==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 21-JUN-10 3NKZ . COMPND 2 MOLECULE: FLAGELLAR PROTEIN FLIT; . SOURCE 2 ORGANISM_SCIENTIFIC: YERSINIA ENTEROCOLITICA SUBSP. ENTEROC . AUTHOR K.TAN,H.LI,B.FELDMANN,A.JOACHIMIAK,MIDWEST CENTER FOR STRUCT . 385 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20214.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 351 91.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 5 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 312 81.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 1 0 3 0 4 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 -2 A S 0 0 38 0, 0.0 2,-0.1 0, 0.0 348,-0.0 0.000 360.0 360.0 360.0 166.9 4.8 -3.9 13.4 2 -1 A N > - 0 0 56 348,-0.1 4,-2.5 346,-0.0 5,-0.2 -0.185 360.0 -80.6 -93.5-173.2 8.2 -2.2 13.7 3 0 A A H > S+ 0 0 27 346,-0.3 4,-2.2 1,-0.2 5,-0.2 0.929 126.8 45.1 -57.0 -56.8 10.2 -1.1 16.7 4 1 A X H > S+ 0 0 115 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.919 114.6 51.1 -54.5 -44.0 8.4 2.2 17.5 5 2 A E H > S+ 0 0 36 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.899 109.8 48.4 -66.0 -42.2 5.1 0.5 17.1 6 3 A R H X S+ 0 0 75 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.874 111.8 50.4 -61.4 -40.8 6.0 -2.4 19.4 7 4 A H H X S+ 0 0 32 -4,-2.2 4,-2.8 2,-0.2 5,-0.4 0.910 109.5 49.2 -66.9 -45.0 7.2 0.0 22.1 8 5 A Q H X S+ 0 0 118 -4,-2.4 4,-3.0 -5,-0.2 -1,-0.2 0.934 114.4 46.6 -59.6 -42.8 4.1 2.2 22.0 9 6 A H H X S+ 0 0 67 -4,-1.9 4,-3.0 -5,-0.2 -2,-0.2 0.946 113.6 47.7 -66.0 -45.9 1.9 -0.9 22.3 10 7 A L H X S+ 0 0 11 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.932 117.4 40.9 -62.3 -49.0 3.9 -2.4 25.1 11 8 A L H X S+ 0 0 38 -4,-2.8 4,-2.2 1,-0.2 3,-0.4 0.941 113.8 54.3 -64.3 -46.8 4.0 0.8 27.1 12 9 A S H X S+ 0 0 43 -4,-3.0 4,-2.4 -5,-0.4 -2,-0.2 0.911 105.1 54.1 -52.7 -44.5 0.4 1.5 26.3 13 10 A E H X S+ 0 0 8 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.865 109.7 47.0 -60.2 -38.1 -0.6 -2.0 27.6 14 11 A Y H X S+ 0 0 8 -4,-1.4 4,-2.9 -3,-0.4 5,-0.3 0.815 107.8 56.4 -74.8 -31.2 1.1 -1.3 31.0 15 12 A Q H X S+ 0 0 90 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.951 107.2 49.9 -63.1 -48.4 -0.5 2.1 31.2 16 13 A Q H X S+ 0 0 88 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.951 114.6 43.6 -51.6 -55.7 -3.9 0.5 30.8 17 14 A I H X S+ 0 0 9 -4,-2.0 4,-3.3 1,-0.2 5,-0.2 0.944 115.7 45.8 -59.8 -49.1 -3.2 -2.1 33.6 18 15 A L H X S+ 0 0 14 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.891 111.5 53.3 -65.0 -36.7 -1.6 0.4 36.0 19 16 A T H X S+ 0 0 70 -4,-2.6 4,-1.9 -5,-0.3 -1,-0.2 0.873 113.1 43.3 -67.1 -35.7 -4.4 2.9 35.5 20 17 A L H X S+ 0 0 19 -4,-2.0 4,-2.6 -5,-0.2 5,-0.3 0.929 110.3 55.4 -71.5 -50.7 -7.0 0.2 36.3 21 18 A S H X S+ 0 0 1 -4,-3.3 4,-2.8 1,-0.2 -2,-0.2 0.927 109.6 49.3 -41.7 -51.6 -5.0 -1.1 39.2 22 19 A E H X S+ 0 0 98 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.939 109.0 49.8 -60.0 -50.4 -5.0 2.5 40.6 23 20 A Q H X S+ 0 0 98 -4,-1.9 4,-1.9 1,-0.2 3,-0.3 0.956 114.9 45.0 -53.7 -52.4 -8.8 3.0 40.1 24 21 A X H X S+ 0 0 4 -4,-2.6 4,-3.2 1,-0.2 3,-0.3 0.940 107.9 56.0 -56.8 -53.2 -9.5 -0.3 41.9 25 22 A L H X S+ 0 0 35 -4,-2.8 4,-2.1 -5,-0.3 -1,-0.2 0.842 108.5 50.6 -50.9 -34.0 -7.0 0.3 44.7 26 23 A V H < S+ 0 0 80 -4,-1.9 -1,-0.2 -3,-0.3 4,-0.2 0.874 108.8 48.7 -74.9 -38.0 -8.9 3.6 45.4 27 24 A L H >< S+ 0 0 31 -4,-1.9 3,-2.1 -3,-0.3 -2,-0.2 0.976 111.8 53.4 -56.7 -51.6 -12.3 1.9 45.5 28 25 A A H >< S+ 0 0 3 -4,-3.2 3,-0.7 1,-0.3 -2,-0.2 0.883 98.3 60.2 -48.7 -51.9 -10.7 -0.6 47.8 29 26 A T T 3< S+ 0 0 75 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.551 120.4 27.4 -60.6 -4.9 -9.4 2.0 50.3 30 27 A E T < S- 0 0 130 -3,-2.1 -1,-0.3 1,-0.4 -2,-0.1 -0.363 111.0 -88.8-161.1 76.5 -13.0 3.0 50.8 31 28 A G S < S+ 0 0 37 -3,-0.7 -1,-0.4 1,-0.2 5,-0.1 -0.335 78.2 121.4 59.3-130.2 -15.8 0.6 50.3 32 29 A N > + 0 0 97 1,-0.2 4,-1.0 -3,-0.1 -1,-0.2 0.811 35.9 153.6 40.7 33.5 -17.0 0.6 46.7 33 30 A W T 4 S+ 0 0 38 1,-0.2 4,-0.2 2,-0.2 -1,-0.2 0.648 70.0 42.8 -70.1 -16.3 -16.1 -3.1 47.0 34 31 A D T >> S+ 0 0 111 2,-0.2 3,-0.9 1,-0.1 4,-0.8 0.735 104.1 62.5 -96.6 -29.6 -18.6 -4.0 44.3 35 32 A A H 3> S+ 0 0 26 1,-0.3 4,-1.0 2,-0.2 3,-0.2 0.765 100.7 59.9 -59.2 -22.8 -17.7 -1.0 42.1 36 33 A L H 3X S+ 0 0 2 -4,-1.0 4,-1.5 1,-0.2 -1,-0.3 0.802 93.3 61.4 -74.2 -32.6 -14.4 -2.9 42.2 37 34 A V H <> S+ 0 0 41 -3,-0.9 4,-0.8 -4,-0.2 -1,-0.2 0.759 99.2 57.6 -69.2 -25.0 -15.9 -6.0 40.6 38 35 A D H X S+ 0 0 107 -4,-0.8 4,-0.8 -3,-0.2 3,-0.4 0.940 107.1 44.8 -71.5 -50.2 -16.8 -4.0 37.5 39 36 A L H X S+ 0 0 35 -4,-1.0 4,-3.0 1,-0.2 3,-0.3 0.838 98.3 80.1 -60.2 -32.8 -13.3 -2.9 36.7 40 37 A E H X S+ 0 0 34 -4,-1.5 4,-2.6 1,-0.2 -1,-0.2 0.869 92.2 44.0 -48.1 -53.4 -12.1 -6.5 37.4 41 38 A X H X S+ 0 0 85 -4,-0.8 4,-1.5 -3,-0.4 -1,-0.2 0.909 116.0 48.1 -60.4 -41.1 -13.1 -8.0 34.1 42 39 A T H X S+ 0 0 74 -4,-0.8 4,-1.6 -3,-0.3 -1,-0.2 0.898 111.3 51.5 -65.5 -40.5 -11.7 -5.0 32.2 43 40 A Y H X S+ 0 0 12 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.922 109.4 50.5 -55.0 -48.3 -8.5 -5.3 34.3 44 41 A L H X S+ 0 0 12 -4,-2.6 4,-1.7 -5,-0.3 -1,-0.2 0.773 108.3 51.6 -68.4 -27.0 -8.3 -8.9 33.4 45 42 A K H X S+ 0 0 93 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.811 107.3 51.8 -81.8 -26.6 -8.6 -8.3 29.7 46 43 A A H X S+ 0 0 5 -4,-1.6 4,-1.4 -3,-0.2 -2,-0.2 0.903 110.6 50.7 -70.8 -40.2 -5.9 -5.7 29.7 47 44 A V H X S+ 0 0 43 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.872 108.3 51.7 -62.3 -39.7 -3.8 -8.3 31.5 48 45 A E H X S+ 0 0 52 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.884 108.2 51.7 -64.3 -38.1 -4.7 -10.9 28.8 49 46 A S H < S+ 0 0 41 -4,-1.8 4,-0.4 2,-0.2 -1,-0.2 0.781 111.6 47.2 -72.4 -26.2 -3.6 -8.4 26.0 50 47 A T H >X S+ 0 0 11 -4,-1.4 3,-1.0 2,-0.2 4,-0.7 0.901 110.2 50.5 -78.4 -45.0 -0.3 -7.9 27.7 51 48 A A H >X S+ 0 0 18 -4,-2.4 4,-1.4 1,-0.3 3,-0.5 0.898 104.8 61.0 -57.3 -38.4 0.4 -11.5 28.3 52 49 A N H 3X S+ 0 0 31 -4,-2.0 4,-3.1 1,-0.2 5,-0.3 0.721 86.3 73.9 -66.2 -23.8 -0.4 -12.1 24.6 53 50 A I H <> S+ 0 0 31 -3,-1.0 4,-1.0 -4,-0.4 -1,-0.2 0.975 105.4 36.3 -50.4 -57.8 2.4 -9.8 23.5 54 51 A T H << S+ 0 0 25 -4,-0.7 4,-0.2 -3,-0.5 -1,-0.2 0.859 118.4 52.3 -61.6 -41.2 5.0 -12.5 24.4 55 52 A I H >< S+ 0 0 0 -4,-1.4 3,-1.7 1,-0.2 -2,-0.2 0.954 107.3 48.6 -63.3 -52.7 2.7 -15.4 23.3 56 53 A S H 3< S+ 0 0 4 -4,-3.1 198,-0.3 1,-0.3 -1,-0.2 0.725 108.6 55.5 -64.3 -23.8 1.9 -14.1 19.8 57 54 A S T 3< S+ 0 0 69 -4,-1.0 -1,-0.3 -5,-0.3 2,-0.2 0.460 82.3 121.9 -86.2 -1.7 5.6 -13.4 19.1 58 55 A C < - 0 0 10 -3,-1.7 6,-0.1 -4,-0.2 -3,-0.0 -0.424 55.5-148.4 -76.2 131.9 6.6 -17.0 19.9 59 56 A S S S+ 0 0 76 -2,-0.2 2,-0.2 42,-0.1 -1,-0.1 0.976 78.6 77.6 -55.8 -63.2 8.5 -19.2 17.3 60 57 A S > - 0 0 32 1,-0.2 4,-2.4 41,-0.1 5,-0.1 -0.320 59.3-167.5 -58.0 117.2 7.1 -22.6 18.3 61 58 A L H > S+ 0 0 72 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.894 91.1 56.3 -70.8 -39.2 3.6 -22.9 17.0 62 59 A X H > S+ 0 0 133 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.903 112.7 41.4 -55.5 -43.9 3.2 -26.0 19.3 63 60 A L H > S+ 0 0 8 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.889 111.3 54.1 -72.9 -42.0 4.1 -23.8 22.3 64 61 A Q H X S+ 0 0 1 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.910 107.9 53.4 -58.7 -41.6 2.1 -20.8 21.2 65 62 A D H X S+ 0 0 79 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.954 113.7 41.2 -50.7 -53.4 -0.9 -23.1 21.0 66 63 A L H X S+ 0 0 39 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.802 108.5 56.6 -78.3 -33.6 -0.4 -24.3 24.5 67 64 A L H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.886 106.1 52.5 -64.0 -37.7 0.4 -21.1 26.2 68 65 A R H X S+ 0 0 63 -4,-1.7 4,-2.3 -5,-0.3 -2,-0.2 0.933 108.6 51.6 -63.4 -42.7 -2.8 -19.6 25.0 69 66 A E H X S+ 0 0 138 -4,-1.5 4,-1.4 1,-0.2 -2,-0.2 0.905 112.6 44.7 -55.6 -47.7 -4.6 -22.6 26.5 70 67 A K H X S+ 0 0 41 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.860 110.3 54.4 -68.4 -37.1 -2.9 -22.1 29.8 71 68 A L H X S+ 0 0 9 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.919 108.3 48.8 -64.8 -41.4 -3.5 -18.3 29.8 72 69 A R H X S+ 0 0 96 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.869 112.4 49.3 -67.3 -32.3 -7.2 -18.8 29.3 73 70 A A H X S+ 0 0 29 -4,-1.4 4,-2.5 -5,-0.2 -2,-0.2 0.925 110.4 50.2 -68.5 -45.5 -7.3 -21.3 32.2 74 71 A I H X S+ 0 0 12 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.912 114.3 44.7 -58.4 -43.8 -5.4 -19.0 34.4 75 72 A L H X S+ 0 0 8 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.927 111.9 50.3 -68.9 -44.7 -7.8 -16.2 33.7 76 73 A D H X S+ 0 0 75 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.885 112.8 49.2 -62.4 -37.7 -10.9 -18.3 34.0 77 74 A N H X S+ 0 0 27 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.911 109.0 50.2 -66.9 -45.2 -9.6 -19.5 37.4 78 75 A E H X S+ 0 0 21 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.882 112.6 49.7 -57.3 -39.1 -8.8 -15.9 38.6 79 76 A I H X S+ 0 0 56 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.914 112.0 47.4 -64.3 -43.1 -12.3 -15.1 37.6 80 77 A E H X S+ 0 0 64 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.838 111.8 48.3 -73.6 -36.4 -13.8 -18.1 39.5 81 78 A I H X S+ 0 0 20 -4,-2.7 4,-2.5 2,-0.2 5,-0.3 0.968 109.8 52.0 -64.0 -51.9 -11.9 -17.5 42.6 82 79 A K H X S+ 0 0 30 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.785 111.2 49.0 -56.5 -30.7 -12.8 -13.8 42.7 83 80 A R H X S+ 0 0 127 -4,-1.3 4,-4.1 2,-0.2 5,-0.2 0.961 108.5 52.5 -69.4 -54.6 -16.4 -14.9 42.4 84 81 A L H X S+ 0 0 15 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.838 113.7 44.5 -47.1 -41.3 -16.1 -17.4 45.1 85 82 A L H X S+ 0 0 30 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.862 111.7 50.5 -78.1 -35.6 -14.7 -14.7 47.4 86 83 A Q H X S+ 0 0 67 -4,-1.9 4,-3.5 -5,-0.3 5,-0.3 0.969 113.1 48.5 -60.7 -48.2 -17.3 -12.2 46.4 87 84 A L H X S+ 0 0 67 -4,-4.1 4,-3.2 2,-0.2 -2,-0.2 0.906 110.1 50.4 -56.1 -46.0 -19.9 -14.9 47.1 88 85 A R H X S+ 0 0 74 -4,-2.2 4,-3.2 -5,-0.2 5,-0.3 0.963 117.8 40.3 -55.6 -54.2 -18.2 -15.6 50.5 89 86 A L H X S+ 0 0 7 -4,-2.8 4,-3.0 2,-0.2 5,-0.3 0.995 114.1 51.0 -54.4 -71.3 -18.3 -11.9 51.3 90 87 A D H X S+ 0 0 66 -4,-3.5 4,-1.8 2,-0.2 5,-0.2 0.849 118.1 43.4 -31.6 -49.0 -21.8 -11.3 49.8 91 88 A R H X S+ 0 0 169 -4,-3.2 4,-2.3 -5,-0.3 3,-0.3 0.999 112.1 47.1 -65.0 -73.3 -22.8 -14.3 52.0 92 89 A L H X S+ 0 0 19 -4,-3.2 4,-1.8 1,-0.2 -2,-0.2 0.794 115.2 51.1 -35.1 -41.2 -21.0 -13.5 55.3 93 90 A S H X S+ 0 0 31 -4,-3.0 4,-1.3 -5,-0.3 -1,-0.2 0.947 107.7 45.1 -72.5 -54.0 -22.4 -9.9 55.1 94 91 A D H < S+ 0 0 123 -4,-1.8 -1,-0.2 -3,-0.3 -2,-0.2 0.918 110.1 62.4 -55.2 -41.5 -26.1 -10.4 54.4 95 92 A L H < S+ 0 0 118 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.957 112.7 30.7 -42.7 -75.4 -25.9 -13.0 57.2 96 93 A V H < 0 0 65 -4,-1.8 -2,-0.2 -5,-0.1 -3,-0.1 0.975 360.0 360.0 -49.1 -80.5 -24.8 -10.6 59.9 97 94 A G < 0 0 96 -4,-1.3 -3,-0.2 -5,-0.1 -2,-0.1 -0.562 360.0 360.0-174.0 360.0 -26.6 -7.5 58.7 98 !* 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 99 -2 B S > 0 0 106 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 99.1 20.0 -23.3 21.4 100 -1 B N H > + 0 0 87 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.924 360.0 52.6 -52.6 -50.1 18.7 -20.0 22.6 101 0 B A H > S+ 0 0 39 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.942 110.9 47.7 -51.4 -51.7 15.3 -20.5 21.0 102 1 B X H > S+ 0 0 108 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.949 115.7 43.9 -54.7 -53.8 15.0 -23.9 22.8 103 2 B E H X S+ 0 0 108 -4,-2.8 4,-2.5 1,-0.2 3,-0.4 0.963 111.6 52.3 -56.9 -56.9 16.1 -22.4 26.2 104 3 B R H X S+ 0 0 75 -4,-3.4 4,-2.5 1,-0.2 -1,-0.2 0.907 110.5 51.2 -43.1 -46.5 13.9 -19.3 25.8 105 4 B H H X S+ 0 0 36 -4,-2.6 4,-2.5 -5,-0.3 -1,-0.2 0.863 108.3 49.5 -65.8 -39.1 11.0 -21.7 25.1 106 5 B Q H X S+ 0 0 101 -4,-2.0 4,-3.6 -3,-0.4 5,-0.2 0.930 112.4 48.0 -62.3 -49.7 11.6 -23.9 28.2 107 6 B H H X S+ 0 0 91 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.942 113.5 46.3 -58.8 -50.1 11.7 -20.9 30.5 108 7 B L H X S+ 0 0 14 -4,-2.5 4,-2.0 -5,-0.3 5,-0.2 0.935 116.1 46.1 -58.5 -46.1 8.6 -19.4 29.0 109 8 B L H X S+ 0 0 36 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.954 112.1 51.0 -61.1 -49.7 6.8 -22.7 29.2 110 9 B S H X S+ 0 0 36 -4,-3.6 4,-3.0 1,-0.2 -1,-0.2 0.899 107.6 53.5 -54.7 -45.3 8.0 -23.3 32.8 111 10 B E H X S+ 0 0 12 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.946 112.0 42.9 -58.2 -50.6 6.9 -19.9 33.9 112 11 B Y H X S+ 0 0 11 -4,-2.0 4,-2.9 1,-0.2 5,-0.2 0.866 112.8 53.8 -64.9 -36.5 3.3 -20.4 32.6 113 12 B Q H X S+ 0 0 88 -4,-2.8 4,-2.6 -5,-0.2 -1,-0.2 0.947 109.3 48.9 -59.3 -45.3 3.3 -23.9 34.0 114 13 B Q H X S+ 0 0 87 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.911 113.1 47.1 -62.7 -44.2 4.3 -22.5 37.4 115 14 B I H X S+ 0 0 11 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.931 113.2 47.1 -62.0 -48.0 1.6 -19.9 37.3 116 15 B L H X S+ 0 0 11 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.925 110.0 52.9 -64.9 -42.9 -1.1 -22.3 36.2 117 16 B T H X S+ 0 0 71 -4,-2.6 4,-2.4 -5,-0.2 5,-0.2 0.968 112.4 45.2 -53.7 -53.1 -0.2 -24.9 38.8 118 17 B L H X S+ 0 0 29 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.844 112.2 52.1 -59.6 -38.0 -0.4 -22.2 41.5 119 18 B S H X S+ 0 0 2 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.852 110.2 49.2 -64.8 -36.8 -3.7 -21.0 40.0 120 19 B E H X S+ 0 0 90 -4,-2.7 4,-1.8 2,-0.2 5,-0.2 0.892 110.8 48.5 -72.1 -39.9 -5.1 -24.5 40.1 121 20 B Q H X S+ 0 0 111 -4,-2.4 4,-1.5 -5,-0.2 -2,-0.2 0.914 112.9 48.8 -67.4 -40.0 -4.1 -25.1 43.7 122 21 B X H X S+ 0 0 6 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.910 107.8 55.9 -63.7 -43.8 -5.6 -21.8 44.8 123 22 B L H X S+ 0 0 29 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.927 109.1 43.3 -54.3 -53.5 -8.8 -22.5 42.9 124 23 B V H X S+ 0 0 66 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.833 112.3 54.6 -66.9 -32.9 -9.6 -25.8 44.7 125 24 B L H <>S+ 0 0 36 -4,-1.5 5,-2.5 -5,-0.2 4,-0.3 0.901 111.3 45.5 -61.7 -42.8 -8.6 -24.3 48.0 126 25 B A H ><5S+ 0 0 3 -4,-2.3 3,-0.8 3,-0.2 -2,-0.2 0.869 108.4 57.9 -66.6 -37.5 -11.1 -21.5 47.3 127 26 B T H 3<5S+ 0 0 92 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.826 112.7 37.8 -67.0 -34.0 -13.7 -24.1 46.2 128 27 B E T 3<5S- 0 0 155 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.354 118.1-113.1-101.7 7.0 -13.7 -25.9 49.5 129 28 B G T < 5 + 0 0 34 -3,-0.8 2,-0.2 -4,-0.3 -3,-0.2 0.946 63.1 146.6 68.3 55.6 -13.3 -22.7 51.4 130 29 B N > < + 0 0 78 -5,-2.5 3,-0.5 1,-0.1 4,-0.4 -0.498 10.5 165.6-112.8 62.2 -9.8 -22.7 53.0 131 30 B W T 3> + 0 0 36 1,-0.2 4,-0.7 -2,-0.2 -1,-0.1 0.547 67.3 69.9 -61.7 -5.8 -9.2 -19.0 52.8 132 31 B D H >> S+ 0 0 109 1,-0.2 3,-1.0 2,-0.2 4,-0.7 0.987 95.9 45.4 -67.7 -66.4 -6.3 -19.6 55.1 133 32 B A H <> S+ 0 0 36 -3,-0.5 4,-1.1 1,-0.2 -1,-0.2 0.482 105.5 74.2 -60.2 2.9 -3.9 -21.5 52.9 134 33 B L H 3> S+ 0 0 7 -4,-0.4 4,-1.3 2,-0.2 -1,-0.2 0.902 82.6 53.9 -90.3 -46.9 -4.7 -18.9 50.3 135 34 B V H X S+ 0 0 115 -4,-0.7 4,-1.1 1,-0.2 3,-0.8 0.982 106.6 46.9 -70.5 -57.6 0.3 -17.7 51.3 137 36 B L H 3X S+ 0 0 45 -4,-1.1 4,-1.6 1,-0.2 -1,-0.2 0.762 104.6 69.0 -52.0 -24.1 0.1 -19.1 47.9 138 37 B E H 3X S+ 0 0 26 -4,-1.3 4,-2.7 1,-0.2 5,-0.3 0.925 94.6 49.0 -69.6 -44.5 -0.8 -15.7 46.7 139 38 B X H X S+ 0 0 8 -4,-1.7 4,-0.8 -3,-0.4 3,-0.7 0.824 109.5 56.1 -79.1 -34.9 7.1 -14.0 33.5 149 48 B A H 3X S+ 0 0 21 -4,-2.6 4,-1.6 1,-0.2 3,-0.3 0.865 100.7 60.7 -63.9 -34.4 6.1 -10.4 32.9 150 49 B N H 3X S+ 0 0 40 -4,-2.1 4,-2.9 -5,-0.2 -1,-0.2 0.745 89.4 71.4 -65.6 -20.9 9.8 -9.6 33.0 151 50 B I H <> S+ 0 0 37 -3,-0.7 4,-1.2 -4,-0.4 -1,-0.2 0.982 104.2 39.6 -55.8 -53.2 10.4 -11.9 30.1 152 51 B T H < S+ 0 0 12 -4,-0.8 3,-0.2 -3,-0.3 4,-0.2 0.897 116.6 50.1 -63.8 -42.9 8.7 -9.4 27.9 153 52 B I H >< S+ 0 0 0 -4,-1.6 3,-1.9 1,-0.2 -1,-0.2 0.951 107.5 52.2 -61.6 -50.1 10.3 -6.3 29.5 154 53 B S H 3< S+ 0 0 58 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.751 104.7 56.0 -62.8 -26.3 13.9 -7.6 29.4 155 54 B S T 3< S+ 0 0 41 -4,-1.2 2,-0.4 -3,-0.2 44,-0.3 0.425 82.7 111.7 -86.8 2.1 13.7 -8.4 25.7 156 55 B C < - 0 0 13 -3,-1.9 6,-0.2 -4,-0.2 -3,-0.0 -0.639 63.7-145.7 -81.8 128.4 12.8 -4.8 25.0 157 56 B S S S+ 0 0 80 -2,-0.4 2,-0.6 4,-0.1 -1,-0.1 0.848 78.7 80.5 -63.6 -38.6 15.5 -2.8 23.1 158 57 B S > - 0 0 29 1,-0.2 4,-1.8 2,-0.1 -2,-0.1 -0.608 60.1-166.7 -74.8 116.5 14.8 0.6 24.8 159 58 B L H > S+ 0 0 123 -2,-0.6 4,-1.5 2,-0.2 -1,-0.2 0.775 88.5 58.1 -71.7 -28.3 16.4 0.6 28.2 160 59 B X H > S+ 0 0 133 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.868 108.8 47.4 -66.5 -36.6 14.5 3.7 29.3 161 60 B L H > S+ 0 0 6 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.894 104.3 59.3 -73.5 -40.7 11.4 1.7 28.6 162 61 B Q H X S+ 0 0 26 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.882 108.7 46.4 -53.0 -41.5 12.6 -1.3 30.5 163 62 B D H X S+ 0 0 92 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.901 111.6 48.8 -71.6 -44.5 12.9 0.8 33.6 164 63 B L H X S+ 0 0 48 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.957 113.2 48.2 -57.8 -50.4 9.5 2.5 33.3 165 64 B L H X S+ 0 0 0 -4,-2.9 4,-3.6 1,-0.2 -2,-0.2 0.902 109.9 51.4 -60.5 -44.2 7.9 -0.9 32.8 166 65 B R H X S+ 0 0 79 -4,-2.1 4,-2.9 -5,-0.3 -1,-0.2 0.901 111.2 48.8 -58.1 -42.7 9.6 -2.4 35.8 167 66 B E H X S+ 0 0 129 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.925 115.1 44.5 -60.6 -46.1 8.5 0.5 37.9 168 67 B K H X S+ 0 0 43 -4,-2.9 4,-3.1 2,-0.2 -2,-0.2 0.895 112.7 51.8 -67.4 -38.5 4.9 0.1 36.5 169 68 B L H X S+ 0 0 8 -4,-3.6 4,-2.3 2,-0.2 -2,-0.2 0.947 112.3 45.3 -61.4 -48.3 5.2 -3.7 37.0 170 69 B R H X S+ 0 0 169 -4,-2.9 4,-1.4 2,-0.2 -2,-0.2 0.899 113.7 50.0 -62.6 -40.2 6.3 -3.3 40.6 171 70 B A H X S+ 0 0 30 -4,-2.4 4,-2.1 1,-0.2 3,-0.3 0.933 109.9 50.7 -67.6 -43.3 3.6 -0.7 41.2 172 71 B I H X S+ 0 0 10 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.924 109.8 49.7 -56.1 -46.2 0.9 -2.9 39.7 173 72 B L H X S+ 0 0 12 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.782 111.0 49.2 -67.1 -27.7 1.9 -5.9 41.9 174 73 B D H X S+ 0 0 78 -4,-1.4 4,-3.2 -3,-0.3 -1,-0.2 0.834 109.1 51.4 -83.6 -33.0 1.9 -3.8 45.1 175 74 B N H X S+ 0 0 26 -4,-2.1 4,-3.5 2,-0.2 -2,-0.2 0.911 110.8 49.9 -64.7 -41.6 -1.5 -2.4 44.3 176 75 B E H X S+ 0 0 14 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.913 113.8 45.3 -62.5 -43.6 -2.8 -5.9 43.8 177 76 B I H X S+ 0 0 52 -4,-1.8 4,-4.1 2,-0.2 5,-0.3 0.963 115.5 46.1 -62.4 -53.5 -1.2 -7.0 47.1 178 77 B E H X S+ 0 0 61 -4,-3.2 4,-2.6 2,-0.2 -2,-0.2 0.915 111.6 52.4 -56.1 -46.1 -2.6 -3.9 48.9 179 78 B I H < S+ 0 0 5 -4,-3.5 -1,-0.2 2,-0.2 -2,-0.2 0.939 116.1 40.5 -53.8 -46.8 -6.0 -4.5 47.3 180 79 B K H >X S+ 0 0 29 -4,-2.2 4,-2.3 2,-0.2 3,-1.6 0.905 113.0 52.4 -72.8 -42.6 -6.0 -8.1 48.5 181 80 B R H 3X S+ 0 0 138 -4,-4.1 4,-1.5 1,-0.3 -1,-0.2 0.886 109.2 53.2 -56.1 -36.9 -4.5 -7.2 51.9 182 81 B L H 3X S+ 0 0 24 -4,-2.6 4,-0.7 -5,-0.3 -1,-0.3 0.567 110.5 48.2 -74.2 -7.7 -7.3 -4.7 52.2 183 82 B L H <> S+ 0 0 34 -3,-1.6 4,-3.0 2,-0.2 -2,-0.2 0.783 104.2 52.8-107.7 -36.3 -9.8 -7.4 51.4 184 83 B Q H X S+ 0 0 37 -4,-2.3 4,-3.4 2,-0.2 5,-0.4 0.930 108.9 57.8 -57.7 -44.3 -8.7 -10.2 53.8 185 84 B L H X S+ 0 0 71 -4,-1.5 4,-2.1 -5,-0.3 -2,-0.2 0.922 111.8 37.5 -51.3 -51.0 -9.1 -7.4 56.3 186 85 B R H X S+ 0 0 49 -4,-0.7 4,-1.5 2,-0.2 -1,-0.2 0.873 116.8 51.4 -73.5 -37.2 -12.7 -6.8 55.4 187 86 B L H X S+ 0 0 1 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.900 114.9 42.9 -65.0 -41.8 -13.5 -10.5 54.9 188 87 B D H X S+ 0 0 77 -4,-3.4 4,-0.6 1,-0.2 -2,-0.2 0.887 107.9 60.0 -72.7 -38.6 -12.1 -11.4 58.2 189 88 B R H X S+ 0 0 142 -4,-2.1 4,-1.2 -5,-0.4 -1,-0.2 0.836 111.3 42.4 -56.6 -34.9 -13.7 -8.4 59.9 190 89 B L H X S+ 0 0 31 -4,-1.5 4,-1.2 2,-0.2 -2,-0.2 0.976 107.6 54.0 -74.5 -60.9 -17.1 -9.8 58.8 191 90 B S H < S+ 0 0 25 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.461 111.3 51.8 -61.7 2.1 -16.7 -13.6 59.6 192 91 B D H < S+ 0 0 126 -4,-0.6 -1,-0.2 -3,-0.2 -2,-0.2 0.844 96.5 60.1 -97.3 -58.2 -15.8 -12.6 63.1 193 92 B L H < S+ 0 0 126 -4,-1.2 -2,-0.2 -5,-0.2 -3,-0.1 0.803 108.9 52.1 -36.1 -39.2 -18.6 -10.2 64.2 194 93 B V < 0 0 59 -4,-1.2 -2,-0.1 1,-0.2 -1,-0.1 0.973 360.0 360.0 -67.4 -91.2 -20.9 -13.2 63.6 195 94 B G 0 0 103 -4,-0.4 -1,-0.2 0, 0.0 -2,-0.1 -0.975 360.0 360.0-136.7 360.0 -19.8 -16.4 65.4 196 !* 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 0.0 197 -2 C S >> 0 0 103 0, 0.0 4,-2.4 0, 0.0 3,-0.9 0.000 360.0 360.0 360.0-115.7 18.4 -9.9 23.0 198 -1 C N H 3> + 0 0 45 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.745 360.0 56.8 -53.1 -32.2 15.4 -10.7 20.7 199 0 C A H 3> S+ 0 0 26 -44,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.921 112.0 41.4 -65.8 -44.6 16.3 -8.0 18.1 200 1 C X H <> S+ 0 0 108 -3,-0.9 4,-2.8 2,-0.2 5,-0.2 0.946 117.7 49.1 -61.3 -47.1 19.8 -9.5 17.5 201 2 C E H X S+ 0 0 30 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.829 111.9 48.8 -61.4 -35.3 18.2 -12.9 17.6 202 3 C R H X S+ 0 0 85 -4,-2.7 4,-2.1 -5,-0.3 -1,-0.2 0.854 111.9 48.0 -75.2 -37.0 15.5 -11.8 15.2 203 4 C H H X S+ 0 0 40 -4,-2.0 4,-2.1 2,-0.2 5,-0.3 0.911 111.0 50.5 -69.5 -45.9 18.0 -10.3 12.7 204 5 C Q H X S+ 0 0 117 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.919 114.2 45.6 -55.9 -43.2 20.2 -13.4 12.8 205 6 C H H X S+ 0 0 77 -4,-1.6 4,-2.4 -5,-0.2 -2,-0.2 0.873 110.9 49.8 -75.4 -36.6 17.2 -15.6 12.1 206 7 C L H X S+ 0 0 10 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.917 113.8 46.5 -67.4 -42.4 15.7 -13.6 9.3 207 8 C L H X S+ 0 0 41 -4,-2.1 4,-2.7 1,-0.2 3,-0.2 0.949 111.3 52.5 -61.4 -50.8 19.0 -13.4 7.5 208 9 C S H X S+ 0 0 45 -4,-2.3 4,-2.5 -5,-0.3 -2,-0.2 0.916 108.3 50.9 -48.7 -48.9 19.5 -17.1 8.1 209 10 C E H X S+ 0 0 11 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.849 111.6 46.6 -64.5 -35.7 16.1 -17.9 6.6 210 11 C Y H X S+ 0 0 9 -4,-1.8 4,-2.7 -3,-0.2 5,-0.3 0.867 110.4 52.5 -73.9 -38.5 16.8 -15.8 3.4 211 12 C Q H X S+ 0 0 83 -4,-2.7 4,-3.1 2,-0.2 -2,-0.2 0.939 109.4 51.3 -59.1 -45.0 20.2 -17.3 3.0 212 13 C Q H X S+ 0 0 79 -4,-2.5 4,-2.6 -5,-0.2 5,-0.2 0.944 113.6 42.5 -57.2 -55.3 18.6 -20.8 3.2 213 14 C I H X S+ 0 0 9 -4,-2.0 4,-3.9 2,-0.2 5,-0.2 0.959 116.5 47.2 -56.3 -55.0 16.0 -20.0 0.5 214 15 C L H X S+ 0 0 13 -4,-2.7 4,-3.1 1,-0.2 5,-0.2 0.899 111.6 52.2 -57.0 -40.5 18.4 -18.2 -1.8 215 16 C T H X S+ 0 0 62 -4,-3.1 4,-2.9 -5,-0.3 -1,-0.2 0.939 114.6 41.1 -61.9 -45.7 20.9 -21.1 -1.4 216 17 C L H X S+ 0 0 17 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.906 113.7 55.2 -65.2 -43.1 18.3 -23.6 -2.3 217 18 C S H X S+ 0 0 1 -4,-3.9 4,-1.2 -5,-0.2 -2,-0.2 0.912 112.5 42.1 -52.0 -47.9 17.1 -21.2 -5.0 218 19 C E H X S+ 0 0 95 -4,-3.1 4,-1.3 2,-0.2 3,-0.2 0.906 111.9 53.1 -71.5 -43.9 20.6 -21.1 -6.4 219 20 C Q H X S+ 0 0 97 -4,-2.9 4,-1.3 -5,-0.2 3,-0.2 0.917 111.7 48.5 -53.5 -42.1 21.2 -24.8 -6.1 220 21 C X H X S+ 0 0 1 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.749 103.9 57.7 -74.6 -27.4 18.0 -25.4 -8.0 221 22 C L H X S+ 0 0 32 -4,-1.2 4,-3.0 -3,-0.2 -1,-0.2 0.819 106.0 49.6 -75.7 -30.3 18.7 -23.0 -10.9 222 23 C V H X S+ 0 0 78 -4,-1.3 4,-2.1 -3,-0.2 6,-0.3 0.870 110.2 50.6 -73.8 -38.0 21.9 -24.8 -11.9 223 24 C L H <>S+ 0 0 38 -4,-1.3 5,-1.7 2,-0.2 -2,-0.2 0.874 115.4 43.8 -62.5 -40.1 20.1 -28.1 -11.8 224 25 C A H ><5S+ 0 0 3 -4,-1.8 3,-2.2 3,-0.2 -2,-0.2 0.960 113.6 48.9 -67.5 -55.0 17.5 -26.6 -14.1 225 26 C T H 3<5S+ 0 0 81 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.830 115.0 47.1 -50.0 -36.3 20.0 -24.8 -16.3 226 27 C E T 3<5S- 0 0 144 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.316 111.9-122.8 -93.8 8.1 21.8 -28.1 -16.5 227 28 C G T < 5 + 0 0 35 -3,-2.2 2,-2.2 1,-0.2 3,-0.2 0.540 66.7 138.6 67.1 5.3 18.6 -30.1 -17.2 228 29 C N >< + 0 0 85 -5,-1.7 4,-1.2 -6,-0.3 3,-0.2 -0.485 22.7 161.6 -79.6 71.4 19.1 -32.4 -14.2 229 30 C W H >> + 0 0 45 -2,-2.2 4,-2.4 1,-0.2 3,-0.8 0.916 61.7 54.6 -63.6 -52.8 15.4 -32.2 -13.4 230 31 C D H 3> S+ 0 0 109 1,-0.3 4,-0.7 -3,-0.2 -1,-0.2 0.838 109.9 51.2 -55.4 -31.6 14.8 -35.2 -11.2 231 32 C A H 3> S+ 0 0 24 -3,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.828 108.6 52.0 -71.9 -32.2 17.5 -33.8 -9.0 232 33 C L H X S+ 0 0 110 -4,-0.7 3,-0.7 -5,-0.2 4,-0.5 0.919 101.8 45.8 -71.0 -45.1 14.3 -33.2 -4.8 235 36 C L H >X S+ 0 0 31 -4,-0.9 4,-3.1 -3,-0.4 3,-0.6 0.744 92.0 84.1 -66.6 -24.2 15.2 -29.8 -3.3 236 37 C E H 3X S+ 0 0 20 -4,-1.0 4,-2.2 1,-0.3 -1,-0.2 0.819 89.5 49.1 -58.0 -33.4 11.7 -28.4 -4.0 237 38 C X H <> S+ 0 0 97 -3,-0.7 4,-0.9 -4,-0.5 -1,-0.3 0.875 114.5 45.4 -74.5 -35.3 10.3 -29.9 -0.7 238 39 C T H X S+ 0 0 13 -4,-2.3 3,-0.9 1,-0.2 4,-0.8 0.899 110.4 51.2 -67.4 -42.3 10.3 -17.4 6.6 247 48 C A H >X S+ 0 0 15 -4,-2.4 4,-1.7 1,-0.3 3,-1.1 0.921 100.4 63.0 -62.4 -44.8 6.6 -16.7 6.1 248 49 C N H 3X S+ 0 0 45 -4,-2.7 4,-1.9 1,-0.3 -1,-0.3 0.722 93.7 65.0 -52.6 -24.4 5.9 -17.7 9.7 249 50 C I H < S+ 0 0 0 -4,-1.7 3,-1.0 1,-0.2 -1,-0.2 0.843 109.6 50.8 -62.1 -35.1 2.7 -14.1 10.8 252 53 C S H 3< S+ 0 0 19 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.728 100.5 62.4 -77.0 -23.6 4.4 -14.2 14.2 253 54 C S T 3< S+ 0 0 48 -4,-1.2 2,-0.5 -3,-0.4 -1,-0.3 0.190 85.5 97.2 -87.5 16.8 5.0 -10.4 14.0 254 55 C C < - 0 0 3 -3,-1.0 6,-0.1 -198,-0.3 -3,-0.0 -0.947 65.3-156.0-106.2 122.1 1.3 -10.1 13.9 255 56 C S S S+ 0 0 60 -2,-0.5 2,-0.9 40,-0.1 -199,-0.1 0.582 71.8 88.3 -76.5 -13.2 -0.2 -9.3 17.4 256 57 C S > - 0 0 32 1,-0.2 4,-2.4 -200,-0.1 5,-0.2 -0.797 58.2-168.8 -90.7 104.7 -3.7 -10.7 16.7 257 58 C L H > S+ 0 0 16 -2,-0.9 4,-1.5 1,-0.3 -1,-0.2 0.759 89.1 54.3 -68.7 -26.3 -3.5 -14.4 17.6 258 59 C X H > S+ 0 0 143 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.898 109.4 47.8 -69.2 -39.9 -6.8 -15.0 15.9 259 60 C L H > S+ 0 0 11 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.867 107.2 56.7 -68.1 -36.0 -5.4 -13.4 12.8 260 61 C Q H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.897 104.7 53.3 -58.6 -39.6 -2.3 -15.6 13.1 261 62 C D H X S+ 0 0 66 -4,-1.5 4,-1.4 1,-0.2 -2,-0.2 0.924 110.0 46.9 -63.1 -42.8 -4.6 -18.6 13.1 262 63 C L H X S+ 0 0 56 -4,-1.8 4,-1.8 1,-0.2 3,-0.2 0.943 113.2 47.0 -62.7 -48.7 -6.2 -17.4 9.8 263 64 C L H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.827 107.8 56.1 -67.7 -34.8 -2.9 -16.7 8.1 264 65 C R H X S+ 0 0 33 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.875 108.2 49.2 -61.1 -36.2 -1.4 -20.0 9.2 265 66 C E H X S+ 0 0 141 -4,-1.4 4,-1.6 -3,-0.2 -2,-0.2 0.865 113.6 44.8 -73.1 -36.2 -4.3 -21.8 7.5 266 67 C K H X S+ 0 0 43 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.819 110.8 56.2 -73.5 -31.2 -3.9 -19.8 4.3 267 68 C L H X S+ 0 0 9 -4,-2.3 4,-2.3 -5,-0.2 5,-0.2 0.974 109.1 45.2 -63.1 -51.0 -0.2 -20.4 4.5 268 69 C R H X S+ 0 0 134 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.877 113.8 50.2 -58.8 -38.3 -0.7 -24.1 4.6 269 70 C A H X S+ 0 0 30 -4,-1.6 4,-3.0 2,-0.2 5,-0.2 0.936 108.8 51.7 -67.5 -45.4 -3.2 -24.0 1.8 270 71 C I H X S+ 0 0 11 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.935 113.1 44.1 -55.8 -49.2 -0.9 -21.9 -0.4 271 72 C L H X S+ 0 0 17 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.969 111.2 54.0 -63.9 -53.0 1.9 -24.3 0.0 272 73 C D H X S+ 0 0 80 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.917 109.8 47.3 -41.2 -55.8 -0.3 -27.3 -0.5 273 74 C N H X S+ 0 0 23 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.905 110.8 53.5 -58.5 -40.3 -1.6 -25.9 -3.8 274 75 C E H X S+ 0 0 12 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.944 110.2 45.9 -56.1 -52.7 2.1 -25.2 -4.7 275 76 C I H X S+ 0 0 62 -4,-3.0 4,-1.4 1,-0.2 -2,-0.2 0.917 112.5 52.3 -57.8 -43.7 3.0 -28.8 -4.1 276 77 C E H X S+ 0 0 67 -4,-2.8 4,-2.1 -5,-0.3 -1,-0.2 0.873 110.7 46.4 -64.5 -38.0 -0.0 -30.0 -6.0 277 78 C I H X S+ 0 0 16 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.883 108.3 54.5 -70.8 -39.3 0.8 -27.9 -9.1 278 79 C K H X S+ 0 0 37 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.808 113.6 44.2 -65.1 -26.3 4.5 -28.9 -9.1 279 80 C R H X S+ 0 0 107 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.833 104.2 59.9 -86.0 -40.0 3.3 -32.5 -9.2 280 81 C L H X S+ 0 0 25 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.862 112.1 46.5 -47.7 -38.2 0.6 -32.0 -11.8 281 82 C L H X S+ 0 0 34 -4,-1.6 4,-3.0 2,-0.2 5,-0.3 0.967 101.8 56.3 -74.9 -57.8 3.5 -30.9 -13.8 282 83 C Q H X S+ 0 0 81 -4,-1.9 4,-1.0 1,-0.2 -2,-0.2 0.912 111.8 51.9 -39.7 -43.3 6.1 -33.6 -13.2 283 84 C L H >X S+ 0 0 90 -4,-2.2 4,-3.3 1,-0.2 3,-1.5 0.960 108.6 44.8 -61.0 -55.8 3.2 -35.8 -14.5 284 85 C R H 3X S+ 0 0 44 -4,-1.8 4,-0.5 1,-0.3 -1,-0.2 0.794 109.4 59.7 -60.2 -25.5 2.5 -33.8 -17.7 285 86 C L H 3X S+ 0 0 16 -4,-3.0 4,-2.0 2,-0.2 -1,-0.3 0.756 113.5 36.7 -72.6 -23.5 6.3 -33.8 -18.2 286 87 C D H S+ 0 0 62 -3,-1.5 4,-1.9 -4,-1.0 5,-0.7 0.835 104.4 64.5 -96.6 -40.8 6.2 -37.6 -18.2 287 88 C R H <5S+ 0 0 136 -4,-3.3 -2,-0.2 1,-0.2 -3,-0.2 0.739 120.1 32.7 -49.4 -22.0 3.0 -38.1 -20.0 288 89 C L H <5S+ 0 0 18 -4,-0.5 -2,-0.3 -5,-0.3 -1,-0.2 0.809 114.2 60.2 -98.3 -50.3 5.2 -36.4 -22.6 289 90 C S H <5S+ 0 0 69 -4,-2.0 -3,-0.2 1,-0.2 -2,-0.2 0.917 117.9 27.0 -41.8 -69.3 8.5 -37.9 -21.5 290 91 C D T <5 0 0 148 -4,-1.9 -1,-0.2 0, 0.0 -3,-0.2 0.983 360.0 360.0 -61.4 -58.7 7.6 -41.6 -22.1 291 92 C L < 0 0 131 -5,-0.7 -3,-0.2 -4,-0.1 -4,-0.1 0.778 360.0 360.0 -79.0 360.0 5.0 -40.9 -24.8 292 !* 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 0.0 293 -2 D S > 0 0 113 0, 0.0 4,-1.3 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 5.0 -5.0 1.9 14.5 294 -1 D N H > + 0 0 79 2,-0.2 4,-2.8 3,-0.1 5,-0.2 0.690 360.0 62.2 -72.3 -23.8 -2.0 1.6 12.3 295 0 D A H > S+ 0 0 35 2,-0.2 4,-1.5 1,-0.2 -1,-0.1 0.932 102.8 44.0 -63.2 -47.1 -2.4 -1.8 14.1 296 1 D X H > S+ 0 0 108 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.875 117.0 46.1 -64.5 -38.9 -5.8 -2.3 12.5 297 2 D E H X S+ 0 0 99 -4,-1.3 4,-2.9 2,-0.2 -2,-0.2 0.873 108.0 56.2 -69.4 -39.0 -4.6 -1.2 9.1 298 3 D R H X S+ 0 0 64 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.845 108.6 49.9 -63.2 -34.8 -1.4 -3.4 9.5 299 4 D H H X S+ 0 0 33 -4,-1.5 4,-2.3 -5,-0.2 -1,-0.2 0.830 110.0 48.3 -71.5 -34.8 -3.7 -6.3 10.0 300 5 D Q H X S+ 0 0 108 -4,-1.3 4,-3.5 2,-0.2 5,-0.2 0.943 111.8 50.1 -73.2 -44.2 -5.9 -5.5 6.9 301 6 D H H X S+ 0 0 91 -4,-2.9 4,-2.9 2,-0.2 -2,-0.2 0.959 113.5 45.2 -52.8 -55.2 -2.9 -5.1 4.7 302 7 D L H X S+ 0 0 9 -4,-2.0 4,-2.0 2,-0.2 5,-0.2 0.937 116.4 44.4 -60.6 -50.7 -1.4 -8.4 5.9 303 8 D L H X S+ 0 0 42 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.941 113.4 52.6 -55.9 -46.5 -4.6 -10.3 5.6 304 9 D S H X S+ 0 0 38 -4,-3.5 4,-2.2 -5,-0.2 -2,-0.2 0.913 106.1 54.4 -57.2 -42.0 -5.2 -8.7 2.3 305 10 D E H X S+ 0 0 6 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.907 112.5 41.5 -61.4 -43.2 -1.8 -9.8 1.1 306 11 D Y H X S+ 0 0 10 -4,-2.0 4,-3.0 2,-0.2 5,-0.3 0.852 110.4 57.3 -73.8 -36.2 -2.4 -13.4 1.9 307 12 D Q H X S+ 0 0 80 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.918 107.4 49.2 -57.5 -41.5 -6.0 -13.3 0.5 308 13 D Q H X S+ 0 0 91 -4,-2.2 4,-1.4 -5,-0.2 -1,-0.2 0.824 114.0 45.8 -69.4 -31.9 -4.5 -12.2 -2.8 309 14 D I H X S+ 0 0 9 -4,-1.1 4,-2.8 2,-0.2 -2,-0.2 0.897 111.6 48.6 -79.9 -43.3 -2.0 -14.9 -2.8 310 15 D L H X S+ 0 0 14 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.860 111.0 54.9 -61.7 -34.5 -4.3 -17.8 -1.8 311 16 D T H X S+ 0 0 67 -4,-1.8 4,-2.1 -5,-0.3 -1,-0.2 0.915 109.8 43.1 -65.3 -43.7 -6.6 -16.5 -4.5 312 17 D L H X S+ 0 0 27 -4,-1.4 4,-2.1 2,-0.2 5,-0.2 0.894 112.4 55.8 -69.6 -39.9 -3.9 -16.7 -7.2 313 18 D S H X S+ 0 0 2 -4,-2.8 4,-3.3 2,-0.2 -2,-0.2 0.942 108.7 47.1 -50.1 -53.4 -2.9 -20.1 -5.8 314 19 D E H X S+ 0 0 91 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.913 112.0 47.3 -62.9 -47.6 -6.5 -21.4 -6.2 315 20 D Q H X S+ 0 0 109 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.868 115.4 48.0 -62.0 -36.6 -7.1 -20.1 -9.7 316 21 D X H X S+ 0 0 3 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.940 106.5 56.6 -67.4 -48.9 -3.7 -21.6 -10.7 317 22 D L H X S+ 0 0 35 -4,-3.3 4,-2.2 1,-0.2 -2,-0.2 0.895 113.4 40.4 -48.5 -43.6 -4.4 -24.9 -9.0 318 23 D V H X S+ 0 0 53 -4,-1.9 4,-1.8 2,-0.2 6,-0.2 0.872 110.9 54.8 -80.0 -36.7 -7.6 -25.3 -11.2 319 24 D L H <>S+ 0 0 41 -4,-2.1 5,-2.6 2,-0.2 -2,-0.2 0.932 116.1 41.2 -56.3 -44.4 -6.0 -24.0 -14.4 320 25 D A H ><5S+ 0 0 2 -4,-2.8 3,-1.4 3,-0.2 -2,-0.2 0.875 106.6 62.5 -70.0 -41.3 -3.4 -26.7 -13.9 321 26 D T H 3<5S+ 0 0 91 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.854 110.1 41.2 -48.9 -38.0 -6.0 -29.2 -12.8 322 27 D E T 3<5S- 0 0 158 -4,-1.8 -1,-0.3 -3,-0.1 -2,-0.2 0.454 119.1-115.5 -93.5 -1.1 -7.5 -28.9 -16.2 323 28 D G T < 5 + 0 0 24 -3,-1.4 2,-2.2 1,-0.2 -3,-0.2 0.598 65.0 146.8 81.6 11.7 -4.0 -28.8 -17.8 324 29 D N < + 0 0 78 -5,-2.6 4,-0.5 -6,-0.2 3,-0.4 -0.475 13.3 168.2 -78.5 71.9 -4.2 -25.3 -19.2 325 30 D W + 0 0 10 -2,-2.2 4,-0.4 1,-0.2 -1,-0.2 0.411 69.3 64.4 -69.1 7.2 -0.5 -24.7 -18.6 326 31 D D S >> S+ 0 0 121 2,-0.2 3,-0.9 -7,-0.1 4,-0.6 0.874 94.4 48.9 -96.3 -51.0 -1.1 -21.5 -20.7 327 32 D A H 3> S+ 0 0 42 -3,-0.4 4,-0.9 1,-0.2 -2,-0.2 0.557 108.2 68.8 -63.9 -2.8 -3.4 -19.4 -18.7 328 33 D L H 3> S+ 0 0 14 -4,-0.5 4,-1.3 2,-0.2 -1,-0.2 0.824 82.6 61.1 -88.4 -39.1 -0.9 -20.2 -16.0 329 34 D V H <> S+ 0 0 73 -3,-0.9 4,-0.7 -4,-0.4 -1,-0.2 0.733 107.0 48.4 -70.8 -19.5 2.3 -18.4 -17.1 330 35 D D H >X S+ 0 0 123 -4,-0.6 4,-1.1 2,-0.2 3,-0.6 0.893 107.4 52.4 -84.5 -42.7 0.5 -15.0 -16.8 331 36 D L H 3X S+ 0 0 41 -4,-0.9 4,-2.1 1,-0.2 -2,-0.2 0.784 100.9 70.5 -55.4 -27.1 -1.0 -15.7 -13.4 332 37 D E H 3X S+ 0 0 28 -4,-1.3 4,-2.8 1,-0.2 5,-0.2 0.914 94.5 47.6 -60.1 -48.4 2.6 -16.5 -12.4 333 38 D X H X S+ 0 0 8 -4,-2.0 3,-1.1 2,-0.2 4,-0.7 0.889 110.2 52.9 -77.0 -41.4 4.1 -9.7 1.3 343 48 D A H >X S+ 0 0 18 -4,-2.6 4,-1.5 1,-0.3 3,-0.6 0.877 101.7 61.9 -60.5 -35.5 7.7 -10.6 1.9 344 49 D N H 3X S+ 0 0 44 -4,-1.8 4,-2.6 1,-0.2 5,-0.3 0.744 87.8 73.4 -64.2 -22.7 8.5 -6.8 1.9 345 50 D I H <> S+ 0 0 44 -3,-1.1 4,-0.9 -4,-0.4 -1,-0.2 0.954 104.4 36.9 -53.8 -52.1 6.1 -6.4 4.9 346 51 D T H << S+ 0 0 17 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.865 117.3 51.2 -72.5 -38.3 8.7 -8.0 7.2 347 52 D I H >< S+ 0 0 0 -4,-1.5 3,-2.8 1,-0.2 -2,-0.2 0.991 109.8 47.0 -64.1 -57.7 11.8 -6.6 5.5 348 53 D S H 3< S+ 0 0 72 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.755 107.5 60.8 -57.2 -21.3 10.7 -3.0 5.5 349 54 D S T 3< S+ 0 0 34 -4,-0.9 2,-0.3 -5,-0.3 -346,-0.3 0.445 82.2 108.7 -84.5 -1.5 9.7 -3.5 9.2 350 55 D C < - 0 0 13 -3,-2.8 6,-0.1 -4,-0.2 -348,-0.1 -0.639 63.2-147.9 -85.2 134.5 13.2 -4.3 10.1 351 56 D S S S+ 0 0 78 -2,-0.3 2,-0.4 4,-0.1 -1,-0.1 0.732 72.7 92.4 -75.3 -23.8 15.2 -1.8 12.2 352 57 D S > - 0 0 26 1,-0.2 4,-1.7 2,-0.1 -2,-0.1 -0.579 58.0-163.0 -76.0 125.4 18.6 -2.6 10.6 353 58 D L H > S+ 0 0 134 -2,-0.4 4,-1.3 2,-0.2 -1,-0.2 0.955 88.8 46.1 -73.9 -51.4 19.4 -0.4 7.7 354 59 D X H > S+ 0 0 136 1,-0.2 4,-2.0 2,-0.2 3,-0.4 0.929 112.7 53.3 -53.9 -46.1 22.2 -2.5 6.2 355 60 D L H > S+ 0 0 8 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.900 100.4 57.3 -63.6 -45.9 20.1 -5.6 6.6 356 61 D Q H X S+ 0 0 31 -4,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.855 108.6 50.4 -48.6 -42.2 17.0 -4.3 4.7 357 62 D D H >X S+ 0 0 76 -4,-1.3 4,-2.2 -3,-0.4 3,-0.5 0.988 108.5 50.1 -56.5 -62.5 19.3 -3.7 1.7 358 63 D L H 3X S+ 0 0 50 -4,-2.0 4,-2.2 1,-0.3 -2,-0.2 0.814 112.0 47.2 -50.1 -39.3 20.7 -7.2 1.8 359 64 D L H 3X S+ 0 0 0 -4,-2.2 4,-3.6 2,-0.2 -1,-0.3 0.838 107.9 53.4 -79.1 -33.6 17.4 -8.9 2.0 360 65 D R H < S+ 0 0 42 -4,-3.0 3,-0.7 -5,-0.3 -2,-0.2 0.956 103.6 50.7 -47.4 -67.2 5.1 -31.1 -26.2 386 91 D D H 3< S+ 0 0 131 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.881 109.9 53.5 -34.7 -52.4 6.1 -30.3 -29.8 387 92 D L H 3< 0 0 122 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.849 360.0 360.0 -63.2 -42.1 7.5 -33.8 -30.2 388 93 D V << 0 0 101 -4,-1.9 -3,-0.1 -3,-0.7 -2,-0.1 0.864 360.0 360.0 -75.9 360.0 4.4 -35.7 -29.2