==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CALCIUM BINDING PROTEIN 29-JAN-99 1B8C . COMPND 2 MOLECULE: PROTEIN (PARVALBUMIN); . SOURCE 2 ORGANISM_SCIENTIFIC: CYPRINUS CARPIO; . AUTHOR M.S.CATES,M.B.BERRY,E.L.HO,Q.LI,J.D.POTTER,G.N.PHILLIPS JR. . 216 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11103.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 134 62.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 39.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 1 1 0 1 3 0 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 84 0, 0.0 69,-0.2 0, 0.0 68,-0.1 0.000 360.0 360.0 360.0 -2.1 36.3 51.4 26.0 2 2 A F >> + 0 0 1 67,-0.4 3,-3.0 68,-0.2 4,-1.9 0.238 360.0 144.4-101.2 12.2 37.9 47.9 25.5 3 3 A A B 34 S+a 6 0A 90 1,-0.3 4,-0.1 2,-0.2 67,-0.0 -0.351 80.0 10.9 -52.5 107.7 41.2 49.2 24.1 4 4 A G T 34 S+ 0 0 81 2,-0.8 -1,-0.3 -2,-0.4 3,-0.1 0.334 119.8 71.0 102.9 -5.1 43.7 46.6 25.5 5 5 A V T <4 S+ 0 0 79 -3,-3.0 2,-0.3 1,-0.3 -2,-0.2 0.701 105.4 25.4-107.5 -36.7 41.1 44.1 26.8 6 6 A L B < S-a 3 0A 17 -4,-1.9 -2,-0.8 3,-0.0 -1,-0.3 -0.865 96.5 -90.3-123.5 159.6 39.9 42.8 23.4 7 7 A N > - 0 0 109 26,-0.3 4,-2.6 -2,-0.3 5,-0.2 -0.484 24.7-139.5 -71.1 142.0 41.6 42.6 20.1 8 8 A D H > S+ 0 0 110 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.863 106.8 54.8 -66.4 -35.5 41.0 45.7 17.9 9 9 A A H > S+ 0 0 68 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.935 110.3 45.9 -58.5 -47.3 40.7 43.3 14.9 10 10 A D H > S+ 0 0 63 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.922 112.1 49.9 -61.6 -49.6 38.0 41.4 16.8 11 11 A I H X S+ 0 0 3 -4,-2.6 4,-2.0 1,-0.2 5,-0.3 0.938 112.4 47.6 -59.2 -45.4 36.1 44.5 17.9 12 12 A A H X S+ 0 0 41 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.907 113.7 47.2 -65.8 -36.0 36.1 46.0 14.4 13 13 A A H X S+ 0 0 37 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.882 109.7 52.8 -73.8 -33.6 34.9 42.7 12.9 14 14 A A H X S+ 0 0 2 -4,-2.6 4,-0.6 2,-0.2 -2,-0.2 0.929 113.8 42.9 -65.5 -42.2 32.1 42.2 15.5 15 15 A L H >< S+ 0 0 17 -4,-2.0 3,-1.0 1,-0.2 -2,-0.2 0.873 109.3 57.7 -68.3 -40.5 30.7 45.7 14.8 16 16 A E H >< S+ 0 0 140 -4,-2.2 3,-1.2 -5,-0.3 -1,-0.2 0.892 102.4 56.8 -55.2 -39.6 31.1 45.3 11.0 17 17 A A H 3< S+ 0 0 58 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.689 116.0 33.5 -69.8 -23.9 28.9 42.2 11.3 18 18 A C T << S+ 0 0 6 -3,-1.0 -1,-0.3 -4,-0.6 5,-0.2 -0.045 78.1 120.2-121.7 31.5 26.0 44.1 12.9 19 19 A K < + 0 0 106 -3,-1.2 2,-0.4 4,-0.1 -2,-0.1 0.746 59.4 79.9 -72.1 -22.5 26.4 47.5 11.2 20 20 A A S > S- 0 0 39 -4,-0.2 3,-2.0 -3,-0.2 4,-0.1 -0.724 96.5-101.7 -86.1 132.4 22.9 47.2 9.7 21 21 A A T 3 S+ 0 0 45 -2,-0.4 -1,-0.1 1,-0.3 56,-0.1 -0.249 107.0 15.8 -48.2 138.0 20.0 48.1 11.9 22 22 A D T 3 S+ 0 0 77 -4,-0.1 114,-0.3 1,-0.1 -1,-0.3 0.461 98.4 102.4 71.2 9.4 18.2 45.0 13.2 23 23 A S < + 0 0 5 -3,-2.0 2,-0.2 -5,-0.2 -2,-0.1 0.314 51.7 118.1 -97.8 5.5 21.1 42.7 12.2 24 24 A F + 0 0 15 -6,-0.2 2,-0.3 -4,-0.1 112,-0.1 -0.551 34.3 174.9 -85.0 143.7 22.5 42.4 15.8 25 25 A N > - 0 0 28 -2,-0.2 4,-2.8 1,-0.1 5,-0.2 -0.956 22.4-150.7-143.6 119.8 22.7 39.1 17.7 26 26 A H H > S+ 0 0 33 -2,-0.3 4,-2.8 2,-0.2 5,-0.2 0.849 97.8 51.5 -67.9 -35.9 24.4 39.1 21.1 27 27 A K H > S+ 0 0 50 104,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.931 113.5 46.2 -65.8 -42.0 25.6 35.5 20.8 28 28 A A H > S+ 0 0 30 103,-0.2 4,-2.4 1,-0.2 3,-0.3 0.954 115.7 45.8 -58.9 -51.4 27.1 36.3 17.5 29 29 A F H X S+ 0 0 4 -4,-2.8 4,-2.9 1,-0.2 6,-0.3 0.881 109.5 53.6 -62.4 -43.3 28.7 39.5 18.8 30 30 A F H <>S+ 0 0 2 -4,-2.8 5,-2.4 2,-0.2 6,-2.0 0.835 113.4 42.5 -65.0 -32.2 30.0 38.0 22.0 31 31 A A H <5S+ 0 0 59 -4,-1.4 3,-0.3 -3,-0.3 -2,-0.2 0.936 117.5 44.6 -79.6 -46.8 31.9 35.3 20.1 32 32 A K H <5S+ 0 0 117 -4,-2.4 -2,-0.2 1,-0.2 -18,-0.2 0.885 113.0 50.7 -63.4 -42.0 33.2 37.5 17.4 33 33 A V T <5S- 0 0 0 -4,-2.9 -26,-0.3 -5,-0.2 -1,-0.2 0.725 118.2-116.2 -72.2 -18.3 34.3 40.2 19.8 34 34 A G T 5S+ 0 0 9 -4,-0.5 4,-0.3 -3,-0.3 -3,-0.2 0.634 81.8 117.0 94.8 20.4 36.0 37.5 21.8 35 35 A L > < + 0 0 3 -5,-2.4 3,-1.3 -6,-0.3 -4,-0.2 0.891 64.4 64.3 -84.7 -34.1 34.1 37.6 25.0 36 36 A T T 3 S+ 0 0 44 -6,-2.0 -1,-0.2 1,-0.3 -5,-0.1 0.752 103.4 47.2 -61.9 -27.3 32.6 34.1 24.9 37 37 A S T 3 S+ 0 0 97 -7,-0.3 -1,-0.3 -6,-0.2 -2,-0.1 0.506 92.1 97.9 -95.1 -7.4 36.0 32.4 25.2 38 38 A K S < S- 0 0 73 -3,-1.3 5,-0.0 -4,-0.3 -4,-0.0 -0.481 85.1 -91.9 -79.5 156.3 37.4 34.5 28.0 39 39 A S > - 0 0 53 -2,-0.1 4,-2.3 1,-0.1 3,-0.2 -0.253 33.5-112.4 -60.8 152.0 37.3 33.4 31.7 40 40 A A H > S+ 0 0 39 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.874 121.4 55.7 -54.1 -40.5 34.3 34.3 33.8 41 41 A D H > S+ 0 0 116 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.941 109.7 44.4 -58.8 -45.3 36.7 36.5 35.8 42 42 A D H > S+ 0 0 55 -3,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.789 111.9 54.8 -68.4 -26.8 37.7 38.3 32.6 43 43 A V H X S+ 0 0 0 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.885 105.1 51.9 -74.0 -36.1 34.0 38.4 31.7 44 44 A K H X S+ 0 0 90 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.859 106.2 55.1 -66.7 -35.2 33.2 40.1 35.0 45 45 A K H X S+ 0 0 138 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.907 104.4 53.7 -60.3 -43.0 35.9 42.7 34.2 46 46 A A H X S+ 0 0 0 -4,-1.5 4,-1.9 1,-0.2 -1,-0.2 0.862 106.2 54.1 -61.1 -35.4 34.2 43.5 30.9 47 47 A F H X S+ 0 0 0 -4,-1.4 4,-3.5 2,-0.2 6,-0.4 0.897 105.7 50.8 -65.1 -42.8 31.0 44.1 32.9 48 48 A A H X S+ 0 0 14 -4,-1.8 4,-0.7 1,-0.2 -2,-0.2 0.878 108.9 52.9 -66.1 -34.4 32.6 46.6 35.2 49 49 A I H < S+ 0 0 53 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.935 118.0 36.1 -63.8 -44.2 34.0 48.5 32.2 50 50 A I H < S+ 0 0 13 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.2 0.941 126.4 37.3 -73.0 -48.6 30.5 48.7 30.6 51 51 A A H < S- 0 0 17 -4,-3.5 6,-0.2 -5,-0.2 -1,-0.2 0.402 105.7-127.5 -85.4 -0.6 28.5 49.1 33.8 52 52 A Q S < S+ 0 0 154 -4,-0.7 2,-0.3 -5,-0.3 -3,-0.2 0.401 84.1 36.3 72.1 -3.6 31.3 51.3 35.2 53 53 A D S > S- 0 0 55 -6,-0.4 3,-1.9 1,-0.0 -4,-0.0 -0.858 79.9-117.4 176.4 139.2 31.3 49.1 38.3 54 54 A K T 3 S+ 0 0 143 1,-0.3 45,-0.3 -2,-0.3 -6,-0.1 0.550 115.7 49.3 -58.7 -20.3 30.9 45.5 39.5 55 55 A S T 3 S+ 0 0 84 -4,-0.1 -1,-0.3 43,-0.1 -3,-0.0 0.456 96.6 96.2 -99.2 -7.4 27.8 46.4 41.5 56 56 A G < - 0 0 14 -3,-1.9 43,-0.4 42,-0.1 2,-0.3 -0.031 62.1-137.0 -79.0-178.2 26.1 48.3 38.7 57 57 A F - 0 0 81 -6,-0.2 2,-0.8 41,-0.1 41,-0.3 -0.987 13.2-126.5-138.3 150.9 23.5 47.2 36.2 58 58 A I B -B 97 0B 5 39,-3.4 39,-2.3 -2,-0.3 2,-0.2 -0.884 36.0-161.8 -95.0 109.9 23.0 47.7 32.5 59 59 A E >> - 0 0 104 -2,-0.8 4,-2.8 37,-0.2 3,-1.7 -0.578 32.4 -93.1 -93.9 159.8 19.5 49.2 32.1 60 60 A E H 3> S+ 0 0 88 35,-0.5 4,-2.2 1,-0.3 5,-0.1 0.787 124.1 45.7 -31.8 -58.8 17.3 49.4 29.0 61 61 A D H 3> S+ 0 0 124 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.821 116.9 46.9 -67.3 -23.8 18.4 52.8 27.8 62 62 A E H X4 S+ 0 0 97 -3,-1.7 3,-0.9 2,-0.2 -2,-0.2 0.892 108.9 52.9 -83.7 -37.7 22.0 51.9 28.4 63 63 A L H >< S+ 0 0 1 -4,-2.8 3,-2.2 1,-0.3 4,-0.2 0.865 98.7 65.8 -62.6 -36.2 21.7 48.5 26.7 64 64 A K H 3< S+ 0 0 62 -4,-2.2 13,-3.4 -5,-0.3 3,-0.3 0.844 105.9 43.6 -51.4 -34.2 20.3 50.4 23.7 65 65 A L T X< S+ 0 0 76 -3,-0.9 3,-1.3 -4,-0.5 4,-0.3 0.056 77.6 124.8-102.2 22.9 23.8 52.0 23.4 66 66 A F G X + 0 0 0 -3,-2.2 3,-1.3 1,-0.3 4,-0.3 0.783 67.6 57.5 -53.6 -39.3 25.7 48.7 24.0 67 67 A L G >> S+ 0 0 3 8,-0.3 3,-1.7 -3,-0.3 4,-1.7 0.804 92.9 68.8 -68.4 -26.1 27.8 48.9 20.8 68 68 A Q G <4 S+ 0 0 64 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.602 85.7 69.4 -75.8 -4.7 29.2 52.3 21.8 69 69 A N G <4 S+ 0 0 30 -3,-1.3 -67,-0.4 -4,-0.3 -1,-0.3 0.740 108.6 36.2 -74.3 -23.5 31.1 50.6 24.6 70 70 A F T <4 S+ 0 0 9 -3,-1.7 2,-0.3 1,-0.4 -68,-0.2 0.789 137.4 14.7 -99.8 -34.5 33.3 49.0 21.9 71 71 A K S >< S- 0 0 71 -4,-1.7 3,-2.4 1,-0.1 -1,-0.4 -0.937 75.2-139.0-143.4 115.6 33.4 52.0 19.4 72 72 A A T 3 S+ 0 0 86 -2,-0.3 -1,-0.1 1,-0.3 -4,-0.1 0.800 101.1 36.8 -48.1 -43.9 32.2 55.4 20.7 73 73 A D T 3 S+ 0 0 144 -6,-0.1 -1,-0.3 -3,-0.1 -5,-0.1 -0.007 85.1 132.5-105.8 29.0 30.3 56.3 17.6 74 74 A A < - 0 0 12 -3,-2.4 -6,-0.1 1,-0.1 -55,-0.0 -0.366 66.9 -81.9 -68.9 162.5 28.9 52.9 16.8 75 75 A R - 0 0 35 1,-0.1 -8,-0.3 -8,-0.1 2,-0.2 -0.272 40.8-111.6 -69.1 151.0 25.2 52.8 16.0 76 76 A A - 0 0 43 -9,-0.1 -11,-0.2 -3,-0.1 2,-0.2 -0.495 36.0-109.7 -72.3 148.1 22.5 52.6 18.6 77 77 A L - 0 0 2 -13,-3.4 -1,-0.1 -2,-0.2 -56,-0.1 -0.510 33.9-113.6 -77.2 149.0 20.5 49.4 18.8 78 78 A T > - 0 0 39 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.261 30.6-104.6 -72.4 172.3 16.9 49.5 17.6 79 79 A D H > S+ 0 0 106 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.836 121.6 54.3 -66.0 -28.8 14.2 49.0 20.2 80 80 A G H > S+ 0 0 40 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.940 108.8 44.7 -69.3 -50.7 13.6 45.5 18.8 81 81 A E H > S+ 0 0 11 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.880 115.1 51.0 -55.0 -43.0 17.3 44.4 19.2 82 82 A T H X S+ 0 0 3 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.883 109.1 48.3 -67.5 -42.0 17.4 45.9 22.7 83 83 A K H X S+ 0 0 107 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.851 113.7 48.3 -66.1 -36.7 14.2 44.2 23.9 84 84 A T H X S+ 0 0 89 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.933 113.3 48.0 -67.6 -46.4 15.5 40.9 22.6 85 85 A F H X S+ 0 0 3 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.932 112.2 47.3 -56.2 -56.2 18.9 41.5 24.2 86 86 A L H X S+ 0 0 9 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.872 112.3 50.2 -59.2 -41.0 17.4 42.5 27.6 87 87 A K H < S+ 0 0 179 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.935 112.6 45.7 -64.9 -47.8 15.0 39.5 27.7 88 88 A A H < S+ 0 0 46 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.906 121.2 40.0 -57.9 -42.7 17.7 37.0 26.9 89 89 A G H < S+ 0 0 0 -4,-2.3 2,-2.0 -5,-0.2 3,-0.2 0.822 91.7 83.3 -80.9 -37.9 20.1 38.5 29.4 90 90 A D >< + 0 0 24 -4,-2.8 3,-0.8 1,-0.2 5,-0.2 -0.428 45.1 154.3 -78.6 73.8 17.9 39.4 32.4 91 91 A S T 3 + 0 0 94 -2,-2.0 -1,-0.2 1,-0.2 6,-0.1 0.856 69.8 55.8 -71.1 -36.7 17.8 36.0 34.2 92 92 A D T 3 S- 0 0 88 -3,-0.2 -1,-0.2 4,-0.2 -2,-0.1 0.497 105.5-130.8 -79.6 -0.6 17.2 37.4 37.7 93 93 A G < + 0 0 53 -3,-0.8 -2,-0.1 3,-0.1 -1,-0.1 0.435 68.3 128.4 75.0 4.5 14.1 39.2 36.3 94 94 A D S S- 0 0 66 2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.458 81.2-110.8 -74.4 3.3 14.8 42.7 37.7 95 95 A G S S+ 0 0 39 1,-0.3 -35,-0.5 -5,-0.2 2,-0.3 0.527 91.9 72.3 82.1 2.9 14.4 44.2 34.2 96 96 A K S S- 0 0 50 -37,-0.1 2,-0.7 -7,-0.1 -1,-0.3 -0.864 84.3-103.2-140.2 176.9 18.0 45.1 34.0 97 97 A I B +B 58 0B 2 -39,-2.3 -39,-3.4 -2,-0.3 2,-0.1 -0.895 36.1 176.6-115.3 109.3 21.4 43.3 33.5 98 98 A G > - 0 0 2 -2,-0.7 4,-2.7 -41,-0.3 5,-0.2 -0.346 49.4 -86.5 -93.5-179.1 23.7 42.8 36.5 99 99 A V H > S+ 0 0 35 -43,-0.4 4,-2.5 -45,-0.3 5,-0.2 0.838 127.6 48.1 -64.0 -36.2 27.0 41.0 36.7 100 100 A D H > S+ 0 0 120 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.957 113.7 47.3 -69.6 -47.6 25.5 37.6 37.3 101 101 A D H > S+ 0 0 4 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.897 115.9 46.6 -49.3 -50.7 23.0 38.1 34.4 102 102 A W H X S+ 0 0 3 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.924 110.8 49.4 -60.8 -53.8 25.9 39.3 32.2 103 103 A T H X S+ 0 0 19 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.887 113.5 46.4 -58.1 -45.8 28.4 36.5 33.1 104 104 A A H < S+ 0 0 56 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.904 115.0 46.9 -63.6 -45.5 25.8 33.7 32.5 105 105 A L H >< S+ 0 0 18 -4,-2.0 3,-1.1 -5,-0.3 -2,-0.2 0.869 111.2 50.2 -67.4 -39.5 24.7 35.2 29.2 106 106 A V H 3< S+ 0 0 1 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.935 114.0 45.8 -66.3 -37.8 28.2 35.8 27.9 107 107 A K T 3< 0 0 97 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.283 360.0 360.0 -88.0 10.8 29.1 32.2 28.7 108 108 A A < 0 0 95 -3,-1.1 -3,-0.1 -5,-0.1 -4,-0.0 -0.457 360.0 360.0 -81.0 360.0 25.9 30.8 27.2 109 !* 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 0.0 110 200 B A 0 0 88 0, 0.0 69,-0.2 0, 0.0 68,-0.1 0.000 360.0 360.0 360.0 -0.2 22.6 24.4 -4.0 111 201 B F >> + 0 0 2 67,-0.4 4,-2.1 68,-0.2 3,-1.3 0.084 360.0 141.4 -98.1 24.1 23.8 28.0 -4.5 112 202 B A B 34 S+c 115 0C 92 1,-0.3 4,-0.1 2,-0.2 67,-0.0 -0.554 79.2 6.8 -63.7 114.8 26.7 26.8 -6.5 113 203 B G T 34 S+ 0 0 84 2,-0.6 -1,-0.3 -2,-0.5 3,-0.1 0.196 121.9 73.7 96.8 -14.2 27.1 29.4 -9.3 114 204 B V T <4 S+ 0 0 76 -3,-1.3 2,-0.3 1,-0.2 -2,-0.2 0.847 102.5 22.3 -99.0 -43.9 24.4 31.7 -7.9 115 205 B L B < S-c 112 0C 19 -4,-2.1 -2,-0.6 1,-0.0 2,-0.2 -0.823 95.3 -84.8-120.6 163.3 26.2 33.2 -4.9 116 206 B N > - 0 0 108 26,-0.4 4,-2.9 -2,-0.3 5,-0.2 -0.464 28.5-142.7 -68.8 130.8 29.9 33.6 -4.0 117 207 B D H > S+ 0 0 118 1,-0.2 4,-2.5 -2,-0.2 5,-0.2 0.879 104.6 50.8 -61.1 -38.3 31.4 30.6 -2.3 118 208 B A H > S+ 0 0 68 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.882 111.8 49.4 -65.1 -33.5 33.5 32.8 -0.0 119 209 B D H > S+ 0 0 56 2,-0.2 4,-3.2 3,-0.2 -2,-0.2 0.934 111.7 46.4 -70.9 -48.3 30.3 34.6 0.8 120 210 B I H X S+ 0 0 5 -4,-2.9 4,-2.3 2,-0.2 5,-0.2 0.945 114.2 48.6 -58.3 -49.3 28.3 31.5 1.6 121 211 B A H X S+ 0 0 41 -4,-2.5 4,-2.7 -5,-0.2 -2,-0.2 0.927 114.5 46.4 -54.9 -46.8 31.1 30.1 3.6 122 212 B A H X S+ 0 0 34 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.867 110.2 51.6 -66.8 -41.1 31.4 33.4 5.5 123 213 B A H X S+ 0 0 2 -4,-3.2 4,-0.6 18,-0.2 -1,-0.2 0.926 114.5 44.3 -65.7 -36.4 27.7 33.8 6.1 124 214 B L H >< S+ 0 0 17 -4,-2.3 3,-1.2 -5,-0.2 -2,-0.2 0.929 108.9 56.0 -72.2 -45.1 27.6 30.2 7.6 125 215 B E H >< S+ 0 0 146 -4,-2.7 3,-1.4 1,-0.3 4,-0.2 0.897 103.3 57.3 -49.2 -43.0 30.7 30.7 9.7 126 216 B A H 3< S+ 0 0 64 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.734 114.8 34.4 -69.4 -24.1 29.1 33.7 11.3 127 217 B C T << S+ 0 0 7 -3,-1.2 5,-0.3 -4,-0.6 -1,-0.3 -0.017 78.8 120.6-116.5 29.0 26.1 31.8 12.6 128 218 B K < + 0 0 113 -3,-1.4 2,-0.2 4,-0.1 -2,-0.1 0.806 58.6 77.0 -66.0 -30.1 27.7 28.4 13.3 129 219 B A S > S- 0 0 46 -4,-0.2 3,-1.8 -3,-0.1 4,-0.2 -0.577 98.6 -97.2 -80.7 141.4 26.8 28.4 17.0 130 220 B A T 3 S+ 0 0 43 1,-0.2 -1,-0.1 -2,-0.2 56,-0.1 -0.407 108.3 16.0 -60.5 137.2 23.2 27.6 17.9 131 221 B D T 3 S+ 0 0 84 -4,-0.1 -104,-0.3 -3,-0.0 -1,-0.2 0.448 96.4 104.0 78.8 10.7 21.0 30.8 18.4 132 222 B S < + 0 0 7 -3,-1.8 2,-0.2 -5,-0.3 -2,-0.1 0.393 50.7 115.8 -96.2 1.4 23.5 33.1 16.7 133 223 B F + 0 0 14 -4,-0.2 2,-0.3 -6,-0.2 -106,-0.1 -0.462 35.1 174.8 -78.1 142.3 21.5 33.4 13.5 134 224 B N > - 0 0 29 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.959 23.3-148.5-140.2 124.1 20.1 36.7 12.3 135 225 B H H > S+ 0 0 33 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.902 97.5 52.3 -69.0 -37.5 18.4 36.7 8.9 136 226 B K H > S+ 0 0 46 -114,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.902 111.9 47.6 -63.3 -36.6 19.3 40.3 8.1 137 227 B A H > S+ 0 0 29 -115,-0.2 4,-2.4 1,-0.2 5,-0.2 0.941 114.1 46.8 -65.4 -46.6 23.0 39.6 8.9 138 228 B F H X S+ 0 0 6 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.902 109.0 53.1 -62.4 -45.1 23.0 36.4 6.8 139 229 B F H X>S+ 0 0 1 -4,-3.0 5,-2.9 2,-0.2 6,-1.2 0.924 113.3 44.0 -62.4 -42.0 21.2 38.0 3.7 140 230 B A H <5S+ 0 0 58 -4,-1.5 3,-0.2 -5,-0.2 -2,-0.2 0.948 117.7 43.4 -62.4 -55.0 23.8 40.8 3.6 141 231 B K H <5S+ 0 0 114 -4,-2.4 -18,-0.2 1,-0.2 -2,-0.2 0.893 112.1 51.5 -63.3 -42.2 26.9 38.5 4.1 142 232 B V H <5S- 0 0 0 -4,-3.0 -26,-0.4 -5,-0.2 -1,-0.2 0.769 117.6-115.8 -69.5 -20.2 25.7 35.8 1.8 143 233 B G T <5S+ 0 0 11 -4,-0.9 -3,-0.2 -5,-0.3 4,-0.1 0.684 82.1 116.7 98.6 22.7 25.2 38.5 -0.8 144 234 B L > < + 0 0 2 -5,-2.9 3,-1.6 -6,-0.3 -4,-0.2 0.877 65.3 63.1 -88.5 -35.9 21.5 38.3 -1.4 145 235 B T T 3 S+ 0 0 38 -6,-1.2 -5,-0.1 1,-0.3 -1,-0.1 0.781 103.6 49.7 -58.7 -32.9 20.5 41.8 -0.1 146 236 B S T 3 S+ 0 0 99 -7,-0.3 -1,-0.3 -6,-0.2 -2,-0.1 0.522 93.2 95.7 -88.6 -5.7 22.5 43.5 -2.9 147 237 B K S < S- 0 0 76 -3,-1.6 2,-0.1 -4,-0.1 -3,-0.0 -0.434 85.3 -96.8 -80.6 161.3 21.0 41.4 -5.6 148 238 B S > - 0 0 59 1,-0.1 4,-2.3 -2,-0.1 3,-0.4 -0.348 33.9-107.7 -72.9 157.9 18.1 42.6 -7.7 149 239 B A H > S+ 0 0 41 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.826 120.6 58.6 -54.3 -30.6 14.6 41.5 -6.8 150 240 B D H > S+ 0 0 112 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.934 109.3 41.0 -67.4 -44.5 14.7 39.3 -9.9 151 241 B D H > S+ 0 0 52 -3,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.768 111.3 58.0 -71.6 -27.2 17.7 37.3 -8.7 152 242 B V H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.876 105.7 50.6 -68.6 -35.3 16.2 37.3 -5.3 153 243 B K H X S+ 0 0 95 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.893 107.6 51.7 -66.3 -42.5 13.3 35.6 -6.8 154 244 B K H X S+ 0 0 133 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.869 108.0 53.8 -62.4 -35.2 15.5 33.0 -8.5 155 245 B A H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.898 107.6 50.0 -63.7 -41.3 17.1 32.4 -5.0 156 246 B F H X S+ 0 0 0 -4,-1.9 4,-3.5 1,-0.2 5,-0.4 0.952 108.4 52.9 -59.5 -48.0 13.6 31.8 -3.6 157 247 B A H X S+ 0 0 11 -4,-2.4 4,-1.1 1,-0.2 5,-0.5 0.884 106.7 52.4 -57.0 -41.7 12.9 29.3 -6.4 158 248 B I H < S+ 0 0 52 -4,-2.0 -1,-0.2 3,-0.2 -2,-0.2 0.926 115.8 41.3 -60.9 -42.6 16.1 27.4 -5.7 159 249 B I H < S+ 0 0 15 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.913 123.3 34.8 -74.6 -46.6 15.1 27.1 -2.0 160 250 B A H < S- 0 0 23 -4,-3.5 6,-0.2 -5,-0.1 -1,-0.2 0.499 102.2-129.7 -85.9 -0.8 11.4 26.4 -2.3 161 251 B Q S < S+ 0 0 172 -4,-1.1 2,-0.2 -5,-0.4 -3,-0.2 0.667 85.7 60.7 60.2 19.8 12.1 24.4 -5.5 162 252 B D S > S- 0 0 59 -5,-0.5 3,-2.9 -6,-0.3 -4,-0.0 -0.675 73.7-139.6 179.5 116.5 9.3 26.4 -7.1 163 253 B K T 3 S+ 0 0 147 1,-0.3 45,-0.3 -2,-0.2 -1,-0.1 0.685 114.5 44.6 -42.4 -29.8 8.6 30.1 -7.8 164 254 B S T 3 S+ 0 0 83 43,-0.1 -1,-0.3 -7,-0.1 -3,-0.0 0.361 100.0 103.1-100.6 -0.3 5.0 29.3 -6.8 165 255 B G < - 0 0 11 -3,-2.9 43,-0.5 42,-0.0 2,-0.3 -0.147 61.1-135.7 -80.4 176.1 6.1 27.4 -3.7 166 256 B F E -D 207 0D 92 -6,-0.2 2,-0.7 41,-0.2 41,-0.2 -0.975 11.5-131.2-129.2 145.2 6.2 28.2 -0.0 167 257 B I E -D 206 0D 5 39,-2.4 39,-2.5 -2,-0.3 2,-0.1 -0.899 31.7-153.6 -92.9 110.0 8.8 27.6 2.6 168 258 B E >> - 0 0 105 -2,-0.7 4,-3.1 37,-0.2 3,-0.6 -0.403 28.1-100.2 -79.7 163.4 7.0 26.1 5.6 169 259 B E H 3> S+ 0 0 69 35,-0.5 4,-1.3 1,-0.3 5,-0.1 0.848 122.5 49.0 -49.6 -49.1 8.1 26.3 9.2 170 260 B D H 34 S+ 0 0 123 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.824 116.0 44.1 -69.1 -29.0 9.7 22.9 9.3 171 261 B E H X4 S+ 0 0 106 -3,-0.6 3,-1.1 2,-0.2 -2,-0.2 0.813 107.3 58.8 -81.0 -33.8 11.6 23.6 6.1 172 262 B L H >< S+ 0 0 1 -4,-3.1 3,-1.5 1,-0.3 -2,-0.2 0.810 96.7 63.8 -62.6 -27.0 12.5 27.1 7.2 173 263 B K T 3< S+ 0 0 60 -4,-1.3 13,-3.6 1,-0.3 3,-0.3 0.796 103.3 48.0 -65.5 -28.4 14.3 25.4 10.1 174 264 B L T X S+ 0 0 74 -3,-1.1 3,-1.4 -4,-0.3 4,-0.3 0.123 75.9 123.7 -98.8 16.6 16.6 23.8 7.6 175 265 B F G X + 0 0 2 -3,-1.5 3,-1.7 1,-0.3 4,-0.3 0.815 69.3 53.8 -45.9 -49.8 17.2 27.1 5.8 176 266 B L G >> S+ 0 0 2 -3,-0.3 3,-1.7 1,-0.3 4,-1.7 0.763 94.9 69.8 -61.9 -30.1 21.0 27.0 6.2 177 267 B Q G <4 S+ 0 0 65 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.579 85.9 67.7 -74.2 -6.7 21.1 23.5 4.6 178 268 B N G <4 S+ 0 0 41 -3,-1.7 -67,-0.4 -4,-0.3 -1,-0.3 0.741 108.0 38.8 -75.3 -22.4 20.2 25.1 1.2 179 269 B F T <4 S+ 0 0 8 -3,-1.7 2,-0.3 1,-0.3 -2,-0.2 0.755 136.8 12.6 -97.7 -32.3 23.6 26.8 1.2 180 270 B K S >< S- 0 0 79 -4,-1.7 3,-2.6 1,-0.1 -1,-0.3 -0.896 74.2-138.8-148.4 116.6 25.6 23.9 2.7 181 271 B A T 3 S+ 0 0 87 -2,-0.3 -1,-0.1 1,-0.3 -4,-0.1 0.784 101.4 37.6 -46.3 -46.1 24.0 20.4 2.9 182 272 B D T 3 S+ 0 0 142 -6,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.086 83.9 131.0-102.8 22.3 25.3 19.5 6.3 183 273 B A < - 0 0 11 -3,-2.6 -6,-0.1 -7,-0.1 -55,-0.0 -0.250 68.5 -86.8 -58.4 160.0 25.0 23.0 7.9 184 274 B R - 0 0 36 1,-0.1 -8,-0.3 -8,-0.1 2,-0.2 -0.270 40.9-107.0 -67.9 160.9 23.2 23.0 11.3 185 275 B A - 0 0 41 -9,-0.1 -11,-0.2 -3,-0.1 -1,-0.1 -0.583 37.3-107.6 -76.3 146.6 19.5 23.2 11.7 186 276 B L - 0 0 2 -13,-3.6 -1,-0.1 -2,-0.2 -56,-0.1 -0.448 38.9-112.2 -65.8 149.8 18.1 26.5 13.0 187 277 B T > - 0 0 35 1,-0.1 4,-2.2 -2,-0.1 5,-0.2 -0.394 29.5-104.2 -76.1 169.8 16.9 26.2 16.5 188 278 B D H > S+ 0 0 104 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.838 122.7 54.8 -63.1 -32.4 13.2 26.5 17.1 189 279 B G H > S+ 0 0 38 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.919 109.0 45.3 -64.5 -47.5 13.8 30.0 18.5 190 280 B E H > S+ 0 0 9 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.860 113.3 51.0 -64.5 -39.1 15.6 31.2 15.4 191 281 B T H X S+ 0 0 3 -4,-2.2 4,-3.2 2,-0.2 5,-0.2 0.929 110.0 49.2 -65.3 -44.8 13.0 29.6 13.1 192 282 B K H X S+ 0 0 118 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.885 114.0 45.5 -62.5 -41.9 10.2 31.3 15.0 193 283 B T H X S+ 0 0 95 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.889 115.3 48.3 -66.5 -42.0 11.9 34.7 14.8 194 284 B F H X S+ 0 0 2 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.914 112.9 46.3 -64.8 -47.1 12.7 34.1 11.1 195 285 B L H X S+ 0 0 13 -4,-3.2 4,-2.9 1,-0.2 -2,-0.2 0.956 110.9 52.5 -63.0 -50.0 9.2 33.1 10.2 196 286 B K H < S+ 0 0 185 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.810 113.0 44.5 -57.6 -35.3 7.5 35.9 12.1 197 287 B A H < S+ 0 0 46 -4,-1.6 -1,-0.2 1,-0.1 -2,-0.2 0.845 120.2 39.7 -76.1 -34.5 9.7 38.5 10.3 198 288 B G H < S+ 0 0 0 -4,-1.9 2,-2.1 1,-0.2 3,-0.3 0.778 92.5 83.9 -88.4 -27.7 9.3 37.0 6.9 199 289 B D >< + 0 0 26 -4,-2.9 3,-0.8 1,-0.2 5,-0.2 -0.463 46.0 153.6 -85.2 70.6 5.7 36.0 6.8 200 290 B S T 3 S+ 0 0 91 -2,-2.1 -1,-0.2 1,-0.2 6,-0.1 0.859 72.7 51.2 -62.7 -41.9 4.1 39.4 5.9 201 291 B D T 3 S- 0 0 89 -3,-0.3 -1,-0.2 4,-0.2 -2,-0.1 0.462 105.3-134.6 -80.5 -1.4 1.0 37.9 4.3 202 292 B G < + 0 0 53 -3,-0.8 -2,-0.1 1,-0.1 4,-0.1 0.692 62.4 134.1 56.2 33.3 0.5 35.9 7.4 203 293 B D S S- 0 0 58 2,-0.4 -1,-0.1 1,-0.0 3,-0.1 0.312 81.7-105.6 -87.1 11.3 -0.3 32.5 6.0 204 294 B G S S+ 0 0 39 1,-0.3 -35,-0.5 -5,-0.2 2,-0.3 0.649 95.3 67.0 76.0 12.0 2.2 30.9 8.5 205 295 B K S S- 0 0 46 -37,-0.1 2,-0.6 -10,-0.1 -2,-0.4 -0.923 84.0-102.3-150.5-179.2 4.7 30.3 5.7 206 296 B I E +D 167 0D 1 -39,-2.5 -39,-2.4 -2,-0.3 2,-0.1 -0.864 35.0 176.9-118.5 105.8 7.1 32.2 3.4 207 297 B G E > -D 166 0D 2 -2,-0.6 4,-2.4 -41,-0.2 -41,-0.2 -0.319 50.9 -84.9 -91.3-176.5 6.2 32.6 -0.3 208 298 B V H > S+ 0 0 33 -43,-0.5 4,-1.9 -45,-0.3 5,-0.1 0.715 128.6 49.3 -62.1 -29.4 8.0 34.5 -3.0 209 299 B D H > S+ 0 0 120 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.918 111.5 47.8 -79.8 -43.5 6.4 37.8 -2.1 210 300 B D H > S+ 0 0 3 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.932 115.6 47.5 -51.3 -50.9 7.2 37.4 1.6 211 301 B W H X S+ 0 0 2 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.886 108.1 51.1 -61.3 -52.0 10.7 36.5 0.7 212 302 B T H X S+ 0 0 21 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.876 113.0 47.1 -63.4 -36.0 11.5 39.3 -1.7 213 303 B A H < S+ 0 0 55 -4,-1.8 4,-0.3 2,-0.2 -1,-0.2 0.926 112.4 50.5 -69.5 -43.2 10.3 41.9 0.7 214 304 B L H >< S+ 0 0 17 -4,-2.1 3,-1.0 -5,-0.2 -2,-0.2 0.914 110.4 47.3 -62.7 -45.1 12.3 40.3 3.6 215 305 B V H 3< S+ 0 0 1 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.924 115.4 45.4 -64.8 -40.2 15.6 40.1 1.7 216 306 B K T 3< 0 0 98 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.381 360.0 360.0 -83.4 3.3 15.3 43.7 0.5 217 307 B A < 0 0 93 -3,-1.0 -3,-0.1 -4,-0.3 -4,-0.0 -0.333 360.0 360.0 -80.2 360.0 14.2 44.9 3.9