==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN TRANSPORT, ENDOCYTOSIS 02-MAR-09 3GGY . COMPND 2 MOLECULE: INCREASED SODIUM TOLERANCE PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.XIAO,Z.XU . 372 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20919.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 304 81.7 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 . 4 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 247 66.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.4 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 2 1 0 5 0 0 2 4 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 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 6 A I 0 0 176 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -50.5 52.0 -16.5 32.7 2 7 A P > - 0 0 69 0, 0.0 4,-2.5 0, 0.0 3,-0.3 -0.234 360.0-118.2 -58.1 150.4 51.5 -13.9 35.5 3 8 A F H > S+ 0 0 13 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.935 114.0 53.2 -53.9 -50.7 48.0 -13.8 36.8 4 9 A T H > S+ 0 0 45 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.828 111.0 46.5 -55.7 -36.5 47.6 -10.1 35.8 5 10 A I H > S+ 0 0 81 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.905 112.4 48.5 -74.7 -42.5 48.6 -10.9 32.2 6 11 A K H X S+ 0 0 83 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.876 113.3 49.1 -64.7 -36.6 46.4 -14.0 31.9 7 12 A L H X S+ 0 0 3 -4,-2.7 4,-3.1 -5,-0.2 5,-0.2 0.919 110.3 49.7 -68.8 -43.8 43.5 -12.0 33.3 8 13 A K H X S+ 0 0 97 -4,-1.9 4,-2.5 -5,-0.2 -2,-0.2 0.937 112.2 48.2 -59.7 -47.1 44.1 -9.1 30.9 9 14 A T H X S+ 0 0 86 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.903 113.5 48.5 -58.8 -44.2 44.2 -11.5 27.9 10 15 A C H X S+ 0 0 1 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.945 111.8 47.1 -62.7 -51.2 41.0 -13.1 29.1 11 16 A L H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.888 110.9 52.5 -60.7 -40.3 39.1 -9.9 29.6 12 17 A K H X S+ 0 0 107 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.907 111.9 45.5 -63.5 -40.8 40.1 -8.6 26.2 13 18 A M H X S+ 0 0 74 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.892 110.9 53.6 -69.3 -40.1 38.9 -11.7 24.5 14 19 A C H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.916 108.6 50.2 -60.9 -41.3 35.7 -11.7 26.4 15 20 A I H X S+ 0 0 9 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.923 112.3 46.3 -63.2 -44.1 35.0 -8.1 25.3 16 21 A Q H X S+ 0 0 109 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.916 115.6 46.0 -65.3 -42.3 35.7 -9.0 21.7 17 22 A R H X S+ 0 0 67 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.910 112.7 49.7 -67.1 -43.6 33.5 -12.1 21.8 18 23 A L H X S+ 0 0 0 -4,-2.9 4,-2.2 -5,-0.2 -2,-0.2 0.922 111.7 48.8 -62.1 -42.9 30.7 -10.3 23.7 19 24 A R H X S+ 0 0 110 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.921 113.2 47.4 -62.2 -43.0 30.7 -7.5 21.2 20 25 A Y H X S+ 0 0 145 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.884 110.5 51.4 -66.0 -40.0 30.6 -9.9 18.3 21 26 A A H X S+ 0 0 11 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.884 110.0 50.4 -64.8 -39.0 27.8 -12.0 19.8 22 27 A Q H X S+ 0 0 17 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.946 110.4 49.1 -62.5 -50.3 25.8 -8.8 20.3 23 28 A E H X S+ 0 0 123 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.945 115.9 43.2 -53.1 -53.6 26.3 -7.8 16.7 24 29 A K H X S+ 0 0 127 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.926 115.7 46.8 -60.6 -49.7 25.3 -11.2 15.4 25 30 A Q H X S+ 0 0 42 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.812 110.1 53.2 -66.4 -30.3 22.3 -11.6 17.7 26 31 A Q H X S+ 0 0 93 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.920 109.7 48.5 -69.9 -42.7 21.0 -8.1 17.0 27 32 A A H X S+ 0 0 63 -4,-2.0 4,-1.7 -5,-0.2 -2,-0.2 0.905 112.8 48.4 -62.4 -41.1 21.1 -8.8 13.2 28 33 A I H X S+ 0 0 81 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.882 107.4 55.2 -66.8 -38.5 19.3 -12.1 13.8 29 34 A A H X S+ 0 0 6 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.893 106.2 52.6 -61.6 -38.4 16.7 -10.4 16.0 30 35 A K H X S+ 0 0 117 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.910 108.9 49.0 -63.9 -41.6 16.0 -8.1 13.1 31 36 A Q H X S+ 0 0 104 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.873 107.9 55.2 -65.1 -37.0 15.5 -11.0 10.8 32 37 A S H X S+ 0 0 12 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.883 105.0 52.6 -63.6 -38.4 13.1 -12.6 13.3 33 38 A R H X S+ 0 0 49 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.905 108.7 50.0 -64.3 -41.0 11.0 -9.5 13.4 34 39 A R H X S+ 0 0 142 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.891 110.5 51.0 -62.8 -40.1 10.7 -9.6 9.6 35 40 A Q H X S+ 0 0 63 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.820 106.1 53.4 -68.9 -31.7 9.7 -13.2 9.8 36 41 A V H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.916 107.9 52.2 -67.5 -41.0 7.0 -12.5 12.4 37 42 A A H X S+ 0 0 6 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.900 108.5 50.2 -60.5 -40.8 5.6 -9.9 10.0 38 43 A Q H X S+ 0 0 109 -4,-1.8 4,-1.2 1,-0.2 -1,-0.2 0.860 107.9 53.1 -66.7 -36.2 5.5 -12.5 7.2 39 44 A L H <>S+ 0 0 21 -4,-1.8 5,-2.8 2,-0.2 -1,-0.2 0.891 109.5 49.6 -65.3 -38.3 3.7 -14.9 9.5 40 45 A L H ><5S+ 0 0 0 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.923 106.5 54.3 -66.4 -44.1 1.1 -12.3 10.2 41 46 A L H 3<5S+ 0 0 72 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.776 111.3 47.3 -60.4 -26.9 0.6 -11.5 6.4 42 47 A T T 3<5S- 0 0 62 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.113 116.5-110.9-103.4 20.3 -0.1 -15.2 5.9 43 48 A N T < 5 + 0 0 93 -3,-1.8 2,-1.3 1,-0.2 3,-0.2 0.701 69.4 142.2 61.3 24.9 -2.5 -15.6 8.8 44 49 A K >< + 0 0 92 -5,-2.8 4,-2.2 1,-0.2 -1,-0.2 -0.562 14.1 158.4 -95.9 70.6 -0.2 -17.8 10.9 45 50 A E H > + 0 0 42 -2,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.906 67.8 50.3 -59.5 -49.4 -1.3 -16.3 14.3 46 51 A Q H > S+ 0 0 131 -3,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.936 113.8 45.0 -57.8 -50.4 -0.2 -19.1 16.5 47 52 A K H > S+ 0 0 115 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.894 110.4 54.5 -62.5 -40.6 3.3 -19.3 15.0 48 53 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.913 108.4 50.6 -59.6 -40.7 3.7 -15.6 15.1 49 54 A H H X S+ 0 0 35 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.946 111.0 46.9 -61.6 -50.5 2.9 -15.7 18.8 50 55 A Y H X S+ 0 0 130 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.895 111.9 51.7 -58.4 -41.5 5.5 -18.4 19.4 51 56 A R H X S+ 0 0 82 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.861 108.3 50.9 -66.0 -36.7 8.1 -16.5 17.4 52 57 A V H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.901 105.5 55.5 -68.2 -40.1 7.5 -13.3 19.4 53 58 A E H X S+ 0 0 56 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.918 111.1 45.3 -57.9 -41.2 7.9 -15.1 22.7 54 59 A T H X S+ 0 0 79 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.909 111.0 53.0 -67.8 -42.5 11.3 -16.3 21.4 55 60 A L H X S+ 0 0 1 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.883 104.7 55.8 -60.2 -40.5 12.2 -12.8 20.1 56 61 A I H X S+ 0 0 2 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.929 110.6 44.5 -59.0 -45.2 11.4 -11.3 23.6 57 62 A H H X S+ 0 0 81 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.898 110.6 55.2 -66.9 -38.9 13.9 -13.7 25.2 58 63 A D H X S+ 0 0 51 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.898 108.3 48.5 -60.1 -41.5 16.4 -12.9 22.4 59 64 A D H X S+ 0 0 32 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.884 110.7 50.2 -66.5 -39.2 16.2 -9.2 23.1 60 65 A I H X S+ 0 0 37 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.903 109.6 51.9 -65.5 -39.3 16.6 -9.7 26.9 61 66 A H H X S+ 0 0 22 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.878 106.5 53.2 -65.6 -37.3 19.6 -11.9 26.2 62 67 A I H X S+ 0 0 10 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.912 107.3 52.0 -64.2 -39.1 21.2 -9.1 24.0 63 68 A E H X S+ 0 0 84 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.892 107.3 53.3 -62.4 -39.1 20.7 -6.7 26.9 64 69 A L H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.948 107.5 50.6 -60.2 -47.8 22.5 -9.2 29.2 65 70 A L H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.866 107.8 53.3 -58.3 -38.0 25.4 -9.3 26.7 66 71 A E H X S+ 0 0 79 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.915 111.2 45.8 -64.5 -42.2 25.6 -5.5 26.7 67 72 A I H X S+ 0 0 27 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.917 111.4 51.4 -67.4 -42.9 25.8 -5.4 30.5 68 73 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.873 106.1 55.9 -63.1 -34.7 28.4 -8.1 30.7 69 74 A E H X S+ 0 0 27 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.927 107.9 48.6 -61.8 -45.0 30.5 -6.2 28.1 70 75 A L H X S+ 0 0 109 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.889 109.3 52.2 -62.8 -40.1 30.5 -3.2 30.4 71 76 A Y H X S+ 0 0 12 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.890 109.2 50.7 -63.7 -38.5 31.4 -5.3 33.4 72 77 A C H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.903 109.7 49.4 -64.4 -42.0 34.4 -6.7 31.4 73 78 A E H X S+ 0 0 60 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.886 109.6 53.0 -64.9 -37.3 35.5 -3.2 30.5 74 79 A L H X S+ 0 0 45 -4,-2.2 4,-0.9 1,-0.2 3,-0.2 0.956 112.1 43.4 -61.5 -52.3 35.3 -2.2 34.1 75 80 A L H < S+ 0 0 1 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.847 109.5 58.5 -62.4 -35.6 37.5 -5.0 35.3 76 81 A L H >< S+ 0 0 42 -4,-2.2 3,-0.9 1,-0.2 -1,-0.2 0.886 106.1 48.1 -62.7 -39.0 39.9 -4.5 32.4 77 82 A A H 3< S+ 0 0 75 -4,-1.8 -1,-0.2 -3,-0.2 -2,-0.2 0.674 117.7 41.9 -75.4 -17.7 40.5 -0.9 33.5 78 83 A R T >X S+ 0 0 100 -4,-0.9 4,-1.6 -3,-0.4 3,-1.1 0.072 75.0 122.8-116.4 22.6 41.1 -2.1 37.1 79 84 A V H <> S+ 0 0 7 -3,-0.9 4,-1.2 1,-0.3 -1,-0.1 0.854 70.8 56.5 -52.9 -42.2 43.2 -5.2 36.4 80 85 A Q H 34 S+ 0 0 108 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.799 107.1 50.0 -63.1 -28.7 46.1 -4.0 38.6 81 86 A V H X4 S+ 0 0 47 -3,-1.1 3,-1.9 1,-0.2 -1,-0.2 0.877 103.7 57.3 -77.2 -38.9 43.9 -3.6 41.6 82 87 A I H >< S+ 0 0 10 -4,-1.6 3,-1.9 1,-0.3 -1,-0.2 0.798 93.9 70.3 -61.1 -27.5 42.3 -7.1 41.3 83 88 A N T 3< S+ 0 0 59 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.736 94.5 55.1 -62.9 -21.3 45.9 -8.4 41.5 84 89 A D T < S+ 0 0 113 -3,-1.9 2,-0.6 -4,-0.2 -1,-0.3 0.152 86.0 100.3 -98.5 18.5 45.9 -7.4 45.1 85 90 A I < + 0 0 2 -3,-1.9 3,-0.1 1,-0.1 -3,-0.0 -0.922 29.2 150.7-109.2 118.8 42.7 -9.4 46.0 86 91 A S + 0 0 66 -2,-0.6 2,-0.3 1,-0.2 -1,-0.1 0.502 61.3 45.3-121.2 -11.8 43.3 -12.7 47.7 87 92 A T S > S- 0 0 57 1,-0.1 4,-1.8 48,-0.0 -1,-0.2 -0.959 72.1-125.9-136.3 155.3 40.1 -13.1 49.8 88 93 A E H > S+ 0 0 55 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.815 109.6 62.4 -65.9 -31.6 36.4 -12.7 49.4 89 94 A E H > S+ 0 0 107 1,-0.2 4,-2.6 2,-0.2 5,-0.4 0.929 105.0 47.0 -60.1 -44.5 36.3 -10.4 52.5 90 95 A Q H >>S+ 0 0 48 2,-0.2 4,-2.7 1,-0.2 5,-0.8 0.936 111.2 51.8 -62.0 -46.6 38.5 -7.9 50.6 91 96 A L H X5S+ 0 0 3 -4,-1.8 4,-0.9 1,-0.2 10,-0.3 0.921 116.5 38.8 -56.4 -47.7 36.4 -8.2 47.5 92 97 A V H <5S+ 0 0 40 -4,-2.6 -1,-0.2 2,-0.1 -2,-0.2 0.845 126.7 32.1 -75.8 -35.9 33.2 -7.4 49.3 93 98 A K H <5S+ 0 0 151 -4,-2.6 3,-0.2 -5,-0.2 -3,-0.2 0.810 130.3 30.6 -93.1 -32.1 34.4 -4.8 51.8 94 99 A E H <5S+ 0 0 126 -4,-2.7 4,-0.3 -5,-0.4 -3,-0.2 0.630 124.8 40.7-101.3 -17.3 37.1 -3.0 49.8 95 100 A H S < S+ 0 0 14 -3,-0.1 4,-2.2 1,-0.1 -3,-0.1 0.511 80.9 122.0 72.5 5.6 32.2 -2.0 41.2 100 105 A I H > + 0 0 2 -5,-0.2 4,-2.8 2,-0.2 5,-0.4 0.931 68.2 55.0 -66.1 -46.4 34.6 -4.9 41.0 101 106 A N H > S+ 0 0 2 -6,-2.6 4,-2.0 -10,-0.3 5,-0.2 0.940 114.0 41.4 -50.2 -53.8 32.7 -7.2 43.4 102 107 A E H > S+ 0 0 76 -7,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.890 115.1 51.2 -61.4 -45.1 29.5 -6.8 41.3 103 108 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.932 112.6 42.3 -62.7 -49.7 31.3 -7.1 38.0 104 109 A I H X S+ 0 0 10 -4,-2.8 4,-2.0 1,-0.2 5,-0.2 0.900 115.0 50.5 -67.5 -40.2 33.3 -10.3 38.7 105 110 A R H X S+ 0 0 0 -4,-2.0 4,-2.5 -5,-0.4 -1,-0.2 0.915 110.3 50.2 -63.9 -41.8 30.4 -12.0 40.3 106 111 A S H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.891 110.2 49.4 -64.4 -40.1 28.0 -11.2 37.4 107 112 A L H X S+ 0 0 0 -4,-1.9 4,-0.7 2,-0.2 -1,-0.2 0.894 112.8 46.6 -67.5 -39.1 30.5 -12.6 34.8 108 113 A I H >< S+ 0 0 2 -4,-2.0 3,-0.9 1,-0.2 4,-0.4 0.921 112.3 50.4 -68.8 -42.2 31.0 -15.8 36.7 109 114 A Y H >< S+ 0 0 27 -4,-2.5 3,-0.5 1,-0.2 4,-0.4 0.850 106.5 58.1 -62.1 -33.8 27.3 -16.3 37.2 110 115 A A H >X S+ 0 0 0 -4,-1.8 4,-1.4 1,-0.2 3,-0.8 0.671 80.0 87.8 -72.3 -19.6 26.7 -15.7 33.5 111 116 A I G X< S+ 0 0 38 -3,-0.9 3,-0.7 -4,-0.7 -1,-0.2 0.895 89.1 48.5 -45.7 -52.4 29.0 -18.5 32.3 112 117 A L G <4 S+ 0 0 129 -3,-0.5 3,-0.3 -4,-0.4 -1,-0.3 0.817 116.8 43.1 -59.2 -33.3 26.1 -21.1 32.5 113 118 A F G <4 S+ 0 0 57 -3,-0.8 -1,-0.2 -4,-0.4 -2,-0.2 0.526 111.9 51.4 -94.2 -8.4 23.8 -18.7 30.5 114 119 A V X< + 0 0 1 -4,-1.4 3,-1.6 -3,-0.7 6,-0.2 -0.563 54.6 154.9-128.6 67.0 26.2 -17.5 27.8 115 120 A D T 3 + 0 0 126 -3,-0.3 3,-0.2 1,-0.3 -1,-0.1 0.661 65.0 77.6 -69.7 -11.8 27.7 -20.5 26.3 116 121 A E T 3 S+ 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I H X S+ 0 0 25 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.912 112.5 48.1 -61.6 -38.6 19.6 -12.9 37.6 152 157 A K H < S+ 0 0 94 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.835 111.0 48.1 -71.4 -35.3 16.5 -11.8 35.8 153 158 A K H < S+ 0 0 44 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.747 111.9 50.3 -78.9 -22.0 18.1 -11.5 32.4 154 159 A C H < S+ 0 0 11 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.840 130.1 19.9 -80.2 -34.0 19.7 -14.9 32.7 155 160 A S S < S- 0 0 65 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 -0.601 84.8-170.6-134.8 72.7 16.3 -16.4 33.7 156 161 A P - 0 0 37 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.318 26.1-111.8 -65.9 146.2 13.5 -14.0 32.5 157 162 A S - 0 0 87 1,-0.2 3,-0.1 -5,-0.1 -5,-0.0 -0.273 51.5 -70.0 -71.9 163.6 10.0 -14.7 33.7 158 163 A V - 0 0 125 1,-0.1 2,-0.2 -2,-0.0 -1,-0.2 -0.285 58.2-108.3 -56.0 132.8 7.3 -15.9 31.3 159 164 A P - 0 0 34 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.456 33.3-127.7 -66.0 132.1 6.4 -13.0 28.9 160 165 A K >> - 0 0 133 -2,-0.2 4,-1.7 1,-0.1 3,-1.1 -0.496 19.6-113.8 -78.6 151.9 2.9 -11.7 29.7 161 166 A E H 3> S+ 0 0 89 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.783 115.0 64.0 -55.4 -28.9 0.4 -11.5 26.8 162 167 A E H 3> S+ 0 0 122 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.885 104.9 44.7 -63.5 -39.0 0.5 -7.7 27.2 163 168 A L H <> S+ 0 0 61 -3,-1.1 4,-2.4 2,-0.2 -1,-0.2 0.861 111.6 52.0 -73.5 -37.1 4.1 -7.6 26.1 164 169 A V H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.935 110.8 48.8 -63.8 -44.0 3.6 -10.1 23.3 165 170 A D H X S+ 0 0 43 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.890 109.7 52.3 -61.7 -39.2 0.8 -7.9 22.0 166 171 A L H X S+ 0 0 81 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.922 109.3 49.1 -63.7 -43.5 3.0 -4.9 22.3 167 172 A Y H X S+ 0 0 31 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.902 109.8 51.8 -62.2 -41.3 5.8 -6.6 20.3 168 173 A L H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.926 110.6 48.5 -61.4 -43.8 3.2 -7.6 17.6 169 174 A K H X S+ 0 0 110 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.880 112.4 47.7 -65.0 -38.4 2.0 -4.0 17.3 170 175 A E H X S+ 0 0 93 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.879 112.0 49.5 -72.6 -34.1 5.6 -2.6 17.1 171 176 A I H X S+ 0 0 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4,-0.3 2,-0.2 -1,-0.2 0.862 113.4 43.0 -68.1 -37.0 -3.6 -9.0 9.8 182 187 A L H >X S+ 0 0 17 -4,-1.8 3,-1.4 -3,-0.2 4,-0.8 0.904 110.8 54.8 -75.8 -41.5 -2.3 -7.6 13.1 183 188 A E H >< S+ 0 0 76 -4,-2.7 3,-0.8 1,-0.3 -2,-0.2 0.877 101.1 59.1 -58.8 -39.4 -5.7 -7.5 14.8 184 189 A N T 3< S+ 0 0 108 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.693 105.6 50.9 -64.6 -17.2 -6.2 -11.2 14.1 185 190 A S T <4 0 0 13 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.644 360.0 360.0 -94.0 -17.8 -3.0 -12.0 16.1 186 191 A L << 0 0 76 -4,-0.8 -2,-0.2 -3,-0.8 -3,-0.1 0.994 360.0 360.0 -75.2 360.0 -4.0 -10.0 19.2 187 !* 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 0.0 188 6 B I 0 0 176 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -49.9 54.4 10.4 21.9 189 7 B P > - 0 0 73 0, 0.0 4,-1.9 0, 0.0 3,-0.3 -0.027 360.0-116.6 -50.9 155.5 55.9 7.9 19.4 190 8 B F H > S+ 0 0 33 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.919 114.7 56.9 -60.0 -46.5 54.7 8.0 15.8 191 9 B T H > S+ 0 0 42 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.830 106.8 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B Q H <> S+ 0 0 85 -3,-1.5 4,-2.8 -4,-0.4 -1,-0.3 0.842 96.4 57.3 -67.1 -34.0 45.1 13.5 10.8 310 128 B L H > - 0 0 68 -5,-0.4 4,-1.3 1,-0.1 3,-0.7 -0.985 28.1 -95.2-167.5 169.8 57.1 14.5 3.2 320 138 B V H 3> S+ 0 0 87 -2,-0.3 4,-2.5 1,-0.2 5,-0.3 0.844 117.2 62.9 -61.8 -34.6 54.7 17.2 1.9 321 139 B E H 3> S+ 0 0 154 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.852 100.0 55.3 -59.9 -34.1 55.4 16.1 -1.7 322 140 B F H <> S+ 0 0 0 -3,-0.7 4,-1.6 2,-0.2 -1,-0.2 0.973 111.1 41.1 -63.7 -54.9 54.0 12.7 -1.0 323 141 B V H X S+ 0 0 4 -4,-1.3 4,-2.5 1,-0.2 5,-0.2 0.868 115.7 50.6 -64.0 -35.8 50.6 14.0 0.3 324 142 B N H X>S+ 0 0 83 -4,-2.5 4,-2.7 1,-0.2 5,-0.9 0.866 105.4 56.8 -70.6 -32.4 50.4 16.6 -2.5 325 143 B G H X5S+ 0 0 5 -4,-2.0 6,-1.9 -5,-0.3 4,-0.6 0.891 110.9 45.5 -62.5 -36.8 51.1 14.0 -5.1 326 144 B V H X5S+ 0 0 0 -4,-1.6 4,-1.1 4,-0.2 -2,-0.2 0.971 121.3 34.1 -69.7 -55.8 48.1 12.1 -3.8 327 145 B I H <5S+ 0 0 67 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.927 130.3 31.5 -68.8 -46.6 45.6 15.0 -3.5 328 146 B A H 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0 0 123 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.835 103.7 47.3 -63.1 -36.0 18.7 3.1 -16.9 350 168 B L H <> S+ 0 0 63 -3,-0.9 4,-2.3 2,-0.2 -1,-0.2 0.839 109.4 53.8 -75.3 -33.9 20.0 3.0 -13.3 351 169 B V H X S+ 0 0 2 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.922 110.1 47.5 -65.2 -41.9 17.4 5.4 -12.1 352 170 B D H X S+ 0 0 30 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.875 109.6 53.4 -66.0 -37.2 14.7 3.2 -13.6 353 171 B L H X S+ 0 0 76 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.927 109.5 48.3 -62.6 -45.5 16.3 0.1 -12.0 354 172 B Y H X S+ 0 0 29 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.905 110.1 51.7 -61.0 -43.2 16.2 1.8 -8.6 355 173 B L H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.916 111.3 48.1 -60.7 -42.7 12.6 2.8 -9.1 356 174 B K H X S+ 0 0 113 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.881 112.2 47.8 -66.9 -37.9 11.7 -0.8 -9.9 357 175 B E H X S+ 0 0 96 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.880 113.1 47.7 -72.4 -35.3 13.6 -2.2 -6.9 358 176 B I H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 6,-0.2 0.884 109.5 55.2 -69.6 -36.7 12.0 0.3 -4.6 359 177 B A H <>S+ 0 0 9 -4,-2.2 5,-1.8 -5,-0.2 4,-0.3 0.875 109.7 46.2 -63.1 -36.8 8.6 -0.6 -6.2 360 178 B K H ><5S+ 0 0 176 -4,-1.7 3,-1.1 3,-0.2 -2,-0.2 0.949 112.1 50.4 -70.3 -47.7 9.2 -4.3 -5.4 361 179 B T H 3<5S+ 0 0 87 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.905 122.5 31.3 -55.1 -47.1 10.3 -3.5 -1.8 362 180 B Y T 3<5S- 0 0 58 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.196 105.5-121.1-101.0 16.5 7.3 -1.4 -1.1 363 181 B D T < 5 - 0 0 139 -3,-1.1 -3,-0.2 -4,-0.3 -4,-0.1 0.829 40.0-170.8 47.6 41.6 4.8 -3.1 -3.3 364 182 B V < - 0 0 16 -5,-1.8 -1,-0.2 -6,-0.2 5,-0.1 -0.397 30.4-100.9 -63.2 130.6 4.1 0.0 -5.3 365 183 B P > - 0 0 62 0, 0.0 4,-1.7 0, 0.0 3,-0.3 -0.177 27.5-117.9 -54.8 145.8 1.2 -0.4 -7.7 366 184 B Y H > S+ 0 0 176 1,-0.2 4,-2.5 2,-0.2 3,-0.3 0.903 111.6 51.2 -48.2 -54.8 2.0 -1.1 -11.3 367 185 B S H > S+ 0 0 65 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.880 107.9 53.4 -54.6 -42.5 0.4 2.1 -12.7 368 186 B K H > S+ 0 0 53 -3,-0.3 4,-0.6 1,-0.2 -1,-0.2 0.865 112.0 43.9 -63.4 -38.2 2.1 4.3 -10.2 369 187 B L H >X S+ 0 0 20 -4,-1.7 4,-1.1 -3,-0.3 3,-0.9 0.891 107.1 58.4 -75.7 -39.8 5.6 3.0 -11.1 370 188 B E H 3< S+ 0 0 85 -4,-2.5 3,-0.4 1,-0.3 -1,-0.2 0.857 99.8 59.3 -57.3 -36.5 5.0 3.1 -14.9 371 189 B N H 3< S+ 0 0 99 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.822 104.4 50.8 -62.9 -31.0 4.3 6.8 -14.7 372 190 B S H << 0 0 14 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.726 360.0 360.0 -80.1 -23.5 7.8 7.4 -13.2 373 191 B L < 0 0 68 -4,-1.1 -1,-0.1 -3,-0.4 -4,-0.0 -0.562 360.0 360.0 -74.1 360.0 9.7 5.5 -15.9