==== 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 27-NOV-06 2O0M . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR, SORC FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR R.ZHANG,M.ZHOU,M.BARGASSA,A.JOACHIMIAK,MIDWEST CENTER FOR ST . 247 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11651.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 12.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 5.7 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 13 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 32.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.6 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 2 3 1 1 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 1 1 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 PARALLEL BRIDGES PER LADDER . 1 1 2 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 1 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 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 95 A H > 0 0 172 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -54.0 9.2 45.7 5.6 2 96 A Q H > + 0 0 99 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.928 360.0 45.3 -54.5 -50.5 12.8 44.7 4.5 3 97 A I H > S+ 0 0 38 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.875 111.7 53.3 -64.8 -37.1 13.1 42.2 7.4 4 98 A E H > S+ 0 0 33 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.906 109.1 49.1 -63.1 -43.2 9.6 40.9 6.6 5 99 A K H X S+ 0 0 99 -4,-2.7 4,-2.3 2,-0.2 5,-0.2 0.924 110.2 50.4 -59.9 -47.0 10.6 40.3 3.0 6 100 A E H X S+ 0 0 76 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.897 111.6 49.3 -61.5 -39.2 13.8 38.5 4.1 7 101 A X H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 5,-0.2 0.933 110.1 48.7 -66.9 -45.6 11.7 36.3 6.4 8 102 A T H X>S+ 0 0 26 -4,-2.5 5,-1.7 1,-0.2 4,-1.5 0.904 115.4 45.5 -62.0 -39.9 9.1 35.3 3.8 9 103 A Q H <5S+ 0 0 132 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.854 106.7 58.9 -71.8 -35.1 11.8 34.5 1.3 10 104 A Y H <5S+ 0 0 116 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.906 120.6 27.4 -58.9 -41.7 13.9 32.5 3.8 11 105 A F H <5S- 0 0 17 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.596 102.9-124.3 -97.9 -14.0 11.0 30.1 4.4 12 106 A G T <5 + 0 0 41 -4,-1.5 -3,-0.2 -5,-0.2 2,-0.1 0.836 63.2 139.8 69.7 36.2 9.2 30.4 1.0 13 107 A I < - 0 0 16 -5,-1.7 219,-0.2 -6,-0.2 -1,-0.2 -0.464 62.8-107.4-108.7 177.3 5.9 31.4 2.6 14 108 A Q S S- 0 0 110 219,-1.0 2,-0.3 217,-0.9 220,-0.2 0.906 88.7 -8.5 -70.7 -47.4 3.1 34.0 1.8 15 109 A R E -a 234 0A 81 218,-1.1 220,-2.4 -7,-0.1 2,-0.4 -0.994 48.6-163.0-159.1 139.9 3.6 36.6 4.4 16 110 A C E -a 235 0A 0 -2,-0.3 2,-0.5 218,-0.2 220,-0.2 -1.000 9.3-160.8-128.3 130.3 5.6 37.3 7.5 17 111 A I E -a 236 0A 24 218,-2.7 220,-2.8 -2,-0.4 2,-0.6 -0.970 8.0-160.8-108.0 122.3 4.6 40.1 9.9 18 112 A V E -a 237 0A 18 -2,-0.5 220,-0.3 218,-0.2 2,-0.3 -0.914 7.2-153.3-109.4 110.8 7.5 41.2 12.2 19 113 A V E -a 238 0A 14 218,-3.0 220,-1.9 -2,-0.6 10,-0.0 -0.606 28.7 -99.1 -83.7 142.5 6.4 43.1 15.3 20 114 A A S S+ 0 0 69 -2,-0.3 2,-0.2 218,-0.2 -1,-0.1 -0.333 82.0 10.9 -60.8 135.4 8.7 45.6 16.9 21 115 A G S S- 0 0 12 1,-0.1 219,-1.8 -3,-0.0 218,-0.6 -0.508 89.6 -60.3 105.4-162.8 10.6 44.3 19.9 22 116 A D >> - 0 0 30 217,-0.2 4,-2.2 -2,-0.2 3,-1.3 -0.939 25.2-161.8-136.3 104.6 11.4 41.0 21.8 23 117 A S T 34 S+ 0 0 21 -2,-0.4 7,-0.1 1,-0.3 -1,-0.1 0.622 89.4 69.8 -64.8 -15.4 8.5 39.0 23.3 24 118 A D T 34 S+ 0 0 66 1,-0.1 -1,-0.3 5,-0.0 3,-0.1 0.883 119.9 15.2 -63.1 -39.3 11.1 37.2 25.5 25 119 A I T <4 S+ 0 0 134 -3,-1.3 2,-0.5 1,-0.2 -2,-0.2 0.553 120.1 65.7-115.8 -11.5 11.5 40.4 27.5 26 120 A Q >< - 0 0 86 -4,-2.2 3,-1.2 1,-0.1 4,-0.5 -0.924 54.5-165.8-123.1 109.8 8.6 42.6 26.6 27 121 A K T >> S+ 0 0 188 -2,-0.5 4,-1.1 1,-0.3 3,-1.0 0.799 85.0 68.2 -62.6 -30.3 5.0 41.6 27.5 28 122 A K H 3> S+ 0 0 139 1,-0.2 4,-3.0 2,-0.2 -1,-0.3 0.804 86.3 70.0 -62.0 -27.1 3.4 44.1 25.2 29 123 A V H <> S+ 0 0 1 -3,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.886 97.8 49.6 -59.5 -38.5 4.7 42.2 22.1 30 124 A L H <> S+ 0 0 27 -3,-1.0 4,-1.3 -4,-0.5 -1,-0.2 0.886 110.6 49.6 -67.9 -38.5 2.2 39.3 22.9 31 125 A S H X S+ 0 0 36 -4,-1.1 4,-1.7 1,-0.2 3,-0.4 0.918 109.5 52.6 -61.2 -44.9 -0.6 41.9 23.2 32 126 A D H X S+ 0 0 28 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.857 101.5 59.5 -58.2 -37.5 0.6 43.3 19.9 33 127 A F H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.869 103.0 54.1 -58.6 -36.5 0.4 39.8 18.4 34 128 A G H X S+ 0 0 0 -4,-1.3 4,-2.4 -3,-0.4 34,-0.4 0.926 108.9 46.7 -60.4 -48.5 -3.3 39.9 19.4 35 129 A D H X S+ 0 0 87 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.928 114.2 48.1 -57.3 -46.1 -3.8 43.1 17.4 36 130 A V H X S+ 0 0 27 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.915 111.5 48.8 -67.4 -43.1 -1.9 41.7 14.4 37 131 A L H X S+ 0 0 0 -4,-2.8 4,-3.1 2,-0.2 5,-0.3 0.925 110.5 52.3 -62.4 -41.6 -3.9 38.5 14.4 38 132 A T H X S+ 0 0 13 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.958 113.0 43.4 -57.3 -50.1 -7.1 40.4 14.6 39 133 A N H X S+ 0 0 108 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.900 114.7 51.2 -62.9 -38.2 -6.2 42.6 11.6 40 134 A T H X S+ 0 0 6 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.936 113.3 42.5 -66.7 -49.9 -4.9 39.5 9.8 41 135 A L H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 -1,-0.2 0.836 110.1 58.2 -67.2 -31.6 -8.1 37.5 10.3 42 136 A N H < S+ 0 0 88 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.920 113.8 39.1 -62.5 -41.5 -10.3 40.5 9.5 43 137 A L H < S+ 0 0 126 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.903 123.8 39.1 -68.9 -45.6 -8.6 40.7 6.1 44 138 A L H < S+ 0 0 22 -4,-2.5 -3,-0.2 -5,-0.1 -2,-0.2 0.885 93.8 83.8 -79.2 -43.7 -8.4 37.0 5.5 45 139 A L < - 0 0 5 -4,-2.5 3,-0.1 -5,-0.2 5,-0.1 -0.483 68.7-146.4 -74.6 120.7 -11.7 35.6 6.8 46 140 A P - 0 0 57 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.264 27.9 -84.0 -74.6 169.1 -14.6 35.9 4.3 47 141 A N S S+ 0 0 99 28,-0.1 2,-0.3 2,-0.1 28,-0.3 -0.274 93.3 51.0 -62.2 161.2 -18.3 36.4 4.9 48 142 A G E S-b 75 0A 29 26,-3.1 28,-3.0 -3,-0.1 2,-0.7 -0.779 107.2 -25.3 105.1-154.5 -20.3 33.3 5.8 49 143 A E E -b 76 0A 141 -2,-0.3 2,-0.4 26,-0.2 28,-0.2 -0.879 61.8-174.4-105.2 111.6 -19.6 30.7 8.3 50 144 A N E -b 77 0A 5 26,-2.3 28,-2.6 -2,-0.7 2,-0.5 -0.834 12.9-156.5-104.6 143.2 -15.9 30.2 9.3 51 145 A T E -b 78 0A 20 -2,-0.4 92,-1.6 90,-0.2 93,-1.5 -0.988 9.1-166.0-118.9 119.4 -14.4 27.6 11.5 52 146 A I E -bc 79 144A 0 26,-3.2 28,-2.4 -2,-0.5 2,-0.5 -0.934 4.9-157.3-109.7 113.9 -11.1 28.5 13.1 53 147 A A E -bc 80 145A 0 91,-2.8 93,-2.1 -2,-0.6 2,-0.3 -0.794 18.9-170.2 -94.1 128.7 -9.2 25.6 14.7 54 148 A V E -bc 81 146A 0 26,-2.7 28,-2.8 -2,-0.5 29,-0.5 -0.891 19.8-144.2-126.6 147.5 -6.7 26.7 17.3 55 149 A X - 0 0 10 91,-1.8 38,-0.1 -2,-0.3 2,-0.0 -0.643 22.6-135.6 -94.0 165.2 -3.9 25.4 19.5 56 150 A G + 0 0 14 -2,-0.2 92,-0.4 4,-0.1 4,-0.4 0.068 42.0 115.0 -98.9-150.2 -3.2 26.4 23.0 57 151 A G S > S- 0 0 5 35,-2.8 4,-2.2 32,-0.2 5,-0.2 -0.309 78.5 -64.6 102.4 171.9 -0.0 27.4 24.9 58 152 A T H > S+ 0 0 72 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.919 130.2 48.4 -63.8 -45.7 1.3 30.5 26.6 59 153 A T H > S+ 0 0 17 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.948 114.1 46.1 -58.0 -50.8 1.6 32.5 23.4 60 154 A X H > S+ 0 0 0 -4,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.851 108.5 56.0 -65.2 -34.7 -1.9 31.6 22.2 61 155 A A H X S+ 0 0 17 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.940 112.5 42.7 -61.2 -45.1 -3.4 32.3 25.6 62 156 A X H X S+ 0 0 77 -4,-2.0 4,-0.9 2,-0.2 -2,-0.2 0.892 113.2 51.7 -70.4 -40.7 -2.0 35.9 25.5 63 157 A V H >< S+ 0 0 0 -4,-2.6 3,-1.0 -5,-0.2 -2,-0.2 0.944 109.7 50.5 -55.7 -50.0 -2.9 36.4 21.9 64 158 A A H >< S+ 0 0 0 -4,-2.8 3,-1.5 1,-0.3 -2,-0.2 0.908 106.1 54.5 -58.2 -43.5 -6.5 35.3 22.6 65 159 A E H 3< S+ 0 0 94 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.732 110.4 49.1 -62.4 -21.8 -6.9 37.7 25.5 66 160 A N T << S+ 0 0 47 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.057 83.4 122.4-112.6 25.3 -5.8 40.6 23.2 67 161 A X < - 0 0 14 -3,-1.5 2,-0.2 33,-0.1 -32,-0.1 -0.511 45.2-148.1 -86.2 156.5 -8.1 40.0 20.2 68 162 A G - 0 0 27 -34,-0.4 -1,-0.1 -2,-0.2 2,-0.1 -0.510 40.7 -53.3-112.1-176.0 -10.6 42.6 18.8 69 163 A S + 0 0 89 -2,-0.2 37,-0.2 1,-0.1 36,-0.2 -0.294 50.2 154.7 -67.3 135.8 -13.9 42.2 17.1 70 164 A L + 0 0 2 35,-2.8 36,-0.2 7,-0.1 2,-0.2 0.492 44.2 101.4-125.9 -19.3 -14.3 40.0 14.0 71 165 A E + 0 0 41 34,-2.3 2,-0.3 5,-0.1 5,-0.2 -0.468 43.7 164.0 -76.5 139.1 -18.0 39.1 14.1 72 166 A T - 0 0 66 3,-2.4 -2,-0.0 -2,-0.2 -1,-0.0 -0.843 54.7 -89.8-138.2 178.8 -20.4 40.9 11.7 73 167 A E S S+ 0 0 182 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.887 129.5 29.1 -54.3 -41.2 -23.9 40.5 10.4 74 168 A K S S+ 0 0 142 1,-0.1 -26,-3.1 -27,-0.0 2,-0.6 0.591 113.5 66.1-100.9 -16.8 -22.5 38.6 7.4 75 169 A R E -b 48 0A 13 -28,-0.3 -3,-2.4 -5,-0.1 2,-0.6 -0.944 57.4-179.2-115.2 116.4 -19.4 37.0 9.0 76 170 A H E -b 49 0A 65 -28,-3.0 -26,-2.3 -2,-0.6 2,-0.4 -0.951 9.0-162.3-118.7 115.4 -19.9 34.4 11.7 77 171 A N E -b 50 0A 3 -2,-0.6 31,-2.3 -28,-0.2 2,-0.5 -0.830 5.5-167.0-104.6 131.3 -16.8 32.8 13.2 78 172 A L E -bd 51 108A 33 -28,-2.6 -26,-3.2 -2,-0.4 2,-0.4 -0.965 9.6-153.4-113.8 128.8 -16.7 29.6 15.3 79 173 A F E +bd 52 109A 0 29,-2.8 31,-2.1 -2,-0.5 -26,-0.2 -0.868 20.1 166.5-105.6 132.1 -13.5 28.7 17.3 80 174 A V E -b 53 0A 0 -28,-2.4 -26,-2.7 -2,-0.4 2,-0.1 -0.963 41.4 -97.4-136.8 153.6 -12.7 25.1 18.1 81 175 A P E -b 54 0A 1 0, 0.0 -26,-0.2 0, 0.0 3,-0.1 -0.505 23.0-144.3 -67.9 144.8 -9.5 23.4 19.4 82 176 A A S S+ 0 0 0 -28,-2.8 116,-2.9 1,-0.2 2,-0.3 0.752 81.7 19.3 -78.7 -27.3 -7.4 21.8 16.6 83 177 A R B -G 197 0B 2 -29,-0.5 2,-0.2 114,-0.2 114,-0.2 -0.998 62.2-153.6-142.4 147.9 -6.4 18.9 18.9 84 178 A G S S+ 0 0 4 112,-2.6 112,-0.4 -2,-0.3 32,-0.1 -0.693 76.1 39.4-106.6 167.3 -7.6 17.1 22.0 85 179 A G + 0 0 17 29,-0.4 31,-0.2 30,-0.3 -1,-0.2 0.852 67.8 137.2 68.5 36.0 -5.4 15.1 24.4 86 180 A I - 0 0 12 -3,-0.2 31,-0.1 31,-0.1 30,-0.1 0.751 61.6-126.4 -89.1 -26.5 -2.5 17.5 24.3 87 181 A G + 0 0 7 29,-0.4 30,-0.1 1,-0.2 2,-0.1 0.573 55.6 142.1 94.2 11.8 -1.7 17.5 28.1 88 182 A E - 0 0 9 1,-0.1 -1,-0.2 28,-0.1 28,-0.1 -0.409 54.4-103.1 -79.4 161.7 -1.8 21.2 28.8 89 183 A A >> - 0 0 61 -2,-0.1 3,-1.7 1,-0.1 4,-0.8 -0.416 39.5-101.7 -74.6 157.8 -3.1 22.9 32.0 90 184 A V G >4 S+ 0 0 106 1,-0.3 3,-0.6 2,-0.2 6,-0.2 0.825 116.7 63.6 -53.4 -36.7 -6.6 24.6 31.8 91 185 A S G 34 S+ 0 0 92 1,-0.2 -1,-0.3 5,-0.1 -3,-0.0 0.763 119.9 22.4 -62.7 -25.6 -5.1 28.1 31.6 92 186 A V G <4 S+ 0 0 17 -3,-1.7 -35,-2.8 -36,-0.1 -1,-0.2 0.243 89.7 125.9-127.5 12.2 -3.5 27.4 28.3 93 187 A Q S XX S- 0 0 26 -4,-0.8 4,-2.0 -3,-0.6 3,-0.6 -0.398 71.1-113.4 -73.0 153.4 -5.4 24.4 26.8 94 188 A A H 3> S+ 0 0 5 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.856 115.7 58.1 -56.8 -38.7 -6.8 24.8 23.3 95 189 A N H 3> S+ 0 0 25 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.912 107.8 48.1 -54.4 -45.4 -10.5 24.7 24.6 96 190 A S H <> S+ 0 0 38 -3,-0.6 4,-2.3 2,-0.2 -2,-0.2 0.918 110.3 49.6 -65.2 -43.9 -9.7 27.7 26.8 97 191 A I H X S+ 0 0 3 -4,-2.0 4,-3.0 1,-0.2 5,-0.3 0.922 109.8 53.4 -61.0 -42.1 -8.0 29.7 24.0 98 192 A S H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.916 109.8 47.2 -59.1 -43.2 -11.1 28.9 21.8 99 193 A A H X S+ 0 0 27 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.913 114.1 46.3 -67.9 -43.0 -13.5 30.3 24.4 100 194 A V H X S+ 0 0 35 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.934 112.5 49.8 -65.3 -46.9 -11.5 33.4 25.0 101 195 A X H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 6,-0.4 0.922 110.5 51.0 -58.0 -43.3 -11.1 34.1 21.3 102 196 A A H X>S+ 0 0 2 -4,-2.4 5,-1.4 -5,-0.3 4,-1.1 0.946 113.1 45.7 -59.6 -47.7 -14.8 33.6 20.8 103 197 A N H ><5S+ 0 0 119 -4,-2.4 3,-0.7 1,-0.2 -2,-0.2 0.945 115.1 44.8 -59.2 -51.4 -15.5 36.1 23.5 104 198 A K H 3<5S+ 0 0 83 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.786 118.6 42.4 -69.4 -29.1 -13.0 38.8 22.5 105 199 A T H 3<5S- 0 0 1 -4,-2.1 -35,-2.8 -5,-0.3 -34,-2.3 0.514 110.5-113.4 -93.9 -8.6 -14.0 38.6 18.8 106 200 A G T <<5S+ 0 0 44 -4,-1.1 -3,-0.2 -3,-0.7 -4,-0.1 0.532 80.2 113.2 84.0 8.9 -17.8 38.4 19.2 107 201 A G < - 0 0 13 -5,-1.4 2,-0.3 -6,-0.4 -29,-0.2 0.063 62.5-103.7 -94.1-155.6 -17.9 34.9 17.8 108 202 A N E -d 78 0A 103 -31,-2.3 -29,-2.8 -3,-0.1 2,-0.3 -0.835 22.5-153.0-131.1 165.5 -18.7 31.5 19.2 109 203 A Y E -d 79 0A 109 -2,-0.3 2,-0.4 -31,-0.2 -29,-0.2 -0.950 9.6-156.1-137.6 158.8 -16.9 28.4 20.3 110 204 A R - 0 0 90 -31,-2.1 2,-0.2 -2,-0.3 -12,-0.0 -0.947 20.8-145.9-133.0 116.3 -17.3 24.7 20.6 111 205 A A - 0 0 11 -2,-0.4 2,-0.7 -31,-0.1 24,-0.1 -0.483 12.6-130.6 -76.7 148.3 -15.2 22.9 23.1 112 206 A L - 0 0 3 -2,-0.2 2,-2.3 2,-0.1 -17,-0.1 -0.921 19.4-143.9 -98.7 113.4 -14.0 19.4 22.5 113 207 A Y + 0 0 167 -2,-0.7 19,-0.1 13,-0.1 -29,-0.0 -0.377 57.0 123.0 -88.0 64.0 -14.8 17.6 25.7 114 208 A V - 0 0 9 -2,-2.3 -29,-0.4 82,-0.0 -2,-0.1 -0.987 67.1-113.8-119.0 124.4 -11.8 15.3 25.7 115 209 A P - 0 0 63 0, 0.0 -30,-0.3 0, 0.0 3,-0.1 -0.295 19.3-124.7 -57.3 149.2 -9.6 15.5 28.8 116 210 A E S S+ 0 0 18 1,-0.2 2,-0.4 -31,-0.2 -29,-0.4 0.790 107.6 33.2 -67.4 -28.8 -6.1 16.8 28.1 117 211 A Q S S+ 0 0 102 -31,-0.1 2,-0.3 -30,-0.1 -1,-0.2 -1.000 89.6 160.4-121.3 128.8 -4.8 13.6 29.7 118 212 A L - 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0 0 118 -3,-1.2 12,-0.5 1,-0.2 -3,-0.2 0.885 34.9-166.1 54.2 46.4 17.1 15.6 19.0 174 268 A A < + 0 0 11 -5,-2.4 -21,-0.3 1,-0.2 10,-0.3 -0.439 18.5 168.4 -63.8 134.0 13.6 17.1 18.9 175 269 A V + 0 0 41 8,-3.2 -23,-2.0 1,-0.3 2,-0.3 0.728 56.4 30.9-116.5 -46.0 13.7 20.9 18.4 176 270 A A E -HI 151 183C 0 7,-2.2 7,-3.0 -25,-0.2 2,-0.4 -0.858 56.2-161.1-121.7 154.1 10.2 22.1 17.6 177 271 A E E +HI 150 182C 6 -27,-2.0 -27,-2.5 -2,-0.3 2,-0.3 -0.980 16.1 159.9-126.6 145.8 6.6 21.0 18.4 178 272 A S E > S- I 0 181C 1 3,-2.3 3,-1.9 -2,-0.4 -29,-0.1 -0.841 70.5 -7.3-161.9 134.3 3.4 21.9 16.7 179 273 A F T 3 S- 0 0 1 1,-0.3 3,-0.1 -2,-0.3 21,-0.1 0.674 128.8 -54.5 59.5 20.9 -0.1 20.2 16.8 180 274 A G T 3 S+ 0 0 0 1,-0.4 13,-2.4 12,-0.1 2,-0.4 0.667 113.7 117.6 83.4 15.9 1.4 17.3 18.8 181 275 A Y E < -IJ 178 192C 17 -3,-1.9 -3,-2.3 11,-0.2 2,-0.4 -0.927 53.6-147.1-108.9 143.2 4.2 16.6 16.2 182 276 A F E -IJ 177 191C 0 9,-3.0 8,-2.4 -2,-0.4 9,-1.1 -0.937 13.4-162.7-114.4 135.5 7.8 16.9 17.1 183 277 A F E -IJ 176 189C 0 -7,-3.0 -8,-3.2 -2,-0.4 -7,-2.2 -0.922 9.8-143.8-121.9 136.8 10.4 18.1 14.6 184 278 A D > - 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0 0 14 -116,-2.9 2,-0.4 -2,-0.4 -2,-0.1 -0.090 60.0-142.1 -58.3 135.7 -6.3 17.8 12.9 199 293 A Q >> - 0 0 56 1,-0.1 3,-1.2 -4,-0.1 4,-0.6 -0.816 14.5-134.0 -89.6 135.9 -3.9 15.8 10.7 200 294 A L G >4 S+ 0 0 31 -2,-0.4 3,-1.7 1,-0.3 4,-0.5 0.904 105.8 58.9 -52.2 -44.6 -0.7 17.6 9.8 201 295 A K G >4 S+ 0 0 141 1,-0.3 3,-0.7 2,-0.2 -1,-0.3 0.779 100.0 57.5 -57.9 -29.1 -1.1 16.5 6.1 202 296 A N G X4 S+ 0 0 67 -3,-1.2 3,-1.0 1,-0.2 4,-0.4 0.597 83.3 80.4 -83.8 -10.3 -4.5 18.3 5.9 203 297 A L G X< S+ 0 0 0 -3,-1.7 3,-1.8 -4,-0.6 -1,-0.2 0.860 81.3 69.7 -57.9 -34.7 -3.1 21.7 6.8 204 298 A Q G < S+ 0 0 88 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.783 99.6 46.6 -55.0 -32.2 -2.0 22.0 3.2 205 299 A E G < S+ 0 0 160 -3,-1.0 -1,-0.3 -4,-0.2 -2,-0.2 0.493 87.0 100.7 -92.2 -3.6 -5.6 22.4 2.0 206 300 A I < - 0 0 13 -3,-1.8 -63,-0.1 -4,-0.4 26,-0.1 -0.721 64.0-149.4 -86.8 124.1 -6.7 24.9 4.6 207 301 A P S S+ 0 0 62 0, 0.0 2,-0.7 0, 0.0 -63,-0.2 0.875 81.9 46.5 -61.7 -38.7 -6.7 28.4 3.1 208 302 A Y E +e 144 0A 57 -65,-1.6 -63,-2.4 2,-0.0 2,-0.5 -0.889 65.1 164.2-118.5 103.3 -5.9 30.5 6.1 209 303 A V E -e 145 0A 0 -2,-0.7 25,-2.5 23,-0.4 2,-0.5 -0.985 10.0-176.7-124.4 121.3 -3.0 29.2 8.2 210 304 A V E -ef 146 234A 0 -65,-2.7 -63,-2.1 -2,-0.5 2,-0.4 -0.978 8.5-167.3-128.5 119.3 -1.4 31.5 10.8 211 305 A A E -ef 147 235A 0 23,-2.6 25,-3.2 -2,-0.5 2,-0.5 -0.874 6.5-166.8 -99.8 134.7 1.6 30.6 12.9 212 306 A I E + f 0 236A 0 -65,-2.8 -63,-0.4 -2,-0.4 2,-0.3 -0.959 26.0 138.5-126.8 114.2 2.4 33.0 15.8 213 307 A A + 0 0 0 23,-2.4 25,-0.3 -2,-0.5 2,-0.3 -0.942 17.0 165.9-160.9 130.7 5.8 32.6 17.5 214 308 A G + 0 0 5 -2,-0.3 -192,-0.1 23,-0.2 -65,-0.1 -0.834 24.3 78.3-140.8 175.5 8.3 35.1 18.8 215 309 A G S > S- 0 0 0 -2,-0.3 3,-1.6 -194,-0.2 4,-0.3 0.255 73.5-100.4 97.7 140.0 11.4 35.6 20.9 216 310 A K G > S+ 0 0 102 1,-0.3 3,-1.6 2,-0.2 4,-0.4 0.857 121.1 67.4 -54.1 -32.2 15.1 34.9 20.2 217 311 A T G 3 S+ 0 0 71 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.717 100.1 48.4 -64.3 -20.8 14.5 31.8 22.3 218 312 A K G <> S+ 0 0 30 -3,-1.6 4,-3.1 1,-0.1 -1,-0.3 0.405 78.5 101.6-100.2 1.4 12.2 30.4 19.6 219 313 A A H <> S+ 0 0 3 -3,-1.6 4,-2.3 -4,-0.3 5,-0.2 0.897 85.5 45.1 -54.5 -46.0 14.4 31.0 16.6 220 314 A K H > S+ 0 0 126 -4,-0.4 4,-2.1 -3,-0.2 -1,-0.2 0.928 115.0 47.0 -65.5 -44.1 15.6 27.3 16.4 221 315 A A H > S+ 0 0 3 -4,-0.3 4,-2.4 2,-0.2 5,-0.3 0.905 111.6 51.6 -64.5 -43.3 12.0 25.9 16.9 222 316 A I H X S+ 0 0 0 -4,-3.1 4,-2.8 1,-0.2 5,-0.2 0.947 110.5 48.6 -58.3 -49.0 10.6 28.3 14.3 223 317 A R H X S+ 0 0 86 -4,-2.3 4,-1.0 -5,-0.3 -1,-0.2 0.906 112.5 48.6 -56.8 -43.1 13.2 27.3 11.7 224 318 A A H < S+ 0 0 2 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.903 118.2 37.5 -70.7 -42.4 12.6 23.5 12.3 225 319 A Y H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.2 4,-0.3 0.917 111.5 57.8 -73.1 -44.6 8.8 23.7 12.1 226 320 A X H >< S+ 0 0 0 -4,-2.8 3,-0.9 -5,-0.3 -1,-0.2 0.718 86.1 81.1 -66.4 -18.0 8.6 26.2 9.3 227 321 A K T 3< S+ 0 0 97 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.1 0.862 109.9 21.8 -51.1 -44.1 10.7 24.0 6.9 228 322 A N T < S+ 0 0 62 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.159 93.4 129.1-113.1 13.7 7.7 21.9 6.0 229 323 A A S < S- 0 0 4 -3,-0.9 -3,-0.0 -4,-0.3 -25,-0.0 -0.339 75.0 -83.9 -64.2 152.2 4.9 24.4 6.9 230 324 A P > - 0 0 1 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.318 37.4-124.7 -58.6 141.5 2.2 25.0 4.2 231 325 A K T 3 S+ 0 0 112 1,-0.3 -217,-0.9 -218,-0.1 -2,-0.1 0.734 108.6 62.6 -66.2 -20.3 3.5 27.6 1.8 232 326 A Q T 3 S+ 0 0 45 -219,-0.2 -23,-0.4 -28,-0.1 -1,-0.3 0.499 78.4 128.9 -79.0 -3.3 0.3 29.7 2.4 233 327 A T < - 0 0 0 -3,-2.1 -218,-1.1 -25,-0.1 -219,-1.0 -0.201 50.9-148.2 -55.7 136.1 1.3 30.1 6.0 234 328 A W E -af 15 210A 20 -25,-2.5 -23,-2.6 -220,-0.2 2,-0.6 -0.954 13.8-152.4 -98.8 128.0 1.4 33.7 7.5 235 329 A L E -af 16 211A 0 -220,-2.4 -218,-2.7 -2,-0.5 2,-0.6 -0.919 7.8-165.9-105.6 117.2 4.1 33.9 10.2 236 330 A I E +af 17 212A 0 -25,-3.2 -23,-2.4 -2,-0.6 2,-0.2 -0.914 33.1 138.2 -97.6 121.5 3.5 36.5 12.9 237 331 A T E -a 18 0A 0 -220,-2.8 -218,-3.0 -2,-0.6 2,-0.3 -0.751 42.7-105.5-147.3-171.4 6.7 37.0 14.8 238 332 A D E > -a 19 0A 0 -25,-0.3 4,-2.4 -220,-0.3 -218,-0.2 -0.768 31.4-102.8-126.5 172.3 8.9 39.6 16.3 239 333 A E H > S+ 0 0 84 -220,-1.9 4,-3.1 -218,-0.6 5,-0.3 0.856 117.0 58.3 -59.8 -38.4 12.2 41.4 15.7 240 334 A A H > S+ 0 0 16 -219,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.931 111.4 40.4 -63.2 -42.8 14.1 39.3 18.2 241 335 A A H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.945 117.6 48.2 -68.1 -47.5 13.2 36.0 16.5 242 336 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.920 109.4 51.2 -61.0 -49.7 13.7 37.4 13.0 243 337 A N H < S+ 0 0 95 -4,-3.1 4,-0.4 1,-0.2 -1,-0.2 0.898 113.4 46.9 -55.7 -40.0 17.1 39.0 13.7 244 338 A E H >< S+ 0 0 40 -4,-1.4 3,-0.9 -5,-0.3 -2,-0.2 0.933 113.1 47.0 -68.8 -46.0 18.3 35.7 15.2 245 339 A I H 3< S+ 0 0 10 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.882 116.7 44.6 -61.0 -39.4 17.0 33.6 12.3 246 340 A L T 3< 0 0 43 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.339 360.0 360.0 -92.4 4.4 18.5 35.9 9.6 247 341 A K < 0 0 185 -3,-0.9 -3,-0.0 -4,-0.4 -4,-0.0 -0.258 360.0 360.0 -70.3 360.0 21.9 36.5 11.2