==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-SEP-11 4A00 . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR F.J.FERNANDEZ,D.DEVRIES,E.PENA-SOLER,M.COLL,P.CHRISTEN,H.GEH . 397 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18025.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 274 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 20 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 155 39.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 2 0 0 0 2 1 0 4 1 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 2 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 PARALLEL BRIDGES PER LADDER . 0 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 3 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 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 M 0 0 187 0, 0.0 3,-0.2 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 -32.7 29.2 35.6 4.9 2 2 A F > + 0 0 155 1,-0.2 3,-1.5 2,-0.1 0, 0.0 0.558 360.0 102.6 -98.6 -7.4 27.2 37.9 7.1 3 3 A E T 3 S+ 0 0 157 1,-0.3 -1,-0.2 0, 0.0 0, 0.0 0.750 91.5 31.9 -44.6 -41.4 23.6 36.3 6.4 4 4 A N T 3 S+ 0 0 153 -3,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.352 78.4 139.1-108.4 3.4 23.5 34.5 9.8 5 5 A I < - 0 0 120 -3,-1.5 2,-0.2 1,-0.1 -3,-0.0 -0.271 53.6-123.8 -53.6 125.7 25.4 36.6 12.3 6 6 A T - 0 0 128 1,-0.1 2,-0.1 3,-0.0 -1,-0.1 -0.503 29.3-107.5 -68.3 141.8 23.6 36.7 15.6 7 7 A A - 0 0 86 -2,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.417 30.6-110.2 -69.7 145.0 22.8 40.2 16.9 8 8 A A - 0 0 88 -2,-0.1 -1,-0.1 1,-0.1 0, 0.0 -0.593 48.7-100.9 -66.7 136.5 24.7 41.5 19.8 9 9 A P - 0 0 119 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.281 45.4 -83.1 -62.1 153.1 22.3 41.6 22.7 10 10 A A - 0 0 104 1,-0.1 -2,-0.1 -3,-0.1 4,-0.0 0.673 43.3-137.3 -6.2 -91.2 20.7 44.9 23.8 11 11 A D > - 0 0 66 3,-0.1 4,-2.5 2,-0.1 5,-0.1 0.542 6.1-153.5 99.6 94.1 23.1 46.8 26.0 12 12 A P H > S+ 0 0 100 0, 0.0 4,-4.1 0, 0.0 5,-0.3 0.865 89.6 62.8 -70.2 -34.0 21.2 48.3 28.9 13 13 A I H > S+ 0 0 93 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.962 115.3 32.4 -57.4 -49.8 23.6 51.2 29.5 14 14 A L H > S+ 0 0 90 2,-0.2 4,-3.9 1,-0.2 5,-0.2 0.920 118.4 56.6 -68.0 -42.1 22.8 52.6 26.0 15 15 A G H X S+ 0 0 25 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.880 110.1 45.2 -53.5 -42.0 19.3 51.3 26.3 16 16 A L H X S+ 0 0 28 -4,-4.1 4,-2.7 2,-0.2 -1,-0.2 0.924 112.4 50.0 -67.4 -48.7 19.0 53.3 29.5 17 17 A A H X S+ 0 0 32 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.936 113.3 47.6 -57.8 -45.6 20.5 56.4 27.9 18 18 A D H X S+ 0 0 74 -4,-3.9 4,-2.2 2,-0.2 3,-0.4 0.970 112.4 47.3 -56.9 -56.5 18.1 56.1 24.9 19 19 A L H X S+ 0 0 87 -4,-2.5 4,-0.6 1,-0.2 -1,-0.2 0.875 111.6 54.4 -55.5 -36.7 15.1 55.6 27.2 20 20 A F H < S+ 0 0 36 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.864 108.6 45.9 -66.0 -39.2 16.3 58.6 29.2 21 21 A R H < S+ 0 0 144 -4,-2.1 -2,-0.2 -3,-0.4 -1,-0.2 0.963 113.4 48.4 -69.1 -48.9 16.6 61.0 26.2 22 22 A A H < S+ 0 0 69 -4,-2.2 2,-0.7 -5,-0.2 -1,-0.2 0.536 82.7 111.7 -67.4 -10.8 13.2 60.1 24.7 23 23 A D < - 0 0 17 -4,-0.6 5,-0.1 -5,-0.2 2,-0.1 -0.592 54.4-163.8 -69.3 110.0 11.6 60.5 28.2 24 24 A E + 0 0 185 -2,-0.7 -1,-0.1 0, 0.0 -2,-0.1 -0.089 48.0 118.4 -90.7 34.2 9.4 63.6 27.6 25 25 A R > - 0 0 90 1,-0.1 3,-1.0 -2,-0.1 -2,-0.0 -0.843 62.8-137.7-103.0 141.4 8.9 64.3 31.3 26 26 A P T 3 S+ 0 0 142 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.936 96.6 42.2 -65.0 -47.4 10.2 67.6 32.8 27 27 A G T 3 S+ 0 0 53 2,-0.1 0, 0.0 360,-0.0 0, 0.0 -0.010 75.5 145.8 -96.6 28.8 11.7 66.3 36.0 28 28 A K < - 0 0 62 -3,-1.0 2,-0.4 -5,-0.1 339,-0.2 -0.259 33.7-152.4 -60.1 148.5 13.5 63.1 34.9 29 29 A I E -a 367 0A 12 337,-3.3 339,-3.1 336,-0.1 2,-0.6 -0.972 4.1-152.9-136.1 119.4 16.7 62.3 36.7 30 30 A N E +a 368 0A 17 -2,-0.4 339,-0.1 337,-0.2 337,-0.1 -0.833 33.9 147.7 -94.5 116.2 19.7 60.4 35.3 31 31 A L + 0 0 2 337,-2.8 345,-1.5 -2,-0.6 339,-0.3 0.103 57.3 89.1-121.1 13.7 21.8 58.6 37.8 32 32 A G + 0 0 5 336,-0.2 2,-0.1 337,-0.2 337,-0.1 0.523 65.6 83.9 -96.0 -8.4 22.5 55.8 35.3 33 33 A Q S S- 0 0 37 2,-0.1 346,-0.1 343,-0.1 337,-0.1 -0.434 72.3-123.9-101.6 174.4 25.6 56.9 33.4 34 34 A G S S+ 0 0 7 -2,-0.1 2,-0.3 2,-0.1 313,-0.1 0.281 75.1 88.7 -98.2 7.3 29.4 56.7 34.1 35 35 A V S S- 0 0 38 1,-0.1 -2,-0.1 312,-0.0 2,-0.1 -0.718 76.0-102.7-112.7 157.9 30.5 60.4 33.9 36 36 A Y - 0 0 14 -2,-0.3 2,-0.3 8,-0.1 -1,-0.1 -0.420 31.0-166.4 -70.8 149.1 30.8 63.3 36.3 37 37 A K - 0 0 36 6,-0.1 6,-0.2 343,-0.1 343,-0.1 -0.986 12.0-137.5-134.2 142.8 28.2 66.1 36.3 38 38 A D > - 0 0 28 4,-2.3 3,-2.0 -2,-0.3 276,-0.0 -0.162 45.9 -76.4 -89.3-173.6 28.5 69.4 38.0 39 39 A E T 3 S+ 0 0 114 1,-0.3 344,-0.3 2,-0.1 -1,-0.0 0.732 132.5 53.9 -57.0 -19.7 25.9 71.3 40.0 40 40 A T T 3 S- 0 0 86 2,-0.2 -1,-0.3 341,-0.1 3,-0.1 0.507 118.3-106.6 -92.9 -10.9 24.2 72.3 36.7 41 41 A G S < S+ 0 0 34 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.532 79.2 122.8 96.3 8.0 23.9 68.7 35.3 42 42 A K - 0 0 134 1,-0.0 -4,-2.3 0, 0.0 -1,-0.3 -0.724 61.7-139.2-108.3 156.1 26.6 69.1 32.7 43 43 A T - 0 0 62 -2,-0.3 -6,-0.1 -6,-0.2 2,-0.0 -0.851 42.3-170.8-106.2 88.7 29.9 67.3 31.9 44 44 A P - 0 0 52 0, 0.0 2,-0.5 0, 0.0 -8,-0.1 -0.273 28.3-105.3 -87.1 165.9 32.0 70.4 31.2 45 45 A V - 0 0 72 1,-0.1 204,-0.1 205,-0.1 205,-0.1 -0.775 45.7-112.4 -82.6 130.8 35.5 70.8 29.8 46 46 A L > - 0 0 14 202,-0.5 4,-2.7 -2,-0.5 5,-0.2 -0.330 15.1-126.3 -64.0 148.1 37.9 71.6 32.7 47 47 A T H > S+ 0 0 90 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.909 112.9 54.6 -61.5 -40.4 39.4 75.1 32.6 48 48 A S H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.863 108.1 49.3 -59.9 -39.7 42.8 73.6 32.8 49 49 A V H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.956 108.7 51.5 -64.6 -53.0 42.0 71.5 29.8 50 50 A K H X S+ 0 0 122 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.883 111.5 48.7 -50.0 -41.1 40.8 74.4 27.7 51 51 A K H X S+ 0 0 110 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.881 111.1 49.5 -71.0 -37.4 44.0 76.3 28.6 52 52 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.896 109.5 51.6 -64.9 -39.8 46.1 73.3 27.6 53 53 A E H X S+ 0 0 43 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.863 108.9 51.3 -67.1 -35.7 44.2 73.0 24.2 54 54 A Q H X S+ 0 0 120 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.929 110.1 49.0 -64.1 -49.6 44.8 76.7 23.4 55 55 A Y H X S+ 0 0 125 -4,-2.0 4,-1.7 2,-0.2 5,-0.2 0.890 112.6 47.8 -58.7 -40.5 48.5 76.3 24.1 56 56 A L H X S+ 0 0 15 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.912 109.2 53.8 -70.3 -39.6 48.6 73.2 21.9 57 57 A L H < S+ 0 0 149 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.919 114.5 41.6 -56.8 -42.3 46.7 74.9 19.1 58 58 A E H < S+ 0 0 133 -4,-2.4 -1,-0.2 1,-0.1 -2,-0.2 0.767 124.2 33.8 -82.9 -21.7 49.3 77.8 19.2 59 59 A N H < S+ 0 0 84 -4,-1.7 2,-0.2 -5,-0.2 -2,-0.2 0.737 84.7 103.5-110.5 -26.0 52.4 75.7 19.5 60 60 A E < + 0 0 65 -4,-2.5 3,-0.1 -5,-0.2 -4,-0.0 -0.423 33.3 171.4 -58.9 126.5 52.0 72.4 17.6 61 61 A T + 0 0 142 1,-0.2 2,-0.3 -2,-0.2 -1,-0.1 0.343 64.5 26.5-114.1 -4.5 53.8 72.4 14.3 62 62 A T - 0 0 95 2,-0.1 -1,-0.2 1,-0.0 0, 0.0 -0.987 46.5-157.9-150.6 156.1 53.3 68.7 13.3 63 63 A K + 0 0 159 -2,-0.3 3,-0.1 -3,-0.1 225,-0.1 0.012 45.4 152.6-114.0 22.4 51.0 65.7 13.9 64 64 A N - 0 0 119 1,-0.1 -2,-0.1 0, 0.0 0, 0.0 -0.196 57.0 -74.1 -52.1 144.3 53.7 63.2 13.0 65 65 A Y - 0 0 183 1,-0.1 2,-0.2 220,-0.0 -1,-0.1 0.073 41.6-133.3 -38.8 137.0 53.3 59.8 14.7 66 66 A L - 0 0 46 220,-0.3 5,-0.1 1,-0.2 -1,-0.1 -0.560 38.9 -91.4 -76.9 158.8 54.0 59.3 18.4 67 67 A G > - 0 0 45 3,-0.3 3,-1.7 -2,-0.2 -1,-0.2 -0.210 48.1 -93.2 -62.0 167.0 56.1 56.3 19.3 68 68 A I T 3 S+ 0 0 50 1,-0.3 -1,-0.1 217,-0.2 -2,-0.1 0.782 128.6 46.5 -56.2 -32.6 54.2 53.1 20.1 69 69 A D T 3 S- 0 0 44 1,-0.3 30,-2.7 29,-0.1 -1,-0.3 0.445 109.3-134.5 -94.2 2.8 54.2 53.9 23.8 70 70 A G < + 0 0 5 -3,-1.7 -3,-0.3 28,-0.2 -1,-0.3 -0.414 55.8 2.7 85.9-157.4 53.2 57.6 23.3 71 71 A I >> - 0 0 35 1,-0.1 4,-1.6 -2,-0.1 3,-0.5 -0.521 60.6-142.5 -75.2 120.6 54.5 60.9 24.7 72 72 A P H 3> S+ 0 0 93 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.865 99.5 50.5 -51.0 -46.9 57.5 60.3 27.1 73 73 A E H 3> S+ 0 0 70 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.847 105.3 58.3 -57.2 -38.8 56.5 63.0 29.6 74 74 A F H <> S+ 0 0 1 -3,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.957 107.9 45.7 -57.7 -49.6 53.0 61.5 29.8 75 75 A G H X S+ 0 0 10 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.883 112.8 50.4 -60.0 -42.8 54.4 58.2 30.9 76 76 A R H X S+ 0 0 132 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.940 113.0 44.7 -64.8 -47.6 56.7 59.9 33.4 77 77 A C H X S+ 0 0 10 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.854 111.7 54.5 -64.4 -35.5 53.9 61.9 35.0 78 78 A T H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.3 -2,-0.2 0.943 107.5 50.1 -61.2 -46.8 51.7 58.8 35.0 79 79 A Q H X S+ 0 0 25 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.866 110.8 48.5 -62.8 -41.1 54.3 56.9 36.9 80 80 A E H X S+ 0 0 58 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.868 110.4 51.6 -63.0 -43.8 54.8 59.6 39.6 81 81 A L H < S+ 0 0 2 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.900 118.2 38.2 -57.9 -44.9 51.0 59.9 40.0 82 82 A L H < S+ 0 0 1 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.927 132.1 22.3 -73.1 -46.8 50.7 56.1 40.5 83 83 A F H < S- 0 0 9 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.594 105.9-114.6-105.2 -12.5 53.8 55.4 42.5 84 84 A G >< - 0 0 5 -4,-2.1 3,-1.7 -5,-0.3 6,-0.2 0.227 38.6 -69.3 91.5 143.2 54.8 58.7 44.1 85 85 A K T 3 S+ 0 0 170 1,-0.2 -5,-0.0 -5,-0.1 0, 0.0 -0.412 124.9 30.2 -55.6 139.7 57.8 60.9 43.6 86 86 A G T 3 S+ 0 0 54 1,-0.3 -1,-0.2 2,-0.1 5,-0.1 0.267 81.3 157.9 93.3 -14.0 60.8 59.1 45.0 87 87 A S X> - 0 0 20 -3,-1.7 4,-2.3 1,-0.2 3,-0.9 -0.183 43.5-140.9 -47.7 123.9 59.4 55.6 44.4 88 88 A A H 3> S+ 0 0 52 1,-0.3 4,-3.6 2,-0.2 5,-0.2 0.859 103.1 65.1 -54.0 -38.1 62.2 53.1 44.3 89 89 A L H 34>S+ 0 0 11 1,-0.2 5,-2.4 2,-0.2 6,-0.4 0.897 107.6 40.0 -49.6 -46.0 60.3 51.5 41.4 90 90 A I H X45S+ 0 0 44 -3,-0.9 3,-1.0 3,-0.2 -2,-0.2 0.919 115.4 51.0 -72.3 -44.9 60.9 54.6 39.4 91 91 A N H 3<5S+ 0 0 103 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.2 0.898 113.3 45.0 -58.6 -41.9 64.6 55.1 40.6 92 92 A D T 3<5S- 0 0 93 -4,-3.6 173,-0.5 -5,-0.2 -1,-0.3 0.531 110.0-126.9 -80.9 -6.2 65.4 51.5 39.7 93 93 A K T < 5 + 0 0 141 -3,-1.0 -3,-0.2 -4,-0.3 175,-0.1 0.887 62.4 141.1 61.8 43.7 63.6 51.9 36.3 94 94 A R < + 0 0 34 -5,-2.4 168,-1.9 -6,-0.2 2,-0.4 0.400 50.0 75.7 -91.6 -0.4 61.4 48.8 36.9 95 95 A A E -B 261 0B 6 -6,-0.4 2,-0.4 166,-0.2 166,-0.2 -0.944 52.7-175.3-122.2 130.1 58.3 50.4 35.3 96 96 A R E -B 260 0B 69 164,-2.6 164,-3.2 -2,-0.4 2,-0.4 -0.987 11.5-160.1-120.2 136.1 57.5 51.1 31.7 97 97 A T E -B 259 0B 10 -2,-0.4 2,-0.5 162,-0.3 162,-0.2 -0.957 5.9-163.6-118.1 132.9 54.3 52.9 30.7 98 98 A A E -B 258 0B 0 160,-2.9 160,-2.8 -2,-0.4 2,-0.2 -0.979 23.9-127.4-108.3 129.5 52.5 53.0 27.3 99 99 A Q E -B 257 0B 2 -30,-2.7 158,-0.3 -2,-0.5 156,-0.1 -0.521 38.7-173.7 -62.4 135.6 50.0 55.7 26.6 100 100 A T E -B 256 0B 0 156,-2.2 156,-2.1 -2,-0.2 2,-2.1 -0.897 38.9 -91.3-134.2 161.6 46.7 54.0 25.5 101 101 A P E > S-B 255 0B 29 0, 0.0 4,-1.2 0, 0.0 154,-0.3 -0.517 93.4 -49.9 -72.6 83.0 43.3 54.8 24.2 102 102 A G H > S- 0 0 0 -2,-2.1 4,-1.5 152,-0.6 154,-0.4 0.011 79.4 -64.3 79.6 171.0 41.7 55.1 27.6 103 103 A G H > S+ 0 0 0 152,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.866 134.5 57.1 -56.9 -39.8 41.7 52.8 30.6 104 104 A T H > S+ 0 0 27 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.945 105.4 49.5 -60.0 -48.2 39.8 50.2 28.5 105 105 A G H X S+ 0 0 12 -4,-1.2 4,-2.7 1,-0.2 -1,-0.2 0.871 109.4 53.7 -57.3 -35.8 42.6 50.2 25.9 106 106 A A H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.947 108.3 48.1 -65.4 -47.3 45.0 49.8 28.7 107 107 A L H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.902 114.2 47.9 -59.6 -38.8 43.2 46.7 30.0 108 108 A R H X S+ 0 0 87 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.857 110.1 49.8 -70.2 -41.8 43.1 45.3 26.4 109 109 A V H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.917 114.2 46.9 -60.4 -43.8 46.8 45.9 25.8 110 110 A A H X S+ 0 0 0 -4,-2.7 4,-2.9 -5,-0.2 5,-0.2 0.965 112.3 50.7 -63.1 -47.9 47.5 44.2 29.1 111 111 A A H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.907 114.2 42.5 -57.0 -47.5 45.2 41.3 28.2 112 112 A D H X S+ 0 0 35 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.899 112.5 54.1 -64.9 -44.0 46.8 40.8 24.8 113 113 A F H X S+ 0 0 14 -4,-2.6 4,-1.7 -5,-0.2 -2,-0.2 0.941 114.4 40.8 -56.8 -48.5 50.3 41.1 26.2 114 114 A L H X S+ 0 0 4 -4,-2.9 4,-1.8 2,-0.2 6,-0.4 0.914 113.2 52.2 -65.0 -48.1 49.6 38.4 28.8 115 115 A A H < S+ 0 0 34 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.859 119.0 37.8 -59.0 -35.7 47.7 36.0 26.5 116 116 A K H < S+ 0 0 154 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.718 126.7 28.8 -91.5 -26.8 50.5 36.1 24.0 117 117 A N H < S+ 0 0 57 -4,-1.7 2,-0.3 -5,-0.2 -2,-0.2 0.373 115.4 43.7-123.0 4.5 53.7 36.2 26.1 118 118 A T S < S- 0 0 54 -4,-1.8 0, 0.0 2,-0.2 0, 0.0 -0.861 81.0-109.0-138.0 177.6 52.8 34.4 29.4 119 119 A S + 0 0 99 -2,-0.3 -4,-0.1 -3,-0.0 -5,-0.1 0.341 67.4 138.6 -90.0 3.8 51.1 31.3 30.6 120 120 A V + 0 0 8 -6,-0.4 -2,-0.2 1,-0.2 53,-0.1 -0.286 16.3 161.0 -54.5 131.6 48.3 33.4 32.0 121 121 A K + 0 0 131 51,-0.3 22,-2.4 1,-0.3 2,-0.3 0.488 56.3 41.3-121.7 -16.8 44.9 31.7 31.3 122 122 A R E -c 143 0B 49 50,-0.3 52,-2.3 20,-0.2 2,-0.4 -0.986 53.1-158.6-151.0 139.5 42.6 33.4 33.8 123 123 A V E -cd 144 174B 0 20,-2.6 22,-2.6 -2,-0.3 2,-0.5 -0.993 14.4-147.3-125.8 130.7 41.7 36.7 35.4 124 124 A W E +cd 145 175B 3 50,-3.1 52,-3.0 -2,-0.4 2,-0.3 -0.834 21.9 175.6 -95.8 127.7 39.9 37.1 38.7 125 125 A V E -c 146 0B 6 20,-2.7 22,-2.4 -2,-0.5 4,-0.1 -0.898 34.4 -93.1-125.0 156.8 37.5 40.2 39.1 126 126 A S E -c 147 0B 0 50,-0.3 22,-0.2 -2,-0.3 23,-0.1 -0.350 44.3 -99.7 -64.7 145.9 35.2 41.2 41.9 127 127 A N S S+ 0 0 81 20,-2.5 23,-1.0 1,-0.2 22,-0.4 -0.976 114.3 29.2 -98.1 117.1 31.5 40.3 42.0 128 128 A P S S+ 0 0 25 0, 0.0 2,-0.3 0, 0.0 57,-0.2 0.725 88.2 156.2 -82.0 168.6 30.1 42.6 41.0 129 129 A S - 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0 0 57 0, 0.0 4,-0.7 0, 0.0 5,-0.1 -0.546 32.5-156.7 -76.5 127.9 46.1 59.4 20.0 288 288 A A H > S+ 0 0 36 -2,-0.3 4,-2.9 1,-0.1 5,-0.3 0.900 72.6 68.4 -71.0 -48.7 48.1 62.5 20.8 289 289 A H H > S+ 0 0 53 1,-0.3 4,-2.4 2,-0.2 -1,-0.1 0.834 103.8 39.2 -53.5 -57.2 45.6 65.3 21.7 290 290 A G H > S+ 0 0 2 -37,-0.4 4,-2.1 1,-0.2 -1,-0.3 0.889 119.6 45.5 -57.6 -47.2 44.2 64.1 25.0 291 291 A A H X S+ 0 0 1 -4,-0.7 4,-2.5 -38,-0.2 -1,-0.2 0.801 111.3 54.9 -68.6 -33.7 47.4 62.7 26.4 292 292 A S H X S+ 0 0 20 -4,-2.9 4,-2.5 2,-0.2 5,-0.2 0.905 105.8 51.5 -66.2 -43.1 49.2 65.9 25.3 293 293 A V H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.3 -2,-0.2 0.967 111.8 48.4 -53.6 -49.5 46.6 67.9 27.2 294 294 A V H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.892 112.5 46.2 -61.5 -43.3 47.4 65.7 30.2 295 295 A A H X S+ 0 0 8 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.858 111.9 51.2 -69.6 -36.1 51.2 66.0 29.9 296 296 A T H < S+ 0 0 21 -4,-2.5 4,-0.2 2,-0.2 -2,-0.2 0.888 114.2 44.7 -71.1 -34.7 51.0 69.8 29.4 297 297 A I H >< S+ 0 0 0 -4,-2.5 3,-1.3 -5,-0.2 7,-0.4 0.964 115.1 46.7 -68.5 -50.6 48.8 70.1 32.5 298 298 A L H 3< S+ 0 0 8 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.797 113.3 47.0 -66.1 -27.1 50.9 67.7 34.8 299 299 A S T 3< S+ 0 0 68 -4,-1.8 2,-0.5 -5,-0.2 -1,-0.3 0.324 98.1 79.0-100.3 6.4 54.3 69.2 33.9 300 300 A N <> - 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