==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 20-APR-05 1ZFS . COMPND 2 MOLECULE: S-100 PROTEIN, ALPHA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR N.T.WRIGHT,K.M.VARNEY,D.J.WEBER . 186 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10894.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 139 74.7 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 . 6 3.2 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 . 10 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 55.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 4 0 0 0 0 2 0 0 0 2 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 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 G 0 0 78 0, 0.0 4,-0.3 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 168.4 61.5 13.4 -6.5 2 2 A S > + 0 0 47 1,-0.1 4,-4.3 2,-0.1 5,-0.2 0.152 360.0 107.7-105.8 16.6 63.2 12.8 -3.1 3 3 A E H > S+ 0 0 89 2,-0.2 4,-0.6 1,-0.2 102,-0.2 0.950 89.3 34.9 -60.8 -46.8 62.0 9.2 -2.9 4 4 A L H >> S+ 0 0 26 2,-0.2 4,-1.0 -3,-0.2 3,-0.5 0.913 121.8 48.1 -74.4 -40.1 65.4 7.8 -3.5 5 5 A E H >> S+ 0 0 45 -4,-0.3 4,-1.8 1,-0.3 3,-0.8 0.919 107.3 56.1 -65.2 -40.0 67.0 10.7 -1.6 6 6 A T H 3X S+ 0 0 56 -4,-4.3 4,-1.7 1,-0.3 -1,-0.3 0.751 98.3 64.7 -63.3 -22.0 64.5 10.1 1.2 7 7 A A H X S+ 0 0 38 -4,-1.8 3,-0.8 2,-0.1 4,-0.7 0.769 121.4 60.8-102.3 -34.7 69.6 4.0 18.2 19 19 A S G >< S+ 0 0 0 -4,-1.4 3,-0.6 -5,-0.5 4,-0.2 0.906 111.0 41.3 -61.3 -40.0 73.3 4.3 17.6 20 20 A G G 34 S+ 0 0 25 -4,-0.3 -1,-0.3 -5,-0.2 3,-0.2 0.509 100.7 75.4 -86.1 -2.1 73.5 7.5 19.7 21 21 A K G <4 S+ 0 0 132 -3,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.732 94.6 49.2 -80.5 -20.4 71.2 6.0 22.3 22 22 A E S << S- 0 0 98 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.540 112.3-118.2 -94.4 -6.6 74.0 3.8 23.6 23 23 A G S S+ 0 0 56 -4,-0.2 2,-3.4 -3,-0.2 3,-0.3 -0.127 92.0 105.4 96.0 -38.9 76.4 6.7 23.9 24 24 A D + 0 0 22 1,-0.2 3,-0.4 2,-0.1 -1,-0.1 -0.363 37.9 151.1 -72.7 70.0 78.9 5.1 21.5 25 25 A K + 0 0 137 -2,-3.4 -1,-0.2 1,-0.2 -5,-0.1 0.622 64.8 57.9 -79.5 -11.9 77.7 7.7 18.9 26 26 A Y S S+ 0 0 172 -3,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.652 116.2 27.4 -92.2 -15.4 81.1 7.6 17.1 27 27 A K S S- 0 0 53 -3,-0.4 -1,-0.2 -8,-0.2 43,-0.2 -1.000 78.6-123.8-144.9 145.6 81.0 3.8 16.5 28 28 A L E -A 69 0A 1 41,-1.8 41,-1.1 -2,-0.3 2,-0.3 -0.385 28.5-152.0 -82.5 166.9 78.1 1.3 16.0 29 29 A S E > -A 68 0A 38 39,-0.2 4,-1.8 1,-0.1 5,-0.3 -0.887 29.0-102.5-137.1 167.6 77.9 -1.8 18.2 30 30 A K H > S+ 0 0 87 37,-1.1 4,-1.1 -2,-0.3 38,-0.1 0.894 121.3 44.2 -59.2 -40.1 76.5 -5.4 18.0 31 31 A K H > S+ 0 0 114 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.851 107.5 59.4 -75.7 -33.0 73.4 -4.6 20.0 32 32 A E H > S+ 0 0 1 1,-0.2 4,-1.4 2,-0.2 3,-0.4 0.961 107.5 43.8 -61.6 -50.0 72.7 -1.3 18.2 33 33 A L H X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 5,-0.3 0.856 106.7 62.9 -65.2 -31.4 72.3 -2.9 14.7 34 34 A K H X S+ 0 0 49 -4,-1.1 4,-1.8 -5,-0.3 -1,-0.2 0.906 104.1 48.2 -60.0 -40.0 70.2 -5.7 16.3 35 35 A D H X S+ 0 0 28 -4,-1.5 4,-1.3 -3,-0.4 -1,-0.2 0.881 107.2 55.7 -68.6 -40.4 67.6 -3.1 17.2 36 36 A L H X>S+ 0 0 4 -4,-1.4 4,-1.4 2,-0.2 5,-0.7 0.903 113.6 38.2 -63.6 -41.2 67.6 -1.5 13.8 37 37 A L H X5S+ 0 0 8 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.917 117.7 47.6 -79.0 -41.8 66.7 -4.7 11.9 38 38 A Q H <5S+ 0 0 54 -4,-1.8 4,-0.2 -5,-0.3 -1,-0.2 0.730 110.2 58.1 -70.4 -19.8 64.3 -6.1 14.4 39 39 A T H <5S- 0 0 46 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.975 131.9 -5.5 -76.4 -58.0 62.6 -2.8 14.6 40 40 A E H <5S+ 0 0 18 -4,-1.4 3,-0.2 -5,-0.2 4,-0.2 0.698 139.1 42.9-111.0 -28.1 61.5 -2.2 11.0 41 41 A L S X> + 0 0 86 1,-0.2 3,-1.4 2,-0.1 4,-0.9 -0.691 63.6 174.0-103.2 83.9 67.4 -16.3 15.3 51 51 A A H 3> S+ 0 0 65 -2,-1.0 4,-1.1 -3,-0.3 3,-0.4 0.826 82.3 62.3 -60.0 -24.1 69.8 -14.5 17.6 52 52 A D H 3> S+ 0 0 100 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.853 93.5 64.0 -69.0 -28.9 72.5 -16.7 16.1 53 53 A A H <> S+ 0 0 26 -3,-1.4 4,-1.6 1,-0.2 -1,-0.2 0.860 100.5 50.4 -63.2 -33.3 71.7 -15.0 12.8 54 54 A V H X S+ 0 0 8 -4,-0.9 4,-1.8 -3,-0.4 -1,-0.2 0.822 106.8 53.9 -75.8 -29.0 72.9 -11.7 14.3 55 55 A D H X S+ 0 0 93 -4,-1.1 4,-1.3 2,-0.2 -2,-0.2 0.929 112.4 44.1 -68.9 -42.0 76.2 -13.2 15.5 56 56 A K H X S+ 0 0 116 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.873 111.5 53.8 -67.1 -40.1 76.9 -14.5 12.0 57 57 A I H X S+ 0 0 44 -4,-1.6 4,-1.1 -5,-0.2 -1,-0.2 0.901 111.3 44.1 -66.8 -40.0 75.9 -11.3 10.3 58 58 A M H X S+ 0 0 20 -4,-1.8 4,-4.9 1,-0.2 -1,-0.2 0.792 102.1 69.7 -75.3 -26.0 78.3 -9.2 12.5 59 59 A K H < S+ 0 0 118 -4,-1.3 6,-0.2 1,-0.2 -1,-0.2 0.942 99.9 46.4 -58.9 -43.9 81.0 -11.7 12.0 60 60 A E H >< S+ 0 0 113 -4,-1.3 3,-0.7 1,-0.2 -1,-0.2 0.926 120.8 40.3 -64.1 -40.0 81.3 -10.7 8.3 61 61 A L H 3< S+ 0 0 10 -4,-1.1 2,-1.0 1,-0.2 3,-0.5 0.975 119.0 43.9 -71.5 -56.2 81.3 -7.1 9.3 62 62 A D T >< + 0 0 7 -4,-4.9 3,-4.5 1,-0.2 -1,-0.2 -0.110 68.6 143.6 -81.9 42.4 83.5 -7.5 12.4 63 63 A E T < S+ 0 0 165 -2,-1.0 -1,-0.2 -3,-0.7 -2,-0.1 0.826 73.3 60.8 -52.1 -22.9 85.9 -9.7 10.4 64 64 A N T 3 S- 0 0 134 -3,-0.5 -1,-0.3 -4,-0.1 -2,-0.1 0.586 114.2-124.3 -79.8 -8.8 88.4 -7.8 12.6 65 65 A G < + 0 0 66 -3,-4.5 -2,-0.1 -6,-0.2 -3,-0.1 0.887 67.4 137.9 69.1 34.8 86.6 -9.3 15.7 66 66 A D - 0 0 56 2,-0.3 3,-0.1 -4,-0.1 -1,-0.1 0.463 59.2-138.0 -92.0 -0.1 86.1 -5.8 17.1 67 67 A G S S+ 0 0 35 -5,-0.2 -37,-1.1 1,-0.2 2,-0.3 0.629 80.7 90.9 55.0 5.1 82.5 -6.5 18.3 68 68 A E E -A 29 0A 65 -39,-0.2 2,-0.3 -38,-0.1 -2,-0.3 -0.931 67.2-147.9-129.7 151.9 81.9 -3.0 16.9 69 69 A V E -A 28 0A 0 -41,-1.1 -41,-1.8 -2,-0.3 -7,-0.1 -0.899 17.2-138.9-122.2 150.6 80.9 -2.0 13.3 70 70 A D - 0 0 84 -2,-0.3 2,-3.8 -43,-0.2 -1,-0.0 0.181 39.7-127.4 -91.8 18.9 81.8 1.1 11.3 71 71 A F S > S+ 0 0 23 1,-0.2 4,-1.9 3,-0.0 -1,-0.1 -0.012 102.6 75.6 62.6 -42.3 78.2 1.3 10.0 72 72 A Q H > S+ 0 0 83 -2,-3.8 4,-1.4 1,-0.2 -1,-0.2 0.934 92.2 51.6 -65.5 -40.1 79.6 1.4 6.4 73 73 A E H > S+ 0 0 53 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.914 108.4 54.7 -60.1 -40.0 80.3 -2.3 6.6 74 74 A F H > S+ 0 0 15 1,-0.2 4,-1.8 2,-0.2 5,-0.4 0.918 102.0 53.8 -61.1 -48.5 76.7 -2.9 7.7 75 75 A V H X S+ 0 0 22 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.901 109.2 48.6 -59.9 -39.8 75.0 -1.1 4.8 76 76 A V H X S+ 0 0 48 -4,-1.4 4,-1.4 2,-0.2 -1,-0.2 0.904 112.7 47.0 -69.2 -40.0 76.8 -3.1 2.2 77 77 A L H X S+ 0 0 29 -4,-1.6 4,-1.6 1,-0.2 -2,-0.2 0.986 119.9 35.1 -67.8 -57.5 76.1 -6.6 3.8 78 78 A V H X S+ 0 0 14 -4,-1.8 4,-1.9 1,-0.2 5,-0.4 0.773 110.4 66.4 -70.1 -22.5 72.3 -6.2 4.5 79 79 A A H X S+ 0 0 16 -4,-1.2 4,-1.5 -5,-0.4 -1,-0.2 0.966 107.2 38.5 -63.4 -49.0 71.8 -4.1 1.3 80 80 A A H X S+ 0 0 22 -4,-1.4 4,-1.7 -5,-0.2 -2,-0.2 0.866 115.0 53.2 -70.2 -38.3 72.6 -7.1 -0.9 81 81 A L H X S+ 0 0 84 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.947 113.3 40.6 -66.7 -46.8 70.8 -9.7 1.2 82 82 A T H X S+ 0 0 12 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.915 113.3 54.1 -69.4 -40.1 67.4 -8.0 1.4 83 83 A V H X S+ 0 0 8 -4,-1.5 4,-1.3 -5,-0.4 -1,-0.2 0.928 107.4 52.1 -60.0 -41.1 67.5 -6.8 -2.2 84 84 A A H X S+ 0 0 46 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.896 103.5 58.3 -62.2 -39.9 68.1 -10.5 -3.2 85 85 A C H X S+ 0 0 45 -4,-1.5 4,-1.3 1,-0.2 5,-0.2 0.912 100.9 55.1 -59.9 -41.2 65.0 -11.6 -1.2 86 86 A N H X S+ 0 0 60 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.922 109.1 47.5 -60.1 -40.1 62.7 -9.3 -3.2 87 87 A N H X S+ 0 0 74 -4,-1.3 4,-3.1 1,-0.2 -1,-0.2 0.786 100.1 69.6 -71.6 -24.7 63.8 -10.9 -6.4 88 88 A F H X S+ 0 0 126 -4,-1.4 4,-1.1 1,-0.2 -1,-0.2 0.946 104.2 40.1 -60.0 -45.3 63.4 -14.4 -4.9 89 89 A F H < S+ 0 0 127 -4,-1.3 4,-0.4 -3,-0.2 -1,-0.2 0.883 117.5 49.7 -71.1 -36.4 59.6 -13.9 -4.9 90 90 A W H >< S+ 0 0 180 -4,-1.4 3,-0.7 -5,-0.2 -2,-0.2 0.862 102.0 62.3 -70.8 -34.3 59.7 -12.3 -8.3 91 91 A E H 3< S+ 0 0 154 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.908 110.4 38.5 -60.2 -40.2 61.8 -15.1 -9.8 92 92 A N T 3< 0 0 99 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.518 360.0 360.0 -88.6 -2.4 59.1 -17.7 -9.1 93 93 A S < 0 0 157 -3,-0.7 -1,-0.1 -4,-0.4 -2,-0.1 -0.133 360.0 360.0 75.5 360.0 56.4 -15.2 -10.1 94 !* 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 95 1 B G 0 0 75 0, 0.0 4,-0.3 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 167.6 58.6 2.4 12.4 96 2 B S > + 0 0 47 1,-0.1 4,-4.3 2,-0.1 5,-0.2 0.154 360.0 107.6-106.1 16.6 58.8 1.8 8.6 97 3 B E H > S+ 0 0 88 2,-0.2 4,-0.6 1,-0.2 -86,-0.2 0.950 89.3 34.9 -60.9 -46.7 61.4 4.6 8.1 98 4 B L H >> S+ 0 0 25 2,-0.2 4,-1.0 -3,-0.2 3,-0.5 0.913 121.8 48.0 -74.4 -40.1 64.2 2.1 7.4 99 5 B E H >> S+ 0 0 43 -4,-0.3 4,-1.8 1,-0.3 3,-0.8 0.918 107.3 56.2 -65.4 -39.9 61.7 -0.3 5.7 100 6 B T H 3X S+ 0 0 56 -4,-4.3 4,-1.7 1,-0.3 -1,-0.3 0.751 98.3 64.7 -63.3 -21.8 60.4 2.6 3.7 101 7 B A H X S+ 0 0 17 -4,-1.7 4,-2.1 2,-0.2 3,-0.5 0.975 110.0 45.1 -71.8 -54.4 61.4 3.7 -2.2 105 11 B L H 3X S+ 0 0 36 -4,-1.4 4,-1.4 1,-0.2 -1,-0.2 0.869 114.2 53.5 -60.0 -29.1 64.7 2.9 -4.0 106 12 B I H 3X S+ 0 0 24 -4,-1.2 4,-1.4 -5,-0.2 -1,-0.2 0.857 108.4 48.9 -71.9 -34.1 63.0 -0.2 -5.4 107 13 B N H X S+ 0 0 38 -4,-1.9 3,-0.8 2,-0.1 4,-0.7 0.768 121.4 60.9-102.5 -34.5 62.9 4.1 -14.9 113 19 B S G >< S+ 0 0 0 -4,-1.4 3,-0.6 -5,-0.5 4,-0.2 0.905 111.0 41.2 -61.4 -40.0 64.3 0.6 -15.3 114 20 B G G 34 S+ 0 0 26 -4,-0.3 -1,-0.3 -5,-0.2 3,-0.2 0.506 100.7 75.4 -86.2 -2.0 61.0 -0.7 -16.8 115 21 B K G <4 S+ 0 0 133 -3,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.730 94.7 49.2 -80.7 -20.2 60.6 2.5 -18.8 116 22 B E S << S- 0 0 99 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.541 112.3-118.2 -94.5 -6.5 63.3 1.3 -21.3 117 23 B G S S+ 0 0 56 -4,-0.2 2,-3.4 -3,-0.2 3,-0.3 -0.126 92.0 105.4 95.9 -38.7 61.6 -2.1 -21.8 118 24 B D + 0 0 23 1,-0.2 3,-0.4 2,-0.1 -1,-0.1 -0.365 38.0 151.1 -72.7 70.0 64.7 -3.9 -20.4 119 25 B K + 0 0 134 -2,-3.4 -1,-0.2 1,-0.2 -5,-0.1 0.621 64.8 57.9 -79.5 -11.8 62.8 -4.6 -17.2 120 26 B Y S S+ 0 0 165 -3,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.656 116.2 27.5 -92.0 -16.0 64.8 -7.8 -16.5 121 27 B K S S- 0 0 53 -3,-0.4 -1,-0.2 -8,-0.2 43,-0.2 -1.000 78.6-123.8-144.5 145.3 68.2 -6.0 -16.5 122 28 B L E -B 163 0B 3 41,-1.8 41,-1.1 -2,-0.3 2,-0.3 -0.381 28.6-151.7 -82.2 166.9 69.3 -2.5 -15.7 123 29 B S E > -B 162 0B 38 39,-0.2 4,-1.8 1,-0.1 5,-0.3 -0.880 28.9-102.4-136.1 168.9 71.3 -0.4 -18.3 124 30 B K H > S+ 0 0 86 37,-1.1 4,-1.1 -2,-0.3 38,-0.1 0.896 121.3 44.0 -60.1 -40.5 73.9 2.4 -18.4 125 31 B K H > S+ 0 0 112 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.849 107.5 59.6 -76.0 -32.8 71.3 5.1 -19.2 126 32 B E H > S+ 0 0 2 1,-0.2 4,-1.4 2,-0.2 3,-0.4 0.961 107.5 43.7 -61.5 -50.0 68.7 3.9 -16.7 127 33 B L H X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 5,-0.3 0.854 106.7 62.8 -65.2 -31.5 71.0 4.3 -13.7 128 34 B K H X S+ 0 0 50 -4,-1.1 4,-1.8 -5,-0.3 -1,-0.2 0.908 104.2 48.3 -59.9 -40.0 72.1 7.7 -15.0 129 35 B D H X S+ 0 0 27 -4,-1.5 4,-1.2 -3,-0.4 -1,-0.2 0.873 107.2 55.6 -68.8 -39.0 68.4 8.9 -14.7 130 36 B L H X>S+ 0 0 5 -4,-1.4 4,-1.4 2,-0.2 5,-0.7 0.902 113.6 38.3 -65.3 -40.8 68.0 7.6 -11.1 131 37 B L H X5S+ 0 0 8 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.919 117.7 47.6 -79.0 -41.9 71.0 9.5 -9.7 132 38 B Q H <5S+ 0 0 56 -4,-1.8 4,-0.2 -5,-0.3 -1,-0.2 0.731 110.2 58.1 -70.0 -20.0 70.6 12.8 -11.7 133 39 B T H <5S- 0 0 47 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.976 131.9 -5.6 -76.2 -58.2 66.9 12.7 -10.7 134 40 B E H <5S+ 0 0 18 -4,-1.4 3,-0.2 -5,-0.2 4,-0.2 0.698 139.1 42.9-110.9 -27.9 67.0 12.7 -6.9 135 41 B L S X> + 0 0 85 1,-0.2 3,-1.4 2,-0.1 4,-0.9 -0.691 63.6 173.9-103.3 83.7 80.3 14.9 -15.2 145 51 B A H 3> S+ 0 0 64 -2,-1.0 4,-1.1 -3,-0.3 3,-0.4 0.827 82.3 62.2 -60.1 -24.1 79.1 12.4 -17.8 146 52 B D H 3> S+ 0 0 97 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.855 93.6 64.0 -68.9 -29.3 82.6 10.9 -17.5 147 53 B A H <> S+ 0 0 25 -3,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.864 100.5 50.4 -62.3 -34.3 81.7 10.2 -13.9 148 54 B V H X S+ 0 0 8 -4,-0.9 4,-1.8 -3,-0.4 -1,-0.2 0.822 106.9 53.8 -75.1 -29.0 78.9 7.8 -15.0 149 55 B D H X S+ 0 0 90 -4,-1.1 4,-1.3 2,-0.2 -2,-0.2 0.928 112.4 44.2 -69.3 -41.8 81.2 5.9 -17.4 150 56 B K H X S+ 0 0 118 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.875 111.5 53.8 -67.3 -40.0 83.7 5.3 -14.5 151 57 B I H X S+ 0 0 44 -4,-1.7 4,-1.1 -5,-0.2 -1,-0.2 0.898 111.3 44.2 -66.7 -40.0 80.9 4.3 -12.1 152 58 B M H X S+ 0 0 23 -4,-1.8 4,-4.9 1,-0.2 -1,-0.2 0.794 102.1 69.7 -75.5 -26.0 79.5 1.7 -14.4 153 59 B K H < S+ 0 0 119 -4,-1.3 6,-0.2 1,-0.2 -1,-0.2 0.942 99.9 46.4 -58.8 -43.9 82.9 0.4 -15.1 154 60 B E H >< S+ 0 0 112 -4,-1.3 3,-0.7 1,-0.2 -1,-0.2 0.926 120.8 40.3 -64.2 -40.0 83.3 -1.0 -11.6 155 61 B L H 3< S+ 0 0 9 -4,-1.1 2,-1.1 1,-0.2 3,-0.5 0.975 119.0 43.9 -71.5 -56.3 79.8 -2.5 -11.9 156 62 B D T >< + 0 0 7 -4,-4.9 3,-4.5 1,-0.2 -1,-0.2 -0.111 68.5 143.8 -81.9 42.6 80.1 -3.6 -15.5 157 63 B E T < S+ 0 0 163 -2,-1.1 -1,-0.2 -3,-0.7 -2,-0.1 0.824 73.3 60.8 -52.4 -22.6 83.6 -5.0 -14.7 158 64 B N T 3 S- 0 0 137 -3,-0.5 -1,-0.3 -4,-0.1 -2,-0.1 0.584 114.2-124.2 -79.9 -8.8 82.4 -7.7 -17.2 159 65 B G < + 0 0 64 -3,-4.5 -2,-0.1 -6,-0.2 -3,-0.1 0.887 67.4 137.8 69.1 35.0 82.0 -4.9 -19.9 160 66 B D - 0 0 55 2,-0.3 3,-0.1 -4,-0.1 -1,-0.1 0.463 59.3-138.0 -92.2 -0.0 78.3 -5.9 -20.4 161 67 B G S S+ 0 0 32 -5,-0.2 -37,-1.1 1,-0.2 2,-0.3 0.630 80.7 91.1 54.8 5.4 77.2 -2.2 -20.6 162 68 B E E -B 123 0B 63 -39,-0.2 2,-0.3 -38,-0.1 -2,-0.3 -0.931 67.1-147.9-129.6 151.9 74.4 -3.6 -18.4 163 69 B V E -B 122 0B 0 -41,-1.1 -41,-1.8 -2,-0.3 -7,-0.1 -0.900 17.2-139.0-122.2 150.5 74.1 -3.8 -14.6 164 70 B D - 0 0 85 -2,-0.3 2,-3.8 -43,-0.2 -1,-0.0 0.182 39.7-127.5 -91.7 18.7 72.3 -6.4 -12.4 165 71 B F S > S+ 0 0 22 1,-0.2 4,-1.9 3,-0.0 -1,-0.1 -0.014 102.6 75.6 62.7 -42.5 71.1 -3.6 -10.1 166 72 B Q H > S+ 0 0 84 -2,-3.8 4,-1.4 1,-0.2 -1,-0.2 0.934 92.2 51.7 -65.4 -40.0 72.6 -5.4 -7.2 167 73 B E H > S+ 0 0 52 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.915 108.4 54.7 -60.1 -40.0 76.1 -4.3 -8.2 168 74 B F H > S+ 0 0 15 1,-0.2 4,-1.8 2,-0.2 5,-0.4 0.919 102.0 53.6 -61.2 -48.4 74.7 -0.7 -8.3 169 75 B V H X S+ 0 0 23 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.904 109.2 48.9 -60.0 -40.0 73.3 -0.6 -4.8 170 76 B V H X S+ 0 0 47 -4,-1.4 4,-1.4 2,-0.2 -1,-0.2 0.904 112.7 46.7 -68.6 -40.0 76.6 -1.6 -3.2 171 77 B L H X S+ 0 0 27 -4,-1.6 4,-1.6 1,-0.2 -2,-0.2 0.986 119.9 35.1 -68.3 -57.5 78.8 0.9 -5.1 172 78 B V H X S+ 0 0 15 -4,-1.8 4,-1.8 1,-0.2 5,-0.4 0.773 110.4 66.5 -70.1 -22.4 76.7 4.1 -4.6 173 79 B A H X S+ 0 0 16 -4,-1.2 4,-1.5 -5,-0.4 -1,-0.2 0.967 107.2 38.4 -63.1 -49.4 75.7 3.0 -1.1 174 80 B A H X S+ 0 0 23 -4,-1.4 4,-1.7 -5,-0.2 -2,-0.2 0.865 115.0 53.2 -70.0 -38.4 79.2 3.3 0.2 175 81 B L H X S+ 0 0 84 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.947 113.3 40.5 -66.7 -46.8 80.2 6.5 -1.8 176 82 B T H X S+ 0 0 11 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.914 113.3 54.2 -69.5 -40.1 77.2 8.6 -0.6 177 83 B V H X S+ 0 0 9 -4,-1.5 4,-1.3 -5,-0.4 -1,-0.2 0.928 107.4 52.0 -60.0 -41.0 77.3 7.4 3.0 178 84 B A H X S+ 0 0 46 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.897 103.5 58.3 -62.3 -39.8 81.0 8.4 3.1 179 85 B C H X S+ 0 0 46 -4,-1.5 4,-1.3 1,-0.2 3,-0.2 0.913 100.9 55.2 -60.1 -41.3 80.1 11.9 1.8 180 86 B N H X S+ 0 0 62 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.921 109.1 47.4 -60.1 -40.1 77.7 12.5 4.8 181 87 B N H X S+ 0 0 76 -4,-1.3 4,-3.1 1,-0.2 -1,-0.2 0.786 100.1 69.6 -71.7 -24.5 80.6 11.7 7.2 182 88 B F H X S+ 0 0 126 -4,-1.4 4,-1.1 -3,-0.2 -1,-0.2 0.946 104.1 40.1 -60.0 -45.5 82.9 14.0 5.3 183 89 B F H < S+ 0 0 130 -4,-1.3 4,-0.4 -3,-0.2 -1,-0.2 0.883 117.5 49.7 -71.0 -36.4 81.0 17.1 6.4 184 90 B W H >< S+ 0 0 191 -4,-1.4 3,-0.7 -5,-0.2 -2,-0.2 0.861 102.1 62.4 -70.9 -34.3 80.6 15.7 9.9 185 91 B E H 3< S+ 0 0 157 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.909 110.3 38.5 -60.0 -40.5 84.3 14.8 10.2 186 92 B N T 3< 0 0 99 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.518 360.0 360.0 -88.3 -2.5 85.3 18.5 9.9 187 93 B S < 0 0 158 -3,-0.7 -1,-0.1 -4,-0.4 -2,-0.1 -0.134 360.0 360.0 75.6 360.0 82.3 19.6 12.0