2 162.3-100.1 99.5 19.0 53.7 0.6 231 231 A R E +G 288 0A 107 -2,-0.8 2,-0.3 57,-0.2 57,-0.2 -0.990 10.5 178.4-122.7 135.0 16.1 55.1 2.7 232 232 A K E -G 287 0A 70 55,-2.5 55,-2.5 -2,-0.4 2,-0.6 -0.993 30.8-130.3-141.4 147.7 15.1 53.5 6.1 233 233 A Q E +G 286 0A 102 -2,-0.3 2,-0.3 53,-0.2 53,-0.2 -0.852 44.0 165.3 -93.3 117.0 12.6 54.0 8.8 234 234 A V E -G 285 0A 7 51,-3.0 51,-2.7 -2,-0.6 2,-0.2 -0.971 34.1-134.2-133.8 146.7 14.5 53.9 12.1 235 235 A T > - 0 0 12 -2,-0.3 4,-2.5 49,-0.3 5,-0.2 -0.521 40.2-104.1 -80.9 168.2 14.0 54.8 15.7 236 236 A L H > S+ 0 0 0 47,-0.3 4,-2.4 44,-0.3 5,-0.1 0.880 125.6 54.4 -60.1 -36.7 16.8 56.7 17.5 237 237 A V H > S+ 0 0 61 44,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.914 107.8 48.3 -63.6 -44.4 17.5 53.4 19.2 238 238 A E H > S+ 0 0 78 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.889 110.6 50.2 -64.5 -39.8 17.9 51.6 15.9 239 239 A F H X S+ 0 0 4 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.933 109.7 51.7 -63.6 -41.8 20.2 54.3 14.5 240 240 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.890 106.5 53.8 -61.0 -36.9 22.3 54.0 17.7 241 241 A D H < S+ 0 0 51 -4,-2.1 4,-0.4 2,-0.2 -1,-0.2 0.896 106.4 52.4 -65.3 -36.5 22.4 50.2 17.1 242 242 A Y H >< S+ 0 0 13 -4,-1.9 3,-1.8 1,-0.2 4,-0.3 0.932 106.8 52.9 -61.6 -45.3 23.8 51.0 13.6 243 243 A V H >< S+ 0 0 0 -4,-2.4 3,-2.0 1,-0.3 6,-0.3 0.911 103.2 58.7 -53.0 -41.3 26.4 53.2 15.2 244 244 A R T 3< S+ 0 0 39 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.615 99.6 58.1 -67.5 -12.0 27.3 50.3 17.4 245 245 A T T < S+ 0 0 1 -3,-1.8 -1,-0.3 -4,-0.4 -2,-0.2 0.402 81.8 114.6 -92.3 -2.8 28.1 48.3 14.2 246 246 A W S <> S- 0 0 15 -3,-2.0 4,-2.4 -4,-0.3 5,-0.2 -0.456 70.0-133.0 -70.5 145.4 30.7 50.7 13.0 247 247 A S H > S+ 0 0 6 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.923 109.7 51.7 -58.1 -43.4 34.3 49.6 12.8 248 248 A A H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.874 108.0 52.0 -63.1 -37.5 35.4 52.8 14.5 249 249 A Y H > S+ 0 0 14 -6,-0.3 4,-3.0 2,-0.2 5,-0.3 0.926 105.7 53.9 -65.3 -43.4 32.9 52.2 17.3 250 250 A H H X S+ 0 0 20 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.941 114.0 42.6 -53.2 -49.0 34.2 48.7 17.9 251 251 A Q H X S+ 0 0 77 -4,-2.0 4,-0.8 1,-0.2 -1,-0.2 0.918 115.9 47.9 -66.6 -44.1 37.7 50.1 18.3 252 252 A W H >< S+ 0 0 7 -4,-2.6 3,-0.9 1,-0.2 6,-0.3 0.931 110.8 50.9 -60.4 -46.7 36.7 53.1 20.4 253 253 A K H 3< S+ 0 0 111 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.829 113.2 44.8 -65.2 -34.3 34.5 51.0 22.7 254 254 A Q H 3< S+ 0 0 101 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.537 85.8 106.8 -87.8 -7.7 37.3 48.5 23.4 255 255 A D X< - 0 0 46 -3,-0.9 3,-2.3 -4,-0.8 4,-0.1 -0.620 65.5-145.4 -77.0 118.0 40.1 51.0 23.9 256 256 A P G > S+ 0 0 112 0, 0.0 3,-1.7 0, 0.0 4,-0.2 0.773 94.5 70.4 -55.8 -22.5 40.9 51.2 27.6 257 257 A K G 3 S+ 0 0 127 1,-0.3 3,-0.3 2,-0.1 -2,-0.1 0.731 97.6 51.6 -68.8 -14.3 41.6 54.9 27.4 258 258 A N G X S+ 0 0 8 -3,-2.3 3,-2.0 -6,-0.3 -1,-0.3 0.319 74.2 111.6-102.2 7.4 37.8 55.5 26.9 259 259 A K T < S+ 0 0 178 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.744 80.8 43.3 -56.8 -33.1 36.6 53.5 29.9 260 260 A D T 3 S+ 0 0 163 -3,-0.3 -1,-0.3 -4,-0.2 2,-0.3 0.269 95.6 100.7 -98.2 11.8 35.4 56.5 31.8 261 261 A K S < S- 0 0 96 -3,-2.0 2,-0.1 1,-0.1 3,-0.1 -0.672 81.0-100.0-100.7 149.3 33.7 58.2 28.9 262 262 A E - 0 0 99 -2,-0.3 2,-0.1 1,-0.1 -1,-0.1 -0.381 50.3 -97.7 -62.7 139.5 30.0 58.3 28.0 263 263 A D > - 0 0 11 1,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.326 26.9-138.9 -61.5 133.9 29.2 55.8 25.3 264 264 A V H > S+ 0 0 16 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.879 101.1 49.5 -67.4 -38.9 29.0 57.6 21.9 265 265 A A H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.916 112.5 47.9 -66.0 -39.8 25.9 55.7 20.7 266 266 A D H > S+ 0 0 79 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.895 108.6 55.7 -65.4 -37.1 24.1 56.5 23.9 267 267 A W H X S+ 0 0 73 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.898 101.4 58.3 -62.2 -40.7 25.2 60.1 23.6 268 268 A F H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.927 107.5 46.2 -53.6 -47.7 23.6 60.3 20.1 269 269 A I H X S+ 0 0 26 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.947 114.0 47.3 -62.4 -49.6 20.3 59.4 21.6 270 270 A K H X S+ 0 0 107 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.926 114.0 46.8 -58.4 -44.0 20.5 61.8 24.4 271 271 A E H X S+ 0 0 23 -4,-3.0 4,-1.9 2,-0.2 -1,-0.2 0.859 109.9 53.9 -71.6 -31.5 21.6 64.7 22.2 272 272 A S H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.926 108.2 49.3 -66.2 -44.8 18.9 63.9 19.6 273 273 A L H < S+ 0 0 55 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.871 108.2 54.6 -60.3 -37.1 16.3 64.1 22.3 274 274 A R H < S+ 0 0 160 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.916 112.4 43.4 -65.2 -37.6 17.8 67.4 23.5 275 275 A R H < S+ 0 0 61 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.802 129.5 25.3 -75.5 -32.3 17.4 68.8 19.9 276 276 A R >< + 0 0 51 -4,-2.1 3,-2.0 -5,-0.1 -1,-0.3 -0.718 69.0 175.0-133.6 76.4 13.9 67.5 19.3 277 277 A P T 3 S+ 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.635 74.3 64.5 -70.0 -14.9 12.3 67.0 22.7 278 278 A E T 3 S+ 0 0 114 2,-0.1 2,-0.4 0, 0.0 -5,-0.1 0.612 84.2 97.7 -72.7 -15.6 9.0 66.0 21.1 279 279 A L < - 0 0 12 -3,-2.0 2,-0.3 -6,-0.2 -3,-0.1 -0.630 64.9-145.7 -84.7 131.4 10.5 62.9 19.7 280 280 A S > - 0 0 51 -2,-0.4 3,-1.6 1,-0.1 -44,-0.3 -0.626 21.3-122.3 -84.7 151.8 10.2 59.6 21.4 281 281 A T T 3 S+ 0 0 51 1,-0.3 -44,-1.3 -2,-0.3 -45,-0.2 0.598 112.6 50.8 -74.0 -5.5 13.0 57.1 21.2 282 282 A N T 3 S+ 0 0 115 -47,-0.1 2,-0.5 -46,-0.1 -1,-0.3 0.230 83.9 111.0-110.7 13.9 10.6 54.5 19.7 283 283 A T < - 0 0 56 -3,-1.6 -47,-0.3 -49,-0.0 2,-0.3 -0.701 68.3-127.2 -87.6 127.8 9.3 56.8 16.9 284 284 A K + 0 0 101 -2,-0.5 2,-0.3 -49,-0.1 -49,-0.3 -0.615 33.3 172.8 -74.5 135.9 10.3 55.9 13.4 285 285 A I E - G 0 234A 7 -51,-2.7 -51,-3.0 -2,-0.3 2,-0.4 -0.911 34.8 -96.3-136.6 160.4 11.9 58.6 11.3 286 286 A E E - G 0 233A 31 -2,-0.3 2,-0.4 -53,-0.2 -129,-0.3 -0.614 32.9-174.6 -84.5 137.9 13.5 58.5 7.9 287 287 A V E - G 0 232A 0 -55,-2.5 -55,-2.5 -2,-0.4 2,-0.3 -0.966 3.9-172.6-123.7 142.8 17.3 58.2 7.4 288 288 A V E -EG 154 231A 0 -134,-2.5 -134,-2.3 -2,-0.4 2,-0.3 -0.995 9.5-145.3-137.5 140.4 18.9 58.4 4.0 289 289 A W E - 0 0 4 -59,-1.7 -59,-0.4 -2,-0.3 2,-0.3 -0.716 21.8-110.5-103.5 153.7 22.5 57.7 3.0 290 290 A N E -E 151 0A 31 -139,-2.1 -139,-2.0 -2,-0.3 2,-0.3 -0.616 51.0-174.5 -66.7 141.8 25.0 59.2 0.5 291 291 A T E -EF 150 209A 0 -82,-2.1 -82,-2.7 -2,-0.3 2,-0.3 -0.939 20.9-174.7-141.6 163.3 25.5 56.4 -2.1 292 292 A F E -EF 149 208A 3 -143,-1.9 -143,-1.9 -2,-0.3 2,-0.3 -0.988 1.8-171.2-147.1 159.0 27.5 55.4 -5.2 293 293 A Y E -EF 148 207A 1 -86,-1.8 -86,-2.4 -2,-0.3 2,-0.4 -0.987 6.3-164.5-146.8 155.9 27.6 52.7 -7.7 294 294 A K E -EF 147 206A 2 -147,-2.5 -147,-2.7 -2,-0.3 2,-0.4 -0.993 11.8-173.7-135.8 127.5 30.0 51.6 -10.5 295 295 A L E +EF 146 205A 1 -90,-2.6 -90,-2.4 -2,-0.4 2,-0.3 -0.966 7.8 167.7-121.5 140.5 29.0 49.1 -13.2 296 296 A G E -E 145 0A 0 -151,-2.2 -151,-2.4 -2,-0.4 2,-0.4 -0.980 27.4-137.7-146.5 162.0 31.1 47.6 -16.0 297 297 A K E -EF 144 202A 7 -95,-2.2 -95,-2.5 -2,-0.3 2,-0.3 -0.966 38.2-107.4-116.0 132.8 31.0 44.8 -18.6 298 298 A R E F 0 201A 20 -155,-2.5 -156,-2.6 -2,-0.4 -97,-0.3 -0.385 360.0 360.0 -69.2 128.4 34.2 42.8 -19.1 299 299 A V 0 0 65 -99,-2.6 -1,-0.1 -2,-0.3 -156,-0.1 -0.429 360.0 360.0 -67.1 360.0 35.9 43.6 -22.3 300 ! 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 0.0 301 308 A X 0 0 11 0, 0.0 -179,-0.1 0, 0.0 -251,-0.1 0.000 360.0 360.0 360.0 360.0 28.5 43.9 3.2