==== 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 TRANSPORT PROTEIN 28-JUL-05 2AHY . COMPND 2 MOLECULE: POTASSIUM CHANNEL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR N.SHI,S.YE,A.ALAM,L.CHEN,Y.JIANG . 207 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12799.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 169 81.6 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 . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 7.2 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 . 4 1.9 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 0 0 0 0 0 0 0 0 2 0 0 1 0 1 0 0 0 0 0 2 0 0 0 1 0 0 1 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 0 124 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -37.3 38.7 49.5 35.7 2 2 A L H > + 0 0 114 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.894 360.0 54.3 -74.5 -40.1 41.2 46.8 34.8 3 3 A S H > S+ 0 0 56 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.908 105.8 53.9 -57.5 -42.5 42.9 47.4 38.1 4 4 A F H > S+ 0 0 58 1,-0.2 4,-3.2 2,-0.2 -1,-0.2 0.958 111.0 44.2 -55.5 -54.6 39.5 46.8 39.8 5 5 A L H X S+ 0 0 90 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.880 114.4 49.7 -58.8 -42.1 39.1 43.5 38.0 6 6 A L H X S+ 0 0 95 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.870 113.3 46.0 -67.1 -37.4 42.7 42.5 38.8 7 7 A T H X S+ 0 0 5 -4,-2.8 4,-2.9 -5,-0.2 5,-0.3 0.928 110.9 53.2 -70.5 -43.6 42.3 43.4 42.4 8 8 A L H X S+ 0 0 40 -4,-3.2 4,-3.6 -5,-0.2 -2,-0.2 0.938 111.6 45.3 -55.6 -49.3 39.0 41.6 42.6 9 9 A K H X S+ 0 0 124 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.875 112.1 51.3 -63.9 -37.9 40.5 38.4 41.3 10 10 A R H X S+ 0 0 106 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.919 116.2 41.3 -65.2 -42.4 43.5 38.7 43.5 11 11 A M H X S+ 0 0 38 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.923 112.7 53.8 -69.5 -46.1 41.3 39.1 46.5 12 12 A L H X S+ 0 0 82 -4,-3.6 4,-2.4 -5,-0.3 5,-0.3 0.920 108.5 51.4 -54.5 -45.0 38.9 36.4 45.3 13 13 A R H X S+ 0 0 167 -4,-2.5 4,-3.1 1,-0.2 -1,-0.2 0.949 106.8 52.0 -56.5 -52.8 41.8 34.1 45.1 14 14 A A H X S+ 0 0 57 -4,-1.9 4,-1.0 1,-0.2 -1,-0.2 0.824 109.4 52.0 -54.1 -34.7 42.9 34.8 48.6 15 15 A C H >X S+ 0 0 62 -4,-2.0 4,-0.9 2,-0.2 3,-0.9 0.966 113.7 40.2 -67.8 -54.0 39.4 34.0 49.8 16 16 A L H 3< S+ 0 0 103 -4,-2.4 3,-0.4 1,-0.3 -2,-0.2 0.834 111.3 60.6 -63.2 -30.1 39.3 30.7 48.0 17 17 A R H >< S+ 0 0 170 -4,-3.1 3,-0.8 -5,-0.3 -1,-0.3 0.803 101.7 52.9 -65.3 -28.3 42.9 30.3 49.2 18 18 A A H X< S+ 0 0 32 -4,-1.0 3,-1.8 -3,-0.9 -1,-0.2 0.713 91.0 73.1 -78.9 -22.6 41.5 30.6 52.8 19 19 A W T 3< S+ 0 0 120 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.376 91.3 63.6 -72.1 7.4 39.0 27.8 52.0 20 20 A K T < S+ 0 0 139 -3,-0.8 2,-0.6 4,-0.0 -1,-0.3 0.516 73.8 104.9-106.1 -13.2 42.1 25.7 52.3 21 21 A D X> - 0 0 43 -3,-1.8 4,-2.6 1,-0.2 3,-0.6 -0.614 65.9-145.4 -75.0 118.4 42.9 26.4 55.9 22 22 A K H 3> S+ 0 0 149 -2,-0.6 4,-2.0 1,-0.3 -1,-0.2 0.861 99.7 51.4 -50.7 -42.0 42.0 23.3 58.0 23 23 A E H 3> S+ 0 0 123 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.843 109.5 49.9 -67.3 -33.0 40.9 25.5 60.9 24 24 A F H <> S+ 0 0 33 -3,-0.6 4,-3.2 2,-0.2 -2,-0.2 0.948 108.5 53.8 -68.1 -46.7 38.7 27.6 58.7 25 25 A Q H X S+ 0 0 63 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.887 108.9 48.2 -52.9 -45.2 37.1 24.4 57.3 26 26 A V H X S+ 0 0 67 -4,-2.0 4,-3.1 2,-0.2 5,-0.2 0.940 110.3 50.5 -65.1 -44.4 36.3 23.2 60.7 27 27 A L H X S+ 0 0 27 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.954 112.7 48.9 -56.6 -46.8 34.7 26.5 61.7 28 28 A F H X S+ 0 0 82 -4,-3.2 4,-2.1 1,-0.2 -2,-0.2 0.911 111.9 46.7 -57.0 -48.2 32.7 26.3 58.4 29 29 A V H X S+ 0 0 74 -4,-2.8 4,-3.0 1,-0.2 -1,-0.2 0.903 110.4 53.7 -62.1 -41.9 31.6 22.7 59.1 30 30 A L H X S+ 0 0 76 -4,-3.1 4,-2.6 1,-0.2 -1,-0.2 0.887 108.1 50.7 -60.2 -39.2 30.7 23.7 62.7 31 31 A T H X S+ 0 0 17 -4,-2.2 4,-2.8 -5,-0.2 -1,-0.2 0.918 111.1 47.2 -66.2 -43.4 28.5 26.5 61.3 32 32 A I H X S+ 0 0 66 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.937 113.2 48.4 -63.1 -46.9 26.7 24.3 58.9 33 33 A L H X S+ 0 0 91 -4,-3.0 4,-2.9 1,-0.2 5,-0.2 0.913 112.1 50.1 -58.6 -42.9 26.1 21.7 61.7 34 34 A T H X S+ 0 0 19 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.916 111.3 48.4 -60.5 -45.1 24.9 24.5 63.9 35 35 A L H X S+ 0 0 13 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.852 112.9 48.2 -64.4 -36.3 22.6 25.7 61.2 36 36 A I H X S+ 0 0 85 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.933 111.3 48.3 -70.9 -46.3 21.3 22.1 60.6 37 37 A S H X S+ 0 0 64 -4,-2.9 4,-3.6 1,-0.2 5,-0.2 0.947 112.8 51.0 -58.1 -45.5 20.7 21.5 64.3 38 38 A G H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.2 5,-0.3 0.926 109.5 48.6 -56.6 -48.8 18.9 24.8 64.4 39 39 A T H X S+ 0 0 29 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.901 114.8 46.2 -59.1 -42.7 16.7 23.9 61.5 40 40 A I H X S+ 0 0 97 -4,-2.9 4,-2.8 2,-0.2 5,-0.3 0.956 113.4 48.4 -65.3 -51.0 15.9 20.6 63.1 41 41 A F H X>S+ 0 0 21 -4,-3.6 4,-2.8 1,-0.2 5,-0.7 0.940 113.9 43.9 -55.6 -54.3 15.2 22.1 66.5 42 42 A Y H <5S+ 0 0 0 -4,-2.6 6,-2.0 3,-0.2 4,-0.3 0.789 115.5 48.2 -66.3 -27.5 12.9 24.9 65.4 43 43 A S H X5S+ 0 0 32 -4,-1.5 4,-0.5 -5,-0.3 -1,-0.2 0.941 121.9 36.2 -75.2 -47.1 10.9 22.7 62.9 44 44 A T H <5S+ 0 0 103 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.996 130.1 27.6 -65.9 -67.7 10.5 20.0 65.6 45 45 A V T <5S+ 0 0 42 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.1 0.889 132.3 33.5 -66.4 -44.9 10.1 22.0 68.8 46 46 A E T 4> - 0 0 121 -2,-0.3 4,-1.6 1,-0.1 3,-1.1 -0.306 43.3-106.7 -55.2 144.2 8.1 24.7 58.3 50 50 A P H >> S+ 0 0 83 0, 0.0 4,-1.9 0, 0.0 3,-0.7 0.885 119.9 49.8 -41.9 -55.0 11.6 23.5 57.6 51 51 A I H 3> S+ 0 0 26 1,-0.3 4,-1.7 2,-0.2 5,-0.1 0.821 110.7 51.5 -58.5 -31.6 12.5 26.4 55.4 52 52 A D H <> S+ 0 0 44 -3,-1.1 4,-2.3 2,-0.2 -1,-0.3 0.778 108.1 52.5 -75.7 -25.4 11.2 28.8 58.1 53 53 A A H S+ 0 0 0 -4,-3.0 6,-2.6 1,-0.2 5,-0.6 0.818 117.0 47.5 -67.5 -26.9 19.0 35.3 61.0 60 60 A T H ><5S+ 0 0 14 -4,-2.1 3,-1.3 -5,-0.3 -2,-0.2 0.934 110.8 48.5 -77.3 -48.5 19.3 34.4 64.7 61 61 A L H 3<5S+ 0 0 20 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.775 115.8 45.9 -63.5 -24.7 22.9 33.0 64.5 62 62 A T T 3<5S- 0 0 21 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.433 109.5-121.9 -98.6 1.7 24.0 36.1 62.5 63 63 A T T < 5S+ 0 0 87 -3,-1.3 -3,-0.2 -4,-0.2 -4,-0.1 0.406 83.6 115.7 71.4 1.5 22.3 38.6 64.9 64 64 A V < - 0 0 8 -5,-0.6 -4,-0.2 -6,-0.3 -5,-0.1 0.973 62.6-162.8 -59.9 -53.7 20.2 39.9 61.9 65 65 A G - 0 0 30 -6,-2.6 2,-0.5 -9,-0.1 106,-0.3 0.090 18.6 -93.6 88.6 157.8 17.1 38.7 63.6 66 66 A D - 0 0 31 3,-0.3 109,-0.1 104,-0.1 106,-0.1 -0.955 20.2-156.4-112.8 126.6 13.5 38.1 62.6 67 67 A G S S+ 0 0 28 -2,-0.5 108,-0.1 104,-0.5 -1,-0.1 0.445 90.2 33.4 -81.2 0.7 10.9 40.8 63.0 68 68 A N S S+ 0 0 96 1,-0.2 2,-0.4 106,-0.1 -1,-0.1 0.709 107.1 61.1-122.1 -40.6 7.9 38.5 63.1 69 69 A F + 0 0 41 3,-0.0 -3,-0.3 0, 0.0 -1,-0.2 -0.762 46.0 166.7-101.1 140.6 8.9 35.3 64.8 70 70 A S - 0 0 69 -2,-0.4 7,-0.1 -3,-0.1 6,-0.0 -0.981 52.0 -88.1-140.9 137.2 10.1 34.7 68.3 71 71 A P - 0 0 19 0, 0.0 -25,-0.0 0, 0.0 6,-0.0 -0.205 34.1-158.2 -50.6 135.7 10.2 31.2 69.9 72 72 A Q + 0 0 136 -26,-0.0 2,-0.3 4,-0.0 -26,-0.0 0.682 65.9 66.6 -92.5 -19.1 6.9 30.4 71.5 73 73 A T S > S- 0 0 48 1,-0.1 4,-2.8 0, 0.0 5,-0.2 -0.740 78.8-126.7-107.2 155.0 8.1 27.7 74.0 74 74 A D H > S+ 0 0 125 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.787 115.1 55.3 -63.8 -27.6 10.4 27.9 77.0 75 75 A F H > S+ 0 0 132 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.904 109.4 46.5 -71.7 -41.3 12.3 25.1 75.4 76 76 A G H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.924 111.1 51.6 -65.9 -44.3 12.8 27.2 72.3 77 77 A K H X S+ 0 0 100 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.927 112.3 45.5 -58.9 -46.8 13.7 30.3 74.3 78 78 A I H X S+ 0 0 106 -4,-2.1 4,-2.0 1,-0.2 5,-0.2 0.943 113.7 49.3 -63.2 -47.4 16.4 28.4 76.2 79 79 A F H X S+ 0 0 46 -4,-2.4 4,-3.1 1,-0.2 -2,-0.2 0.914 109.5 52.2 -58.2 -43.7 17.7 26.8 73.1 80 80 A T H X S+ 0 0 12 -4,-3.0 4,-3.0 2,-0.2 -1,-0.2 0.901 104.9 56.0 -61.4 -39.9 17.9 30.1 71.3 81 81 A I H X S+ 0 0 89 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.964 114.8 38.4 -55.1 -54.3 19.9 31.6 74.1 82 82 A L H X S+ 0 0 107 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.881 112.2 58.1 -64.6 -39.4 22.5 28.9 73.8 83 83 A Y H X S+ 0 0 9 -4,-3.1 4,-2.3 -5,-0.2 -1,-0.2 0.945 105.5 51.1 -56.0 -48.5 22.2 28.9 70.0 84 84 A I H X S+ 0 0 58 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.893 108.7 49.5 -58.2 -43.3 23.1 32.6 70.0 85 85 A F H X S+ 0 0 129 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.840 106.9 55.9 -68.4 -29.5 26.2 32.2 72.1 86 86 A I H X S+ 0 0 84 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.973 108.3 49.2 -62.3 -49.9 27.4 29.4 69.8 87 87 A G H X S+ 0 0 7 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.862 111.0 47.8 -56.1 -40.4 27.1 31.8 67.0 88 88 A I H X S+ 0 0 54 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.888 110.7 52.9 -69.4 -36.5 29.1 34.4 68.9 89 89 A G H X S+ 0 0 43 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.937 110.4 47.7 -62.0 -44.0 31.6 31.7 69.7 90 90 A L H X S+ 0 0 18 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.888 110.2 51.4 -64.0 -40.4 31.9 30.9 66.0 91 91 A V H X S+ 0 0 49 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.893 109.3 49.1 -67.2 -39.2 32.3 34.5 64.9 92 92 A F H X S+ 0 0 131 -4,-2.2 4,-3.6 2,-0.2 5,-0.2 0.893 109.0 55.7 -65.8 -36.6 35.1 35.2 67.4 93 93 A G H X S+ 0 0 21 -4,-1.9 4,-2.9 -5,-0.2 -2,-0.2 0.967 110.4 43.0 -57.5 -54.3 36.7 32.0 66.1 94 94 A F H X S+ 0 0 24 -4,-2.4 4,-3.2 1,-0.2 5,-0.2 0.915 116.6 48.7 -58.1 -43.6 36.6 33.4 62.5 95 95 A I H X S+ 0 0 66 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.898 110.2 50.1 -65.0 -40.7 37.8 36.8 63.8 96 96 A H H X S+ 0 0 126 -4,-3.6 4,-2.6 2,-0.2 -2,-0.2 0.952 112.7 49.2 -60.6 -46.3 40.6 35.2 65.8 97 97 A K H X S+ 0 0 14 -4,-2.9 4,-3.0 1,-0.2 5,-0.3 0.965 110.1 48.1 -56.2 -57.5 41.6 33.3 62.7 98 98 A L H X S+ 0 0 28 -4,-3.2 4,-0.5 1,-0.2 -1,-0.2 0.828 111.8 54.0 -53.7 -31.6 41.5 36.4 60.5 99 99 A A H >X S+ 0 0 45 -4,-2.0 4,-1.0 -5,-0.2 3,-0.7 0.928 110.3 43.4 -69.3 -46.3 43.6 38.0 63.2 100 100 A V H >X S+ 0 0 56 -4,-2.6 4,-1.5 1,-0.2 3,-0.8 0.922 109.6 56.8 -65.2 -44.5 46.3 35.3 63.2 101 101 A N H 3< S+ 0 0 76 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.648 105.6 53.8 -62.0 -15.3 46.4 35.1 59.4 102 102 A V H << S+ 0 0 23 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.794 113.1 39.8 -87.7 -30.1 47.2 38.9 59.4 103 103 A Q H << 0 0 118 -4,-1.0 -2,-0.2 -3,-0.8 -3,-0.1 0.872 360.0 360.0 -89.5 -46.9 50.2 38.7 61.7 104 104 A L < 0 0 189 -4,-1.5 -3,-0.0 0, 0.0 -4,-0.0 0.542 360.0 360.0 -4.6 360.0 52.5 35.7 61.2 105 !* 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,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 131.8 38.9 73.2 70.8 107 2 B L H > + 0 0 121 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.868 360.0 59.7 -66.0 -38.4 41.4 73.4 67.9 108 3 B S H > S+ 0 0 89 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.925 103.9 51.6 -55.7 -45.8 42.9 70.1 69.1 109 4 B F H > S+ 0 0 141 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.943 111.5 44.6 -57.2 -54.5 39.6 68.4 68.5 110 5 B L H X S+ 0 0 93 -4,-1.7 4,-3.5 1,-0.2 5,-0.2 0.935 113.3 50.2 -57.5 -49.9 39.1 69.7 65.0 111 6 B L H X S+ 0 0 101 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.913 112.7 47.2 -56.3 -45.1 42.7 68.9 64.0 112 7 B T H X S+ 0 0 58 -4,-2.6 4,-2.4 -5,-0.2 -1,-0.2 0.922 113.8 47.7 -62.8 -44.2 42.4 65.4 65.4 113 8 B L H X S+ 0 0 68 -4,-2.8 4,-3.5 1,-0.2 5,-0.2 0.952 112.0 49.9 -60.6 -50.6 39.0 64.9 63.6 114 9 B K H X S+ 0 0 121 -4,-3.5 4,-2.2 2,-0.2 -1,-0.2 0.866 109.7 50.7 -56.5 -40.9 40.5 66.3 60.3 115 10 B R H X S+ 0 0 139 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.958 113.1 46.0 -62.3 -49.2 43.4 64.0 60.5 116 11 B M H X S+ 0 0 116 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.916 111.8 51.1 -58.9 -45.9 41.1 61.0 61.1 117 12 B L H X S+ 0 0 88 -4,-3.5 4,-2.1 1,-0.2 -1,-0.2 0.857 110.6 50.1 -60.7 -34.4 38.9 62.2 58.2 118 13 B R H X S+ 0 0 132 -4,-2.2 4,-1.6 -5,-0.2 -2,-0.2 0.910 109.9 49.2 -70.0 -42.1 42.0 62.4 56.1 119 14 B A H < S+ 0 0 50 -4,-2.6 4,-0.3 2,-0.2 -2,-0.2 0.834 110.7 51.8 -65.1 -32.6 43.0 58.9 57.1 120 15 B C H >X S+ 0 0 64 -4,-2.2 3,-1.6 1,-0.2 4,-0.9 0.936 109.3 48.6 -69.4 -46.1 39.5 57.7 56.3 121 16 B L H 3< S+ 0 0 111 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.782 100.7 65.4 -64.8 -27.4 39.6 59.3 52.8 122 17 B R T 3< S+ 0 0 153 -4,-1.6 3,-0.5 1,-0.2 -1,-0.3 0.672 97.5 58.1 -68.9 -13.8 43.0 57.7 52.2 123 18 B A T X4 S+ 0 0 26 -3,-1.6 3,-2.4 -4,-0.3 6,-0.2 0.866 92.2 63.6 -81.6 -39.6 41.1 54.4 52.3 124 19 B W T 3< S+ 0 0 120 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.349 101.9 55.8 -67.3 10.8 38.7 55.2 49.5 125 20 B K T 3 S+ 0 0 155 -3,-0.5 2,-0.4 5,-0.0 -1,-0.3 0.461 83.0 100.4-116.1 -12.9 41.9 55.3 47.4 126 21 B D S <> S- 0 0 50 -3,-2.4 4,-2.2 1,-0.1 5,-0.2 -0.617 70.3-141.2 -76.4 130.8 43.0 51.8 48.4 127 22 B K H > S+ 0 0 108 -2,-0.4 4,-2.2 1,-0.2 -1,-0.1 0.915 99.2 50.5 -59.8 -48.1 42.1 49.3 45.6 128 23 B E H > S+ 0 0 46 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.857 111.7 49.6 -60.5 -35.6 41.0 46.4 47.8 129 24 B F H > S+ 0 0 34 -6,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.919 107.7 53.3 -69.2 -42.9 38.7 48.8 49.7 130 25 B Q H X S+ 0 0 67 -4,-2.2 4,-2.9 -7,-0.2 -2,-0.2 0.889 109.7 50.0 -58.1 -41.0 37.2 50.1 46.5 131 26 B V H X S+ 0 0 0 -4,-2.2 4,-3.4 2,-0.2 5,-0.2 0.976 111.1 46.3 -61.2 -57.4 36.4 46.6 45.5 132 27 B L H X S+ 0 0 11 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.906 114.7 50.7 -52.9 -42.0 34.8 45.7 48.8 133 28 B F H X S+ 0 0 91 -4,-3.1 4,-2.2 2,-0.2 -1,-0.2 0.928 111.3 45.0 -62.9 -47.1 32.9 49.0 48.5 134 29 B V H X S+ 0 0 47 -4,-2.9 4,-3.7 1,-0.2 5,-0.3 0.939 111.6 55.4 -62.6 -44.9 31.7 48.3 45.0 135 30 B L H X S+ 0 0 49 -4,-3.4 4,-2.5 1,-0.2 -1,-0.2 0.887 108.6 45.0 -56.7 -42.8 30.7 44.8 45.9 136 31 B T H X S+ 0 0 26 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.925 114.3 49.8 -71.3 -37.2 28.5 45.9 48.8 137 32 B I H X S+ 0 0 67 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.952 112.5 47.3 -60.7 -47.7 26.9 48.6 46.7 138 33 B L H X S+ 0 0 89 -4,-3.7 4,-2.8 1,-0.2 -1,-0.2 0.901 111.6 51.7 -58.6 -39.8 26.4 45.9 44.0 139 34 B T H X S+ 0 0 19 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.874 109.2 49.6 -64.1 -39.2 24.9 43.6 46.6 140 35 B L H X S+ 0 0 32 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.882 111.1 49.7 -66.9 -39.4 22.6 46.4 47.8 141 36 B I H X S+ 0 0 84 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.957 111.1 48.9 -63.4 -50.8 21.4 47.0 44.2 142 37 B S H X S+ 0 0 63 -4,-2.8 4,-3.3 1,-0.2 -2,-0.2 0.909 112.0 49.0 -55.7 -45.0 20.8 43.3 43.7 143 38 B G H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.4 0.913 109.4 52.1 -61.5 -43.9 18.9 43.1 46.9 144 39 B T H X S+ 0 0 25 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.926 114.0 44.1 -58.1 -45.8 16.8 46.1 45.9 145 40 B I H X S+ 0 0 102 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.973 115.6 46.9 -64.5 -54.5 16.0 44.4 42.6 146 41 B F H X>S+ 0 0 20 -4,-3.3 4,-2.8 1,-0.2 5,-0.7 0.957 116.4 41.0 -52.2 -62.9 15.3 41.0 44.0 147 42 B Y H <5S+ 0 0 0 -4,-2.6 6,-1.7 1,-0.2 4,-0.5 0.791 115.5 52.8 -59.3 -28.5 13.0 42.1 46.9 148 43 B S H <5S+ 0 0 33 -4,-1.5 -1,-0.2 -5,-0.4 -2,-0.2 0.913 122.0 31.2 -72.2 -40.7 11.3 44.6 44.6 149 44 B T H <5S+ 0 0 105 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.983 128.5 31.4 -79.2 -65.9 10.7 41.9 42.1 150 45 B V T <5S+ 0 0 40 -4,-2.8 -3,-0.2 1,-0.2 31,-0.1 0.794 130.4 33.3 -68.0 -33.7 10.2 38.6 44.0 151 46 B E S > - 0 0 167 -2,-0.3 4,-2.0 1,-0.1 3,-0.6 -0.380 40.8-107.5 -63.2 150.1 8.4 49.3 46.4 155 50 B P H 3> S+ 0 0 85 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.887 121.3 53.6 -47.5 -44.0 12.1 50.0 45.4 156 51 B I H 3> S+ 0 0 96 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.897 112.5 43.0 -60.0 -41.7 12.5 52.2 48.5 157 52 B D H <> S+ 0 0 74 -3,-0.6 4,-1.8 2,-0.2 -1,-0.2 0.700 111.6 55.1 -78.1 -19.3 11.3 49.4 50.8 158 53 B A H X S+ 0 0 0 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.833 110.3 45.7 -80.1 -32.9 13.4 46.8 48.9 159 54 B L H X S+ 0 0 69 -4,-2.2 4,-2.9 -5,-0.3 5,-0.2 0.924 112.2 51.7 -72.3 -44.9 16.5 48.9 49.5 160 55 B Y H X S+ 0 0 133 -4,-2.1 4,-3.0 1,-0.2 5,-0.3 0.940 112.7 44.1 -56.6 -52.3 15.6 49.5 53.2 161 56 B F H X S+ 0 0 5 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.873 113.6 51.9 -62.5 -37.5 15.1 45.8 53.8 162 57 B S H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.918 114.7 42.1 -63.8 -44.5 18.3 45.0 51.8 163 58 B V H X S+ 0 0 56 -4,-2.9 4,-1.7 2,-0.2 6,-0.3 0.950 115.5 47.9 -66.5 -52.2 20.3 47.5 53.9 164 59 B V H <>S+ 0 0 7 -4,-3.0 6,-3.0 -5,-0.2 5,-0.7 0.810 117.3 44.5 -60.7 -30.5 18.8 46.6 57.2 165 60 B T H ><5S+ 0 0 3 -4,-1.8 3,-1.3 -5,-0.3 -2,-0.2 0.933 110.6 49.9 -81.2 -49.7 19.4 42.9 56.4 166 61 B L H 3<5S+ 0 0 25 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.746 115.0 46.5 -62.7 -24.1 22.9 43.0 55.0 167 62 B T T 3<5S- 0 0 72 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.478 110.2-120.8 -97.4 -3.0 24.0 45.1 58.1 168 63 B T T < 5S+ 0 0 45 -3,-1.3 -3,-0.2 -4,-0.2 -4,-0.1 0.451 82.3 117.8 75.7 4.9 22.2 42.8 60.7 169 64 B V < - 0 0 104 -5,-0.7 -4,-0.2 -6,-0.3 -5,-0.1 0.968 61.6-159.6 -62.8 -50.5 20.1 45.6 61.9 170 65 B G - 0 0 16 -6,-3.0 2,-0.5 -9,-0.1 -104,-0.1 0.074 16.8 -94.9 87.5 157.0 17.0 43.8 60.8 171 66 B D - 0 0 33 -106,-0.3 -104,-0.5 3,-0.3 -1,-0.0 -0.954 20.2-154.0-111.6 126.9 13.4 44.9 60.1 172 67 B G S S+ 0 0 50 -2,-0.5 -1,-0.1 1,-0.1 3,-0.1 0.520 91.0 29.0 -78.3 -3.5 10.9 44.6 62.8 173 68 B N S S+ 0 0 141 1,-0.2 2,-0.4 -105,-0.0 -1,-0.1 0.739 104.8 67.3-122.2 -43.6 7.9 44.3 60.5 174 69 B F + 0 0 43 -106,-0.0 -107,-0.3 -108,-0.0 -3,-0.3 -0.712 46.5 171.1 -93.3 131.7 8.9 42.7 57.2 175 70 B S - 0 0 12 -2,-0.4 7,-0.1 -108,-0.1 -109,-0.1 -0.995 49.2 -91.6-130.8 134.6 9.9 39.1 56.8 176 71 B P - 0 0 6 0, 0.0 -25,-0.0 0, 0.0 6,-0.0 -0.159 35.7-162.2 -46.4 134.7 10.3 37.5 53.3 177 72 B Q + 0 0 134 -26,-0.0 2,-0.2 4,-0.0 -26,-0.1 0.758 64.3 65.7 -95.5 -27.3 7.0 35.9 52.3 178 73 B T S > S- 0 0 49 1,-0.1 4,-2.2 -28,-0.0 5,-0.1 -0.629 79.9-126.3 -96.9 155.8 8.1 33.6 49.5 179 74 B D H > S+ 0 0 67 -2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.843 114.4 54.0 -65.9 -33.6 10.3 30.6 49.8 180 75 B F H > S+ 0 0 129 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.895 107.9 50.6 -67.6 -38.6 12.5 32.0 47.1 181 76 B G H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.918 109.8 49.7 -64.8 -42.4 12.8 35.2 49.1 182 77 B K H X S+ 0 0 24 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.911 112.2 47.4 -63.3 -41.9 13.8 33.3 52.3 183 78 B I H X S+ 0 0 72 -4,-2.2 4,-2.0 2,-0.2 5,-0.2 0.915 113.0 49.0 -65.6 -43.1 16.5 31.3 50.4 184 79 B F H X S+ 0 0 50 -4,-2.5 4,-3.2 1,-0.2 -2,-0.2 0.925 109.3 51.6 -62.4 -45.0 17.8 34.5 48.8 185 80 B T H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 -1,-0.2 0.887 106.5 55.8 -60.2 -38.0 17.9 36.3 52.2 186 81 B I H X S+ 0 0 16 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.967 114.4 37.7 -58.1 -54.6 19.9 33.4 53.6 187 82 B L H X S+ 0 0 98 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.883 114.0 57.7 -64.7 -37.8 22.6 33.6 50.9 188 83 B Y H X S+ 0 0 4 -4,-3.2 4,-2.5 1,-0.2 3,-0.2 0.929 104.6 51.3 -57.5 -47.8 22.3 37.4 51.0 189 84 B I H X S+ 0 0 3 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.899 109.3 49.6 -59.7 -41.6 23.1 37.5 54.7 190 85 B F H X S+ 0 0 78 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.818 107.1 54.2 -70.8 -26.8 26.2 35.3 54.2 191 86 B I H X S+ 0 0 84 -4,-1.8 4,-2.7 -3,-0.2 -2,-0.2 0.963 108.7 51.2 -66.3 -47.9 27.4 37.6 51.4 192 87 B G H X S+ 0 0 3 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.895 110.5 46.8 -53.1 -45.1 27.1 40.4 53.9 193 88 B I H X S+ 0 0 39 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.913 111.0 51.9 -66.0 -40.6 29.1 38.5 56.5 194 89 B G H X S+ 0 0 43 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.890 110.4 51.0 -60.6 -36.5 31.7 37.7 53.9 195 90 B L H X S+ 0 0 16 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.949 109.2 47.9 -65.4 -50.2 31.8 41.4 53.1 196 91 B V H X S+ 0 0 63 -4,-2.6 4,-3.5 1,-0.2 -2,-0.2 0.899 110.3 50.8 -61.2 -41.8 32.3 42.5 56.7 197 92 B F H X S+ 0 0 40 -4,-2.5 4,-3.7 1,-0.2 5,-0.3 0.904 108.0 56.6 -60.8 -37.2 35.1 40.0 57.3 198 93 B G H X S+ 0 0 21 -4,-1.6 4,-1.9 -5,-0.3 -2,-0.2 0.934 111.3 40.4 -57.9 -48.2 36.6 41.4 54.1 199 94 B F H X S+ 0 0 54 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.914 116.2 51.3 -66.8 -42.9 36.5 44.9 55.6 200 95 B I H X S+ 0 0 65 -4,-3.5 4,-2.9 2,-0.2 -2,-0.2 0.976 111.0 46.8 -57.2 -57.3 37.7 43.6 59.0 201 96 B H H X S+ 0 0 68 -4,-3.7 4,-2.5 1,-0.2 -1,-0.2 0.887 112.3 53.3 -51.6 -40.6 40.6 41.7 57.4 202 97 B K H X S+ 0 0 18 -4,-1.9 4,-1.8 -5,-0.3 -1,-0.2 0.965 110.1 44.3 -61.4 -53.7 41.4 44.9 55.5 203 98 B L H < S+ 0 0 113 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.869 112.1 56.6 -58.9 -34.7 41.5 47.0 58.6 204 99 B A H >< S+ 0 0 24 -4,-2.9 3,-1.2 -5,-0.2 -1,-0.2 0.915 107.7 45.2 -62.9 -45.7 43.5 44.3 60.2 205 100 B V H >< S+ 0 0 58 -4,-2.5 3,-1.3 1,-0.3 -1,-0.2 0.785 105.4 62.3 -69.6 -27.8 46.2 44.3 57.5 206 101 B N T 3< S+ 0 0 101 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.455 94.9 62.7 -77.2 -0.1 46.3 48.2 57.6 207 102 B V T < 0 0 113 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 0.449 360.0 360.0-100.2 -4.7 47.4 48.0 61.2 208 103 B Q < 0 0 128 -3,-1.3 -2,-0.2 -4,-0.1 -3,-0.1 0.929 360.0 360.0 -82.0 360.0 50.6 46.2 60.2