==== 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 METAL BINDING PROTEIN 31-MAY-09 3HNJ . COMPND 2 MOLECULE: SOLUBLE CYTOCHROME B562; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR E.N.SALGADO,R.A.LEWIS,J.BRODIN,F.A.TEZCAN . 424 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20705.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 344 81.1 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 . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 284 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 0 0 0 0 0 0 4 4 0 0 0 0 0 4 4 0 0 0 0 0 0 4 0 0 0 0 0 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 1 A A 0 0 89 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 157.3 1.9 7.0 4.6 2 2 A D > - 0 0 95 1,-0.1 4,-2.2 41,-0.0 5,-0.2 -0.183 360.0-106.7 -68.9 162.3 5.3 8.7 5.2 3 3 A L H > S+ 0 0 24 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.916 119.5 52.2 -55.9 -46.0 7.8 7.4 7.8 4 4 A E H > S+ 0 0 114 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.884 109.9 48.6 -59.7 -42.3 7.1 10.5 10.1 5 5 A D H > S+ 0 0 90 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.878 111.5 48.7 -67.7 -38.8 3.4 9.8 10.0 6 6 A N H X S+ 0 0 10 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.861 111.3 51.7 -66.7 -36.3 3.8 6.1 10.7 7 7 A M H X S+ 0 0 53 -4,-2.5 4,-2.7 -5,-0.2 -2,-0.2 0.875 109.5 48.5 -67.1 -39.4 6.1 7.1 13.6 8 8 A E H X S+ 0 0 110 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.868 110.7 51.6 -67.7 -36.9 3.5 9.5 15.0 9 9 A T H X S+ 0 0 54 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.893 111.6 47.3 -64.0 -41.7 0.8 6.8 14.7 10 10 A L H X S+ 0 0 16 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.946 115.8 44.6 -61.3 -52.5 3.2 4.4 16.6 11 11 A N H X S+ 0 0 74 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.924 113.9 48.7 -57.9 -50.4 3.9 7.1 19.3 12 12 A D H X S+ 0 0 90 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.895 113.3 45.9 -62.2 -43.0 0.2 8.2 19.7 13 13 A N H X S+ 0 0 17 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.840 107.3 57.0 -73.0 -33.3 -1.2 4.7 20.0 14 14 A L H X S+ 0 0 14 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.897 109.2 47.4 -60.4 -40.2 1.5 3.6 22.5 15 15 A K H X S+ 0 0 107 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.876 108.4 55.3 -69.8 -36.8 0.4 6.5 24.8 16 16 A V H X S+ 0 0 73 -4,-1.6 4,-0.6 1,-0.2 -2,-0.2 0.875 106.6 51.1 -58.6 -41.0 -3.3 5.5 24.3 17 17 A I H >< S+ 0 0 0 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.913 105.7 55.0 -65.5 -43.6 -2.5 1.9 25.5 18 18 A E H 3< S+ 0 0 75 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.838 116.5 36.7 -57.0 -37.8 -0.8 3.3 28.7 19 19 A K H 3< S+ 0 0 168 -4,-1.4 -1,-0.2 -3,-0.1 -2,-0.2 0.442 92.9 125.3 -96.4 -1.0 -3.9 5.3 29.6 20 20 A A << - 0 0 12 -3,-0.9 -3,-0.1 -4,-0.6 3,-0.1 -0.211 41.3-167.3 -67.6 147.4 -6.4 2.7 28.4 21 21 A D + 0 0 135 1,-0.1 2,-0.2 63,-0.0 -1,-0.1 0.872 65.3 29.4 -94.2 -54.4 -9.2 1.3 30.6 22 22 A N S > S- 0 0 80 1,-0.1 4,-1.4 62,-0.0 3,-0.2 -0.498 80.7-103.2-113.1 174.0 -10.5 -1.7 28.7 23 23 A A H > S+ 0 0 29 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.869 113.2 60.9 -62.6 -41.6 -9.5 -4.4 26.2 24 24 A A H > S+ 0 0 62 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.883 104.3 48.7 -55.8 -45.1 -11.2 -2.8 23.2 25 25 A Q H > S+ 0 0 74 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.929 114.8 44.9 -60.0 -48.1 -9.1 0.4 23.5 26 26 A V H X S+ 0 0 0 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.921 113.2 51.1 -62.4 -47.3 -5.8 -1.7 23.8 27 27 A K H X S+ 0 0 74 -4,-3.2 4,-2.0 1,-0.2 -2,-0.2 0.901 112.2 46.3 -55.6 -48.2 -6.9 -4.0 20.9 28 28 A D H X S+ 0 0 63 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.909 112.2 49.1 -65.2 -45.3 -7.7 -1.0 18.6 29 29 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.882 112.2 48.7 -63.9 -39.4 -4.5 0.9 19.4 30 30 A L H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.877 109.1 52.6 -67.5 -41.4 -2.3 -2.3 18.8 31 31 A T H X S+ 0 0 16 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.897 110.6 48.5 -57.2 -43.2 -4.1 -3.0 15.5 32 32 A K H X S+ 0 0 94 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.874 111.2 50.0 -67.3 -38.9 -3.3 0.6 14.4 33 33 A M H X S+ 0 0 3 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.909 107.9 53.9 -62.4 -45.6 0.3 0.2 15.5 34 34 A A H X S+ 0 0 1 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.924 109.5 47.6 -54.7 -48.2 0.5 -3.1 13.5 35 35 A A H X S+ 0 0 37 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.892 112.9 48.7 -60.7 -41.7 -0.7 -1.3 10.3 36 36 A A H X S+ 0 0 4 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.880 110.9 49.5 -66.8 -42.5 1.8 1.6 10.9 37 37 A A H X S+ 0 0 0 -4,-2.7 4,-0.5 2,-0.2 3,-0.4 0.938 113.2 47.0 -61.6 -47.4 4.8 -0.7 11.4 38 38 A A H >< S+ 0 0 4 -4,-2.3 3,-1.0 1,-0.2 4,-0.3 0.893 111.7 50.4 -62.2 -41.4 3.9 -2.7 8.3 39 39 A D H 3< S+ 0 0 58 -4,-2.2 3,-0.3 1,-0.2 -1,-0.2 0.723 108.1 54.2 -68.7 -22.8 3.5 0.5 6.2 40 40 A A H >< S+ 0 0 0 -4,-1.2 3,-2.1 -3,-0.4 -1,-0.2 0.589 82.2 99.2 -82.1 -11.6 6.9 1.8 7.5 41 41 A W T << S+ 0 0 8 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.1 0.783 85.8 35.7 -49.9 -48.7 8.6 -1.4 6.3 42 42 A S T 3 S+ 0 0 90 -3,-0.3 -1,-0.3 -4,-0.3 2,-0.2 0.126 89.1 127.7 -97.8 16.0 10.1 -0.2 3.0 43 43 A A < - 0 0 21 -3,-2.1 -3,-0.0 -41,-0.0 -41,-0.0 -0.473 52.7-141.9 -74.0 143.5 10.9 3.3 4.2 44 44 A T - 0 0 79 -2,-0.2 -41,-0.1 17,-0.0 5,-0.1 -0.954 20.2-139.0-104.8 116.1 14.4 4.8 3.7 45 45 A P > - 0 0 5 0, 0.0 3,-2.0 0, 0.0 4,-0.2 -0.417 20.7-113.3 -72.9 148.4 15.3 6.9 6.8 46 46 A P G > S+ 0 0 100 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.838 116.1 57.9 -47.5 -41.8 17.2 10.2 6.2 47 47 A K G 3 S+ 0 0 129 58,-0.5 3,-0.2 1,-0.3 59,-0.1 0.684 113.0 39.9 -65.4 -19.7 20.3 8.9 7.9 48 48 A L G X S+ 0 0 8 -3,-2.0 3,-0.9 57,-0.1 -1,-0.3 0.173 78.4 113.0-117.3 16.7 20.5 6.0 5.4 49 49 A E T < S+ 0 0 142 -3,-1.4 -1,-0.1 1,-0.2 -2,-0.1 0.805 81.6 46.6 -57.7 -34.7 19.5 7.9 2.2 50 50 A D T 3 S+ 0 0 131 -4,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.623 96.5 96.6 -84.5 -13.8 23.0 7.5 0.6 51 51 A K S < S- 0 0 80 -3,-0.9 -3,-0.1 1,-0.1 0, 0.0 -0.362 84.8 -96.9 -80.6 154.7 23.2 3.8 1.5 52 52 A S > - 0 0 74 1,-0.1 3,-2.2 -2,-0.1 6,-0.4 -0.426 29.4-122.7 -66.0 139.7 22.3 0.9 -0.8 53 53 A P T 3 S+ 0 0 85 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.723 116.1 41.8 -56.2 -22.0 18.8 -0.6 -0.4 54 54 A D T 3 S+ 0 0 80 4,-0.1 -2,-0.1 5,-0.0 298,-0.0 -0.050 88.8 128.5-116.5 29.5 20.5 -3.9 0.3 55 55 A S S <> S- 0 0 12 -3,-2.2 4,-2.2 1,-0.1 5,-0.2 -0.389 76.0-106.2 -74.1 160.0 23.3 -2.6 2.5 56 56 A P H > S+ 0 0 95 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.866 122.2 53.9 -52.3 -38.6 24.0 -4.2 5.9 57 57 A E H > S+ 0 0 71 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.900 108.6 45.8 -66.6 -43.3 22.5 -1.0 7.4 58 58 A M H > S+ 0 0 4 -6,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.850 112.5 51.3 -68.2 -37.1 19.2 -1.3 5.5 59 59 A H H X S+ 0 0 60 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.930 113.2 45.4 -63.3 -46.4 18.9 -5.0 6.3 60 60 A D H X S+ 0 0 8 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.871 111.0 54.0 -63.7 -38.6 19.4 -4.1 10.0 61 61 A F H X S+ 0 0 8 -4,-2.5 4,-0.9 1,-0.2 3,-0.4 0.953 111.4 44.3 -60.0 -50.9 16.9 -1.3 9.7 62 62 A R H >X S+ 0 0 18 -4,-2.6 4,-1.9 1,-0.2 3,-0.8 0.883 105.4 62.6 -61.6 -38.2 14.3 -3.6 8.3 63 63 A H H 3X S+ 0 0 14 -4,-2.4 4,-2.1 1,-0.3 -1,-0.2 0.882 97.5 58.3 -55.0 -38.8 15.1 -6.3 10.9 64 64 A G H 3X S+ 0 0 15 -4,-1.5 4,-1.9 -3,-0.4 -1,-0.3 0.843 103.9 51.1 -59.3 -36.6 14.0 -3.8 13.6 65 65 A F H S+ 0 0 8 -4,-1.8 5,-2.3 2,-0.2 -2,-0.2 0.884 112.1 45.7 -62.8 -40.7 -2.9 -11.1 25.2 79 79 A A H ><5S+ 0 0 2 -4,-1.8 3,-1.2 1,-0.2 -2,-0.2 0.854 109.9 55.0 -69.1 -37.7 -5.4 -8.4 24.7 80 80 A N H 3<5S+ 0 0 53 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.761 105.6 53.3 -62.0 -31.0 -7.6 -10.8 22.7 81 81 A E T 3<5S- 0 0 28 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.348 121.8-107.9 -85.8 3.0 -7.5 -13.2 25.7 82 82 A G T < 5S+ 0 0 51 -3,-1.2 2,-1.9 1,-0.2 3,-0.3 0.508 79.1 135.0 80.2 6.1 -8.7 -10.4 28.0 83 83 A K >< + 0 0 67 -5,-2.3 4,-1.9 -6,-0.2 -1,-0.2 -0.486 20.4 159.1 -87.0 69.3 -5.3 -10.1 29.6 84 84 A V H > + 0 0 28 -2,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.897 66.8 50.7 -61.8 -49.0 -5.3 -6.3 29.5 85 85 A K H > S+ 0 0 162 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.917 113.1 46.3 -59.3 -44.3 -2.6 -5.6 32.2 86 86 A E H > S+ 0 0 52 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.829 110.5 54.0 -69.7 -30.9 -0.1 -8.1 30.5 87 87 A A H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.909 109.4 47.8 -64.5 -44.8 -0.9 -6.5 27.1 88 88 A Q H X S+ 0 0 35 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.893 111.3 51.7 -61.9 -40.6 -0.1 -3.1 28.5 89 89 A K H X S+ 0 0 95 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.916 108.3 50.7 -58.4 -46.4 3.1 -4.6 30.0 90 90 A A H X S+ 0 0 23 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.848 108.3 52.7 -60.6 -37.5 4.0 -6.0 26.6 91 91 A A H < S+ 0 0 2 -4,-1.9 4,-0.4 2,-0.2 -1,-0.2 0.878 108.4 50.8 -66.6 -39.0 3.5 -2.6 25.0 92 92 A E H >< S+ 0 0 88 -4,-2.0 3,-1.2 1,-0.2 4,-0.2 0.917 109.1 51.8 -61.9 -44.7 5.8 -1.0 27.6 93 93 A L H >< S+ 0 0 53 -4,-2.2 3,-1.6 1,-0.2 4,-0.3 0.825 99.1 62.3 -62.4 -35.9 8.5 -3.6 26.9 94 94 A L T >X S+ 0 0 6 -4,-1.5 4,-1.4 1,-0.3 3,-1.1 0.596 79.3 85.3 -75.7 -5.0 8.5 -3.1 23.1 95 95 A K H <> S+ 0 0 54 -3,-1.2 4,-2.7 -4,-0.4 -1,-0.3 0.796 80.6 65.9 -58.0 -29.4 9.7 0.6 23.7 96 96 A A H <> S+ 0 0 28 -3,-1.6 4,-2.3 -4,-0.2 -1,-0.3 0.811 97.6 52.8 -63.5 -32.5 13.2 -1.0 23.7 97 97 A I H <> S+ 0 0 36 -3,-1.1 4,-1.9 -4,-0.3 5,-0.2 0.924 110.0 47.3 -68.5 -45.8 12.7 -1.9 20.1 98 98 A C H X S+ 0 0 34 -4,-1.4 4,-2.4 1,-0.2 -2,-0.2 0.949 115.3 46.3 -54.6 -50.6 11.8 1.7 19.3 99 99 A N H X S+ 0 0 83 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.850 108.2 55.1 -66.0 -39.7 14.8 2.9 21.2 100 100 A A H X S+ 0 0 37 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.889 112.7 41.9 -62.0 -44.1 17.3 0.4 19.7 101 101 A C H X S+ 0 0 25 -4,-1.9 4,-3.0 2,-0.2 5,-0.5 0.939 113.6 52.5 -69.4 -47.0 16.5 1.5 16.1 102 102 A H H X S+ 0 0 48 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.880 105.0 56.1 -51.9 -44.2 16.4 5.2 17.0 103 103 A Q H < S+ 0 0 163 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.885 118.8 32.3 -56.4 -41.7 19.8 5.0 18.6 104 104 A K H < S+ 0 0 63 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.835 136.2 15.8 -83.7 -39.0 21.3 3.6 15.4 105 105 A Y H < 0 0 26 -4,-3.0 -58,-0.5 -5,-0.1 -3,-0.2 0.531 360.0 360.0-126.5 -10.1 19.3 5.2 12.7 106 106 A R < 0 0 202 -4,-1.8 0, 0.0 -5,-0.5 0, 0.0 -0.697 360.0 360.0 -89.4 360.0 17.3 8.3 13.8 107 !* 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 0.0 108 1 B A 0 0 86 0, 0.0 5,-0.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 155.5 18.1 -29.3 36.8 109 2 B D > - 0 0 82 1,-0.1 4,-2.3 41,-0.0 5,-0.2 -0.233 360.0-106.1 -72.3 161.1 16.2 -27.4 39.6 110 3 B L H > S+ 0 0 43 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.900 119.9 52.1 -54.8 -45.6 14.7 -23.9 39.1 111 4 B E H > S+ 0 0 146 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.904 110.6 48.0 -58.2 -45.6 17.4 -22.2 41.2 112 5 B D H > S+ 0 0 71 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.880 111.8 48.9 -62.8 -42.3 20.2 -23.9 39.1 113 6 B N H X S+ 0 0 11 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.850 111.7 50.0 -66.6 -35.2 18.5 -22.9 35.9 114 7 B M H X S+ 0 0 55 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.852 110.4 49.7 -69.2 -37.7 18.2 -19.3 37.1 115 8 B E H X S+ 0 0 107 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.884 110.4 50.6 -64.3 -42.2 21.8 -19.3 38.2 116 9 B T H X S+ 0 0 53 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.902 112.1 47.4 -62.5 -42.0 22.8 -20.6 34.7 117 10 B L H X S+ 0 0 15 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.945 115.3 45.3 -62.1 -51.3 20.7 -17.8 33.1 118 11 B N H X S+ 0 0 83 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.923 113.9 48.2 -58.9 -49.8 22.2 -15.1 35.4 119 12 B D H X S+ 0 0 92 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.898 113.0 47.1 -60.9 -43.9 25.8 -16.3 35.0 120 13 B N H X S+ 0 0 16 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.802 106.6 56.8 -73.6 -29.0 25.6 -16.5 31.2 121 14 B L H X S+ 0 0 14 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.896 108.9 48.0 -63.9 -41.0 24.0 -13.1 30.8 122 15 B K H X S+ 0 0 113 -4,-1.6 4,-1.4 1,-0.2 -2,-0.2 0.872 108.4 54.7 -66.8 -38.2 27.0 -11.6 32.7 123 16 B V H X S+ 0 0 61 -4,-1.7 4,-0.6 2,-0.2 -2,-0.2 0.872 106.5 51.7 -58.7 -42.2 29.3 -13.6 30.3 124 17 B I H >< S+ 0 0 2 -4,-1.9 3,-0.8 1,-0.2 -2,-0.2 0.915 106.7 52.7 -64.3 -44.8 27.7 -12.0 27.3 125 18 B E H 3< S+ 0 0 127 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.841 116.9 38.9 -57.7 -37.0 28.1 -8.5 28.7 126 19 B K H 3< S+ 0 0 170 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.468 92.7 123.7 -91.7 -6.9 31.9 -9.1 29.2 127 20 B A << - 0 0 10 -3,-0.8 -3,-0.1 -4,-0.6 3,-0.1 -0.202 40.6-170.2 -66.6 146.3 32.4 -11.1 26.0 128 21 B D + 0 0 150 1,-0.1 2,-0.2 0, 0.0 -1,-0.1 0.851 65.2 32.3 -94.4 -47.2 34.9 -10.2 23.3 129 22 B N S > S- 0 0 79 1,-0.1 4,-1.4 62,-0.0 3,-0.2 -0.560 80.4-105.1-116.8 170.8 34.1 -12.5 20.4 130 23 B A H > S+ 0 0 27 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.866 113.2 60.6 -61.6 -41.6 31.2 -14.3 18.7 131 24 B A H > S+ 0 0 63 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.885 104.1 49.3 -56.8 -44.1 32.0 -17.7 20.0 132 25 B Q H > S+ 0 0 84 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.924 114.7 44.4 -59.7 -48.4 31.7 -16.6 23.7 133 26 B V H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.929 113.2 51.3 -64.3 -46.8 28.3 -15.0 23.0 134 27 B K H X S+ 0 0 75 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.911 111.7 46.6 -56.0 -46.9 27.1 -18.0 21.0 135 28 B D H X S+ 0 0 56 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.905 112.4 49.1 -65.4 -44.3 28.0 -20.5 23.7 136 29 B A H X S+ 0 0 1 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.875 111.8 49.1 -63.6 -40.2 26.4 -18.5 26.5 137 30 B L H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.911 109.4 51.9 -65.6 -44.2 23.2 -18.0 24.6 138 31 B T H X S+ 0 0 13 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.905 111.3 48.2 -54.4 -45.5 23.1 -21.8 23.8 139 32 B K H X S+ 0 0 96 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.888 111.1 49.8 -64.9 -39.6 23.5 -22.4 27.5 140 33 B M H X S+ 0 0 2 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.904 108.4 54.0 -64.0 -41.5 20.7 -19.9 28.4 141 34 B A H X S+ 0 0 1 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.915 108.9 48.4 -58.7 -45.2 18.4 -21.6 25.8 142 35 B A H X S+ 0 0 40 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.908 112.8 47.8 -60.5 -44.8 19.0 -25.0 27.5 143 36 B A H X S+ 0 0 4 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.879 110.9 50.2 -67.6 -39.4 18.3 -23.6 31.0 144 37 B A H X S+ 0 0 0 -4,-2.5 4,-0.6 2,-0.2 3,-0.3 0.934 113.3 46.5 -62.7 -45.8 15.1 -21.7 29.9 145 38 B A H >< S+ 0 0 2 -4,-2.1 3,-0.8 1,-0.2 4,-0.3 0.891 111.5 51.4 -65.7 -39.2 13.8 -24.9 28.3 146 39 B D H 3< S+ 0 0 63 -4,-2.4 3,-0.3 1,-0.2 -1,-0.2 0.754 108.3 52.9 -66.5 -26.0 14.7 -27.0 31.3 147 40 B A H >< S+ 0 0 1 -4,-1.4 3,-2.2 -3,-0.3 -1,-0.2 0.585 81.6 102.2 -84.1 -9.4 12.9 -24.5 33.6 148 41 B W T << S+ 0 0 3 -3,-0.8 -1,-0.2 -4,-0.6 -2,-0.1 0.798 85.5 34.0 -44.4 -53.0 9.7 -24.8 31.5 149 42 B S T 3 S+ 0 0 80 -3,-0.3 -1,-0.3 -4,-0.3 2,-0.1 0.141 89.0 129.5 -97.8 20.9 7.6 -27.1 33.7 150 43 B A < - 0 0 24 -3,-2.2 -3,-0.0 -41,-0.0 -41,-0.0 -0.447 52.6-140.2 -72.8 146.1 8.9 -25.8 37.1 151 44 B T - 0 0 75 -2,-0.1 -41,-0.1 17,-0.0 5,-0.1 -0.958 20.6-139.3-105.3 113.1 6.5 -24.8 39.8 152 45 B P > - 0 0 4 0, 0.0 3,-2.0 0, 0.0 4,-0.2 -0.424 20.7-113.9 -69.9 147.0 7.8 -21.6 41.6 153 46 B P G > S+ 0 0 97 0, 0.0 3,-1.3 0, 0.0 4,-0.3 0.833 116.0 58.4 -45.9 -43.0 7.4 -21.4 45.4 154 47 B K G 3 S+ 0 0 125 58,-0.5 3,-0.2 1,-0.2 59,-0.1 0.690 113.5 39.1 -62.3 -20.8 4.9 -18.5 45.1 155 48 B L G X S+ 0 0 11 -3,-2.0 3,-0.9 57,-0.1 -1,-0.2 0.155 78.2 112.2-118.0 17.1 2.6 -20.7 43.0 156 49 B E T < S+ 0 0 138 -3,-1.3 -1,-0.1 1,-0.3 -2,-0.1 0.808 82.2 47.8 -61.6 -30.5 3.0 -24.1 44.8 157 50 B D T 3 S+ 0 0 137 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.627 96.8 97.3 -83.4 -15.9 -0.6 -24.0 46.0 158 51 B K S < S- 0 0 91 -3,-0.9 -3,-0.1 1,-0.1 0, 0.0 -0.371 84.4 -96.8 -79.9 152.6 -2.0 -23.1 42.5 159 52 B S > - 0 0 63 1,-0.1 3,-2.1 -2,-0.1 6,-0.4 -0.397 29.3-123.7 -60.6 139.9 -3.5 -25.4 39.9 160 53 B P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.748 116.1 41.0 -59.2 -23.9 -1.0 -26.6 37.2 161 54 B D T 3 S+ 0 0 71 4,-0.1 -2,-0.1 5,-0.0 84,-0.0 -0.041 88.7 129.3-115.7 29.6 -3.5 -25.2 34.7 162 55 B S S <> S- 0 0 9 -3,-2.1 4,-2.3 1,-0.1 5,-0.2 -0.369 75.6-107.5 -70.7 158.3 -4.4 -22.0 36.6 163 56 B P H > S+ 0 0 88 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.862 121.5 55.2 -54.3 -35.3 -4.2 -18.6 34.9 164 57 B E H > S+ 0 0 58 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.904 108.6 44.2 -65.6 -45.7 -1.1 -17.9 37.0 165 58 B M H > S+ 0 0 6 -6,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.853 112.9 52.4 -69.8 -35.2 0.8 -21.0 35.8 166 59 B H H X S+ 0 0 50 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.922 113.0 44.9 -61.5 -44.9 -0.2 -20.4 32.2 167 60 B D H X S+ 0 0 18 -4,-2.2 4,-1.5 -5,-0.2 -2,-0.2 0.851 110.8 54.6 -67.3 -36.3 1.1 -16.8 32.5 168 61 B F H X S+ 0 0 10 -4,-2.2 4,-0.9 2,-0.2 3,-0.2 0.942 110.7 45.1 -60.8 -48.7 4.2 -18.2 34.2 169 62 B R H >X S+ 0 0 18 -4,-2.5 4,-1.8 1,-0.2 3,-0.6 0.875 105.4 61.5 -63.4 -38.8 4.9 -20.5 31.3 170 63 B H H 3X S+ 0 0 17 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.886 97.5 60.0 -56.1 -40.2 4.2 -17.7 28.8 171 64 B G H 3X S+ 0 0 17 -4,-1.5 4,-2.1 -3,-0.2 -1,-0.2 0.856 104.1 48.7 -55.4 -40.6 7.1 -15.8 30.3 172 65 B F H S+ 0 0 9 -4,-2.2 5,-2.3 1,-0.2 -2,-0.2 0.904 112.4 45.8 -57.9 -43.3 22.4 -12.3 15.3 186 79 B A H ><5S+ 0 0 2 -4,-2.0 3,-1.1 1,-0.2 -1,-0.2 0.834 110.0 54.3 -68.6 -36.3 25.5 -13.9 16.9 187 80 B N H 3<5S+ 0 0 51 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.751 105.5 54.7 -64.9 -28.2 25.6 -16.6 14.1 188 81 B E T 3<5S- 0 0 41 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.360 121.8-108.3 -85.6 2.5 25.6 -13.8 11.6 189 82 B G T < 5S+ 0 0 51 -3,-1.1 2,-1.8 1,-0.1 3,-0.3 0.495 79.4 134.3 80.1 6.3 28.7 -12.2 13.2 190 83 B K >< + 0 0 60 -5,-2.3 4,-2.0 -6,-0.2 5,-0.2 -0.460 20.2 158.5 -87.9 68.1 26.6 -9.3 14.6 191 84 B V H > + 0 0 27 -2,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.883 67.4 51.1 -61.9 -47.1 28.1 -9.5 18.0 192 85 B K H > S+ 0 0 154 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.919 112.8 47.0 -57.9 -47.1 27.3 -6.0 19.2 193 86 B E H > S+ 0 0 38 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.835 110.7 52.0 -63.8 -36.6 23.7 -6.4 18.2 194 87 B A H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.887 109.4 49.5 -66.2 -41.6 23.5 -9.8 19.9 195 88 B Q H X S+ 0 0 33 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.877 111.1 50.6 -63.2 -38.3 24.9 -8.3 23.1 196 89 B K H X S+ 0 0 103 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.894 109.5 49.7 -63.1 -44.3 22.3 -5.6 22.8 197 90 B A H X S+ 0 0 24 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.857 108.6 54.1 -62.4 -37.9 19.5 -8.2 22.4 198 91 B A H < S+ 0 0 1 -4,-2.0 4,-0.3 1,-0.2 -2,-0.2 0.892 108.1 49.0 -64.5 -42.0 20.9 -9.9 25.5 199 92 B E H >< S+ 0 0 72 -4,-1.9 3,-1.2 1,-0.2 4,-0.2 0.889 109.2 53.3 -61.7 -39.5 20.6 -6.7 27.5 200 93 B L H >< S+ 0 0 74 -4,-1.9 3,-1.6 1,-0.3 4,-0.3 0.826 96.6 64.9 -69.0 -31.3 17.0 -6.1 26.3 201 94 B L T >X S+ 0 0 4 -4,-1.5 4,-1.4 1,-0.3 3,-0.7 0.571 79.3 84.2 -75.2 -3.6 15.8 -9.6 27.4 202 95 B K H <> S+ 0 0 73 -3,-1.2 4,-2.7 -4,-0.3 -1,-0.3 0.791 81.7 63.2 -61.1 -29.1 16.5 -8.6 31.0 203 96 B A H <> S+ 0 0 34 -3,-1.6 4,-2.4 -4,-0.2 -1,-0.2 0.810 99.1 53.7 -66.2 -29.9 13.0 -7.0 31.0 204 97 B I H <> S+ 0 0 28 -3,-0.7 4,-1.9 -4,-0.3 -2,-0.2 0.930 110.3 46.3 -66.2 -47.6 11.6 -10.5 30.4 205 98 B C H X S+ 0 0 30 -4,-1.4 4,-2.4 1,-0.2 -2,-0.2 0.939 115.8 46.8 -53.5 -51.3 13.5 -11.7 33.5 206 99 B N H X S+ 0 0 83 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.867 108.0 54.6 -64.8 -41.1 12.3 -8.7 35.5 207 100 B A H X S+ 0 0 16 -4,-2.4 4,-1.1 2,-0.2 -1,-0.2 0.894 112.9 42.2 -62.4 -43.8 8.6 -9.0 34.3 208 101 B C H X S+ 0 0 24 -4,-1.9 4,-2.9 2,-0.2 5,-0.4 0.927 113.5 52.9 -66.5 -46.1 8.3 -12.6 35.5 209 102 B H H X S+ 0 0 50 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.864 103.9 56.7 -58.0 -41.7 10.2 -11.9 38.8 210 103 B Q H < S+ 0 0 162 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.891 118.7 31.8 -56.8 -42.7 7.9 -9.0 39.7 211 104 B K H < S+ 0 0 98 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.2 0.864 136.4 17.0 -82.8 -39.6 4.9 -11.3 39.5 212 105 B Y H < 0 0 28 -4,-2.9 -58,-0.5 -5,-0.1 -3,-0.2 0.541 360.0 360.0-122.6 -12.0 6.2 -14.7 40.6 213 106 B R < 0 0 205 -4,-1.8 0, 0.0 -5,-0.4 0, 0.0 -0.688 360.0 360.0 -89.7 360.0 9.6 -14.5 42.4 214 !* 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 0.0 215 1 C A 0 0 82 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 158.5 11.4 -37.9 30.3 216 2 C D > - 0 0 110 1,-0.1 4,-2.2 4,-0.0 5,-0.2 -0.209 360.0-105.6 -71.1 162.1 13.3 -39.6 27.4 217 3 C L H > S+ 0 0 37 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.900 120.1 50.8 -54.1 -44.2 13.1 -38.5 23.8 218 4 C E H > S+ 0 0 134 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.861 109.9 49.8 -66.7 -37.8 10.8 -41.4 22.8 219 5 C D H > S+ 0 0 102 2,-0.2 4,-2.0 -3,-0.2 -1,-0.2 0.879 111.8 48.4 -64.9 -41.9 8.4 -40.6 25.6 220 6 C N H X S+ 0 0 11 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.864 110.7 51.3 -68.3 -37.0 8.3 -37.0 24.6 221 7 C M H X S+ 0 0 50 -4,-2.4 4,-2.8 -5,-0.2 -2,-0.2 0.872 110.1 49.0 -65.4 -39.0 7.8 -37.9 20.9 222 8 C E H X S+ 0 0 97 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.878 110.1 51.4 -68.1 -37.0 4.9 -40.2 21.9 223 9 C T H X S+ 0 0 53 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.902 112.4 46.8 -62.1 -43.0 3.4 -37.3 24.0 224 10 C L H X S+ 0 0 17 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.940 115.8 45.2 -60.7 -51.7 3.7 -35.0 21.0 225 11 C N H X S+ 0 0 63 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.922 113.7 47.9 -58.5 -50.9 2.2 -37.6 18.6 226 12 C D H X S+ 0 0 83 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.886 113.1 47.5 -61.6 -43.1 -0.7 -38.6 21.0 227 13 C N H X S+ 0 0 20 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.817 106.7 56.1 -72.8 -32.5 -1.7 -35.0 21.7 228 14 C L H X S+ 0 0 15 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.885 109.0 48.4 -64.8 -37.7 -1.7 -33.9 18.0 229 15 C K H X S+ 0 0 108 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.873 108.4 54.7 -67.5 -37.8 -4.2 -36.7 17.3 230 16 C V H X S+ 0 0 64 -4,-1.6 4,-0.6 1,-0.2 -2,-0.2 0.872 106.6 51.2 -60.2 -39.9 -6.3 -35.5 20.3 231 17 C I H >< S+ 0 0 1 -4,-1.9 3,-0.8 1,-0.2 -2,-0.2 0.911 106.4 54.5 -65.4 -43.7 -6.4 -32.0 18.8 232 18 C E H 3< S+ 0 0 81 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.839 116.5 37.0 -56.7 -38.5 -7.6 -33.4 15.4 233 19 C K H 3< S+ 0 0 159 -4,-1.4 -1,-0.2 -3,-0.0 -2,-0.2 0.427 93.1 127.5 -96.8 -1.3 -10.5 -35.2 17.0 234 20 C A << - 0 0 11 -3,-0.8 -3,-0.1 -4,-0.6 3,-0.1 -0.192 40.5-167.8 -66.5 148.4 -11.2 -32.5 19.6 235 21 C D + 0 0 132 1,-0.1 2,-0.2 63,-0.0 -1,-0.1 0.874 64.8 26.0 -96.5 -55.8 -14.7 -30.9 20.1 236 22 C N S > S- 0 0 81 1,-0.0 4,-1.4 62,-0.0 3,-0.2 -0.517 80.5-101.4-114.3 174.6 -14.1 -27.9 22.3 237 23 C A H > S+ 0 0 22 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.868 114.1 61.2 -63.0 -41.2 -11.5 -25.3 23.3 238 24 C A H > S+ 0 0 62 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.883 104.4 48.4 -54.7 -45.5 -10.6 -26.9 26.6 239 25 C Q H > S+ 0 0 67 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.920 114.6 44.9 -60.7 -48.3 -9.5 -30.2 24.8 240 26 C V H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.920 113.5 50.4 -63.6 -46.5 -7.3 -28.3 22.3 241 27 C K H X S+ 0 0 66 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.899 111.9 47.2 -56.4 -46.1 -5.8 -26.0 25.0 242 28 C D H X S+ 0 0 61 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.894 112.4 48.6 -66.9 -43.7 -4.9 -29.0 27.3 243 29 C A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.888 111.5 49.9 -63.7 -42.2 -3.3 -31.0 24.5 244 30 C L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.885 109.1 51.3 -64.4 -43.2 -1.2 -28.0 23.3 245 31 C T H X S+ 0 0 12 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.872 111.0 49.1 -58.7 -41.7 0.0 -27.3 26.8 246 32 C K H X S+ 0 0 99 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.861 111.1 49.9 -67.5 -37.3 1.1 -31.0 27.1 247 33 C M H X S+ 0 0 2 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.884 108.1 53.4 -64.9 -42.6 2.8 -30.7 23.7 248 34 C A H X S+ 0 0 1 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.902 109.2 48.6 -60.1 -43.5 4.6 -27.5 24.8 249 35 C A H X S+ 0 0 28 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.872 112.4 48.4 -62.6 -39.7 5.9 -29.3 27.9 250 36 C A H X S+ 0 0 3 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.881 111.1 49.7 -69.2 -41.8 7.1 -32.3 25.8 251 37 C A H X S+ 0 0 0 -4,-2.5 4,-0.6 2,-0.2 3,-0.4 0.940 112.9 47.4 -60.5 -49.0 8.9 -30.1 23.3 252 38 C A H >< S+ 0 0 4 -4,-2.2 3,-0.9 1,-0.2 4,-0.3 0.889 111.8 49.8 -61.6 -41.4 10.7 -28.2 26.1 253 39 C D H 3< S+ 0 0 66 -4,-2.1 3,-0.3 1,-0.2 -1,-0.2 0.731 107.8 54.8 -70.1 -22.5 11.7 -31.4 27.8 254 40 C A H >< S+ 0 0 1 -4,-1.4 3,-2.1 -3,-0.4 -1,-0.2 0.596 82.0 99.6 -80.4 -12.0 13.1 -32.8 24.5 255 41 C W T << S+ 0 0 5 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.1 0.792 85.5 35.0 -48.2 -49.5 15.3 -29.8 24.1 256 42 C S T 3 S+ 0 0 88 -3,-0.3 -1,-0.3 -4,-0.3 2,-0.1 0.168 88.8 127.2 -98.5 16.0 18.6 -31.1 25.3 257 43 C A < - 0 0 25 -3,-2.1 -3,-0.0 -41,-0.0 -41,-0.0 -0.456 53.9-139.6 -72.9 143.9 18.2 -34.7 24.0 258 44 C T - 0 0 78 -2,-0.1 -41,-0.1 17,-0.0 5,-0.1 -0.946 21.0-138.7-101.2 115.1 20.8 -36.3 21.8 259 45 C P > - 0 0 5 0, 0.0 3,-2.0 0, 0.0 4,-0.1 -0.420 20.8-112.8 -69.0 148.0 19.1 -38.3 19.0 260 46 C P G > S+ 0 0 87 0, 0.0 3,-1.5 0, 0.0 4,-0.3 0.848 116.2 57.3 -46.1 -45.7 20.6 -41.8 18.1 261 47 C K G 3 S+ 0 0 129 58,-0.5 3,-0.2 1,-0.3 59,-0.1 0.675 113.2 40.1 -64.3 -17.5 21.7 -40.5 14.7 262 48 C L G X S+ 0 0 7 -3,-2.0 3,-0.9 57,-0.1 -1,-0.3 0.159 77.4 112.0-118.8 18.8 23.8 -37.8 16.3 263 49 C E T < S+ 0 0 142 -3,-1.5 -1,-0.1 1,-0.3 -2,-0.1 0.800 82.2 48.2 -61.0 -31.5 25.3 -39.7 19.3 264 50 C D T 3 S+ 0 0 132 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.645 96.9 96.8 -81.4 -19.1 28.8 -39.5 17.8 265 51 C K S < S- 0 0 103 -3,-0.9 -3,-0.1 1,-0.1 0, 0.0 -0.344 84.4 -95.2 -80.6 153.7 28.5 -35.8 17.1 266 52 C S > - 0 0 68 1,-0.1 3,-2.1 -2,-0.1 6,-0.4 -0.382 29.3-125.2 -58.4 136.0 29.8 -32.8 19.1 267 53 C P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.746 115.9 40.1 -57.1 -23.3 27.1 -31.3 21.4 268 54 C D T 3 S+ 0 0 76 4,-0.1 -2,-0.1 5,-0.0 -130,-0.0 -0.094 89.5 129.4-117.5 33.8 27.9 -28.0 19.7 269 55 C S S <> S- 0 0 11 -3,-2.1 4,-2.2 1,-0.1 5,-0.2 -0.399 76.0-106.5 -73.8 159.4 28.2 -29.4 16.2 270 56 C P H > S+ 0 0 99 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.874 122.6 54.7 -52.3 -38.6 26.3 -27.7 13.2 271 57 C E H > S+ 0 0 64 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.895 108.3 45.4 -62.6 -47.2 24.0 -30.8 13.4 272 58 C M H > S+ 0 0 5 -6,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.844 113.3 49.9 -68.9 -36.1 23.2 -30.4 17.1 273 59 C H H X S+ 0 0 45 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.907 113.6 46.4 -66.0 -42.0 22.6 -26.7 16.7 274 60 C D H X S+ 0 0 17 -4,-2.3 4,-1.5 -5,-0.2 -2,-0.2 0.880 110.9 53.6 -64.5 -41.6 20.3 -27.4 13.7 275 61 C F H X S+ 0 0 9 -4,-2.6 4,-0.8 1,-0.2 3,-0.3 0.939 111.6 44.1 -59.0 -49.2 18.6 -30.2 15.7 276 62 C R H >X S+ 0 0 30 -4,-2.5 4,-1.8 1,-0.2 3,-0.9 0.885 104.5 63.6 -64.3 -38.6 17.9 -27.7 18.5 277 63 C H H 3X S+ 0 0 22 -4,-2.3 4,-2.1 1,-0.3 -1,-0.2 0.889 96.8 59.3 -51.5 -41.6 16.7 -25.1 16.1 278 64 C G H 3X S+ 0 0 15 -4,-1.5 4,-1.9 -3,-0.3 -1,-0.3 0.834 103.6 50.0 -56.4 -38.2 13.9 -27.4 15.1 279 65 C F H S+ 0 0 4 -4,-2.2 5,-2.3 1,-0.2 -2,-0.2 0.908 112.1 45.2 -54.7 -46.7 -5.7 -19.0 19.1 293 79 C A H ><5S+ 0 0 0 -4,-2.0 3,-1.1 1,-0.2 -1,-0.2 0.844 110.2 54.1 -67.5 -36.2 -7.3 -21.6 21.3 294 80 C N H 3<5S+ 0 0 50 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.759 105.6 54.8 -64.2 -29.3 -7.3 -19.2 24.3 295 81 C E T 3<5S- 0 0 37 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.358 121.6-109.3 -85.0 2.0 -9.2 -16.7 22.0 296 82 C G T < 5S+ 0 0 48 -3,-1.1 2,-1.9 1,-0.1 3,-0.2 0.498 78.2 136.0 79.7 5.2 -11.8 -19.3 21.4 297 83 C K >< + 0 0 41 -5,-2.3 4,-1.9 -6,-0.2 5,-0.2 -0.455 20.6 160.4 -84.3 67.4 -10.6 -19.7 17.8 298 84 C V H > + 0 0 26 -2,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.891 67.1 49.8 -56.7 -50.9 -10.8 -23.5 17.9 299 85 C K H > S+ 0 0 152 -3,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.912 112.8 46.7 -60.6 -45.0 -10.9 -24.2 14.2 300 86 C E H > S+ 0 0 54 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.826 110.8 52.9 -69.1 -30.8 -7.9 -22.0 13.5 301 87 C A H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.898 109.0 49.9 -65.5 -43.4 -6.0 -23.6 16.4 302 88 C Q H X S+ 0 0 39 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.886 111.3 49.4 -60.4 -41.9 -6.7 -27.0 14.9 303 89 C K H X S+ 0 0 96 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.889 109.1 51.6 -62.8 -42.4 -5.4 -25.7 11.5 304 90 C A H X S+ 0 0 24 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.870 108.2 52.0 -63.1 -39.3 -2.3 -24.4 13.2 305 91 C A H < S+ 0 0 2 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.863 109.2 50.3 -63.8 -39.5 -1.7 -27.8 14.8 306 92 C E H >< S+ 0 0 90 -4,-1.8 3,-1.1 1,-0.2 4,-0.2 0.894 109.6 51.3 -63.2 -40.9 -2.0 -29.4 11.3 307 93 C L H >< S+ 0 0 57 -4,-2.1 3,-1.4 1,-0.2 4,-0.2 0.814 98.4 63.8 -68.9 -31.9 0.5 -27.0 9.8 308 94 C L T >X S+ 0 0 4 -4,-1.6 4,-1.3 1,-0.3 3,-1.1 0.582 79.6 85.2 -73.9 -5.8 3.1 -27.6 12.5 309 95 C K H <> S+ 0 0 62 -3,-1.1 4,-2.8 -4,-0.3 -1,-0.3 0.800 79.9 65.0 -58.9 -32.0 3.4 -31.3 11.3 310 96 C A H <> S+ 0 0 30 -3,-1.4 4,-2.2 -4,-0.2 -1,-0.3 0.785 98.4 52.7 -64.3 -28.1 5.8 -29.9 8.7 311 97 C I H <> S+ 0 0 34 -3,-1.1 4,-1.8 -4,-0.2 5,-0.2 0.912 110.2 47.2 -70.9 -44.3 8.2 -29.0 11.6 312 98 C C H X S+ 0 0 33 -4,-1.3 4,-2.3 1,-0.2 -2,-0.2 0.934 115.3 47.1 -56.3 -48.6 7.9 -32.6 12.9 313 99 C N H X S+ 0 0 102 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.875 108.1 53.9 -64.5 -42.6 8.5 -33.9 9.4 314 100 C A H X S+ 0 0 45 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.895 112.6 42.5 -63.6 -44.2 11.5 -31.7 8.6 315 101 C C H X S+ 0 0 27 -4,-1.8 4,-3.0 2,-0.2 5,-0.5 0.931 113.0 53.8 -66.3 -46.0 13.5 -32.7 11.7 316 102 C H H X S+ 0 0 45 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.898 105.4 54.2 -54.3 -43.6 12.6 -36.4 11.2 317 103 C Q H < S+ 0 0 140 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.891 119.2 33.0 -58.6 -41.0 13.9 -36.4 7.6 318 104 C K H < S+ 0 0 60 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.860 136.2 16.9 -82.9 -37.7 17.3 -35.1 8.7 319 105 C Y H < 0 0 8 -4,-3.0 -58,-0.5 -5,-0.1 -3,-0.2 0.529 360.0 360.0-124.6 -13.8 17.7 -36.7 12.1 320 106 C R < 0 0 196 -4,-2.1 0, 0.0 -5,-0.5 0, 0.0 -0.696 360.0 360.0 -91.0 360.0 15.3 -39.6 12.8 321 !* 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 0.0 322 1 D A 0 0 87 0, 0.0 5,-0.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 157.5 1.2 -1.7 -4.3 323 2 D D > - 0 0 82 1,-0.1 4,-2.2 41,-0.0 5,-0.2 -0.230 360.0-102.9 -76.9 166.5 -2.2 -3.4 -4.8 324 3 D L H > S+ 0 0 40 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.896 120.3 51.3 -55.7 -46.3 -3.0 -6.9 -3.4 325 4 D E H > S+ 0 0 144 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.897 110.6 49.4 -60.5 -42.5 -2.7 -8.6 -6.8 326 5 D D H > S+ 0 0 64 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.886 111.4 48.5 -62.6 -43.2 0.8 -7.0 -7.4 327 6 D N H X S+ 0 0 8 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.844 111.4 50.2 -66.1 -36.8 2.0 -8.1 -3.9 328 7 D M H X S+ 0 0 55 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.854 110.1 50.2 -67.6 -39.3 0.7 -11.7 -4.6 329 8 D E H X S+ 0 0 111 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.872 110.4 50.8 -62.1 -41.8 2.5 -11.7 -7.9 330 9 D T H X S+ 0 0 49 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.908 111.9 46.7 -61.9 -46.0 5.7 -10.5 -6.1 331 10 D L H X S+ 0 0 14 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.929 115.8 45.8 -60.3 -49.2 5.3 -13.3 -3.5 332 11 D N H X S+ 0 0 104 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.930 113.3 47.8 -61.3 -51.0 4.7 -16.0 -6.3 333 12 D D H X S+ 0 0 100 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.891 113.8 46.7 -59.6 -44.6 7.5 -14.9 -8.6 334 13 D N H X S+ 0 0 14 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.803 106.4 57.1 -73.8 -29.6 10.1 -14.8 -5.8 335 14 D L H X S+ 0 0 10 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.896 109.0 47.9 -62.8 -42.2 9.1 -18.1 -4.3 336 15 D K H X S+ 0 0 127 -4,-1.6 4,-1.4 1,-0.2 -2,-0.2 0.865 108.0 55.7 -63.4 -40.4 9.9 -19.6 -7.8 337 16 D V H X S+ 0 0 54 -4,-1.6 4,-0.6 1,-0.2 -2,-0.2 0.879 106.6 50.0 -59.6 -41.7 13.2 -17.7 -7.8 338 17 D I H >< S+ 0 0 2 -4,-1.9 3,-0.9 1,-0.2 -1,-0.2 0.911 106.3 55.3 -65.9 -44.6 14.2 -19.3 -4.5 339 18 D E H 3< S+ 0 0 74 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.841 116.8 36.9 -53.1 -39.8 13.4 -22.9 -5.8 340 19 D K H 3< S+ 0 0 186 -4,-1.4 -1,-0.2 -3,-0.1 -2,-0.2 0.454 93.2 124.0 -95.1 -4.2 15.7 -22.4 -8.8 341 20 D A << - 0 0 9 -3,-0.9 -3,-0.1 -4,-0.6 3,-0.1 -0.211 41.2-167.9 -68.5 148.1 18.4 -20.4 -7.0 342 21 D D + 0 0 150 1,-0.1 2,-0.2 0, 0.0 -1,-0.1 0.866 64.7 29.7 -94.5 -52.7 22.1 -21.4 -6.9 343 22 D N S > S- 0 0 80 1,-0.0 4,-1.4 62,-0.0 3,-0.2 -0.506 80.6-102.1-114.8 174.3 23.7 -19.2 -4.2 344 23 D A H > S+ 0 0 22 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.876 113.0 59.8 -60.3 -44.1 22.9 -17.3 -1.0 345 24 D A H > S+ 0 0 56 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.870 105.1 48.4 -58.0 -42.7 22.6 -13.9 -2.6 346 25 D Q H > S+ 0 0 96 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.917 114.6 45.3 -62.9 -45.3 19.8 -14.9 -4.8 347 26 D V H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.927 113.4 50.9 -63.3 -46.1 17.8 -16.5 -2.0 348 27 D K H X S+ 0 0 70 -4,-3.2 4,-2.0 1,-0.2 -2,-0.2 0.903 111.8 46.1 -57.7 -47.0 18.5 -13.5 0.3 349 28 D D H X S+ 0 0 58 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.895 112.4 49.7 -67.1 -42.6 17.3 -11.0 -2.2 350 29 D A H X S+ 0 0 1 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.867 111.2 49.5 -63.1 -40.0 14.1 -12.9 -3.1 351 30 D L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.884 109.1 51.9 -67.4 -40.2 13.2 -13.3 0.6 352 31 D T H X S+ 0 0 9 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.887 110.6 48.8 -61.7 -40.3 13.7 -9.6 1.2 353 32 D K H X S+ 0 0 105 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.873 110.9 50.5 -66.1 -39.5 11.4 -8.9 -1.7 354 33 D M H X S+ 0 0 1 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.905 108.4 52.6 -62.9 -42.5 8.8 -11.3 -0.3 355 34 D A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.913 109.0 49.4 -60.6 -44.2 9.1 -9.6 3.1 356 35 D A H X S+ 0 0 34 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.905 112.7 47.5 -58.9 -44.2 8.4 -6.2 1.5 357 36 D A H X S+ 0 0 3 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.887 110.9 50.3 -67.6 -42.7 5.3 -7.6 -0.4 358 37 D A H X S+ 0 0 0 -4,-2.6 4,-0.5 2,-0.2 3,-0.3 0.931 112.7 47.1 -60.1 -46.3 3.9 -9.3 2.7 359 38 D A H >< S+ 0 0 3 -4,-2.2 3,-0.8 1,-0.2 4,-0.3 0.871 111.7 50.4 -65.5 -38.0 4.2 -6.2 4.7 360 39 D D H 3< S+ 0 0 56 -4,-2.1 3,-0.3 1,-0.2 -1,-0.2 0.728 107.6 54.6 -71.1 -23.3 2.7 -4.0 2.0 361 40 D A H >< S+ 0 0 0 -4,-1.4 3,-2.1 -3,-0.3 -1,-0.2 0.599 81.6 100.4 -82.2 -10.5 -0.3 -6.4 1.7 362 41 D W T << S+ 0 0 5 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.1 0.788 85.6 34.3 -49.0 -49.2 -1.0 -6.1 5.4 363 42 D S T 3 S+ 0 0 86 -3,-0.3 -1,-0.3 -4,-0.3 2,-0.1 0.148 88.9 128.2 -98.5 16.8 -3.9 -3.7 5.3 364 43 D A < - 0 0 22 -3,-2.1 -3,-0.0 -41,-0.0 -41,-0.0 -0.454 53.2-140.5 -73.7 144.3 -5.5 -4.9 2.1 365 44 D T - 0 0 74 -2,-0.1 -41,-0.1 17,-0.0 5,-0.1 -0.951 20.6-139.0-103.5 115.1 -9.1 -5.8 1.9 366 45 D P > - 0 0 5 0, 0.0 3,-1.9 0, 0.0 4,-0.2 -0.438 21.0-113.6 -70.0 146.7 -9.6 -9.0 -0.2 367 46 D P G > S+ 0 0 93 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.836 116.0 59.2 -46.7 -42.5 -12.6 -9.1 -2.6 368 47 D K G 3 S+ 0 0 129 58,-0.5 3,-0.2 1,-0.2 59,-0.1 0.709 112.6 39.4 -61.5 -22.3 -14.2 -11.9 -0.6 369 48 D L G X S+ 0 0 9 -3,-1.9 3,-1.0 57,-0.1 -1,-0.2 0.166 78.0 114.5-116.5 17.4 -14.3 -9.7 2.5 370 49 D E T < S+ 0 0 137 -3,-1.4 -1,-0.1 1,-0.2 -2,-0.1 0.810 82.3 45.4 -53.0 -37.9 -15.2 -6.3 0.9 371 50 D D T 3 S+ 0 0 173 -4,-0.3 -1,-0.2 -3,-0.2 2,-0.1 0.599 96.5 98.9 -85.4 -12.0 -18.6 -6.3 2.7 372 51 D K S < S- 0 0 101 -3,-1.0 -3,-0.1 1,-0.1 0, 0.0 -0.397 83.7 -98.7 -79.9 151.7 -17.1 -7.3 6.1 373 52 D S > - 0 0 74 1,-0.1 3,-2.2 -2,-0.1 6,-0.4 -0.412 29.7-122.0 -64.0 139.8 -16.2 -4.9 8.9 374 53 D P T 3 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.722 115.9 40.9 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