==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 07-FEB-07 2OT1 . COMPND 2 MOLECULE: FRUCTOSE-BISPHOSPHATE ALDOLASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR M.ST-JEAN,T.IZARD,J.SYGUSCH . 1399 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49016.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 984 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 162 11.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 1.7 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 76 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 144 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 510 36.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 1.7 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 4 0 0 5 0 1 6 4 4 8 4 0 0 0 4 0 4 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 12 3 9 4 0 0 4 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 . 4 0 4 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 0 0 0 0 4 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 P 0 0 57 0, 0.0 2,-0.4 0, 0.0 1259,-0.1 0.000 360.0 360.0 360.0 173.4 23.5 9.0 34.2 2 2 A H - 0 0 38 505,-0.2 2,-0.4 1257,-0.1 1254,-0.0 -0.916 360.0-122.7-115.9 140.7 25.6 6.0 35.5 3 3 A S + 0 0 47 -2,-0.4 466,-0.1 1,-0.1 465,-0.0 -0.630 27.7 171.4 -85.0 131.2 27.4 5.8 38.8 4 4 A H - 0 0 50 464,-0.4 464,-0.2 -2,-0.4 -1,-0.1 -0.682 45.5-119.4-135.5 74.1 31.2 5.1 38.9 5 5 A P - 0 0 97 0, 0.0 463,-0.3 0, 0.0 464,-0.1 0.254 23.7-165.7 -19.8 110.6 31.9 5.6 42.6 6 6 A A S S+ 0 0 24 461,-0.2 2,-0.3 462,-0.2 462,-0.1 0.822 77.5 28.6 -73.9 -30.5 34.5 8.4 42.9 7 7 A L S S- 0 0 13 460,-0.1 -1,-0.1 461,-0.1 172,-0.1 -0.950 75.6-130.2-133.6 150.8 35.0 7.4 46.5 8 8 A T > - 0 0 60 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.483 38.7-102.8 -90.3 166.3 34.7 4.2 48.6 9 9 A P H > S+ 0 0 57 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.878 124.3 52.2 -57.1 -36.8 32.8 4.1 51.9 10 10 A E H > S+ 0 0 139 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.896 108.2 49.5 -66.6 -41.3 36.2 4.2 53.8 11 11 A Q H > S+ 0 0 58 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.888 110.7 51.6 -65.4 -37.7 37.3 7.3 51.8 12 12 A K H X S+ 0 0 39 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.930 107.8 51.3 -64.0 -45.8 34.0 9.0 52.6 13 13 A K H X S+ 0 0 104 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.913 109.4 50.3 -59.0 -44.1 34.3 8.3 56.3 14 14 A E H X S+ 0 0 85 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.931 114.2 44.1 -60.7 -46.5 37.8 9.8 56.4 15 15 A L H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.939 115.6 46.8 -64.5 -48.1 36.7 13.0 54.6 16 16 A S H X S+ 0 0 7 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.925 111.6 51.6 -60.9 -44.9 33.5 13.4 56.7 17 17 A D H X S+ 0 0 50 -4,-2.9 4,-1.9 -5,-0.3 -1,-0.2 0.906 111.6 47.0 -59.1 -42.7 35.3 12.8 59.9 18 18 A I H X S+ 0 0 1 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.938 111.4 51.1 -64.4 -47.2 37.9 15.4 59.1 19 19 A A H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.913 111.6 47.2 -57.3 -45.8 35.3 17.9 58.0 20 20 A H H < S+ 0 0 100 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.866 108.4 54.9 -65.9 -36.7 33.3 17.5 61.3 21 21 A R H >< S+ 0 0 124 -4,-1.9 3,-0.9 -5,-0.2 -1,-0.2 0.887 105.9 53.0 -63.7 -38.8 36.4 17.8 63.4 22 22 A I H 3< S+ 0 0 0 -4,-1.9 52,-0.3 1,-0.2 -1,-0.2 0.887 119.0 32.5 -65.2 -40.8 37.3 21.1 61.9 23 23 A V T 3< S+ 0 0 11 -4,-1.4 -1,-0.2 51,-0.1 -2,-0.2 0.044 83.7 149.4-106.8 26.1 34.0 22.7 62.6 24 24 A A X - 0 0 25 -3,-0.9 3,-2.7 1,-0.2 50,-0.1 -0.225 67.2 -62.2 -56.0 149.3 33.1 20.9 65.8 25 25 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.2 0, 0.0 314,-0.1 0.015 126.0 8.4 -38.0 125.5 30.9 23.0 68.2 26 26 A G T 3 S+ 0 0 8 312,-0.3 2,-0.3 1,-0.2 312,-0.1 0.395 106.2 116.8 81.1 -3.1 32.7 26.2 69.3 27 27 A K < + 0 0 56 -3,-2.7 -1,-0.2 311,-0.1 46,-0.2 -0.732 33.9 166.0-104.8 150.8 35.6 25.7 66.8 28 28 A G E -a 73 0A 0 44,-2.3 46,-2.9 -2,-0.3 47,-1.5 -0.722 33.2 -90.6-140.6-169.2 36.8 27.7 63.9 29 29 A I E -ab 75 300A 0 270,-2.5 272,-1.5 -2,-0.2 2,-0.6 -0.936 16.1-147.3-120.8 134.5 39.7 28.2 61.5 30 30 A L E -ab 76 301A 0 45,-2.4 47,-2.6 -2,-0.4 2,-1.0 -0.877 17.1-152.1 -94.5 118.9 42.8 30.4 61.8 31 31 A A E +a 77 0A 6 270,-3.2 274,-0.1 -2,-0.6 47,-0.1 -0.818 35.3 150.5 -95.8 100.7 43.7 31.4 58.2 32 32 A A E +a 78 0A 1 45,-1.9 47,-0.5 -2,-1.0 -1,-0.1 -0.069 31.5 115.6-119.2 31.1 47.5 32.0 58.3 33 33 A D + 0 0 7 45,-0.3 2,-0.3 49,-0.0 47,-0.1 -0.075 32.9 150.1 -93.4 33.8 48.3 31.0 54.7 34 34 A E - 0 0 29 45,-0.1 45,-0.2 -3,-0.1 5,-0.0 -0.504 46.4-124.5 -69.2 130.1 49.5 34.4 53.5 35 35 A S > - 0 0 41 -2,-0.3 4,-2.9 1,-0.1 3,-0.4 -0.302 26.4-104.2 -69.4 159.7 52.0 33.9 50.7 36 36 A T H > S+ 0 0 42 1,-0.3 4,-0.7 2,-0.2 -1,-0.1 0.796 126.0 50.6 -55.8 -28.0 55.4 35.6 51.2 37 37 A G H 4 S+ 0 0 63 2,-0.2 4,-0.5 1,-0.2 -1,-0.3 0.853 113.4 43.3 -78.1 -35.3 54.3 38.2 48.7 38 38 A S H > S+ 0 0 51 -3,-0.4 4,-0.5 1,-0.2 3,-0.3 0.786 111.6 53.2 -79.2 -30.1 51.0 38.8 50.6 39 39 A I H X S+ 0 0 2 -4,-2.9 4,-2.5 1,-0.2 5,-0.3 0.696 91.2 79.0 -77.8 -19.7 52.7 38.9 54.0 40 40 A A H X S+ 0 0 35 -4,-0.7 4,-1.8 -5,-0.3 -1,-0.2 0.906 92.2 48.6 -54.4 -47.0 55.2 41.5 52.8 41 41 A K H > S+ 0 0 157 -4,-0.5 4,-1.9 -3,-0.3 -1,-0.2 0.851 110.4 54.3 -63.5 -33.8 52.6 44.3 53.1 42 42 A R H < S+ 0 0 111 -4,-0.5 4,-0.3 1,-0.2 -2,-0.2 0.965 111.9 40.4 -63.6 -55.2 51.8 43.0 56.6 43 43 A L H ><>S+ 0 0 1 -4,-2.5 5,-3.2 1,-0.2 3,-0.6 0.750 111.4 60.5 -66.7 -24.3 55.4 43.1 57.9 44 44 A Q H ><5S+ 0 0 141 -4,-1.8 3,-2.4 -5,-0.3 -1,-0.2 0.922 95.3 59.9 -68.8 -44.2 55.9 46.4 56.1 45 45 A S T 3<5S+ 0 0 88 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.607 112.1 41.5 -60.3 -12.0 53.2 48.1 58.1 46 46 A I T < 5S- 0 0 31 -3,-0.6 -1,-0.3 -4,-0.3 -2,-0.2 0.024 115.6-112.1-123.8 26.1 55.3 47.2 61.2 47 47 A G T < 5 + 0 0 70 -3,-2.4 2,-0.5 1,-0.2 -3,-0.2 0.841 67.7 146.0 46.3 44.0 58.7 48.1 59.8 48 48 A T < - 0 0 18 -5,-3.2 -1,-0.2 -8,-0.1 -2,-0.1 -0.946 53.5-117.4-116.5 123.9 59.8 44.4 59.8 49 49 A E - 0 0 149 -2,-0.5 2,-1.5 1,-0.1 5,-0.2 -0.313 29.6-121.6 -56.5 130.8 62.1 43.0 57.2 50 50 A N + 0 0 57 4,-0.1 2,-0.3 3,-0.1 -1,-0.1 -0.611 55.3 147.0 -80.6 90.6 60.3 40.3 55.3 51 51 A T > - 0 0 40 -2,-1.5 4,-2.4 1,-0.1 5,-0.3 -0.897 62.3-115.0-124.5 154.1 62.6 37.3 55.9 52 52 A E H > S+ 0 0 110 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.844 117.9 56.9 -53.9 -33.1 61.8 33.6 56.2 53 53 A E H > S+ 0 0 96 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.966 108.1 42.5 -64.0 -54.9 63.1 33.9 59.7 54 54 A N H > S+ 0 0 41 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.823 115.0 52.1 -62.5 -31.5 60.6 36.7 60.8 55 55 A R H X S+ 0 0 20 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.897 110.1 48.4 -71.2 -39.2 57.8 34.8 59.0 56 56 A R H X S+ 0 0 36 -4,-2.3 4,-2.7 -5,-0.3 -2,-0.2 0.925 112.7 48.5 -64.7 -44.9 58.7 31.6 60.9 57 57 A F H X S+ 0 0 12 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.926 111.4 49.1 -61.5 -46.9 58.8 33.5 64.2 58 58 A Y H X S+ 0 0 2 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.935 114.0 45.2 -59.7 -47.4 55.4 35.2 63.5 59 59 A R H X S+ 0 0 2 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.906 112.4 52.1 -63.2 -40.7 53.8 31.9 62.6 60 60 A Q H X S+ 0 0 12 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.919 104.7 57.6 -60.3 -42.3 55.4 30.3 65.6 61 61 A L H < S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.903 113.5 38.3 -54.4 -44.6 54.0 33.1 67.7 62 62 A L H >< S+ 0 0 2 -4,-1.7 3,-1.4 1,-0.2 -2,-0.2 0.941 116.6 49.1 -73.1 -49.3 50.4 32.2 66.6 63 63 A L H 3< S+ 0 0 10 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.766 112.1 48.8 -64.3 -27.2 50.8 28.5 66.5 64 64 A T T 3< S+ 0 0 46 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.1 0.152 77.7 138.3-100.9 19.9 52.3 28.3 70.0 65 65 A A < - 0 0 1 -3,-1.4 5,-0.1 1,-0.1 -3,-0.1 -0.261 67.1 -78.5 -59.6 153.6 49.7 30.5 71.7 66 66 A D > - 0 0 41 1,-0.1 3,-1.7 2,-0.1 4,-0.2 0.018 49.5 -93.5 -53.6 162.5 48.7 29.1 75.2 67 67 A D T 3 S+ 0 0 115 1,-0.3 3,-0.4 2,-0.2 -1,-0.1 0.411 108.4 88.5 -61.0 0.6 46.2 26.3 75.5 68 68 A R T 3 S+ 0 0 105 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.781 87.1 53.6 -70.2 -23.5 43.2 28.6 75.8 69 69 A V S X> S+ 0 0 4 -3,-1.7 4,-2.4 1,-0.2 3,-2.1 0.703 83.9 89.2 -81.5 -21.5 42.9 28.6 72.0 70 70 A N T 34 S+ 0 0 37 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.866 91.4 41.8 -44.8 -50.4 42.8 24.8 71.8 71 71 A P T 34 S+ 0 0 76 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.586 117.0 52.0 -77.7 -5.2 39.0 24.6 72.1 72 72 A C T <4 S+ 0 0 1 -3,-2.1 -44,-2.3 1,-0.2 2,-0.7 0.766 99.6 64.9 -96.5 -32.8 38.6 27.6 69.8 73 73 A I E < +a 28 0A 11 -4,-2.4 -44,-0.2 -46,-0.2 -1,-0.2 -0.842 44.4 165.0-103.3 111.2 40.7 26.4 66.9 74 74 A G E S+ 0 0 1 -46,-2.9 29,-2.2 -2,-0.7 2,-0.3 0.681 72.5 10.7 -92.1 -21.8 39.6 23.4 64.9 75 75 A G E -ac 29 103A 0 -47,-1.5 -45,-2.4 27,-0.3 2,-0.4 -0.997 56.3-152.2-156.4 156.9 41.9 24.0 62.0 76 76 A V E -ac 30 104A 6 27,-2.4 29,-3.2 -2,-0.3 2,-0.5 -0.986 13.6-147.4-135.5 123.6 44.8 26.1 60.8 77 77 A I E -ac 31 105A 0 -47,-2.6 -45,-1.9 -2,-0.4 2,-0.3 -0.795 22.7-170.7 -92.1 124.4 45.5 27.0 57.1 78 78 A L E -ac 32 106A 0 27,-2.3 29,-2.2 -2,-0.5 -45,-0.3 -0.790 22.3-122.1-115.2 158.2 49.2 27.2 56.3 79 79 A F >> - 0 0 50 -47,-0.5 4,-1.6 -2,-0.3 3,-0.6 -0.669 41.6-100.8 -90.7 152.9 51.1 28.4 53.3 80 80 A H H 3> S+ 0 0 85 -2,-0.3 4,-0.7 27,-0.3 3,-0.4 0.862 121.1 53.1 -39.1 -56.1 53.5 25.9 51.7 81 81 A E H >4 S+ 0 0 33 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.901 108.5 49.5 -48.8 -50.0 56.6 27.4 53.3 82 82 A T H X4 S+ 0 0 0 -3,-0.6 3,-2.0 1,-0.3 11,-0.3 0.823 96.7 68.2 -63.6 -34.8 55.1 27.2 56.8 83 83 A L H 3< S+ 0 0 4 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.769 107.4 41.8 -56.9 -25.4 54.0 23.6 56.5 84 84 A Y T << S+ 0 0 100 -3,-1.2 -1,-0.3 -4,-0.7 2,-0.2 0.186 95.7 98.4-109.9 16.6 57.7 22.6 56.5 85 85 A Q < - 0 0 11 -3,-2.0 8,-2.9 -29,-0.0 2,-0.3 -0.611 58.7-142.9 -99.8 164.3 59.0 24.9 59.2 86 86 A K B -I 92 0B 119 6,-0.3 -26,-0.1 -2,-0.2 5,-0.1 -0.896 14.9-112.5-127.7 156.5 59.7 24.1 62.8 87 87 A A > - 0 0 9 4,-2.9 3,-2.3 -2,-0.3 -30,-0.1 -0.291 46.5 -94.2 -76.2 169.6 59.3 25.8 66.2 88 88 A D T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -31,-0.0 0.838 126.6 58.9 -54.9 -35.5 62.5 26.7 68.1 89 89 A D T 3 S- 0 0 100 2,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.459 122.2-105.8 -75.1 -1.0 62.2 23.4 70.0 90 90 A G S < S+ 0 0 40 -3,-2.3 -2,-0.1 1,-0.3 -1,-0.1 0.280 73.9 139.2 96.5 -11.7 62.4 21.5 66.8 91 91 A R - 0 0 78 -5,-0.1 -4,-2.9 1,-0.1 -1,-0.3 -0.506 58.5-116.3 -71.2 128.7 58.8 20.4 66.5 92 92 A P B >> -I 86 0B 47 0, 0.0 4,-1.7 0, 0.0 3,-0.9 -0.390 25.4-118.4 -62.0 140.1 57.4 20.7 62.9 93 93 A F H 3> S+ 0 0 0 -8,-2.9 4,-2.4 -11,-0.3 5,-0.2 0.860 113.9 57.5 -49.7 -41.5 54.6 23.2 62.8 94 94 A P H 3> S+ 0 0 10 0, 0.0 4,-2.4 0, 0.0 -1,-0.3 0.909 106.7 50.3 -57.1 -39.3 52.1 20.6 61.7 95 95 A Q H <> S+ 0 0 90 -3,-0.9 4,-2.4 1,-0.2 -2,-0.2 0.892 108.2 52.4 -64.3 -40.5 52.9 18.7 64.9 96 96 A V H X S+ 0 0 1 -4,-1.7 4,-0.9 2,-0.2 -1,-0.2 0.913 110.7 47.9 -61.7 -44.2 52.5 21.8 67.0 97 97 A I H ><>S+ 0 0 6 -4,-2.4 5,-2.2 1,-0.2 3,-0.7 0.945 113.4 46.5 -62.2 -50.3 49.0 22.4 65.5 98 98 A K H ><5S+ 0 0 96 -4,-2.4 3,-2.2 1,-0.2 -2,-0.2 0.859 104.9 59.8 -62.3 -39.1 47.9 18.8 66.0 99 99 A S H 3<5S+ 0 0 82 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.792 103.7 53.2 -60.8 -27.2 49.1 18.6 69.6 100 100 A K T <<5S- 0 0 32 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.237 128.4-100.3 -91.5 12.0 46.8 21.5 70.4 101 101 A G T < 5S+ 0 0 46 -3,-2.2 2,-0.2 1,-0.3 -3,-0.2 0.581 79.7 133.1 82.8 11.6 43.9 19.6 68.9 102 102 A G < - 0 0 7 -5,-2.2 2,-0.3 -6,-0.2 -1,-0.3 -0.639 53.8-126.2 -99.9 155.1 43.8 21.3 65.5 103 103 A V E -c 75 0A 10 -29,-2.2 -27,-2.4 -2,-0.2 2,-0.4 -0.755 27.9-124.3 -94.2 141.3 43.6 20.0 62.0 104 104 A V E -c 76 0A 0 37,-0.5 39,-3.0 -2,-0.3 40,-1.3 -0.742 28.3-171.6 -91.6 130.8 46.3 21.1 59.5 105 105 A G E -cd 77 144A 0 -29,-3.2 -27,-2.3 -2,-0.4 2,-0.4 -0.819 7.7-153.5-118.8 159.8 45.3 22.8 56.3 106 106 A I E -cd 78 145A 2 38,-1.9 40,-1.9 -2,-0.3 2,-0.4 -0.993 16.8-129.5-137.8 131.6 47.2 23.8 53.2 107 107 A K E + d 0 146A 36 -29,-2.2 -27,-0.3 -2,-0.4 40,-0.2 -0.627 30.9 170.8 -74.7 130.3 46.6 26.5 50.5 108 108 A V + 0 0 0 38,-2.6 39,-0.2 -2,-0.4 -1,-0.1 0.505 38.0 100.7-121.3 -6.4 46.8 24.9 47.1 109 109 A D - 0 0 21 37,-0.9 17,-0.3 1,-0.1 3,-0.1 -0.369 62.2-141.5 -76.9 161.7 45.7 27.5 44.6 110 110 A K - 0 0 88 15,-3.2 16,-0.2 1,-0.4 -1,-0.1 -0.143 53.4 -91.5-114.6 35.5 48.2 29.5 42.5 111 111 A G - 0 0 29 14,-0.2 14,-2.5 37,-0.1 -1,-0.4 0.026 54.0 -54.5 82.7 170.7 46.4 32.8 42.6 112 112 A V E -J 124 0C 71 12,-0.2 12,-0.3 -3,-0.1 37,-0.1 -0.509 42.6-163.4 -86.6 154.4 44.0 34.5 40.2 113 113 A V E -J 123 0C 30 10,-2.6 10,-2.2 -2,-0.2 2,-0.1 -0.977 30.1 -97.4-134.2 145.8 44.4 35.1 36.5 114 114 A P E -J 122 0C 105 0, 0.0 2,-0.7 0, 0.0 8,-0.3 -0.347 25.3-134.7 -68.0 143.6 42.5 37.5 34.3 115 115 A L > - 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0 0 113 -3,-2.3 3,-2.5 1,-0.1 -1,-0.2 -0.835 53.3-154.5 -99.7 115.7 59.9 42.5 68.5 317 317 A K G > S+ 0 0 139 -2,-0.6 3,-1.4 1,-0.3 4,-0.2 0.743 94.5 69.4 -56.3 -22.8 60.5 39.2 70.1 318 318 A E G 3 S+ 0 0 149 1,-0.3 -1,-0.3 2,-0.1 3,-0.3 0.738 93.4 57.2 -68.1 -22.5 60.0 41.0 73.4 319 319 A N G <> S+ 0 0 55 -3,-2.5 4,-3.2 -6,-0.3 5,-0.3 0.249 71.7 115.3 -93.1 12.5 56.4 41.5 72.6 320 320 A L H <> S+ 0 0 52 -3,-1.4 4,-2.8 1,-0.2 5,-0.2 0.920 80.0 39.2 -46.3 -61.2 55.7 37.8 72.2 321 321 A K H > S+ 0 0 132 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.880 116.3 51.0 -61.1 -41.1 53.2 37.4 75.1 322 322 A A H > S+ 0 0 54 -4,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.938 113.6 46.0 -62.3 -45.2 51.5 40.8 74.4 323 323 A A H >X S+ 0 0 0 -4,-3.2 4,-1.5 -11,-0.2 3,-0.5 0.932 112.2 49.0 -62.7 -48.9 51.0 39.8 70.8 324 324 A Q H 3X S+ 0 0 12 -4,-2.8 4,-2.9 -5,-0.3 -1,-0.2 0.850 104.6 61.1 -60.7 -35.5 49.8 36.2 71.6 325 325 A E H 3X S+ 0 0 66 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.870 102.5 50.9 -59.9 -39.3 47.3 37.7 74.1 326 326 A E H <>S+ 0 0 74 -4,-2.0 5,-2.6 1,-0.2 3,-1.5 0.904 112.9 56.3 -67.6 -39.3 31.8 32.3 71.6 337 337 A A H ><5S+ 0 0 0 -4,-2.1 3,-2.2 1,-0.3 -50,-0.3 0.915 99.2 56.0 -59.8 -46.8 30.5 33.9 68.5 338 338 A C T 3<5S+ 0 0 13 -4,-2.9 -312,-0.3 1,-0.3 -41,-0.3 0.461 113.0 45.7 -68.8 5.3 30.2 30.7 66.5 339 339 A Q T < 5S- 0 0 85 -3,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.314 116.2-115.5-121.9 -2.7 27.9 29.6 69.3 340 340 A G T < 5S+ 0 0 17 -3,-2.2 -3,-0.2 -4,-0.3 -2,-0.1 0.834 87.2 110.1 69.6 33.4 25.9 32.8 69.5 341 341 A K < + 0 0 139 -5,-2.6 2,-0.4 -6,-0.1 -4,-0.2 0.053 40.9 122.1-125.8 24.5 27.2 33.6 73.0 342 342 A Y + 0 0 25 -6,-0.3 -9,-0.1 -5,-0.2 -8,-0.0 -0.757 29.6 174.1 -95.7 134.2 29.5 36.6 72.3 343 343 A T - 0 0 114 -2,-0.4 -62,-0.0 2,-0.1 -7,-0.0 -0.909 30.3-124.6-139.8 107.5 29.0 40.0 73.9 344 344 A P 0 0 61 0, 0.0 -67,-0.0 0, 0.0 0, 0.0 0.097 360.0 360.0 -46.0 159.3 31.6 42.7 73.3 345 345 A S 0 0 173 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 -0.303 360.0 360.0 54.7 360.0 33.4 44.5 76.1 346 ! 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 0.0 347 360 A N 0 0 98 0, 0.0 3,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 17.2 12.0 37.7 57.1 348 361 A H + 0 0 34 1,-0.2 720,-0.2 2,-0.2 721,-0.1 0.444 360.0 76.5 -91.5 -7.3 9.9 37.9 53.9 349 362 A A 0 0 78 1,-0.2 -1,-0.2 719,-0.1 717,-0.0 0.388 360.0 360.0 -82.4 0.9 11.7 41.1 53.1 350 363 A Y 0 0 51 -3,-0.4 -1,-0.2 715,-0.1 -2,-0.2 0.677 360.0 360.0-113.9 360.0 14.7 39.0 52.1 351 !* 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 0.0 352 1 B P 0 0 42 0, 0.0 2,-0.4 0, 0.0 555,-0.1 0.000 360.0 360.0 360.0 168.7 25.3 40.5 27.8 353 2 B H - 0 0 43 -197,-0.2 2,-0.3 553,-0.1 505,-0.0 -0.927 360.0-128.5-118.0 138.4 27.9 43.2 27.7 354 3 B S + 0 0 52 -2,-0.4 -236,-0.1 -236,-0.1 549,-0.0 -0.645 27.7 167.5 -88.7 135.7 31.0 43.5 25.5 355 4 B H - 0 0 47 -238,-0.4 -238,-0.1 -2,-0.3 -1,-0.0 -0.669 44.8-121.4-142.7 76.3 34.5 44.0 26.8 356 5 B P - 0 0 105 0, 0.0 -239,-0.3 0, 0.0 -238,-0.1 0.200 20.8-164.3 -26.2 116.5 36.7 43.3 23.7 357 6 B A S S+ 0 0 23 -241,-0.2 2,-0.3 -240,-0.2 -240,-0.1 0.800 77.5 29.8 -76.7 -29.1 39.2 40.5 24.4 358 7 B L S S- 0 0 12 -242,-0.1 -1,-0.1 -241,-0.1 172,-0.1 -0.951 74.5-131.1-134.6 151.1 41.1 41.5 21.3 359 8 B T > - 0 0 61 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.491 39.5-102.6 -90.8 165.9 41.9 44.7 19.3 360 9 B P H > S+ 0 0 57 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.879 124.3 53.4 -57.9 -34.1 41.5 44.8 15.5 361 10 B E H > S+ 0 0 136 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.893 108.5 47.2 -66.9 -41.6 45.3 44.6 15.3 362 11 B Q H > S+ 0 0 62 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.875 111.6 52.2 -68.0 -36.7 45.5 41.5 17.5 363 12 B K H X S+ 0 0 37 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.926 108.0 51.0 -64.4 -44.5 42.7 39.9 15.5 364 13 B K H X S+ 0 0 102 -4,-2.3 4,-3.0 -5,-0.2 5,-0.2 0.938 109.0 50.8 -58.4 -48.4 44.5 40.5 12.2 365 14 B E H X S+ 0 0 85 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.928 113.5 44.5 -55.3 -48.7 47.7 38.9 13.5 366 15 B L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.904 114.8 47.8 -64.8 -43.5 45.9 35.8 14.6 367 16 B S H X S+ 0 0 6 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.908 110.5 51.8 -65.8 -41.9 43.8 35.5 11.5 368 17 B D H X S+ 0 0 53 -4,-3.0 4,-1.8 -5,-0.2 -1,-0.2 0.917 111.9 47.3 -61.2 -42.1 46.8 36.0 9.2 369 18 B I H X S+ 0 0 3 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.956 110.9 50.2 -63.7 -50.4 48.7 33.2 11.1 370 19 B A H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.891 111.8 48.8 -56.0 -41.2 45.8 30.8 11.0 371 20 B H H < S+ 0 0 100 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.857 107.2 54.8 -68.8 -35.1 45.4 31.3 7.2 372 21 B R H >< S+ 0 0 120 -4,-1.8 3,-1.0 1,-0.2 -1,-0.2 0.892 106.0 52.9 -65.4 -38.5 49.1 30.8 6.5 373 22 B I H 3< S+ 0 0 0 -4,-1.9 52,-0.3 1,-0.2 -1,-0.2 0.874 118.7 34.0 -65.1 -38.7 49.1 27.5 8.2 374 23 B V T 3< S+ 0 0 9 -4,-1.4 -1,-0.2 -5,-0.2 3,-0.2 0.072 83.0 149.8-107.4 25.3 46.2 26.1 6.2 375 24 B A X - 0 0 25 -3,-1.0 3,-2.8 1,-0.2 50,-0.1 -0.175 68.0 -63.5 -53.2 150.9 46.9 27.9 2.9 376 25 B P T 3 S+ 0 0 118 0, 0.0 -1,-0.2 0, 0.0 314,-0.1 -0.084 126.2 8.2 -42.1 122.6 45.7 25.9 -0.2 377 26 B G T 3 S+ 0 0 5 312,-0.4 2,-0.3 1,-0.3 312,-0.1 0.416 105.4 116.3 84.3 -1.0 47.6 22.6 -0.4 378 27 B K < + 0 0 57 -3,-2.8 -1,-0.3 311,-0.1 2,-0.2 -0.753 34.1 168.6-106.6 150.4 49.3 23.0 3.0 379 28 B G E -k 424 0D 0 44,-2.1 46,-2.8 -2,-0.3 47,-1.5 -0.796 33.3 -91.8-141.2-176.2 49.1 21.0 6.1 380 29 B I E -kl 426 651D 0 270,-3.4 272,-1.7 -2,-0.2 2,-0.7 -0.874 18.4-144.6-111.9 137.2 50.8 20.5 9.5 381 30 B L E -kl 427 652D 0 45,-2.5 47,-2.7 -2,-0.4 2,-1.0 -0.881 16.5-151.0 -96.5 115.8 53.6 18.2 10.5 382 31 B A E +k 428 0D 5 270,-3.3 274,-0.1 -2,-0.7 47,-0.1 -0.771 36.5 149.7 -90.9 99.2 52.9 17.0 14.0 383 32 B A E +k 429 0D 2 45,-1.7 47,-0.5 -2,-1.0 -1,-0.1 -0.107 31.7 115.0-120.2 34.3 56.4 16.3 15.4 384 33 B D + 0 0 8 45,-0.3 2,-0.3 49,-0.0 45,-0.1 -0.106 33.2 151.7 -96.9 34.5 55.6 17.2 19.1 385 34 B E - 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0 0 117 -3,-2.2 3,-1.7 1,-0.2 -1,-0.2 -0.759 50.1-153.9 -89.0 119.5 -22.5 0.8 46.3 1373 317 D K G > S+ 0 0 152 -2,-0.6 3,-1.1 1,-0.3 -1,-0.2 0.809 94.7 61.6 -60.1 -30.7 -24.0 3.9 47.9 1374 318 D E G 3 S+ 0 0 149 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.648 93.1 65.3 -71.6 -14.6 -24.8 1.9 51.0 1375 319 D N G <> + 0 0 57 -3,-1.7 4,-2.5 -6,-0.3 -1,-0.3 0.081 68.0 111.9 -95.3 23.9 -21.1 1.2 51.5 1376 320 D L H <> S+ 0 0 47 -3,-1.1 4,-3.1 2,-0.2 5,-0.3 0.981 78.2 43.0 -58.1 -62.5 -20.4 4.9 52.1 1377 321 D K H > S+ 0 0 160 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.889 115.2 50.3 -51.3 -47.1 -19.4 4.5 55.8 1378 322 D A H > S+ 0 0 49 -4,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.929 113.4 45.5 -59.6 -47.4 -17.4 1.4 55.2 1379 323 D A H >X S+ 0 0 0 -4,-2.5 4,-1.6 -11,-0.2 3,-0.7 0.958 112.7 48.9 -61.4 -53.0 -15.5 3.1 52.4 1380 324 D Q H 3X S+ 0 0 14 -4,-3.1 4,-2.9 1,-0.3 -1,-0.2 0.847 106.2 59.4 -56.6 -35.0 -14.8 6.3 54.3 1381 325 D E H 3X S+ 0 0 74 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.3 0.870 103.2 50.7 -62.4 -38.6 -13.6 4.2 57.2 1382 326 D E H <>S+ 0 0 73 -4,-1.7 5,-2.7 -3,-0.2 3,-1.4 0.850 110.3 58.2 -75.7 -35.7 1.4 9.3 62.4 1393 337 D A H ><5S+ 0 0 0 -4,-2.1 3,-1.5 1,-0.3 -50,-0.3 0.886 98.7 56.8 -62.4 -40.9 4.0 8.3 59.8 1394 338 D C T 3<5S+ 0 0 15 -4,-2.2 -312,-0.4 1,-0.3 -41,-0.3 0.392 111.5 46.1 -74.6 8.8 4.9 11.8 58.9 1395 339 D Q T < 5S- 0 0 71 -3,-1.4 -1,-0.3 -313,-0.1 -2,-0.2 0.345 114.9-116.5-123.2 -5.7 5.7 12.3 62.6 1396 340 D G T < 5S+ 0 0 20 -3,-1.5 -3,-0.2 -4,-0.3 -2,-0.1 0.827 86.6 112.8 70.3 32.0 7.7 9.0 63.0 1397 341 D K < + 0 0 133 -5,-2.7 2,-0.4 -8,-0.1 -4,-0.2 -0.031 42.1 116.3-123.1 28.0 5.1 7.7 65.4 1398 342 D Y + 0 0 26 -6,-0.3 -9,-0.0 -5,-0.2 -8,-0.0 -0.858 28.6 165.7-106.7 134.8 3.6 4.9 63.3 1399 343 D T 0 0 118 -2,-0.4 -62,-0.0 1,-0.1 -6,-0.0 -0.878 360.0 360.0-146.9 107.8 3.8 1.2 64.1 1400 344 D P 0 0 110 0, 0.0 -1,-0.1 0, 0.0 -11,-0.0 0.765 360.0 360.0 -44.2 360.0 1.5 -1.3 62.2 1401 ! 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 1402 359 D S > 0 0 128 0, 0.0 3,-0.6 0, 0.0 -1389,-0.0 0.000 360.0 360.0 360.0 61.9 27.1 3.4 58.4 1403 360 D N G > + 0 0 58 1,-0.2 3,-1.1 2,-0.1 -56,-0.0 0.487 360.0 77.4 -88.1 -4.6 25.8 6.4 56.4 1404 361 D H G 3 S+ 0 0 30 1,-0.2 -1,-0.2 2,-0.2 -1392,-0.2 0.536 79.8 70.9 -80.5 -6.3 29.1 6.6 54.5 1405 362 D A G < 0 0 59 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.1 0.451 360.0 360.0 -86.4 -1.9 27.8 3.6 52.5 1406 363 D Y < 0 0 46 -3,-1.1 -2,-0.2 -1397,-0.1 -1,-0.2 0.716 360.0 360.0-109.5 360.0 25.3 5.9 50.9