==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR 08-MAY-13 4KMR . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR, LACI FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: SANGUIBACTER KEDDIEII; . AUTHOR E.V.FILIPPOVA,G.MINASOV,L.SHUVALOVA,O.KIRYUKHINA,M.ENDRES, . 539 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21989.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 377 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 74 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 1.9 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 . 38 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 170 31.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.8 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 1 1 0 0 0 3 3 1 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 7 3 0 1 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 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 0 0 2 0 0 0 0 0 0 1 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 66 A G 0 0 121 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 156.3 58.4 21.0 62.0 2 67 A R + 0 0 195 1,-0.2 58,-0.1 2,-0.1 57,-0.0 -0.317 360.0 174.3 -64.2 124.5 57.8 20.5 58.3 3 68 A S - 0 0 35 56,-0.2 -1,-0.2 2,-0.2 3,-0.1 0.561 45.4-119.6-100.0 -19.2 55.2 17.9 57.7 4 69 A G S S+ 0 0 19 1,-0.3 31,-2.1 30,-0.1 2,-0.4 0.728 75.3 122.2 76.2 22.5 55.0 18.3 53.9 5 70 A V E -a 35 0A 0 54,-0.4 56,-3.2 29,-0.2 57,-0.5 -0.957 40.4-172.3-118.8 132.9 51.3 19.2 54.2 6 71 A I E -a 36 0A 1 29,-2.5 31,-2.7 -2,-0.4 2,-0.3 -0.931 19.4-130.0-116.6 151.3 49.7 22.4 52.9 7 72 A G E -ab 37 63A 1 55,-2.8 57,-2.6 -2,-0.4 2,-0.4 -0.732 12.2-164.0 -99.5 151.0 46.1 23.4 53.6 8 73 A L E -ab 38 64A 0 29,-2.6 31,-2.6 -2,-0.3 2,-0.6 -0.968 7.7-169.1-129.8 114.3 43.5 24.6 51.2 9 74 A A E +ab 39 65A 0 55,-2.6 57,-2.6 -2,-0.4 31,-0.2 -0.937 17.9 160.6-110.5 113.6 40.5 26.4 52.7 10 75 A V E -a 40 0A 0 29,-2.1 31,-2.3 -2,-0.6 32,-0.5 -0.860 50.8-107.7-126.5 163.9 37.6 26.9 50.3 11 76 A P S S- 0 0 2 0, 0.0 31,-2.5 0, 0.0 2,-0.3 0.953 89.8 -34.7 -58.6 -53.4 33.9 27.6 50.8 12 77 A E > - 0 0 76 28,-0.1 3,-0.9 29,-0.1 6,-0.3 -0.929 41.3-131.1-167.8 144.5 32.7 24.1 49.7 13 78 A L T 3 S+ 0 0 0 -2,-0.3 6,-0.3 1,-0.2 281,-0.1 0.634 100.7 77.1 -74.4 -15.8 33.7 21.4 47.1 14 79 A G T 3 S+ 0 0 33 280,-0.1 2,-0.7 4,-0.1 -1,-0.2 0.598 78.0 86.9 -67.1 -14.4 30.1 21.1 45.9 15 80 A Q S X> S- 0 0 65 -3,-0.9 4,-2.3 1,-0.1 3,-0.6 -0.843 79.9-144.2 -88.0 116.5 30.9 24.4 44.1 16 81 A A H 3> S+ 0 0 29 -2,-0.7 4,-2.6 1,-0.3 5,-0.3 0.847 95.8 58.1 -53.1 -40.0 32.5 23.3 40.7 17 82 A F H 3> S+ 0 0 33 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.933 111.9 40.2 -56.2 -46.4 34.9 26.3 40.6 18 83 A F H <> S+ 0 0 22 -3,-0.6 4,-2.5 -6,-0.3 -2,-0.2 0.850 112.8 54.0 -73.7 -34.0 36.5 25.2 44.0 19 84 A A H X S+ 0 0 2 -4,-2.3 4,-2.0 -6,-0.3 -1,-0.2 0.906 113.1 44.2 -63.1 -44.5 36.4 21.5 43.2 20 85 A Q H X S+ 0 0 43 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.873 113.0 50.3 -69.8 -36.2 38.3 22.2 40.0 21 86 A L H X S+ 0 0 3 -4,-2.1 4,-2.6 -5,-0.3 -2,-0.2 0.926 110.6 50.7 -64.0 -45.2 40.7 24.6 41.6 22 87 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.898 106.5 54.2 -56.9 -45.7 41.4 22.0 44.3 23 88 A D H X S+ 0 0 10 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.941 111.6 45.8 -54.9 -46.6 42.1 19.3 41.7 24 89 A E H X S+ 0 0 31 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.912 113.1 49.2 -65.4 -43.3 44.7 21.6 40.1 25 90 A V H X S+ 0 0 1 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.920 111.6 49.1 -59.4 -47.7 46.3 22.5 43.6 26 91 A I H X S+ 0 0 15 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.932 112.6 48.3 -59.1 -46.1 46.5 18.8 44.5 27 92 A R H X S+ 0 0 117 -4,-2.2 4,-0.6 -5,-0.2 -2,-0.2 0.904 114.7 43.8 -62.7 -44.0 48.1 18.0 41.2 28 93 A V H >< S+ 0 0 15 -4,-2.4 3,-1.0 1,-0.2 4,-0.4 0.911 112.3 52.7 -67.7 -45.7 50.7 20.8 41.4 29 94 A A H ><>S+ 0 0 0 -4,-2.9 5,-2.4 1,-0.2 3,-1.8 0.885 102.4 59.9 -56.5 -40.0 51.5 20.1 45.0 30 95 A A H ><5S+ 0 0 62 -4,-2.1 3,-1.3 1,-0.3 -1,-0.2 0.754 91.5 68.7 -64.6 -19.5 52.1 16.5 44.3 31 96 A E T <<5S+ 0 0 137 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.731 108.9 35.6 -71.5 -17.5 54.9 17.5 41.9 32 97 A Q T < 5S- 0 0 80 -3,-1.8 -1,-0.3 -4,-0.4 -2,-0.2 -0.043 122.7-106.8-124.4 35.3 56.9 18.7 44.8 33 98 A D T < 5S+ 0 0 144 -3,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.694 72.7 139.3 36.0 45.0 55.6 15.9 47.0 34 99 A L < - 0 0 13 -5,-2.4 2,-0.3 -6,-0.1 -29,-0.2 -0.750 40.0-147.0 -97.0 153.8 53.4 17.9 49.2 35 100 A V E -a 5 0A 59 -31,-2.1 -29,-2.5 -2,-0.3 2,-0.5 -0.814 14.4-124.8-117.9 162.0 49.9 16.6 50.2 36 101 A V E -a 6 0A 2 276,-0.5 276,-2.2 -2,-0.3 2,-0.6 -0.944 9.0-157.4-124.2 122.1 46.8 18.8 50.7 37 102 A L E -aC 7 311A 0 -31,-2.7 -29,-2.6 -2,-0.5 2,-0.6 -0.864 22.4-152.5 -88.8 116.6 44.5 19.1 53.7 38 103 A V E -a 8 0A 0 272,-2.2 272,-0.5 -2,-0.6 2,-0.3 -0.881 15.5-178.1-101.7 122.7 41.1 20.4 52.3 39 104 A E E -a 9 0A 21 -31,-2.6 -29,-2.1 -2,-0.6 2,-0.4 -0.843 17.1-142.9-113.3 150.1 39.0 22.4 54.7 40 105 A Q E +a 10 0A 23 -2,-0.3 -28,-0.1 -31,-0.2 -31,-0.1 -0.964 16.9 178.4-115.5 134.9 35.6 23.9 54.0 41 106 A T > - 0 0 3 -31,-2.3 3,-2.0 -2,-0.4 6,-0.3 0.480 36.6-131.6-109.8 -11.1 34.7 27.3 55.4 42 107 A G T 3 - 0 0 42 -31,-2.5 -30,-0.1 -32,-0.5 3,-0.1 0.610 62.0 -78.1 64.9 11.2 31.2 27.8 54.0 43 108 A G T 3 S+ 0 0 15 1,-0.2 2,-0.4 -33,-0.1 -1,-0.3 0.639 94.1 146.0 70.2 18.0 32.4 31.3 53.0 44 109 A L <> - 0 0 75 -3,-2.0 4,-2.0 1,-0.1 3,-0.3 -0.687 51.6-140.1 -93.5 131.2 31.8 32.4 56.6 45 110 A R H > S+ 0 0 115 -2,-0.4 4,-2.5 1,-0.2 5,-0.2 0.873 102.1 55.1 -58.2 -37.0 34.2 34.9 58.1 46 111 A E H > S+ 0 0 101 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.879 110.2 46.0 -65.0 -39.7 34.4 33.2 61.4 47 112 A R H > S+ 0 0 95 -3,-0.3 4,-1.7 -6,-0.3 -1,-0.2 0.810 110.1 53.5 -71.5 -31.8 35.5 29.9 59.8 48 113 A E H X S+ 0 0 0 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.937 110.0 48.2 -66.3 -45.2 38.0 31.7 57.6 49 114 A L H >X S+ 0 0 21 -4,-2.5 4,-1.4 1,-0.2 3,-0.7 0.914 108.6 54.3 -61.0 -40.8 39.5 33.3 60.7 50 115 A E H 3X S+ 0 0 99 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.865 101.0 60.1 -62.4 -38.7 39.6 29.8 62.4 51 116 A A H 3< S+ 0 0 5 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.852 106.6 47.6 -58.7 -32.8 41.5 28.4 59.5 52 117 A L H << S+ 0 0 16 -4,-1.1 -1,-0.2 -3,-0.7 -2,-0.2 0.844 128.6 15.8 -76.7 -34.7 44.3 30.8 60.2 53 118 A R H < S+ 0 0 141 -4,-1.4 -2,-0.2 -3,-0.0 -3,-0.2 0.656 90.8 102.9-119.2 -18.4 44.7 30.4 63.9 54 119 A N >< - 0 0 59 -4,-2.6 3,-1.4 -5,-0.2 0, 0.0 -0.446 68.4-129.4 -72.7 141.3 43.1 27.2 65.3 55 120 A P G > S+ 0 0 91 0, 0.0 3,-1.9 0, 0.0 4,-0.2 0.548 94.9 91.1 -64.4 -7.9 45.3 24.2 66.2 56 121 A R G 3 S+ 0 0 37 1,-0.3 3,-0.3 -6,-0.2 -5,-0.1 0.881 92.4 40.9 -52.4 -38.3 42.9 22.1 64.1 57 122 A L G X S+ 0 0 1 -3,-1.4 3,-1.9 1,-0.2 -1,-0.3 0.098 77.5 120.5-102.1 27.7 45.2 22.8 61.1 58 123 A S T < + 0 0 89 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.704 63.8 69.0 -64.2 -21.5 48.5 22.5 63.0 59 124 A L T 3 S+ 0 0 44 -3,-0.3 -54,-0.4 -4,-0.2 -1,-0.3 0.798 85.1 93.4 -66.1 -24.3 49.6 19.7 60.7 60 125 A T < - 0 0 12 -3,-1.9 -54,-0.2 1,-0.1 3,-0.1 -0.384 61.6-157.9 -77.3 144.6 49.9 22.2 57.9 61 126 A D S S- 0 0 23 -56,-3.2 2,-0.3 1,-0.3 -55,-0.2 0.605 80.5 -15.1 -85.2 -24.2 53.1 24.0 57.0 62 127 A G - 0 0 0 -57,-0.5 -55,-2.8 15,-0.2 2,-0.4 -0.962 68.8-117.2-168.3 172.4 51.1 26.8 55.3 63 128 A L E -bd 7 79A 0 15,-2.6 17,-2.2 -2,-0.3 2,-0.5 -0.956 4.3-157.7-132.6 137.8 47.7 27.7 54.0 64 129 A L E -bd 8 80A 0 -57,-2.6 -55,-2.6 -2,-0.4 2,-0.4 -0.969 27.9-168.7-102.7 121.8 46.0 28.7 50.7 65 130 A L E -bd 9 81A 0 15,-2.1 17,-3.0 -2,-0.5 -55,-0.2 -0.960 19.9-165.8-120.0 127.0 42.8 30.6 51.7 66 131 A A - 0 0 4 -57,-2.6 2,-0.2 -2,-0.4 17,-0.1 -0.861 26.6-162.3-106.3 92.6 39.9 31.5 49.3 67 132 A P + 0 0 24 0, 0.0 -22,-0.1 0, 0.0 -23,-0.0 -0.458 31.8 156.8 -83.3 148.4 38.0 34.0 51.3 68 133 A L S S+ 0 0 104 -2,-0.2 -24,-0.1 15,-0.1 -23,-0.1 0.533 77.5 43.1-129.0 -40.5 34.5 35.2 50.7 69 134 A G S S+ 0 0 31 -25,-0.1 -24,-0.2 2,-0.0 -25,-0.1 0.771 95.4 87.9 -84.2 -28.7 33.2 36.5 54.1 70 135 A L 0 0 10 1,-0.1 4,-0.0 -26,-0.1 -24,-0.0 -0.338 360.0 360.0 -70.2 154.9 36.3 38.4 55.1 71 136 A T 0 0 136 15,-0.0 -1,-0.1 2,-0.0 3,-0.1 0.214 360.0 360.0-157.6 360.0 37.0 42.1 54.2 72 ! 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 73 138 A D 0 0 178 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 105.0 40.1 43.4 61.2 74 139 A D 0 0 50 1,-0.2 -25,-0.0 -3,-0.1 13,-0.0 -0.699 360.0 360.0-103.2 146.0 42.5 40.7 60.3 75 140 A V 0 0 93 -2,-0.3 -1,-0.2 12,-0.0 -26,-0.0 0.230 360.0 360.0 -28.1 360.0 44.6 38.1 62.3 76 ! 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 77 147 A R 0 0 101 0, 0.0 -15,-0.2 0, 0.0 -16,-0.1 0.000 360.0 360.0 360.0 101.1 50.9 30.1 59.5 78 148 A P - 0 0 30 0, 0.0 -15,-2.6 0, 0.0 2,-0.4 -0.354 360.0-158.9 -48.5 140.8 52.5 31.2 56.1 79 149 A L E -d 63 0A 8 11,-0.4 13,-1.1 -17,-0.2 2,-0.4 -0.981 30.4-178.3-142.2 134.1 49.6 32.3 53.9 80 150 A V E -de 64 92A 0 -17,-2.2 -15,-2.1 -2,-0.4 2,-0.4 -0.998 24.5-145.2-125.6 131.5 48.7 32.9 50.2 81 151 A V E -de 65 93A 0 11,-2.6 13,-2.6 -2,-0.4 2,-1.1 -0.842 5.7-146.6-100.0 131.2 45.2 34.2 49.5 82 152 A L E S+ e 0 94A 19 -17,-3.0 2,-0.3 -2,-0.4 13,-0.2 -0.837 74.5 45.6 -95.0 88.4 43.2 33.2 46.4 83 153 A G S S- 0 0 20 11,-1.2 3,-0.1 -2,-1.1 -2,-0.1 -0.956 98.2 -37.4 164.7-177.7 41.5 36.4 45.8 84 154 A E S S- 0 0 63 -2,-0.3 10,-0.1 1,-0.2 46,-0.0 -0.266 84.7 -63.0 -62.4 160.0 41.8 40.2 45.6 85 155 A P S S+ 0 0 77 0, 0.0 -1,-0.2 0, 0.0 175,-0.0 -0.189 76.2 134.9 -49.5 133.2 44.2 42.1 47.9 86 156 A L + 0 0 42 1,-0.3 -12,-0.1 -3,-0.1 -15,-0.0 0.403 46.4 63.7-147.9 -60.1 42.9 41.7 51.5 87 157 A F - 0 0 23 5,-0.1 -1,-0.3 1,-0.1 4,-0.2 -0.592 65.6-141.1 -86.2 141.9 45.7 40.9 54.1 88 158 A P + 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.342 61.7 29.1 -85.5 179.6 48.5 43.2 55.0 89 159 A G S S- 0 0 42 1,-0.1 2,-2.5 -2,-0.1 -2,-0.0 -0.246 115.6 -4.2 73.4-156.5 52.1 42.1 55.6 90 160 A P S S+ 0 0 88 0, 0.0 -11,-0.4 0, 0.0 2,-0.4 -0.326 96.5 117.1 -78.9 63.8 54.1 39.1 54.2 91 161 A V - 0 0 14 -2,-2.5 2,-0.3 -4,-0.2 168,-0.2 -0.977 52.1-145.4-131.3 139.5 51.2 37.6 52.3 92 162 A D E -e 80 0A 0 -13,-1.1 -11,-2.6 -2,-0.4 2,-0.4 -0.779 9.6-153.1-103.6 152.2 50.8 37.0 48.6 93 163 A H E -ef 81 260A 13 166,-2.4 168,-1.7 -2,-0.3 2,-0.5 -0.990 5.9-167.3-126.9 133.1 47.5 37.2 46.7 94 164 A V E +ef 82 261A 2 -13,-2.6 -11,-1.2 -2,-0.4 168,-0.2 -0.990 23.7 158.7-120.5 120.5 46.7 35.4 43.4 95 165 A T - 0 0 9 166,-2.8 2,-0.3 -2,-0.5 -11,-0.1 -0.484 36.2-102.1-126.5-169.4 43.5 36.7 41.7 96 166 A X - 0 0 18 166,-0.2 2,-2.0 -2,-0.2 3,-0.2 -0.792 38.0-100.9-118.9 161.7 42.0 36.6 38.2 97 167 A Q > + 0 0 61 166,-0.5 4,-2.7 134,-0.3 5,-0.3 -0.447 54.4 163.7 -82.5 66.9 41.8 39.4 35.6 98 168 A H H > + 0 0 14 -2,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.888 69.5 41.7 -52.9 -51.8 38.3 40.4 36.5 99 169 A E H > S+ 0 0 87 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.941 117.6 44.5 -65.7 -50.5 38.2 43.8 34.8 100 170 A A H > S+ 0 0 40 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.906 115.5 48.9 -63.2 -39.5 40.0 42.8 31.5 101 171 A A H X S+ 0 0 1 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.901 110.9 49.7 -68.2 -40.3 38.0 39.6 31.1 102 172 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.3 5,-0.2 0.898 111.1 50.1 -66.5 -38.7 34.7 41.4 31.7 103 173 A R H X S+ 0 0 108 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.943 112.7 46.1 -63.4 -44.2 35.7 44.0 29.1 104 174 A A H X S+ 0 0 21 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.889 112.6 51.1 -67.0 -35.7 36.6 41.3 26.6 105 175 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.948 112.7 45.2 -65.9 -45.1 33.4 39.3 27.3 106 176 A T H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.911 110.6 53.7 -66.5 -41.7 31.3 42.4 26.8 107 177 A E H X S+ 0 0 93 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.860 106.1 54.7 -57.7 -40.6 33.2 43.3 23.6 108 178 A H H X S+ 0 0 32 -4,-2.1 4,-0.7 2,-0.2 -2,-0.2 0.938 110.4 44.5 -59.1 -46.0 32.5 39.8 22.3 109 179 A L H ><>S+ 0 0 0 -4,-2.0 5,-1.5 1,-0.2 3,-1.0 0.920 113.9 48.8 -66.4 -42.4 28.7 40.2 22.8 110 180 A L H ><5S+ 0 0 32 -4,-2.7 3,-2.0 1,-0.2 -1,-0.2 0.887 105.1 61.0 -65.0 -34.2 28.7 43.7 21.3 111 181 A G H 3<5S+ 0 0 67 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.666 95.7 60.7 -67.4 -17.5 30.7 42.4 18.3 112 182 A L T <<5S- 0 0 70 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.465 126.2-101.9 -82.3 -6.5 27.9 40.0 17.5 113 183 A G T < 5S+ 0 0 58 -3,-2.0 2,-0.3 1,-0.3 -3,-0.2 0.597 75.6 144.3 92.3 17.9 25.7 43.1 17.0 114 184 A R < + 0 0 50 -5,-1.5 -1,-0.3 1,-0.1 3,-0.1 -0.697 21.7 175.9 -89.9 139.0 23.9 42.8 20.4 115 185 A R + 0 0 181 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.427 64.0 61.8-127.2 -0.4 23.1 46.1 21.9 116 186 A R - 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0 0 0 15,-2.3 2,-0.3 -2,-0.3 -25,-0.2 -0.291 20.5-115.8-121.4-152.3 20.9 8.8 35.1 483 283 B F S S+ 0 0 2 15,-0.2 -26,-1.5 -2,-0.1 -25,-0.2 -0.928 79.8 48.5-160.3 124.0 22.4 7.8 38.4 484 284 B D S S- 0 0 14 15,-3.0 19,-0.1 -2,-0.3 16,-0.1 -0.030 82.9-120.9 137.6 -29.3 24.2 9.9 41.1 485 285 B D - 0 0 9 1,-0.2 2,-0.2 15,-0.1 -1,-0.1 0.945 40.5-177.1 58.3 54.7 22.0 13.0 41.6 486 286 B V > - 0 0 0 1,-0.1 3,-1.3 -3,-0.0 4,-0.3 -0.521 36.1-114.2 -75.8 152.2 24.6 15.6 40.6 487 287 B A G > S+ 0 0 40 1,-0.3 3,-1.8 -2,-0.2 4,-0.4 0.836 108.4 68.0 -58.4 -35.5 23.4 19.3 41.0 488 288 B D G > S+ 0 0 20 1,-0.3 3,-1.7 2,-0.2 4,-0.4 0.830 86.1 68.9 -59.8 -28.9 23.5 20.0 37.3 489 289 B G G < S+ 0 0 0 -3,-1.3 7,-2.8 1,-0.3 3,-0.3 0.678 88.3 65.3 -66.2 -18.5 20.6 17.7 36.6 490 290 B R G < S+ 0 0 141 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.715 107.1 41.5 -72.8 -20.0 18.1 20.0 38.4 491 291 B Y S < S+ 0 0 64 -3,-1.7 -2,-0.2 -4,-0.4 -1,-0.2 0.322 83.8 103.2-119.4 6.2 18.7 22.8 35.7 492 292 B T S S- 0 0 31 -4,-0.4 3,-0.1 -3,-0.3 -270,-0.0 -0.371 81.7 -99.8 -70.4 171.0 18.8 21.1 32.4 493 293 B Y S S+ 0 0 96 1,-0.4 2,-0.1 -2,-0.1 -2,-0.0 -0.891 123.2 32.5-136.8 96.2 15.6 21.5 30.2 494 294 B P S S- 0 0 14 0, 0.0 -1,-0.4 0, 0.0 -2,-0.1 0.414 109.1-128.6 -70.1 151.9 14.3 18.9 30.7 495 295 B S - 0 0 13 -5,-0.1 47,-2.3 -2,-0.1 2,-0.6 -0.364 33.3-105.1 -65.7 149.1 15.5 18.4 34.2 496 296 B L - 0 0 1 -7,-2.8 -15,-0.1 45,-0.2 2,-0.1 -0.719 18.7-139.9 -94.5 119.7 17.1 15.0 34.6 497 297 B T B +t 481 0D 0 -17,-0.7 -15,-2.3 -2,-0.6 2,-0.3 -0.434 41.3 158.8 -66.1 141.6 15.5 12.0 36.5 498 298 B T E -U 538 0E 0 40,-2.1 40,-3.0 -17,-0.2 2,-0.4 -0.877 42.1-105.6-152.7 179.7 18.2 10.3 38.5 499 299 B V E -U 537 0E 2 -2,-0.3 -15,-3.0 38,-0.2 38,-0.2 -0.993 18.7-150.5-119.0 128.9 18.9 8.0 41.4 500 300 B E E -U 536 0E 7 36,-3.1 36,-2.0 -2,-0.4 -15,-0.1 -0.884 11.6-162.1 -97.3 115.3 20.4 9.4 44.6 501 301 B P - 0 0 2 0, 0.0 -134,-0.3 0, 0.0 -1,-0.1 0.449 52.7 -81.8 -85.8 3.0 22.5 6.4 45.9 502 302 B G > + 0 0 6 34,-0.1 4,-2.7 -18,-0.1 3,-0.3 0.807 58.3 170.4 105.4 43.9 22.7 7.6 49.5 503 303 B R H > S+ 0 0 50 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.815 78.1 52.9 -56.1 -38.5 25.5 10.1 49.8 504 304 B H H > S+ 0 0 95 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.934 115.1 40.3 -64.8 -44.4 24.7 11.2 53.3 505 305 B D H > S+ 0 0 80 -3,-0.3 4,-2.9 2,-0.2 5,-0.3 0.873 113.0 56.0 -70.1 -38.8 24.8 7.6 54.7 506 306 B I H X S+ 0 0 3 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.959 113.6 40.2 -56.2 -53.4 27.8 6.7 52.5 507 307 B A H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.2 5,-0.3 0.919 118.6 45.4 -63.4 -46.1 29.8 9.6 54.1 508 308 B R H X S+ 0 0 94 -4,-2.3 4,-2.4 -5,-0.2 5,-0.3 0.931 113.8 48.2 -66.4 -45.3 28.6 9.2 57.6 509 309 B A H X S+ 0 0 14 -4,-2.9 4,-2.6 -5,-0.2 5,-0.2 0.939 113.6 48.6 -57.9 -45.5 29.0 5.4 57.6 510 310 B A H X S+ 0 0 10 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.929 114.6 41.7 -63.6 -50.0 32.5 5.6 56.2 511 311 B V H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.921 115.8 50.2 -66.2 -43.0 33.8 8.3 58.5 512 312 B T H X S+ 0 0 48 -4,-2.4 4,-1.9 -5,-0.3 -2,-0.2 0.935 112.3 46.4 -63.6 -42.5 32.2 6.8 61.6 513 313 B X H X S+ 0 0 13 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.886 111.3 52.5 -67.0 -37.1 33.5 3.2 60.9 514 314 B L H X S+ 0 0 0 -4,-2.1 4,-2.6 -5,-0.2 5,-0.2 0.952 106.1 53.7 -63.9 -42.6 37.0 4.6 60.2 515 315 B S H X S+ 0 0 35 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.874 108.8 51.0 -57.0 -41.6 36.9 6.4 63.5 516 316 B E H X S+ 0 0 74 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.915 110.9 46.0 -62.2 -46.6 36.1 3.0 65.2 517 317 B R H X>S+ 0 0 12 -4,-2.1 4,-0.9 2,-0.2 5,-0.7 0.845 108.7 56.5 -63.7 -39.9 39.0 1.2 63.5 518 318 B I H ><5S+ 0 0 46 -4,-2.6 3,-1.0 1,-0.2 -1,-0.2 0.935 106.8 49.4 -58.9 -47.4 41.5 4.0 64.3 519 319 B A H 3<5S+ 0 0 83 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.842 107.1 56.6 -64.7 -28.9 40.6 3.6 68.0 520 320 B D H ><5S- 0 0 55 -4,-1.3 3,-0.8 -5,-0.1 -1,-0.2 0.684 90.9-149.5 -75.6 -19.1 41.2 -0.1 67.8 521 321 B A T <<5 - 0 0 90 -3,-1.0 -3,-0.1 -4,-0.9 -2,-0.1 0.867 67.2 -47.4 48.9 46.3 44.7 0.1 66.5 522 322 B G T 3 > - 0 0 26 -2,-0.5 5,-2.0 5,-0.2 3,-1.2 -0.582 55.6 -75.9-125.6-165.7 12.2 15.0 37.1 541 341 B E G > 5S+ 0 0 70 1,-0.2 3,-1.6 3,-0.2 -45,-0.2 0.785 112.8 75.1 -70.3 -24.0 11.0 16.2 33.7 542 342 B S G 3 5S+ 0 0 1 -47,-2.3 -62,-2.2 1,-0.3 -1,-0.2 0.593 108.4 32.5 -71.7 -9.1 13.1 13.8 31.6 543 343 B T G < 5S- 0 0 2 -3,-1.2 -1,-0.3 -64,-0.2 -2,-0.2 0.055 130.4 -87.7-124.9 16.2 10.8 10.9 32.5 544 344 B G T < 5 0 0 58 -3,-1.6 -3,-0.2 -4,-0.1 -2,-0.1 0.385 360.0 360.0 98.9 -2.6 7.5 12.9 32.7 545 345 B G < 0 0 101 -5,-2.0 -5,-0.2 0, 0.0 -4,-0.0 -0.198 360.0 360.0 70.3 360.0 7.5 14.1 36.4