==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-OCT-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANPORT PROTEIN, MEMBRANE PROTEIN 03-MAY-13 4KJP . COMPND 2 MOLECULE: H(+)/CL(-) EXCHANGE TRANSPORTER CLCA; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR H.-H.LIM,C MILLER . 1748 6 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 67211.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1277 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 347 19.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.4 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 . 141 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 137 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 568 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 37 2.1 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 4 2 2 0 6 3 0 0 2 1 0 0 0 4 2 4 2 2 2 0 0 0 2 0 0 0 4 RESIDUES PER ALPHA HELIX . 0 0 2 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 PARALLEL BRIDGES PER LADDER . 7 5 14 3 11 15 3 0 2 2 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 2 8 2 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 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 17 A R > 0 0 119 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 12.7 49.5 -13.7 55.8 2 18 A R H > + 0 0 77 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.856 360.0 51.4 -68.0 -36.0 47.9 -10.8 57.8 3 19 A R H > S+ 0 0 176 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.793 108.0 51.0 -75.1 -29.3 51.3 -9.1 58.1 4 20 A Q H > S+ 0 0 110 2,-0.2 4,-3.1 1,-0.1 -1,-0.2 0.907 110.1 50.8 -70.6 -42.5 51.9 -9.3 54.4 5 21 A L H X S+ 0 0 0 -4,-1.7 4,-4.0 2,-0.2 5,-0.3 0.917 105.0 54.3 -62.2 -48.0 48.5 -7.8 53.7 6 22 A I H X S+ 0 0 17 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.853 114.2 43.9 -55.8 -35.4 49.0 -4.8 56.0 7 23 A R H X S+ 0 0 158 -4,-1.0 4,-0.8 2,-0.2 -2,-0.2 0.937 115.7 47.2 -71.4 -49.2 52.2 -4.2 54.0 8 24 A Q H >< S+ 0 0 46 -4,-3.1 3,-0.7 1,-0.2 -2,-0.2 0.893 108.9 54.0 -59.7 -44.0 50.5 -4.8 50.7 9 25 A L H >< S+ 0 0 7 -4,-4.0 3,-1.4 1,-0.3 -1,-0.2 0.913 108.2 48.8 -58.9 -44.4 47.5 -2.5 51.6 10 26 A L H 3< S+ 0 0 57 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.667 113.0 49.8 -71.3 -15.9 49.7 0.4 52.4 11 27 A E T << S+ 0 0 69 -4,-0.8 3,-0.4 -3,-0.7 -1,-0.3 -0.008 84.0 130.7-109.4 25.6 51.6 -0.1 49.2 12 28 A R < + 0 0 17 -3,-1.4 -3,-0.1 1,-0.2 861,-0.0 -0.609 67.5 10.0 -86.3 140.9 48.5 -0.3 47.0 13 29 A D S S+ 0 0 41 -2,-0.3 -1,-0.2 1,-0.1 -4,-0.0 0.968 76.6 133.6 57.5 62.7 48.2 1.8 43.8 14 30 A K - 0 0 113 -3,-0.4 -1,-0.1 855,-0.0 3,-0.1 -0.362 34.9-174.4-132.0 52.7 51.8 3.1 43.5 15 31 A T - 0 0 8 1,-0.1 5,-0.1 2,-0.1 -3,-0.0 -0.230 36.8 -97.3 -53.0 130.2 52.3 2.4 39.8 16 32 A P >> - 0 0 54 0, 0.0 4,-1.7 0, 0.0 3,-1.6 -0.285 25.9-131.3 -52.8 127.8 55.9 3.1 38.7 17 33 A L H 3> S+ 0 0 114 1,-0.3 4,-1.8 2,-0.2 5,-0.2 0.732 106.6 60.7 -53.9 -27.7 56.2 6.6 37.1 18 34 A A H 3> S+ 0 0 52 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.849 106.1 46.6 -69.9 -32.2 58.1 5.1 34.2 19 35 A I H <> S+ 0 0 9 -3,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.884 109.6 53.0 -76.6 -39.1 55.1 2.9 33.4 20 36 A L H X S+ 0 0 8 -4,-1.7 4,-1.2 2,-0.2 -2,-0.2 0.914 110.6 46.7 -61.2 -45.8 52.5 5.7 33.6 21 37 A F H X S+ 0 0 129 -4,-1.8 4,-1.3 1,-0.2 3,-0.4 0.915 112.3 48.8 -65.3 -45.5 54.4 8.0 31.2 22 38 A M H X S+ 0 0 22 -4,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.783 105.2 59.7 -67.3 -26.5 54.9 5.2 28.6 23 39 A A H X S+ 0 0 0 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.846 103.8 51.1 -67.8 -33.4 51.2 4.4 28.9 24 40 A A H X S+ 0 0 24 -4,-1.2 4,-1.5 -3,-0.4 -2,-0.2 0.823 110.9 49.1 -70.8 -32.0 50.5 8.0 27.8 25 41 A V H X S+ 0 0 38 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.932 110.2 48.9 -72.0 -47.9 52.8 7.4 24.9 26 42 A V H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.918 110.1 53.0 -57.0 -45.6 51.3 4.1 23.8 27 43 A G H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.899 108.5 48.9 -58.2 -44.0 47.8 5.7 24.0 28 44 A T H X S+ 0 0 34 -4,-1.5 4,-2.7 2,-0.2 -1,-0.2 0.919 114.2 45.4 -63.8 -44.8 48.7 8.6 21.7 29 45 A L H X S+ 0 0 63 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.953 113.3 48.2 -65.2 -50.0 50.3 6.3 19.1 30 46 A V H X S+ 0 0 2 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.853 112.4 53.5 -58.7 -32.7 47.4 3.8 19.2 31 47 A G H X S+ 0 0 0 -4,-2.0 4,-2.1 -5,-0.3 -2,-0.2 0.978 111.7 41.0 -63.0 -58.5 45.2 6.8 18.9 32 48 A L H X S+ 0 0 76 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.837 115.2 53.8 -59.1 -35.4 46.8 8.3 15.8 33 49 A A H X S+ 0 0 21 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.903 109.6 46.6 -66.7 -41.3 47.2 4.8 14.4 34 50 A A H X S+ 0 0 5 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.829 112.8 49.5 -72.3 -33.5 43.4 4.1 14.8 35 51 A V H X S+ 0 0 7 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.917 111.2 49.4 -69.0 -44.7 42.5 7.4 13.3 36 52 A A H X S+ 0 0 48 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.908 112.0 48.4 -60.1 -44.7 44.8 6.8 10.3 37 53 A F H X S+ 0 0 1 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.906 111.4 50.4 -60.8 -42.7 43.3 3.4 9.8 38 54 A D H X S+ 0 0 24 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.855 110.8 48.7 -66.3 -36.2 39.8 4.8 10.0 39 55 A K H X S+ 0 0 91 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.837 111.2 52.0 -71.2 -33.6 40.6 7.5 7.5 40 56 A G H X S+ 0 0 17 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.923 108.5 47.5 -68.2 -47.1 42.1 4.9 5.2 41 57 A V H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 5,-0.2 0.880 112.0 51.9 -62.5 -38.5 39.1 2.5 5.2 42 58 A A H X S+ 0 0 45 -4,-1.5 4,-1.3 -5,-0.2 -1,-0.2 0.896 107.7 51.9 -65.3 -41.5 36.8 5.5 4.5 43 59 A W H X S+ 0 0 147 -4,-1.6 4,-1.9 1,-0.2 -2,-0.2 0.913 110.4 47.1 -62.0 -46.3 38.9 6.6 1.5 44 60 A L H X S+ 0 0 32 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.880 110.3 51.1 -66.5 -40.3 38.9 3.2 -0.2 45 61 A Q H X S+ 0 0 66 -4,-1.9 4,-1.0 1,-0.2 -1,-0.2 0.800 111.7 51.8 -65.3 -27.1 35.1 2.7 0.3 46 62 A N H X S+ 0 0 93 -4,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.847 106.7 49.8 -77.8 -37.0 34.8 6.1 -1.2 47 63 A Q H X S+ 0 0 80 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.931 109.7 51.9 -67.0 -45.1 36.9 5.4 -4.3 48 64 A R H X S+ 0 0 38 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.852 108.8 51.6 -57.8 -36.0 34.9 2.2 -4.9 49 65 A M H X S+ 0 0 129 -4,-1.0 4,-0.6 1,-0.2 -1,-0.2 0.891 110.2 48.7 -66.5 -40.2 31.8 4.4 -4.7 50 66 A G H X S+ 0 0 43 -4,-1.8 4,-1.2 1,-0.2 -2,-0.2 0.749 107.2 55.5 -73.1 -24.9 33.2 6.8 -7.2 51 67 A A H X S+ 0 0 30 -4,-1.9 4,-0.8 1,-0.2 -1,-0.2 0.838 101.5 56.9 -76.0 -32.9 34.1 4.0 -9.6 52 68 A L H < S+ 0 0 20 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.689 107.5 49.7 -71.6 -17.8 30.6 2.7 -9.7 53 69 A V H >< S+ 0 0 107 -4,-0.6 3,-1.5 1,-0.2 -1,-0.2 0.800 99.3 64.3 -86.9 -33.6 29.5 6.1 -10.9 54 70 A H H 3< S+ 0 0 168 -4,-1.2 -2,-0.2 1,-0.3 -1,-0.2 0.760 120.3 25.9 -56.6 -27.2 32.1 6.1 -13.6 55 71 A T T 3< S+ 0 0 28 -4,-0.8 -1,-0.3 1,-0.1 -2,-0.1 -0.331 80.6 139.5-131.7 50.7 30.2 3.2 -15.0 56 72 A A < + 0 0 69 -3,-1.5 3,-0.1 1,-0.2 -2,-0.1 0.228 67.7 52.1 -87.2 16.6 26.7 3.8 -13.7 57 73 A D S S+ 0 0 132 1,-0.2 2,-1.6 -3,-0.1 -1,-0.2 0.775 88.9 68.2-113.0 -59.2 24.9 2.8 -16.9 58 74 A N >> - 0 0 82 1,-0.2 4,-3.0 2,-0.1 3,-0.6 -0.513 67.6-167.5 -67.9 89.8 26.1 -0.6 -18.0 59 75 A Y H 3> S+ 0 0 126 -2,-1.6 4,-2.3 1,-0.3 -1,-0.2 0.841 83.2 47.1 -53.0 -44.4 24.6 -2.6 -15.1 60 76 A P H 34 S+ 0 0 88 0, 0.0 4,-0.4 0, 0.0 -1,-0.3 0.848 116.0 46.5 -67.7 -30.3 26.4 -5.8 -15.8 61 77 A L H <> S+ 0 0 74 -3,-0.6 4,-2.0 2,-0.2 3,-0.5 0.875 113.1 49.4 -73.0 -38.9 29.7 -3.9 -16.2 62 78 A L H X S+ 0 0 6 -4,-3.0 4,-0.8 1,-0.2 -3,-0.2 0.838 106.1 55.3 -70.8 -33.9 28.9 -2.0 -13.0 63 79 A L H X S+ 0 0 39 -4,-2.3 4,-1.1 -5,-0.3 -1,-0.2 0.698 109.9 51.4 -68.1 -18.1 28.1 -5.1 -11.1 64 80 A T H > S+ 0 0 64 -3,-0.5 4,-3.2 -4,-0.4 5,-0.3 0.941 105.6 47.3 -85.0 -53.7 31.6 -6.3 -12.1 65 81 A V H X S+ 0 0 31 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.633 110.4 57.7 -68.3 -11.1 33.8 -3.4 -11.1 66 82 A A H X S+ 0 0 2 -4,-0.8 4,-1.5 -5,-0.2 -1,-0.2 0.923 112.6 39.3 -74.4 -51.4 32.0 -3.5 -7.8 67 83 A F H X S+ 0 0 71 -4,-1.1 4,-2.8 1,-0.2 3,-0.3 0.971 118.2 46.6 -58.3 -60.1 33.0 -7.2 -7.4 68 84 A L H X S+ 0 0 91 -4,-3.2 4,-3.8 1,-0.2 5,-0.3 0.870 108.3 54.9 -55.6 -44.9 36.5 -6.8 -8.7 69 85 A C H X S+ 0 0 43 -4,-1.0 4,-1.6 -5,-0.3 -1,-0.2 0.902 117.6 36.0 -58.5 -43.2 37.4 -3.7 -6.7 70 86 A S H X S+ 0 0 0 -4,-1.5 4,-1.9 -3,-0.3 -1,-0.2 0.788 116.9 55.7 -78.9 -29.5 36.5 -5.4 -3.5 71 87 A A H X S+ 0 0 9 -4,-2.8 4,-2.5 -5,-0.2 -2,-0.2 0.951 109.9 43.9 -64.8 -51.5 37.9 -8.7 -4.8 72 88 A V H X S+ 0 0 86 -4,-3.8 4,-2.1 1,-0.2 -2,-0.2 0.924 114.8 49.4 -60.6 -45.7 41.3 -7.2 -5.5 73 89 A L H X S+ 0 0 36 -4,-1.6 4,-0.8 -5,-0.3 -1,-0.2 0.855 111.0 50.6 -63.1 -37.0 41.4 -5.3 -2.2 74 90 A A H >X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 3,-1.0 0.955 108.9 50.4 -64.1 -52.0 40.4 -8.5 -0.3 75 91 A M H 3X S+ 0 0 61 -4,-2.5 4,-2.4 1,-0.3 -2,-0.2 0.878 107.5 54.0 -53.6 -43.2 43.1 -10.6 -2.0 76 92 A F H 3X S+ 0 0 97 -4,-2.1 4,-1.4 1,-0.2 -1,-0.3 0.768 110.6 48.8 -63.3 -25.6 45.7 -8.0 -1.1 77 93 A G H S+ 0 0 28 -4,-1.4 4,-1.0 -5,-0.2 5,-0.5 0.806 114.7 44.6 -55.1 -30.5 49.8 -9.6 3.3 81 97 A V H X5S+ 0 0 3 -4,-1.1 4,-1.7 3,-0.2 -2,-0.2 0.961 114.0 45.0 -79.3 -55.5 48.7 -11.8 6.2 82 98 A R H <5S+ 0 0 74 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.827 119.3 41.7 -56.6 -37.4 49.6 -15.2 4.8 83 99 A K H <5S+ 0 0 123 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.804 131.9 13.1 -86.4 -33.3 53.0 -14.1 3.6 84 100 A Y H <5S+ 0 0 108 -4,-1.0 -3,-0.2 -5,-0.3 -2,-0.2 0.681 134.7 14.1-121.4 -26.7 54.3 -11.9 6.3 85 101 A A ><< + 0 0 0 -4,-1.7 3,-1.9 -5,-0.5 -2,-0.1 -0.542 50.2 173.9-157.7 83.6 52.2 -12.3 9.5 86 102 A P G > S+ 0 0 61 0, 0.0 3,-1.1 0, 0.0 -4,-0.1 0.723 83.4 65.0 -63.6 -22.7 49.8 -15.3 9.7 87 103 A E G 3 S+ 0 0 12 1,-0.2 8,-0.1 -6,-0.1 -5,-0.1 0.475 89.3 68.8 -79.2 -5.0 49.0 -14.3 13.3 88 104 A A G < S+ 0 0 0 -3,-1.9 -1,-0.2 -7,-0.2 2,-0.1 0.244 81.0 97.5 -99.4 9.9 47.5 -11.1 12.0 89 105 A G S < S+ 0 0 17 -3,-1.1 247,-0.2 248,-0.1 3,-0.1 -0.365 74.2 15.8 -87.7 175.2 44.5 -12.8 10.4 90 106 A G S S- 0 0 15 245,-1.0 248,-2.2 1,-0.2 243,-0.1 -0.179 121.7 -26.8 62.9-150.1 41.1 -13.1 12.0 91 107 A S - 0 0 4 246,-0.2 46,-0.3 241,-0.1 -1,-0.2 0.974 63.8-150.6 -64.9 -58.8 40.0 -11.0 14.9 92 108 A G S > S+ 0 0 4 -3,-0.1 4,-1.7 44,-0.1 5,-0.2 0.036 75.6 93.7 104.8 -24.5 43.4 -10.3 16.5 93 109 A I H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.900 81.7 53.1 -65.8 -42.1 41.9 -10.1 20.0 94 110 A P H > S+ 0 0 11 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.865 108.0 53.3 -60.1 -32.8 42.6 -13.8 20.8 95 111 A E H > S+ 0 0 26 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.900 110.9 43.2 -69.5 -43.0 46.2 -13.2 19.8 96 112 A I H X S+ 0 0 3 -4,-1.7 4,-0.8 2,-0.2 -1,-0.2 0.819 111.8 56.5 -70.6 -30.8 46.7 -10.3 22.2 97 113 A E H X S+ 0 0 11 -4,-2.1 4,-0.8 1,-0.2 3,-0.4 0.884 108.7 46.6 -64.6 -38.9 44.8 -12.2 24.8 98 114 A G H <>S+ 0 0 0 -4,-1.8 5,-2.4 1,-0.2 6,-0.7 0.852 105.0 59.9 -70.7 -35.7 47.4 -15.0 24.4 99 115 A A H <5S+ 0 0 5 -4,-1.8 3,-0.4 1,-0.2 -1,-0.2 0.710 101.4 55.4 -65.6 -21.1 50.2 -12.5 24.5 100 116 A L H <5S+ 0 0 0 -4,-0.8 -1,-0.2 -3,-0.4 -2,-0.2 0.777 104.3 51.5 -82.7 -28.4 49.0 -11.6 28.0 101 117 A E T <5S- 0 0 17 -4,-0.8 -1,-0.2 -3,-0.5 -2,-0.2 0.305 116.2-120.4 -84.1 7.1 49.2 -15.2 29.1 102 118 A D T 5S+ 0 0 69 -3,-0.4 -3,-0.2 2,-0.1 -2,-0.1 0.808 87.8 110.4 55.4 34.4 52.8 -15.1 27.7 103 119 A Q < + 0 0 57 -5,-2.4 -4,-0.2 1,-0.1 -1,-0.1 0.431 68.2 51.0-115.9 -5.2 51.9 -17.9 25.4 104 120 A R S S- 0 0 46 -6,-0.7 2,-0.2 -8,-0.1 -2,-0.1 -0.993 81.0-119.8-135.6 143.6 51.9 -16.0 22.1 105 121 A P - 0 0 66 0, 0.0 2,-0.8 0, 0.0 -6,-0.1 -0.545 10.8-141.7 -83.2 145.4 54.6 -13.7 20.6 106 122 A V - 0 0 20 -2,-0.2 2,-2.1 -7,-0.1 3,-0.2 -0.726 19.6-175.9-103.8 80.5 53.9 -10.0 19.8 107 123 A R >> + 0 0 69 -2,-0.8 4,-2.6 1,-0.2 3,-1.1 -0.498 11.8 167.1 -79.4 79.6 55.9 -9.7 16.5 108 124 A W H 3> + 0 0 58 -2,-2.1 4,-1.5 1,-0.3 -1,-0.2 0.817 66.8 64.7 -68.3 -32.5 55.3 -5.9 16.2 109 125 A W H 34 S+ 0 0 139 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.758 117.9 28.0 -61.0 -23.9 57.8 -5.4 13.4 110 126 A R H <> S+ 0 0 99 -3,-1.1 4,-1.8 2,-0.1 -2,-0.2 0.828 120.0 48.6-103.5 -46.5 55.7 -7.6 11.2 111 127 A V H X>S+ 0 0 0 -4,-2.6 4,-4.0 1,-0.2 5,-0.5 0.872 99.0 67.7 -70.5 -38.2 52.1 -7.3 12.3 112 128 A L H X5S+ 0 0 30 -4,-1.5 4,-1.6 -5,-0.3 -1,-0.2 0.919 113.1 28.9 -49.4 -54.6 52.0 -3.5 12.5 113 129 A P H >5S+ 0 0 58 0, 0.0 4,-2.1 0, 0.0 5,-0.4 0.876 122.1 53.4 -77.0 -32.3 52.3 -3.0 8.7 114 130 A V H X5S+ 0 0 4 -4,-1.8 4,-2.2 2,-0.2 5,-0.3 0.938 115.3 38.2 -64.7 -46.1 50.6 -6.3 7.9 115 131 A K H X5S+ 0 0 0 -4,-4.0 4,-2.8 3,-0.2 5,-0.4 0.916 116.5 51.5 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18.2 16.9 71.2 512 85 B C H X S+ 0 0 45 -4,-1.1 4,-1.7 -5,-0.3 -1,-0.2 0.899 118.8 35.3 -55.8 -44.5 16.1 14.9 68.6 513 86 B S H X S+ 0 0 0 -4,-1.5 4,-2.2 -3,-0.3 -1,-0.2 0.819 117.1 55.9 -77.5 -32.4 19.3 14.3 66.6 514 87 B A H X S+ 0 0 8 -4,-3.0 4,-2.4 -5,-0.2 -2,-0.2 0.955 111.1 42.5 -62.3 -52.2 21.4 14.1 69.7 515 88 B V H X S+ 0 0 87 -4,-4.0 4,-2.3 1,-0.2 5,-0.2 0.923 114.6 50.5 -60.7 -47.3 19.2 11.3 71.2 516 89 B L H X S+ 0 0 37 -4,-1.7 4,-0.9 -5,-0.3 -1,-0.2 0.866 110.7 50.5 -60.2 -38.1 19.0 9.5 67.8 517 90 B A H >X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 3,-0.9 0.945 108.4 51.5 -62.4 -50.5 22.8 9.7 67.5 518 91 B M H 3X S+ 0 0 58 -4,-2.4 4,-2.3 1,-0.3 -2,-0.2 0.884 106.7 53.6 -55.9 -43.1 23.3 8.3 71.0 519 92 B F H 3X S+ 0 0 95 -4,-2.3 4,-1.5 1,-0.2 -1,-0.3 0.788 110.8 49.5 -61.5 -27.8 21.0 5.3 70.2 520 93 B G H < + 0 0 0 -4,-1.7 3,-1.6 -5,-0.4 -1,-0.2 -0.554 50.9 174.8-159.9 86.4 28.6 -5.1 67.2 529 102 B P G > S+ 0 0 60 0, 0.0 3,-1.1 0, 0.0 -4,-0.1 0.757 83.4 64.6 -66.1 -25.5 31.7 -2.8 67.3 530 103 B E G 3 S+ 0 0 10 1,-0.3 8,-0.1 -6,-0.1 -5,-0.1 0.558 89.2 70.1 -74.2 -9.4 32.7 -3.9 63.8 531 104 B A G < S+ 0 0 0 -3,-1.6 -1,-0.3 -7,-0.2 2,-0.1 0.161 79.6 99.4 -97.6 16.3 29.6 -2.2 62.6 532 105 B G S < S+ 0 0 18 -3,-1.1 247,-0.2 -8,-0.1 3,-0.2 -0.461 74.0 12.4 -91.3 172.3 30.8 1.3 63.2 533 106 B G S S- 0 0 14 245,-1.3 248,-1.9 1,-0.2 243,-0.1 -0.164 121.9 -25.8 62.7-152.3 32.3 3.6 60.7 534 107 B S - 0 0 5 246,-0.2 46,-0.3 241,-0.1 -1,-0.2 0.960 64.2-153.2 -61.6 -57.2 32.1 3.0 57.0 535 108 B G S > S+ 0 0 4 -3,-0.2 4,-1.6 44,-0.1 5,-0.2 0.071 72.9 96.3 100.2 -22.9 31.8 -0.8 57.0 536 109 B I H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.925 81.5 50.6 -64.0 -45.5 33.3 -1.1 53.6 537 110 B P H > S+ 0 0 9 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.872 108.1 56.5 -59.2 -33.4 36.8 -1.9 54.9 538 111 B E H > S+ 0 0 26 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.884 110.3 41.2 -65.4 -42.0 35.2 -4.5 57.1 539 112 B I H X S+ 0 0 2 -4,-1.6 4,-1.2 2,-0.2 -1,-0.2 0.829 112.1 57.5 -73.8 -32.2 33.6 -6.4 54.2 540 113 B E H X S+ 0 0 8 -4,-2.4 4,-0.9 1,-0.2 3,-0.3 0.901 108.1 46.3 -62.0 -42.6 36.9 -5.8 52.2 541 114 B G H ><>S+ 0 0 0 -4,-2.4 5,-2.4 1,-0.2 3,-0.6 0.880 106.2 59.6 -64.9 -38.8 38.7 -7.6 55.0 542 115 B A H ><5S+ 0 0 7 -4,-1.6 3,-0.8 1,-0.3 -1,-0.2 0.780 100.7 55.5 -61.4 -28.6 36.1 -10.3 55.0 543 116 B L H 3<5S+ 0 0 0 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.793 104.8 51.7 -76.3 -28.7 37.0 -11.0 51.4 544 117 B E T <<5S- 0 0 8 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.331 116.4-120.2 -83.4 5.8 40.6 -11.5 52.3 545 118 B D T < 5S+ 0 0 64 -3,-0.8 -3,-0.2 2,-0.1 -2,-0.1 0.836 87.3 112.2 55.1 36.4 39.3 -14.0 54.9 546 119 B Q < + 0 0 40 -5,-2.4 -4,-0.2 -6,-0.1 -5,-0.1 0.354 68.2 48.0-118.5 -0.6 40.9 -11.8 57.6 547 120 B R S S- 0 0 47 -6,-0.6 2,-0.3 -8,-0.1 -2,-0.1 -0.979 81.4-117.7-137.3 152.4 37.7 -10.5 59.2 548 121 B P - 0 0 67 0, 0.0 2,-0.8 0, 0.0 -6,-0.1 -0.661 10.9-142.1 -91.7 146.6 34.6 -12.2 60.5 549 122 B V - 0 0 19 -2,-0.3 2,-1.9 -7,-0.1 3,-0.2 -0.783 18.6-175.7-104.5 85.4 31.1 -11.6 59.1 550 123 B R >> + 0 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0 -4,-2.5 4,-2.8 -5,-0.3 5,-0.5 0.832 105.3 66.1 -69.3 -31.7 22.6 3.6 61.0 563 136 B L H 3X5S+ 0 0 21 -4,-0.6 4,-0.7 -5,-0.3 -1,-0.2 0.731 106.4 43.6 -60.2 -23.1 18.9 4.4 61.1 564 137 B G H S+ 0 0 0 -4,-1.7 5,-2.0 2,-0.2 4,-0.2 0.909 123.3 39.8 -65.1 -43.2 22.8 8.5 62.8 566 139 B L H ><5S+ 0 0 4 -4,-2.8 3,-2.0 1,-0.2 -3,-0.2 0.950 116.4 49.1 -70.0 -50.3 21.4 8.9 59.3 567 140 B G H 3< S+ 0 0 63 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.690 100.1 71.1 -77.7 -21.3 23.6 5.3 52.9 575 148 B E H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 5,-0.4 0.805 88.1 63.8 -70.3 -29.6 26.2 3.0 51.2 576 149 B G H > S+ 0 0 0 -3,-0.4 4,-1.9 2,-0.2 5,-0.3 0.989 113.1 33.1 -52.7 -65.6 28.0 2.5 54.5 577 150 B P H > S+ 0 0 0 0, 0.0 4,-3.1 0, 0.0 5,-0.3 0.958 122.2 48.2 -51.7 -57.2 25.0 0.7 56.0 578 151 B T H X S+ 0 0 5 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.838 112.4 46.5 -62.3 -38.2 23.8 -0.9 52.8 579 152 B V H X S+ 0 0 0 -4,-3.0 4,-2.1 33,-0.2 -1,-0.2 0.939 117.4 42.3 -69.8 -46.2 27.1 -2.3 51.6 580 153 B Q H X S+ 0 0 1 -4,-1.9 4,-2.1 -5,-0.4 -2,-0.2 0.933 118.1 46.4 -66.1 -45.7 28.0 -3.8 55.0 581 154 B I H X S+ 0 0 8 -4,-3.1 4,-2.9 -5,-0.3 5,-0.2 0.942 111.2 53.8 -56.0 -49.0 24.5 -5.0 55.5 582 155 B G H X S+ 0 0 0 -4,-2.7 4,-1.8 -5,-0.3 27,-0.3 0.851 107.6 49.9 -57.3 -38.9 24.5 -6.4 52.0 583 156 B G H X S+ 0 0 0 -4,-2.1 4,-1.9 25,-0.3 -1,-0.2 0.919 112.9 45.8 -66.2 -44.2 27.7 -8.3 52.6 584 157 B N H X S+ 0 0 2 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.849 109.6 54.5 -68.4 -35.4 26.3 -9.9 55.8 585 158 B I H X S+ 0 0 15 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.902 109.8 49.4 -59.5 -40.7 23.0 -10.7 54.0 586 159 B G H X S+ 0 0 0 -4,-1.8 4,-0.7 -5,-0.2 -2,-0.2 0.856 112.9 45.5 -66.6 -36.5 25.2 -12.4 51.5 587 160 B R H X S+ 0 0 64 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.861 107.4 61.5 -72.2 -36.2 27.0 -14.3 54.2 588 161 B M H X S+ 0 0 34 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.933 105.6 42.3 -56.4 -53.9 23.7 -15.0 55.9 589 162 B V H X S+ 0 0 3 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.721 109.3 60.9 -71.7 -19.7 22.2 -17.1 53.1 590 163 B L H <>S+ 0 0 6 -4,-0.7 5,-2.1 -5,-0.2 4,-0.3 0.935 112.2 37.9 -66.1 -48.2 25.5 -18.8 52.6 591 164 B D H ><5S+ 0 0 46 -4,-2.1 3,-0.7 3,-0.2 -2,-0.2 0.945 115.9 52.9 -66.5 -50.9 25.3 -20.1 56.1 592 165 B I H 3<5S+ 0 0 97 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.901 119.2 33.5 -54.9 -49.1 21.6 -20.8 56.0 593 166 B F T 3<5S- 0 0 120 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.452 107.6-131.7 -87.7 -1.1 21.7 -22.9 52.9 594 167 B R T < 5 - 0 0 215 -3,-0.7 2,-0.2 -4,-0.3 -3,-0.2 0.880 32.9-174.3 55.1 47.2 25.1 -24.1 54.0 595 168 B L < - 0 0 40 -5,-2.1 2,-0.3 -6,-0.2 -1,-0.2 -0.539 10.4-146.6 -74.7 138.0 26.9 -23.5 50.6 596 169 B K + 0 0 206 -2,-0.2 4,-0.2 4,-0.1 2,-0.1 -0.831 46.2 58.3-112.5 144.4 30.4 -24.9 50.6 597 170 B G S > S- 0 0 39 -2,-0.3 4,-1.5 2,-0.1 5,-0.1 -0.325 75.6-100.9 124.2 155.2 33.5 -23.5 48.8 598 171 B D H > S+ 0 0 85 2,-0.2 4,-3.3 3,-0.2 5,-0.3 0.857 119.4 58.0 -73.3 -37.2 35.7 -20.4 48.6 599 172 B E H > S+ 0 0 60 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.961 109.1 43.5 -57.4 -53.2 34.0 -19.4 45.4 600 173 B A H > S+ 0 0 4 -4,-0.2 4,-1.9 1,-0.2 5,-0.3 0.883 116.9 46.9 -60.6 -40.4 30.5 -19.4 47.0 601 174 B R H X S+ 0 0 46 -4,-1.5 4,-0.9 2,-0.2 -1,-0.2 0.899 118.1 41.6 -69.7 -40.0 31.8 -17.6 50.1 602 175 B H H X S+ 0 0 5 -4,-3.3 4,-0.8 2,-0.2 -2,-0.2 0.905 118.7 45.0 -74.6 -42.5 33.7 -15.0 48.1 603 176 B T H >X S+ 0 0 0 -4,-3.4 4,-2.9 -5,-0.3 3,-1.7 0.989 113.6 45.7 -63.4 -62.5 31.0 -14.6 45.4 604 177 B L H 3X S+ 0 0 2 -4,-1.9 4,-1.0 1,-0.3 -1,-0.2 0.776 112.7 52.8 -56.7 -28.1 27.9 -14.3 47.7 605 178 B L H 3X S+ 0 0 4 -4,-0.9 4,-0.6 -5,-0.3 -1,-0.3 0.750 114.5 43.4 -76.8 -23.9 29.8 -11.9 50.0 606 179 B A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 3,-0.6 0.929 110.0 51.1 -70.4 -46.7 27.6 -4.8 45.2 611 184 B A H 3X S+ 0 0 0 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.639 108.7 55.5 -66.0 -13.8 23.8 -5.1 45.3 612 185 B G H 34 S+ 0 0 0 -4,-0.4 -1,-0.2 2,-0.2 -33,-0.2 0.765 108.5 44.1 -88.9 -30.2 24.0 -2.8 48.4 613 186 B L H XX S+ 0 0 0 -4,-1.1 3,-1.1 -3,-0.6 4,-0.7 0.879 113.9 52.1 -76.9 -40.8 25.9 -0.0 46.6 614 187 B A H >X>S+ 0 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