==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHEMOTAXIS 18-APR-95 1LIH . COMPND 2 MOLECULE: ASPARTATE RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR S.-H.KIM,W.SCOTT,J.I.YEH,G.G.PRIVE,M.MILBURN . 160 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9372.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 128 80.0 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 . 5 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 110 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 1 0 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 25 A M 0 0 161 0, 0.0 2,-0.2 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0-161.7 2.5 55.6 174.9 2 26 A G + 0 0 54 2,-0.1 2,-0.0 3,-0.0 0, 0.0 -0.827 360.0 37.9-155.9-173.6 -0.5 57.2 176.8 3 27 A G S S+ 0 0 83 -2,-0.2 2,-1.3 1,-0.1 0, 0.0 -0.338 113.3 5.9 68.5-148.0 -3.0 60.2 176.3 4 28 A L S S+ 0 0 149 1,-0.2 155,-0.2 155,-0.1 -1,-0.1 -0.574 73.8 145.9 -81.0 81.4 -4.4 60.9 172.7 5 29 A L + 0 0 38 -2,-1.3 152,-2.5 1,-0.2 2,-0.4 0.903 56.6 36.0 -87.8 -51.7 -3.0 58.1 170.5 6 30 A F - 0 0 80 150,-0.2 -1,-0.2 1,-0.1 150,-0.1 -0.969 58.8-143.1-117.9 136.3 -5.7 57.3 167.9 7 31 A S S S- 0 0 108 -2,-0.4 2,-0.3 1,-0.1 3,-0.1 0.726 82.0 -26.7 -62.8 -26.6 -8.2 59.5 165.9 8 32 A S S > S- 0 0 60 1,-0.1 4,-2.7 0, 0.0 5,-0.1 -0.968 72.5 -82.1-174.0 173.7 -11.0 56.8 166.0 9 33 A L H > S+ 0 0 127 -2,-0.3 4,-3.1 2,-0.2 5,-0.3 0.913 126.8 54.4 -59.9 -45.1 -11.7 53.2 166.3 10 34 A Q H > S+ 0 0 123 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.961 110.8 45.7 -55.8 -47.6 -11.0 52.8 162.4 11 35 A H H > S+ 0 0 43 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.929 115.3 46.4 -64.5 -38.2 -7.6 54.4 162.9 12 36 A C H X S+ 0 0 49 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.992 114.2 47.7 -66.6 -50.0 -6.8 52.2 166.0 13 37 A Q H X S+ 0 0 113 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.852 109.1 54.1 -59.5 -33.5 -8.0 49.1 164.3 14 38 A Q H X S+ 0 0 97 -4,-3.0 4,-1.6 -5,-0.3 -1,-0.2 0.947 108.3 48.9 -64.0 -41.2 -6.0 49.9 161.2 15 39 A G H X S+ 0 0 5 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.870 109.5 54.0 -70.8 -32.6 -2.9 50.2 163.2 16 40 A F H X S+ 0 0 124 -4,-2.1 4,-3.3 2,-0.2 -2,-0.2 0.975 104.2 53.3 -60.6 -49.9 -3.7 46.9 164.9 17 41 A V H X S+ 0 0 87 -4,-2.4 4,-1.6 2,-0.2 5,-0.2 0.938 114.0 42.1 -56.3 -40.7 -4.0 44.9 161.7 18 42 A I H X S+ 0 0 51 -4,-1.6 4,-2.4 1,-0.2 3,-0.4 0.945 117.3 47.4 -69.8 -52.4 -0.5 46.2 160.4 19 43 A S H X S+ 0 0 25 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.840 107.8 54.9 -64.1 -33.4 1.2 45.7 163.8 20 44 A N H X S+ 0 0 59 -4,-3.3 4,-1.1 2,-0.2 -1,-0.2 0.868 111.8 43.4 -72.9 -32.1 -0.3 42.2 164.3 21 45 A E H X S+ 0 0 38 -4,-1.6 4,-2.8 -3,-0.4 3,-0.4 0.910 113.3 53.4 -66.6 -54.3 1.2 41.0 160.9 22 46 A L H X S+ 0 0 9 -4,-2.4 4,-2.9 1,-0.3 5,-0.3 0.930 107.6 50.8 -47.5 -48.1 4.5 42.7 161.7 23 47 A R H X S+ 0 0 169 -4,-2.5 4,-1.8 1,-0.2 -1,-0.3 0.819 111.0 46.0 -56.8 -45.2 4.7 41.0 164.9 24 48 A Q H X S+ 0 0 68 -4,-1.1 4,-2.4 -3,-0.4 -2,-0.2 0.906 113.6 49.8 -71.4 -40.1 4.1 37.5 163.5 25 49 A Q H X S+ 0 0 3 -4,-2.8 4,-1.9 1,-0.3 3,-0.3 0.971 112.9 45.3 -59.6 -57.4 6.6 38.0 160.7 26 50 A Q H X S+ 0 0 56 -4,-2.9 4,-2.5 -5,-0.3 -1,-0.3 0.842 108.1 58.9 -54.4 -40.3 9.2 39.3 163.1 27 51 A S H X S+ 0 0 51 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.2 0.967 109.1 46.0 -58.0 -42.8 8.5 36.3 165.6 28 52 A E H X S+ 0 0 33 -4,-2.4 4,-2.4 -3,-0.3 -2,-0.2 0.926 114.5 45.3 -66.6 -47.7 9.3 33.9 162.8 29 53 A L H X S+ 0 0 5 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.906 111.2 53.4 -60.8 -42.0 12.5 35.7 161.7 30 54 A T H X S+ 0 0 84 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.919 111.7 45.5 -60.6 -51.6 13.7 36.1 165.2 31 55 A S H X S+ 0 0 31 -4,-2.0 4,-2.6 -5,-0.2 -1,-0.2 0.860 110.1 54.4 -68.1 -31.7 13.3 32.4 165.9 32 56 A T H X S+ 0 0 5 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.933 111.8 43.8 -67.5 -43.7 15.0 31.5 162.6 33 57 A W H X S+ 0 0 61 -4,-2.9 4,-2.7 2,-0.2 3,-0.3 0.956 113.5 52.9 -63.6 -42.4 18.2 33.7 163.5 34 58 A D H X S+ 0 0 77 -4,-2.9 4,-2.0 1,-0.3 -1,-0.2 0.920 109.8 44.9 -61.8 -45.3 18.2 32.3 167.0 35 59 A L H X S+ 0 0 20 -4,-2.6 4,-1.4 2,-0.2 -1,-0.3 0.766 111.4 55.0 -75.8 -14.9 18.1 28.6 165.9 36 60 A M H X S+ 0 0 0 -4,-1.6 4,-2.5 -3,-0.3 -2,-0.2 0.906 108.3 48.1 -80.4 -38.1 20.8 29.3 163.2 37 61 A L H X S+ 0 0 50 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.947 110.9 50.5 -63.3 -45.5 23.1 30.8 165.9 38 62 A Q H X S+ 0 0 74 -4,-2.0 4,-2.8 -5,-0.3 -1,-0.2 0.927 110.5 51.9 -57.8 -33.9 22.5 27.7 168.2 39 63 A T H X S+ 0 0 0 -4,-1.4 4,-1.4 2,-0.2 -2,-0.2 0.987 108.8 47.7 -68.2 -46.8 23.3 25.6 165.2 40 64 A R H >X S+ 0 0 50 -4,-2.5 4,-2.7 2,-0.2 3,-0.6 0.909 114.0 49.6 -55.6 -42.2 26.6 27.4 164.6 41 65 A I H 3X S+ 0 0 100 -4,-2.5 4,-2.6 1,-0.3 5,-0.3 0.989 109.8 49.2 -64.2 -53.9 27.4 27.1 168.4 42 66 A N H 3X S+ 0 0 19 -4,-2.8 4,-0.9 -5,-0.2 -1,-0.3 0.671 110.9 50.1 -59.9 -19.2 26.6 23.4 168.4 43 67 A L H < S+ 0 0 128 -4,-3.0 3,-1.1 1,-0.2 -2,-0.2 0.931 110.1 53.7 -55.9 -40.2 35.7 18.2 170.7 50 74 A M H 3< S+ 0 0 16 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.919 106.5 53.7 -59.8 -46.8 37.0 16.8 167.4 51 75 A M H 3< S+ 0 0 119 -4,-2.4 2,-2.0 -5,-0.2 -1,-0.3 0.647 90.8 73.9 -74.6 -9.4 40.1 18.8 167.7 52 76 A M S X< S- 0 0 131 -3,-1.1 3,-1.0 -4,-1.0 2,-0.2 -0.591 87.6-163.2 -78.9 40.7 41.0 17.6 171.2 53 77 A D T 3 + 0 0 111 -2,-2.0 -2,-0.1 1,-0.2 -3,-0.1 -0.611 64.6 68.8 -77.2 156.3 42.0 14.4 169.9 54 78 A A T 3 S- 0 0 97 -2,-0.2 -1,-0.2 -4,-0.1 -4,-0.0 -0.612 84.6-172.1 159.0 -46.4 42.7 11.2 171.2 55 79 A S < - 0 0 36 -3,-1.0 2,-0.2 -6,-0.2 3,-0.1 -0.256 23.9-100.7 73.7-154.9 38.9 11.4 171.6 56 80 A N - 0 0 149 1,-0.1 2,-0.2 -2,-0.0 -1,-0.1 -0.659 68.1 -52.5-169.2 108.8 36.7 8.9 173.5 57 81 A Q S S- 0 0 198 -2,-0.2 2,-0.4 2,-0.1 -1,-0.1 -0.345 114.9 -4.6 53.8-109.0 34.6 6.3 171.5 58 82 A Q S S+ 0 0 75 -2,-0.2 5,-0.0 1,-0.1 -3,-0.0 -0.953 71.8 134.1-120.5 136.5 32.5 8.0 168.8 59 83 A S + 0 0 35 -2,-0.4 7,-0.3 4,-0.1 6,-0.2 0.303 62.3 53.2-142.5 -44.7 32.4 11.8 168.7 60 84 A S S S+ 0 0 35 -11,-0.1 6,-0.2 1,-0.1 60,-0.1 0.964 112.8 17.9 -75.7 -78.1 32.8 12.9 165.1 61 85 A A S S+ 0 0 29 57,-0.1 2,-0.3 58,-0.1 -1,-0.1 0.880 131.9 15.4 -64.0 -50.8 30.5 11.4 162.4 62 86 A K S S+ 0 0 98 4,-0.0 2,-0.1 3,-0.0 3,-0.1 -0.743 83.3 84.6-124.1 165.5 27.9 10.3 164.8 63 87 A T S > S- 0 0 59 -2,-0.3 4,-0.7 1,-0.1 3,-0.5 -0.240 84.4 -70.5 115.1-162.5 27.1 10.8 168.4 64 88 A D H > S+ 0 0 110 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.561 106.5 72.2-135.3 -13.2 24.8 13.8 169.4 65 89 A L H > S+ 0 0 23 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.900 108.1 44.6 -69.1 -42.5 26.2 17.3 169.3 66 90 A L H > S+ 0 0 3 -3,-0.5 4,-2.5 -7,-0.3 -1,-0.2 0.842 109.6 55.2 -68.9 -30.0 26.0 17.1 165.6 67 91 A Q H X S+ 0 0 80 -4,-0.7 4,-2.2 2,-0.2 -2,-0.2 0.879 106.1 51.9 -67.2 -37.6 22.5 15.6 165.9 68 92 A N H X S+ 0 0 69 -4,-2.1 4,-2.9 2,-0.2 5,-0.3 0.941 109.8 50.9 -59.4 -45.2 21.6 18.7 168.0 69 93 A A H X S+ 0 0 0 -4,-1.8 4,-1.9 1,-0.3 5,-0.3 0.940 108.8 51.0 -62.2 -44.9 23.0 20.9 165.1 70 94 A K H X S+ 0 0 54 -4,-2.5 4,-2.4 1,-0.2 -1,-0.3 0.857 112.0 47.0 -68.0 -40.0 20.8 18.9 162.8 71 95 A T H X S+ 0 0 69 -4,-2.2 4,-1.1 2,-0.2 -1,-0.2 0.848 112.5 45.0 -64.6 -44.7 17.8 19.5 164.9 72 96 A T H X S+ 0 0 12 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.908 115.5 49.4 -74.6 -28.6 18.1 23.4 165.6 73 97 A L H X S+ 0 0 19 -4,-1.9 4,-1.7 -5,-0.3 5,-0.3 0.990 110.8 49.5 -70.3 -49.2 18.9 23.9 161.8 74 98 A A H < S+ 0 0 70 -4,-2.4 4,-0.3 -5,-0.3 -1,-0.2 0.666 112.4 48.8 -65.8 -18.8 15.9 21.8 160.9 75 99 A Q H X S+ 0 0 100 -4,-1.1 4,-1.6 -40,-0.1 -1,-0.2 0.826 106.1 56.6 -82.0 -37.3 13.8 24.0 163.4 76 100 A A H >X S+ 0 0 0 -4,-2.5 4,-2.7 -3,-0.2 3,-0.5 0.980 106.7 48.0 -56.1 -54.0 15.1 27.4 162.0 77 101 A A H 3X S+ 0 0 39 -4,-1.7 4,-3.0 2,-0.2 -1,-0.2 0.843 107.6 58.3 -57.2 -17.4 13.9 26.6 158.2 78 102 A A H 3> S+ 0 0 52 -5,-0.3 4,-1.9 -4,-0.3 -1,-0.2 0.953 109.1 42.3 -80.2 -44.1 10.5 25.6 159.6 79 103 A H H < S+ 0 0 14 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.926 109.2 50.9 -55.6 -47.4 7.8 33.4 157.5 84 108 A K H 3< S+ 0 0 112 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.803 104.5 59.5 -63.6 -30.6 7.8 32.6 153.7 85 109 A N T 3< S+ 0 0 145 -4,-2.3 2,-0.3 -5,-0.2 -1,-0.3 0.473 89.3 95.5 -60.8 -17.1 4.1 31.7 153.9 86 110 A M S < S- 0 0 42 -3,-1.5 -3,-0.0 -5,-0.1 3,-0.0 -0.675 88.6 -89.9 -92.0 149.6 3.0 35.1 155.1 87 111 A T - 0 0 90 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.1 -0.257 39.2-128.7 -55.1 120.5 1.7 38.0 153.1 88 112 A P - 0 0 91 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.488 23.2-135.4 -63.4 125.7 4.6 40.3 152.0 89 113 A L >> - 0 0 31 1,-0.1 3,-1.2 -68,-0.0 4,-0.9 -0.865 13.7-123.8 -85.7 140.9 3.6 43.8 153.1 90 114 A P G >4 S+ 0 0 121 0, 0.0 3,-1.6 0, 0.0 4,-0.4 0.855 112.7 48.9 -42.2 -54.6 4.3 46.5 150.3 91 115 A A G 34 S+ 0 0 61 1,-0.3 4,-0.3 2,-0.1 3,-0.2 0.754 116.8 43.6 -63.0 -20.4 6.5 48.6 152.8 92 116 A M G <> S+ 0 0 1 -3,-1.2 4,-2.6 1,-0.2 -1,-0.3 0.502 84.6 97.9-106.9 -4.5 8.4 45.5 153.7 93 117 A A H S+ 0 0 168 -4,-0.4 4,-2.4 2,-0.2 3,-0.2 0.988 116.2 46.5 -67.3 -55.6 12.5 44.9 149.5 95 119 A A H > S+ 0 0 5 -4,-0.3 4,-1.9 1,-0.3 49,-0.2 0.849 111.9 52.6 -41.7 -49.5 13.8 44.1 153.1 96 120 A S H X S+ 0 0 17 -4,-2.6 4,-2.1 2,-0.2 -1,-0.3 0.930 110.6 45.9 -67.5 -45.2 12.0 40.8 153.0 97 121 A A H X S+ 0 0 63 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.967 110.7 53.3 -63.5 -35.0 13.7 39.8 149.5 98 122 A N H X S+ 0 0 47 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.885 108.1 53.3 -70.1 -33.6 17.0 40.9 150.8 99 123 A V H X S+ 0 0 1 -4,-1.9 4,-2.7 -5,-0.2 -1,-0.2 0.942 103.5 52.9 -65.5 -37.0 16.4 38.6 153.7 100 124 A D H X S+ 0 0 44 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.865 106.2 58.2 -67.2 -34.8 15.7 35.5 151.7 101 125 A E H X S+ 0 0 91 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.984 112.3 33.9 -60.0 -57.3 18.9 36.0 149.8 102 126 A K H X S+ 0 0 31 -4,-1.6 4,-2.6 1,-0.2 35,-0.2 0.856 115.7 59.8 -71.3 -22.1 21.3 35.9 152.6 103 127 A Y H X S+ 0 0 8 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.958 103.6 50.9 -66.8 -53.3 19.1 33.3 154.5 104 128 A Q H X S+ 0 0 81 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.823 112.4 46.8 -52.6 -38.5 19.4 30.8 151.7 105 129 A R H X S+ 0 0 102 -4,-1.3 4,-2.2 -5,-0.2 -1,-0.2 0.959 113.5 45.6 -73.9 -42.5 23.1 31.2 151.7 106 130 A Y H X S+ 0 0 0 -4,-2.6 4,-1.8 27,-0.2 -2,-0.2 0.845 111.7 52.2 -75.0 -28.2 23.6 30.9 155.4 107 131 A Q H X S+ 0 0 54 -4,-3.1 4,-3.0 -5,-0.2 -1,-0.2 0.942 111.8 47.1 -63.2 -49.8 21.2 27.9 155.8 108 132 A A H X S+ 0 0 34 -4,-1.5 4,-2.9 -5,-0.3 5,-0.2 0.963 111.3 52.4 -58.3 -53.6 23.2 26.0 153.0 109 133 A A H X S+ 0 0 3 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.917 111.3 46.2 -46.4 -46.4 26.5 26.9 154.7 110 134 A L H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.975 111.0 50.9 -69.6 -45.2 25.3 25.5 157.9 111 135 A A H X S+ 0 0 26 -4,-3.0 4,-1.2 1,-0.2 -2,-0.2 0.908 111.8 50.0 -56.5 -41.9 23.9 22.3 156.4 112 136 A E H X S+ 0 0 84 -4,-2.9 4,-2.7 1,-0.2 3,-0.3 0.928 104.6 55.0 -65.5 -49.0 27.2 21.8 154.7 113 137 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 5,-0.3 0.881 103.4 58.1 -53.1 -30.2 29.3 22.3 157.8 114 138 A I H X S+ 0 0 12 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.936 107.5 46.9 -68.3 -36.6 27.2 19.5 159.3 115 139 A Q H X S+ 0 0 111 -4,-1.2 4,-2.0 -3,-0.3 6,-0.2 0.922 107.7 56.0 -73.2 -35.8 28.3 17.2 156.5 116 140 A F H <>S+ 0 0 49 -4,-2.7 5,-2.8 1,-0.2 4,-0.5 0.947 112.8 41.1 -53.8 -44.9 31.9 18.2 156.8 117 141 A L H ><5S+ 0 0 0 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.906 109.2 56.5 -79.9 -28.8 32.0 17.3 160.4 118 142 A D H 3<5S+ 0 0 31 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.859 110.7 47.9 -65.7 -31.5 30.0 14.2 160.0 119 143 A N T 3<5S- 0 0 132 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.501 114.3-120.8 -83.0 4.4 32.8 13.2 157.5 120 144 A G T < 5 + 0 0 38 -3,-0.9 2,-1.3 -4,-0.5 -3,-0.2 0.706 64.7 144.3 72.6 10.3 35.4 14.1 160.0 121 145 A N >< + 0 0 77 -5,-2.8 4,-1.4 -6,-0.2 3,-0.3 -0.633 18.6 170.7 -94.6 96.7 36.9 16.7 157.6 122 146 A M H > S+ 0 0 34 -2,-1.3 4,-2.2 1,-0.2 5,-0.2 0.816 72.3 61.5 -77.4 -34.7 38.0 19.5 159.8 123 147 A D H > S+ 0 0 132 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.909 106.2 45.7 -61.8 -36.1 39.9 21.4 157.0 124 148 A A H > S+ 0 0 25 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.892 107.9 58.9 -72.8 -34.8 36.7 21.9 155.0 125 149 A Y H < S+ 0 0 18 -4,-1.4 5,-0.2 1,-0.2 -1,-0.2 0.898 116.1 35.3 -52.8 -61.9 34.9 23.0 158.2 126 150 A F H < S+ 0 0 119 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.764 110.9 61.4 -66.9 -27.4 37.5 25.8 158.6 127 151 A A H < S+ 0 0 75 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.858 82.6 95.0 -64.8 -41.8 37.9 26.5 154.8 128 152 A Q S < S- 0 0 19 -4,-2.2 2,-2.1 1,-0.2 3,-0.3 -0.295 82.7-129.4 -56.0 133.9 34.2 27.4 154.5 129 153 A P > + 0 0 94 0, 0.0 4,-1.3 0, 0.0 3,-0.2 -0.331 49.9 155.9 -77.7 58.4 33.8 31.3 154.8 130 154 A T H > + 0 0 9 -2,-2.1 4,-2.5 -5,-0.2 5,-0.2 0.930 59.2 54.8 -60.4 -35.9 31.1 30.8 157.5 131 155 A Q H > S+ 0 0 81 -3,-0.3 4,-3.1 1,-0.2 5,-0.2 0.904 102.8 55.6 -71.5 -38.5 31.3 34.1 159.3 132 156 A G H > S+ 0 0 50 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.950 112.0 45.5 -59.2 -38.2 30.9 36.4 156.2 133 157 A M H X S+ 0 0 38 -4,-1.3 4,-1.5 2,-0.2 -27,-0.2 0.866 111.5 51.2 -75.0 -30.3 27.6 34.6 155.4 134 158 A Q H X S+ 0 0 31 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.968 112.8 46.6 -65.7 -47.8 26.4 34.7 159.0 135 159 A N H X S+ 0 0 69 -4,-3.1 4,-2.6 1,-0.3 -2,-0.2 0.889 106.1 57.1 -64.0 -38.5 27.1 38.5 159.2 136 160 A A H X S+ 0 0 24 -4,-2.6 4,-2.3 2,-0.3 -1,-0.3 0.883 109.2 45.7 -56.2 -47.7 25.4 39.2 155.9 137 161 A L H X S+ 0 0 2 -4,-1.5 4,-2.8 1,-0.2 5,-0.3 0.930 110.4 56.6 -68.9 -36.1 22.2 37.6 157.2 138 162 A G H X S+ 0 0 18 -4,-2.6 4,-2.0 1,-0.2 -2,-0.3 0.884 108.8 44.9 -55.3 -47.4 22.7 39.6 160.4 139 163 A E H X S+ 0 0 130 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.876 112.1 52.0 -67.0 -31.0 22.8 42.8 158.6 140 164 A A H X S+ 0 0 1 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.921 111.5 47.6 -71.7 -39.0 19.8 41.9 156.4 141 165 A L H X S+ 0 0 28 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.856 111.6 48.6 -73.9 -28.9 17.8 41.0 159.5 142 166 A G H X S+ 0 0 44 -4,-2.0 4,-2.0 -5,-0.3 -1,-0.2 0.894 110.6 53.3 -77.9 -28.3 18.8 44.3 161.2 143 167 A N H X S+ 0 0 46 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.965 110.1 46.5 -69.6 -43.8 17.8 46.0 157.9 144 168 A Y H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.913 110.3 54.6 -55.5 -51.1 14.3 44.3 158.1 145 169 A A H X S+ 0 0 34 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.913 108.2 48.6 -50.3 -57.6 14.0 45.3 161.8 146 170 A R H X S+ 0 0 154 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.866 112.0 47.4 -53.2 -42.4 14.6 48.9 161.0 147 171 A V H X S+ 0 0 31 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.907 112.5 49.0 -73.7 -43.7 12.0 49.0 158.2 148 172 A S H X S+ 0 0 4 -4,-2.8 4,-3.1 1,-0.2 -2,-0.2 0.884 108.9 55.6 -55.8 -38.5 9.4 47.2 160.4 149 173 A E H X S+ 0 0 85 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.899 108.0 46.9 -64.9 -46.8 10.2 49.8 163.2 150 174 A N H X S+ 0 0 70 -4,-1.9 4,-1.0 2,-0.2 -1,-0.2 0.887 113.6 48.3 -60.0 -37.4 9.4 52.7 160.9 151 175 A L H >< S+ 0 0 22 -4,-1.7 3,-0.8 1,-0.2 4,-0.3 0.973 112.2 50.4 -72.7 -39.6 6.1 51.1 159.6 152 176 A Y H >< S+ 0 0 99 -4,-3.1 3,-2.0 1,-0.2 4,-0.3 0.930 105.5 55.5 -62.5 -44.3 5.2 50.4 163.2 153 177 A R H >< S+ 0 0 128 -4,-2.3 3,-0.6 1,-0.3 -1,-0.2 0.781 99.5 60.8 -56.8 -27.9 5.8 54.0 164.3 154 178 A Q T << S+ 0 0 146 -4,-1.0 -1,-0.3 -3,-0.8 -2,-0.2 0.598 87.5 77.9 -79.9 -7.9 3.4 55.4 161.7 155 179 A T T < S+ 0 0 10 -3,-2.0 2,-0.3 -4,-0.3 -140,-0.2 0.680 98.2 32.4 -81.3 -14.0 0.4 53.4 163.2 156 180 A F S < S- 0 0 31 -3,-0.6 -150,-0.2 -4,-0.3 -151,-0.1 -0.927 109.6 -51.1-133.5 163.5 -0.2 55.8 166.2 157 181 A D - 0 0 34 -152,-2.5 -2,-0.1 -2,-0.3 -1,-0.1 0.029 41.2-138.7 -29.3 119.3 0.1 59.5 166.8 158 182 A Q S S+ 0 0 161 1,-0.2 2,-0.8 -4,-0.1 -1,-0.2 0.480 85.4 83.8 -66.7 9.6 3.4 61.0 165.9 159 183 A S 0 0 75 -155,-0.2 -1,-0.2 -154,-0.1 -155,-0.1 -0.599 360.0 360.0-130.1 85.4 3.5 63.1 169.0 160 184 A A 0 0 100 -2,-0.8 -2,-0.1 -159,-0.1 -155,-0.1 -0.349 360.0 360.0 61.3 360.0 4.8 61.0 171.8