==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 13-MAY-12 4F5G . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR T.A.ADDINGTON,A.J.FISHER,M.D.TONEY . 798 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30117.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 551 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.8 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 . 42 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 309 38.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.9 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 0 0 2 1 3 0 8 2 2 2 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 0 4 0 2 3 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 2 2 0 0 3 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 . 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 8 A H 0 0 143 0, 0.0 2,-0.3 0, 0.0 607,-0.1 0.000 360.0 360.0 360.0 167.7 -9.1 -26.5 -10.9 2 9 A V + 0 0 77 1,-0.1 603,-0.0 606,-0.1 0, 0.0 -0.977 360.0 56.3-174.5-159.0 -6.9 -24.3 -13.0 3 10 A G + 0 0 13 -2,-0.3 4,-0.3 1,-0.1 -1,-0.1 0.749 22.5 171.9 20.4 92.1 -6.5 -22.0 -16.0 4 11 A T S S+ 0 0 23 1,-0.1 3,-0.2 2,-0.1 518,-0.2 0.742 96.5 42.3 -71.9 -27.0 -8.6 -18.9 -16.2 5 12 A F S > S+ 0 0 0 1,-0.2 3,-1.4 2,-0.1 -1,-0.1 0.603 91.6 88.3 -94.1 -14.1 -6.4 -18.0 -19.1 6 13 A E T 3 S+ 0 0 84 1,-0.3 -1,-0.2 667,-0.0 -2,-0.1 0.820 90.5 43.8 -57.4 -36.0 -6.3 -21.5 -20.6 7 14 A N T 3 S+ 0 0 143 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.434 80.2 123.0 -95.4 1.5 -9.4 -21.0 -22.8 8 15 A I < - 0 0 5 -3,-1.4 2,-0.2 1,-0.1 666,-0.1 -0.413 58.2-135.3 -60.2 132.3 -8.6 -17.5 -24.1 9 16 A T - 0 0 103 511,-0.1 2,-0.1 -2,-0.1 668,-0.1 -0.626 26.7 -92.4 -91.9 155.0 -8.6 -17.6 -27.8 10 17 A A - 0 0 67 -2,-0.2 -1,-0.1 1,-0.1 663,-0.1 -0.364 36.7-118.7 -68.3 137.8 -5.8 -15.9 -29.9 11 18 A A - 0 0 31 662,-0.4 -1,-0.1 1,-0.1 666,-0.1 -0.447 40.9 -96.2 -65.7 147.5 -6.4 -12.4 -31.0 12 19 A P - 0 0 119 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.449 47.8-101.0 -62.3 141.5 -6.3 -12.0 -34.8 13 20 A A - 0 0 99 1,-0.1 3,-0.0 -2,-0.1 -3,-0.0 -0.441 34.6-126.0 -61.7 134.6 -2.9 -11.0 -36.0 14 21 A D > - 0 0 48 1,-0.1 4,-2.0 -2,-0.1 5,-0.1 -0.788 9.9-148.8 -88.9 121.9 -2.8 -7.3 -36.8 15 22 A P H > S+ 0 0 96 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.726 92.7 66.2 -63.0 -25.0 -1.6 -6.8 -40.3 16 23 A I H > S+ 0 0 107 2,-0.2 4,-2.8 1,-0.2 3,-0.4 0.996 106.9 37.8 -56.8 -66.5 -0.1 -3.4 -39.3 17 24 A L H > S+ 0 0 79 1,-0.3 4,-3.3 2,-0.2 -1,-0.2 0.879 115.4 57.6 -51.9 -40.5 2.5 -5.0 -37.0 18 25 A G H X S+ 0 0 29 -4,-2.0 4,-2.8 2,-0.2 -1,-0.3 0.911 108.6 44.1 -56.2 -45.2 2.8 -7.8 -39.6 19 26 A L H X S+ 0 0 32 -4,-2.9 4,-3.2 -3,-0.4 -2,-0.2 0.890 112.9 51.5 -69.2 -39.5 3.7 -5.2 -42.3 20 27 A A H X S+ 0 0 36 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.911 110.9 49.5 -60.4 -42.8 6.1 -3.5 -39.9 21 28 A D H X S+ 0 0 76 -4,-3.3 4,-2.3 -5,-0.2 -2,-0.2 0.956 112.8 45.9 -59.9 -52.4 7.6 -6.9 -39.2 22 29 A L H X S+ 0 0 88 -4,-2.8 4,-1.1 1,-0.2 -2,-0.2 0.921 113.6 49.7 -55.3 -46.7 8.0 -7.6 -42.9 23 30 A F H < S+ 0 0 46 -4,-3.2 3,-0.4 1,-0.2 -1,-0.2 0.909 110.0 51.2 -60.1 -41.9 9.4 -4.1 -43.4 24 31 A R H < S+ 0 0 163 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.878 111.8 45.9 -64.8 -38.7 11.9 -4.6 -40.6 25 32 A A H < S+ 0 0 79 -4,-2.3 2,-0.7 -5,-0.2 -1,-0.2 0.631 89.0 102.7 -79.2 -13.5 13.1 -8.0 -42.0 26 33 A D < - 0 0 18 -4,-1.1 5,-0.1 -3,-0.4 -4,-0.0 -0.616 50.4-174.7 -75.7 110.9 13.4 -6.4 -45.5 27 34 A E + 0 0 186 -2,-0.7 -1,-0.2 2,-0.0 -4,-0.1 0.410 40.6 121.6 -89.5 0.7 17.1 -5.8 -46.1 28 35 A R > - 0 0 92 1,-0.1 3,-0.8 2,-0.1 -2,-0.0 -0.427 57.8-143.3 -69.5 140.2 16.7 -4.0 -49.4 29 36 A P T 3 S+ 0 0 136 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.740 91.3 65.6 -77.7 -23.7 18.1 -0.5 -49.5 30 37 A G T 3 S+ 0 0 53 2,-0.1 -2,-0.1 360,-0.0 338,-0.0 0.342 71.4 146.3 -82.6 9.8 15.5 1.1 -51.7 31 38 A K < - 0 0 60 -3,-0.8 2,-0.5 -5,-0.1 339,-0.2 -0.133 28.6-169.0 -54.5 134.4 12.7 0.6 -49.2 32 39 A V E -a 370 0A 7 337,-2.5 339,-3.3 336,-0.0 2,-1.0 -0.987 8.3-155.1-125.2 120.4 10.0 3.3 -49.1 33 40 A D E +a 371 0A 35 -2,-0.5 3,-0.4 349,-0.2 339,-0.1 -0.770 29.7 155.7-101.5 94.5 7.6 3.1 -46.2 34 41 A L + 0 0 2 337,-2.5 345,-1.7 -2,-1.0 339,-0.3 0.372 65.9 73.9 -93.8 5.1 4.3 4.7 -47.2 35 42 A G + 0 0 17 336,-0.4 -1,-0.2 337,-0.2 337,-0.1 0.548 67.0 116.8 -95.1 -8.8 2.5 2.7 -44.6 36 43 A V - 0 0 21 -3,-0.4 345,-0.1 335,-0.2 346,-0.1 -0.167 57.1-145.2 -62.4 156.0 3.7 4.6 -41.5 37 44 A G S S+ 0 0 34 2,-0.1 2,-0.3 342,-0.0 -1,-0.1 0.244 70.6 66.0-108.7 12.6 1.2 6.4 -39.4 38 45 A V S S- 0 0 9 312,-0.1 2,-0.2 341,-0.1 343,-0.1 -0.789 89.2 -85.0-128.1 169.8 3.2 9.4 -38.3 39 46 A Y - 0 0 10 -2,-0.3 2,-0.4 8,-0.1 -2,-0.1 -0.511 40.3-169.3 -71.4 140.6 4.8 12.5 -39.8 40 47 A K - 0 0 47 -2,-0.2 6,-0.2 6,-0.1 343,-0.1 -0.990 12.2-137.3-128.0 145.3 8.3 12.0 -41.3 41 48 A D > - 0 0 25 4,-2.7 3,-2.0 -2,-0.4 276,-0.0 -0.107 44.7 -77.0 -86.7-170.6 10.6 14.8 -42.4 42 49 A E T 3 S+ 0 0 105 1,-0.3 344,-0.2 2,-0.1 -1,-0.1 0.685 133.1 51.9 -64.2 -17.4 12.7 15.0 -45.6 43 50 A T T 3 S- 0 0 87 2,-0.1 -1,-0.3 341,-0.0 3,-0.1 0.374 120.1-107.4 -99.6 3.1 15.2 12.7 -43.9 44 51 A G S < S+ 0 0 35 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.657 78.2 128.0 82.5 16.9 12.6 10.1 -43.0 45 52 A K - 0 0 133 420,-0.0 -4,-2.7 1,-0.0 -1,-0.3 -0.709 58.0-143.1-104.7 157.3 12.7 10.9 -39.3 46 53 A T - 0 0 17 -2,-0.3 420,-0.5 -6,-0.2 421,-0.4 -0.768 39.0-169.8-110.9 81.3 10.0 11.7 -36.8 47 54 A P - 0 0 46 0, 0.0 2,-0.5 0, 0.0 419,-0.2 -0.132 28.7-107.2 -75.5 165.3 11.9 14.3 -34.8 48 55 A V - 0 0 17 416,-0.4 204,-0.1 415,-0.1 205,-0.1 -0.792 48.7-110.2 -81.3 131.8 11.1 16.0 -31.5 49 56 A L > - 0 0 13 202,-0.5 4,-2.4 -2,-0.5 5,-0.2 -0.323 13.8-127.0 -63.1 147.1 10.2 19.6 -32.3 50 57 A T H > S+ 0 0 78 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.903 112.6 55.6 -59.4 -42.1 12.6 22.3 -31.2 51 58 A S H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.907 108.8 49.1 -56.7 -39.6 9.7 24.1 -29.5 52 59 A V H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.921 108.5 51.0 -67.5 -46.1 9.1 20.9 -27.5 53 60 A K H X S+ 0 0 48 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.920 111.5 49.0 -56.5 -43.0 12.8 20.5 -26.5 54 61 A K H X S+ 0 0 103 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.914 111.5 48.6 -64.5 -42.6 12.8 24.0 -25.3 55 62 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.907 110.3 51.8 -62.4 -42.2 9.6 23.5 -23.3 56 63 A E H X S+ 0 0 10 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.854 108.2 51.8 -65.3 -34.8 11.0 20.3 -21.8 57 64 A Q H X S+ 0 0 92 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.925 108.9 50.5 -64.9 -45.1 14.2 22.1 -20.8 58 65 A Y H X S+ 0 0 121 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.918 110.8 49.2 -59.5 -44.4 12.1 24.8 -19.1 59 66 A L H X S+ 0 0 18 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.899 107.9 53.7 -60.7 -41.9 10.1 22.1 -17.2 60 67 A L H < S+ 0 0 34 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.919 113.6 43.7 -59.3 -40.0 13.2 20.4 -16.1 61 68 A E H < S+ 0 0 114 -4,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.818 125.5 29.6 -74.2 -31.2 14.5 23.7 -14.6 62 69 A N H < S+ 0 0 80 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.726 85.7 102.1-109.3 -25.0 11.2 24.7 -13.0 63 70 A E < + 0 0 32 -4,-2.7 385,-0.1 -5,-0.2 3,-0.1 -0.416 34.8 174.7 -70.2 134.5 9.1 21.8 -11.9 64 71 A T + 0 0 113 1,-0.2 384,-0.4 -2,-0.1 2,-0.3 0.375 63.1 23.7-121.1 0.7 9.3 21.1 -8.2 65 72 A T - 0 0 48 382,-0.2 -1,-0.2 2,-0.1 383,-0.1 -0.985 43.3-161.5-158.1 155.9 6.8 18.3 -7.8 66 73 A K + 0 0 0 380,-0.5 589,-3.1 -2,-0.3 590,-0.2 0.005 45.9 146.2-122.7 24.9 5.0 15.6 -9.8 67 74 A T - 0 0 42 379,-0.4 -2,-0.1 587,-0.2 381,-0.0 -0.188 61.0 -79.1 -60.2 153.5 2.2 15.2 -7.3 68 75 A Y - 0 0 62 1,-0.1 2,-0.2 586,-0.0 -1,-0.1 -0.209 43.8-160.0 -50.5 139.5 -1.2 14.3 -8.7 69 76 A L - 0 0 61 1,-0.3 219,-0.1 220,-0.2 5,-0.1 -0.361 42.9 -63.0 -97.6-167.3 -3.2 17.1 -10.2 70 77 A G > - 0 0 36 3,-0.5 3,-1.9 -2,-0.2 -1,-0.3 -0.215 52.0-100.0 -71.8 169.0 -7.0 16.8 -10.7 71 78 A L T 3 S+ 0 0 26 1,-0.3 -1,-0.1 217,-0.2 3,-0.1 0.732 124.2 59.4 -63.4 -20.7 -8.5 14.2 -12.9 72 79 A D T 3 S- 0 0 49 1,-0.3 30,-2.6 29,-0.1 -1,-0.3 0.455 102.5-143.7 -87.4 -2.1 -8.9 16.9 -15.6 73 80 A G < + 0 0 4 -3,-1.9 -3,-0.5 28,-0.2 -1,-0.3 -0.438 54.3 5.6 82.3-148.0 -5.1 17.5 -15.6 74 81 A L >> - 0 0 39 1,-0.2 4,-2.0 -2,-0.1 3,-0.6 -0.627 57.7-150.1 -85.4 116.5 -3.4 20.8 -16.1 75 82 A P H 3> S+ 0 0 78 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.893 96.4 53.6 -51.6 -46.3 -5.7 23.8 -16.1 76 83 A E H 3> S+ 0 0 72 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.860 107.2 52.0 -59.3 -37.1 -3.5 25.9 -18.4 77 84 A F H <> S+ 0 0 0 -3,-0.6 4,-2.6 2,-0.2 -1,-0.2 0.921 108.8 51.4 -64.1 -41.9 -3.4 23.0 -20.9 78 85 A G H X S+ 0 0 8 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.932 111.6 46.6 -58.2 -46.5 -7.2 22.9 -20.9 79 86 A R H X S+ 0 0 134 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.908 113.2 47.9 -64.0 -43.9 -7.4 26.7 -21.5 80 87 A C H X S+ 0 0 12 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.892 110.6 52.5 -66.3 -38.6 -4.8 26.6 -24.3 81 88 A T H X S+ 0 0 7 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.951 109.8 48.6 -60.3 -47.6 -6.6 23.7 -25.9 82 89 A Q H X S+ 0 0 23 -4,-2.4 4,-2.9 1,-0.2 5,-0.5 0.887 109.6 52.2 -62.2 -38.2 -9.9 25.5 -25.9 83 90 A E H X S+ 0 0 70 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.888 110.6 47.7 -66.9 -38.5 -8.3 28.6 -27.4 84 91 A L H < S+ 0 0 11 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.922 117.8 41.9 -63.2 -45.7 -6.8 26.6 -30.3 85 92 A L H < S+ 0 0 3 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.942 130.1 22.2 -69.7 -48.1 -10.1 24.8 -30.9 86 93 A F H < S- 0 0 12 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.615 103.6-126.6-103.8 -15.5 -12.6 27.7 -30.6 87 94 A G >< - 0 0 5 -4,-1.6 3,-1.0 -5,-0.5 6,-0.2 0.105 36.8 -54.2 88.8 156.4 -10.4 30.8 -31.2 88 95 A K T 3 S+ 0 0 171 1,-0.2 -5,-0.0 -4,-0.1 5,-0.0 -0.377 124.3 22.2 -60.0 145.3 -9.8 33.9 -29.2 89 96 A G T 3 S+ 0 0 67 1,-0.2 2,-0.4 2,-0.1 -1,-0.2 0.779 81.7 168.8 65.8 27.1 -13.0 35.8 -28.3 90 97 A S <> - 0 0 20 -3,-1.0 4,-2.6 1,-0.2 -1,-0.2 -0.604 33.1-148.0 -70.3 126.9 -15.2 32.7 -28.7 91 98 A A H > S+ 0 0 63 -2,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.874 99.4 60.2 -61.3 -35.8 -18.6 33.4 -27.3 92 99 A L H 4>S+ 0 0 8 1,-0.2 5,-2.2 2,-0.2 6,-0.3 0.926 109.1 40.5 -57.9 -49.1 -18.8 29.8 -26.2 93 100 A I H >45S+ 0 0 42 1,-0.2 3,-2.1 3,-0.2 -1,-0.2 0.917 112.7 55.5 -66.1 -44.0 -15.7 30.2 -24.0 94 101 A N H 3<5S+ 0 0 106 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.876 105.8 52.2 -56.9 -37.4 -16.9 33.6 -22.8 95 102 A D T 3<5S- 0 0 99 -4,-2.6 173,-0.5 -5,-0.2 -1,-0.3 0.385 112.6-122.6 -80.3 2.6 -20.2 32.0 -21.7 96 103 A K T < 5 + 0 0 131 -3,-2.1 -3,-0.2 -5,-0.1 175,-0.1 0.855 67.4 139.3 59.1 39.0 -18.2 29.3 -19.8 97 104 A R < + 0 0 34 -5,-2.2 168,-2.1 -6,-0.2 2,-0.4 0.510 47.2 76.6 -91.4 -7.0 -19.8 26.6 -21.7 98 105 A A E +B 264 0B 7 -6,-0.3 2,-0.4 166,-0.2 166,-0.2 -0.846 49.1 180.0-112.4 143.0 -16.7 24.5 -22.2 99 106 A R E -B 263 0B 45 164,-2.4 164,-2.8 -2,-0.4 2,-0.5 -0.998 12.7-158.4-133.6 141.9 -14.8 22.1 -19.9 100 107 A T E -B 262 0B 12 -2,-0.4 2,-0.6 162,-0.2 162,-0.2 -0.967 8.0-163.1-127.0 127.7 -11.7 20.3 -20.9 101 108 A A E -B 261 0B 0 160,-2.8 160,-2.7 -2,-0.5 -28,-0.2 -0.947 24.3-131.6-101.7 119.7 -10.2 17.2 -19.4 102 109 A Q E -B 260 0B 1 -30,-2.6 158,-0.3 -2,-0.6 156,-0.1 -0.511 37.3-176.4 -60.3 136.8 -6.6 16.5 -20.4 103 110 A T E -B 259 0B 0 156,-2.4 2,-1.9 -2,-0.2 156,-1.5 -0.909 40.5 -85.8-136.5 163.0 -6.5 12.9 -21.5 104 111 A P E > S-B 258 0B 0 0, 0.0 4,-1.6 0, 0.0 154,-0.3 -0.523 95.6 -47.5 -74.2 87.0 -3.9 10.4 -22.7 105 112 A G H > S- 0 0 0 -2,-1.9 4,-2.1 152,-0.5 154,-0.4 0.069 79.5 -68.8 76.5 171.1 -4.0 11.3 -26.3 106 113 A G H > S+ 0 0 0 152,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.798 136.8 61.4 -61.0 -28.6 -7.0 11.9 -28.5 107 114 A S H > S+ 0 0 1 2,-0.2 4,-2.3 579,-0.2 5,-0.2 0.953 104.4 45.6 -63.1 -48.6 -7.5 8.1 -28.1 108 115 A G H X S+ 0 0 0 -4,-1.6 4,-3.0 578,-0.4 5,-0.2 0.915 112.2 53.2 -57.6 -43.9 -7.8 8.5 -24.4 109 116 A A H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.890 108.7 48.7 -57.9 -44.2 -10.2 11.4 -25.1 110 117 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.895 114.0 45.5 -65.0 -41.0 -12.3 9.2 -27.4 111 118 A R H X S+ 0 0 4 -4,-2.3 4,-3.2 574,-0.4 5,-0.2 0.917 114.1 48.4 -68.6 -43.3 -12.5 6.3 -24.8 112 119 A V H X S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.935 112.7 48.7 -61.8 -44.4 -13.3 8.8 -22.0 113 120 A A H X S+ 0 0 0 -4,-2.8 4,-2.9 -5,-0.2 -2,-0.2 0.942 113.0 48.9 -57.8 -47.4 -15.9 10.3 -24.2 114 121 A A H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.914 113.8 44.0 -59.2 -48.2 -17.3 6.8 -24.9 115 122 A D H X S+ 0 0 9 -4,-3.2 4,-2.1 2,-0.2 -1,-0.2 0.902 114.1 50.8 -65.3 -42.3 -17.4 5.7 -21.3 116 123 A F H X S+ 0 0 0 -4,-2.8 4,-1.7 -5,-0.2 -2,-0.2 0.928 114.2 44.5 -59.1 -46.7 -18.9 9.1 -20.2 117 124 A L H X S+ 0 0 0 -4,-2.9 4,-1.9 -5,-0.2 6,-0.3 0.929 113.1 50.8 -64.4 -45.4 -21.6 8.7 -22.9 118 125 A A H < S+ 0 0 30 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.863 118.4 36.7 -62.1 -37.2 -22.3 5.1 -22.1 119 126 A K H < S+ 0 0 131 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.696 129.2 27.1 -91.0 -19.3 -22.7 5.6 -18.4 120 127 A N H < S+ 0 0 42 -4,-1.7 2,-0.3 -5,-0.2 -2,-0.2 0.446 113.6 46.5-126.8 -5.7 -24.4 9.0 -18.3 121 128 A T S < S- 0 0 24 -4,-1.9 284,-0.1 -5,-0.2 283,-0.1 -0.813 75.5-113.7-135.5 175.6 -26.4 9.5 -21.5 122 129 A S + 0 0 80 -2,-0.3 2,-0.1 282,-0.2 -4,-0.1 0.273 64.7 135.6 -95.7 9.9 -28.8 7.7 -23.8 123 130 A V + 0 0 6 -6,-0.3 -2,-0.1 1,-0.2 53,-0.1 -0.405 17.9 163.0 -62.4 129.6 -26.3 7.5 -26.7 124 131 A K + 0 0 125 1,-0.2 22,-2.5 -2,-0.1 2,-0.4 0.554 57.9 44.5-115.6 -20.8 -26.4 4.0 -28.2 125 132 A R E -c 146 0B 57 20,-0.2 52,-2.6 50,-0.2 2,-0.4 -0.981 53.9-163.4-140.9 136.7 -24.8 4.6 -31.6 126 133 A V E -cd 147 177B 0 20,-2.7 22,-2.3 -2,-0.4 2,-0.5 -0.993 17.3-147.7-121.5 128.1 -21.8 6.5 -33.0 127 134 A W E +cd 148 178B 1 50,-2.7 52,-3.0 -2,-0.4 2,-0.3 -0.835 19.1 177.9 -99.1 130.8 -21.5 7.2 -36.7 128 135 A V E -c 149 0B 6 20,-2.8 22,-2.6 -2,-0.5 4,-0.1 -0.890 31.5 -94.2-128.5 159.7 -18.2 7.2 -38.5 129 136 A S E -c 150 0B 0 -2,-0.3 22,-0.2 50,-0.3 23,-0.1 -0.294 43.1 -96.1 -72.3 153.1 -17.2 7.8 -42.1 130 137 A N E S+c 151 0B 86 20,-2.0 23,-1.6 1,-0.2 22,-0.6 -0.949 119.7 22.6-101.8 107.5 -16.5 5.0 -44.6 131 138 A P S S+ 0 0 22 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.659 94.3 157.3 -85.5 164.7 -13.6 4.8 -44.4 132 139 A S - 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0 0 19 -2,-0.3 4,-1.5 -60,-0.1 3,-0.3 -0.943 45.8-104.7-141.2 163.4 7.1 16.0 11.4 785 392 B P T 4 S+ 0 0 80 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.837 121.6 50.6 -59.0 -27.3 9.2 16.4 14.5 786 393 B D T 4 S+ 0 0 150 -344,-0.2 3,-0.1 1,-0.2 -3,-0.0 0.789 116.4 36.2 -83.4 -29.0 8.0 20.0 14.7 787 394 B N T > S+ 0 0 32 -3,-0.3 4,-2.0 1,-0.1 5,-0.2 0.514 95.9 88.2 -97.8 -3.4 4.2 19.4 14.4 788 395 B M H X S+ 0 0 2 -4,-1.5 4,-2.4 1,-0.2 5,-0.2 0.899 83.2 51.2 -66.7 -43.7 4.1 16.2 16.4 789 396 B A H > S+ 0 0 38 -4,-0.5 4,-2.9 1,-0.2 5,-0.2 0.963 113.8 41.7 -62.6 -53.7 3.6 17.5 19.9 790 397 B P H > S+ 0 0 76 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.910 115.6 50.0 -61.5 -39.5 0.7 19.8 19.1 791 398 B L H X S+ 0 0 1 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.902 114.3 45.6 -66.8 -35.4 -1.1 17.3 16.9 792 399 B C H X S+ 0 0 0 -4,-2.4 4,-3.0 -5,-0.2 5,-0.2 0.887 110.5 52.4 -73.2 -37.8 -0.6 14.6 19.6 793 400 B E H X S+ 0 0 102 -4,-2.9 4,-2.2 -5,-0.2 -2,-0.2 0.921 110.7 50.0 -58.9 -41.5 -1.8 17.0 22.3 794 401 B A H X S+ 0 0 3 -4,-2.4 4,-1.0 -5,-0.2 -2,-0.2 0.918 110.9 48.0 -63.3 -45.6 -4.9 17.6 20.1 795 402 B I H >X S+ 0 0 4 -4,-2.3 3,-1.0 1,-0.2 4,-0.8 0.942 111.3 49.9 -61.6 -47.2 -5.5 13.9 19.7 796 403 B V H >< S+ 0 0 31 -4,-3.0 3,-0.9 1,-0.3 -1,-0.2 0.895 106.4 58.1 -57.0 -38.8 -5.1 13.2 23.4 797 404 B A H 3< S+ 0 0 45 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.754 109.0 43.7 -65.4 -26.4 -7.6 16.1 24.0 798 405 B V H << 0 0 6 -4,-1.0 -1,-0.2 -3,-1.0 -2,-0.2 0.481 360.0 360.0 -99.1 -3.4 -10.3 14.4 21.9 799 406 B L << 0 0 64 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.1 0.721 360.0 360.0 -72.6 360.0 -9.9 10.8 23.2