==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR 03-APR-09 3GYB . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATORS (LACI-FAMILY . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM GLUTAMICUM; . AUTHOR K.PALANI,S.K.BURLEY,S.SWAMINATHAN,NEW YORK SGX RESEARCH . 507 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19902.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 337 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 67 13.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 2.4 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 . 33 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 161 31.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.0 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 2 0 2 0 0 0 0 2 0 0 6 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 7 3 2 4 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 . 2 0 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 . 2 2 2 0 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 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 62 A R 0 0 188 0, 0.0 56,-0.0 0, 0.0 58,-0.0 0.000 360.0 360.0 360.0 162.0 13.3 42.2 64.2 2 63 A T - 0 0 43 55,-0.3 3,-0.1 2,-0.2 32,-0.1 0.547 360.0-132.1-106.2 -12.2 12.9 39.9 61.2 3 64 A Q + 0 0 92 1,-0.3 31,-2.6 30,-0.1 2,-0.4 0.696 64.0 136.8 65.4 18.5 11.1 37.0 63.0 4 65 A L E -a 34 0A 0 53,-0.3 55,-2.7 29,-0.2 56,-1.2 -0.807 39.3-166.9-101.9 137.0 13.7 34.8 61.2 5 66 A I E -ab 35 60A 0 29,-2.4 31,-1.8 -2,-0.4 2,-0.4 -0.992 12.8-146.5-123.5 122.2 15.5 32.0 62.9 6 67 A A E -ab 36 61A 0 54,-1.9 56,-3.1 -2,-0.5 2,-0.5 -0.738 9.9-159.9 -89.2 134.9 18.5 30.5 61.1 7 68 A V E -ab 37 62A 1 29,-2.9 31,-2.7 -2,-0.4 2,-0.5 -0.965 4.3-156.4-119.0 118.6 19.1 26.7 61.6 8 69 A L E +ab 38 63A 0 54,-2.8 56,-2.3 -2,-0.5 2,-0.3 -0.833 19.6 164.3-100.1 123.5 22.5 25.4 60.9 9 70 A I E - b 0 64A 1 29,-2.5 56,-0.2 -2,-0.5 31,-0.2 -0.845 34.1-131.7-127.3 166.4 23.0 21.7 60.0 10 71 A D S S+ 0 0 51 54,-0.5 30,-1.5 -2,-0.3 31,-0.4 0.944 79.0 4.3 -85.5 -51.2 26.0 19.9 58.5 11 72 A D > - 0 0 30 3,-0.2 3,-1.7 28,-0.1 -1,-0.3 -0.978 45.5-149.3-146.5 126.2 24.7 17.7 55.7 12 73 A Y T 3 S+ 0 0 14 -2,-0.4 -1,-0.1 1,-0.3 268,-0.1 0.726 98.9 69.8 -63.0 -20.3 21.3 17.2 54.0 13 74 A S T 3 S+ 0 0 43 1,-0.2 -1,-0.3 267,-0.1 137,-0.1 0.621 89.0 66.4 -73.1 -14.9 22.4 13.6 53.3 14 75 A N S X S- 0 0 21 -3,-1.7 3,-0.8 1,-0.1 -3,-0.2 -0.891 70.3-165.1-111.4 99.0 22.2 12.8 57.1 15 76 A P G > + 0 0 14 0, 0.0 3,-1.0 0, 0.0 4,-0.4 0.157 56.6 112.3 -70.3 18.6 18.5 13.0 58.1 16 77 A W G 3 S+ 0 0 29 1,-0.2 4,-0.3 2,-0.1 3,-0.2 0.825 77.4 51.8 -60.9 -30.5 19.1 13.0 61.8 17 78 A F G <> S+ 0 0 2 -3,-0.8 4,-2.7 1,-0.2 3,-0.3 0.579 82.5 92.2 -83.7 -13.8 17.9 16.7 61.9 18 79 A I H <> S+ 0 0 22 -3,-1.0 4,-1.9 1,-0.2 -1,-0.2 0.915 93.1 35.0 -52.7 -55.7 14.6 16.3 60.2 19 80 A D H > S+ 0 0 31 -4,-0.4 4,-1.8 -3,-0.2 -1,-0.2 0.696 114.2 60.9 -75.8 -13.4 12.3 15.7 63.2 20 81 A L H > S+ 0 0 2 -3,-0.3 4,-2.7 -4,-0.3 -2,-0.2 0.919 108.1 43.0 -73.6 -43.4 14.4 18.0 65.3 21 82 A I H X S+ 0 0 2 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.878 111.8 54.7 -68.9 -35.9 13.6 20.9 62.8 22 83 A Q H X S+ 0 0 72 -4,-1.9 4,-2.3 -5,-0.3 -1,-0.2 0.918 111.7 44.8 -62.1 -42.0 9.9 19.7 62.7 23 84 A S H X S+ 0 0 8 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.923 112.0 51.1 -67.6 -44.9 9.9 20.0 66.5 24 85 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 3,-0.4 0.931 112.4 48.9 -55.7 -45.7 11.7 23.4 66.5 25 86 A S H X S+ 0 0 2 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.894 103.5 58.2 -62.2 -43.8 9.1 24.5 64.0 26 87 A D H < S+ 0 0 95 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.816 115.6 37.5 -58.1 -31.2 6.1 23.3 66.0 27 88 A V H < S+ 0 0 20 -4,-1.4 4,-0.2 -3,-0.4 -2,-0.2 0.876 124.8 36.3 -87.6 -42.7 7.2 25.5 68.9 28 89 A L H ><>S+ 0 0 0 -4,-2.7 5,-1.6 -5,-0.2 3,-1.1 0.887 107.5 57.4 -82.5 -42.0 8.5 28.5 67.0 29 90 A T G ><5S+ 0 0 13 -4,-2.4 3,-2.1 1,-0.3 278,-0.3 0.843 97.7 60.7 -63.5 -34.7 6.2 29.0 63.9 30 91 A P G 3 5S+ 0 0 96 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.781 103.6 55.7 -63.1 -20.2 2.9 29.4 65.9 31 92 A K G < 5S- 0 0 130 -3,-1.1 -2,-0.2 -4,-0.2 -3,-0.1 0.335 129.8 -94.0 -92.1 5.3 4.6 32.4 67.5 32 93 A G T < 5S+ 0 0 30 -3,-2.1 -3,-0.2 1,-0.3 2,-0.2 0.410 81.2 133.2 100.3 -2.7 5.3 34.1 64.2 33 94 A Y < - 0 0 20 -5,-1.6 2,-0.4 -8,-0.1 -1,-0.3 -0.511 38.7-156.1 -83.8 152.6 8.8 32.9 63.5 34 95 A R E -a 4 0A 49 -31,-2.6 -29,-2.4 -2,-0.2 2,-0.3 -0.951 11.3-140.1-125.1 145.9 10.0 31.5 60.2 35 96 A L E -a 5 0A 3 270,-2.4 2,-0.4 -2,-0.4 266,-0.3 -0.846 16.3-177.5-113.9 146.2 12.9 29.2 59.7 36 97 A S E -a 6 0A 0 -31,-1.8 -29,-2.9 -2,-0.3 2,-0.4 -0.997 21.2-132.5-138.5 139.3 15.7 29.0 57.1 37 98 A V E -aC 7 299A 0 262,-2.7 262,-2.9 -2,-0.4 2,-0.4 -0.774 15.3-171.9-101.8 137.8 18.4 26.3 56.9 38 99 A I E -a 8 0A 2 -31,-2.7 -29,-2.5 -2,-0.4 2,-0.2 -0.984 12.9-164.6-121.1 129.7 22.2 26.8 56.4 39 100 A D - 0 0 3 -2,-0.4 -29,-0.2 258,-0.3 -28,-0.1 -0.493 26.1-122.9-107.7-178.2 24.3 23.8 55.9 40 101 A S S S+ 0 0 35 -30,-1.5 -29,-0.1 -31,-0.2 -30,-0.1 0.440 102.7 44.6-104.9 0.6 28.1 23.3 56.0 41 102 A L S S+ 0 0 92 -31,-0.4 -30,-0.1 6,-0.0 -1,-0.1 0.681 125.1 15.0-115.2 -25.0 28.7 21.9 52.5 42 103 A T S S+ 0 0 8 255,-0.1 255,-0.1 245,-0.0 249,-0.1 0.648 100.0 79.4-126.6 -21.9 26.7 24.1 50.1 43 104 A S S S+ 0 0 1 253,-0.1 254,-2.2 -4,-0.1 2,-0.3 0.737 107.5 11.5 -63.8 -23.1 25.5 27.4 51.7 44 105 A Q - 0 0 6 2,-0.2 252,-0.1 252,-0.2 247,-0.1 -0.956 69.8-118.6-149.1 167.0 28.9 29.0 51.3 45 106 A A S S+ 0 0 78 -2,-0.3 -1,-0.1 246,-0.3 251,-0.1 0.851 98.3 33.6 -76.3 -35.6 32.2 28.5 49.5 46 107 A G S S- 0 0 38 245,-0.1 -2,-0.2 2,-0.1 -3,-0.0 0.071 101.4 -84.9 -99.4-149.7 34.2 28.3 52.7 47 108 A T S S+ 0 0 139 1,-0.1 3,-0.1 2,-0.0 -7,-0.0 -0.324 88.0 105.9-119.3 49.5 33.6 27.0 56.2 48 109 A D >> + 0 0 55 1,-0.1 4,-1.2 2,-0.1 3,-0.8 -0.451 27.1 154.4-126.7 60.2 31.9 30.1 57.7 49 110 A P H 3> S+ 0 0 11 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.751 71.3 64.0 -58.6 -26.2 28.2 29.1 58.0 50 111 A I H 3> S+ 0 0 42 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.913 100.7 50.4 -66.0 -40.5 27.7 31.6 60.9 51 112 A T H <> S+ 0 0 58 -3,-0.8 4,-1.2 1,-0.2 -1,-0.2 0.869 109.6 52.4 -64.1 -34.5 28.5 34.5 58.6 52 113 A S H < S+ 0 0 1 -4,-1.2 4,-0.4 2,-0.2 3,-0.4 0.926 109.5 48.4 -66.2 -44.2 25.9 33.0 56.1 53 114 A A H >< S+ 0 0 0 -4,-2.4 3,-1.6 1,-0.2 4,-0.2 0.923 107.8 55.0 -61.4 -44.5 23.3 32.9 58.9 54 115 A L H >< S+ 0 0 68 -4,-2.6 3,-2.1 1,-0.3 -1,-0.2 0.790 92.3 73.0 -60.1 -28.8 24.0 36.5 59.9 55 116 A S T 3< S+ 0 0 29 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.733 94.6 51.9 -60.8 -22.7 23.4 37.7 56.4 56 117 A X T < S- 0 0 4 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.462 109.4-126.6 -92.3 -0.1 19.7 37.1 56.8 57 118 A R < - 0 0 181 -3,-2.1 -53,-0.3 -4,-0.2 -55,-0.3 0.975 36.7-163.7 53.1 60.6 19.7 39.2 60.0 58 119 A P - 0 0 8 0, 0.0 -53,-0.2 0, 0.0 -1,-0.1 -0.425 26.0-138.6 -75.3 150.6 18.1 36.5 62.1 59 120 A D S S+ 0 0 23 -55,-2.7 2,-0.3 1,-0.2 -54,-0.2 0.810 88.2 0.8 -74.8 -31.3 16.5 37.2 65.5 60 121 A G E -b 5 0A 0 -56,-1.2 -54,-1.9 10,-0.2 2,-0.4 -0.958 67.0-139.9-151.0 166.1 18.0 34.0 66.8 61 122 A I E -bd 6 72A 0 10,-2.0 12,-1.9 -2,-0.3 2,-0.6 -0.996 1.0-156.6-137.6 132.9 20.1 31.0 65.6 62 123 A I E -bd 7 73A 0 -56,-3.1 -54,-2.8 -2,-0.4 2,-0.8 -0.946 15.6-156.5-105.6 120.4 19.9 27.3 66.3 63 124 A I E +bd 8 74A 19 10,-2.9 12,-2.1 -2,-0.6 14,-0.3 -0.859 27.6 159.1-102.2 104.8 23.3 25.7 65.8 64 125 A A E +b 9 0A 3 -56,-2.3 -54,-0.5 -2,-0.8 2,-0.3 -0.154 46.0 103.2-114.1 35.0 22.9 22.0 65.0 65 126 A Q S S- 0 0 5 -56,-0.2 2,-1.0 -55,-0.1 12,-0.1 -0.780 80.7-107.6-113.8 159.1 26.3 21.7 63.4 66 127 A D 0 0 69 -2,-0.3 -2,-0.1 11,-0.0 -57,-0.0 -0.784 360.0 360.0 -90.0 102.8 29.6 20.2 64.8 67 128 A I 0 0 127 -2,-1.0 52,-0.1 -4,-0.1 11,-0.1 -0.789 360.0 360.0-131.4 360.0 31.8 23.2 65.5 68 ! 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 69 137 A L 0 0 131 0, 0.0 3,-0.1 0, 0.0 -15,-0.0 0.000 360.0 360.0 360.0 139.7 26.0 37.7 67.7 70 138 A P - 0 0 33 0, 0.0 -10,-0.2 0, 0.0 -11,-0.1 -0.158 360.0 -70.3 -64.1 166.0 22.2 37.2 68.0 71 139 A P - 0 0 50 0, 0.0 -10,-2.0 0, 0.0 2,-0.3 -0.317 64.4-177.6 -58.8 141.0 20.9 34.8 70.7 72 140 A F E -d 61 0A 58 -12,-0.2 2,-0.4 -3,-0.1 -10,-0.2 -0.969 23.0-158.2-143.1 159.0 21.7 31.2 69.9 73 141 A V E -d 62 0A 0 -12,-1.9 -10,-2.9 -2,-0.3 2,-0.6 -0.998 19.4-134.9-136.8 135.0 21.2 27.6 71.2 74 142 A I E -de 63 87A 31 12,-2.9 14,-2.4 -2,-0.4 2,-0.4 -0.825 29.9-168.2 -91.5 124.9 23.4 24.6 70.3 75 143 A A E + e 0 88A 0 -12,-2.1 14,-0.2 -2,-0.6 3,-0.1 -0.946 58.7 10.2-122.1 137.0 21.1 21.7 69.5 76 144 A G S S+ 0 0 11 12,-2.1 2,-0.2 -2,-0.4 14,-0.2 0.151 125.6 30.2 90.7 -21.3 21.8 18.0 69.1 77 145 A T - 0 0 17 11,-0.3 11,-0.3 -14,-0.3 2,-0.3 -0.824 60.0-177.9-150.5-171.7 25.4 18.3 70.3 78 146 A R - 0 0 30 -2,-0.2 2,-0.6 9,-0.1 6,-0.1 -0.936 44.0 -75.7 176.9 166.2 27.6 20.4 72.6 79 147 A I - 0 0 77 -2,-0.3 8,-0.0 4,-0.3 -2,-0.0 -0.716 38.8-138.9 -81.6 123.0 31.2 20.8 73.8 80 148 A T S S+ 0 0 79 -2,-0.6 -1,-0.2 1,-0.2 4,-0.0 0.828 100.2 38.1 -50.7 -36.0 31.9 17.9 76.2 81 149 A Q S S+ 0 0 177 2,-0.0 -1,-0.2 -3,-0.0 -2,-0.0 0.958 100.2 81.6 -81.5 -57.0 33.8 20.3 78.5 82 150 A A S S- 0 0 52 1,-0.1 0, 0.0 2,-0.0 0, 0.0 0.146 89.3 -85.0 -49.7 163.1 31.8 23.5 78.4 83 151 A S - 0 0 77 1,-0.1 3,-0.3 -5,-0.0 -4,-0.3 -0.182 27.9-132.8 -64.5 162.5 28.7 24.3 80.4 84 152 A T S > S+ 0 0 54 1,-0.2 3,-1.6 2,-0.1 -1,-0.1 0.213 72.7 113.2-104.2 14.5 25.3 23.2 79.0 85 153 A H T 3 S+ 0 0 116 1,-0.3 -1,-0.2 3,-0.0 -3,-0.0 0.823 88.4 29.7 -56.2 -35.0 23.6 26.6 79.6 86 154 A D T 3 S+ 0 0 28 -3,-0.3 -12,-2.9 -13,-0.1 2,-0.3 0.049 111.6 78.3-115.6 26.4 23.1 27.2 75.9 87 155 A S E < -e 74 0A 1 -3,-1.6 2,-0.4 -14,-0.2 -12,-0.2 -0.979 50.0-167.6-137.4 148.4 22.9 23.7 74.6 88 156 A V E +e 75 0A 0 -14,-2.4 -12,-2.1 -2,-0.3 -11,-0.3 -0.997 30.9 138.6-132.3 124.6 20.2 21.0 74.5 89 157 A A E -i 248 0B 0 158,-2.1 160,-2.0 -2,-0.4 -12,-0.1 -0.980 50.1 -98.0-159.7 164.4 21.2 17.5 73.6 90 158 A N E -i 249 0B 6 -2,-0.3 2,-1.1 158,-0.2 160,-0.2 -0.383 51.0 -93.2 -82.1 168.3 20.7 13.8 74.5 91 159 A D > - 0 0 48 158,-1.8 4,-2.5 1,-0.2 5,-0.1 -0.744 40.4-174.3 -85.6 99.8 23.1 12.0 76.7 92 160 A D H > S+ 0 0 2 -2,-1.1 4,-2.5 1,-0.2 5,-0.2 0.819 81.9 56.4 -64.0 -34.3 25.5 10.4 74.3 93 161 A F H > S+ 0 0 82 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.945 111.9 42.6 -63.6 -45.4 27.3 8.5 77.0 94 162 A R H > S+ 0 0 104 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.916 113.4 52.4 -65.9 -44.7 24.1 6.9 78.1 95 163 A G H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.919 111.4 45.2 -58.3 -46.2 22.9 6.3 74.6 96 164 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.821 111.4 54.7 -67.8 -30.9 26.1 4.5 73.6 97 165 A E H X S+ 0 0 79 -4,-1.6 4,-3.0 -5,-0.2 5,-0.2 0.925 108.2 48.7 -67.6 -43.6 26.0 2.6 76.8 98 166 A I H X S+ 0 0 26 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.926 112.8 47.8 -61.0 -46.5 22.5 1.3 76.0 99 167 A A H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.928 116.3 42.3 -60.9 -48.5 23.5 0.3 72.5 100 168 A T H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.927 114.1 50.8 -66.0 -45.9 26.6 -1.6 73.7 101 169 A K H X S+ 0 0 74 -4,-3.0 4,-3.4 1,-0.2 5,-0.2 0.861 106.6 56.7 -61.0 -35.9 24.9 -3.2 76.6 102 170 A H H X S+ 0 0 23 -4,-2.2 4,-1.3 -5,-0.2 -1,-0.2 0.938 108.7 45.4 -61.8 -46.1 22.1 -4.3 74.3 103 171 A L H <>S+ 0 0 0 -4,-1.7 5,-2.1 2,-0.2 -2,-0.2 0.904 114.8 49.0 -63.6 -40.6 24.6 -6.2 72.1 104 172 A I H ><5S+ 0 0 28 -4,-2.4 3,-1.9 1,-0.2 -2,-0.2 0.932 109.8 50.2 -64.6 -45.9 26.3 -7.6 75.2 105 173 A D H 3<5S+ 0 0 116 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.751 104.0 61.4 -65.4 -21.3 23.0 -8.7 76.7 106 174 A L T 3<5S- 0 0 31 -4,-1.3 156,-3.6 -5,-0.2 -1,-0.3 0.491 125.3-101.4 -81.9 -3.1 22.3 -10.4 73.4 107 175 A G T < 5S+ 0 0 39 -3,-1.9 2,-0.3 1,-0.3 -3,-0.2 0.504 75.3 139.4 99.2 3.7 25.3 -12.6 73.8 108 176 A H < + 0 0 5 -5,-2.1 -1,-0.3 1,-0.2 3,-0.1 -0.619 16.1 163.5 -83.4 140.9 27.8 -10.8 71.5 109 177 A T + 0 0 77 -2,-0.3 2,-1.7 1,-0.1 -1,-0.2 0.621 66.7 66.9-122.4 -39.0 31.4 -10.5 72.7 110 178 A H S S+ 0 0 102 56,-0.2 58,-2.2 27,-0.1 59,-1.1 -0.631 74.6 163.7 -87.1 80.8 33.3 -9.6 69.5 111 179 A I E -j 169 0C 2 -2,-1.7 29,-0.7 27,-0.2 2,-0.3 -0.849 19.8-164.0-105.9 134.9 31.6 -6.3 69.2 112 180 A A E -jk 170 140C 0 57,-2.5 59,-2.8 -2,-0.4 2,-0.4 -0.875 7.8-145.5-119.6 153.1 32.9 -3.5 66.9 113 181 A H E -jk 171 141C 0 27,-2.2 29,-1.5 -2,-0.3 2,-0.8 -0.959 4.8-149.5-119.3 131.1 32.2 0.2 66.8 114 182 A L E -j 172 0C 1 57,-1.7 59,-2.4 -2,-0.4 60,-0.2 -0.884 31.2-154.0 -97.1 111.3 32.1 2.4 63.6 115 183 A R - 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0 0 36 -5,-2.9 -1,-0.2 -6,-0.2 -2,-0.2 -0.795 62.3-121.8-109.8 147.9 0.0 -2.8 26.8 393 206 B E - 0 0 138 -2,-0.3 -27,-0.3 -29,-0.1 2,-0.1 -0.712 33.8-134.0 -83.2 122.8 -2.7 -1.8 29.2 394 207 B P - 0 0 20 0, 0.0 2,-0.4 0, 0.0 -27,-0.1 -0.428 17.0-163.0 -78.2 154.9 -1.4 0.6 31.9 395 208 B L E +q 367 0F 40 -29,-0.7 -27,-2.3 -2,-0.1 2,-0.3 -0.991 16.3 162.1-138.4 127.4 -2.1 0.1 35.6 396 209 B S E -q 368 0F 29 -2,-0.4 -27,-0.2 -29,-0.2 2,-0.1 -0.949 35.2-117.2-140.7 159.7 -1.6 2.9 38.2 397 210 B N - 0 0 16 -29,-1.5 -27,-0.1 -2,-0.3 15,-0.0 -0.358 25.9-124.0 -86.3 177.1 -2.7 3.5 41.7 398 211 B D + 0 0 131 -2,-0.1 2,-0.1 -29,-0.0 -1,-0.1 0.354 59.6 137.6-106.3 6.5 -4.9 6.6 42.4 399 212 B Y + 0 0 49 1,-0.1 -2,-0.1 8,-0.1 -29,-0.0 -0.311 21.2 171.8 -55.0 122.8 -2.7 8.2 45.1 400 213 B L + 0 0 113 -29,-0.1 -1,-0.1 -28,-0.1 -29,-0.1 0.091 41.3 105.2-122.0 20.5 -2.5 11.9 44.4 401 214 B G S S- 0 0 23 -31,-0.2 -29,-2.5 1,-0.2 -28,-0.2 -0.129 79.2 -63.4 -89.3-170.2 -0.7 13.0 47.6 402 215 B P - 0 0 93 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 -0.256 59.9 -90.0 -72.6 163.2 2.9 14.1 48.1 403 216 B A + 0 0 18 -3,-0.1 2,-0.3 4,-0.1 -32,-0.1 -0.651 64.4 151.9 -78.2 106.5 5.9 11.8 47.5 404 217 B V > - 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0 0 65 -2,-0.5 3,-0.3 -37,-0.1 -36,-0.2 -0.095 62.6 -59.9-123.7-132.5 21.5 -1.0 39.2 506 325 B G S S+ 0 0 25 -38,-1.7 -37,-0.2 1,-0.2 -2,-0.1 0.290 104.9 81.6-110.5 17.4 20.2 -4.1 40.8 507 326 B T S S+ 0 0 5 -39,-0.2 -54,-2.5 -54,-0.1 2,-0.3 0.411 83.1 62.4-101.4 3.0 16.4 -3.7 41.1 508 327 B C + 0 0 19 -3,-0.3 -59,-0.1 -56,-0.2 -56,-0.1 -0.922 53.3 164.8-126.4 153.5 15.3 -4.8 37.6 509 328 B A - 0 0 20 -2,-0.3 -57,-0.1 -61,-0.2 -148,-0.1 -0.979 42.8 -84.3-159.4 157.7 15.6 -8.0 35.6 510 329 B P 0 0 93 0, 0.0 -148,-0.2 0, 0.0 -149,-0.1 -0.391 360.0 360.0 -68.6 147.6 14.2 -9.7 32.5 511 330 B R 0 0 138 -150,-2.7 -147,-0.3 -2,-0.1 -149,-0.2 0.013 360.0 360.0 176.7 360.0 10.9 -11.5 32.9