==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 13-MAR-03 1ORJ . COMPND 2 MOLECULE: FLAGELLAR PROTEIN FLIS; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR A.G.EVDOKIMOV,J.PHAN,J.E.TROPEA,K.M.ROUTZAHN,H.K.PETERS III, . 460 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24751.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 388 84.3 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 . 11 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 317 68.9 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 2 2 0 4 4 2 0 0 2 0 0 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 1002 A R 0 0 137 0, 0.0 4,-0.1 0, 0.0 286,-0.0 0.000 360.0 360.0 360.0 138.6 -11.7 -1.8 -16.7 2 1003 A N > - 0 0 84 1,-0.1 3,-1.4 2,-0.1 4,-0.2 0.557 360.0-161.5 -5.5 102.5 -14.2 -2.8 -14.0 3 1004 A I G > S+ 0 0 21 1,-0.3 3,-2.2 112,-0.2 4,-0.3 0.803 82.3 78.1 -71.8 -19.2 -14.3 0.1 -11.6 4 1005 A A G >> S+ 0 0 12 1,-0.3 4,-3.1 2,-0.2 3,-1.2 0.765 77.1 72.2 -56.7 -24.7 -15.8 -2.2 -9.0 5 1006 A E G <4 S+ 0 0 17 -3,-1.4 -1,-0.3 1,-0.2 73,-0.2 0.715 82.1 73.7 -67.4 -15.2 -12.3 -3.7 -8.4 6 1007 A A G <4 S+ 0 0 0 -3,-2.2 64,-3.1 -4,-0.2 -1,-0.2 0.845 120.5 7.3 -60.6 -40.7 -11.5 -0.4 -6.6 7 1008 A Y T <4 S+ 0 0 1 -3,-1.2 2,-0.2 -4,-0.3 -2,-0.2 0.670 124.1 53.8-110.2 -32.7 -13.6 -1.4 -3.6 8 1009 A F S < S- 0 0 27 -4,-3.1 2,-0.3 66,-0.1 -1,-0.1 -0.677 72.7-108.3-122.0 162.5 -14.6 -5.0 -4.1 9 1010 A Q > - 0 0 99 -2,-0.2 3,-1.3 389,-0.1 -3,-0.1 -0.634 40.3-106.7 -89.7 148.4 -13.4 -8.5 -4.8 10 1011 A N T 3 S+ 0 0 117 -2,-0.3 2,-0.9 1,-0.2 -1,-0.1 0.855 105.3 39.0 -35.6 -79.2 -13.9 -10.3 -8.1 11 1012 A M T 3 S+ 0 0 166 2,-0.0 2,-0.2 -3,-0.0 -1,-0.2 0.066 80.1 133.2 -85.0 34.2 -16.6 -12.9 -7.7 12 1013 A V < + 0 0 32 -3,-1.3 383,-0.0 -2,-0.9 -4,-0.0 -0.547 25.0 172.4 -82.6 139.0 -19.0 -11.1 -5.3 13 1014 A E + 0 0 104 -2,-0.2 2,-0.5 381,-0.1 -1,-0.1 0.407 47.3 109.8-119.6 -5.5 -22.7 -11.2 -6.0 14 1015 A T - 0 0 22 1,-0.1 4,-0.4 380,-0.1 -2,-0.1 -0.621 49.0-169.7 -73.5 119.3 -23.8 -9.5 -2.8 15 1016 A A > + 0 0 17 -2,-0.5 4,-1.9 1,-0.2 5,-0.2 0.495 58.7 91.9 -98.0 -4.9 -25.1 -6.1 -3.8 16 1017 A T H > S+ 0 0 26 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.917 90.5 44.1 -60.1 -46.4 -25.5 -4.2 -0.5 17 1018 A P H > S+ 0 0 5 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.883 112.0 53.7 -66.8 -35.3 -22.0 -2.7 -0.3 18 1019 A L H > S+ 0 0 13 -4,-0.4 4,-1.8 1,-0.2 -2,-0.2 0.868 107.0 52.3 -64.3 -35.6 -22.1 -1.7 -4.0 19 1020 A E H X S+ 0 0 77 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.807 104.9 55.9 -69.5 -31.8 -25.4 0.1 -3.3 20 1021 A Q H X S+ 0 0 15 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.913 104.8 52.4 -67.6 -40.5 -23.8 2.0 -0.4 21 1022 A I H X S+ 0 0 1 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.965 110.5 47.3 -57.5 -49.1 -21.1 3.3 -2.8 22 1023 A I H X S+ 0 0 10 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.867 110.0 54.2 -61.7 -34.5 -23.7 4.6 -5.2 23 1024 A L H X S+ 0 0 78 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.903 106.8 50.4 -63.3 -43.3 -25.6 6.2 -2.3 24 1025 A L H X S+ 0 0 1 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.945 111.5 48.4 -63.4 -45.6 -22.5 8.0 -1.2 25 1026 A Y H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.926 109.5 53.6 -56.6 -49.2 -22.0 9.3 -4.8 26 1027 A D H X S+ 0 0 54 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.917 110.8 45.6 -48.7 -51.2 -25.7 10.3 -4.9 27 1028 A K H X S+ 0 0 54 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.864 112.3 50.2 -68.5 -37.3 -25.3 12.4 -1.7 28 1029 A A H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.852 110.3 50.4 -67.4 -36.8 -22.1 14.0 -2.8 29 1030 A I H X S+ 0 0 2 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.956 110.2 48.2 -71.0 -46.8 -23.4 15.1 -6.1 30 1031 A E H X S+ 0 0 117 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.802 113.3 47.9 -58.7 -35.6 -26.6 16.6 -4.7 31 1032 A C H X S+ 0 0 1 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.841 111.8 50.3 -77.3 -29.7 -24.6 18.6 -2.1 32 1033 A L H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.862 108.8 52.2 -70.8 -39.7 -22.2 19.8 -4.8 33 1034 A E H X S+ 0 0 71 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.879 108.9 50.3 -62.4 -45.5 -25.0 20.9 -7.0 34 1035 A R H X S+ 0 0 68 -4,-1.6 4,-1.9 1,-0.2 -2,-0.2 0.961 110.4 49.0 -57.3 -51.6 -26.5 22.9 -4.2 35 1036 A A H < S+ 0 0 0 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.868 112.7 48.0 -61.0 -34.1 -23.2 24.6 -3.4 36 1037 A I H >< S+ 0 0 15 -4,-1.8 3,-1.7 1,-0.2 4,-0.4 0.962 107.4 56.9 -69.6 -42.2 -22.8 25.4 -7.1 37 1038 A E H 3< S+ 0 0 130 -4,-2.7 -2,-0.2 1,-0.3 3,-0.2 0.801 118.1 32.2 -54.6 -36.4 -26.3 26.7 -7.2 38 1039 A I T >< S+ 0 0 3 -4,-1.9 3,-1.1 1,-0.1 -1,-0.3 0.186 83.8 110.0-112.1 17.9 -25.6 29.2 -4.5 39 1040 A Y G X S+ 0 0 60 -3,-1.7 3,-1.0 -4,-0.3 -1,-0.1 0.890 78.3 53.2 -56.2 -41.4 -21.9 30.0 -5.1 40 1041 A D G 3 S+ 0 0 118 -4,-0.4 -1,-0.2 1,-0.3 3,-0.2 0.582 103.3 56.7 -76.7 -9.9 -22.6 33.5 -6.3 41 1042 A Q G X + 0 0 68 -3,-1.1 3,-0.8 1,-0.2 7,-0.3 0.077 63.6 118.4-109.1 23.3 -24.6 34.5 -3.2 42 1043 A V T < + 0 0 45 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.417 63.0 72.8 -80.3 7.3 -22.0 33.9 -0.5 43 1044 A N T 3 S+ 0 0 153 -3,-0.2 2,-0.6 1,-0.1 -1,-0.3 0.934 80.5 84.7 -73.3 -46.7 -22.0 37.5 0.5 44 1045 A E S <> S- 0 0 106 -3,-0.8 4,-2.8 1,-0.2 3,-0.3 -0.374 84.5-145.3 -41.9 93.9 -25.4 36.6 1.9 45 1046 A L H > S+ 0 0 91 -2,-0.6 4,-1.4 1,-0.2 -1,-0.2 0.719 96.2 53.2 -53.1 -21.4 -24.2 35.3 5.3 46 1047 A E H > S+ 0 0 155 2,-0.2 4,-2.2 1,-0.1 -1,-0.2 0.971 112.0 42.1 -75.8 -51.5 -27.0 32.7 5.2 47 1048 A K H > S+ 0 0 55 -3,-0.3 4,-1.8 -6,-0.3 -2,-0.2 0.862 111.8 57.4 -60.0 -36.3 -26.1 31.3 1.8 48 1049 A R H X S+ 0 0 103 -4,-2.8 4,-2.5 -7,-0.3 -1,-0.2 0.949 107.1 47.7 -58.2 -45.8 -22.5 31.4 2.7 49 1050 A K H X S+ 0 0 118 -4,-1.4 4,-1.8 1,-0.3 -2,-0.2 0.911 112.4 48.1 -66.0 -41.4 -23.1 29.2 5.7 50 1051 A E H X S+ 0 0 60 -4,-2.2 4,-1.7 1,-0.2 -1,-0.3 0.788 110.9 53.6 -65.9 -26.7 -25.1 26.8 3.6 51 1052 A F H X S+ 0 0 21 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.926 108.5 47.3 -72.9 -45.0 -22.3 26.8 1.0 52 1053 A V H X S+ 0 0 76 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.833 112.5 51.2 -63.4 -35.3 -19.7 26.0 3.6 53 1054 A E H X S+ 0 0 91 -4,-1.8 4,-1.5 -5,-0.2 -1,-0.2 0.871 109.7 48.3 -72.0 -40.0 -21.8 23.2 4.9 54 1055 A N H X S+ 0 0 9 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.877 111.5 50.1 -70.0 -35.8 -22.5 21.6 1.5 55 1056 A I H X S+ 0 0 15 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.850 107.6 54.3 -69.7 -34.8 -18.8 21.7 0.7 56 1057 A D H X S+ 0 0 84 -4,-1.5 4,-2.6 2,-0.2 -1,-0.2 0.880 108.8 50.0 -58.3 -41.2 -18.0 20.1 4.0 57 1058 A R H X S+ 0 0 77 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.886 110.5 47.4 -71.5 -39.6 -20.4 17.3 3.1 58 1059 A V H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.924 114.4 48.7 -64.6 -43.2 -18.8 16.7 -0.3 59 1060 A Y H X S+ 0 0 91 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.872 112.5 47.1 -64.1 -44.0 -15.4 16.7 1.3 60 1061 A D H X S+ 0 0 21 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.883 114.5 46.3 -66.4 -41.9 -16.4 14.2 4.0 61 1062 A I H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.923 115.2 44.8 -70.8 -39.0 -18.1 11.8 1.6 62 1063 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.835 111.3 54.5 -72.2 -30.8 -15.3 11.9 -1.0 63 1064 A S H X S+ 0 0 23 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.910 111.9 44.7 -64.2 -41.6 -12.7 11.5 1.8 64 1065 A A H X S+ 0 0 4 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.950 111.7 52.4 -63.3 -53.7 -14.6 8.4 3.0 65 1066 A L H < S+ 0 0 0 -4,-3.0 4,-0.3 1,-0.3 -2,-0.2 0.892 112.0 47.5 -51.1 -42.4 -14.9 7.2 -0.6 66 1067 A K H >< S+ 0 0 47 -4,-2.6 3,-1.0 1,-0.2 -1,-0.3 0.884 112.9 45.0 -71.3 -34.5 -11.2 7.6 -1.0 67 1068 A S H 3< S+ 0 0 29 -4,-1.7 342,-0.2 1,-0.3 -2,-0.2 0.792 103.7 63.4 -88.6 -15.4 -10.2 5.9 2.2 68 1069 A F T 3< S+ 0 0 2 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.505 81.7 122.1 -68.6 -11.2 -12.6 3.0 1.7 69 1070 A L < - 0 0 5 -3,-1.0 2,-1.6 -4,-0.3 -62,-0.2 -0.267 69.7-126.7 -63.4 138.6 -10.5 2.2 -1.4 70 1071 A D > + 0 0 15 -64,-3.1 4,-1.3 1,-0.2 8,-0.2 -0.610 39.6 164.2 -85.6 84.9 -8.9 -1.2 -1.7 71 1072 A H T 4 S+ 0 0 97 -2,-1.6 4,-0.3 334,-0.2 -1,-0.2 0.857 70.7 52.9 -67.9 -37.5 -5.3 -0.2 -2.3 72 1073 A E T 4 S+ 0 0 162 -3,-0.2 -1,-0.2 1,-0.2 3,-0.1 0.919 129.4 13.9 -68.6 -44.3 -3.8 -3.6 -1.6 73 1074 A K T 4 S+ 0 0 117 1,-0.1 -1,-0.2 -67,-0.1 -2,-0.2 0.284 106.3 86.9-111.7 4.0 -6.0 -5.7 -3.9 74 1075 A G S >X S- 0 0 0 -4,-1.3 4,-1.7 1,-0.2 3,-0.5 0.451 73.3-158.8 -94.7 -0.4 -7.5 -3.0 -6.1 75 1076 A K H 3> - 0 0 118 -4,-0.3 4,-1.5 1,-0.2 3,-0.4 -0.107 58.2 -30.9 65.4-157.1 -4.7 -2.8 -8.6 76 1077 A E H 3> S+ 0 0 72 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.744 135.4 69.2 -66.3 -20.8 -4.1 0.3 -10.9 77 1078 A I H <> S+ 0 0 14 -3,-0.5 4,-1.8 2,-0.2 -2,-0.2 0.945 101.4 40.4 -70.0 -41.3 -7.9 0.7 -10.7 78 1079 A A H X S+ 0 0 0 -4,-1.7 4,-2.5 -3,-0.4 -1,-0.2 0.920 115.8 53.3 -67.7 -41.5 -7.9 1.7 -7.0 79 1080 A K H X S+ 0 0 81 -4,-1.5 4,-1.5 1,-0.2 -2,-0.2 0.919 109.9 46.6 -60.5 -43.7 -4.8 3.8 -7.5 80 1081 A N H X S+ 0 0 13 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.855 111.1 51.6 -66.7 -39.3 -6.4 5.7 -10.4 81 1082 A L H X S+ 0 0 12 -4,-1.8 4,-2.9 -5,-0.3 5,-0.2 0.918 108.2 53.0 -63.7 -38.6 -9.5 6.3 -8.5 82 1083 A D H X S+ 0 0 22 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.872 105.4 55.0 -62.5 -37.5 -7.4 7.6 -5.6 83 1084 A T H X S+ 0 0 11 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.926 111.1 43.3 -62.3 -48.0 -5.7 10.0 -8.0 84 1085 A I H X S+ 0 0 10 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.939 113.8 50.3 -65.4 -49.2 -9.0 11.5 -9.1 85 1086 A Y H X S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 5,-0.2 0.929 108.8 54.0 -53.7 -45.1 -10.4 11.7 -5.6 86 1087 A T H X S+ 0 0 39 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.912 108.2 48.4 -58.3 -41.1 -7.3 13.4 -4.4 87 1088 A I H X S+ 0 0 18 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.935 111.8 49.6 -65.1 -45.2 -7.6 16.1 -7.1 88 1089 A I H >X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.2 3,-0.6 0.959 111.8 48.6 -55.8 -50.5 -11.2 16.6 -6.1 89 1090 A L H 3X S+ 0 0 18 -4,-3.0 4,-1.6 1,-0.3 -1,-0.2 0.890 109.3 51.3 -58.3 -45.6 -10.3 16.9 -2.5 90 1091 A N H 3X S+ 0 0 97 -4,-2.5 4,-0.6 -5,-0.2 -1,-0.3 0.803 110.6 51.7 -62.7 -28.6 -7.5 19.4 -3.2 91 1092 A T H X< S+ 0 0 3 -4,-1.7 3,-0.7 -3,-0.6 -2,-0.2 0.894 106.7 51.1 -75.4 -45.2 -10.0 21.4 -5.2 92 1093 A L H 3< S+ 0 0 4 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.843 109.3 51.9 -61.4 -30.2 -12.6 21.6 -2.4 93 1094 A V H 3< S+ 0 0 90 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.700 81.7 111.7 -85.1 -15.4 -10.0 22.8 0.1 94 1095 A K X< - 0 0 61 -3,-0.7 3,-1.2 -4,-0.6 -3,-0.0 -0.342 60.9-148.9 -58.9 127.7 -8.8 25.7 -2.1 95 1096 A V T 3 S+ 0 0 149 1,-0.3 -1,-0.2 -2,-0.1 -4,-0.0 0.811 97.2 42.8 -71.9 -25.8 -9.8 29.0 -0.5 96 1097 A D T 3 S+ 0 0 117 2,-0.0 -1,-0.3 -3,-0.0 -2,-0.1 -0.059 81.4 154.9-108.8 37.6 -10.0 30.6 -3.9 97 1098 A K < - 0 0 29 -3,-1.2 2,-0.2 -5,-0.1 -5,-0.0 -0.351 35.1-133.7 -64.1 147.7 -11.8 27.8 -5.7 98 1099 A T > - 0 0 47 1,-0.1 4,-1.7 0, 0.0 5,-0.2 -0.605 16.5-119.2-100.8 163.5 -13.9 28.9 -8.7 99 1100 A K H > S+ 0 0 57 1,-0.2 4,-1.6 -2,-0.2 5,-0.1 0.815 114.3 59.0 -67.0 -32.2 -17.5 28.0 -9.7 100 1101 A E H > S+ 0 0 98 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.908 103.1 48.1 -62.0 -51.3 -16.0 26.6 -12.9 101 1102 A E H > S+ 0 0 32 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.912 112.3 50.1 -69.2 -31.1 -13.7 24.1 -11.1 102 1103 A L H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.863 107.8 54.0 -66.8 -34.5 -16.6 22.9 -8.9 103 1104 A Q H X S+ 0 0 92 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.901 109.5 48.1 -66.4 -39.7 -18.8 22.4 -12.0 104 1105 A K H X S+ 0 0 46 -4,-1.9 4,-2.4 2,-0.2 3,-0.2 0.923 108.2 52.7 -63.8 -51.1 -16.2 20.2 -13.6 105 1106 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.3 -1,-0.2 0.889 107.1 55.7 -52.7 -39.0 -15.7 18.1 -10.5 106 1107 A L H X S+ 0 0 14 -4,-1.9 4,-2.2 2,-0.2 -1,-0.3 0.887 104.5 50.6 -65.4 -38.5 -19.5 17.7 -10.6 107 1108 A E H X S+ 0 0 80 -4,-1.5 4,-2.5 -3,-0.2 -1,-0.2 0.942 111.1 50.8 -60.8 -43.9 -19.4 16.3 -14.1 108 1109 A I H X S+ 0 0 4 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.897 107.6 50.3 -61.1 -42.7 -16.7 13.9 -12.9 109 1110 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 -1,-0.2 0.941 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4087 D T H X S+ 0 0 42 -4,-3.3 4,-2.9 -5,-0.2 5,-0.3 0.955 107.3 49.4 -57.9 -51.1 -10.1 -11.7 9.9 425 4088 D I H X S+ 0 0 16 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.937 111.5 50.0 -54.4 -47.6 -10.9 -14.2 12.6 426 4089 D I H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.911 111.6 47.8 -59.0 -41.0 -14.6 -13.9 11.7 427 4090 D L H X S+ 0 0 12 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.879 108.5 53.7 -70.2 -38.0 -13.8 -14.5 8.0 428 4091 D N H X S+ 0 0 99 -4,-2.9 4,-1.0 -5,-0.2 -1,-0.2 0.891 109.6 50.3 -64.0 -31.9 -11.6 -17.5 8.7 429 4092 D T H >< S+ 0 0 3 -4,-1.9 3,-1.0 -5,-0.3 -2,-0.2 0.973 107.8 50.4 -68.3 -51.7 -14.5 -19.0 10.7 430 4093 D L H 3< S+ 0 0 7 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.782 107.7 56.6 -57.3 -27.7 -17.1 -18.5 8.0 431 4094 D V H 3< S+ 0 0 97 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.803 86.8 93.6 -79.5 -27.4 -14.8 -20.1 5.4 432 4095 D K << - 0 0 44 -4,-1.0 3,-0.5 -3,-1.0 -3,-0.0 -0.344 67.2-142.5 -75.5 145.6 -14.3 -23.5 7.2 433 4096 D V S S+ 0 0 143 1,-0.2 2,-1.6 -2,-0.1 -1,-0.1 0.932 97.9 59.3 -58.9 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