==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 09-MAR-11 3R0Z . COMPND 2 MOLECULE: D-SERINE DEHYDRATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA ENTERICA SUBSP. ENTERICA SE . AUTHOR S.R.BHARATH,B.SHVETA,H.S.SAVITHRI,M.R.N.MURTHY . 433 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17216.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 333 76.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 9.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 2.3 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 38 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 161 37.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 1 2 1 4 3 1 0 2 1 1 1 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 1 3 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 . 1 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 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 0 125 0, 0.0 3,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-167.0 25.2 -25.8 1.3 2 2 A E > + 0 0 62 1,-0.2 3,-2.5 2,-0.1 4,-0.2 0.509 360.0 105.0 -60.8 -5.5 22.6 -25.0 -1.3 3 3 A N T 3> + 0 0 67 1,-0.3 4,-0.7 2,-0.2 -1,-0.2 0.183 54.1 90.8 -59.7 15.7 21.1 -28.5 -0.5 4 4 A I H 3> S+ 0 0 47 -3,-0.4 4,-1.9 2,-0.2 -1,-0.3 0.679 76.7 62.8 -74.3 -30.0 18.5 -26.4 1.3 5 5 A Q H <> S+ 0 0 140 -3,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.743 95.1 58.9 -71.4 -20.7 16.6 -26.6 -2.0 6 6 A K H > S+ 0 0 108 2,-0.2 4,-1.3 -4,-0.2 -1,-0.2 0.922 105.6 47.8 -68.3 -48.7 16.4 -30.3 -1.6 7 7 A L H X S+ 0 0 35 -4,-0.7 4,-3.3 2,-0.2 3,-0.4 0.904 111.7 51.2 -56.0 -44.7 14.5 -29.9 1.7 8 8 A I H < S+ 0 0 34 -4,-1.9 -2,-0.2 1,-0.2 7,-0.2 0.909 105.0 56.0 -59.7 -45.4 12.2 -27.3 -0.1 9 9 A A H < S+ 0 0 87 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.789 118.1 34.4 -56.6 -31.6 11.6 -29.8 -2.9 10 10 A R H < S+ 0 0 69 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.775 132.0 30.5 -92.8 -32.7 10.3 -32.3 -0.3 11 11 A Y S >< S- 0 0 82 -4,-3.3 3,-2.2 -5,-0.2 4,-0.3 -0.742 70.8-172.9-127.2 82.2 8.7 -29.8 2.1 12 12 A P T > S+ 0 0 78 0, 0.0 3,-3.0 0, 0.0 4,-0.4 0.828 81.0 65.0 -47.2 -45.6 7.5 -26.8 -0.1 13 13 A L T >> S+ 0 0 33 1,-0.3 4,-1.8 2,-0.2 3,-1.5 0.814 84.9 75.1 -47.6 -33.6 6.5 -24.6 2.9 14 14 A V H <> S+ 0 0 0 -3,-2.2 4,-1.8 1,-0.3 -1,-0.3 0.804 88.5 61.9 -51.9 -28.6 10.2 -24.6 3.8 15 15 A E H <> S+ 0 0 114 -3,-3.0 4,-1.8 -4,-0.3 -1,-0.3 0.840 100.8 48.7 -68.0 -36.8 10.6 -22.1 0.9 16 16 A D H <4>S+ 0 0 45 -3,-1.5 5,-2.5 -4,-0.4 -2,-0.2 0.895 108.9 55.7 -67.1 -38.9 8.3 -19.5 2.5 17 17 A L H ><5S+ 0 0 3 -4,-1.8 3,-1.4 1,-0.2 -2,-0.2 0.925 107.8 47.4 -57.3 -46.3 10.3 -19.9 5.7 18 18 A V H 3<5S+ 0 0 57 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.887 107.0 56.5 -61.3 -44.2 13.5 -19.1 3.9 19 19 A A T 3<5S- 0 0 69 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.383 111.1-124.1 -67.4 2.8 11.8 -16.1 2.2 20 20 A L T < 5 + 0 0 61 -3,-1.4 2,-0.4 1,-0.2 -3,-0.2 0.838 58.1 159.8 54.6 36.6 11.0 -14.8 5.8 21 21 A K < - 0 0 113 -5,-2.5 -1,-0.2 279,-0.1 2,-0.1 -0.732 51.1-100.6-100.1 135.6 7.5 -14.8 4.6 22 22 A E - 0 0 74 -2,-0.4 2,-0.3 -3,-0.1 334,-0.1 -0.354 52.6-175.6 -59.6 121.3 4.5 -14.8 7.1 23 23 A T - 0 0 7 -2,-0.1 332,-3.0 332,-0.1 2,-0.4 -0.928 24.5-162.8-128.9 145.8 3.3 -18.4 7.2 24 24 A T E -A 354 0A 43 -2,-0.3 2,-0.4 330,-0.2 330,-0.2 -0.998 11.2-169.7-123.5 132.4 0.4 -20.4 8.7 25 25 A W E -A 353 0A 33 328,-2.2 328,-1.8 -2,-0.4 2,-0.5 -0.988 8.5-158.1-125.5 122.7 0.5 -24.2 9.0 26 26 A F E -A 352 0A 51 -2,-0.4 326,-0.3 326,-0.2 325,-0.1 -0.887 23.8-127.8 -99.5 128.5 -2.4 -26.3 10.0 27 27 A N > - 0 0 21 324,-2.3 3,-0.9 -2,-0.5 283,-0.0 -0.632 15.6-165.7 -78.5 117.6 -1.3 -29.7 11.3 28 28 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.2 0, 0.0 324,-0.0 0.834 89.0 62.5 -70.9 -26.0 -3.1 -32.6 9.6 29 29 A G T 3 + 0 0 39 -3,-0.1 2,-0.3 321,-0.0 321,-0.1 0.003 69.9 129.5 -89.2 27.0 -1.8 -34.8 12.4 30 30 A A < - 0 0 21 -3,-0.9 2,-0.2 321,-0.2 319,-0.2 -0.673 38.3-177.3 -78.2 142.4 -3.6 -33.0 15.2 31 31 A T - 0 0 29 317,-3.1 -2,-0.0 -2,-0.3 5,-0.0 -0.770 28.8 -81.3-135.6 171.8 -5.5 -35.6 17.4 32 32 A S > - 0 0 47 -2,-0.2 4,-1.3 1,-0.1 -1,-0.1 -0.198 48.6-104.5 -69.1 168.0 -7.8 -36.0 20.4 33 33 A L H >> S+ 0 0 33 2,-0.2 4,-3.3 1,-0.2 3,-0.9 0.961 121.5 54.0 -58.9 -52.2 -6.4 -35.9 23.9 34 34 A A H 34 S+ 0 0 77 1,-0.3 -1,-0.2 2,-0.2 -3,-0.0 0.899 113.1 43.1 -47.7 -51.3 -6.8 -39.7 24.2 35 35 A Q H 34 S+ 0 0 123 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.725 120.7 42.6 -65.3 -25.2 -4.8 -40.2 21.0 36 36 A G H X< S+ 0 0 0 -4,-1.3 3,-1.0 -3,-0.9 4,-0.3 0.807 93.7 78.0 -95.7 -32.8 -2.2 -37.6 22.0 37 37 A L G >X S+ 0 0 56 -4,-3.3 3,-2.8 1,-0.2 4,-0.9 0.863 82.2 63.2 -49.6 -55.7 -1.6 -38.2 25.7 38 38 A P G 34 S+ 0 0 94 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.801 97.8 59.1 -36.2 -46.9 0.7 -41.3 25.4 39 39 A Y G <4 S+ 0 0 125 -3,-1.0 -2,-0.2 1,-0.2 308,-0.1 0.520 99.7 56.3 -73.7 -7.2 3.4 -39.2 23.6 40 40 A V T <4 S- 0 0 5 -3,-2.8 -1,-0.2 -4,-0.3 305,-0.1 0.856 86.1-149.9 -88.6 -39.0 3.8 -36.7 26.4 41 41 A G < + 0 0 64 -4,-0.9 2,-0.3 -3,-0.5 -2,-0.1 0.935 62.9 100.3 62.8 44.2 4.7 -39.1 29.3 42 42 A L - 0 0 20 -5,-0.3 -1,-0.3 197,-0.0 2,-0.2 -0.919 57.8-152.0-147.5 140.4 3.1 -37.0 32.0 43 43 A T > - 0 0 63 -2,-0.3 4,-1.2 -3,-0.1 5,-0.1 -0.473 35.3 -99.0-101.7 178.7 -0.3 -37.6 33.5 44 44 A E H > S+ 0 0 100 2,-0.2 4,-3.0 1,-0.2 5,-0.1 0.802 124.0 57.6 -59.4 -33.1 -3.0 -35.5 35.1 45 45 A Q H > S+ 0 0 126 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.940 101.1 53.0 -69.0 -48.6 -1.6 -36.7 38.5 46 46 A D H > S+ 0 0 69 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.882 115.7 43.3 -48.9 -40.4 2.0 -35.4 37.7 47 47 A V H X S+ 0 0 8 -4,-1.2 4,-1.8 2,-0.2 -2,-0.2 0.907 110.7 52.9 -75.3 -43.5 0.2 -32.1 37.0 48 48 A N H X S+ 0 0 62 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.866 107.4 54.2 -57.8 -39.5 -2.2 -32.4 40.1 49 49 A A H X S+ 0 0 43 -4,-3.3 4,-2.8 2,-0.2 -1,-0.2 0.931 103.6 55.1 -59.8 -46.0 1.0 -32.9 42.3 50 50 A A H X S+ 0 0 0 -4,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.899 108.9 47.5 -54.6 -45.7 2.5 -29.7 40.9 51 51 A H H X S+ 0 0 18 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.922 111.1 51.3 -58.7 -47.3 -0.7 -27.8 42.0 52 52 A D H X S+ 0 0 93 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.890 108.0 51.9 -62.5 -40.5 -0.6 -29.4 45.5 53 53 A R H X S+ 0 0 44 -4,-2.8 4,-1.2 1,-0.2 -1,-0.2 0.929 111.8 47.2 -56.9 -44.8 3.1 -28.4 45.9 54 54 A L H X S+ 0 0 23 -4,-2.0 4,-0.8 2,-0.2 -2,-0.2 0.827 109.9 52.7 -67.2 -32.5 2.2 -24.8 45.0 55 55 A A H >< S+ 0 0 61 -4,-2.2 3,-1.6 2,-0.2 -2,-0.2 0.977 107.0 51.7 -66.1 -59.0 -0.8 -24.9 47.5 56 56 A R H 3< S+ 0 0 66 -4,-2.3 86,-0.6 1,-0.2 4,-0.3 0.764 112.0 49.0 -37.7 -37.4 1.5 -26.1 50.3 57 57 A F H >X S+ 0 0 0 -4,-1.2 4,-2.8 -5,-0.2 3,-0.6 0.647 86.3 91.2 -84.5 -15.1 3.8 -23.1 49.4 58 58 A A H S+ 0 0 48 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.869 116.7 46.9 -55.9 -32.1 1.2 -19.5 53.0 60 60 A Y H <> S+ 0 0 0 -3,-0.6 4,-2.5 -4,-0.3 3,-0.4 0.988 112.4 45.9 -68.3 -63.1 5.0 -19.1 52.3 61 61 A L H X S+ 0 0 4 -4,-2.8 4,-3.3 1,-0.2 7,-0.3 0.841 108.9 56.7 -47.3 -45.2 4.8 -17.1 49.0 62 62 A A H < S+ 0 0 37 -4,-2.6 -1,-0.2 6,-0.3 -2,-0.2 0.912 113.7 39.0 -57.2 -47.6 2.1 -14.7 50.4 63 63 A K H < S+ 0 0 124 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.876 119.9 45.2 -69.9 -39.7 4.4 -13.7 53.3 64 64 A A H < S+ 0 0 23 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.850 123.8 34.8 -76.3 -34.3 7.6 -13.6 51.3 65 65 A F S >< S- 0 0 18 -4,-3.3 3,-0.7 -5,-0.3 -1,-0.3 -0.873 74.4-159.9-122.2 95.0 6.0 -11.8 48.4 66 66 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.806 93.0 47.6 -38.2 -46.3 3.4 -9.3 49.8 67 67 A Q T 3 0 0 145 4,-0.0 4,-0.2 -4,-0.0 -5,-0.1 0.902 360.0 360.0 -62.6 -42.3 1.6 -9.1 46.3 68 68 A T < 0 0 20 -3,-0.7 3,-1.3 -7,-0.3 4,-0.6 0.908 360.0 360.0 -75.4 360.0 1.5 -12.9 45.8 69 ! 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 70 72 A G 0 0 98 0, 0.0 -8,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 68.5 -4.1 -16.6 48.1 71 73 A G + 0 0 3 -3,-1.3 2,-0.5 1,-0.3 -10,-0.2 0.662 360.0 140.8 78.4 20.5 -0.3 -16.9 47.9 72 74 A M - 0 0 97 -4,-0.6 2,-0.9 -11,-0.1 -1,-0.3 -0.839 54.1-144.1-103.2 132.0 -0.8 -17.6 44.2 73 75 A I + 0 0 17 -2,-0.5 2,-0.3 -3,-0.1 34,-0.1 -0.877 51.1 141.4 -87.4 103.3 1.4 -16.3 41.5 74 76 A E - 0 0 44 -2,-0.9 2,-0.3 32,-0.1 34,-0.3 -0.911 40.6-137.0-141.3 169.3 -1.2 -15.7 38.8 75 77 A S - 0 0 4 -2,-0.3 29,-0.1 32,-0.1 2,-0.1 -0.934 25.1-105.5-130.9 151.5 -2.2 -13.3 36.1 76 78 A D - 0 0 106 -2,-0.3 27,-2.9 27,-0.3 2,-0.5 -0.418 19.3-145.9 -70.2 147.5 -5.4 -11.7 35.0 77 79 A V E -B 102 0A 10 25,-0.2 2,-0.4 -2,-0.1 25,-0.2 -0.977 26.3-170.9-109.6 128.4 -7.2 -12.7 31.8 78 80 A V E -B 101 0A 47 23,-2.9 23,-3.3 -2,-0.5 2,-0.2 -0.953 25.0-119.4-126.9 141.7 -8.9 -9.7 30.2 79 81 A A E -B 100 0A 48 -2,-0.4 21,-0.2 21,-0.2 19,-0.0 -0.541 23.8-169.1 -69.1 140.1 -11.4 -9.1 27.4 80 82 A I > + 0 0 1 19,-1.9 4,-2.3 -2,-0.2 20,-0.1 -0.445 25.5 150.1-133.8 64.4 -10.0 -7.0 24.5 81 83 A P H > S+ 0 0 77 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.839 74.5 52.7 -68.0 -32.8 -12.8 -6.0 22.2 82 84 A A H > S+ 0 0 37 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.903 110.7 47.0 -72.3 -41.9 -11.4 -2.6 21.1 83 85 A M H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.928 109.4 58.8 -57.7 -43.4 -8.1 -4.3 20.2 84 86 A Q H X S+ 0 0 20 -4,-2.3 4,-1.1 1,-0.2 -2,-0.2 0.844 107.8 42.2 -55.0 -42.9 -10.3 -6.9 18.4 85 87 A K H X S+ 0 0 150 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.846 109.5 58.7 -74.8 -35.1 -12.0 -4.3 16.1 86 88 A R H X S+ 0 0 35 -4,-2.0 4,-3.0 1,-0.2 -2,-0.2 0.919 106.1 49.3 -58.6 -42.0 -8.7 -2.5 15.4 87 89 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 5,-0.5 0.848 110.8 49.4 -66.1 -35.1 -7.3 -5.8 14.0 88 90 A E H X S+ 0 0 56 -4,-1.1 4,-1.4 3,-0.2 -1,-0.2 0.876 115.3 44.8 -70.3 -35.9 -10.4 -6.2 11.8 89 91 A K H < S+ 0 0 157 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.905 118.1 42.6 -73.5 -41.9 -10.0 -2.6 10.6 90 92 A E H < S+ 0 0 71 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.829 131.0 21.5 -73.6 -33.7 -6.2 -2.9 10.1 91 93 A Y H < S- 0 0 92 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.571 94.0-131.3-120.5 -16.8 -6.0 -6.3 8.4 92 94 A G < + 0 0 66 -4,-1.4 2,-0.5 -5,-0.5 -4,-0.2 0.656 64.3 119.8 81.8 16.6 -9.5 -6.8 7.1 93 95 A Q - 0 0 56 -6,-0.5 -1,-0.2 2,-0.0 -2,-0.1 -0.983 63.1-124.0-117.1 120.3 -10.3 -10.3 8.4 94 96 A T - 0 0 83 -2,-0.5 2,-0.6 297,-0.1 -9,-0.1 -0.302 14.8-144.3 -53.3 137.3 -13.3 -10.6 10.8 95 97 A I - 0 0 4 -11,-0.1 4,-0.1 2,-0.1 2,-0.1 -0.948 18.7-150.6-106.0 106.0 -12.4 -12.2 14.1 96 98 A N + 0 0 38 -2,-0.6 312,-0.2 291,-0.2 2,-0.1 -0.407 57.9 8.7 -70.4 149.5 -15.5 -14.4 15.1 97 99 A G S S- 0 0 24 311,-0.3 2,-0.5 -2,-0.1 314,-0.2 -0.446 108.1 -37.4 81.0-152.4 -16.3 -15.0 18.8 98 100 A E E - c 0 411A 80 312,-3.2 314,-2.5 -2,-0.1 2,-0.4 -0.941 47.9-145.2-123.3 118.1 -14.6 -13.2 21.7 99 101 A M E - c 0 412A 1 -2,-0.5 -19,-1.9 312,-0.2 2,-0.3 -0.617 23.3-177.9 -79.6 131.5 -10.9 -12.2 21.8 100 102 A L E -Bc 79 413A 2 312,-4.0 314,-3.0 -2,-0.4 2,-0.4 -0.875 18.3-138.7-125.7 159.9 -9.2 -12.4 25.3 101 103 A L E -Bc 78 414A 0 -23,-3.3 -23,-2.9 -2,-0.3 2,-0.6 -0.982 3.1-154.9-122.1 122.5 -5.7 -11.6 26.7 102 104 A K E -Bc 77 415A 0 312,-2.8 314,-2.2 -2,-0.4 2,-1.2 -0.844 15.6-150.1 -91.9 119.6 -3.9 -13.7 29.3 103 105 A K E > + c 0 416A 35 -27,-2.9 3,-2.5 -2,-0.6 -27,-0.3 -0.331 43.6 144.6 -96.5 54.9 -1.5 -11.4 31.1 104 106 A D G > + 0 0 0 -2,-1.2 3,-1.4 312,-1.0 -1,-0.2 0.711 67.6 77.8 -60.4 -20.2 1.4 -13.6 32.0 105 107 A S G 3 S+ 0 0 0 -3,-0.3 315,-1.1 313,-0.3 -1,-0.3 0.528 93.9 48.8 -55.9 -13.9 3.4 -10.4 31.2 106 108 A H G < S+ 0 0 90 -3,-2.5 -1,-0.2 310,-0.2 -2,-0.2 0.120 79.2 132.2-121.5 18.3 2.2 -9.2 34.7 107 109 A L <> - 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0 0 17 -6,-0.9 2,-0.6 -9,-0.0 -1,-0.2 -0.789 40.1-159.0 -92.6 124.5 -1.9 -2.5 28.0 375 380 A R + 0 0 105 -2,-0.6 2,-0.2 -3,-0.1 -9,-0.1 -0.885 22.2 157.7-112.4 114.1 1.8 -2.1 27.2 376 381 A L - 0 0 2 -2,-0.6 43,-0.2 -11,-0.2 -7,-0.1 -0.566 38.7 -98.7-123.8-178.7 3.8 -5.2 26.3 377 382 A E > - 0 0 29 41,-1.1 3,-0.9 -2,-0.2 4,-0.4 -0.669 40.9-102.6-101.0 165.2 7.0 -6.2 24.6 378 383 A P G >> S+ 0 0 2 0, 0.0 3,-2.1 0, 0.0 4,-0.5 0.875 118.1 58.7 -55.5 -45.1 7.2 -7.5 20.9 379 384 A S G >4 S+ 0 0 6 -50,-0.3 3,-1.2 1,-0.3 4,-0.3 0.847 100.3 58.7 -50.5 -38.7 7.6 -11.2 21.9 380 385 A A G <4 S+ 0 0 1 -3,-0.9 3,-0.3 1,-0.2 -1,-0.3 0.626 96.6 62.5 -73.1 -11.2 4.3 -11.0 23.7 381 386 A L G X> S+ 0 0 0 -3,-2.1 3,-1.4 -4,-0.4 4,-0.7 0.635 74.1 93.1 -86.5 -14.1 2.5 -9.9 20.5 382 387 A A G X< S+ 0 0 0 -3,-1.2 3,-0.9 -4,-0.5 4,-0.3 0.863 87.0 48.3 -45.1 -47.2 3.3 -13.2 18.7 383 388 A G G >4 S+ 0 0 0 -3,-0.3 3,-1.2 32,-0.3 -1,-0.3 0.750 96.0 74.4 -67.4 -25.5 -0.1 -14.7 19.9 384 389 A M G <4 S+ 0 0 0 -3,-1.4 4,-0.3 1,-0.3 -1,-0.2 0.769 89.7 55.9 -64.5 -29.3 -2.0 -11.6 18.8 385 390 A A G S+ 0 0 0 -3,-1.2 4,-2.2 -4,-0.3 3,-0.4 0.825 75.8 65.7 -63.0 -42.1 -3.3 -15.9 15.4 387 392 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.919 106.5 44.7 -50.4 -45.7 -7.1 -15.2 15.8 388 393 A Q H > S+ 0 0 16 -3,-0.4 4,-1.4 -4,-0.3 -2,-0.2 0.786 107.5 57.3 -72.1 -27.9 -7.2 -13.9 12.2 389 394 A R H X S+ 0 0 42 -4,-0.9 4,-0.6 -3,-0.4 -1,-0.2 0.894 113.4 42.5 -62.5 -38.5 -5.1 -16.8 10.8 390 395 A I H >< S+ 0 0 0 -4,-2.2 3,-0.7 1,-0.2 -2,-0.2 0.909 113.6 48.2 -76.6 -46.4 -7.7 -19.1 12.2 391 396 A C H 3< S+ 0 0 9 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.745 109.3 55.9 -64.4 -27.4 -10.9 -17.2 11.2 392 397 A A H 3< S+ 0 0 51 -4,-1.4 2,-0.9 -5,-0.2 -1,-0.2 0.693 90.0 82.6 -79.6 -22.3 -9.6 -16.8 7.7 393 398 A S S+ 0 0 107 -2,-0.9 4,-3.0 2,-0.2 5,-0.3 0.873 82.8 61.2 -73.0 -35.9 -12.1 -22.4 5.9 395 400 A A H > S+ 0 0 53 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.970 108.3 42.6 -45.1 -61.6 -10.0 -25.5 5.2 396 401 A Y H > S+ 0 0 5 1,-0.2 4,-1.5 2,-0.2 6,-0.2 0.901 114.4 51.6 -56.6 -43.9 -9.0 -25.6 8.9 397 402 A Q H <>S+ 0 0 11 -4,-1.8 5,-2.4 -7,-0.2 -1,-0.2 0.904 113.9 42.5 -57.9 -45.2 -12.5 -24.8 10.0 398 403 A Q H ><5S+ 0 0 151 -4,-3.0 3,-1.2 1,-0.2 -2,-0.2 0.871 109.0 57.5 -76.0 -35.7 -14.0 -27.6 7.9 399 404 A R H 3<5S+ 0 0 191 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.803 113.7 40.7 -61.9 -31.9 -11.3 -30.2 8.8 400 405 A H T 3<5S- 0 0 70 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.323 114.7-118.6 -99.2 5.8 -12.1 -29.7 12.5 401 406 A G T < 5 + 0 0 47 -3,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.617 50.4 168.2 68.2 20.3 -15.9 -29.6 11.8 402 407 A F < - 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