==== 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 TRANSPORT, MEMBRANE PROTEIN 04-JUN-07 2Q69 . COMPND 2 MOLECULE: POTASSIUM CHANNEL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR A.ALAM,N.SHI,Y.JIANG . 207 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12852.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 81.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 145 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 0 2 0 0 0 0 2 0 0 0 0 0 1 1 0 0 2 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M > 0 0 113 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -29.1 38.8 49.5 36.0 2 2 A L H > + 0 0 116 2,-0.2 4,-2.0 1,-0.1 5,-0.2 0.883 360.0 48.2 -79.0 -39.9 41.6 47.1 35.1 3 3 A S H > S+ 0 0 55 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.924 107.7 58.6 -63.2 -42.5 43.3 47.5 38.5 4 4 A F H > S+ 0 0 56 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.936 108.9 42.4 -49.6 -55.7 39.9 47.1 40.1 5 5 A L H X S+ 0 0 72 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.833 114.0 51.2 -63.6 -35.4 39.5 43.6 38.5 6 6 A L H X S+ 0 0 101 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.856 112.1 46.4 -71.8 -35.3 43.1 42.6 39.3 7 7 A T H X S+ 0 0 3 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.926 111.4 52.8 -70.0 -43.4 42.7 43.6 42.9 8 8 A L H X S+ 0 0 25 -4,-2.6 4,-2.8 -5,-0.3 -2,-0.2 0.881 110.2 48.5 -57.5 -41.3 39.4 41.8 43.0 9 9 A K H X S+ 0 0 107 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.890 111.3 47.8 -67.7 -42.4 41.1 38.6 41.7 10 10 A R H X S+ 0 0 114 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.898 114.5 48.6 -64.9 -40.5 44.0 38.7 44.1 11 11 A M H X S+ 0 0 37 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.941 111.2 48.0 -65.3 -48.7 41.5 39.3 46.9 12 12 A L H X S+ 0 0 83 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.912 111.3 51.8 -59.1 -42.3 39.2 36.4 45.8 13 13 A R H X S+ 0 0 159 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.935 109.4 49.5 -59.0 -46.3 42.3 34.2 45.5 14 14 A A H X S+ 0 0 61 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.853 111.2 51.0 -60.1 -36.5 43.3 35.1 49.1 15 15 A C H >X S+ 0 0 63 -4,-2.2 3,-1.2 2,-0.2 4,-0.8 0.951 112.1 43.6 -66.8 -51.3 39.7 34.3 50.2 16 16 A L H >< S+ 0 0 109 -4,-2.9 3,-0.5 1,-0.3 -2,-0.2 0.810 106.6 63.6 -63.9 -29.2 39.7 30.9 48.6 17 17 A R H >< S+ 0 0 166 -4,-2.2 3,-0.7 -5,-0.3 4,-0.3 0.781 99.8 53.7 -64.6 -26.0 43.2 30.4 50.0 18 18 A A H X< S+ 0 0 39 -3,-1.2 3,-0.9 -4,-0.7 -1,-0.2 0.731 92.7 69.9 -79.9 -24.3 41.5 30.7 53.4 19 19 A W T << S+ 0 0 123 -4,-0.8 -1,-0.2 -3,-0.5 -2,-0.2 0.292 95.8 58.6 -76.0 12.1 39.1 27.9 52.6 20 20 A K T < S+ 0 0 121 -3,-0.7 -1,-0.2 5,-0.0 2,-0.2 0.619 76.3 104.4-111.2 -25.8 42.2 25.7 52.7 21 21 A D <> - 0 0 42 -3,-0.9 4,-2.1 -4,-0.3 3,-0.2 -0.423 67.1-142.7 -62.2 125.7 43.2 26.4 56.3 22 22 A K H > S+ 0 0 147 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.868 98.8 52.1 -59.9 -41.1 42.2 23.4 58.5 23 23 A E H > S+ 0 0 129 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.846 110.4 49.9 -66.1 -32.1 41.1 25.5 61.5 24 24 A F H > S+ 0 0 38 -3,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.886 108.1 53.1 -71.0 -38.9 38.9 27.6 59.2 25 25 A Q H X S+ 0 0 61 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.861 108.8 50.5 -63.2 -37.1 37.4 24.4 57.8 26 26 A V H X S+ 0 0 81 -4,-1.9 4,-3.4 2,-0.2 5,-0.3 0.949 109.7 48.6 -65.6 -50.8 36.6 23.3 61.3 27 27 A L H X S+ 0 0 26 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.933 114.4 48.0 -54.5 -46.6 34.9 26.6 62.2 28 28 A F H X S+ 0 0 83 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.927 113.4 45.2 -59.8 -49.6 32.9 26.3 59.0 29 29 A V H X S+ 0 0 76 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.920 113.1 51.6 -60.8 -44.3 31.9 22.7 59.6 30 30 A L H X S+ 0 0 76 -4,-3.4 4,-2.2 1,-0.2 -1,-0.2 0.865 109.2 51.0 -60.1 -38.8 31.1 23.5 63.2 31 31 A T H X S+ 0 0 13 -4,-2.2 4,-2.4 -5,-0.3 -2,-0.2 0.924 111.5 46.4 -66.1 -44.8 28.9 26.4 61.9 32 32 A I H X S+ 0 0 66 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.907 112.5 51.0 -64.1 -42.3 27.0 24.2 59.5 33 33 A L H X S+ 0 0 92 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.896 111.2 48.4 -61.7 -40.3 26.6 21.5 62.2 34 34 A T H X S+ 0 0 23 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.884 109.6 51.7 -68.9 -38.5 25.2 24.2 64.5 35 35 A L H X S+ 0 0 13 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.877 110.8 49.1 -65.5 -36.1 22.8 25.5 61.9 36 36 A I H X S+ 0 0 89 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.915 109.8 50.2 -68.9 -44.3 21.5 22.0 61.3 37 37 A S H X S+ 0 0 67 -4,-2.1 4,-3.1 1,-0.2 -2,-0.2 0.913 112.3 48.9 -59.4 -43.3 21.0 21.3 65.0 38 38 A G H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.903 108.6 51.8 -63.6 -43.2 19.1 24.6 65.2 39 39 A T H X S+ 0 0 27 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.896 114.0 45.2 -60.5 -40.5 16.9 23.8 62.2 40 40 A I H X S+ 0 0 101 -4,-2.3 4,-2.3 2,-0.2 5,-0.3 0.945 113.9 48.9 -68.0 -49.5 16.0 20.4 63.8 41 41 A F H X>S+ 0 0 24 -4,-3.1 4,-3.3 1,-0.2 5,-0.6 0.936 114.0 43.4 -55.9 -53.9 15.4 21.9 67.3 42 42 A Y H X5S+ 0 0 0 -4,-2.8 6,-1.9 2,-0.2 4,-0.6 0.758 114.7 48.7 -68.1 -26.6 13.1 24.8 66.2 43 43 A S H <5S+ 0 0 32 -4,-1.3 4,-0.3 -5,-0.3 -1,-0.2 0.904 120.9 37.7 -77.6 -40.6 11.1 22.7 63.7 44 44 A T H <5S+ 0 0 105 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.956 127.9 29.7 -73.0 -56.6 10.6 20.0 66.4 45 45 A V H <5S+ 0 0 43 -4,-3.3 -3,-0.2 -5,-0.3 -2,-0.1 0.849 131.7 32.2 -77.8 -37.5 10.2 22.0 69.6 46 46 A E S <> - 0 0 122 -2,-0.2 3,-1.7 1,-0.1 4,-1.5 -0.452 40.7-112.0 -62.0 136.6 8.3 24.7 59.1 50 50 A P H >> S+ 0 0 84 0, 0.0 4,-2.2 0, 0.0 3,-0.5 0.847 117.4 53.5 -39.5 -50.0 12.0 23.5 58.4 51 51 A I H 3> S+ 0 0 29 1,-0.3 4,-1.4 2,-0.2 5,-0.0 0.803 111.1 46.9 -59.0 -32.1 12.7 26.4 56.1 52 52 A D H <> S+ 0 0 44 -3,-1.7 4,-1.9 2,-0.2 -1,-0.3 0.701 109.8 54.4 -82.6 -21.3 11.6 28.8 58.9 53 53 A A H < S+ 0 0 8 -4,-1.7 3,-1.1 -5,-0.2 -2,-0.2 0.909 112.6 46.5 -82.6 -46.9 19.9 34.2 65.5 61 61 A L H 3< S+ 0 0 9 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.805 114.5 47.6 -67.2 -31.1 23.4 32.6 65.2 62 62 A T T 3< S- 0 0 14 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.397 110.5-123.2 -89.7 1.6 24.8 35.5 63.1 63 63 A T S < S+ 0 0 76 -3,-1.1 -3,-0.2 -5,-0.1 -4,-0.1 0.467 76.3 126.9 69.3 4.1 23.3 38.0 65.7 64 64 A V - 0 0 9 -6,-0.3 -4,-0.2 -5,-0.3 -5,-0.1 0.871 63.3-142.1 -56.5 -38.1 21.3 39.7 62.9 65 65 A G - 0 0 37 -6,-3.1 2,-0.4 -9,-0.1 106,-0.3 0.373 0.7-106.5 85.3 142.7 18.2 39.2 65.1 66 66 A N - 0 0 46 3,-0.1 106,-0.1 104,-0.1 109,-0.1 -0.887 23.0-178.3-110.2 132.9 14.7 38.3 64.3 67 67 A G S S+ 0 0 27 104,-0.8 3,-0.1 -2,-0.4 -1,-0.1 -0.129 81.0 44.9-118.0 35.6 11.8 40.7 64.4 68 68 A N S S+ 0 0 102 1,-0.4 2,-0.4 106,-0.0 104,-0.1 0.473 108.6 42.5-141.1 -39.5 8.9 38.4 63.5 69 69 A F + 0 0 47 -13,-0.0 -1,-0.4 3,-0.0 -3,-0.1 -0.912 52.2 175.1-121.4 146.2 9.3 35.2 65.5 70 70 A S - 0 0 71 -2,-0.4 7,-0.1 -3,-0.1 6,-0.0 -0.980 44.3 -92.6-147.1 130.8 10.3 34.5 69.1 71 71 A P - 0 0 18 0, 0.0 -25,-0.0 0, 0.0 -29,-0.0 -0.114 31.1-162.9 -45.1 132.7 10.4 31.1 70.8 72 72 A Q + 0 0 139 -26,-0.0 2,-0.3 4,-0.0 -26,-0.1 0.742 65.6 69.6 -92.8 -27.8 7.1 30.4 72.6 73 73 A T S > S- 0 0 51 1,-0.1 4,-2.1 -28,-0.0 5,-0.2 -0.648 81.7-126.1 -95.5 151.7 8.2 27.6 74.9 74 74 A D H > S+ 0 0 128 -2,-0.3 4,-1.5 1,-0.2 5,-0.1 0.748 114.2 56.9 -62.6 -23.1 10.5 28.0 77.9 75 75 A F H > S+ 0 0 128 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.902 105.5 47.7 -74.7 -45.0 12.6 25.3 76.3 76 76 A G H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.870 110.4 53.9 -64.4 -36.2 13.0 27.2 73.1 77 77 A K H X S+ 0 0 97 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.894 109.6 46.1 -65.9 -41.2 14.0 30.3 75.1 78 78 A I H X S+ 0 0 100 -4,-1.5 4,-2.0 2,-0.2 5,-0.2 0.948 114.1 48.4 -66.7 -47.6 16.7 28.5 77.0 79 79 A F H X S+ 0 0 50 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.910 109.1 53.4 -58.1 -45.4 18.1 26.9 73.9 80 80 A T H X S+ 0 0 18 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.888 106.7 52.1 -58.5 -43.1 18.1 30.2 72.0 81 81 A I H X S+ 0 0 88 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.943 114.6 41.9 -59.0 -48.2 20.1 31.9 74.7 82 82 A L H X S+ 0 0 101 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.886 112.1 56.6 -66.3 -37.3 22.7 29.2 74.6 83 83 A Y H X S+ 0 0 4 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.906 102.7 54.8 -60.1 -43.4 22.5 29.2 70.8 84 84 A I H X S+ 0 0 50 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.922 109.2 47.1 -57.5 -46.1 23.4 33.0 70.8 85 85 A F H X S+ 0 0 131 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.841 107.5 54.8 -67.8 -33.8 26.6 32.4 72.8 86 86 A I H X S+ 0 0 84 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.956 109.8 49.2 -61.8 -46.0 27.7 29.5 70.6 87 87 A G H X S+ 0 0 1 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.842 110.8 48.4 -59.9 -37.8 27.3 31.8 67.6 88 88 A I H X S+ 0 0 50 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.871 109.8 53.6 -70.6 -36.6 29.4 34.5 69.4 89 89 A G H X S+ 0 0 42 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.923 109.5 48.1 -62.4 -42.5 31.9 31.8 70.2 90 90 A L H X S+ 0 0 20 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.898 110.6 51.1 -64.3 -41.2 32.1 30.9 66.6 91 91 A V H X S+ 0 0 47 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.902 109.8 48.8 -63.7 -43.6 32.5 34.6 65.5 92 92 A F H X S+ 0 0 133 -4,-2.4 4,-3.6 2,-0.2 5,-0.3 0.911 109.6 54.5 -62.4 -41.1 35.3 35.2 68.0 93 93 A G H X S+ 0 0 23 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.937 110.8 43.8 -57.0 -49.9 37.0 32.0 66.6 94 94 A F H X S+ 0 0 27 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.902 116.6 48.0 -61.5 -42.4 36.8 33.4 63.1 95 95 A I H X S+ 0 0 62 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.906 109.0 51.7 -66.2 -42.8 38.0 36.8 64.3 96 96 A H H X S+ 0 0 127 -4,-3.6 4,-2.3 2,-0.2 -1,-0.2 0.938 110.9 51.7 -57.6 -45.0 40.9 35.3 66.3 97 97 A K H X S+ 0 0 23 -4,-2.2 4,-3.0 -5,-0.3 3,-0.3 0.960 107.9 48.0 -55.2 -59.2 41.8 33.5 63.1 98 98 A L H < S+ 0 0 40 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.885 112.9 51.3 -50.7 -41.2 41.8 36.6 60.9 99 99 A A H >X S+ 0 0 38 -4,-2.4 4,-0.9 1,-0.2 3,-0.8 0.880 112.2 44.9 -65.3 -40.5 43.9 38.3 63.5 100 100 A V H >< S+ 0 0 53 -4,-2.3 3,-1.0 -3,-0.3 -2,-0.2 0.947 109.5 54.0 -69.1 -49.3 46.5 35.5 63.7 101 101 A N T 3< S+ 0 0 80 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.380 110.6 51.3 -67.6 7.4 46.8 35.1 60.0 102 102 A V T <4 S+ 0 0 17 -3,-0.8 -1,-0.2 -5,-0.2 -2,-0.2 0.607 108.4 47.0-114.7 -23.7 47.5 38.8 59.9 103 103 A Q << 0 0 129 -3,-1.0 -2,-0.1 -4,-0.9 -1,-0.1 -0.354 360.0 360.0-117.3 52.1 50.3 39.0 62.4 104 104 A L 0 0 175 -3,-0.1 -3,-0.0 -2,-0.0 -4,-0.0 -0.544 360.0 360.0-103.1 360.0 52.6 36.1 61.5 105 !* 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 0.0 106 1 B M > 0 0 114 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 127.1 39.5 73.4 71.3 107 2 B L H > + 0 0 121 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.863 360.0 59.6 -59.4 -36.2 42.0 73.6 68.5 108 3 B S H > S+ 0 0 88 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.942 104.5 47.0 -56.1 -54.2 43.3 70.3 69.7 109 4 B F H > S+ 0 0 152 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.930 114.1 48.6 -55.1 -49.1 40.0 68.5 69.2 110 5 B L H X S+ 0 0 82 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.933 112.2 47.1 -59.0 -49.5 39.7 70.0 65.8 111 6 B L H X S+ 0 0 99 -4,-3.1 4,-1.9 1,-0.2 -1,-0.2 0.891 112.9 49.8 -60.1 -41.8 43.2 69.1 64.7 112 7 B T H X S+ 0 0 56 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.915 111.7 48.1 -63.5 -44.2 42.8 65.6 66.0 113 8 B L H X S+ 0 0 71 -4,-2.6 4,-3.0 -5,-0.2 -2,-0.2 0.927 111.4 50.0 -62.1 -45.6 39.5 65.2 64.1 114 9 B K H X S+ 0 0 113 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.848 110.0 51.4 -61.9 -35.1 41.0 66.5 60.9 115 10 B R H X S+ 0 0 154 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.942 111.8 46.5 -65.8 -47.7 43.9 64.1 61.3 116 11 B M H X S+ 0 0 115 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.899 111.1 52.0 -61.6 -42.7 41.4 61.2 61.7 117 12 B L H X S+ 0 0 88 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.901 109.2 50.7 -62.0 -39.3 39.4 62.4 58.8 118 13 B R H X S+ 0 0 136 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.925 109.7 49.4 -63.4 -45.0 42.6 62.5 56.7 119 14 B A H X S+ 0 0 46 -4,-2.4 4,-0.6 1,-0.2 -1,-0.2 0.812 111.5 51.5 -63.7 -28.9 43.5 58.9 57.7 120 15 B C H >X S+ 0 0 59 -4,-1.8 4,-1.3 2,-0.2 3,-1.2 0.938 109.2 47.1 -72.9 -48.5 39.9 57.9 56.8 121 16 B L H 3< S+ 0 0 114 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.831 104.6 63.3 -61.5 -31.4 40.0 59.5 53.3 122 17 B R H >< S+ 0 0 155 -4,-2.0 3,-0.7 1,-0.2 -1,-0.3 0.793 100.1 53.9 -62.5 -28.3 43.4 57.7 52.9 123 18 B A H X< S+ 0 0 27 -3,-1.2 3,-2.3 -4,-0.6 -1,-0.2 0.905 97.6 61.2 -72.4 -43.7 41.4 54.5 53.3 124 19 B W T 3< S+ 0 0 127 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.367 101.3 58.8 -65.3 8.2 39.0 55.4 50.4 125 20 B K T < S+ 0 0 161 -3,-0.7 2,-0.3 5,-0.0 -1,-0.3 0.531 79.8 101.5-111.3 -16.0 42.2 55.5 48.3 126 21 B D <> - 0 0 49 -3,-2.3 4,-2.0 -4,-0.2 5,-0.1 -0.557 68.8-142.3 -72.7 131.0 43.2 51.9 49.0 127 22 B K H > S+ 0 0 105 -2,-0.3 4,-2.2 1,-0.2 -1,-0.1 0.889 99.8 50.8 -62.1 -43.0 42.3 49.6 46.1 128 23 B E H > S+ 0 0 44 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.866 110.8 49.5 -64.6 -35.6 41.2 46.7 48.2 129 24 B F H > S+ 0 0 31 -6,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.873 109.3 52.9 -69.7 -36.2 39.0 48.9 50.2 130 25 B Q H X S+ 0 0 80 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.882 108.2 50.0 -66.1 -39.6 37.5 50.3 47.0 131 26 B V H X S+ 0 0 0 -4,-2.2 4,-3.3 2,-0.2 5,-0.2 0.970 110.9 49.0 -61.8 -52.6 36.7 46.8 45.8 132 27 B L H X S+ 0 0 11 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.897 113.1 48.5 -53.0 -44.5 35.0 46.0 49.1 133 28 B F H X S+ 0 0 90 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.940 112.7 45.9 -62.7 -49.2 33.0 49.2 48.9 134 29 B V H X S+ 0 0 49 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.925 110.8 54.8 -60.6 -45.0 31.9 48.6 45.3 135 30 B L H X S+ 0 0 48 -4,-3.3 4,-2.5 1,-0.2 -1,-0.2 0.861 108.9 47.0 -57.8 -37.3 31.0 45.0 46.1 136 31 B T H X S+ 0 0 24 -4,-1.8 4,-2.7 -5,-0.2 -1,-0.2 0.903 112.2 49.0 -74.8 -37.5 28.7 46.1 49.0 137 32 B I H X S+ 0 0 66 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.923 114.7 47.1 -63.4 -41.1 27.0 48.7 46.8 138 33 B L H X S+ 0 0 89 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.923 112.3 48.6 -64.3 -45.1 26.6 46.1 44.2 139 34 B T H X S+ 0 0 24 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.886 111.0 52.0 -62.1 -38.9 25.3 43.6 46.7 140 35 B L H X S+ 0 0 32 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.891 110.1 47.6 -64.8 -41.5 22.9 46.2 48.0 141 36 B I H X S+ 0 0 88 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.941 111.3 50.0 -66.1 -47.3 21.6 46.9 44.5 142 37 B S H X S+ 0 0 67 -4,-2.7 4,-3.1 1,-0.2 -2,-0.2 0.922 111.3 50.8 -55.8 -44.4 21.1 43.2 43.7 143 38 B G H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.3 0.919 108.7 50.3 -59.4 -45.8 19.3 43.0 47.0 144 39 B T H X S+ 0 0 22 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.930 112.2 47.7 -59.1 -46.3 17.0 45.9 46.2 145 40 B I H X S+ 0 0 96 -4,-2.8 4,-2.6 2,-0.2 3,-0.4 0.973 112.9 49.3 -58.6 -55.0 16.2 44.3 42.8 146 41 B F H X>S+ 0 0 20 -4,-3.1 4,-1.8 1,-0.2 5,-0.7 0.919 112.8 43.6 -50.9 -56.3 15.5 40.9 44.4 147 42 B Y H <5S+ 0 0 0 -4,-2.7 6,-2.1 1,-0.2 4,-0.3 0.758 113.3 53.8 -66.3 -22.8 13.2 42.0 47.2 148 43 B S H X5S+ 0 0 30 -4,-1.5 4,-0.5 -3,-0.4 -1,-0.2 0.955 120.4 31.0 -72.3 -49.8 11.3 44.4 44.8 149 44 B T H <5S+ 0 0 109 -4,-2.6 3,-0.4 -5,-0.2 -2,-0.2 0.998 128.3 32.3 -69.6 -73.4 10.7 41.5 42.3 150 45 B V T <5S+ 0 0 40 -4,-1.8 -3,-0.2 1,-0.2 31,-0.2 0.746 131.6 32.1 -61.7 -29.6 10.3 38.3 44.3 151 46 B E T 4> - 0 0 165 -2,-0.2 4,-1.9 1,-0.1 3,-0.9 -0.433 40.6-107.9 -66.1 149.2 8.6 49.1 46.8 155 50 B P H 3> S+ 0 0 89 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.881 119.6 51.7 -47.2 -46.7 12.2 49.8 45.8 156 51 B I H 3> S+ 0 0 102 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.838 112.4 46.0 -63.9 -31.7 12.8 52.0 48.9 157 52 B D H <> S+ 0 0 71 -3,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.743 110.9 53.6 -80.4 -24.1 11.6 49.2 51.2 158 53 B A H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.831 111.5 45.0 -76.6 -33.9 13.6 46.7 49.3 159 54 B L H X S+ 0 0 77 -4,-2.1 4,-2.8 -5,-0.2 -2,-0.2 0.921 112.8 51.8 -73.0 -45.9 16.8 48.8 49.8 160 55 B Y H X S+ 0 0 140 -4,-1.9 4,-2.8 1,-0.2 5,-0.3 0.944 113.3 43.1 -55.1 -53.4 15.9 49.4 53.4 161 56 B F H X S+ 0 0 7 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.898 112.9 53.1 -61.7 -41.1 15.4 45.6 54.1 162 57 B S H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.894 112.5 46.8 -59.8 -39.9 18.6 44.9 52.1 163 58 B V H X S+ 0 0 52 -4,-2.8 4,-2.1 2,-0.2 6,-0.3 0.961 111.6 45.6 -69.1 -54.0 20.5 47.4 54.3 164 59 B V H < S+ 0 0 12 -4,-2.8 6,-4.0 1,-0.2 5,-0.3 0.770 119.0 47.2 -63.8 -20.4 19.3 46.3 57.7 165 60 B T H >< S+ 0 0 5 -4,-1.6 3,-1.2 -5,-0.3 -2,-0.2 0.923 111.6 44.6 -84.9 -49.3 19.9 42.7 56.7 166 61 B L H 3< S+ 0 0 12 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.788 114.9 50.7 -67.4 -27.6 23.4 43.0 55.1 167 62 B T T 3< S- 0 0 67 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.416 110.4-123.1 -88.9 -0.0 24.6 45.1 58.0 168 63 B T S < S+ 0 0 48 -3,-1.2 -3,-0.2 -5,-0.1 -4,-0.1 0.450 80.6 119.8 71.4 2.6 23.3 42.6 60.5 169 64 B V - 0 0 103 -6,-0.3 -4,-0.2 -5,-0.3 -5,-0.1 0.916 59.7-158.8 -61.7 -43.8 21.2 45.3 62.2 170 65 B G - 0 0 19 -6,-4.0 2,-0.4 -9,-0.1 -104,-0.1 0.306 8.1-109.9 78.1 151.8 18.0 43.3 61.4 171 66 B N - 0 0 28 -106,-0.3 -104,-0.8 3,-0.2 -1,-0.1 -0.958 11.4-162.2-125.6 139.0 14.4 44.4 61.1 172 67 B G S S+ 0 0 47 -2,-0.4 3,-0.1 -106,-0.1 -106,-0.1 -0.168 88.4 50.9-106.7 38.3 11.4 43.7 63.3 173 68 B N S S+ 0 0 144 1,-0.4 2,-0.3 0, 0.0 -1,-0.1 0.526 100.4 50.7-136.8 -47.5 8.8 44.7 60.7 174 69 B F + 0 0 51 -13,-0.0 -1,-0.4 2,-0.0 -107,-0.2 -0.790 52.0 173.3-105.7 147.7 9.5 42.8 57.5 175 70 B S - 0 0 18 -2,-0.3 7,-0.1 -3,-0.1 6,-0.0 -0.970 40.4-101.2-150.0 129.0 10.0 39.1 56.9 176 71 B P - 0 0 2 0, 0.0 -25,-0.0 0, 0.0 -29,-0.0 -0.210 27.8-165.3 -51.2 136.5 10.3 37.3 53.6 177 72 B Q + 0 0 141 -26,-0.0 2,-0.2 5,-0.0 -26,-0.1 0.764 64.5 66.7 -97.2 -30.8 7.1 35.4 52.6 178 73 B T S > S- 0 0 51 1,-0.1 4,-1.7 -28,-0.1 5,-0.1 -0.567 80.5-126.0 -92.1 157.2 8.4 33.1 49.8 179 74 B D H > S+ 0 0 68 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.821 114.1 54.8 -68.1 -31.4 10.8 30.2 50.2 180 75 B F H > S+ 0 0 126 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.930 107.5 49.2 -66.4 -45.9 12.9 31.8 47.5 181 76 B G H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.846 112.4 48.6 -63.5 -34.7 13.1 35.0 49.5 182 77 B K H X S+ 0 0 21 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.904 111.6 47.3 -72.0 -43.3 14.0 33.2 52.7 183 78 B I H X S+ 0 0 85 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.941 113.7 49.0 -63.7 -45.0 16.8 31.1 51.1 184 79 B F H X S+ 0 0 51 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.900 108.1 54.0 -60.0 -43.6 18.2 34.3 49.4 185 80 B T H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.879 106.3 53.2 -59.1 -39.8 18.1 36.2 52.7 186 81 B I H X S+ 0 0 16 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.912 113.5 41.2 -63.3 -44.3 20.1 33.5 54.4 187 82 B L H X S+ 0 0 94 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.887 111.5 58.1 -70.5 -38.0 22.8 33.6 51.7 188 83 B Y H X S+ 0 0 4 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.913 103.3 53.3 -56.1 -45.6 22.6 37.4 51.7 189 84 B I H X S+ 0 0 3 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.907 109.7 46.4 -58.5 -44.8 23.4 37.5 55.4 190 85 B F H X S+ 0 0 73 -4,-1.4 4,-2.9 2,-0.2 -1,-0.2 0.826 108.9 54.7 -69.9 -31.1 26.6 35.4 54.9 191 86 B I H X S+ 0 0 83 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.956 109.6 49.4 -63.3 -46.1 27.7 37.5 52.0 192 87 B G H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.892 111.7 47.0 -56.8 -45.1 27.3 40.5 54.4 193 88 B I H X S+ 0 0 34 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.903 110.3 53.1 -64.8 -41.4 29.4 38.7 57.0 194 89 B G H X S+ 0 0 43 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.917 110.8 48.6 -58.8 -40.3 32.0 37.8 54.4 195 90 B L H X S+ 0 0 18 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.913 110.1 49.9 -65.6 -44.9 32.1 41.5 53.5 196 91 B V H X S+ 0 0 59 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.894 109.9 50.5 -62.5 -41.6 32.4 42.6 57.2 197 92 B F H X S+ 0 0 42 -4,-2.6 4,-3.5 1,-0.2 5,-0.2 0.885 108.1 54.9 -63.5 -36.9 35.3 40.2 57.8 198 93 B G H X S+ 0 0 26 -4,-1.7 4,-1.6 -5,-0.2 -2,-0.2 0.914 111.3 42.8 -62.1 -44.7 36.9 41.6 54.6 199 94 B F H X S+ 0 0 53 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.910 116.1 49.2 -66.7 -42.5 36.8 45.1 56.0 200 95 B I H X S+ 0 0 64 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.930 110.2 49.6 -62.9 -45.5 37.9 43.9 59.4 201 96 B H H X S+ 0 0 70 -4,-3.5 4,-1.6 1,-0.2 -1,-0.2 0.868 110.5 53.7 -60.2 -35.0 40.8 42.0 58.0 202 97 B K H X S+ 0 0 20 -4,-1.6 4,-2.0 -5,-0.2 -2,-0.2 0.918 106.2 48.8 -66.7 -46.2 41.6 45.1 56.1 203 98 B L H < S+ 0 0 119 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.819 110.1 54.5 -64.0 -29.5 41.7 47.4 59.2 204 99 B A H >< S+ 0 0 26 -4,-1.8 3,-1.0 1,-0.2 -1,-0.2 0.850 106.3 50.1 -72.0 -36.5 44.0 44.7 60.8 205 100 B V H >< S+ 0 0 58 -4,-1.6 3,-1.0 1,-0.3 -2,-0.2 0.898 104.0 58.9 -68.1 -40.1 46.5 44.8 58.0 206 101 B N T 3< S+ 0 0 102 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.486 89.2 76.7 -67.3 -1.4 46.6 48.6 58.2 207 102 B V T < 0 0 104 -3,-1.0 -1,-0.3 -5,-0.1 -2,-0.1 0.061 360.0 360.0 -96.3 24.2 47.7 48.1 61.8 208 103 B Q < 0 0 147 -3,-1.0 -2,-0.2 0, 0.0 -3,-0.1 0.343 360.0 360.0-151.9 360.0 51.2 47.2 60.5