==== 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 15-SEP-08 3EI9 . COMPND 2 MOLECULE: LL-DIAMINOPIMELATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR N.WATANABE,M.D.CLAY,M.J.VAN BELKUM,M.M.CHERNEY,J.C.VEDERAS, . 824 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28782.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 567 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 54 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 276 33.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 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 2 2 0 0 0 2 2 2 6 2 2 4 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 3 3 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 . 2 4 2 4 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 ANTIPARALLEL BRIDGES PER LADDER . 4 0 2 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 19 A E 0 0 196 0, 0.0 2,-0.2 0, 0.0 681,-0.0 0.000 360.0 360.0 360.0 144.9 76.1 -22.5 -4.9 2 20 A Y - 0 0 55 680,-0.0 2,-0.3 686,-0.0 682,-0.1 -0.522 360.0-172.5 -71.4 140.4 77.8 -19.3 -6.1 3 21 A K - 0 0 87 -2,-0.2 682,-0.2 680,-0.1 683,-0.1 -0.986 21.1-122.1-130.6 145.5 76.2 -16.0 -5.0 4 22 A T - 0 0 3 680,-2.1 684,-0.2 -2,-0.3 623,-0.2 -0.194 21.3-121.1 -70.6 175.4 77.1 -12.5 -6.1 5 23 A K S S+ 0 0 134 621,-2.1 2,-0.5 590,-0.1 622,-0.1 0.121 74.9 119.1-102.6 18.1 78.1 -9.9 -3.5 6 24 A V - 0 0 0 678,-0.3 680,-2.8 620,-0.1 681,-0.3 -0.743 64.5-128.4 -87.8 127.5 75.2 -7.6 -4.6 7 25 A S - 0 0 79 -2,-0.5 3,-0.1 678,-0.2 530,-0.1 -0.567 25.6-110.9 -73.8 132.7 72.7 -6.8 -1.8 8 26 A R - 0 0 53 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 -0.287 46.5 -90.1 -53.3 142.0 69.1 -7.4 -2.6 9 27 A N >> - 0 0 6 524,-0.3 4,-1.5 1,-0.2 3,-0.8 -0.459 33.9-144.6 -59.8 117.5 67.2 -4.2 -2.9 10 28 A S H 3> S+ 0 0 59 -2,-0.3 4,-0.7 1,-0.3 -1,-0.2 0.757 97.8 60.5 -61.8 -22.5 66.0 -3.6 0.7 11 29 A N H 3> S+ 0 0 16 2,-0.2 4,-0.5 1,-0.2 3,-0.4 0.861 101.9 51.1 -71.9 -35.1 62.8 -2.1 -0.7 12 30 A M H X4 S+ 0 0 2 -3,-0.8 3,-1.1 1,-0.2 -2,-0.2 0.875 104.7 58.6 -64.5 -38.1 61.9 -5.3 -2.5 13 31 A S H 3< S+ 0 0 58 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.755 96.2 64.7 -60.9 -26.9 62.5 -7.1 0.8 14 32 A K H 3< S+ 0 0 23 -4,-0.7 136,-0.4 -3,-0.4 -1,-0.2 0.751 75.8 105.9 -70.3 -26.3 59.8 -5.0 2.4 15 33 A L << - 0 0 21 -3,-1.1 3,-0.1 -4,-0.5 134,-0.0 -0.328 62.7-148.4 -63.3 135.4 57.0 -6.4 0.2 16 34 A Q - 0 0 96 1,-0.1 2,-0.3 2,-0.1 -1,-0.1 0.783 68.2 -21.6 -75.8 -32.6 54.7 -8.7 2.2 17 35 A A S S- 0 0 64 1,-0.1 3,-0.1 0, 0.0 -1,-0.1 -0.867 86.7 -61.0-159.2-176.7 53.7 -11.0 -0.6 18 36 A G S S- 0 0 46 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.1 -0.244 75.6 -66.5 -70.7 169.8 53.5 -11.2 -4.4 19 37 A Y > - 0 0 3 1,-0.1 4,-1.8 4,-0.0 -1,-0.2 -0.299 53.2-114.4 -58.3 144.4 51.3 -8.8 -6.4 20 38 A L H > S+ 0 0 13 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.854 107.6 49.3 -52.6 -48.9 47.6 -9.4 -5.7 21 39 A F H > S+ 0 0 12 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.914 109.4 49.2 -71.5 -43.2 46.5 -10.6 -9.1 22 40 A P H > S+ 0 0 46 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.881 110.1 55.5 -55.3 -36.4 49.2 -13.2 -9.7 23 41 A E H X S+ 0 0 48 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.916 107.0 48.2 -62.4 -41.8 48.4 -14.5 -6.2 24 42 A I H X S+ 0 0 7 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.919 108.0 55.5 -62.5 -41.6 44.7 -14.9 -7.2 25 43 A A H X S+ 0 0 52 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.876 105.0 53.5 -57.9 -38.9 45.9 -16.8 -10.3 26 44 A R H X S+ 0 0 132 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.900 110.0 46.6 -62.4 -42.9 47.8 -19.2 -8.1 27 45 A R H X S+ 0 0 78 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.854 110.1 53.6 -69.8 -33.6 44.7 -19.9 -6.1 28 46 A R H X S+ 0 0 89 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.930 109.8 48.3 -63.4 -44.4 42.7 -20.4 -9.3 29 47 A S H X S+ 0 0 74 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.917 110.0 50.7 -62.1 -45.5 45.2 -22.9 -10.5 30 48 A A H X S+ 0 0 50 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.885 108.5 53.9 -58.8 -40.6 45.2 -24.8 -7.2 31 49 A H H X S+ 0 0 10 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.898 105.7 52.4 -61.2 -40.6 41.4 -24.9 -7.4 32 50 A L H < S+ 0 0 55 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.812 106.1 53.7 -68.5 -30.0 41.6 -26.4 -10.9 33 51 A L H < S+ 0 0 146 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.893 112.7 44.4 -65.6 -39.6 43.9 -29.2 -9.6 34 52 A K H < S+ 0 0 126 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.843 129.0 26.9 -72.5 -36.1 41.3 -30.0 -6.9 35 53 A Y >< + 0 0 78 -4,-2.4 3,-1.8 -5,-0.2 -1,-0.3 -0.707 69.3 174.2-128.8 78.6 38.4 -29.8 -9.4 36 54 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.738 81.3 48.3 -60.4 -25.8 39.8 -30.7 -12.8 37 55 A D T 3 S+ 0 0 155 2,-0.1 -5,-0.1 0, 0.0 -2,-0.0 0.373 82.7 129.6 -93.7 0.8 36.3 -30.7 -14.4 38 56 A A < - 0 0 18 -3,-1.8 2,-1.1 -6,-0.2 330,-0.0 -0.298 57.1-139.3 -63.9 137.5 35.2 -27.3 -12.9 39 57 A Q - 0 0 149 2,-0.0 2,-0.2 330,-0.0 -1,-0.1 -0.765 30.7-159.7 -94.9 86.2 33.8 -24.7 -15.3 40 58 A V - 0 0 27 -2,-1.1 2,-0.5 329,-0.1 329,-0.2 -0.455 10.9-162.3 -74.6 133.9 35.5 -21.7 -13.7 41 59 A I E -a 369 0A 10 327,-2.4 329,-2.5 -2,-0.2 2,-0.7 -0.986 13.1-143.4-115.2 124.0 34.2 -18.2 -14.4 42 60 A S E +a 370 0A 46 -2,-0.5 329,-0.1 327,-0.2 5,-0.1 -0.810 39.1 150.4 -96.8 114.5 36.6 -15.4 -13.6 43 61 A L + 0 0 1 327,-2.3 345,-2.5 -2,-0.7 329,-0.2 -0.186 57.0 90.1-120.9 32.7 35.2 -12.2 -12.1 44 62 A G S S+ 0 0 0 1,-0.2 328,-0.2 327,-0.2 344,-0.1 0.730 78.1 36.8 -92.4-102.9 38.4 -11.4 -10.3 45 63 A I S S- 0 0 50 326,-0.2 2,-2.3 1,-0.2 -1,-0.2 -0.208 92.1-111.9 -50.5 141.0 41.0 -9.3 -12.2 46 64 A G + 0 0 3 779,-3.5 2,-0.5 -3,-0.1 -1,-0.2 -0.451 57.6 159.1 -80.1 70.2 39.2 -6.7 -14.3 47 65 A D - 0 0 42 -2,-2.3 441,-0.0 343,-0.2 205,-0.0 -0.848 40.9-123.3-100.5 126.4 40.1 -8.2 -17.6 48 66 A T - 0 0 3 -2,-0.5 441,-0.2 1,-0.1 440,-0.1 -0.290 26.1-176.3 -65.4 150.2 37.9 -7.2 -20.6 49 67 A T + 0 0 37 342,-0.1 -1,-0.1 2,-0.1 437,-0.1 0.584 49.0 87.0-124.7 -21.8 36.3 -10.1 -22.4 50 68 A E S S- 0 0 38 1,-0.1 437,-0.1 341,-0.1 432,-0.1 -0.565 84.2 -92.6 -89.3 152.3 34.4 -8.8 -25.5 51 69 A P - 0 0 32 0, 0.0 430,-0.2 0, 0.0 -1,-0.1 -0.133 40.9-102.9 -60.0 154.1 36.1 -8.2 -28.9 52 70 A I - 0 0 2 428,-2.6 203,-0.1 430,-0.1 5,-0.1 -0.596 50.0 -95.0 -71.8 136.0 37.6 -4.9 -29.9 53 71 A P >> - 0 0 24 0, 0.0 4,-2.2 0, 0.0 3,-1.1 -0.251 29.5-123.6 -52.5 140.5 35.2 -3.0 -32.3 54 72 A E H 3> S+ 0 0 141 1,-0.3 4,-2.9 2,-0.2 5,-0.3 0.819 108.4 62.9 -58.0 -35.7 36.1 -3.5 -35.9 55 73 A V H 3> S+ 0 0 36 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.876 110.8 41.0 -59.5 -31.2 36.5 0.2 -36.6 56 74 A I H <> S+ 0 0 0 -3,-1.1 4,-1.6 2,-0.2 -2,-0.2 0.927 115.7 46.3 -84.2 -46.3 39.4 0.2 -34.1 57 75 A T H X S+ 0 0 2 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.874 108.5 58.4 -64.5 -34.1 41.1 -3.1 -35.1 58 76 A S H X S+ 0 0 68 -4,-2.9 4,-2.6 -5,-0.2 -1,-0.2 0.889 104.7 50.6 -61.5 -38.8 40.8 -2.1 -38.8 59 77 A A H X S+ 0 0 27 -4,-0.9 4,-2.0 -5,-0.3 -1,-0.2 0.871 111.2 48.6 -66.1 -35.6 42.9 1.0 -38.0 60 78 A M H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.926 111.9 47.8 -70.1 -43.6 45.5 -1.1 -36.3 61 79 A A H X S+ 0 0 2 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.908 110.4 53.5 -61.7 -41.7 45.7 -3.6 -39.1 62 80 A K H X S+ 0 0 132 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.922 108.8 48.6 -56.9 -46.6 45.9 -0.7 -41.6 63 81 A K H X S+ 0 0 38 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.925 109.7 52.9 -60.3 -42.7 48.9 0.7 -39.6 64 82 A A H < S+ 0 0 0 -4,-2.4 3,-0.4 1,-0.2 4,-0.4 0.941 110.9 45.9 -59.1 -47.3 50.5 -2.7 -39.6 65 83 A H H >< S+ 0 0 89 -4,-2.6 3,-1.9 1,-0.2 -1,-0.2 0.909 108.2 57.3 -60.9 -41.6 50.2 -3.0 -43.4 66 84 A E H >< S+ 0 0 69 -4,-2.5 3,-2.0 1,-0.3 6,-0.4 0.822 94.9 66.3 -58.2 -32.3 51.5 0.6 -43.8 67 85 A L T 3< S+ 0 0 0 -4,-1.7 398,-2.7 -3,-0.4 -1,-0.3 0.656 94.7 59.1 -67.5 -13.9 54.7 -0.4 -41.9 68 86 A S T < S+ 0 0 21 -3,-1.9 2,-0.3 -4,-0.4 -1,-0.3 0.358 96.5 78.5 -92.5 3.7 55.5 -2.7 -44.8 69 87 A T S <> S- 0 0 46 -3,-2.0 4,-1.5 -4,-0.1 396,-0.1 -0.817 80.8-127.9-113.3 153.8 55.6 0.2 -47.3 70 88 A I T 4 S+ 0 0 114 -2,-0.3 3,-0.3 1,-0.2 -1,-0.1 0.948 111.3 41.4 -61.4 -49.4 58.3 2.8 -47.9 71 89 A E T 4 S+ 0 0 164 1,-0.2 -1,-0.2 -3,-0.1 -4,-0.1 0.812 119.3 44.6 -68.4 -33.0 55.9 5.7 -47.5 72 90 A G T 4 S+ 0 0 15 -6,-0.4 -1,-0.2 -7,-0.1 -2,-0.2 0.555 85.2 110.0 -94.7 -10.9 54.0 4.2 -44.5 73 91 A Y < + 0 0 25 -4,-1.5 2,-0.3 -3,-0.3 -6,-0.1 -0.424 41.3 178.8 -66.7 138.9 56.9 3.0 -42.4 74 92 A S - 0 0 42 594,-0.1 597,-0.4 -2,-0.1 3,-0.1 -0.992 6.6-172.5-138.8 142.0 57.7 4.9 -39.2 75 93 A G + 0 0 9 1,-0.4 220,-0.1 -2,-0.3 387,-0.1 0.383 60.5 6.6 -99.8-128.2 60.4 4.1 -36.7 76 94 A Y - 0 0 29 385,-0.2 -1,-0.4 595,-0.1 2,-0.3 -0.304 68.5-152.5 -54.8 136.7 60.9 5.7 -33.3 77 95 A G - 0 0 39 214,-0.5 2,-0.1 593,-0.3 5,-0.0 -0.793 36.7 -83.3 -99.8 157.3 58.1 8.0 -32.3 78 96 A A > - 0 0 66 -2,-0.3 3,-2.0 1,-0.1 213,-0.1 -0.406 44.1-123.2 -49.2 132.6 58.6 10.9 -29.9 79 97 A E T 3 S+ 0 0 21 1,-0.3 214,-0.2 213,-0.1 213,-0.2 0.737 109.2 62.9 -60.4 -26.3 58.3 9.3 -26.5 80 98 A Q T 3 S- 0 0 38 1,-0.2 26,-3.0 25,-0.1 -1,-0.3 0.637 116.5-104.9 -70.8 -16.9 55.4 11.7 -25.6 81 99 A G < - 0 0 2 -3,-2.0 -1,-0.2 24,-0.2 -3,-0.1 -0.181 49.1 -41.8 108.9 157.2 53.3 10.2 -28.4 82 100 A A >> - 0 0 45 1,-0.1 4,-2.5 -3,-0.1 3,-0.7 -0.286 53.2-129.6 -55.9 132.1 52.1 11.1 -31.9 83 101 A K H 3> S+ 0 0 142 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.897 106.7 53.5 -53.8 -46.8 51.0 14.8 -32.0 84 102 A P H 3> S+ 0 0 84 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.851 111.1 47.8 -59.9 -30.5 47.6 14.0 -33.6 85 103 A L H <> S+ 0 0 2 -3,-0.7 4,-2.7 2,-0.2 5,-0.2 0.925 110.8 49.2 -73.7 -44.3 46.9 11.5 -30.8 86 104 A R H X S+ 0 0 34 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.914 113.6 48.7 -56.6 -42.3 47.9 13.9 -28.1 87 105 A A H X S+ 0 0 14 -4,-3.0 4,-2.6 -5,-0.2 5,-0.3 0.907 110.3 49.8 -64.7 -42.8 45.6 16.5 -29.7 88 106 A A H X S+ 0 0 12 -4,-2.0 4,-2.6 -5,-0.2 5,-0.3 0.904 113.2 46.3 -63.9 -42.0 42.7 14.1 -30.0 89 107 A I H X>S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 5,-0.6 0.949 112.3 51.2 -63.5 -46.3 43.0 13.1 -26.3 90 108 A A H X5S+ 0 0 3 -4,-2.6 4,-1.2 -5,-0.2 -2,-0.2 0.918 118.1 37.1 -60.5 -43.5 43.4 16.8 -25.2 91 109 A K H X5S+ 0 0 146 -4,-2.6 4,-1.1 3,-0.2 -1,-0.2 0.896 117.4 48.8 -77.9 -39.2 40.3 17.9 -27.1 92 110 A T H <5S+ 0 0 55 -4,-2.6 -2,-0.2 -5,-0.3 -3,-0.2 0.939 128.2 19.7 -68.1 -46.5 38.1 14.8 -26.6 93 111 A F H <5S+ 0 0 47 -4,-2.3 -1,-0.2 -5,-0.3 -3,-0.2 0.657 137.7 28.8 -99.1 -17.9 38.5 14.4 -22.8 94 112 A Y H > - 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0 0 40 -5,-0.1 -4,-3.1 1,-0.1 2,-0.3 -0.494 55.7-114.3 -72.6 130.0 60.2 23.7 -11.2 277 295 A P B >> -I 271 0D 40 0, 0.0 3,-1.3 0, 0.0 4,-0.9 -0.497 14.2-145.9 -69.4 125.7 57.4 22.4 -13.5 278 296 A V H >> S+ 0 0 0 -8,-2.2 4,-2.2 -2,-0.3 3,-0.7 0.866 96.1 63.7 -57.4 -37.5 56.6 18.8 -12.7 279 297 A A H 3> S+ 0 0 19 -9,-0.5 4,-2.5 -12,-0.4 -1,-0.3 0.800 95.7 58.8 -59.9 -29.8 55.8 18.1 -16.4 280 298 A K H <> S+ 0 0 127 -3,-1.3 4,-1.7 2,-0.2 -1,-0.3 0.874 107.1 46.3 -70.4 -35.6 59.4 18.8 -17.3 281 299 A D H - 0 0 6 -34,-0.3 4,-2.6 -35,-0.2 378,-0.2 -0.279 36.3-133.5 -55.3 135.2 53.5 1.0 -29.7 295 313 A N H > S+ 0 0 15 376,-2.7 4,-2.0 1,-0.2 377,-0.1 0.851 107.8 50.6 -61.4 -34.0 52.8 2.7 -33.1 296 314 A I H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.909 109.9 49.6 -69.1 -41.2 50.1 0.3 -33.9 297 315 A S H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.895 109.8 52.3 -64.2 -39.0 48.5 0.8 -30.4 298 316 A Q H X S+ 0 0 17 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.905 107.4 52.0 -64.3 -39.5 48.6 4.6 -31.0 299 317 A A H X S+ 0 0 24 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.880 109.6 49.6 -63.1 -37.2 46.9 4.1 -34.4 300 318 A G H X S+ 0 0 0 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.921 110.3 49.9 -65.8 -44.4 44.1 2.2 -32.7 301 319 A A H X S+ 0 0 0 -4,-2.4 4,-1.1 2,-0.2 3,-0.2 0.892 107.1 54.6 -62.8 -39.1 43.7 4.9 -30.0 302 320 A L H >< S+ 0 0 72 -4,-2.5 3,-0.8 1,-0.2 -1,-0.2 0.931 106.8 51.9 -59.9 -41.2 43.5 7.6 -32.7 303 321 A A H 3< S+ 0 0 16 -4,-1.8 3,-0.4 1,-0.2 6,-0.4 0.793 101.9 61.1 -65.1 -28.9 40.7 5.6 -34.3 304 322 A C H 3< S+ 0 0 0 -4,-1.3 2,-1.1 -3,-0.2 -1,-0.2 0.843 94.8 64.4 -61.9 -33.4 38.9 5.5 -30.9 305 323 A L S << S+ 0 0 19 -4,-1.1 -1,-0.2 -3,-0.8 -2,-0.1 -0.418 86.7 86.6 -99.0 56.5 38.6 9.3 -30.8 306 324 A T S > S- 0 0 53 -2,-1.1 4,-3.3 -3,-0.4 5,-0.3 -0.886 95.7 -95.1-139.3 163.6 36.4 9.7 -33.9 307 325 A P H > S+ 0 0 118 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.942 127.8 43.0 -51.2 -46.8 32.6 9.6 -34.1 308 326 A E H > S+ 0 0 120 2,-0.2 4,-2.1 1,-0.2 -253,-0.1 0.881 115.4 49.0 -68.7 -37.9 32.7 5.9 -35.1 309 327 A G H > S+ 0 0 0 -6,-0.4 4,-2.7 2,-0.2 5,-0.2 0.921 112.6 47.2 -65.6 -44.6 35.3 5.1 -32.4 310 328 A L H X S+ 0 0 59 -4,-3.3 4,-2.4 2,-0.2 -2,-0.2 0.888 111.8 50.8 -66.2 -38.7 33.4 6.9 -29.7 311 329 A E H X S+ 0 0 130 -4,-2.2 4,-1.8 -5,-0.3 -1,-0.2 0.924 111.5 48.8 -61.0 -43.9 30.1 5.2 -30.7 312 330 A A H X S+ 0 0 16 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.919 111.7 47.2 -64.2 -46.4 31.9 1.8 -30.6 313 331 A M H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.3 0.910 108.6 56.3 -62.8 -39.7 33.4 2.4 -27.1 314 332 A H H X S+ 0 0 141 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.891 107.9 48.3 -57.9 -40.3 30.0 3.6 -25.9 315 333 A K H X S+ 0 0 148 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.916 112.1 48.5 -66.9 -42.4 28.5 0.3 -27.0 316 334 A V H X S+ 0 0 20 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.948 114.1 46.1 -60.2 -52.1 31.3 -1.7 -25.3 317 335 A I H X S+ 0 0 7 -4,-3.0 4,-2.3 -64,-0.3 -1,-0.2 0.910 110.3 54.4 -57.6 -43.5 30.9 0.3 -22.1 318 336 A G H X S+ 0 0 36 -4,-2.4 4,-1.9 -5,-0.3 -1,-0.2 0.870 105.8 52.6 -61.1 -37.7 27.1 -0.1 -22.2 319 337 A F H X S+ 0 0 53 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.936 111.3 45.5 -64.3 -45.9 27.4 -3.9 -22.5 320 338 A Y H X S+ 0 0 1 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.836 109.2 55.9 -68.5 -32.2 29.6 -4.0 -19.4 321 339 A K H X S+ 0 0 35 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.876 106.5 51.1 -66.0 -35.9 27.2 -1.6 -17.5 322 340 A E H X S+ 0 0 84 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.916 108.2 51.5 -66.1 -42.4 24.4 -4.0 -18.3 323 341 A N H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.906 107.9 53.7 -55.3 -43.3 26.5 -6.9 -16.9 324 342 A T H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.920 106.0 52.1 -59.6 -43.9 27.0 -4.7 -13.8 325 343 A N H X S+ 0 0 62 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.881 106.7 53.4 -61.2 -39.2 23.3 -4.3 -13.3 326 344 A I H X S+ 0 0 26 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.938 112.1 45.3 -60.2 -44.9 22.7 -8.0 -13.5 327 345 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 5,-0.3 0.927 112.2 50.4 -66.2 -46.4 25.2 -8.5 -10.7 328 346 A I H X S+ 0 0 32 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.931 111.1 49.5 -54.5 -48.5 23.8 -5.7 -8.6 329 347 A D H X S+ 0 0 104 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.892 108.9 53.4 -61.4 -40.2 20.3 -7.1 -8.9 330 348 A T H X S+ 0 0 4 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.957 114.1 39.3 -59.9 -51.8 21.5 -10.6 -7.9 331 349 A F H <>S+ 0 0 1 -4,-2.3 5,-2.3 2,-0.2 4,-0.2 0.855 114.6 53.5 -71.4 -32.9 23.2 -9.5 -4.7 332 350 A T H ><5S+ 0 0 81 -4,-2.6 3,-1.8 -5,-0.3 -1,-0.2 0.947 108.9 49.3 -64.3 -46.2 20.5 -7.0 -3.8 333 351 A S H 3<5S+ 0 0 82 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.789 105.9 58.2 -64.6 -26.0 17.8 -9.7 -4.2 334 352 A L T 3<5S- 0 0 21 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.477 122.0-107.6 -79.7 -5.0 20.0 -12.0 -1.9 335 353 A G T < 5S+ 0 0 37 -3,-1.8 -3,-0.2 1,-0.3 2,-0.2 0.566 71.0 141.2 90.9 12.1 19.8 -9.3 0.9 336 354 A Y < - 0 0 20 -5,-2.3 2,-0.7 75,-0.1 -1,-0.3 -0.536 59.7-115.7 -84.3 150.6 23.4 -8.0 0.6 337 355 A D - 0 0 93 13,-0.4 13,-2.6 -2,-0.2 2,-0.5 -0.807 41.7-169.6 -77.9 114.1 24.6 -4.5 1.0 338 356 A V E -J 349 0E 29 -2,-0.7 2,-0.3 11,-0.2 11,-0.2 -0.953 5.2-173.0-114.9 128.5 26.0 -3.9 -2.5 339 357 A Y E +J 348 0E 60 9,-2.7 9,-2.9 -2,-0.5 2,-0.1 -0.735 48.0 15.1-117.9 165.0 28.0 -0.8 -3.3 340 358 A G E +J 347 0E 31 -2,-0.3 2,-0.6 7,-0.2 7,-0.2 -0.372 66.2 112.4 72.1-153.3 29.4 0.6 -6.5 341 359 A G + 0 0 2 5,-1.4 -1,-0.1 1,-0.1 6,-0.1 -0.040 65.6 81.4 79.5 -34.3 28.1 -0.7 -9.8 342 360 A K S S+ 0 0 107 -2,-0.6 -1,-0.1 1,-0.2 -147,-0.1 0.902 109.7 16.1 -70.5 -41.0 26.4 2.6 -10.7 343 361 A N S S+ 0 0 9 -149,-0.4 -118,-0.3 -117,-0.2 -1,-0.2 0.175 126.2 46.3-119.3 14.6 29.5 4.3 -12.0 344 362 A A S S- 0 0 0 2,-0.2 2,-0.8 -120,-0.1 -121,-0.0 -0.986 81.1-110.6-158.8 152.3 32.0 1.5 -12.6 345 363 A P S S+ 0 0 0 0, 0.0 44,-2.6 0, 0.0 45,-0.4 -0.237 94.4 58.0 -87.5 44.9 32.1 -2.1 -14.1 346 364 A Y E S- K 0 388E 4 -2,-0.8 -5,-1.4 42,-0.3 2,-0.3 -0.959 71.4-132.7-160.0 163.6 32.4 -3.9 -10.8 347 365 A V E -JK 340 387E 0 40,-2.3 40,-2.6 -2,-0.3 2,-0.6 -0.909 7.2-143.2-125.3 150.2 30.5 -4.2 -7.5 348 366 A W E -JK 339 386E 0 -9,-2.9 -9,-2.7 -2,-0.3 2,-0.5 -0.923 22.4-164.0-119.4 102.5 31.7 -4.0 -4.0 349 367 A V E -JK 338 385E 0 36,-2.7 36,-2.1 -2,-0.6 2,-0.5 -0.771 14.9-131.8-101.1 130.2 29.8 -6.4 -1.8 350 368 A H E + K 0 384E 39 -13,-2.6 -13,-0.4 -2,-0.5 34,-0.2 -0.690 25.6 174.2 -84.4 121.1 29.8 -6.2 2.0 351 369 A F > - 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W 0 797J 53 -13,-2.7 -13,-0.5 -2,-0.4 34,-0.2 -0.733 17.7-176.4 -87.4 122.2 87.7 10.7 -34.8 764 369 B F > - 0 0 6 32,-3.2 3,-0.8 -2,-0.5 8,-0.1 -0.865 19.5-151.8-115.4 91.6 87.8 14.5 -35.2 765 370 B P T 3 S+ 0 0 80 0, 0.0 3,-0.1 0, 0.0 31,-0.1 -0.240 71.0 14.9 -64.4 151.3 91.0 15.7 -33.5 766 371 B N T 3 S+ 0 0 180 1,-0.1 2,-0.3 0, 0.0 30,-0.0 0.752 108.6 93.8 58.0 31.0 91.3 19.2 -32.0 767 372 B Q S < S- 0 0 74 -3,-0.8 2,-0.2 29,-0.0 -3,-0.2 -0.995 76.7-116.5-149.9 142.6 87.5 19.8 -32.1 768 373 B S > - 0 0 38 -2,-0.3 4,-2.1 1,-0.1 3,-0.3 -0.579 27.3-128.1 -75.9 144.4 84.7 19.3 -29.6 769 374 B S H > S+ 0 0 0 1,-0.2 4,-2.7 -2,-0.2 5,-0.1 0.855 109.0 55.3 -66.2 -32.3 82.2 16.8 -30.8 770 375 B W H > S+ 0 0 64 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.856 107.8 50.2 -66.0 -33.3 79.2 19.2 -30.4 771 376 B D H > S+ 0 0 101 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.899 111.2 47.8 -69.8 -40.2 81.1 21.7 -32.6 772 377 B V H X S+ 0 0 0 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.941 110.8 52.1 -63.7 -46.8 81.6 19.1 -35.3 773 378 B F H X S+ 0 0 1 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.927 112.1 46.1 -49.6 -49.7 77.9 18.1 -35.0 774 379 B A H X S+ 0 0 42 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.876 113.0 49.4 -67.2 -38.0 76.9 21.7 -35.5 775 380 B E H X S+ 0 0 51 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.926 112.0 47.4 -66.2 -47.1 79.3 22.2 -38.4 776 381 B I H X>S+ 0 0 1 -4,-3.0 4,-2.4 2,-0.2 6,-0.9 0.927 114.9 46.4 -60.8 -44.5 78.1 19.1 -40.2 777 382 B L H X5S+ 0 0 9 -4,-2.4 4,-1.5 -5,-0.3 -2,-0.2 0.946 115.6 45.1 -65.3 -45.5 74.5 20.0 -39.7 778 383 B E H <5S+ 0 0 68 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.913 123.4 33.5 -63.6 -43.9 74.9 23.7 -40.8 779 384 B K H <5S+ 0 0 120 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.798 135.3 19.3 -87.9 -31.4 77.0 23.0 -43.9 780 385 B T H <5S- 0 0 7 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.2 0.481 89.9-126.5-118.5 -9.3 75.7 19.6 -45.1 781 386 B H << + 0 0 52 -4,-1.5 -327,-2.5 -5,-0.6 2,-0.5 0.837 65.6 135.8 59.8 31.3 72.2 19.3 -43.5 782 387 B V E -m 454 0F 0 -6,-0.9 2,-0.4 -329,-0.2 -1,-0.2 -0.955 48.7-142.9-109.8 130.1 73.3 15.9 -42.2 783 388 B V E +m 455 0F 3 -329,-2.5 -327,-2.1 -2,-0.5 2,-0.2 -0.792 28.3 165.0 -90.3 131.7 72.4 15.0 -38.5 784 389 B T - 0 0 0 -2,-0.4 -327,-0.2 -11,-0.1 16,-0.2 -0.596 37.6-102.9-125.5-171.8 75.1 13.0 -36.7 785 390 B T E -X 799 0J 0 14,-2.3 14,-2.8 -329,-0.3 2,-0.2 -0.981 28.8-124.6-122.5 124.5 75.6 12.2 -32.9 786 391 B P E > -X 798 0J 0 0, 0.0 3,-1.8 0, 0.0 12,-0.2 -0.453 16.7-135.4 -65.4 132.4 78.3 14.0 -30.9 787 392 B G G > S+ 0 0 0 10,-2.6 3,-2.3 1,-0.3 8,-0.3 0.813 101.0 67.7 -58.2 -33.3 80.6 11.5 -29.3 788 393 B S G > S+ 0 0 31 6,-0.4 3,-1.6 9,-0.4 -1,-0.3 0.720 84.6 72.8 -62.9 -18.7 80.5 13.4 -25.9 789 394 B G G < S+ 0 0 17 -3,-1.8 -1,-0.3 1,-0.3 -356,-0.2 0.641 94.5 54.7 -65.8 -14.5 76.8 12.4 -25.7 790 395 B F G < S- 0 0 6 -3,-2.3 -244,-2.6 1,-0.4 -1,-0.3 0.171 128.2 -75.6-104.9 14.3 78.1 8.9 -24.9 791 396 B G X - 0 0 18 -3,-1.6 3,-2.0 -246,-0.2 -1,-0.4 -0.401 60.8 -60.8 113.7 170.4 80.3 10.0 -22.0 792 397 B P G > S+ 0 0 21 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.813 127.4 63.5 -62.6 -30.4 83.7 11.7 -21.6 793 398 B G G 3 S+ 0 0 10 1,-0.3 -5,-0.1 -3,-0.2 -2,-0.1 0.610 96.1 62.9 -65.8 -10.4 85.5 9.0 -23.5 794 399 B G G X S+ 0 0 0 -3,-2.0 3,-1.9 -7,-0.2 -6,-0.4 0.543 73.0 119.8 -91.2 -10.3 83.4 10.0 -26.5 795 400 B E T < S+ 0 0 88 -3,-1.6 3,-0.1 -8,-0.3 -27,-0.1 -0.323 75.6 25.8 -58.8 135.5 84.8 13.5 -26.7 796 401 B G T 3 S+ 0 0 10 1,-0.3 -32,-3.2 -29,-0.1 2,-0.3 0.450 108.2 93.9 88.4 2.8 86.5 14.2 -30.1 797 402 B F E < -W 763 0J 18 -3,-1.9 -10,-2.6 -34,-0.2 -9,-0.4 -0.849 55.8-156.2-121.5 161.8 84.5 11.6 -31.9 798 403 B V E -WX 762 786J 0 -36,-2.1 -36,-2.9 -2,-0.3 2,-0.5 -0.999 12.6-141.6-134.6 134.4 81.2 11.6 -33.9 799 404 B R E -WX 761 785J 2 -14,-2.8 -14,-2.3 -2,-0.4 2,-0.5 -0.831 13.3-164.6 -93.9 133.2 78.9 8.6 -34.4 800 405 B V E -W 760 0J 1 -40,-2.6 -40,-2.4 -2,-0.5 2,-0.2 -0.983 14.3-138.8-117.7 118.7 77.3 8.3 -37.8 801 406 B S E -W 759 0J 2 -345,-2.5 -42,-0.3 -2,-0.5 -343,-0.1 -0.512 4.4-153.1 -73.2 144.3 74.3 5.9 -38.1 802 407 B A + 0 0 0 -44,-2.4 2,-0.7 -2,-0.2 -43,-0.2 0.348 60.7 114.8 -95.6 0.7 74.1 3.6 -41.2 803 408 B F + 0 0 2 -45,-0.4 2,-0.3 -67,-0.1 -343,-0.2 -0.668 47.4 99.8 -75.8 115.2 70.3 3.5 -41.0 804 409 B G S S- 0 0 4 -2,-0.7 -342,-0.1 -348,-0.0 2,-0.1 -0.940 78.4 -76.1-179.3 160.4 68.9 5.1 -44.1 805 410 B H >> - 0 0 61 -2,-0.3 4,-2.1 1,-0.1 3,-0.6 -0.446 53.1-112.7 -61.7 146.3 67.5 4.6 -47.5 806 411 B R H 3> S+ 0 0 70 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.889 116.7 52.0 -53.0 -44.7 70.3 3.7 -49.9 807 412 B E H 3> S+ 0 0 121 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.851 109.2 50.6 -63.5 -33.6 70.0 7.0 -51.8 808 413 B N H <> S+ 0 0 68 -3,-0.6 4,-2.7 2,-0.2 -1,-0.2 0.851 109.6 49.3 -72.3 -36.3 70.2 9.0 -48.6 809 414 B I H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.943 113.7 47.1 -64.1 -46.0 73.3 7.2 -47.4 810 415 B L H X S+ 0 0 54 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.921 113.8 47.6 -61.8 -44.2 74.9 7.8 -50.8 811 416 B E H X S+ 0 0 56 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.930 110.9 50.8 -63.7 -45.9 73.8 11.5 -50.8 812 417 B A H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.932 110.9 49.1 -56.6 -44.7 75.1 12.0 -47.2 813 418 B C H X S+ 0 0 4 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.879 108.6 53.0 -65.0 -38.4 78.4 10.5 -48.2 814 419 B R H X S+ 0 0 130 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.905 110.2 49.0 -59.2 -42.4 78.6 12.8 -51.3 815 420 B R H X S+ 0 0 35 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.905 111.0 48.7 -66.3 -42.3 78.0 15.8 -49.0 816 421 B F H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.920 112.2 49.1 -61.1 -45.2 80.7 14.7 -46.6 817 422 B K H X S+ 0 0 89 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.925 111.8 48.7 -62.0 -44.9 83.2 14.1 -49.4 818 423 B Q H < S+ 0 0 142 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.894 114.6 45.4 -62.9 -41.1 82.5 17.5 -50.9 819 424 B L H < S+ 0 0 36 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.895 126.0 27.3 -68.1 -40.5 82.9 19.3 -47.5 820 425 B Y H >< S+ 0 0 20 -4,-2.4 3,-1.9 -5,-0.2 -2,-0.2 0.614 92.6 90.2-104.6 -13.7 86.0 17.6 -46.4 821 426 B K T 3< S+ 0 0 117 -4,-2.5 -1,-0.1 1,-0.3 -3,-0.1 0.769 91.0 46.7 -62.0 -30.5 87.9 16.6 -49.6 822 427 B H T 3 0 0 149 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.343 360.0 360.0 -93.3 6.7 90.0 19.8 -49.9 823 428 B H < 0 0 192 -3,-1.9 -3,-0.1 -76,-0.1 -4,-0.0 -0.433 360.0 360.0-125.8 360.0 90.9 19.8 -46.3 824 !* 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 0.0 825 433 A X 0 0 1 0, 0.0 -779,-3.5 0, 0.0 -778,-0.1 0.000 360.0 360.0 360.0 360.0 42.5 -4.0 -13.1 826 !* 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 0.0 827 433 B X 0 0 0 0, 0.0 -368,-3.6 0, 0.0 -367,-0.1 0.000 360.0 360.0 360.0 360.0 69.5 4.1 -30.3