==== 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 TRANSFERASE(AMINOTRANSFERASE) 02-DEC-91 8AAT . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR C.A.MCPHALEN,M.G.VINCENT,J.N.JANSONIUS . 802 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31191.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 576 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 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 . 52 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 316 39.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.0 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 5 1 0 1 4 1 1 4 6 3 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 0 4 0 2 2 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 PARALLEL BRIDGES PER LADDER . 0 2 2 0 2 0 2 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 . 6 0 0 0 0 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 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 3 A S 0 0 43 0, 0.0 667,-0.0 0, 0.0 641,-0.0 0.000 360.0 360.0 360.0 11.1 29.5 -5.5 44.7 2 4 A S + 0 0 53 1,-0.1 3,-0.4 2,-0.1 4,-0.1 0.918 360.0 153.5 57.0 48.4 29.9 -7.6 41.5 3 5 A W S S+ 0 0 5 1,-0.2 3,-0.2 2,-0.1 521,-0.1 0.712 71.8 36.7 -73.9 -28.8 26.2 -7.4 40.9 4 6 A W S > S+ 0 0 1 1,-0.1 3,-2.0 2,-0.1 -1,-0.2 0.151 73.3 113.6-115.1 15.7 26.7 -7.8 37.1 5 7 A S T 3 S+ 0 0 77 -3,-0.4 -1,-0.1 1,-0.3 -2,-0.1 0.726 82.1 54.1 -59.3 -24.2 29.5 -10.3 36.7 6 8 A H T 3 S+ 0 0 56 -3,-0.2 2,-0.6 -4,-0.1 -1,-0.3 0.420 79.9 109.2 -90.1 -1.3 27.0 -12.7 35.2 7 9 A V < - 0 0 1 -3,-2.0 2,-0.2 666,-0.0 670,-0.1 -0.692 60.4-150.1 -81.0 120.7 25.8 -10.3 32.6 8 10 A E - 0 0 150 -2,-0.6 2,-0.2 1,-0.1 672,-0.1 -0.591 23.3 -97.3 -92.8 151.3 27.0 -11.5 29.2 9 11 A M - 0 0 107 -2,-0.2 667,-0.1 1,-0.1 -1,-0.1 -0.515 45.6-122.4 -68.0 130.2 27.8 -9.4 26.2 10 12 A G - 0 0 9 666,-0.3 -1,-0.1 -2,-0.2 670,-0.1 -0.328 35.3 -85.9 -72.8 160.0 24.8 -9.4 23.9 11 13 A P - 0 0 114 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.341 49.6-106.7 -68.1 148.0 25.2 -10.6 20.3 12 14 A P - 0 0 121 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.392 29.9-107.0 -77.3 153.9 26.3 -8.0 17.7 13 15 A D > - 0 0 61 1,-0.1 4,-1.4 -2,-0.1 0, 0.0 -0.714 19.2-152.6 -86.1 125.0 24.0 -6.5 15.1 14 16 A P H > S+ 0 0 89 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.881 97.2 53.9 -62.1 -43.4 24.7 -7.8 11.6 15 17 A I H > S+ 0 0 52 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.848 106.3 54.2 -60.2 -36.2 23.5 -4.6 10.0 16 18 A L H > S+ 0 0 97 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.852 104.1 55.3 -64.3 -38.6 25.9 -2.7 12.2 17 19 A G H X S+ 0 0 44 -4,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.928 108.8 47.6 -58.8 -49.2 28.6 -5.0 10.8 18 20 A V H X S+ 0 0 25 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.873 111.9 48.7 -60.8 -44.1 27.6 -4.0 7.3 19 21 A T H X S+ 0 0 44 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.870 111.4 50.1 -65.8 -39.4 27.6 -0.2 8.1 20 22 A E H X S+ 0 0 77 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.874 111.4 46.3 -67.1 -43.8 31.0 -0.4 9.8 21 23 A A H X S+ 0 0 22 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.888 112.0 53.0 -66.7 -40.6 32.8 -2.2 7.0 22 24 A F H < S+ 0 0 44 -4,-2.0 3,-0.5 1,-0.2 -2,-0.2 0.912 108.4 50.8 -58.1 -46.2 31.1 0.3 4.6 23 25 A K H < S+ 0 0 130 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.805 108.9 51.2 -62.1 -35.1 32.6 3.1 6.7 24 26 A R H < S+ 0 0 182 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.715 87.3 104.2 -76.7 -25.9 36.0 1.5 6.6 25 27 A D < - 0 0 29 -4,-1.5 5,-0.0 -3,-0.5 -3,-0.0 -0.348 50.8-166.5 -63.6 135.3 36.1 1.2 2.8 26 28 A T + 0 0 143 -2,-0.1 2,-0.4 3,-0.0 -1,-0.1 0.569 52.4 111.2 -98.2 -13.1 38.2 3.7 0.8 27 29 A N > - 0 0 63 1,-0.2 3,-2.0 2,-0.1 -2,-0.1 -0.531 62.5-146.6 -66.4 119.4 36.9 3.0 -2.7 28 30 A S T 3 S+ 0 0 127 -2,-0.4 -1,-0.2 1,-0.3 342,-0.0 0.527 95.9 65.9 -65.6 -6.1 34.9 6.2 -3.6 29 31 A K T 3 S+ 0 0 124 2,-0.1 -1,-0.3 362,-0.0 -2,-0.1 0.451 74.6 128.9 -93.6 -3.9 32.6 3.8 -5.6 30 32 A K < - 0 0 60 -3,-2.0 2,-0.4 -8,-0.1 341,-0.2 -0.132 42.9-156.0 -54.9 149.0 31.3 2.1 -2.5 31 33 A M E -a 371 0A 4 339,-2.5 341,-3.1 353,-0.0 2,-0.7 -0.992 9.5-149.2-131.4 137.5 27.6 1.8 -1.9 32 34 A N E +a 372 0A 25 -2,-0.4 3,-0.4 351,-0.3 341,-0.2 -0.911 25.8 162.0-109.7 101.5 25.7 1.3 1.4 33 35 A L + 0 0 0 339,-3.4 347,-1.8 -2,-0.7 341,-0.3 0.034 66.6 76.0-105.0 23.1 22.5 -0.7 0.7 34 36 A G + 0 0 3 339,-0.2 -1,-0.2 345,-0.2 2,-0.2 0.333 67.0 127.8-109.6 -2.4 22.1 -1.5 4.4 35 37 A V - 0 0 18 -3,-0.4 347,-0.3 345,-0.2 348,-0.2 -0.359 45.2-161.8 -64.3 128.2 20.8 2.0 5.1 36 38 A G + 0 0 39 -2,-0.2 2,-0.3 2,-0.1 -1,-0.1 0.348 65.5 56.9 -96.7 4.7 17.5 2.2 7.0 37 39 A A S S- 0 0 6 314,-0.0 213,-0.1 343,-0.0 431,-0.0 -0.893 93.7 -82.9-131.9 161.7 16.4 5.7 6.3 38 40 A Y - 0 0 14 -2,-0.3 8,-0.4 8,-0.1 2,-0.3 -0.280 40.5-168.2 -66.9 148.0 15.7 7.7 3.2 39 41 A R - 0 0 47 6,-0.2 345,-0.1 343,-0.1 -4,-0.0 -0.984 18.0-123.2-135.7 140.4 18.6 9.3 1.4 40 42 A D > - 0 0 46 4,-3.1 3,-2.5 -2,-0.3 6,-0.0 -0.048 43.0 -83.7 -76.6-179.1 18.4 11.9 -1.4 41 43 A D T 3 S+ 0 0 47 1,-0.3 346,-0.4 2,-0.1 345,-0.1 0.723 132.6 55.0 -58.9 -22.6 19.9 11.6 -4.9 42 44 A N T 3 S- 0 0 119 2,-0.2 -1,-0.3 343,-0.1 343,-0.1 0.237 121.2-108.7 -95.6 10.8 23.1 12.9 -3.4 43 45 A G S < S+ 0 0 48 -3,-2.5 -2,-0.1 1,-0.2 342,-0.0 0.740 77.7 131.3 67.5 28.9 23.1 10.1 -0.8 44 46 A K - 0 0 125 1,-0.1 -4,-3.1 0, 0.0 -1,-0.2 -0.857 65.3 -97.2-117.2 151.5 22.3 12.6 2.0 45 47 A P - 0 0 49 0, 0.0 2,-0.5 0, 0.0 -6,-0.2 -0.242 40.8-143.6 -57.1 144.9 19.7 12.7 4.8 46 48 A Y - 0 0 66 -8,-0.4 2,-0.6 -6,-0.0 -8,-0.1 -0.951 17.9-170.9-129.7 118.1 16.6 14.7 3.9 47 49 A V - 0 0 27 -2,-0.5 206,-0.1 207,-0.0 207,-0.1 -0.918 36.9-118.6 -99.4 119.2 14.6 17.0 6.2 48 50 A L > - 0 0 0 -2,-0.6 4,-1.7 204,-0.5 3,-0.4 -0.214 11.9-123.5 -62.0 154.4 11.4 18.0 4.3 49 51 A N H > S+ 0 0 90 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.889 112.9 56.5 -61.9 -45.7 10.8 21.6 3.6 50 52 A C H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.765 104.9 54.4 -60.5 -28.3 7.5 21.5 5.4 51 53 A V H > S+ 0 0 0 -3,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.925 107.1 48.5 -71.2 -48.1 9.3 20.2 8.4 52 54 A R H X S+ 0 0 54 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.952 114.7 47.3 -54.5 -53.3 11.7 23.2 8.4 53 55 A K H X S+ 0 0 82 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.865 110.6 49.8 -56.4 -46.8 8.7 25.5 8.1 54 56 A A H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.924 111.9 50.4 -60.8 -42.5 6.7 23.9 10.9 55 57 A E H X S+ 0 0 48 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.900 108.6 50.2 -60.6 -45.7 9.8 24.1 13.1 56 58 A A H X S+ 0 0 61 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.841 108.0 56.2 -61.5 -36.7 10.2 27.8 12.4 57 59 A M H X S+ 0 0 73 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.865 107.1 46.5 -63.8 -43.0 6.5 28.3 13.2 58 60 A I H <>S+ 0 0 20 -4,-1.7 5,-1.0 2,-0.2 4,-0.4 0.861 111.5 52.3 -67.0 -40.2 6.9 26.8 16.7 59 61 A A H ><5S+ 0 0 63 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.921 107.9 53.0 -61.3 -46.2 10.0 28.9 17.3 60 62 A A H 3<5S+ 0 0 80 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.768 104.6 54.3 -60.6 -33.3 8.0 31.9 16.3 61 63 A K T 3<5S- 0 0 120 -4,-1.2 -1,-0.3 -3,-0.1 -2,-0.2 0.464 98.8-134.0 -82.2 -5.7 5.2 31.2 18.8 62 64 A K T < 5 - 0 0 137 -3,-1.3 -3,-0.1 -4,-0.4 -2,-0.1 0.943 34.8-166.3 47.4 59.6 7.5 31.0 21.8 63 66 A M < - 0 0 55 -5,-1.0 -1,-0.1 1,-0.1 2,-0.0 -0.401 14.9-116.3 -75.2 153.1 5.7 27.8 22.9 64 67 A D - 0 0 62 -2,-0.1 -1,-0.1 1,-0.1 385,-0.0 -0.177 11.2-129.5 -80.2 177.1 6.2 26.5 26.4 65 68 A K + 0 0 5 590,-0.1 593,-3.1 -2,-0.0 594,-0.3 -0.053 52.3 149.8-121.2 28.9 7.7 23.1 27.2 66 69 A E - 0 0 27 591,-0.2 226,-0.0 1,-0.1 383,-0.0 -0.249 56.3 -85.5 -67.5 149.3 5.0 21.9 29.5 67 70 A Y - 0 0 78 1,-0.1 -1,-0.1 590,-0.0 591,-0.1 -0.199 41.2-132.5 -51.9 142.9 4.1 18.2 29.9 68 71 A L - 0 0 18 222,-0.4 5,-0.1 1,-0.2 -1,-0.1 -0.581 37.0 -86.5 -92.3 159.3 1.7 16.9 27.4 69 72 A P > - 0 0 83 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 -0.219 45.7-103.9 -59.5 157.0 -1.3 14.8 28.6 70 73 A I T 3 S+ 0 0 29 1,-0.3 3,-0.1 219,-0.2 -2,-0.1 0.902 125.4 51.8 -49.2 -46.6 -0.4 11.1 28.9 71 74 A A T 3 S- 0 0 12 1,-0.2 30,-2.8 218,-0.1 -1,-0.3 0.552 114.0-126.7 -70.9 -12.2 -2.3 10.4 25.7 72 75 A G < - 0 0 5 -3,-1.8 2,-0.7 28,-0.2 -1,-0.2 -0.448 52.2 -13.4 97.0-168.2 -0.3 13.1 23.9 73 76 A L >> - 0 0 38 -2,-0.2 4,-2.4 1,-0.1 3,-1.4 -0.608 53.3-149.2 -74.4 108.9 -1.3 16.2 21.8 74 77 A A H 3> S+ 0 0 69 -2,-0.7 4,-2.5 1,-0.3 5,-0.3 0.795 97.2 53.6 -47.0 -42.4 -5.0 16.1 20.9 75 78 A D H 3> S+ 0 0 99 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.799 114.1 45.9 -63.5 -32.4 -4.5 18.0 17.6 76 79 A F H <> S+ 0 0 0 -3,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.900 112.4 45.9 -78.2 -49.9 -1.9 15.4 16.8 77 80 A T H X S+ 0 0 22 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.889 115.9 47.8 -63.3 -41.2 -3.8 12.2 17.8 78 81 A R H X S+ 0 0 86 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.913 113.5 45.5 -64.3 -49.6 -7.0 13.5 16.0 79 82 A A H X S+ 0 0 0 -4,-1.3 4,-2.0 -5,-0.3 -1,-0.2 0.834 111.4 56.3 -61.6 -34.3 -5.1 14.4 12.8 80 83 A S H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.927 108.8 43.8 -65.9 -45.9 -3.3 11.1 13.0 81 84 A A H X S+ 0 0 0 -4,-1.9 4,-3.6 2,-0.2 5,-0.4 0.914 113.8 50.7 -66.3 -45.1 -6.5 9.0 13.1 82 85 A E H X S+ 0 0 22 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.873 107.7 55.1 -60.9 -38.5 -8.0 11.1 10.3 83 86 A L H < S+ 0 0 2 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.912 117.0 35.6 -59.8 -47.3 -4.9 10.5 8.3 84 87 A A H < S+ 0 0 1 -4,-1.9 -2,-0.2 1,-0.1 -1,-0.2 0.886 125.9 35.0 -73.9 -48.1 -5.2 6.7 8.7 85 88 A L H < S- 0 0 8 -4,-3.6 -3,-0.2 -5,-0.1 -2,-0.2 0.696 109.1-111.9 -83.2 -27.4 -9.0 6.2 8.5 86 89 A G >< - 0 0 12 -4,-2.3 3,-1.8 -5,-0.4 6,-0.2 0.232 24.9 -93.9 99.7 138.4 -9.9 9.0 6.0 87 90 A E T 3 S+ 0 0 125 1,-0.3 -1,-0.1 -4,-0.1 6,-0.1 0.862 126.0 41.3 -50.0 -46.3 -11.9 12.1 6.7 88 91 A N T 3 S+ 0 0 124 4,-0.1 -1,-0.3 -6,-0.1 -2,-0.1 0.245 83.0 133.7 -91.7 11.3 -15.2 10.5 5.7 89 92 A S <> - 0 0 25 -3,-1.8 4,-2.7 1,-0.1 5,-0.2 -0.349 57.6-137.7 -62.4 140.6 -14.6 7.2 7.4 90 93 A E H > S+ 0 0 113 2,-0.2 4,-2.2 1,-0.2 6,-0.2 0.870 105.4 54.5 -66.3 -38.3 -17.6 6.0 9.4 91 94 A A H 4>S+ 0 0 0 2,-0.2 5,-1.8 1,-0.2 6,-0.3 0.845 112.2 43.9 -63.5 -38.6 -15.2 5.0 12.2 92 95 A F H >45S+ 0 0 30 -6,-0.2 3,-1.7 3,-0.2 -2,-0.2 0.968 113.9 47.7 -71.7 -58.5 -13.7 8.4 12.3 93 96 A K H 3<5S+ 0 0 138 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.837 112.6 48.4 -54.2 -42.4 -17.0 10.4 12.1 94 97 A S T 3<5S- 0 0 55 -4,-2.2 175,-0.3 -5,-0.2 -1,-0.3 0.509 107.0-130.6 -77.1 -6.9 -18.7 8.4 14.8 95 98 A G T < 5 + 0 0 27 -3,-1.7 -3,-0.2 -5,-0.1 177,-0.1 0.802 58.9 143.1 59.7 37.2 -15.6 8.8 17.0 96 99 A R < + 0 0 25 -5,-1.8 170,-3.3 -6,-0.2 2,-0.3 0.043 46.6 78.5 -97.3 27.4 -15.4 5.1 17.8 97 100 A Y E -B 265 0B 42 -6,-0.3 2,-0.4 168,-0.2 168,-0.2 -0.827 64.3-148.7-125.0 162.5 -11.6 4.9 17.8 98 101 A V E -B 264 0B 5 166,-1.6 166,-2.4 -2,-0.3 2,-0.4 -0.984 14.1-170.0-134.8 127.4 -9.1 5.9 20.4 99 102 A T E -B 263 0B 9 -2,-0.4 2,-0.4 164,-0.2 164,-0.2 -0.996 2.1-173.1-123.0 128.5 -5.7 7.1 19.3 100 103 A V E -B 262 0B 0 162,-2.8 162,-3.0 -2,-0.4 -28,-0.2 -0.917 29.2-113.6-119.0 145.3 -2.8 7.7 21.7 101 104 A Q E -B 261 0B 0 -30,-2.8 160,-0.3 -2,-0.4 2,-0.3 -0.537 40.7-176.9 -72.1 143.4 0.6 9.3 20.9 102 105 A G E -B 260 0B 0 158,-1.9 2,-1.8 -2,-0.2 158,-0.8 -0.797 43.9 -81.1-134.5 173.4 3.4 6.7 21.2 103 106 A I E > S-B 259 0B 2 -2,-0.3 4,-2.5 585,-0.2 156,-0.2 -0.617 89.7 -67.5 -81.8 83.1 7.2 6.8 20.9 104 107 A S H > S- 0 0 2 -2,-1.8 4,-1.9 154,-0.9 156,-0.3 -0.129 88.5 -45.9 60.7-162.7 7.2 6.6 17.1 105 108 A G H > S+ 0 0 7 154,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.892 139.8 55.4 -64.7 -44.6 6.0 3.3 15.5 106 109 A T H > S+ 0 0 9 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.953 110.4 42.4 -53.9 -59.2 8.1 1.2 17.9 107 110 A G H X S+ 0 0 2 -4,-2.5 4,-2.9 582,-0.4 -1,-0.2 0.869 115.0 52.3 -55.4 -42.2 6.7 2.6 21.1 108 111 A S H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.899 109.3 49.4 -63.4 -41.3 3.2 2.5 19.5 109 112 A L H X S+ 0 0 2 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.917 113.8 46.6 -61.7 -45.3 3.7 -1.2 18.6 110 113 A R H X S+ 0 0 13 -4,-2.7 4,-2.8 578,-0.3 5,-0.2 0.906 109.3 51.8 -63.6 -47.1 4.8 -1.9 22.2 111 114 A V H X S+ 0 0 1 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.901 112.8 48.6 -55.7 -43.4 2.0 -0.0 23.9 112 115 A G H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.859 110.3 49.7 -63.2 -41.7 -0.3 -2.0 21.7 113 116 A A H X S+ 0 0 0 -4,-2.0 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34.3 509 110 B G H X S+ 0 0 1 -4,-2.2 4,-2.5 -222,-0.4 -1,-0.2 0.802 113.2 52.3 -67.0 -32.1 11.3 6.1 31.2 510 111 B S H X S+ 0 0 0 -4,-1.1 4,-2.2 -5,-0.2 -2,-0.2 0.901 109.5 48.4 -68.5 -42.2 14.7 5.9 32.8 511 112 B L H X S+ 0 0 1 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.843 113.1 48.9 -62.6 -39.7 13.2 4.4 36.0 512 113 B R H X S+ 0 0 16 -4,-1.8 4,-2.5 -226,-0.2 -2,-0.2 0.923 110.6 48.2 -68.7 -46.8 11.2 1.9 33.9 513 114 B V H X S+ 0 0 1 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.925 113.9 49.5 -58.0 -45.9 14.3 0.9 31.8 514 115 B G H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.886 111.6 47.6 -57.8 -46.8 16.1 0.5 35.1 515 116 B A H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.855 112.5 48.4 -63.7 -44.2 13.3 -1.6 36.6 516 117 B N H X S+ 0 0 17 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.808 109.6 54.3 -66.1 -36.7 13.0 -3.8 33.5 517 118 B F H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.2 5,-0.4 0.906 111.0 45.1 -64.3 -44.3 16.8 -4.3 33.6 518 119 B L H X S+ 0 0 0 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.841 108.0 55.3 -70.6 -36.9 16.6 -5.5 37.3 519 120 B Q H < S+ 0 0 75 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.855 117.3 40.5 -63.0 -34.4 13.7 -7.8 36.7 520 121 B R H < S+ 0 0 91 -4,-1.3 -2,-0.2 -5,-0.1 -1,-0.2 0.908 133.0 13.4 -79.6 -50.5 15.9 -9.3 34.0 521 122 B F H < S+ 0 0 31 -4,-2.7 2,-1.6 1,-0.1 -3,-0.2 0.572 98.2 90.2-107.3 -18.8 19.4 -9.5 35.5 522 123 B F >< + 0 0 0 -4,-1.6 3,-0.8 -5,-0.4 -1,-0.1 -0.670 46.1 164.2 -84.8 80.7 19.1 -8.8 39.2 523 124 B K T 3 + 0 0 134 -2,-1.6 -1,-0.2 1,-0.2 3,-0.1 0.622 56.1 80.7 -72.8 -20.4 18.7 -12.4 40.2 524 125 B F T 3 S- 0 0 65 -3,-0.1 2,-0.3 -521,-0.1 -1,-0.2 0.690 107.0 -12.8 -60.9 -25.2 19.4 -11.8 43.9 525 126 B S < - 0 0 18 -3,-0.8 -1,-0.1 1,-0.1 -3,-0.1 -0.986 37.8-146.4-171.5 164.2 15.9 -10.6 44.7 526 129 B R + 0 0 85 -2,-0.3 22,-2.9 -3,-0.1 2,-0.3 0.455 69.9 105.9-113.4 -11.3 12.5 -9.4 43.4 527 130 B D E -l 548 0F 41 20,-0.2 52,-2.4 22,-0.1 2,-0.5 -0.637 45.0-171.9 -86.1 132.7 11.8 -6.9 46.2 528 133 B V E -lm 549 579F 0 20,-2.7 22,-2.6 -2,-0.3 2,-0.6 -0.989 13.3-148.8-123.2 123.6 12.0 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539 144 B T H <> S+ 0 0 45 -3,-1.3 4,-2.9 -4,-0.4 -1,-0.2 0.955 110.3 37.5 -64.2 -60.1 4.5 1.7 42.4 540 145 B P H > S+ 0 0 30 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.796 111.7 63.4 -64.7 -30.7 3.2 0.8 39.0 541 146 B I H X S+ 0 0 0 -4,-2.0 4,-1.0 2,-0.2 -2,-0.2 0.976 115.0 29.8 -56.2 -58.2 6.6 1.4 37.5 542 147 B F H X>S+ 0 0 0 -4,-1.6 5,-2.5 2,-0.2 4,-0.6 0.891 121.2 52.6 -67.6 -44.8 8.2 -1.4 39.5 543 148 B R H ><5S+ 0 0 152 -4,-2.9 3,-1.2 1,-0.3 -2,-0.2 0.921 111.7 45.8 -58.2 -47.7 5.0 -3.5 39.7 544 149 B D H 3<5S+ 0 0 45 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.757 105.9 61.6 -67.8 -27.4 4.6 -3.4 35.9 545 150 B A H 3<5S- 0 0 8 -4,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.631 124.2-104.5 -74.2 -15.8 8.3 -4.2 35.6 546 151 B G T <<5S+ 0 0 43 -3,-1.2 -3,-0.2 -4,-0.6 2,-0.2 0.559 79.0 127.0 101.5 13.9 7.5 -7.5 37.4 547 152 B L < - 0 0 4 -5,-2.5 2,-0.4 -6,-0.1 -1,-0.3 -0.539 58.2-117.2 -99.9 165.8 9.0 -6.6 40.8 548 154 B Q E -l 527 0F 119 -22,-2.9 -20,-2.7 -2,-0.2 2,-0.3 -0.869 26.2-134.7-103.9 135.5 7.5 -6.8 44.3 549 155 B L E +l 528 0F 45 -2,-0.4 2,-0.3 -22,-0.2 -20,-0.2 -0.718 28.6 165.3 -95.5 141.7 7.0 -3.6 46.3 550 156 B Q E -l 529 0F 77 -22,-2.6 -20,-2.2 -2,-0.3 2,-0.3 -0.793 20.6-140.0-139.7 173.9 7.9 -3.3 50.0 551 157 B A E -l 530 0F 49 -22,-0.3 2,-0.3 -2,-0.3 -22,-0.1 -0.924 8.5-154.9-142.5 164.4 8.3 -0.2 52.1 552 158 B Y E -l 531 0F 5 -22,-1.5 -20,-1.3 -2,-0.3 15,-0.1 -0.978 40.3 -95.9-137.8 140.2 10.5 1.3 54.9 553 159 B R E +l 532 0F 78 13,-0.4 18,-0.1 -2,-0.3 17,-0.1 -0.278 58.7 143.9 -57.3 140.8 9.4 4.0 57.3 554 160 B Y + 0 0 16 -22,-0.8 9,-3.2 1,-0.4 2,-0.4 0.428 47.3 56.1-142.0 -66.9 10.3 7.5 56.2 555 161 B Y E -Q 562 0G 28 -23,-2.8 -1,-0.4 7,-0.2 7,-0.2 -0.680 62.4-149.1 -88.3 135.8 7.9 10.3 56.9 556 162 B D E >> -Q 561 0G 19 5,-4.0 4,-1.7 -2,-0.4 5,-1.6 -0.929 8.1-170.2-106.2 105.2 6.8 11.0 60.4 557 163 B P T 45S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.672 84.2 63.4 -69.0 -22.9 3.3 12.5 60.4 558 164 B K T 45S+ 0 0 171 1,-0.2 -3,-0.0 3,-0.1 -2,-0.0 0.819 123.3 18.4 -71.7 -32.3 3.5 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690 296 B S S < S+ 0 0 2 -438,-2.5 4,-1.7 2,-0.1 -437,-0.1 0.713 73.3 72.3 -80.3 -29.5 16.5 13.7 20.1 695 301 B N H > S+ 0 0 15 -439,-0.2 4,-2.1 2,-0.2 5,-0.2 0.932 99.7 39.9 -57.1 -58.7 15.3 17.3 20.9 696 302 B G H > S+ 0 0 0 -37,-0.7 4,-2.8 1,-0.2 -1,-0.2 0.846 116.3 52.3 -62.0 -36.9 15.6 17.5 24.7 697 303 B A H > S+ 0 0 0 -4,-0.5 4,-2.2 -38,-0.2 -1,-0.2 0.844 108.5 51.5 -68.1 -36.3 18.9 15.6 24.6 698 304 B R H X S+ 0 0 21 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.910 114.0 43.1 -65.8 -45.4 20.2 18.1 22.0 699 305 B I H X S+ 0 0 1 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.963 115.8 47.3 -63.8 -56.8 19.3 21.1 24.2 700 306 B A H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.887 111.9 51.1 -52.8 -46.1 20.5 19.5 27.4 701 307 B S H X S+ 0 0 10 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.883 108.4 51.9 -60.4 -42.5 23.8 18.5 25.8 702 308 B L H X S+ 0 0 29 -4,-1.7 4,-1.6 1,-0.2 7,-0.2 0.956 112.0 46.0 -59.9 -53.2 24.4 22.0 24.4 703 309 B I H < S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.854 116.3 43.2 -58.4 -44.7 23.9 23.6 27.8 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