==== 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 10-MAR-09 2WC8 . COMPND 2 MOLECULE: PROTEIN S100-A12; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR O.V.MOROZ,E.V.BLAGOVA,A.J.WILKINSON,K.S.WILSON, I.B.BRONSTEI . 364 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19510.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 271 74.5 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 . 12 3.3 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 . 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 . 6 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 203 55.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 3 1 2 0 1 4 0 0 0 0 0 4 0 4 0 0 0 0 0 0 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 4 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 . 4 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 0 A S 0 0 82 0, 0.0 130,-0.1 0, 0.0 129,-0.1 0.000 360.0 360.0 360.0 142.7 -14.5 -7.5 22.0 2 1 A T > - 0 0 29 128,-0.3 4,-2.8 127,-0.1 5,-0.2 -0.133 360.0-100.3 -65.2 166.6 -12.6 -6.4 18.9 3 2 A K H > S+ 0 0 72 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.918 127.3 50.2 -54.6 -43.7 -13.7 -7.4 15.5 4 3 A L H > S+ 0 0 3 1,-0.2 4,-1.8 2,-0.2 3,-0.2 0.954 110.7 49.0 -61.3 -46.7 -11.1 -10.2 15.5 5 4 A E H > S+ 0 0 1 125,-0.4 4,-2.5 1,-0.2 -2,-0.2 0.849 104.3 58.7 -64.8 -35.9 -12.4 -11.4 18.9 6 5 A E H X S+ 0 0 86 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.899 106.9 50.3 -55.8 -39.6 -16.1 -11.3 17.7 7 6 A H H X S+ 0 0 13 -4,-1.7 4,-2.0 -3,-0.2 -2,-0.2 0.928 110.2 47.6 -66.6 -42.3 -15.0 -13.8 15.0 8 7 A L H X S+ 0 0 2 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.932 113.8 48.3 -63.3 -42.1 -13.2 -16.1 17.6 9 8 A E H X S+ 0 0 97 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.834 109.8 52.7 -65.5 -34.8 -16.3 -16.0 19.9 10 9 A G H X S+ 0 0 12 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.865 107.9 49.9 -71.9 -38.8 -18.6 -16.7 17.0 11 10 A I H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.908 112.8 47.4 -63.4 -47.0 -16.5 -19.8 16.1 12 11 A V H X S+ 0 0 3 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.917 110.8 53.1 -59.2 -42.4 -16.7 -20.9 19.7 13 12 A N H X S+ 0 0 100 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.902 108.0 49.7 -61.7 -40.8 -20.4 -20.2 19.7 14 13 A I H X S+ 0 0 7 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.928 109.5 51.5 -68.2 -43.0 -21.0 -22.4 16.6 15 14 A F H >X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 3,-0.6 0.925 110.2 49.3 -50.3 -51.9 -19.1 -25.2 18.1 16 15 A H H 3X S+ 0 0 38 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.851 101.4 62.7 -64.5 -32.3 -21.2 -25.0 21.2 17 16 A Q H 3< S+ 0 0 84 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.868 115.6 32.9 -55.6 -39.3 -24.4 -25.0 19.2 18 17 A Y H X< S+ 0 0 7 -4,-1.3 3,-0.9 -3,-0.6 4,-0.4 0.898 118.4 52.8 -83.0 -45.3 -23.5 -28.5 17.9 19 18 A S H 3< S+ 0 0 0 -4,-2.9 3,-0.5 1,-0.2 8,-0.4 0.810 103.3 57.5 -67.3 -33.2 -21.7 -29.7 21.0 20 19 A V T 3< S+ 0 0 92 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.1 0.765 87.0 82.1 -66.7 -21.2 -24.6 -28.9 23.4 21 20 A R S < S+ 0 0 137 -3,-0.9 2,-0.3 -4,-0.3 -1,-0.2 0.818 99.3 9.2 -65.9 -40.6 -27.1 -31.1 21.5 22 21 A K S S- 0 0 143 -3,-0.5 5,-0.2 -4,-0.4 -1,-0.1 -0.954 111.3 -16.5-135.3 158.3 -26.3 -34.6 22.9 23 22 A G S S+ 0 0 82 -2,-0.3 2,-0.2 2,-0.1 5,-0.0 -0.185 117.6 14.8 57.2-140.9 -24.2 -36.1 25.7 24 23 A H S > S- 0 0 104 1,-0.1 3,-1.1 2,-0.0 -2,-0.2 -0.525 73.7-132.9 -71.9 136.0 -21.6 -34.0 27.1 25 24 A F T 3 S+ 0 0 103 1,-0.2 -1,-0.1 -2,-0.2 -4,-0.1 0.577 99.2 49.9 -62.4 -17.7 -22.0 -30.3 26.3 26 25 A D T 3 S+ 0 0 30 -6,-0.1 42,-0.5 -7,-0.1 2,-0.3 0.340 106.0 53.4-109.3 3.4 -18.3 -29.7 25.2 27 26 A T E < -A 67 0A 29 -3,-1.1 2,-0.3 -8,-0.4 -5,-0.2 -0.925 61.0-154.5-130.8 165.2 -17.7 -32.6 22.9 28 27 A L E -A 66 0A 0 38,-2.3 38,-3.4 -2,-0.3 2,-0.1 -0.967 23.8-109.2-136.5 156.6 -19.3 -34.0 19.8 29 28 A S > - 0 0 38 -2,-0.3 4,-2.6 36,-0.2 5,-0.2 -0.392 34.1-112.2 -75.2 159.5 -19.4 -37.4 18.1 30 29 A K H > S+ 0 0 75 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.894 120.1 53.9 -58.4 -39.9 -17.5 -38.0 14.9 31 30 A G H > S+ 0 0 46 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.915 108.9 46.8 -57.3 -47.1 -20.9 -38.3 13.1 32 31 A E H > S+ 0 0 35 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.880 111.4 52.8 -65.2 -41.3 -22.1 -35.0 14.5 33 32 A L H X S+ 0 0 2 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.895 105.7 53.7 -58.7 -43.5 -18.8 -33.4 13.5 34 33 A K H X S+ 0 0 70 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.929 110.1 47.3 -58.4 -43.4 -19.1 -34.7 10.0 35 34 A Q H X S+ 0 0 126 -4,-2.0 4,-2.3 2,-0.2 5,-0.3 0.933 110.3 52.8 -63.6 -39.8 -22.5 -33.1 9.7 36 35 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.4 0.942 113.1 43.7 -62.4 -45.5 -21.2 -29.8 11.2 37 36 A L H X S+ 0 0 2 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.935 111.5 51.4 -68.7 -46.6 -18.4 -29.6 8.6 38 37 A T H < S+ 0 0 64 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.864 122.2 32.7 -60.8 -37.8 -20.5 -30.6 5.6 39 38 A K H >< S+ 0 0 131 -4,-2.3 3,-1.3 -5,-0.2 4,-0.2 0.953 123.8 40.5 -78.8 -56.6 -23.2 -27.9 6.4 40 39 A E H 3< S+ 0 0 19 -4,-2.7 55,-0.4 -5,-0.3 52,-0.4 0.739 126.1 35.7 -76.5 -23.3 -21.2 -25.1 8.0 41 40 A L T 3X S+ 0 0 6 -4,-2.2 4,-2.9 -5,-0.4 -1,-0.3 0.068 79.5 124.0-110.3 24.6 -18.2 -25.4 5.5 42 41 A A H <> S+ 0 0 44 -3,-1.3 4,-2.0 1,-0.2 -1,-0.1 0.872 79.7 39.6 -51.7 -46.1 -20.4 -26.3 2.4 43 42 A N H > S+ 0 0 69 -4,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.882 113.7 53.4 -75.4 -38.9 -19.0 -23.4 0.3 44 43 A T H > S+ 0 0 18 2,-0.2 4,-0.7 1,-0.2 -2,-0.2 0.931 112.2 46.9 -55.3 -50.1 -15.5 -23.7 1.5 45 44 A I H >< S+ 0 0 34 -4,-2.9 3,-1.1 1,-0.2 -2,-0.2 0.918 108.8 53.4 -60.4 -45.3 -15.6 -27.4 0.5 46 45 A K H 3< S+ 0 0 164 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.878 110.0 48.7 -61.5 -39.0 -17.1 -26.7 -2.8 47 46 A N H 3< S+ 0 0 46 -4,-2.0 2,-0.7 -5,-0.1 -1,-0.3 0.525 86.8 97.2 -78.0 -9.5 -14.2 -24.2 -3.6 48 47 A I << - 0 0 21 -3,-1.1 6,-0.1 -4,-0.7 34,-0.0 -0.744 48.7-178.3 -82.4 117.3 -11.4 -26.6 -2.5 49 48 A K + 0 0 177 -2,-0.7 2,-0.9 1,-0.1 -1,-0.2 0.638 60.4 84.9 -93.7 -13.1 -10.1 -28.2 -5.7 50 49 A D >> - 0 0 94 1,-0.2 3,-1.6 2,-0.0 4,-1.4 -0.771 62.5-162.8 -87.3 104.6 -7.5 -30.4 -4.0 51 50 A K H 3> S+ 0 0 176 -2,-0.9 4,-3.0 1,-0.3 -1,-0.2 0.790 88.3 64.4 -59.5 -25.0 -9.4 -33.6 -3.0 52 51 A A H 3> S+ 0 0 60 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.808 101.2 49.9 -68.1 -28.3 -6.5 -34.5 -0.6 53 52 A V H <> S+ 0 0 34 -3,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.878 109.9 48.6 -76.6 -40.2 -7.3 -31.3 1.4 54 53 A I H >X S+ 0 0 42 -4,-1.4 4,-1.8 2,-0.2 3,-0.5 0.956 110.9 52.4 -59.0 -46.5 -10.9 -32.3 1.6 55 54 A D H 3X S+ 0 0 105 -4,-3.0 4,-1.9 1,-0.3 -2,-0.2 0.907 105.1 56.5 -54.1 -42.3 -9.6 -35.7 2.7 56 55 A E H 3< S+ 0 0 114 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.857 107.5 47.8 -56.6 -40.9 -7.6 -33.9 5.3 57 56 A I H << S+ 0 0 2 -4,-1.8 -1,-0.2 -3,-0.5 -2,-0.2 0.872 121.1 33.6 -69.2 -38.8 -10.7 -32.3 6.8 58 57 A F H >< S+ 0 0 41 -4,-1.8 3,-2.0 -5,-0.1 4,-0.3 0.558 86.4 130.9 -96.9 -7.1 -12.8 -35.5 7.0 59 58 A Q T 3< S+ 0 0 131 -4,-1.9 -3,-0.0 -5,-0.3 -4,-0.0 -0.113 76.1 7.6 -57.0 132.5 -10.0 -37.9 7.7 60 59 A G T > S+ 0 0 23 1,-0.1 3,-2.0 3,-0.0 -1,-0.3 0.326 88.6 116.2 83.3 -7.7 -10.6 -40.2 10.7 61 60 A L T < S+ 0 0 17 -3,-2.0 -2,-0.1 1,-0.3 -27,-0.1 0.690 80.8 49.4 -67.3 -16.0 -14.2 -39.3 11.1 62 61 A D T 3 0 0 136 -4,-0.3 -1,-0.3 1,-0.1 -3,-0.1 0.284 360.0 360.0-103.1 14.9 -15.1 -42.9 10.2 63 62 A A < 0 0 106 -3,-2.0 -2,-0.2 -4,-0.0 -1,-0.1 0.642 360.0 360.0-118.4 360.0 -12.5 -44.3 12.7 64 ! 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 65 67 A Q 0 0 136 0, 0.0 2,-0.4 0, 0.0 -36,-0.2 0.000 360.0 360.0 360.0 160.1 -15.7 -38.1 21.0 66 68 A V E -A 28 0A 5 -38,-3.4 -38,-2.3 4,-0.0 2,-0.2 -0.933 360.0-157.2-115.0 133.9 -14.2 -35.0 19.5 67 69 A D E > -A 27 0A 66 -2,-0.4 4,-2.1 -40,-0.2 3,-0.3 -0.513 34.5 -95.8-103.9 177.9 -13.2 -32.0 21.6 68 70 A F H > S+ 0 0 8 -42,-0.5 4,-2.9 1,-0.2 5,-0.2 0.900 121.3 58.2 -59.9 -42.3 -12.6 -28.3 20.9 69 71 A Q H > S+ 0 0 82 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.916 107.8 46.5 -54.4 -43.5 -8.9 -28.7 20.5 70 72 A E H > S+ 0 0 91 -3,-0.3 4,-1.2 1,-0.2 3,-0.3 0.907 110.8 54.3 -66.0 -36.9 -9.5 -31.2 17.6 71 73 A F H X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.878 101.5 57.8 -64.8 -38.8 -12.0 -28.8 16.2 72 74 A I H X S+ 0 0 6 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.888 101.2 56.8 -52.1 -41.8 -9.4 -26.0 16.2 73 75 A S H X S+ 0 0 72 -4,-1.3 4,-1.1 -3,-0.3 -1,-0.2 0.881 110.4 44.6 -62.6 -36.7 -7.1 -28.3 14.0 74 76 A L H X S+ 0 0 22 -4,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.887 110.0 53.2 -73.2 -42.6 -10.0 -28.4 11.4 75 77 A V H X S+ 0 0 7 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.876 106.1 55.8 -57.8 -38.7 -10.7 -24.7 11.7 76 78 A A H X S+ 0 0 24 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.855 108.7 47.0 -62.6 -38.2 -7.0 -24.1 10.9 77 79 A I H X S+ 0 0 28 -4,-1.1 4,-2.1 2,-0.2 -1,-0.2 0.905 111.4 49.6 -69.4 -45.6 -7.3 -26.1 7.7 78 80 A A H X S+ 0 0 1 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.887 108.9 54.9 -63.9 -36.4 -10.4 -24.4 6.6 79 81 A L H X S+ 0 0 2 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.915 106.0 49.7 -63.7 -43.2 -8.7 -21.0 7.3 80 82 A K H X S+ 0 0 120 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.939 113.7 46.9 -56.4 -50.2 -5.8 -21.9 5.0 81 83 A A H X S+ 0 0 17 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.906 111.1 51.6 -57.1 -47.0 -8.2 -22.9 2.3 82 84 A A H X S+ 0 0 19 -4,-3.0 4,-1.7 2,-0.2 -2,-0.2 0.917 111.0 48.2 -60.7 -42.0 -10.3 -19.7 2.8 83 85 A H H X S+ 0 0 23 -4,-2.7 4,-0.9 2,-0.2 3,-0.3 0.950 110.0 50.9 -65.1 -48.3 -7.2 -17.5 2.5 84 86 A Y H >< S+ 0 0 187 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.931 109.4 51.9 -54.0 -47.7 -6.0 -19.2 -0.6 85 87 A H H >< S+ 0 0 66 -4,-2.3 3,-1.8 1,-0.3 -1,-0.2 0.836 96.9 65.5 -62.2 -32.3 -9.5 -18.7 -2.2 86 88 A T H 3< S+ 0 0 13 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.806 102.0 52.4 -59.6 -27.2 -9.5 -15.0 -1.4 87 89 A H T << S+ 0 0 43 -3,-1.2 -1,-0.3 -4,-0.9 -2,-0.2 0.362 77.7 131.8 -91.1 8.2 -6.6 -14.8 -3.9 88 90 A K < 0 0 116 -3,-1.8 -3,-0.0 -4,-0.2 116,-0.0 -0.325 360.0 360.0 -57.1 128.1 -8.4 -16.6 -6.8 89 91 A E 0 0 159 -2,-0.1 -1,-0.1 116,-0.1 -2,-0.0 -0.450 360.0 360.0 -78.0 360.0 -8.0 -14.6 -10.0 90 !* 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 91 0 B S 0 0 92 0, 0.0 2,-0.1 0, 0.0 -50,-0.1 0.000 360.0 360.0 360.0 138.6 -21.3 -18.2 3.2 92 1 B T > - 0 0 28 -52,-0.4 4,-2.7 1,-0.1 5,-0.2 -0.418 360.0 -98.3 -85.2 174.2 -22.5 -19.6 6.5 93 2 B K H > S+ 0 0 152 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.932 128.5 52.4 -60.9 -42.1 -21.9 -17.7 9.7 94 3 B L H > S+ 0 0 4 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.923 109.8 48.6 -59.0 -41.8 -18.9 -19.9 10.3 95 4 B E H > S+ 0 0 8 -55,-0.4 4,-2.7 2,-0.2 5,-0.2 0.897 107.0 55.2 -66.1 -37.7 -17.6 -19.1 6.8 96 5 B E H X S+ 0 0 96 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.905 107.2 51.1 -63.4 -37.4 -18.1 -15.3 7.4 97 6 B H H X S+ 0 0 31 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.937 109.2 50.0 -68.7 -39.1 -15.9 -15.6 10.5 98 7 B L H X S+ 0 0 2 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.956 113.4 45.7 -58.7 -50.3 -13.2 -17.4 8.6 99 8 B E H X S+ 0 0 53 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.878 110.0 55.5 -58.9 -40.2 -13.3 -14.7 5.9 100 9 B G H X S+ 0 0 7 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.925 106.9 49.5 -59.8 -42.9 -13.3 -12.0 8.6 101 10 B I H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.912 112.3 47.7 -61.9 -44.9 -10.1 -13.5 10.1 102 11 B V H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.902 109.9 54.4 -61.4 -41.1 -8.5 -13.4 6.7 103 12 B N H X S+ 0 0 25 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.870 106.9 49.1 -60.0 -42.4 -9.7 -9.9 6.2 104 13 B I H X S+ 0 0 7 -4,-2.1 4,-1.1 2,-0.2 -1,-0.2 0.901 109.6 51.8 -67.0 -41.8 -8.1 -8.6 9.5 105 14 B F H >X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 3,-0.6 0.943 111.9 48.2 -54.7 -45.6 -4.8 -10.3 8.5 106 15 B H H 3X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.829 101.2 62.0 -70.9 -31.4 -5.0 -8.5 5.2 107 16 B Q H 3< S+ 0 0 19 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.816 116.3 34.5 -64.5 -26.2 -5.8 -5.1 6.7 108 17 B Y H X< S+ 0 0 24 -4,-1.1 3,-1.0 -3,-0.6 4,-0.5 0.843 117.8 51.1 -86.3 -44.2 -2.4 -5.4 8.4 109 18 B S H 3< S+ 0 0 0 -4,-2.7 8,-0.5 1,-0.2 3,-0.4 0.857 103.2 58.2 -66.7 -39.2 -0.5 -7.2 5.6 110 19 B V T 3< S+ 0 0 1 -4,-2.5 -1,-0.2 1,-0.2 -3,-0.1 0.615 90.5 77.7 -61.8 -18.1 -1.4 -4.8 2.8 111 20 B R S < S- 0 0 49 -3,-1.0 2,-0.3 -5,-0.2 -1,-0.2 0.937 101.8 -1.7 -70.7 -50.7 0.1 -1.8 4.6 112 21 B K S S- 0 0 58 -4,-0.5 5,-0.3 -3,-0.4 -1,-0.1 -0.825 108.5 -0.2-136.8 168.5 3.9 -2.1 4.1 113 22 B G S S+ 0 0 57 -2,-0.3 2,-0.3 2,-0.1 5,-0.0 -0.134 119.9 10.0 60.3-136.3 6.5 -4.3 2.5 114 23 B H S > S- 0 0 107 1,-0.1 3,-1.5 2,-0.0 -2,-0.2 -0.573 77.0-130.8 -76.2 134.9 5.0 -7.4 0.8 115 24 B F T 3 S+ 0 0 64 -2,-0.3 -1,-0.1 1,-0.3 -4,-0.1 0.603 101.5 45.0 -61.2 -18.3 1.2 -7.2 0.6 116 25 B D T 3 S+ 0 0 31 -7,-0.1 45,-0.5 -6,-0.1 2,-0.3 0.161 108.5 55.2-117.8 13.6 0.6 -10.6 2.0 117 26 B T < - 0 0 24 -3,-1.5 2,-0.3 -8,-0.5 -5,-0.2 -0.904 60.2-152.9-134.9 167.3 2.9 -10.7 5.0 118 27 B L E -B 159 0B 0 41,-2.0 41,-2.7 -2,-0.3 -9,-0.1 -0.996 25.0-107.9-137.0 151.3 3.6 -8.7 8.1 119 28 B S E > -B 158 0B 14 -2,-0.3 4,-2.4 39,-0.2 39,-0.2 -0.219 31.6-111.7 -69.0 163.9 6.7 -8.2 10.2 120 29 B K H > S+ 0 0 5 37,-1.3 4,-2.1 35,-0.4 36,-0.2 0.883 121.7 58.0 -61.7 -36.7 7.0 -9.6 13.7 121 30 B G H > S+ 0 0 19 34,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.935 108.4 44.1 -55.8 -50.6 6.8 -6.0 14.9 122 31 B E H > S+ 0 0 14 33,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.856 109.1 56.7 -62.4 -38.2 3.4 -5.6 13.2 123 32 B L H X S+ 0 0 1 -4,-2.4 4,-3.2 1,-0.2 -1,-0.2 0.896 105.4 51.6 -61.7 -40.5 2.2 -9.0 14.5 124 33 B K H X S+ 0 0 65 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.844 108.6 51.5 -57.7 -39.2 2.9 -7.8 18.1 125 34 B Q H X S+ 0 0 115 -4,-1.4 4,-2.0 2,-0.2 5,-0.3 0.884 111.8 46.6 -65.8 -41.2 0.9 -4.7 17.3 126 35 B L H X>S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 5,-0.8 0.948 113.5 49.1 -66.1 -44.4 -2.0 -6.9 16.1 127 36 B L H X5S+ 0 0 18 -4,-3.2 4,-1.2 1,-0.2 8,-0.2 0.933 113.8 45.0 -60.3 -46.2 -1.6 -9.2 19.1 128 37 B T H <5S+ 0 0 85 -4,-2.7 -1,-0.2 2,-0.1 -2,-0.2 0.850 125.9 29.6 -70.2 -37.8 -1.7 -6.3 21.6 129 38 B K H ><5S+ 0 0 112 -4,-2.0 3,-0.7 -5,-0.2 -2,-0.2 0.926 125.7 36.8 -88.2 -54.9 -4.6 -4.5 20.0 130 39 B E H 3<5S+ 0 0 19 -4,-2.6 -125,-0.4 -5,-0.3 -128,-0.3 0.719 126.4 38.0 -78.4 -20.4 -6.8 -7.0 18.3 131 40 B L T >X S- 0 0 79 1,-0.1 4,-2.4 0, 0.0 5,-0.2 -0.785 79.6-103.4-132.0 169.5 -1.2 -13.6 30.7 138 47 B I H > S+ 0 0 142 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.886 115.7 55.3 -53.3 -48.0 2.4 -15.0 30.8 139 48 B K H > S+ 0 0 157 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.926 111.0 41.9 -60.1 -47.9 1.2 -18.5 30.0 140 49 B D H > S+ 0 0 33 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.862 114.5 51.3 -70.8 -36.4 -0.6 -17.6 26.8 141 50 B K H X S+ 0 0 96 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.858 106.7 57.0 -63.9 -32.2 2.1 -15.2 25.7 142 51 B A H X S+ 0 0 50 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.870 103.4 51.9 -63.6 -40.9 4.6 -18.1 26.3 143 52 B V H X S+ 0 0 59 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.943 113.0 46.3 -61.9 -45.6 2.6 -20.4 23.9 144 53 B I H X S+ 0 0 2 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.928 109.4 52.8 -63.6 -45.5 2.9 -17.6 21.3 145 54 B D H <>S+ 0 0 72 -4,-2.8 5,-4.0 1,-0.2 4,-0.3 0.834 106.0 54.9 -57.6 -35.5 6.6 -17.0 22.0 146 55 B E H ><5S+ 0 0 134 -4,-2.0 3,-0.8 3,-0.2 -1,-0.2 0.921 110.7 45.8 -64.1 -45.5 7.3 -20.7 21.4 147 56 B I H 3<5S+ 0 0 57 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.837 119.7 38.8 -64.4 -40.5 5.6 -20.6 18.0 148 57 B F T 3<5S- 0 0 9 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.219 111.2-113.1 -99.7 15.8 7.3 -17.4 16.9 149 58 B Q T < 5S- 0 0 143 -3,-0.8 -3,-0.2 -4,-0.3 -4,-0.1 0.874 92.4 -26.8 53.7 41.4 10.7 -18.1 18.4 150 59 B G > < - 0 0 22 -5,-4.0 3,-1.7 -6,-0.2 -5,-0.1 0.729 69.3-135.2 80.3 104.4 10.1 -15.2 20.8 151 60 B L T 3 S+ 0 0 6 1,-0.3 -27,-0.2 -10,-0.2 -28,-0.1 0.795 103.0 57.3 -67.4 -26.7 7.7 -12.7 19.2 152 61 B D T 3 S+ 0 0 104 -28,-0.1 3,-0.4 2,-0.0 2,-0.3 0.482 91.6 87.2 -73.7 -14.2 10.0 -9.8 20.4 153 62 B A S < S+ 0 0 41 -3,-1.7 4,-0.1 1,-0.2 -33,-0.0 -0.713 97.4 2.5 -96.1 146.7 13.1 -11.1 18.6 154 63 B N S > S- 0 0 109 -2,-0.3 3,-2.2 1,-0.1 -34,-0.3 0.921 71.4-176.9 48.5 56.9 14.1 -10.3 15.0 155 64 B Q T 3 S+ 0 0 65 -3,-0.4 -34,-2.6 1,-0.3 -35,-0.4 0.576 72.8 66.4 -71.1 -8.4 11.1 -8.0 14.7 156 65 B D T 3 S+ 0 0 148 -37,-0.2 -1,-0.3 -36,-0.2 -2,-0.1 0.641 75.9 112.5 -76.8 -20.6 11.9 -7.4 11.0 157 66 B E S < S- 0 0 101 -3,-2.2 -37,-1.3 -38,-0.1 2,-0.2 -0.313 70.3-122.7 -58.7 136.5 11.2 -11.0 10.1 158 67 B Q E -B 119 0B 91 -39,-0.2 2,-0.4 -38,-0.1 -39,-0.2 -0.551 19.4-157.4 -85.4 143.0 8.2 -11.5 7.9 159 68 B V E -B 118 0B 4 -41,-2.7 -41,-2.0 -2,-0.2 2,-0.1 -0.961 10.1-152.9-118.1 130.0 5.2 -13.7 9.0 160 69 B D > - 0 0 72 -2,-0.4 4,-2.3 -43,-0.2 3,-0.2 -0.400 35.3 -92.1 -98.2-179.4 2.9 -15.2 6.4 161 70 B F H > S+ 0 0 6 -45,-0.5 4,-2.3 1,-0.2 5,-0.1 0.856 122.9 58.5 -59.6 -37.5 -0.8 -16.3 6.7 162 71 B Q H > S+ 0 0 83 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.924 109.5 44.3 -60.3 -45.3 0.1 -19.9 7.6 163 72 B E H >> S+ 0 0 83 1,-0.2 4,-1.2 2,-0.2 3,-0.7 0.901 109.4 55.7 -65.3 -43.3 2.1 -18.6 10.7 164 73 B F H 3X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 3,-0.3 0.889 99.4 62.4 -56.4 -33.5 -0.7 -16.2 11.6 165 74 B I H 3X S+ 0 0 5 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.871 97.0 57.4 -58.0 -37.3 -3.0 -19.3 11.6 166 75 B S H X S+ 0 0 23 -4,-2.3 4,-0.9 2,-0.2 3,-0.6 0.950 110.2 51.0 -69.9 -46.8 -13.0 -21.1 24.4 177 86 B Y H >< S+ 0 0 184 -4,-2.6 3,-1.0 1,-0.2 4,-0.2 0.893 105.9 59.3 -57.1 -37.2 -11.5 -21.5 27.8 178 87 B H H >X S+ 0 0 111 -4,-2.4 3,-2.0 1,-0.3 4,-0.6 0.880 94.0 62.1 -60.4 -37.2 -12.8 -18.1 28.7 179 88 B T H << S+ 0 0 55 -4,-1.2 -1,-0.3 -3,-0.6 3,-0.2 0.797 106.7 47.7 -62.6 -27.1 -16.4 -19.1 28.1 180 89 B H T << S+ 0 0 80 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.341 86.4 89.6-100.1 11.6 -16.0 -21.6 30.9 181 90 B K T <4 0 0 71 -3,-2.0 -1,-0.2 -4,-0.2 -2,-0.2 0.905 360.0 360.0 -66.1 -47.0 -14.4 -19.2 33.4 182 91 B E < 0 0 207 -4,-0.6 0, 0.0 -3,-0.2 0, 0.0 -0.528 360.0 360.0 -88.1 360.0 -17.7 -18.1 34.9 183 !* 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 0.0 184 0 C S 0 0 114 0, 0.0 2,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -52.5 -7.9 6.8 18.4 185 1 C T > - 0 0 26 132,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.651 360.0-114.2 -85.8 166.0 -11.0 9.0 18.1 186 2 C K H > S+ 0 0 152 -2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.887 118.1 51.5 -62.1 -42.1 -14.2 7.3 17.0 187 3 C L H > S+ 0 0 4 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.931 110.0 49.2 -57.6 -47.7 -14.2 9.4 13.8 188 4 C E H > S+ 0 0 14 129,-0.4 4,-2.6 1,-0.2 -2,-0.2 0.867 108.2 54.5 -60.4 -36.3 -10.7 8.3 13.1 189 5 C E H X S+ 0 0 99 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.895 108.6 48.2 -66.5 -37.7 -11.6 4.7 13.7 190 6 C H H X S+ 0 0 37 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.886 110.4 51.2 -67.8 -39.3 -14.4 4.9 11.2 191 7 C L H X S+ 0 0 2 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.941 113.2 45.2 -63.4 -44.7 -12.1 6.5 8.6 192 8 C E H X S+ 0 0 56 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.886 108.9 57.7 -65.8 -39.2 -9.5 3.7 9.1 193 9 C G H X S+ 0 0 7 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.875 105.0 50.1 -55.7 -39.1 -12.4 1.2 9.0 194 10 C I H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.922 111.4 48.3 -68.3 -44.5 -13.3 2.4 5.5 195 11 C V H X S+ 0 0 0 -4,-1.8 4,-3.1 1,-0.2 -2,-0.2 0.943 110.8 52.9 -55.6 -47.6 -9.6 2.1 4.3 196 12 C N H X S+ 0 0 16 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.866 107.6 49.4 -58.3 -41.5 -9.5 -1.3 5.8 197 13 C I H X S+ 0 0 10 -4,-1.9 4,-1.2 2,-0.2 -1,-0.2 0.928 110.9 49.7 -68.3 -43.4 -12.6 -2.5 3.9 198 14 C F H >X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 3,-0.8 0.955 112.9 47.8 -56.5 -49.7 -11.2 -1.1 0.7 199 15 C H H 3X S+ 0 0 0 -4,-3.1 4,-2.6 1,-0.2 -2,-0.2 0.860 101.3 63.6 -62.4 -34.7 -7.9 -3.0 1.4 200 16 C Q H 3< S+ 0 0 22 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.799 116.4 31.4 -61.2 -30.6 -9.6 -6.2 2.3 201 17 C Y H X< S+ 0 0 12 -4,-1.2 3,-1.3 -3,-0.8 4,-0.5 0.832 117.6 54.8 -84.5 -44.7 -10.9 -6.3 -1.4 202 18 C S H 3< S+ 0 0 0 -4,-3.0 8,-0.4 1,-0.3 3,-0.4 0.848 102.3 58.8 -62.7 -33.1 -7.9 -4.5 -3.0 203 19 C V T 3< S+ 0 0 2 -4,-2.6 -1,-0.3 1,-0.2 -3,-0.1 0.676 90.2 76.3 -69.3 -17.7 -5.4 -7.0 -1.6 204 20 C R S < S+ 0 0 40 -3,-1.3 2,-0.2 -5,-0.2 -1,-0.2 0.878 100.8 1.9 -71.8 -48.5 -7.0 -10.0 -3.2 205 21 C K S S- 0 0 57 -4,-0.5 5,-0.2 -3,-0.4 -117,-0.1 -0.811 108.9 -3.7-136.7 171.6 -6.0 -10.0 -6.9 206 22 C G S S+ 0 0 57 -2,-0.2 2,-0.3 2,-0.1 5,-0.1 -0.066 120.4 9.7 48.1-128.4 -3.9 -8.0 -9.4 207 23 C H S > S- 0 0 102 1,-0.1 3,-1.1 2,-0.0 -2,-0.3 -0.569 74.8-133.7 -81.7 140.0 -2.4 -4.9 -7.8 208 24 C F T 3 S+ 0 0 65 -2,-0.3 -1,-0.1 1,-0.2 -4,-0.1 0.639 99.5 47.0 -71.9 -20.8 -2.8 -4.8 -4.0 209 25 C D T 3 S+ 0 0 29 -6,-0.1 45,-0.4 -7,-0.1 2,-0.3 0.259 110.6 48.3-109.2 13.6 -3.9 -1.3 -3.7 210 26 C T < - 0 0 24 -3,-1.1 2,-0.3 -8,-0.4 -5,-0.2 -0.919 63.8-149.7-137.3 167.5 -6.5 -1.1 -6.5 211 27 C L E -C 252 0C 0 41,-1.9 41,-3.4 -2,-0.3 -9,-0.1 -0.956 23.4-106.1-133.9 157.4 -9.5 -3.2 -7.6 212 28 C S E > -C 251 0C 7 -2,-0.3 4,-2.4 39,-0.3 39,-0.2 -0.323 33.0-112.8 -68.9 157.8 -11.3 -4.0 -10.8 213 29 C K H > S+ 0 0 51 37,-1.5 4,-2.7 34,-0.4 5,-0.2 0.905 120.0 56.3 -59.5 -42.2 -14.7 -2.4 -11.6 214 30 C G H > S+ 0 0 21 34,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.934 110.2 44.2 -50.8 -50.9 -16.2 -6.0 -11.4 215 31 C E H > S+ 0 0 18 33,-0.4 4,-2.6 1,-0.2 -2,-0.2 0.874 111.6 52.5 -65.3 -41.7 -14.8 -6.3 -7.8 216 32 C L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.916 106.8 52.9 -60.6 -40.4 -15.9 -2.8 -6.8 217 33 C K H X S+ 0 0 100 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.916 110.6 48.5 -60.2 -42.4 -19.4 -3.6 -8.0 218 34 C Q H X S+ 0 0 113 -4,-1.8 4,-1.8 -5,-0.2 5,-0.3 0.925 111.0 50.8 -63.7 -42.3 -19.4 -6.7 -5.8 219 35 C L H X S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.2 5,-0.3 0.937 114.1 42.4 -58.3 -51.8 -18.1 -4.6 -2.9 220 36 C L H X S+ 0 0 2 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.918 111.8 54.2 -65.2 -42.9 -20.8 -2.0 -3.2 221 37 C T H < S+ 0 0 60 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.844 121.5 30.6 -62.3 -35.7 -23.5 -4.5 -3.8 222 38 C K H >< S+ 0 0 110 -4,-1.8 3,-1.1 -5,-0.2 4,-0.2 0.906 121.9 44.8 -87.0 -51.2 -22.6 -6.4 -0.6 223 39 C E H 3< S+ 0 0 28 -4,-3.3 59,-0.5 -5,-0.3 56,-0.2 0.670 124.4 34.3 -77.2 -18.6 -21.3 -3.8 1.7 224 40 C L T 3X S+ 0 0 5 -4,-1.8 4,-3.3 -5,-0.3 5,-0.3 0.028 78.1 127.2-117.8 23.9 -24.0 -1.2 1.0 225 41 C A H <> S+ 0 0 46 -3,-1.1 4,-1.5 1,-0.2 -2,-0.1 0.809 82.4 36.9 -49.3 -41.6 -26.8 -3.8 0.5 226 42 C N H > S+ 0 0 35 2,-0.2 4,-2.4 -4,-0.2 -1,-0.2 0.867 112.4 55.3 -82.0 -45.0 -29.0 -2.0 3.1 227 43 C T H > S+ 0 0 15 1,-0.2 4,-1.0 2,-0.2 -2,-0.2 0.913 112.1 48.1 -51.0 -46.9 -28.0 1.6 2.2 228 44 C I H >< S+ 0 0 36 -4,-3.3 3,-0.5 1,-0.2 -2,-0.2 0.897 108.5 51.9 -61.6 -47.3 -29.1 0.6 -1.3 229 45 C K H 3< S+ 0 0 141 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.896 110.2 50.6 -54.5 -41.2 -32.4 -0.9 -0.2 230 46 C N H 3< S+ 0 0 46 -4,-2.4 2,-0.5 2,-0.0 -1,-0.2 0.690 87.5 96.4 -77.5 -21.5 -33.1 2.3 1.7 231 47 C I << + 0 0 26 -4,-1.0 37,-0.0 -3,-0.5 36,-0.0 -0.600 45.6 178.0 -69.8 120.1 -32.4 4.6 -1.3 232 48 C K + 0 0 121 -2,-0.5 2,-0.7 1,-0.1 -1,-0.1 0.470 57.7 85.4-100.4 -3.8 -35.7 5.5 -3.1 233 49 C D >> - 0 0 92 1,-0.2 3,-1.5 2,-0.0 4,-1.2 -0.881 63.5-157.1-106.9 111.2 -34.1 7.8 -5.7 234 50 C K H 3> S+ 0 0 156 -2,-0.7 4,-3.0 1,-0.3 5,-0.2 0.813 90.2 65.8 -46.8 -41.2 -32.9 5.9 -8.7 235 51 C A H 3> S+ 0 0 73 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.813 99.6 51.6 -57.1 -32.8 -30.5 8.7 -9.6 236 52 C V H <> S+ 0 0 34 -3,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.963 112.3 44.2 -71.6 -49.3 -28.5 8.1 -6.4 237 53 C I H X S+ 0 0 47 -4,-1.2 4,-2.2 1,-0.2 -2,-0.2 0.942 113.2 52.4 -59.1 -45.2 -28.1 4.3 -7.1 238 54 C D H X S+ 0 0 84 -4,-3.0 4,-1.2 1,-0.2 -1,-0.2 0.892 107.9 52.0 -57.1 -41.5 -27.2 5.1 -10.8 239 55 C E H < S+ 0 0 116 -4,-1.9 3,-0.3 -5,-0.2 -1,-0.2 0.903 109.6 48.4 -64.1 -40.0 -24.6 7.5 -9.6 240 56 C I H < S+ 0 0 3 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.914 121.7 34.4 -64.1 -39.0 -22.9 5.0 -7.3 241 57 C F H < S+ 0 0 44 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.406 77.2 143.4-102.1 -0.3 -22.9 2.3 -10.0 242 58 C Q S < S- 0 0 159 -4,-1.2 -3,-0.0 -3,-0.3 -4,-0.0 -0.171 75.9 -6.4 -53.0 129.1 -22.3 4.3 -13.2 243 59 C G 0 0 46 1,-0.1 5,-0.0 3,-0.0 4,-0.0 -0.017 360.0 360.0 61.6 176.1 -20.0 2.2 -15.5 244 60 C L 0 0 28 3,-0.0 -27,-0.1 -28,-0.0 4,-0.1 0.739 360.0 360.0 114.1 360.0 -18.7 -1.0 -13.7 245 ! 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 0.0 246 62 C A 0 0 108 0, 0.0 2,-0.3 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0-147.2 -17.2 -1.0 -19.7 247 63 C N > - 0 0 96 1,-0.2 3,-1.1 2,-0.1 -34,-0.4 -0.307 360.0-165.4 -60.1 110.2 -14.1 -3.1 -18.9 248 64 C Q T 3 S+ 0 0 95 -2,-0.3 -34,-2.6 1,-0.2 -33,-0.4 0.594 91.0 57.7 -70.1 -9.4 -15.0 -4.9 -15.6 249 65 C D T 3 S+ 0 0 121 -37,-0.2 -1,-0.2 -36,-0.2 -2,-0.1 0.540 79.0 114.4 -90.8 -10.1 -11.2 -5.6 -15.4 250 66 C E S < S- 0 0 50 -3,-1.1 -37,-1.5 -38,-0.1 2,-0.2 -0.360 71.1-114.6 -64.2 140.1 -10.3 -1.9 -15.5 251 67 C Q E -C 212 0C 81 -39,-0.2 2,-0.4 -38,-0.1 -39,-0.3 -0.461 23.3-161.2 -82.9 143.4 -8.7 -0.8 -12.1 252 68 C V E -C 211 0C 8 -41,-3.4 -41,-1.9 -2,-0.2 2,-0.1 -0.977 13.8-147.7-121.0 136.0 -10.2 1.7 -9.7 253 69 C D > - 0 0 68 -2,-0.4 4,-2.1 -43,-0.2 3,-0.3 -0.404 30.9 -95.6-102.9 177.3 -8.0 3.4 -7.1 254 70 C F H > S+ 0 0 8 -45,-0.4 4,-2.6 1,-0.2 5,-0.1 0.881 120.4 58.6 -61.2 -37.4 -8.6 4.7 -3.6 255 71 C Q H > S+ 0 0 85 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.916 107.7 46.4 -58.8 -38.8 -9.4 8.3 -4.7 256 72 C E H > S+ 0 0 96 -3,-0.3 4,-1.2 1,-0.2 -1,-0.2 0.887 109.4 55.9 -69.7 -39.3 -12.3 7.0 -7.0 257 73 C F H >X S+ 0 0 1 -4,-2.1 4,-2.8 1,-0.2 3,-0.6 0.921 100.9 57.8 -55.7 -47.4 -13.5 4.9 -4.1 258 74 C I H 3X S+ 0 0 4 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.920 101.8 55.3 -47.0 -49.7 -13.7 8.1 -1.9 259 75 C S H 3X S+ 0 0 68 -4,-1.4 4,-1.2 1,-0.2 -1,-0.2 0.842 111.0 44.4 -55.5 -37.8 -16.1 9.6 -4.4 260 76 C L H < S+ 0 0 147 -4,-2.5 3,-1.3 1,-0.2 4,-0.3 0.910 105.0 57.2 -53.0 -44.0 -30.5 11.6 4.2 271 87 C H H >< S+ 0 0 58 -4,-2.5 3,-1.6 1,-0.3 -1,-0.2 0.853 96.5 62.3 -66.1 -29.8 -32.1 8.3 5.4 272 88 C T H 3< S+ 0 0 76 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.798 100.3 55.2 -63.7 -25.5 -31.7 9.3 9.0 273 89 C H T << S+ 0 0 83 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.416 79.6 133.6 -89.3 3.2 -34.1 12.2 8.3 274 90 C K < 0 0 147 -3,-1.6 -3,-0.0 -4,-0.3 -4,-0.0 -0.208 360.0 360.0 -47.3 139.1 -36.8 9.9 6.9 275 91 C E 0 0 256 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.173 360.0 360.0 -79.9 360.0 -40.3 10.7 8.3 276 !* 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 0.0 277 -1 D G 0 0 105 0, 0.0 -51,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 117.8 -28.3 -6.7 9.1 278 0 D S - 0 0 73 1,-0.1 -54,-0.1 4,-0.1 -55,-0.0 0.020 360.0-135.5 -40.9 123.3 -25.9 -3.6 8.9 279 1 D T > - 0 0 24 -56,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.284 25.1-104.9 -80.2 166.2 -22.5 -4.3 7.4 280 2 D K H > S+ 0 0 72 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.953 123.2 51.2 -56.3 -43.4 -19.2 -3.0 8.8 281 3 D L H > S+ 0 0 3 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.910 109.5 49.5 -59.2 -41.6 -19.0 -0.4 6.0 282 4 D E H > S+ 0 0 9 -59,-0.5 4,-2.7 1,-0.2 -1,-0.2 0.880 106.7 56.4 -64.7 -43.6 -22.6 0.8 6.8 283 5 D E H X S+ 0 0 86 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.865 105.9 51.1 -53.0 -42.9 -21.6 1.0 10.5 284 6 D H H X S+ 0 0 12 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.924 110.7 47.2 -63.7 -44.5 -18.8 3.4 9.6 285 7 D L H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.929 112.1 51.2 -59.8 -42.7 -21.1 5.6 7.5 286 8 D E H X S+ 0 0 123 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.914 110.2 50.6 -59.7 -39.0 -23.6 5.5 10.5 287 9 D G H X S+ 0 0 9 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.868 107.5 51.0 -71.7 -38.0 -20.8 6.5 12.8 288 10 D I H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.933 112.4 47.2 -65.4 -43.9 -19.6 9.5 10.7 289 11 D V H X S+ 0 0 5 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.905 110.0 54.8 -57.3 -44.0 -23.2 10.8 10.6 290 12 D N H X S+ 0 0 99 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.893 107.9 48.0 -58.4 -46.4 -23.5 10.2 14.4 291 13 D I H X S+ 0 0 8 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.903 110.8 50.7 -66.0 -43.7 -20.5 12.3 15.1 292 14 D F H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 3,-0.4 0.932 111.9 48.2 -54.7 -47.5 -21.7 15.2 12.8 293 15 D H H X S+ 0 0 32 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.882 100.5 64.8 -68.9 -36.6 -25.0 15.1 14.6 294 16 D Q H < S+ 0 0 78 -4,-2.6 -1,-0.2 1,-0.2 4,-0.2 0.886 114.3 33.7 -46.5 -43.2 -23.3 15.1 18.0 295 17 D Y H >< S+ 0 0 10 -4,-1.4 3,-1.1 -3,-0.4 4,-0.4 0.881 115.3 55.5 -79.5 -42.2 -22.0 18.6 17.1 296 18 D S H >< S+ 0 0 0 -4,-2.6 3,-0.6 1,-0.3 8,-0.4 0.847 104.2 52.5 -66.3 -35.1 -25.0 19.9 15.0 297 19 D V T 3< S+ 0 0 68 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.1 0.606 85.5 88.1 -77.0 -11.0 -27.7 19.4 17.6 298 20 D R T < S- 0 0 142 -3,-1.1 2,-0.3 -5,-0.2 -1,-0.2 0.862 101.7 -13.0 -60.6 -40.2 -25.8 21.3 20.4 299 21 D K S < S+ 0 0 130 -3,-0.6 -1,-0.1 -4,-0.4 2,-0.0 -0.968 109.4 2.3-154.2 168.1 -27.2 24.7 19.5 300 22 D G S S+ 0 0 79 -2,-0.3 2,-0.2 -3,-0.1 5,-0.1 -0.262 113.8 23.5 58.9-126.0 -29.1 26.8 16.8 301 23 D H S S- 0 0 114 1,-0.1 3,-0.5 2,-0.0 -2,-0.3 -0.465 73.0-135.3 -75.5 144.4 -30.2 24.6 13.9 302 24 D F S S+ 0 0 131 1,-0.2 -1,-0.1 -2,-0.2 -4,-0.1 0.856 99.5 35.3 -63.0 -41.6 -30.6 20.9 14.5 303 25 D D S S+ 0 0 44 -6,-0.1 45,-0.4 -8,-0.0 2,-0.3 0.254 112.7 54.0-109.7 9.2 -28.8 19.8 11.3 304 26 D T - 0 0 28 -3,-0.5 2,-0.3 -8,-0.4 43,-0.2 -0.876 59.8-155.0-133.1 167.5 -26.0 22.4 10.8 305 27 D L E -D 346 0D 0 41,-2.0 41,-2.7 -2,-0.3 -9,-0.1 -0.973 27.4-101.7-138.5 150.7 -23.2 23.9 12.9 306 28 D S E > -D 345 0D 8 -2,-0.3 4,-2.6 39,-0.2 39,-0.2 -0.330 33.5-112.2 -64.4 153.5 -21.3 27.1 12.8 307 29 D K H > S+ 0 0 34 37,-1.9 4,-2.6 34,-0.3 36,-0.2 0.895 120.8 55.7 -47.1 -42.8 -17.8 27.3 11.2 308 30 D G H > S+ 0 0 15 34,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.906 108.2 46.2 -60.4 -45.9 -16.5 27.9 14.8 309 31 D E H > S+ 0 0 16 33,-0.4 4,-2.2 1,-0.2 -2,-0.2 0.891 112.0 51.8 -64.0 -40.0 -18.1 24.7 16.0 310 32 D L H X S+ 0 0 2 -4,-2.6 4,-3.1 2,-0.2 5,-0.3 0.898 103.5 56.3 -64.5 -39.9 -16.7 22.9 13.0 311 33 D K H X S+ 0 0 67 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.930 111.1 46.4 -56.7 -41.6 -13.2 24.1 13.6 312 34 D Q H X S+ 0 0 118 -4,-1.5 4,-2.1 2,-0.2 5,-0.3 0.852 109.7 52.5 -66.6 -44.9 -13.6 22.6 17.1 313 35 D L H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.4 0.952 114.0 43.0 -54.5 -55.8 -15.0 19.3 15.8 314 36 D L H X S+ 0 0 2 -4,-3.1 4,-1.7 1,-0.2 -2,-0.2 0.915 112.2 54.1 -60.1 -41.6 -12.1 18.9 13.3 315 37 D T H < S+ 0 0 74 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.884 122.0 28.4 -60.3 -42.3 -9.5 19.9 16.0 316 38 D K H >< S+ 0 0 131 -4,-2.1 3,-1.2 -5,-0.1 4,-0.2 0.936 123.7 43.5 -86.2 -50.4 -10.7 17.3 18.4 317 39 D E H 3< S+ 0 0 18 -4,-3.0 -129,-0.4 -5,-0.3 -3,-0.2 0.631 124.8 34.7 -81.1 -14.9 -12.1 14.5 16.3 318 40 D L T 3X S+ 0 0 6 -4,-1.7 4,-2.9 -5,-0.4 5,-0.3 -0.012 76.8 127.4-118.2 29.1 -9.2 14.5 13.8 319 41 D A H <> S+ 0 0 43 -3,-1.2 4,-2.1 1,-0.2 -2,-0.1 0.885 79.9 39.6 -56.7 -43.8 -6.4 15.4 16.2 320 42 D N H > S+ 0 0 44 -4,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.869 111.9 54.5 -75.1 -39.2 -4.3 12.4 15.1 321 43 D T H > S+ 0 0 15 2,-0.2 4,-0.7 1,-0.2 -2,-0.2 0.922 112.7 46.4 -55.6 -45.6 -5.1 12.6 11.3 322 44 D I H >< S+ 0 0 34 -4,-2.9 3,-1.0 1,-0.2 -2,-0.2 0.924 108.8 53.3 -63.9 -51.8 -3.9 16.3 11.5 323 45 D K H 3< S+ 0 0 147 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.882 110.6 49.5 -47.6 -42.9 -0.8 15.4 13.5 324 46 D N H 3< S+ 0 0 61 -4,-2.0 2,-0.5 -5,-0.1 -1,-0.2 0.593 86.4 98.8 -80.6 -14.0 0.1 12.8 10.7 325 47 D I << - 0 0 24 -3,-1.0 37,-0.0 -4,-0.7 36,-0.0 -0.680 46.2-177.7 -77.5 125.3 -0.3 15.1 7.7 326 48 D K + 0 0 107 -2,-0.5 2,-0.6 5,-0.0 -1,-0.1 0.388 54.4 96.3-102.1 -3.2 3.1 16.5 6.6 327 49 D D >> - 0 0 84 1,-0.1 4,-1.3 2,-0.0 3,-1.1 -0.854 59.5-156.8 -96.0 113.4 1.6 18.7 3.7 328 50 D K H 3> S+ 0 0 180 -2,-0.6 4,-2.2 1,-0.2 3,-0.2 0.866 93.1 57.5 -43.9 -49.6 1.1 22.4 4.7 329 51 D A H 3> S+ 0 0 62 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.750 103.0 52.4 -65.0 -26.7 -1.5 22.8 2.0 330 52 D V H <> S+ 0 0 31 -3,-1.1 4,-2.7 2,-0.2 -1,-0.2 0.822 107.3 48.9 -83.1 -36.7 -3.7 20.0 3.2 331 53 D I H X S+ 0 0 51 -4,-1.3 4,-2.6 -3,-0.2 -2,-0.2 0.947 112.4 51.1 -64.9 -43.6 -4.0 21.3 6.8 332 54 D D H < S+ 0 0 114 -4,-2.2 4,-0.4 1,-0.2 -2,-0.2 0.921 109.8 51.5 -52.3 -46.0 -4.8 24.7 5.2 333 55 D E H >< S+ 0 0 100 -4,-1.6 3,-1.1 1,-0.2 -2,-0.2 0.923 108.8 48.5 -60.7 -45.9 -7.4 22.8 3.2 334 56 D I H 3< S+ 0 0 2 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.923 120.7 37.1 -65.0 -37.9 -9.0 21.2 6.2 335 57 D F T >< S+ 0 0 46 -4,-2.6 3,-1.6 -5,-0.1 -1,-0.3 0.316 85.6 142.8 -95.7 10.8 -9.2 24.5 8.1 336 58 D Q T < S- 0 0 147 -3,-1.1 -3,-0.1 -4,-0.4 -4,-0.0 -0.240 74.9 -4.6 -59.9 132.2 -10.0 26.7 5.1 337 59 D G T > S+ 0 0 23 1,-0.1 3,-1.1 2,-0.0 -1,-0.3 0.348 95.6 118.9 75.5 -4.2 -12.4 29.5 5.7 338 60 D L T < S+ 0 0 9 -3,-1.6 -27,-0.2 1,-0.3 -2,-0.1 0.534 71.2 49.4 -81.5 -8.1 -13.1 28.5 9.3 339 61 D D T 3 S+ 0 0 110 -4,-0.2 2,-0.6 2,-0.1 3,-0.4 0.443 94.3 85.7 -99.6 -5.3 -11.8 31.7 11.0 340 62 D A S < S- 0 0 52 -3,-1.1 4,-0.1 1,-0.3 -33,-0.1 -0.856 112.7 -13.4-103.1 121.3 -13.8 34.0 8.8 341 63 D N S > S- 0 0 114 -2,-0.6 3,-2.0 1,-0.1 -34,-0.3 0.987 75.1-170.7 47.7 65.1 -17.5 34.6 9.9 342 64 D Q T 3 S+ 0 0 81 -3,-0.4 -34,-2.6 1,-0.3 -33,-0.4 0.591 76.2 64.2 -63.8 -14.1 -17.3 31.8 12.4 343 65 D D T 3 S+ 0 0 131 -37,-0.2 -1,-0.3 -36,-0.2 -2,-0.1 0.603 76.4 111.1 -86.2 -9.3 -21.0 32.0 13.1 344 66 D E S < S- 0 0 100 -3,-2.0 -37,-1.9 -4,-0.1 2,-0.2 -0.340 74.1-108.8 -65.2 144.6 -22.0 31.1 9.5 345 67 D Q E -D 306 0D 73 -39,-0.2 2,-0.4 -38,-0.1 -39,-0.2 -0.499 25.9-161.4 -88.8 145.7 -23.6 27.7 9.2 346 68 D V E -D 305 0D 7 -41,-2.7 -41,-2.0 -2,-0.2 2,-0.1 -0.982 12.4-153.7-125.2 132.0 -22.1 24.6 7.7 347 69 D D > - 0 0 71 -2,-0.4 4,-1.8 -43,-0.2 5,-0.2 -0.372 32.5 -94.1-106.8 178.4 -24.1 21.6 6.5 348 70 D F H > S+ 0 0 7 -45,-0.4 4,-2.4 1,-0.2 5,-0.2 0.901 119.3 58.3 -63.0 -37.6 -23.6 17.9 6.0 349 71 D Q H > S+ 0 0 93 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.926 108.6 46.8 -60.1 -45.3 -22.7 18.1 2.3 350 72 D E H > S+ 0 0 96 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.874 109.6 53.8 -62.1 -33.9 -19.8 20.4 3.3 351 73 D F H X S+ 0 0 2 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.872 101.8 59.3 -71.9 -32.7 -18.8 18.1 6.0 352 74 D I H X S+ 0 0 6 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.911 100.8 55.9 -58.3 -41.2 -18.7 15.2 3.5 353 75 D S H X S+ 0 0 72 -4,-1.4 4,-1.6 1,-0.2 -1,-0.2 0.873 109.6 45.2 -58.3 -43.1 -16.0 17.3 1.6 354 76 D L H X S+ 0 0 26 -4,-1.2 4,-2.7 -3,-0.2 -2,-0.2 0.912 110.2 54.0 -68.4 -43.4 -13.9 17.4 4.8 355 77 D V H X S+ 0 0 10 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.901 107.5 52.4 -53.5 -41.9 -14.5 13.6 5.4 356 78 D A H X S+ 0 0 22 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.903 109.6 47.6 -66.9 -40.1 -13.2 12.9 1.9 357 79 D I H X S+ 0 0 28 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.949 113.2 49.1 -62.9 -47.7 -10.0 14.9 2.5 358 80 D A H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.862 108.1 54.4 -61.1 -37.0 -9.5 13.1 5.8 359 81 D L H X S+ 0 0 1 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.888 106.6 50.3 -63.4 -45.3 -10.1 9.7 4.1 360 82 D K H X S+ 0 0 122 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.918 113.6 45.6 -58.7 -45.2 -7.4 10.4 1.5 361 83 D A H X S+ 0 0 18 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.902 111.5 52.4 -65.6 -43.8 -4.9 11.4 4.3 362 84 D A H X S+ 0 0 18 -4,-2.7 4,-1.4 2,-0.2 -2,-0.2 0.946 110.5 48.4 -59.2 -47.8 -5.9 8.3 6.5 363 85 D H H >X S+ 0 0 25 -4,-2.6 3,-0.8 1,-0.2 4,-0.7 0.961 109.5 50.9 -56.5 -55.7 -5.3 6.0 3.5 364 86 D Y H >< S+ 0 0 188 -4,-2.3 3,-1.2 1,-0.2 -1,-0.2 0.896 108.9 53.1 -48.6 -42.5 -1.8 7.5 2.7 365 87 D H H >< S+ 0 0 71 -4,-2.0 3,-1.8 1,-0.3 -1,-0.2 0.794 95.4 67.9 -69.4 -27.1 -0.8 7.1 6.4 366 88 D T H << S+ 0 0 10 -4,-1.4 -1,-0.3 -3,-0.8 -2,-0.2 0.754 101.2 49.9 -63.0 -21.4 -1.7 3.4 6.4 367 89 D H T << S+ 0 0 44 -3,-1.2 2,-0.3 -4,-0.7 -1,-0.3 0.213 78.2 132.1-103.0 12.3 1.2 2.8 4.0 368 90 D K < 0 0 141 -3,-1.8 -3,-0.0 1,-0.1 -257,-0.0 -0.523 360.0 360.0 -69.0 127.3 3.8 4.7 6.0 369 91 D E 0 0 167 -2,-0.3 -1,-0.1 -257,-0.0 -2,-0.0 -0.308 360.0 360.0 -76.7 360.0 6.9 2.6 6.3