==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 03-JUN-05 1ZW0 . COMPND 2 MOLECULE: TYPE III SECRETION PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: YERSINIA PESTIS; . AUTHOR J.PHAN,B.P.AUSTIN,D.S.WAUGH . 479 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26066.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 415 86.6 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 . 1 0.2 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 . 28 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 380 79.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 0 0 1 1 0 0 1 0 0 0 1 0 1 2 1 0 0 1 7 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 0 147 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -27.7 63.2 -6.1 56.3 2 2 A T H > + 0 0 105 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.951 360.0 47.0 -66.6 -46.7 61.6 -7.4 59.5 3 3 A Q H > S+ 0 0 137 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.889 111.7 50.1 -61.0 -42.9 65.0 -7.8 61.0 4 4 A L H > S+ 0 0 117 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.946 111.8 46.6 -62.3 -47.5 66.1 -4.3 59.9 5 5 A E H X S+ 0 0 89 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.903 112.1 51.2 -61.6 -41.7 63.0 -2.6 61.3 6 6 A E H X S+ 0 0 67 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.918 110.9 48.4 -64.0 -43.4 63.3 -4.4 64.6 7 7 A Q H X S+ 0 0 49 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.922 111.7 49.6 -62.3 -44.7 67.0 -3.4 65.0 8 8 A L H X S+ 0 0 94 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.924 111.9 47.4 -60.9 -45.4 66.2 0.2 64.2 9 9 A H H X S+ 0 0 48 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.879 111.1 51.9 -66.1 -39.5 63.4 0.3 66.7 10 10 A N H X S+ 0 0 3 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.891 110.4 48.5 -59.1 -43.6 65.7 -1.4 69.4 11 11 A V H X S+ 0 0 25 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.891 109.0 54.1 -64.4 -38.0 68.4 1.2 68.7 12 12 A E H X S+ 0 0 23 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.884 106.5 50.4 -59.8 -40.8 65.7 4.0 69.0 13 13 A T H X S+ 0 0 3 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.905 109.6 52.1 -64.5 -41.6 64.7 2.6 72.5 14 14 A V H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 5,-0.3 0.952 109.4 49.9 -58.0 -49.4 68.4 2.7 73.5 15 15 A R H X S+ 0 0 104 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.913 111.5 48.3 -55.1 -47.2 68.6 6.3 72.4 16 16 A S H X S+ 0 0 18 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.905 114.1 45.6 -60.7 -48.7 65.5 7.3 74.3 17 17 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.911 111.3 51.0 -65.2 -43.5 66.7 5.6 77.5 18 18 A T H X S+ 0 0 4 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.909 108.7 52.1 -64.5 -36.4 70.1 6.9 77.3 19 19 A M H X S+ 0 0 124 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 0.939 110.8 49.0 -58.5 -43.9 68.8 10.5 76.9 20 20 A Q H X S+ 0 0 50 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.908 109.9 51.6 -64.8 -43.0 66.6 10.0 80.0 21 21 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.924 108.1 51.1 -57.7 -45.5 69.6 8.6 82.0 22 22 A E H X S+ 0 0 51 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.929 110.3 49.6 -61.5 -42.4 71.7 11.7 81.1 23 23 A M H X S+ 0 0 114 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.916 111.2 48.8 -61.1 -42.3 68.9 14.0 82.2 24 24 A A H X S+ 0 0 9 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.855 109.0 52.9 -67.6 -36.0 68.6 12.1 85.5 25 25 A L H X S+ 0 0 4 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.901 105.1 56.0 -65.2 -38.6 72.4 12.3 86.1 26 26 A T H X S+ 0 0 71 -4,-2.1 4,-1.5 -5,-0.2 -2,-0.2 0.902 109.9 45.1 -58.1 -40.1 72.2 16.0 85.5 27 27 A K H X S+ 0 0 109 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.927 111.1 51.5 -69.7 -43.3 69.6 16.3 88.4 28 28 A L H X S+ 0 0 9 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.897 106.8 57.8 -60.7 -37.9 71.5 14.0 90.7 29 29 A K H X S+ 0 0 85 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.896 100.7 53.8 -61.3 -42.7 74.5 16.3 90.0 30 30 A K H < S+ 0 0 155 -4,-1.5 3,-0.3 1,-0.2 -1,-0.2 0.937 109.5 49.5 -54.0 -48.2 72.7 19.4 91.2 31 31 A D H >X S+ 0 0 5 -4,-1.7 4,-3.5 1,-0.2 3,-1.2 0.848 107.2 53.3 -62.7 -37.4 71.9 17.7 94.5 32 32 A M H 3< S+ 0 0 46 -4,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.829 101.5 60.8 -67.5 -28.9 75.5 16.6 95.0 33 33 A M T 3< S+ 0 0 140 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.301 123.6 19.6 -78.1 16.5 76.7 20.1 94.5 34 34 A R T <4 S+ 0 0 123 -3,-1.2 -2,-0.2 3,-0.1 -1,-0.2 0.507 98.6 84.9-157.5 -41.2 74.7 21.2 97.5 35 35 A G S < S- 0 0 49 -4,-3.5 2,-0.3 -5,-0.2 -3,-0.1 0.515 107.5 -80.1 -57.4 -9.3 73.8 18.1 99.8 36 36 A G - 0 0 56 -4,-0.3 2,-0.1 -5,-0.1 -1,-0.1 -0.997 46.2-109.2 148.1-144.5 77.2 18.4 101.6 37 37 A D > + 0 0 76 -2,-0.3 4,-1.2 -3,-0.0 3,-0.4 -0.372 61.8 78.4-145.2-128.5 80.8 17.3 100.7 38 38 A A H >> S- 0 0 85 1,-0.2 4,-1.7 2,-0.2 3,-0.8 0.179 99.4 -6.8 56.2-155.3 83.3 14.6 102.0 39 39 A K H 3> S+ 0 0 66 1,-0.2 4,-3.3 2,-0.2 -1,-0.2 0.842 130.4 53.4 -43.9 -45.2 83.3 10.9 101.1 40 40 A Q H 3> S+ 0 0 132 -3,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.850 106.8 47.9 -75.3 -28.4 80.1 10.9 99.3 41 41 A Y H S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 5,-0.6 0.939 108.8 49.2 -56.3 -45.2 77.0 2.3 74.7 59 59 A H H X5S+ 0 0 46 -4,-2.4 4,-1.9 1,-0.2 6,-0.3 0.929 110.8 50.2 -60.7 -39.7 76.8 5.1 72.1 60 60 A Y H <5S+ 0 0 198 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.926 120.7 34.4 -66.2 -40.3 79.9 3.8 70.3 61 61 A V H <5S+ 0 0 30 -4,-2.8 -2,-0.2 1,-0.1 -3,-0.2 0.932 127.7 34.5 -79.7 -53.9 78.7 0.2 70.2 62 62 A A H <5S- 0 0 9 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.751 91.7-148.1 -71.8 -27.8 74.9 0.6 69.7 63 63 A G << + 0 0 41 -4,-1.9 -4,-0.1 -5,-0.6 -3,-0.1 0.799 47.9 142.3 61.5 36.4 75.5 3.8 67.5 64 64 A D 0 0 9 -6,-0.3 -5,-0.1 1,-0.2 -1,-0.1 0.743 360.0 360.0 -73.6 -20.7 72.2 5.4 68.7 65 65 A L 0 0 162 -6,-0.3 -1,-0.2 -50,-0.0 -6,-0.1 -0.508 360.0 360.0 75.4 360.0 73.9 8.9 68.7 66 !* 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 67 1 B M > 0 0 173 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -41.2 62.6 14.3 105.3 68 2 B T H > + 0 0 122 2,-0.2 4,-2.7 1,-0.2 5,-0.1 0.949 360.0 44.3 -61.7 -43.1 61.0 15.8 102.1 69 3 B Q H > S+ 0 0 82 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.874 113.8 50.1 -71.4 -33.4 64.4 17.0 100.8 70 4 B L H > S+ 0 0 102 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.916 109.5 51.8 -69.8 -40.1 66.0 13.7 101.8 71 5 B E H X S+ 0 0 114 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.902 107.8 53.1 -59.8 -39.8 63.2 11.9 100.0 72 6 B E H X S+ 0 0 73 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.950 110.3 46.1 -59.1 -50.1 64.0 14.2 96.9 73 7 B Q H X S+ 0 0 55 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.923 113.8 49.8 -57.7 -44.3 67.7 13.1 97.0 74 8 B L H X S+ 0 0 115 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.876 108.7 52.3 -59.8 -42.5 66.6 9.5 97.4 75 9 B H H X S+ 0 0 107 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.855 108.5 50.7 -61.4 -40.1 64.2 9.9 94.4 76 10 B N H X S+ 0 0 6 -4,-2.0 4,-1.7 2,-0.2 -48,-0.2 0.899 112.7 45.6 -69.5 -36.9 67.0 11.3 92.2 77 11 B V H X S+ 0 0 43 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.920 113.1 50.3 -68.7 -45.3 69.3 8.4 93.0 78 12 B E H X S+ 0 0 16 -4,-2.5 4,-3.1 1,-0.2 -2,-0.2 0.861 107.7 53.8 -62.6 -35.8 66.5 5.8 92.5 79 13 B T H X S+ 0 0 38 -4,-2.1 4,-3.0 2,-0.2 5,-0.2 0.912 109.2 47.9 -62.6 -49.3 65.6 7.3 89.2 80 14 B V H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.943 114.4 47.3 -56.3 -49.9 69.3 7.0 88.0 81 15 B R H X S+ 0 0 40 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.933 113.5 47.8 -59.4 -45.3 69.3 3.4 89.3 82 16 B S H X S+ 0 0 9 -4,-3.1 4,-1.9 1,-0.2 -2,-0.2 0.919 112.2 47.9 -63.5 -43.6 65.9 2.6 87.6 83 17 B I H X S+ 0 0 12 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.876 108.9 54.7 -67.7 -36.2 66.9 4.1 84.3 84 18 B T H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.943 108.3 48.6 -63.2 -39.2 70.2 2.2 84.3 85 19 B M H X S+ 0 0 45 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.889 111.3 51.5 -64.9 -38.4 68.4 -1.1 84.8 86 20 B Q H X S+ 0 0 14 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.879 108.4 50.6 -62.4 -40.9 66.0 -0.1 81.9 87 21 B L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.890 106.4 55.2 -64.9 -41.5 69.0 0.6 79.7 88 22 B E H X S+ 0 0 27 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.945 110.9 45.5 -55.1 -48.7 70.4 -2.9 80.6 89 23 B M H X S+ 0 0 51 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.876 110.9 52.2 -65.1 -36.0 67.2 -4.5 79.4 90 24 B A H X S+ 0 0 4 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.885 111.8 46.1 -67.9 -41.9 67.0 -2.4 76.2 91 25 B L H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.853 110.1 54.8 -67.6 -34.9 70.6 -3.4 75.3 92 26 B T H X S+ 0 0 60 -4,-1.9 4,-2.9 -5,-0.3 -2,-0.2 0.912 109.9 46.0 -62.6 -47.1 69.7 -7.0 76.1 93 27 B K H X S+ 0 0 70 -4,-2.3 4,-2.9 2,-0.2 5,-0.3 0.941 112.4 52.1 -63.3 -45.0 66.7 -6.9 73.7 94 28 B L H X S+ 0 0 1 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.933 115.1 40.1 -52.6 -52.1 68.9 -5.2 71.1 95 29 B K H X S+ 0 0 45 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.881 116.9 48.5 -69.1 -42.2 71.6 -7.9 71.4 96 30 B K H < S+ 0 0 140 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.918 111.3 50.4 -62.1 -45.6 69.2 -10.8 71.6 97 31 B D H < S+ 0 0 33 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.874 107.9 52.4 -63.0 -38.4 67.1 -9.7 68.6 98 32 B M H < 0 0 30 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.844 360.0 360.0 -73.1 -26.8 70.1 -9.3 66.4 99 33 B M < 0 0 84 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.145 360.0 360.0 -90.8 360.0 71.2 -12.9 67.3 100 ! 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 0.0 101 41 B Y > 0 0 177 0, 0.0 4,-2.6 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -24.2 78.4 -13.5 61.1 102 42 B Q H > + 0 0 48 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.867 360.0 55.1 -54.1 -40.0 81.4 -12.4 63.1 103 43 B V H > S+ 0 0 99 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.882 110.5 44.6 -70.3 -38.1 80.4 -8.7 63.0 104 44 B W H > S+ 0 0 106 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.956 117.0 47.5 -62.0 -48.1 76.9 -9.5 64.5 105 45 B Q H X S+ 0 0 87 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.873 111.4 49.5 -55.3 -43.7 78.6 -11.7 67.0 106 46 B R H X S+ 0 0 183 -4,-3.2 4,-2.0 2,-0.2 -1,-0.2 0.907 111.6 47.9 -73.3 -35.1 81.2 -9.1 67.8 107 47 B E H X S+ 0 0 39 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.897 110.7 53.4 -68.1 -38.1 78.6 -6.4 68.4 108 48 B S H X S+ 0 0 9 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.909 109.2 46.8 -63.2 -41.5 76.6 -8.7 70.5 109 49 B K H X S+ 0 0 126 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.888 111.9 52.3 -64.9 -40.7 79.6 -9.5 72.8 110 50 B A H X S+ 0 0 35 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.913 109.1 49.5 -63.2 -42.6 80.4 -5.8 73.0 111 51 B L H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.923 109.2 51.3 -63.4 -44.5 76.8 -5.1 74.0 112 52 B E H X S+ 0 0 79 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.934 112.0 48.6 -54.2 -44.0 77.0 -7.9 76.7 113 53 B S H X S+ 0 0 68 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.893 110.2 49.6 -65.6 -39.2 80.2 -6.2 78.0 114 54 B A H X S+ 0 0 3 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.919 110.8 51.2 -66.6 -40.7 78.6 -2.7 78.0 115 55 B I H X S+ 0 0 21 -4,-2.7 4,-2.4 -5,-0.2 -2,-0.2 0.945 109.2 49.8 -59.1 -48.8 75.7 -4.1 79.9 116 56 B A H X S+ 0 0 59 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.895 111.5 51.6 -56.8 -40.7 78.1 -5.8 82.5 117 57 B I H X S+ 0 0 87 -4,-2.3 4,-2.9 2,-0.2 5,-0.3 0.959 109.8 44.2 -64.7 -52.3 79.9 -2.5 82.9 118 58 B I H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.914 112.2 54.6 -68.6 -31.0 77.0 -0.3 83.6 119 59 B H H X S+ 0 0 118 -4,-2.4 4,-0.6 -5,-0.3 -1,-0.2 0.888 112.4 44.1 -59.1 -43.8 75.5 -2.9 86.0 120 60 B Y H >X S+ 0 0 194 -4,-2.0 3,-1.1 -5,-0.2 4,-0.6 0.955 113.2 48.7 -66.4 -54.1 78.8 -2.8 87.9 121 61 B V H >< S+ 0 0 23 -4,-2.9 3,-0.9 1,-0.3 -2,-0.2 0.896 111.4 51.8 -57.4 -37.5 79.2 0.9 88.0 122 62 B A H >< S+ 0 0 13 -4,-2.4 3,-1.7 -5,-0.3 -1,-0.3 0.660 88.5 80.5 -75.7 -15.4 75.6 1.3 89.1 123 63 B G H X< S+ 0 0 44 -3,-1.1 3,-1.9 -4,-0.6 -1,-0.2 0.861 84.1 63.1 -59.1 -35.5 76.0 -1.2 92.0 124 64 B D T << S+ 0 0 58 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.599 88.2 68.0 -64.7 -12.6 77.6 1.6 94.0 125 65 B L T < 0 0 20 -3,-1.7 -1,-0.3 -4,-0.1 -2,-0.2 0.533 360.0 360.0 -79.2 -5.4 74.3 3.5 93.8 126 66 B K < 0 0 161 -3,-1.9 -2,-0.2 -4,-0.2 -3,-0.1 0.921 360.0 360.0 71.8 360.0 73.1 0.7 96.1 127 !* 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 0.0 128 1 C M 0 0 132 0, 0.0 293,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 153.7 61.1 20.5 63.6 129 2 C T > - 0 0 20 289,-0.1 4,-2.8 1,-0.1 5,-0.2 -0.342 360.0-108.3 -70.4 159.3 58.8 20.7 60.6 130 3 C Q H > S+ 0 0 5 1,-0.2 4,-1.9 2,-0.2 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106.9 52.8 -59.1 -44.4 64.2 17.2 45.6 414 56 G A H X S+ 0 0 17 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.898 108.4 49.3 -57.5 -44.0 66.2 19.2 48.2 415 57 G I H X S+ 0 0 1 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.924 108.0 53.7 -61.8 -44.8 63.3 21.4 49.0 416 58 G I H X S+ 0 0 5 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.930 112.0 45.1 -53.6 -48.8 61.0 18.4 49.4 417 59 G H H X S+ 0 0 28 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.916 110.5 54.8 -65.6 -37.1 63.5 16.9 51.9 418 60 G Y H < S+ 0 0 70 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.887 110.2 45.0 -61.7 -41.2 63.8 20.2 53.7 419 61 G V H < S+ 0 0 0 -4,-2.4 -288,-0.4 1,-0.2 -287,-0.4 0.911 115.1 48.2 -70.4 -37.8 60.0 20.5 54.2 420 62 G A H < S- 0 0 9 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.773 95.5-146.1 -72.3 -29.4 59.9 16.8 55.4 421 63 G G < + 0 0 23 -4,-2.1 -3,-0.1 1,-0.3 -1,-0.1 0.219 56.2 130.7 87.0 -17.5 62.7 17.5 57.7 422 64 G D 0 0 29 -5,-0.2 -1,-0.3 0, 0.0 -2,-0.1 0.067 360.0 360.0 -60.6 174.9 63.7 13.9 56.9 423 65 G L 0 0 143 -3,-0.1 -2,-0.0 -5,-0.0 -3,-0.0 0.881 360.0 360.0 62.2 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0.889 100.2 55.2 -62.6 -43.9 46.1 16.2 50.6 455 31 H D H 3< S+ 0 0 11 -4,-1.6 -239,-2.3 1,-0.2 3,-0.3 0.770 109.7 50.8 -52.5 -29.7 46.7 14.5 54.1 456 32 H M T >< S+ 0 0 5 -4,-0.9 3,-1.8 -3,-0.2 -1,-0.2 0.527 79.5 99.3 -89.1 -4.8 47.8 17.9 55.2 457 33 H M T < S+ 0 0 98 -3,-1.5 -240,-0.2 1,-0.3 -1,-0.2 0.845 88.6 38.6 -61.9 -35.4 44.8 19.9 54.0 458 34 H R T 3 S- 0 0 109 -242,-2.1 -1,-0.3 -3,-0.3 -2,-0.1 0.401 103.9-144.2 -93.8 8.2 43.0 20.1 57.4 459 35 H G < - 0 0 2 -3,-1.8 -245,-1.2 -243,-0.2 -1,-0.3 -0.335 11.6-107.4 66.7-152.0 46.3 20.6 59.2 460 36 H G S S+ 0 0 4 1,-0.5 -247,-0.2 -247,-0.3 -248,-0.2 -0.081 84.6 25.0-138.9-121.5 46.9 19.1 62.7 461 37 H D S > S- 0 0 41 1,-0.1 3,-1.5 -253,-0.1 -1,-0.5 -0.360 78.3-127.3 -55.2 131.5 47.1 20.8 66.1 462 38 H A G > S+ 0 0 75 1,-0.3 3,-1.4 2,-0.2 4,-0.2 0.780 105.6 59.2 -58.3 -33.0 45.0 24.0 65.7 463 39 H K G 3 S+ 0 0 153 1,-0.3 3,-0.4 2,-0.1 -1,-0.3 0.835 105.1 51.2 -66.4 -31.0 47.8 26.3 67.0 464 40 H Q G <> S+ 0 0 49 -3,-1.5 4,-2.5 1,-0.2 -1,-0.3 0.165 72.8 115.7 -91.8 11.7 50.1 25.1 64.2 465 41 H Y H <> S+ 0 0 126 -3,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.895 76.1 50.7 -46.3 -47.0 47.6 25.7 61.4 466 42 H Q H > S+ 0 0 57 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.888 108.1 51.3 -66.8 -38.1 49.8 28.4 59.8 467 43 H V H > S+ 0 0 54 1,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.916 110.3 49.1 -64.3 -46.3 52.9 26.1 59.8 468 44 H W H X S+ 0 0 9 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.912 109.9 52.0 -58.5 -42.0 51.0 23.3 58.1 469 45 H Q H X S+ 0 0 74 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.882 110.0 49.2 -60.9 -41.8 49.7 25.8 55.5 470 46 H R H X S+ 0 0 122 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.875 113.3 45.9 -63.8 -40.7 53.3 27.0 54.8 471 47 H E H X S+ 0 0 3 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.886 111.6 52.2 -68.5 -40.3 54.5 23.5 54.4 472 48 H S H X S+ 0 0 19 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.928 111.4 47.2 -62.1 -43.2 51.5 22.6 52.2 473 49 H K H X S+ 0 0 76 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.871 109.1 53.2 -68.6 -41.8 52.3 25.6 50.0 474 50 H A H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.924 113.3 44.4 -56.3 -45.2 56.0 24.8 49.8 475 51 H L H X S+ 0 0 3 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.909 110.6 52.9 -67.7 -44.8 55.0 21.3 48.6 476 52 H E H X S+ 0 0 84 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.879 110.7 49.4 -50.9 -43.2 52.4 22.5 46.2 477 53 H S H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.911 107.5 53.4 -67.4 -39.7 55.2 24.8 44.8 478 54 H A H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.926 107.7 51.6 -62.8 -40.8 57.6 21.9 44.5 479 55 H I H X S+ 0 0 23 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.955 111.9 47.1 -56.7 -45.2 55.0 19.9 42.5 480 56 H A H X S+ 0 0 32 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.882 111.3 49.6 -68.8 -44.5 54.6 22.9 40.2 481 57 H I H X S+ 0 0 2 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.948 112.1 48.7 -58.6 -46.4 58.4 23.4 39.7 482 58 H I H X S+ 0 0 1 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.932 111.1 49.9 -58.5 -48.4 58.8 19.7 38.9 483 59 H H H X S+ 0 0 114 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.883 109.7 51.9 -55.8 -36.8 55.9 19.8 36.4 484 60 H Y H X S+ 0 0 7 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.940 111.9 45.3 -69.4 -48.7 57.5 22.8 34.8 485 61 H V H X S+ 0 0 0 -4,-2.7 4,-0.7 1,-0.2 3,-0.3 0.909 110.9 53.1 -62.7 -42.6 60.9 21.2 34.4 486 62 H A H >< S+ 0 0 2 -4,-2.7 3,-0.9 -5,-0.3 -1,-0.2 0.852 103.9 57.1 -63.7 -32.8 59.3 18.0 33.1 487 63 H G H >< S+ 0 0 30 -4,-1.7 3,-1.1 1,-0.2 -1,-0.3 0.827 101.5 57.2 -63.5 -32.0 57.5 20.1 30.5 488 64 H D H 3< S+ 0 0 45 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.663 97.0 60.6 -72.5 -19.3 60.8 21.3 29.3 489 65 H L T << 0 0 14 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.327 360.0 360.0 -86.3 -3.4 62.0 17.7 28.7 490 66 H K < 0 0 200 -3,-1.1 -1,-0.2 -4,-0.1 -4,-0.0 -0.760 360.0 360.0 101.5 360.0 59.1 17.6 26.2