==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN TRANSPORT 23-JUN-10 3AJW . COMPND 2 MOLECULE: FLAGELLAR FLIJ PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR K.IMADA,T.IBUKI,T.MINAMINO,K.NAMBA . 134 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10735.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 123 91.8 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 . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 114 85.1 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+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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 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 3 A Q 0 0 232 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -41.6 15.6 10.3 77.0 2 4 A H - 0 0 137 1,-0.1 2,-0.2 4,-0.1 3,-0.1 0.066 360.0-143.6 -46.9 164.8 13.3 10.4 80.0 3 5 A G > - 0 0 40 1,-0.1 4,-1.5 0, 0.0 5,-0.3 -0.634 28.2 -89.2-123.5-173.2 9.8 8.9 79.5 4 6 A A H > S+ 0 0 82 -2,-0.2 4,-1.3 2,-0.2 5,-0.1 0.991 123.7 29.9 -60.3 -62.0 6.3 9.7 80.8 5 7 A L H > S+ 0 0 26 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.925 116.6 57.4 -64.2 -50.1 6.5 7.6 84.0 6 8 A E H > S+ 0 0 77 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.865 106.6 47.1 -53.3 -46.2 10.2 7.8 84.6 7 9 A T H X S+ 0 0 61 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.913 117.4 44.2 -63.6 -41.8 10.3 11.6 84.8 8 10 A L H X S+ 0 0 78 -4,-1.3 4,-2.2 -5,-0.3 -2,-0.2 0.865 114.3 49.1 -70.0 -37.8 7.3 11.6 87.1 9 11 A K H X S+ 0 0 20 -4,-3.4 4,-2.4 2,-0.2 -2,-0.2 0.902 109.1 53.2 -68.7 -40.5 8.6 8.7 89.2 10 12 A D H X S+ 0 0 55 -4,-2.8 4,-1.9 -5,-0.3 -2,-0.2 0.890 110.2 47.6 -61.7 -39.1 12.0 10.5 89.5 11 13 A L H X S+ 0 0 97 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.933 111.3 50.2 -67.2 -44.6 10.3 13.6 90.8 12 14 A A H X S+ 0 0 9 -4,-2.2 4,-2.2 1,-0.2 93,-0.2 0.874 109.4 52.1 -59.6 -39.3 8.2 11.5 93.3 13 15 A E H X S+ 0 0 78 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.904 110.3 48.0 -64.2 -43.5 11.4 9.8 94.5 14 16 A K H X S+ 0 0 124 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.884 109.8 52.3 -65.4 -39.1 13.0 13.2 95.1 15 17 A E H X S+ 0 0 77 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.898 110.0 50.3 -62.8 -39.9 9.9 14.5 96.9 16 18 A V H X S+ 0 0 10 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.933 111.4 46.5 -62.3 -49.6 10.1 11.4 99.1 17 19 A D H X S+ 0 0 85 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.913 113.3 49.8 -59.9 -44.8 13.8 11.9 99.9 18 20 A D H X S+ 0 0 86 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.921 111.0 49.5 -59.5 -45.2 13.2 15.6 100.6 19 21 A A H X S+ 0 0 2 -4,-2.6 4,-2.8 1,-0.2 79,-0.2 0.880 108.6 52.6 -63.9 -38.6 10.3 14.7 102.9 20 22 A A H X S+ 0 0 41 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.899 110.6 47.4 -64.9 -41.3 12.4 12.1 104.8 21 23 A R H X S+ 0 0 171 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.917 111.9 50.0 -66.9 -39.6 15.1 14.7 105.4 22 24 A L H X S+ 0 0 68 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.939 110.8 49.9 -62.2 -44.4 12.5 17.2 106.5 23 25 A L H X S+ 0 0 34 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.921 109.6 52.2 -59.6 -42.2 11.1 14.6 108.9 24 26 A G H X S+ 0 0 21 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.902 109.6 48.2 -60.0 -43.9 14.6 14.0 110.2 25 27 A E H X S+ 0 0 106 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.933 112.6 48.5 -63.2 -45.8 15.1 17.7 110.9 26 28 A M H X S+ 0 0 31 -4,-2.7 4,-2.3 1,-0.2 65,-0.2 0.905 112.3 48.6 -62.5 -40.6 11.8 18.0 112.7 27 29 A R H X S+ 0 0 138 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.913 111.4 48.3 -66.8 -43.6 12.4 14.9 114.8 28 30 A R H X S+ 0 0 153 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.893 113.2 49.7 -63.6 -38.0 15.9 16.0 115.9 29 31 A G H X S+ 0 0 11 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.903 110.8 48.4 -66.5 -41.1 14.5 19.4 116.7 30 32 A C H X S+ 0 0 19 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.848 111.4 50.5 -67.0 -37.3 11.6 18.0 118.8 31 33 A Q H X S+ 0 0 108 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.862 111.8 47.2 -69.0 -38.7 14.0 15.7 120.7 32 34 A Q H X S+ 0 0 86 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.903 109.4 53.8 -71.0 -39.0 16.3 18.6 121.5 33 35 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.867 109.8 48.6 -61.8 -36.4 13.4 20.8 122.6 34 36 A E H X S+ 0 0 92 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.859 110.3 50.7 -72.3 -35.7 12.3 18.0 125.0 35 37 A E H X S+ 0 0 78 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.896 111.3 48.3 -68.6 -41.4 15.9 17.6 126.4 36 38 A Q H X S+ 0 0 65 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.914 113.4 46.9 -64.8 -43.2 16.1 21.4 127.0 37 39 A L H X S+ 0 0 14 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.920 110.9 53.7 -63.0 -43.3 12.7 21.4 128.7 38 40 A K H X S+ 0 0 70 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.916 105.3 52.7 -56.4 -48.4 13.8 18.4 130.7 39 41 A M H X S+ 0 0 93 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.877 108.9 50.6 -56.8 -41.5 17.0 20.1 131.9 40 42 A L H X S+ 0 0 35 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.906 108.9 49.9 -66.0 -41.9 15.0 23.1 133.1 41 43 A I H X S+ 0 0 64 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.857 112.3 48.3 -66.5 -33.0 12.5 21.0 135.1 42 44 A D H X S+ 0 0 76 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.911 109.6 52.1 -70.6 -42.1 15.3 19.1 136.7 43 45 A Y H X S+ 0 0 129 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.909 111.2 49.8 -57.9 -41.3 17.0 22.4 137.6 44 46 A Q H X S+ 0 0 29 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.946 112.3 44.6 -63.3 -51.9 13.7 23.4 139.1 45 47 A N H X S+ 0 0 78 -4,-2.5 4,-3.4 2,-0.2 5,-0.4 0.930 114.1 48.4 -60.8 -47.2 13.3 20.3 141.2 46 48 A E H X S+ 0 0 65 -4,-3.0 4,-0.9 1,-0.2 -1,-0.2 0.881 111.8 51.3 -60.2 -38.2 16.9 20.3 142.4 47 49 A Y H < S+ 0 0 55 -4,-2.0 4,-0.3 -5,-0.3 -1,-0.2 0.888 116.8 41.0 -65.4 -39.0 16.5 24.0 143.3 48 50 A R H >< S+ 0 0 100 -4,-2.2 3,-3.4 2,-0.2 -2,-0.2 0.979 108.6 53.7 -72.9 -60.7 13.3 23.1 145.2 49 51 A S H 3< S+ 0 0 98 -4,-3.4 -1,-0.2 1,-0.3 -3,-0.2 0.761 111.5 56.0 -44.5 -24.6 14.3 19.9 147.0 50 52 A N T 3< S+ 0 0 117 -4,-0.9 2,-2.6 -5,-0.4 -1,-0.3 0.602 75.2 96.5 -82.6 -22.6 17.1 22.2 148.1 51 53 A L < 0 0 91 -3,-3.4 -1,-0.2 -4,-0.3 -2,-0.1 -0.101 360.0 360.0 -69.6 43.9 15.0 25.0 149.6 52 54 A N 0 0 165 -2,-2.6 -1,-0.2 -3,-0.1 -2,-0.1 0.591 360.0 360.0-132.1 360.0 15.4 23.5 153.1 53 ! 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 54 57 A M 0 0 196 0, 0.0 2,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 -70.6 17.6 28.9 157.5 55 58 A G - 0 0 33 1,-0.2 0, 0.0 2,-0.0 0, 0.0 -0.203 360.0-113.4-101.9-168.2 16.7 32.1 159.4 56 59 A N S > S- 0 0 145 -2,-0.1 3,-1.3 4,-0.0 -1,-0.2 0.532 93.3 -12.0 -94.3-119.3 13.8 34.5 159.5 57 60 A G G > S+ 0 0 52 1,-0.3 3,-1.2 2,-0.2 4,-0.3 0.778 134.8 65.5 -55.6 -23.1 14.1 38.1 158.4 58 61 A I G 3 S+ 0 0 132 1,-0.3 3,-0.4 2,-0.2 -1,-0.3 0.878 107.5 36.6 -65.4 -40.8 17.8 37.3 158.3 59 62 A A G X> S+ 0 0 8 -3,-1.3 4,-1.4 1,-0.2 3,-0.5 0.016 86.5 111.2 -99.9 24.2 17.3 34.8 155.5 60 63 A S H <> + 0 0 50 -3,-1.2 4,-2.7 1,-0.3 -1,-0.2 0.879 69.2 62.1 -64.3 -38.6 14.7 37.1 154.0 61 64 A N H 3> S+ 0 0 85 -3,-0.4 4,-2.6 -4,-0.3 -1,-0.3 0.829 102.8 53.5 -55.9 -30.7 17.0 37.8 151.1 62 65 A R H <> S+ 0 0 98 -3,-0.5 4,-2.8 2,-0.2 -1,-0.2 0.908 105.5 49.2 -71.0 -45.9 16.7 34.0 150.5 63 66 A W H X S+ 0 0 167 -4,-1.4 4,-2.3 1,-0.2 -2,-0.2 0.929 114.9 47.9 -58.7 -43.9 12.9 34.0 150.4 64 67 A I H X S+ 0 0 85 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.932 111.3 47.5 -62.2 -49.8 13.2 36.9 148.0 65 68 A N H X S+ 0 0 81 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.901 110.9 54.9 -58.4 -42.5 15.8 35.3 145.8 66 69 A Y H X S+ 0 0 34 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.947 108.6 45.7 -55.9 -54.3 13.7 32.2 145.7 67 70 A Q H X S+ 0 0 72 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.911 114.4 47.8 -57.7 -47.2 10.6 33.9 144.5 68 71 A Q H X S+ 0 0 128 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.925 115.0 44.9 -62.5 -45.4 12.4 35.8 141.8 69 72 A F H X S+ 0 0 52 -4,-2.7 4,-3.3 -5,-0.2 5,-0.2 0.934 111.1 51.3 -66.0 -46.6 14.3 32.8 140.5 70 73 A I H X S+ 0 0 27 -4,-2.7 4,-3.0 -5,-0.2 5,-0.2 0.901 111.4 49.1 -57.9 -41.7 11.3 30.4 140.5 71 74 A Q H X S+ 0 0 90 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.2 0.890 112.6 47.9 -64.8 -39.4 9.3 33.0 138.5 72 75 A T H X S+ 0 0 66 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.925 114.4 46.0 -68.0 -43.0 12.1 33.4 136.0 73 76 A L H X S+ 0 0 9 -4,-3.3 4,-2.8 2,-0.2 -2,-0.2 0.914 109.8 53.0 -65.8 -43.9 12.6 29.6 135.7 74 77 A E H X S+ 0 0 74 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.880 107.1 54.4 -59.0 -36.9 8.8 29.0 135.3 75 78 A K H X S+ 0 0 119 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.907 109.3 46.6 -61.7 -44.4 8.9 31.6 132.5 76 79 A A H X S+ 0 0 34 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.921 111.3 52.2 -64.7 -44.6 11.6 29.7 130.7 77 80 A I H X S+ 0 0 14 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.908 107.8 51.5 -59.6 -42.9 9.8 26.4 131.2 78 81 A E H X S+ 0 0 111 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.916 110.9 47.6 -61.9 -44.4 6.6 27.8 129.7 79 82 A Q H X S+ 0 0 122 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.888 113.9 46.9 -64.7 -39.2 8.4 29.0 126.6 80 83 A H H X S+ 0 0 46 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.850 109.5 53.4 -71.9 -33.0 10.2 25.7 126.1 81 84 A R H X S+ 0 0 100 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.944 110.5 48.8 -64.4 -44.5 7.0 23.8 126.7 82 85 A L H X S+ 0 0 80 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.913 109.4 51.5 -60.0 -44.4 5.5 26.0 123.9 83 86 A Q H X S+ 0 0 57 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.887 108.3 51.6 -60.5 -40.4 8.5 25.3 121.6 84 87 A L H X S+ 0 0 18 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.896 107.2 53.4 -63.3 -40.6 8.1 21.6 122.1 85 88 A T H X S+ 0 0 68 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.900 109.8 48.7 -59.8 -40.7 4.4 21.9 121.2 86 89 A Q H X S+ 0 0 107 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.907 112.6 45.9 -67.7 -42.9 5.5 23.7 118.0 87 90 A W H X S+ 0 0 78 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.911 110.1 55.8 -64.8 -42.4 8.1 21.0 117.1 88 91 A T H X S+ 0 0 57 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.918 108.0 47.3 -56.5 -46.2 5.6 18.3 117.9 89 92 A Q H X S+ 0 0 110 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.877 111.0 52.2 -63.7 -37.8 3.1 19.7 115.4 90 93 A K H X S+ 0 0 107 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.900 108.9 50.0 -65.7 -39.7 5.9 20.1 112.8 91 94 A V H X S+ 0 0 27 -4,-2.6 4,-2.7 -65,-0.2 5,-0.2 0.944 109.1 51.9 -63.1 -47.3 6.9 16.4 113.2 92 95 A D H X S+ 0 0 79 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.907 114.3 43.2 -55.1 -45.1 3.2 15.3 112.8 93 96 A L H X S+ 0 0 88 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.886 113.1 50.2 -69.4 -42.4 2.9 17.3 109.6 94 97 A A H X S+ 0 0 4 -4,-2.7 4,-2.5 2,-0.2 -71,-0.2 0.879 111.7 50.5 -63.8 -37.6 6.3 16.2 108.2 95 98 A L H X S+ 0 0 74 -4,-2.7 4,-2.6 -5,-0.2 -2,-0.2 0.935 110.4 47.6 -65.8 -47.9 5.4 12.6 108.9 96 99 A K H X S+ 0 0 117 -4,-2.1 4,-2.2 -5,-0.2 5,-0.2 0.928 112.6 50.8 -59.3 -44.5 2.0 12.8 107.2 97 100 A S H X S+ 0 0 26 -4,-2.6 4,-2.2 1,-0.2 5,-0.2 0.930 110.2 48.1 -59.3 -47.5 3.7 14.5 104.2 98 101 A W H X S+ 0 0 77 -4,-2.5 4,-2.4 -79,-0.2 5,-0.2 0.953 109.5 54.0 -59.7 -48.6 6.3 11.8 103.9 99 102 A R H X S+ 0 0 148 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.911 111.1 43.6 -52.6 -49.5 3.7 9.0 104.1 100 103 A E H X S+ 0 0 112 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.887 114.0 48.9 -68.6 -37.6 1.6 10.4 101.3 101 104 A K H X S+ 0 0 48 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.837 109.4 54.8 -68.3 -29.1 4.6 11.1 99.0 102 105 A K H X S+ 0 0 74 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.897 109.2 47.5 -68.2 -38.9 5.8 7.6 99.8 103 106 A Q H X S+ 0 0 116 -4,-1.9 4,-1.6 -5,-0.2 -2,-0.2 0.846 108.9 53.3 -71.2 -33.0 2.4 6.3 98.6 104 107 A R H X S+ 0 0 159 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.923 108.3 51.3 -66.6 -42.0 2.6 8.5 95.5 105 108 A L H X S+ 0 0 26 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.915 106.7 52.3 -60.7 -45.0 6.0 6.9 94.7 106 109 A Q H X S+ 0 0 116 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.877 106.6 55.6 -59.1 -36.6 4.7 3.4 95.1 107 110 A A H X S+ 0 0 53 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.886 108.8 45.3 -63.9 -40.2 1.9 4.2 92.6 108 111 A W H X S+ 0 0 55 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.855 110.6 55.8 -71.1 -33.2 4.4 5.3 90.0 109 112 A Q H X S+ 0 0 72 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.903 105.4 51.7 -63.4 -42.3 6.4 2.2 90.8 110 113 A T H X S+ 0 0 61 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.906 108.2 51.2 -61.8 -42.6 3.4 0.1 90.0 111 114 A L H X S+ 0 0 61 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.908 109.2 51.0 -62.1 -41.7 2.9 1.8 86.7 112 115 A Q H X S+ 0 0 25 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.887 105.8 55.3 -62.9 -39.3 6.5 1.2 85.7 113 116 A D H X S+ 0 0 88 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.904 108.3 48.7 -61.3 -39.2 6.1 -2.5 86.6 114 117 A R H X S+ 0 0 162 -4,-1.8 4,-3.1 1,-0.2 -1,-0.2 0.831 109.3 53.2 -68.1 -32.2 3.2 -2.7 84.2 115 118 A Q H X S+ 0 0 107 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.880 106.3 51.7 -69.8 -38.1 5.3 -0.9 81.6 116 119 A T H X S+ 0 0 93 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.920 113.0 47.4 -62.6 -40.3 8.0 -3.5 82.0 117 120 A A H X S+ 0 0 55 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.955 112.6 46.8 -64.0 -52.6 5.3 -6.1 81.5 118 121 A A H X S+ 0 0 60 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.903 113.8 49.0 -56.7 -45.1 3.8 -4.4 78.4 119 122 A A H X S+ 0 0 58 -4,-2.9 4,-2.5 2,-0.2 -1,-0.2 0.912 111.5 47.4 -62.9 -46.4 7.3 -3.9 76.9 120 123 A L H X S+ 0 0 118 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.927 114.7 47.9 -61.7 -43.2 8.4 -7.5 77.4 121 124 A L H X S+ 0 0 91 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.879 111.5 49.5 -65.5 -38.7 5.1 -8.7 76.0 122 125 A A H X S+ 0 0 25 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.917 111.3 49.0 -66.2 -44.5 5.3 -6.4 73.0 123 126 A E H X S+ 0 0 103 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.908 110.2 52.5 -59.4 -45.6 8.9 -7.6 72.2 124 127 A N H X S+ 0 0 84 -4,-2.3 4,-0.5 -5,-0.2 -2,-0.2 0.914 114.1 41.8 -58.5 -46.6 7.8 -11.2 72.5 125 128 A R H >X S+ 0 0 138 -4,-2.1 4,-2.0 1,-0.2 3,-0.8 0.926 116.1 45.6 -71.1 -46.1 4.9 -10.7 70.0 126 129 A M H 3X S+ 0 0 102 -4,-2.8 4,-1.0 1,-0.2 -2,-0.2 0.826 107.7 58.9 -69.1 -30.1 6.7 -8.6 67.4 127 130 A D H 3< S+ 0 0 73 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.649 119.2 28.3 -73.7 -14.8 9.8 -10.8 67.5 128 131 A Q H XX S+ 0 0 98 -3,-0.8 4,-1.6 -4,-0.5 3,-0.8 0.572 103.9 74.0-119.4 -15.6 7.8 -13.8 66.4 129 132 A K H >X S+ 0 0 107 -4,-2.0 4,-1.4 1,-0.3 3,-0.8 0.955 94.9 58.8 -57.2 -48.9 5.0 -12.3 64.5 130 133 A K H 3< S+ 0 0 121 -4,-1.0 -1,-0.3 1,-0.3 4,-0.2 0.707 120.3 25.5 -51.5 -28.5 7.6 -11.7 61.8 131 134 A M H <4 S+ 0 0 124 -3,-0.8 -1,-0.3 2,-0.1 -2,-0.2 0.360 109.5 71.6-121.2 1.4 8.3 -15.5 61.6 132 135 A D H X< S+ 0 0 96 -4,-1.6 3,-0.6 -3,-0.8 -3,-0.2 0.932 106.4 32.9 -82.1 -52.5 5.0 -17.0 62.8 133 136 A E T 3< S+ 0 0 132 -4,-1.4 -3,-0.1 1,-0.2 -2,-0.1 0.922 108.9 64.6 -70.5 -47.5 2.8 -16.3 59.8 134 137 A F T 3 0 0 175 -5,-0.5 -1,-0.2 1,-0.3 -2,-0.1 0.634 360.0 360.0 -53.2 -11.0 5.6 -16.6 57.2 135 138 A A < 0 0 118 -3,-0.6 -1,-0.3 -4,-0.0 -2,-0.2 0.991 360.0 360.0 -67.7 360.0 5.5 -20.2 58.4