==== 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 TRANSCRIPTION 31-JUL-07 2QSR . COMPND 2 MOLECULE: TRANSCRIPTION-REPAIR COUPLING FACTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; . AUTHOR U.A.RAMAGOPAL,R.TORO,M.GILMORE,K.BAIN,M.IIZUKA,S.WASSERMAN,L . 161 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9795.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 126 78.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 13.0 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 . 2 1.2 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 . 14 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 41.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 1 0 0 0 1 0 0 0 1 0 0 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 2 0 1 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 1 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 1005 A S 0 0 159 0, 0.0 2,-0.9 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 172.4 50.5 52.2 67.2 2 1006 A L + 0 0 179 1,-0.1 2,-0.6 2,-0.1 0, 0.0 0.080 360.0 90.8 60.1 -26.7 51.9 49.1 65.6 3 1007 A R - 0 0 120 -2,-0.9 -1,-0.1 1,-0.1 3,-0.1 -0.877 59.5-172.2 -98.6 119.9 48.2 48.6 64.8 4 1008 A T - 0 0 114 -2,-0.6 2,-0.3 1,-0.2 -1,-0.1 0.839 65.8 -9.7 -78.5 -33.9 47.2 50.2 61.5 5 1009 A K - 0 0 51 74,-0.1 73,-0.2 1,-0.0 -1,-0.2 -0.969 64.0-116.5-159.0 163.8 43.4 49.7 61.9 6 1010 A G - 0 0 9 71,-2.9 2,-0.2 -2,-0.3 71,-0.1 0.003 26.0-117.8 -90.4-157.1 40.7 48.0 63.9 7 1011 A N - 0 0 118 74,-0.4 70,-0.1 69,-0.1 67,-0.1 -0.666 25.8-153.4-150.5 92.8 38.1 45.4 63.0 8 1012 A A - 0 0 3 65,-0.2 2,-0.7 -2,-0.2 75,-0.2 -0.329 11.7-132.7 -76.9 145.1 34.5 46.4 63.2 9 1013 A E E -a 83 0A 104 73,-1.2 75,-2.8 -2,-0.1 2,-0.7 -0.863 23.1-155.6 -96.6 118.2 31.7 43.9 63.8 10 1014 A L E +a 84 0A 48 -2,-0.7 2,-0.6 73,-0.2 75,-0.2 -0.838 24.6 167.6-106.7 110.3 28.9 44.4 61.3 11 1015 A I E +a 85 0A 51 73,-3.6 75,-3.4 -2,-0.7 -2,-0.0 -0.822 26.0 138.4-114.1 86.2 25.4 43.3 62.1 12 1016 A L - 0 0 10 -2,-0.6 -1,-0.1 73,-0.2 3,-0.1 0.574 53.7-137.8-109.8 -14.3 23.4 45.1 59.4 13 1017 A Q + 0 0 126 1,-0.3 2,-0.5 -3,-0.2 126,-0.1 0.835 55.7 139.9 50.2 33.0 20.9 42.6 58.2 14 1018 A I - 0 0 15 125,-0.1 2,-0.7 51,-0.0 -1,-0.3 -0.903 58.8-121.9 -91.1 137.0 21.5 43.6 54.6 15 1019 A D + 0 0 125 -2,-0.5 2,-0.4 -3,-0.1 50,-0.2 -0.730 46.8 160.0 -86.3 114.9 21.6 40.4 52.5 16 1020 A A + 0 0 30 -2,-0.7 2,-0.3 49,-0.1 47,-0.2 -0.991 9.5 106.7-143.3 127.9 24.9 40.2 50.8 17 1021 A Y - 0 0 119 45,-0.7 49,-0.2 -2,-0.4 50,-0.1 -0.975 65.4 -76.5-177.8-179.5 26.8 37.3 49.3 18 1022 A L - 0 0 2 -2,-0.3 2,-0.2 48,-0.1 -2,-0.0 -0.882 45.5-148.1-105.6 105.5 27.9 35.5 46.1 19 1023 A P >> - 0 0 9 0, 0.0 4,-2.5 0, 0.0 3,-1.9 -0.467 19.6-125.8 -75.6 141.9 25.0 33.6 44.4 20 1024 A D T 34 S+ 0 0 122 1,-0.3 5,-0.1 2,-0.2 9,-0.0 0.787 111.2 66.6 -51.0 -30.3 25.6 30.4 42.5 21 1025 A T T 34 S+ 0 0 144 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.793 111.7 31.7 -63.7 -29.3 23.8 32.2 39.6 22 1026 A Y T <4 S+ 0 0 28 -3,-1.9 2,-0.5 1,-0.3 -2,-0.2 0.847 135.0 20.4 -93.7 -47.6 26.7 34.7 39.4 23 1027 A I < + 0 0 1 -4,-2.5 -1,-0.3 1,-0.1 -2,-0.1 -0.960 60.2 169.1-128.5 114.3 29.7 32.5 40.4 24 1028 A S + 0 0 101 -2,-0.5 -1,-0.1 -3,-0.2 -3,-0.1 0.935 51.2 89.1 -86.0 -53.4 29.3 28.7 40.2 25 1029 A D > - 0 0 61 1,-0.1 4,-1.9 2,-0.1 3,-0.3 -0.192 68.4-142.7 -60.8 129.4 32.9 27.5 40.7 26 1030 A Q H > S+ 0 0 155 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.948 95.9 49.2 -54.0 -63.1 33.7 26.8 44.4 27 1031 A R H > S+ 0 0 156 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.771 109.1 55.9 -58.3 -27.1 37.4 28.0 44.4 28 1032 A H H > S+ 0 0 42 -3,-0.3 4,-3.2 2,-0.2 5,-0.4 0.998 107.2 47.0 -59.8 -68.4 36.4 31.2 42.7 29 1033 A K H X S+ 0 0 31 -4,-1.9 4,-3.9 1,-0.3 5,-0.3 0.902 113.7 49.8 -34.9 -62.3 33.8 32.1 45.3 30 1034 A I H X S+ 0 0 109 -4,-2.3 4,-2.7 1,-0.2 -1,-0.3 0.909 114.1 44.9 -43.7 -55.2 36.4 31.3 48.0 31 1035 A E H X S+ 0 0 74 -4,-2.5 4,-3.7 -5,-0.2 -2,-0.2 0.966 115.9 44.7 -57.4 -55.5 38.9 33.5 46.3 32 1036 A I H X S+ 0 0 1 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.867 111.6 54.4 -61.8 -37.5 36.6 36.4 45.6 33 1037 A Y H X S+ 0 0 84 -4,-3.9 4,-2.3 -5,-0.4 -1,-0.2 0.953 112.7 42.4 -57.9 -52.4 35.2 36.1 49.1 34 1038 A K H X S+ 0 0 135 -4,-2.7 4,-1.2 -5,-0.3 3,-0.2 0.982 111.3 56.5 -54.7 -57.2 38.8 36.4 50.5 35 1039 A K H < S+ 0 0 77 -4,-3.7 3,-0.3 1,-0.2 -2,-0.2 0.829 108.1 49.5 -38.8 -43.3 39.4 39.1 47.9 36 1040 A I H >< S+ 0 0 9 -4,-2.3 3,-2.0 1,-0.2 -1,-0.2 0.929 106.3 51.5 -69.6 -47.6 36.5 41.0 49.4 37 1041 A R H 3< S+ 0 0 224 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.646 103.7 66.3 -61.2 -11.6 37.6 40.7 53.0 38 1042 A Q T 3< + 0 0 103 -4,-1.2 2,-0.8 -3,-0.3 -1,-0.3 0.487 67.5 123.6 -87.3 -5.6 40.9 42.1 51.6 39 1043 A I < + 0 0 9 -3,-2.0 35,-0.2 1,-0.2 3,-0.1 -0.441 24.5 162.7 -66.6 104.0 39.4 45.5 50.7 40 1044 A D - 0 0 64 -2,-0.8 2,-0.2 1,-0.1 -1,-0.2 0.788 63.8 -8.2 -91.0 -33.1 41.6 48.0 52.5 41 1045 A N S > S- 0 0 49 1,-0.1 4,-1.2 34,-0.0 3,-0.3 -0.849 85.2 -75.1-149.7-172.3 40.6 51.1 50.6 42 1046 A R H > S+ 0 0 91 -2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.938 116.9 57.3 -58.8 -54.8 38.6 52.4 47.6 43 1047 A V H > S+ 0 0 75 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.844 105.8 53.5 -53.8 -36.2 40.9 51.5 44.7 44 1048 A N H >> S+ 0 0 45 -3,-0.3 4,-2.6 2,-0.2 3,-0.5 0.989 110.7 45.5 -52.5 -77.9 40.8 47.8 45.8 45 1049 A Y H 3X S+ 0 0 18 -4,-1.2 4,-2.2 1,-0.2 -2,-0.2 0.840 113.3 50.9 -18.5 -65.5 37.0 47.8 45.8 46 1050 A E H 3X S+ 0 0 82 -4,-2.9 4,-2.6 1,-0.3 -1,-0.2 0.920 112.0 45.7 -55.0 -48.4 37.0 49.6 42.4 47 1051 A E H S+ 0 0 43 -4,-2.2 4,-2.7 -5,-0.2 5,-0.5 0.976 110.5 52.5 -62.4 -56.8 34.4 45.5 40.5 50 1054 A E H X5S+ 0 0 85 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.887 113.3 47.6 -43.0 -44.8 36.4 45.9 37.3 51 1055 A E H X5S+ 0 0 51 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.928 111.7 46.2 -66.0 -49.7 37.5 42.3 37.9 52 1056 A L H X5S+ 0 0 1 -4,-2.6 4,-2.0 2,-0.2 5,-0.4 0.942 117.8 41.5 -64.5 -48.3 34.0 40.8 38.5 53 1057 A I H X5S+ 0 0 69 -4,-2.7 4,-2.2 3,-0.2 3,-0.3 0.946 112.2 59.3 -60.4 -45.9 32.3 42.5 35.6 54 1058 A D H <> - 0 0 56 0, 0.0 4,-2.0 0, 0.0 3,-1.6 -0.265 37.4 -96.0 -79.0 167.4 23.2 41.4 41.2 61 1065 A D H 3> S+ 0 0 114 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.821 120.3 59.5 -56.8 -38.6 22.3 43.6 44.1 62 1066 A V H 3> S+ 0 0 33 1,-0.2 4,-1.6 2,-0.2 -45,-0.7 0.828 109.5 45.7 -60.6 -30.0 23.4 41.1 46.8 63 1067 A V H <> S+ 0 0 0 -3,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.923 108.6 54.9 -76.9 -44.9 26.9 41.2 45.3 64 1068 A A H X S+ 0 0 26 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.920 111.4 46.4 -48.5 -47.9 26.9 44.9 45.1 65 1069 A Y H X S+ 0 0 47 -4,-3.0 4,-3.0 2,-0.2 5,-0.3 0.878 105.4 57.3 -66.1 -40.5 26.1 45.0 48.8 66 1070 A L H X S+ 0 0 25 -4,-1.6 4,-1.8 -49,-0.2 -1,-0.2 0.954 113.5 42.9 -54.0 -47.3 28.7 42.4 49.7 67 1071 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.928 112.7 51.2 -59.8 -51.1 31.2 44.8 48.0 68 1072 A E H X S+ 0 0 42 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.948 109.2 49.9 -58.1 -50.9 29.7 48.0 49.6 69 1073 A I H X S+ 0 0 31 -4,-3.0 4,-3.4 1,-0.2 -1,-0.2 0.895 109.6 53.5 -53.6 -43.5 29.8 46.5 53.0 70 1074 A G H X S+ 0 0 13 -4,-1.8 4,-2.1 -5,-0.3 -1,-0.2 0.951 112.6 42.2 -55.7 -53.2 33.4 45.6 52.4 71 1075 A L H >X S+ 0 0 0 -4,-2.6 4,-1.2 2,-0.2 3,-0.5 0.988 114.8 50.3 -56.1 -65.3 34.3 49.1 51.4 72 1076 A V H >X S+ 0 0 1 -4,-2.9 4,-1.8 1,-0.2 3,-1.4 0.907 108.2 54.6 -32.5 -60.3 32.3 50.7 54.2 73 1077 A K H 3X S+ 0 0 51 -4,-3.4 4,-3.0 1,-0.3 5,-0.3 0.882 96.9 62.9 -49.8 -48.3 34.0 48.4 56.7 74 1078 A S H S+ 0 0 1 -4,-1.8 5,-3.1 1,-0.3 -2,-0.2 0.829 111.1 55.1 -51.5 -30.8 34.9 51.9 60.1 77 1081 A D H ><5S+ 0 0 9 -4,-3.0 -71,-2.9 -5,-0.3 3,-1.7 0.930 104.2 50.6 -67.2 -45.8 38.0 49.9 60.7 78 1082 A K H 3<5S+ 0 0 46 -4,-1.6 -1,-0.2 -3,-0.4 -2,-0.2 0.759 111.9 47.8 -67.9 -24.9 40.5 52.8 60.3 79 1083 A V T 3<5S- 0 0 0 -4,-1.6 -1,-0.3 -74,-0.0 -2,-0.2 0.214 119.0-114.3 -97.7 11.0 38.5 54.9 62.7 80 1084 A F T < 5 + 0 0 16 -3,-1.7 16,-1.9 -5,-0.2 19,-0.3 0.850 47.4 175.2 60.5 41.6 38.4 52.0 65.1 81 1085 A V E < - B 0 95A 0 -5,-3.1 -74,-0.4 14,-0.2 14,-0.3 -0.525 14.1-166.9 -63.7 142.7 34.7 51.2 65.2 82 1086 A Q E + 0 0 100 12,-2.7 -73,-1.2 1,-0.3 2,-0.3 0.697 64.1 3.2-106.8 -29.4 34.2 48.1 67.3 83 1087 A R E -aB 9 94A 83 11,-2.3 11,-2.7 -75,-0.2 2,-0.5 -0.872 44.1-170.0-164.4 130.7 30.6 47.3 66.3 84 1088 A V E +aB 10 93A 1 -75,-2.8 -73,-3.6 -2,-0.3 2,-0.4 -0.982 24.4 173.8-113.4 122.1 27.7 48.4 64.1 85 1089 A E E -aB 11 92A 55 7,-1.0 7,-1.9 -2,-0.5 2,-0.5 -0.956 22.2-153.5-138.9 121.3 24.5 46.7 64.9 86 1090 A R E + B 0 91A 34 -75,-3.4 2,-0.3 -2,-0.4 5,-0.3 -0.780 23.6 166.2 -93.3 127.5 21.0 47.3 63.4 87 1091 A K - 0 0 125 3,-2.2 3,-0.1 -2,-0.5 -2,-0.1 -0.885 65.7 -19.7-149.9 105.7 18.3 46.3 65.8 88 1092 A D S S- 0 0 120 -2,-0.3 47,-0.1 1,-0.2 -1,-0.1 0.975 126.7 -44.8 58.5 65.1 14.6 47.4 65.3 89 1093 A N S S+ 0 0 61 45,-0.1 45,-2.5 1,-0.1 46,-0.5 0.702 120.2 108.8 57.2 22.8 15.1 50.3 62.9 90 1094 A K E - C 0 133A 84 43,-0.2 -3,-2.2 44,-0.2 2,-0.6 -0.920 50.3-168.3-135.0 101.1 17.9 51.5 65.1 91 1095 A I E -BC 86 132A 0 41,-2.0 41,-3.4 -2,-0.4 2,-0.5 -0.823 12.0-170.9 -90.2 129.0 21.5 51.2 63.9 92 1096 A T E -BC 85 131A 34 -7,-1.9 -7,-1.0 -2,-0.6 2,-0.3 -0.912 7.6-159.3-132.6 110.1 23.9 51.9 66.7 93 1097 A I E -BC 84 130A 0 37,-1.7 37,-2.2 -2,-0.5 2,-0.4 -0.660 8.9-173.4 -87.5 134.0 27.6 52.3 66.2 94 1098 A Q E -BC 83 129A 34 -11,-2.7 -12,-2.7 -2,-0.3 -11,-2.3 -0.993 7.0-153.6-131.7 144.7 30.1 51.8 69.1 95 1099 A F E -B 81 0A 5 33,-0.7 -14,-0.2 -2,-0.4 2,-0.2 -0.358 25.1 -91.5-106.3 176.7 33.8 52.4 69.1 96 1100 A E > - 0 0 35 -16,-1.9 3,-1.9 -2,-0.1 4,-0.4 -0.608 40.0-110.7 -87.5 154.8 36.9 51.2 70.9 97 1101 A K T > S+ 0 0 161 1,-0.3 3,-1.2 -2,-0.2 4,-0.1 0.757 115.2 70.6 -55.6 -23.8 38.0 53.0 74.1 98 1102 A V T >> S+ 0 0 70 1,-0.2 3,-3.4 2,-0.2 4,-0.7 0.847 78.6 74.0 -61.6 -35.5 41.0 54.2 72.0 99 1103 A T H <> S+ 0 0 0 -3,-1.9 4,-3.5 1,-0.3 3,-0.4 0.776 78.4 76.7 -53.5 -27.6 38.8 56.5 70.0 100 1104 A Q H <4 S+ 0 0 108 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.694 95.1 50.4 -56.7 -18.1 38.7 58.8 73.0 101 1105 A R H <4 S+ 0 0 221 -3,-3.4 -1,-0.3 -4,-0.1 -2,-0.2 0.842 118.0 36.5 -82.1 -38.7 42.2 59.8 72.0 102 1106 A L H < S+ 0 0 49 -4,-0.7 2,-0.3 -3,-0.4 -2,-0.2 0.818 116.0 45.8 -87.0 -34.1 41.3 60.5 68.4 103 1107 A F < - 0 0 5 -4,-3.5 2,-0.3 4,-0.0 -1,-0.1 -0.808 51.7-162.0-125.1 153.4 37.9 62.0 68.7 104 1108 A L >> - 0 0 102 -2,-0.3 4,-1.3 1,-0.1 3,-0.8 -0.757 46.9 -94.6-116.0 168.6 35.8 64.5 70.6 105 1109 A A H 3> S+ 0 0 49 -2,-0.3 4,-1.9 1,-0.2 3,-0.5 0.921 124.6 49.8 -50.4 -48.4 32.1 64.7 70.7 106 1110 A Q H 3> S+ 0 0 115 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.755 98.4 68.7 -70.5 -20.5 31.8 67.3 67.9 107 1111 A D H <> S+ 0 0 23 -3,-0.8 4,-1.7 2,-0.2 -1,-0.2 0.968 106.6 39.4 -56.4 -50.9 34.1 65.2 65.7 108 1112 A Y H X S+ 0 0 0 -4,-1.3 4,-2.6 -3,-0.5 5,-0.3 0.948 113.0 54.8 -60.5 -50.1 31.3 62.6 65.5 109 1113 A F H X S+ 0 0 129 -4,-1.9 4,-3.1 1,-0.3 -2,-0.2 0.900 106.4 52.5 -55.0 -45.7 28.5 65.2 65.2 110 1114 A K H < S+ 0 0 135 -4,-2.8 4,-0.3 2,-0.2 -1,-0.3 0.938 110.2 48.6 -48.8 -54.4 30.3 66.8 62.2 111 1115 A A H >< S+ 0 0 0 -4,-1.7 3,-1.0 1,-0.2 -2,-0.2 0.901 115.2 42.3 -61.0 -46.3 30.5 63.4 60.5 112 1116 A L H >< S+ 0 0 12 -4,-2.6 3,-2.8 1,-0.2 -1,-0.2 0.918 103.0 69.8 -61.0 -44.5 26.8 62.6 61.1 113 1117 A S T 3< S+ 0 0 76 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.578 100.4 49.5 -50.8 -10.1 25.8 66.2 60.2 114 1118 A V T < S+ 0 0 83 -3,-1.0 -1,-0.3 -4,-0.3 2,-0.2 0.350 94.9 78.8-122.1 0.4 26.8 65.3 56.7 115 1119 A T S < S- 0 0 13 -3,-2.8 30,-0.1 2,-0.2 31,-0.0 -0.630 80.5-121.9-100.8 169.7 24.9 62.1 56.0 116 1120 A N S S+ 0 0 133 -2,-0.2 2,-0.1 25,-0.2 -1,-0.1 0.643 85.0 95.5 -87.8 -15.0 21.3 61.8 55.2 117 1121 A L S S- 0 0 9 24,-0.1 2,-0.5 -5,-0.1 -2,-0.2 -0.441 79.2-123.9 -71.1 146.3 20.5 59.5 58.1 118 1122 A K E +D 133 0A 146 15,-0.6 15,-1.9 -2,-0.1 2,-0.3 -0.835 42.2 173.4 -95.7 133.4 19.3 61.3 61.2 119 1123 A A E -D 132 0A 42 -2,-0.5 2,-0.3 13,-0.2 13,-0.2 -0.792 22.8-167.3-137.0 171.8 21.4 60.5 64.2 120 1124 A G E -D 131 0A 32 11,-1.3 11,-2.3 -2,-0.3 2,-0.4 -0.962 22.8-122.2-155.6 161.9 22.2 61.2 67.8 121 1125 A I E -D 130 0A 64 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.945 29.5-177.1-115.6 137.6 24.9 60.5 70.3 122 1126 A A E -D 129 0A 44 7,-2.5 7,-2.8 -2,-0.4 2,-0.7 -0.921 25.7-123.1-133.8 152.8 24.2 58.7 73.5 123 1127 A E E +D 128 0A 98 -2,-0.3 2,-0.6 5,-0.2 5,-0.2 -0.875 29.8 175.4-101.9 111.0 26.2 57.7 76.6 124 1128 A N E > S-D 127 0A 79 3,-1.9 3,-1.0 -2,-0.7 -2,-0.0 -0.913 73.6 -18.7-119.3 108.7 26.3 54.0 77.3 125 1129 A K T 3 S- 0 0 199 -2,-0.6 -1,-0.2 1,-0.2 3,-0.1 0.966 126.4 -53.6 62.6 51.5 28.5 52.9 80.2 126 1130 A G T 3 S+ 0 0 73 1,-0.2 -1,-0.2 -3,-0.2 2,-0.2 0.196 120.0 100.6 74.0 -19.4 30.5 56.0 80.1 127 1131 A L E < S- D 0 124A 39 -3,-1.0 -3,-1.9 -2,-0.1 2,-0.4 -0.494 74.5-105.1 -95.6 168.0 31.3 55.7 76.4 128 1132 A X E - D 0 123A 46 -5,-0.2 -33,-0.7 -2,-0.2 2,-0.4 -0.788 32.8-177.0 -95.7 133.9 29.8 57.4 73.3 129 1133 A E E -CD 94 122A 26 -7,-2.8 -7,-2.5 -2,-0.4 2,-0.5 -0.952 18.3-140.9-124.6 144.4 27.5 55.6 70.9 130 1134 A L E -CD 93 121A 0 -37,-2.2 -37,-1.7 -2,-0.4 2,-0.5 -0.884 17.5-168.8 -98.7 135.2 25.9 56.8 67.6 131 1135 A V E -CD 92 120A 41 -11,-2.3 -11,-1.3 -2,-0.5 2,-0.4 -0.990 1.2-166.6-128.2 123.0 22.4 55.8 67.0 132 1136 A F E -CD 91 119A 0 -41,-3.4 -41,-2.0 -2,-0.5 2,-0.6 -0.884 19.4-135.4-101.1 134.8 20.7 56.2 63.6 133 1137 A D E +CD 90 118A 32 -15,-1.9 -15,-0.6 -2,-0.4 -43,-0.2 -0.831 25.3 179.9 -83.3 124.5 17.0 55.9 63.1 134 1138 A V > + 0 0 1 -45,-2.5 3,-1.5 -2,-0.6 -44,-0.2 0.071 23.3 141.6-119.0 24.3 16.7 53.8 59.9 135 1139 A Q T 3 S+ 0 0 97 -46,-0.5 3,-0.1 1,-0.2 -2,-0.0 -0.356 76.8 12.7 -58.6 145.2 12.9 53.6 59.5 136 1140 A N T 3 S+ 0 0 157 1,-0.2 2,-0.5 -2,-0.0 -1,-0.2 0.570 99.7 139.8 67.7 6.5 11.8 53.8 55.9 137 1141 A K < - 0 0 69 -3,-1.5 -1,-0.2 4,-0.0 2,-0.1 -0.743 47.1-142.6 -98.8 123.8 15.4 53.3 54.9 138 1142 A K >> - 0 0 129 -2,-0.5 4,-1.6 -3,-0.1 3,-1.1 -0.461 29.9-110.4 -74.2 149.3 16.5 51.1 52.0 139 1143 A D H >> S+ 0 0 47 1,-0.3 4,-2.9 2,-0.2 3,-0.7 0.915 118.4 54.6 -46.9 -50.3 19.7 49.1 52.4 140 1144 A Y H 3> S+ 0 0 126 1,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.815 105.9 53.4 -59.3 -29.8 21.6 51.3 49.9 141 1145 A E H <> S+ 0 0 51 -3,-1.1 4,-2.1 2,-0.2 -1,-0.3 0.834 110.8 46.3 -70.0 -34.9 20.6 54.4 51.9 142 1146 A I H < S+ 0 0 56 -4,-2.1 3,-2.8 1,-0.2 -2,-0.2 0.965 112.5 46.1 -51.0 -62.5 41.6 61.5 61.8 158 1162 A E H 3< S+ 0 0 121 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.862 98.9 76.3 -45.3 -40.6 44.0 62.1 59.0 159 1163 A S T 3< S+ 0 0 79 -4,-2.5 2,-0.4 -5,-0.3 -1,-0.3 0.558 90.6 60.7 -56.2 -12.2 43.5 65.8 59.8 160 1164 A K < 0 0 108 -3,-2.8 -58,-0.0 -4,-0.3 0, 0.0 -0.975 360.0 360.0-117.3 138.2 45.8 65.4 62.9 161 1165 A E 0 0 209 -2,-0.4 -3,-0.1 0, 0.0 -2,-0.0 -0.743 360.0 360.0-143.5 360.0 49.4 64.3 62.6