==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 24-SEP-09 3K04 . COMPND 2 MOLECULE: POTASSIUM CHANNEL PROTEIN NAK; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR Y.JIANG,M.G.DEREBE . 185 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12598.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 142 76.8 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 . 9 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 64.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 4.9 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 1 0 0 1 0 0 2 0 0 0 0 0 0 0 0 0 1 0 0 2 0 0 1 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 23 A E > 0 0 140 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -72.0 0.4 -18.2 40.3 2 24 A F H > + 0 0 54 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.930 360.0 50.1 -55.3 -49.2 2.9 -17.9 37.5 3 25 A Q H > S+ 0 0 158 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.858 112.9 48.0 -59.3 -35.2 2.3 -21.4 36.3 4 26 A V H > S+ 0 0 85 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.876 112.0 46.7 -73.9 -38.5 -1.5 -20.6 36.3 5 27 A L H X S+ 0 0 32 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.815 110.5 57.4 -70.0 -29.2 -1.1 -17.3 34.5 6 28 A F H X S+ 0 0 102 -4,-2.4 4,-2.1 -5,-0.3 -2,-0.2 0.967 110.5 40.6 -61.9 -55.8 1.2 -19.3 32.1 7 29 A V H X S+ 0 0 77 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.904 114.3 51.7 -61.4 -45.9 -1.6 -21.8 31.3 8 30 A L H X S+ 0 0 79 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.901 110.4 49.3 -60.2 -40.9 -4.4 -19.2 31.1 9 31 A T H X S+ 0 0 10 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.919 110.1 53.0 -63.9 -42.3 -2.3 -17.2 28.7 10 32 A I H X S+ 0 0 69 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.936 108.5 47.5 -58.0 -51.2 -1.7 -20.3 26.6 11 33 A L H X S+ 0 0 102 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.896 111.0 52.4 -58.4 -41.9 -5.3 -21.2 26.3 12 34 A T H X S+ 0 0 30 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.914 112.4 44.6 -61.5 -43.5 -6.2 -17.6 25.3 13 35 A L H X S+ 0 0 30 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.844 110.4 54.9 -70.8 -34.2 -3.6 -17.6 22.6 14 36 A I H X S+ 0 0 85 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.926 108.6 48.7 -64.4 -42.7 -4.6 -21.1 21.4 15 37 A S H X S+ 0 0 61 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.910 112.2 48.9 -62.7 -42.6 -8.2 -19.9 21.0 16 38 A G H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 5,-0.3 0.919 109.8 51.6 -63.2 -43.1 -7.0 -16.9 19.1 17 39 A T H X S+ 0 0 30 -4,-2.7 4,-1.8 1,-0.2 5,-0.2 0.934 112.6 45.1 -60.3 -46.3 -4.8 -19.0 16.8 18 40 A I H X S+ 0 0 101 -4,-2.5 4,-1.8 2,-0.2 5,-0.2 0.941 114.8 49.6 -63.3 -45.1 -7.7 -21.3 16.0 19 41 A F H X>S+ 0 0 24 -4,-2.7 4,-2.9 -5,-0.2 5,-0.5 0.957 114.1 40.4 -60.3 -55.0 -10.1 -18.4 15.4 20 42 A Y H X5S+ 0 0 2 -4,-2.8 6,-1.7 1,-0.2 4,-0.9 0.838 113.4 53.6 -67.8 -30.9 -7.9 -16.3 13.1 21 43 A S H <5S+ 0 0 30 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.890 118.6 37.3 -69.3 -35.5 -6.6 -19.2 11.1 22 44 A T H <5S+ 0 0 103 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.2 0.955 128.5 27.6 -79.5 -54.4 -10.2 -20.3 10.5 23 45 A V H <5S+ 0 0 40 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.865 132.1 33.6 -80.6 -39.8 -12.2 -17.1 10.0 24 46 A E S <> - 0 0 161 -2,-0.2 4,-2.5 1,-0.1 3,-0.6 -0.473 43.2-107.0 -67.8 148.9 -1.5 -19.6 8.5 28 50 A P H 3> S+ 0 0 86 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.881 119.2 50.6 -47.6 -46.9 -1.3 -20.8 12.1 29 51 A I H 3> S+ 0 0 96 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.887 112.8 46.9 -61.9 -36.9 1.9 -18.9 12.9 30 52 A D H <> S+ 0 0 69 -3,-0.6 4,-2.6 2,-0.2 -1,-0.2 0.842 110.9 52.5 -72.1 -32.4 0.4 -15.7 11.6 31 53 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.889 111.4 46.5 -68.7 -39.5 -2.8 -16.3 13.5 32 54 A L H X S+ 0 0 65 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.904 111.9 51.4 -67.7 -41.6 -0.7 -16.7 16.7 33 55 A Y H X S+ 0 0 102 -4,-2.3 4,-2.8 -5,-0.2 5,-0.3 0.946 109.9 48.5 -61.8 -47.9 1.3 -13.6 15.9 34 56 A F H X S+ 0 0 17 -4,-2.6 4,-1.9 1,-0.2 5,-0.2 0.922 111.0 51.5 -58.0 -43.6 -1.8 -11.5 15.4 35 57 A S H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.924 112.7 46.0 -59.6 -43.6 -3.2 -12.8 18.7 36 58 A V H X S+ 0 0 54 -4,-2.5 4,-1.8 1,-0.2 6,-0.3 0.931 114.0 44.1 -67.3 -49.0 -0.0 -11.9 20.5 37 59 A V H <>S+ 0 0 6 -4,-2.8 6,-2.8 2,-0.2 5,-0.7 0.780 114.4 53.0 -70.8 -21.8 0.5 -8.4 19.1 38 60 A T H ><5S+ 0 0 19 -4,-1.9 3,-1.1 -5,-0.3 -2,-0.2 0.967 112.0 42.1 -74.9 -52.3 -3.2 -7.7 19.6 39 61 A L H 3<5S+ 0 0 1 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.761 117.2 47.0 -67.4 -24.6 -3.4 -8.7 23.3 40 62 A T T 3<5S- 0 0 32 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.494 112.0-123.9 -91.7 -2.7 -0.1 -7.0 24.1 41 63 A T T < 5S+ 0 0 102 -3,-1.1 -3,-0.2 -4,-0.3 -4,-0.1 0.476 79.3 121.2 73.0 8.3 -1.3 -3.9 22.2 42 64 A V < + 0 0 88 -5,-0.7 -4,-0.2 -6,-0.3 -5,-0.1 0.929 41.5 176.5 -62.1 -43.4 1.7 -3.8 19.8 43 65 A G + 0 0 48 -6,-2.8 -5,-0.1 -9,-0.1 -9,-0.1 0.842 16.1 152.2 40.0 55.8 -0.9 -4.2 17.0 44 66 A D + 0 0 90 2,-0.1 -1,-0.1 -10,-0.0 -10,-0.1 0.430 46.6 83.2 -93.1 3.0 1.6 -4.0 14.1 45 67 A T S S- 0 0 42 -11,-0.1 0, 0.0 1,-0.1 0, 0.0 -0.680 90.3 -89.3-108.4 160.7 -0.5 -6.0 11.7 46 68 A P - 0 0 109 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.303 53.7-105.7 -61.0 146.4 -3.4 -5.2 9.4 47 69 A P - 0 0 103 0, 0.0 7,-0.1 0, 0.0 6,-0.0 -0.184 46.1 -73.9 -71.9 168.2 -6.8 -5.5 11.1 48 70 A P - 0 0 14 0, 0.0 -24,-0.0 0, 0.0 -28,-0.0 -0.257 35.4-150.9 -58.5 149.3 -9.3 -8.4 10.5 49 71 A Q S S+ 0 0 165 -3,-0.1 2,-0.3 -25,-0.0 -25,-0.1 0.667 71.9 71.0 -97.5 -21.0 -11.1 -8.1 7.2 50 72 A T S > S- 0 0 50 1,-0.1 4,-2.2 0, 0.0 5,-0.1 -0.677 79.7-128.4 -97.9 152.6 -14.3 -9.9 8.2 51 73 A D H > S+ 0 0 114 -2,-0.3 4,-2.8 2,-0.2 5,-0.2 0.876 113.6 54.7 -63.7 -36.3 -17.0 -8.5 10.5 52 74 A F H > S+ 0 0 127 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.930 108.1 50.5 -61.5 -42.6 -16.9 -11.7 12.5 53 75 A G H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.916 110.9 48.2 -61.8 -41.9 -13.1 -11.1 12.9 54 76 A K H X S+ 0 0 96 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.939 113.3 46.6 -65.6 -45.5 -13.7 -7.5 14.0 55 77 A I H X S+ 0 0 102 -4,-2.8 4,-2.0 2,-0.2 5,-0.2 0.936 114.0 47.1 -62.7 -47.5 -16.4 -8.5 16.6 56 78 A F H X S+ 0 0 42 -4,-2.7 4,-3.4 -5,-0.2 5,-0.2 0.935 110.6 53.5 -59.7 -45.2 -14.4 -11.4 18.0 57 79 A T H X S+ 0 0 14 -4,-2.4 4,-2.8 -5,-0.3 -1,-0.2 0.896 105.8 53.2 -57.9 -42.1 -11.3 -9.1 18.2 58 80 A I H X S+ 0 0 97 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.953 115.8 39.2 -58.2 -50.2 -13.2 -6.5 20.2 59 81 A L H X S+ 0 0 102 -4,-2.0 4,-2.3 1,-0.2 5,-0.3 0.898 113.7 55.6 -67.0 -38.8 -14.3 -9.1 22.7 60 82 A Y H X S+ 0 0 16 -4,-3.4 4,-2.4 -5,-0.2 5,-0.3 0.903 107.5 50.1 -60.7 -42.4 -10.9 -10.9 22.6 61 83 A I H X S+ 0 0 64 -4,-2.8 4,-2.4 -5,-0.2 5,-0.3 0.966 111.7 46.5 -61.8 -52.9 -9.1 -7.6 23.5 62 84 A F H < S+ 0 0 167 -4,-1.9 4,-0.4 1,-0.2 -2,-0.2 0.856 120.6 37.7 -60.3 -36.3 -11.4 -6.8 26.5 63 85 A I H < S+ 0 0 139 -4,-2.3 4,-0.4 -5,-0.2 -1,-0.2 0.775 124.2 37.5 -88.4 -25.9 -11.2 -10.3 28.0 64 86 A G H X S+ 0 0 2 -4,-2.4 4,-2.6 -5,-0.3 5,-0.2 0.713 97.0 72.7-100.2 -22.9 -7.6 -11.1 27.2 65 87 A I H X S+ 0 0 59 -4,-2.4 4,-2.1 -5,-0.3 5,-0.3 0.927 98.6 50.3 -59.2 -45.9 -5.6 -7.9 27.7 66 88 A G H > S+ 0 0 50 -4,-0.4 4,-1.5 -5,-0.3 -1,-0.2 0.916 113.5 45.4 -58.6 -45.0 -5.9 -8.1 31.5 67 89 A L H > S+ 0 0 34 -4,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.926 110.6 52.3 -64.4 -49.0 -4.7 -11.7 31.6 68 90 A V H X S+ 0 0 10 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.903 113.6 42.8 -57.9 -44.0 -1.8 -11.2 29.3 69 91 A F H X S+ 0 0 78 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.792 109.6 57.4 -75.2 -25.5 -0.3 -8.3 31.2 70 92 A G H < S+ 0 0 23 -4,-1.5 -2,-0.2 -5,-0.3 -1,-0.2 0.932 109.6 46.2 -66.7 -43.4 -1.0 -9.9 34.5 71 93 A F H >X S+ 0 0 28 -4,-2.4 4,-2.4 1,-0.2 3,-1.4 0.915 112.6 49.4 -62.7 -44.7 1.2 -12.8 33.3 72 94 A I H 3X S+ 0 0 66 -4,-2.1 4,-1.2 1,-0.3 5,-0.3 0.874 102.2 62.5 -62.7 -37.0 3.8 -10.4 32.0 73 95 A H H 3< S+ 0 0 112 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.189 114.8 34.6 -75.3 19.7 3.8 -8.6 35.4 74 96 A K H <>>S+ 0 0 38 -3,-1.4 4,-2.6 3,-0.1 5,-0.5 0.464 103.2 67.6-138.2 -36.3 5.0 -11.9 36.8 75 97 A L H <>S+ 0 0 75 -4,-2.4 5,-0.5 1,-0.2 -2,-0.2 0.756 123.2 21.3 -61.3 -24.2 7.2 -13.4 34.1 76 98 A A T <5S+ 0 0 52 -4,-1.2 5,-0.2 3,-0.2 -1,-0.2 0.545 127.8 50.1-117.4 -18.4 9.6 -10.5 34.9 77 99 A V T 45S+ 0 0 54 -5,-0.3 -2,-0.2 3,-0.1 -3,-0.1 0.763 127.2 19.8 -93.2 -29.3 8.4 -9.6 38.4 78 100 A N T <5S+ 0 0 80 -4,-2.6 -3,-0.2 3,-0.1 -1,-0.1 0.337 138.7 25.9-121.6 4.0 8.5 -13.0 40.0 79 101 A V T >> S+ 0 0 63 -5,-0.2 4,-3.6 -7,-0.2 3,-0.6 0.973 105.8 40.1 -67.6 -56.5 13.6 -10.1 38.7 82 104 A P H 3>>S+ 0 0 50 0, 0.0 4,-2.6 0, 0.0 5,-0.7 0.971 108.0 61.1 -57.5 -55.6 15.2 -12.4 41.2 83 105 A S H 3<5S+ 0 0 81 -4,-0.8 4,-0.3 1,-0.3 -2,-0.2 0.798 120.4 28.3 -40.1 -37.1 17.5 -14.1 38.6 84 106 A I H <5S+ 0 0 98 -4,-3.6 3,-1.1 2,-0.2 -2,-0.2 0.968 111.0 44.8 -62.4 -58.1 18.4 -9.2 41.4 86 108 A S G ><5S+ 0 0 78 -4,-2.6 3,-1.3 1,-0.3 -1,-0.2 0.858 112.4 53.5 -56.7 -37.5 20.0 -11.9 43.5 87 109 A N G 34 0 0 120 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -32.5 -19.0 -8.3 -43.5 93 20 B K H > + 0 0 126 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.739 360.0 55.8 -72.4 -21.6 -17.0 -5.6 -41.6 94 21 B D H > S+ 0 0 110 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.842 109.6 44.1 -77.3 -35.6 -20.2 -5.3 -39.5 95 22 B K H > S+ 0 0 139 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.816 107.8 60.6 -76.9 -30.6 -20.1 -9.0 -38.7 96 23 B E H X S+ 0 0 73 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.938 107.2 44.9 -59.9 -47.0 -16.3 -8.7 -38.1 97 24 B F H X S+ 0 0 42 -4,-1.6 4,-2.6 1,-0.2 -1,-0.2 0.920 112.6 51.5 -63.3 -43.1 -17.1 -6.2 -35.3 98 25 B Q H X S+ 0 0 107 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.904 111.1 47.3 -61.4 -42.3 -19.9 -8.4 -33.9 99 26 B V H X S+ 0 0 66 -4,-3.0 4,-3.0 2,-0.2 5,-0.2 0.941 113.2 47.7 -65.6 -45.6 -17.6 -11.5 -33.9 100 27 B L H X S+ 0 0 33 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.877 111.5 52.1 -62.2 -36.4 -14.8 -9.5 -32.2 101 28 B F H X S+ 0 0 96 -4,-2.6 4,-2.6 -5,-0.2 -2,-0.2 0.957 111.1 46.9 -63.0 -49.9 -17.3 -8.2 -29.7 102 29 B V H X S+ 0 0 74 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.938 112.7 49.0 -56.6 -49.9 -18.5 -11.7 -28.9 103 30 B L H X S+ 0 0 77 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.890 112.0 49.1 -59.2 -39.8 -15.0 -13.0 -28.5 104 31 B T H X S+ 0 0 9 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.923 112.1 47.8 -66.7 -42.7 -14.1 -10.1 -26.2 105 32 B I H X S+ 0 0 63 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.936 112.8 48.3 -63.1 -47.0 -17.2 -10.6 -24.1 106 33 B L H X S+ 0 0 96 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.910 111.0 51.3 -60.6 -41.0 -16.6 -14.4 -23.8 107 34 B T H X S+ 0 0 28 -4,-2.3 4,-1.7 -5,-0.3 -1,-0.2 0.888 112.4 46.1 -63.8 -37.7 -12.9 -13.7 -22.9 108 35 B L H X S+ 0 0 27 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.845 110.0 53.5 -73.5 -34.3 -14.0 -11.3 -20.2 109 36 B I H X S+ 0 0 81 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.928 107.9 51.2 -65.4 -43.0 -16.7 -13.7 -18.9 110 37 B S H X S+ 0 0 70 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.906 111.5 47.6 -59.6 -41.5 -14.0 -16.4 -18.6 111 38 B G H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 5,-0.4 0.881 110.3 51.7 -67.4 -37.8 -11.8 -14.0 -16.7 112 39 B T H X S+ 0 0 29 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.897 110.9 48.3 -65.3 -39.3 -14.7 -13.1 -14.4 113 40 B I H X S+ 0 0 103 -4,-2.5 4,-0.5 2,-0.2 5,-0.3 0.780 115.3 46.4 -71.2 -27.6 -15.4 -16.7 -13.7 114 41 B F H >X>S+ 0 0 24 -4,-1.5 4,-1.9 -5,-0.2 5,-0.7 0.963 116.1 37.9 -80.0 -56.6 -11.8 -17.4 -13.0 115 42 B Y H 3<5S+ 0 0 2 -4,-2.5 6,-1.0 1,-0.2 4,-0.5 0.778 111.2 60.4 -67.8 -27.8 -10.8 -14.5 -10.7 116 43 B S H 3<5S+ 0 0 32 -4,-1.4 -1,-0.2 -5,-0.4 -2,-0.2 0.808 123.1 20.5 -70.4 -28.5 -14.2 -14.5 -8.8 117 44 B T H X<5S+ 0 0 94 -4,-0.5 3,-0.9 -3,-0.5 -2,-0.2 0.856 128.2 41.5-102.3 -65.7 -13.6 -18.1 -7.7 118 45 B V T 3<5S+ 0 0 46 -4,-1.9 -3,-0.2 -5,-0.3 30,-0.2 0.776 131.0 30.5 -56.2 -30.4 -9.9 -19.0 -7.9 119 46 B E T 3 - 0 0 167 -2,-0.3 4,-2.7 1,-0.1 3,-0.5 -0.324 41.3-105.7 -64.4 153.8 -16.6 -10.4 -6.2 123 50 B P H > S+ 0 0 89 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.898 121.2 50.0 -46.4 -51.0 -17.9 -10.6 -9.8 124 51 B I H > S+ 0 0 94 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.862 113.1 46.5 -59.2 -38.0 -17.5 -6.9 -10.4 125 52 B D H > S+ 0 0 69 -3,-0.5 4,-2.7 2,-0.2 -1,-0.2 0.864 111.3 51.4 -73.0 -36.3 -14.0 -7.0 -9.1 126 53 B A H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.906 113.7 44.4 -66.0 -42.2 -13.1 -10.1 -11.2 127 54 B L H X S+ 0 0 67 -4,-2.7 4,-2.9 -5,-0.2 -2,-0.2 0.916 113.3 50.9 -67.6 -43.9 -14.5 -8.4 -14.3 128 55 B Y H X S+ 0 0 105 -4,-2.3 4,-2.8 -5,-0.2 5,-0.3 0.919 111.1 48.0 -60.4 -44.6 -12.7 -5.2 -13.5 129 56 B F H X S+ 0 0 15 -4,-2.7 4,-2.0 1,-0.2 5,-0.2 0.928 111.8 50.7 -61.7 -44.2 -9.4 -7.0 -13.0 130 57 B S H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.923 113.3 45.5 -58.7 -46.6 -10.0 -8.9 -16.3 131 58 B V H X S+ 0 0 55 -4,-2.9 4,-1.5 1,-0.2 6,-0.3 0.927 114.9 44.2 -65.5 -48.4 -10.6 -5.6 -18.2 132 59 B V H <>S+ 0 0 8 -4,-2.8 6,-2.9 1,-0.2 5,-0.8 0.787 113.5 52.7 -71.0 -24.8 -7.8 -3.6 -16.8 133 60 B T H ><5S+ 0 0 18 -4,-2.0 3,-0.9 -5,-0.3 -2,-0.2 0.949 111.8 43.1 -73.4 -49.4 -5.3 -6.4 -17.2 134 61 B L H 3<5S+ 0 0 1 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.724 115.9 47.7 -70.5 -22.5 -6.1 -7.1 -20.9 135 62 B T T 3<5S- 0 0 34 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.437 112.5-123.6 -93.4 -1.6 -6.1 -3.4 -21.7 136 63 B T T < 5S+ 0 0 93 -3,-0.9 -3,-0.2 -4,-0.2 -4,-0.1 0.491 79.8 121.3 70.7 10.0 -2.8 -3.0 -19.8 137 64 B V < + 0 0 90 -5,-0.8 -4,-0.2 -6,-0.3 -5,-0.1 0.904 40.5 175.0 -64.5 -39.2 -4.2 -0.4 -17.5 138 65 B G + 0 0 49 -6,-2.9 -5,-0.1 1,-0.2 -9,-0.1 0.819 15.5 151.4 32.2 61.3 -3.4 -2.8 -14.6 139 66 B D + 0 0 92 2,-0.1 -1,-0.2 -10,-0.0 -10,-0.1 0.309 48.1 80.2 -99.1 8.5 -4.3 -0.4 -11.8 140 67 B T S S- 0 0 42 -11,-0.1 0, 0.0 1,-0.1 0, 0.0 -0.749 92.2 -80.5-113.8 162.2 -5.2 -3.1 -9.4 141 68 B P - 0 0 108 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.246 52.5-104.6 -59.3 143.5 -3.2 -5.5 -7.1 142 69 B P - 0 0 107 0, 0.0 7,-0.1 0, 0.0 6,-0.0 -0.229 50.3 -74.9 -67.1 157.7 -1.6 -8.6 -8.8 143 70 B P - 0 0 19 0, 0.0 -24,-0.0 0, 0.0 -28,-0.0 -0.084 35.6-154.1 -50.4 152.0 -3.0 -12.1 -8.3 144 71 B Q S S+ 0 0 142 -3,-0.1 2,-0.2 -25,-0.0 -25,-0.1 0.820 70.7 69.7 -98.9 -41.7 -2.4 -13.7 -4.9 145 72 B T S > S- 0 0 36 1,-0.1 4,-1.9 -27,-0.1 5,-0.1 -0.518 78.9-130.8 -81.1 146.3 -2.5 -17.4 -5.7 146 73 B D H > S+ 0 0 127 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.828 112.3 55.3 -63.0 -31.5 0.2 -19.0 -7.8 147 74 B F H > S+ 0 0 127 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.920 105.2 53.4 -66.2 -42.6 -2.6 -20.5 -9.9 148 75 B G H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.902 108.9 47.7 -58.8 -44.0 -3.9 -17.0 -10.5 149 76 B K H X S+ 0 0 90 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.934 110.3 51.0 -64.4 -47.5 -0.5 -15.8 -11.7 150 77 B I H X S+ 0 0 101 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.935 113.7 45.9 -54.4 -48.7 0.0 -18.7 -14.1 151 78 B F H X S+ 0 0 47 -4,-2.4 4,-3.5 1,-0.2 -1,-0.2 0.927 110.0 54.4 -60.7 -46.5 -3.4 -18.1 -15.6 152 79 B T H X S+ 0 0 13 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.902 104.8 52.9 -55.9 -45.8 -2.8 -14.4 -15.8 153 80 B I H X S+ 0 0 96 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.925 116.2 40.1 -56.7 -45.1 0.4 -14.8 -17.8 154 81 B L H X S+ 0 0 106 -4,-1.7 4,-2.2 -5,-0.2 5,-0.3 0.913 113.8 54.2 -69.0 -43.5 -1.5 -17.0 -20.3 155 82 B Y H X S+ 0 0 9 -4,-3.5 4,-1.8 1,-0.2 5,-0.2 0.901 109.0 49.3 -56.9 -45.7 -4.6 -14.8 -20.2 156 83 B I H X S+ 0 0 53 -4,-3.1 4,-2.7 1,-0.2 5,-0.3 0.958 111.5 46.8 -60.6 -55.0 -2.5 -11.7 -21.1 157 84 B F H < S+ 0 0 172 -4,-1.9 4,-0.4 1,-0.2 -1,-0.2 0.833 121.8 35.4 -60.6 -34.9 -0.7 -13.3 -24.0 158 85 B I H < S+ 0 0 110 -4,-2.2 4,-0.4 -5,-0.1 -1,-0.2 0.641 123.8 43.3 -95.0 -13.0 -3.8 -14.7 -25.6 159 86 B G H X S+ 0 0 0 -4,-1.8 4,-2.6 -5,-0.3 5,-0.2 0.760 97.7 66.3-102.1 -28.1 -6.2 -11.9 -24.6 160 87 B I H X S+ 0 0 51 -4,-2.7 4,-2.7 -5,-0.2 5,-0.3 0.923 101.1 51.4 -61.2 -45.3 -4.3 -8.7 -25.3 161 88 B G H > S+ 0 0 56 -4,-0.4 4,-2.0 -5,-0.3 -1,-0.2 0.947 113.3 44.6 -55.9 -51.4 -4.3 -9.2 -29.1 162 89 B L H > S+ 0 0 32 -4,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.924 113.4 49.4 -59.2 -49.5 -8.0 -9.8 -29.2 163 90 B V H X S+ 0 0 10 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.907 114.7 43.4 -61.5 -43.1 -8.9 -6.9 -26.9 164 91 B F H X S+ 0 0 87 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.820 110.9 55.8 -74.4 -24.9 -6.8 -4.4 -28.8 165 92 B G H X S+ 0 0 29 -4,-2.0 4,-2.3 -5,-0.3 -2,-0.2 0.905 110.8 45.9 -68.5 -39.2 -8.1 -5.9 -32.1 166 93 B F H X S+ 0 0 28 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.919 111.2 50.9 -68.1 -44.1 -11.6 -5.2 -30.8 167 94 B I H X S+ 0 0 65 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.919 110.8 50.6 -60.2 -41.8 -10.7 -1.7 -29.6 168 95 B H H X S+ 0 0 102 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.942 113.2 43.2 -61.8 -48.7 -9.2 -1.0 -33.1 169 96 B K H X S+ 0 0 52 -4,-2.3 4,-2.3 1,-0.2 5,-0.3 0.848 112.2 53.9 -67.5 -32.8 -12.3 -2.2 -35.0 170 97 B L H X>S+ 0 0 48 -4,-2.7 5,-2.9 3,-0.2 4,-1.2 0.923 112.6 46.3 -64.7 -42.0 -14.6 -0.4 -32.5 171 98 B A H <>S+ 0 0 35 -4,-2.4 5,-2.2 -5,-0.2 -2,-0.2 0.934 122.2 30.8 -66.3 -50.8 -12.6 2.8 -33.2 172 99 B V H <5S+ 0 0 50 -4,-2.6 -2,-0.2 3,-0.2 -3,-0.2 0.798 128.6 34.9 -83.8 -28.8 -12.4 2.7 -37.0 173 100 B N H <5S+ 0 0 40 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.2 0.519 133.1 17.3-105.8 -4.9 -15.7 0.9 -37.9 174 101 B V T X5S+ 0 0 56 -4,-1.2 4,-1.6 -5,-0.3 -3,-0.2 0.614 127.9 38.2-126.8 -57.0 -18.1 2.2 -35.2 175 102 B Q H > S+ 0 0 62 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.888 113.8 51.6 -60.4 -37.4 -18.5 6.6 -38.7 178 105 B S H X S+ 0 0 58 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.919 110.6 47.2 -64.9 -45.3 -20.5 7.9 -35.8 179 106 B I H X S+ 0 0 92 -4,-3.0 4,-0.8 2,-0.2 -1,-0.2 0.936 111.3 50.9 -63.2 -45.7 -18.2 10.9 -35.4 180 107 B L H >X S+ 0 0 98 -4,-2.7 3,-1.1 1,-0.2 4,-0.8 0.923 110.3 50.0 -58.3 -43.0 -18.4 11.7 -39.1 181 108 B S H 3< S+ 0 0 50 -4,-2.3 3,-0.5 1,-0.3 -1,-0.2 0.865 110.1 50.7 -64.4 -34.9 -22.1 11.5 -39.0 182 109 B N H 3< S+ 0 0 125 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.547 107.6 54.9 -79.9 -6.7 -22.2 13.9 -36.0 183 110 B L H << S+ 0 0 125 -3,-1.1 -1,-0.2 -4,-0.8 -2,-0.2 0.555 79.9 107.4-100.8 -12.1 -20.0 16.4 -37.8 184 111 B V S < S- 0 0 81 -4,-0.8 2,-0.2 -3,-0.5 -3,-0.0 -0.504 73.5-123.1 -70.5 129.5 -22.1 16.8 -40.9 185 112 B P 0 0 119 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.544 360.0 360.0 -73.7 137.6 -23.9 20.2 -41.0 186 113 B R 0 0 265 -2,-0.2 -2,-0.0 0, 0.0 0, 0.0 0.669 360.0 360.0-126.5 360.0 -27.6 19.8 -41.4