==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GENE REGULATION 03-SEP-12 4GWO . COMPND 2 MOLECULE: HTH-TYPE TRANSCRIPTIONAL REGULATOR CYSB; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR M.MITTAL,A.K.SINGH,S.KUMARAN . 478 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20437.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 330 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 54 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 9.8 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 . 40 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 24.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.7 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 2 4 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 2 0 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 PARALLEL BRIDGES PER LADDER . 0 0 2 4 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 2 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 86 A E 0 0 147 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 115.3 24.0 58.2 -8.3 2 87 A H + 0 0 143 1,-0.2 2,-0.4 31,-0.1 0, 0.0 0.191 360.0 65.1-162.7 -37.8 22.1 55.1 -7.7 3 88 A T - 0 0 75 31,-0.1 -1,-0.2 32,-0.0 31,-0.2 -0.801 39.6-159.9-121.8 134.3 20.7 53.6 -4.5 4 89 A W - 0 0 112 29,-2.2 32,-0.6 -2,-0.4 0, 0.0 -0.853 17.4-143.4-107.8 140.1 18.2 54.5 -1.8 5 90 A P + 0 0 113 0, 0.0 -1,-0.1 0, 0.0 29,-0.1 0.439 48.4 146.1 -81.3 0.9 18.2 52.9 1.7 6 91 A D - 0 0 33 1,-0.1 2,-0.4 31,-0.0 30,-0.4 -0.063 33.9-155.0 -47.0 134.8 14.4 52.7 1.9 7 92 A K + 0 0 63 30,-0.1 2,-0.3 28,-0.1 30,-0.2 -0.947 42.3 80.3-122.2 128.6 13.2 49.7 3.9 8 93 A G E -a 37 0A 28 28,-1.3 30,-2.6 -2,-0.4 2,-0.3 -0.961 66.6 -83.9 165.5-176.2 9.8 48.0 3.4 9 94 A S E -a 38 0A 50 -2,-0.3 2,-0.4 28,-0.2 30,-0.2 -0.926 20.3-159.4-122.3 155.3 7.9 45.6 1.2 10 95 A L E -a 39 0A 0 28,-2.5 30,-3.0 -2,-0.3 2,-0.8 -0.957 7.5-165.3-130.6 112.5 6.1 46.0 -2.1 11 96 A Y E -a 40 0A 83 -2,-0.4 48,-2.9 28,-0.2 49,-1.8 -0.853 8.1-173.5-103.8 104.5 3.5 43.3 -3.1 12 97 A I E -ab 41 60A 1 28,-3.0 30,-2.4 -2,-0.8 2,-0.5 -0.840 6.8-170.2-100.0 127.0 2.4 43.4 -6.7 13 98 A A E +ab 42 61A 0 47,-2.8 49,-1.9 -2,-0.5 2,-0.2 -0.973 28.1 141.8-113.4 122.8 -0.3 41.2 -8.0 14 99 A T E -ab 43 62A 0 28,-2.9 30,-1.9 -2,-0.5 2,-0.2 -0.775 40.2 -98.7-148.0-170.4 -0.7 41.2 -11.8 15 100 A T > - 0 0 8 47,-0.7 4,-2.6 -2,-0.2 5,-0.2 -0.565 39.0 -97.9-114.3 175.4 -1.4 39.2 -15.0 16 101 A H H > S+ 0 0 9 28,-0.2 4,-2.8 124,-0.2 5,-0.4 0.890 119.0 55.0 -59.9 -44.8 0.6 37.6 -17.8 17 102 A T H >>S+ 0 0 4 2,-0.2 4,-2.5 3,-0.2 5,-0.7 0.974 114.5 38.8 -55.1 -57.0 0.2 40.5 -20.1 18 103 A Q H >>S+ 0 0 0 1,-0.2 5,-2.5 3,-0.2 4,-2.1 0.964 119.3 46.2 -56.6 -57.9 1.7 43.0 -17.6 19 104 A A H <5S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.846 120.3 38.6 -55.6 -40.8 4.3 40.7 -16.3 20 105 A R H <5S+ 0 0 63 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.875 135.2 11.2 -78.5 -38.3 5.5 39.5 -19.7 21 106 A Y H <5S+ 0 0 52 -4,-2.5 -3,-0.2 -5,-0.4 -2,-0.2 0.668 129.3 34.0-122.8 -26.4 5.3 42.7 -21.7 22 107 A A T < S+ 0 0 26 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.908 95.6 45.8 -58.3 -40.3 10.0 43.8 -16.7 25 110 A G H > S+ 0 0 59 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.963 116.3 44.6 -61.5 -54.5 11.8 47.1 -17.3 26 111 A V H > S+ 0 0 18 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.926 113.8 50.6 -53.2 -48.6 10.1 48.9 -14.5 27 112 A I H X S+ 0 0 0 -4,-3.2 4,-2.2 1,-0.2 -1,-0.2 0.884 110.3 49.5 -62.2 -39.8 10.7 45.9 -12.2 28 113 A K H X S+ 0 0 91 -4,-2.4 4,-1.7 -5,-0.3 -1,-0.2 0.917 111.6 47.5 -64.3 -44.8 14.4 45.7 -13.0 29 114 A G H X S+ 0 0 20 -4,-2.4 4,-1.1 1,-0.2 -2,-0.2 0.891 112.5 52.6 -62.9 -36.8 15.0 49.4 -12.4 30 115 A F H X S+ 0 0 2 -4,-2.2 4,-2.6 -5,-0.3 3,-0.4 0.935 106.4 48.7 -67.3 -49.2 13.1 49.1 -9.2 31 116 A I H < S+ 0 0 41 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.859 113.7 47.3 -63.2 -36.2 15.0 46.3 -7.7 32 117 A E H < S+ 0 0 118 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.715 114.2 49.5 -74.7 -21.7 18.3 47.9 -8.4 33 118 A R H < S+ 0 0 86 -4,-1.1 -29,-2.2 -3,-0.4 -2,-0.2 0.852 116.9 38.7 -82.1 -34.9 17.0 51.2 -7.0 34 119 A Y >< + 0 0 2 -4,-2.6 3,-3.1 1,-0.2 -1,-0.2 -0.463 58.3 165.4-123.4 65.8 15.7 49.7 -3.7 35 120 A P T 3 S+ 0 0 86 0, 0.0 -1,-0.2 0, 0.0 -28,-0.1 0.707 82.7 48.9 -53.7 -26.3 18.0 47.0 -2.3 36 121 A R T 3 S+ 0 0 48 -32,-0.6 -28,-1.3 -30,-0.4 2,-0.6 0.349 90.5 95.0 -99.5 6.4 16.3 47.1 1.1 37 122 A V E < S-a 8 0A 13 -3,-3.1 2,-0.9 -30,-0.2 -28,-0.2 -0.879 72.4-138.1 -95.7 123.0 12.8 46.9 -0.4 38 123 A S E -a 9 0A 69 -30,-2.6 -28,-2.5 -2,-0.6 2,-0.5 -0.732 19.6-156.1 -77.8 105.0 11.4 43.3 -0.5 39 124 A L E -a 10 0A 11 -2,-0.9 2,-0.4 -30,-0.2 -28,-0.2 -0.729 13.6-178.0 -81.1 121.8 9.6 43.0 -3.8 40 125 A H E -a 11 0A 39 -30,-3.0 -28,-3.0 -2,-0.5 2,-0.4 -0.978 2.8-170.1-118.1 142.8 6.9 40.3 -4.0 41 126 A M E -ac 12 377A 5 335,-2.6 337,-2.6 -2,-0.4 2,-0.4 -0.967 7.0-171.8-133.5 145.2 4.9 39.4 -7.1 42 127 A H E -ac 13 378A 48 -30,-2.4 -28,-2.9 -2,-0.4 2,-0.4 -0.998 10.1-151.6-139.2 131.3 1.9 37.3 -7.7 43 128 A Q E +a 14 0A 4 335,-2.8 2,-0.3 -2,-0.4 -28,-0.2 -0.832 34.4 123.1-105.0 143.4 0.3 36.3 -11.0 44 129 A G - 0 0 7 -30,-1.9 -28,-0.2 -2,-0.4 336,-0.1 -0.957 61.3 -55.6-173.2-176.9 -3.4 35.5 -11.5 45 130 A S > - 0 0 9 -2,-0.3 4,-2.4 -30,-0.1 5,-0.2 -0.380 60.0-103.7 -71.4 161.2 -6.5 36.3 -13.4 46 131 A P H > S+ 0 0 3 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.862 123.3 50.2 -55.3 -37.3 -7.6 39.9 -13.2 47 132 A T H > S+ 0 0 58 2,-0.2 4,-2.3 68,-0.2 5,-0.1 0.878 111.3 46.6 -70.9 -38.0 -10.3 39.0 -10.7 48 133 A Q H > S+ 0 0 75 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.876 111.6 52.8 -70.2 -36.8 -8.0 37.0 -8.4 49 134 A I H X S+ 0 0 0 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.877 111.5 46.1 -61.7 -40.1 -5.5 39.9 -8.6 50 135 A A H X S+ 0 0 0 -4,-1.8 4,-2.3 -5,-0.2 -2,-0.2 0.901 111.8 50.1 -73.8 -41.1 -8.2 42.3 -7.5 51 136 A E H X S+ 0 0 102 -4,-2.3 4,-3.1 1,-0.2 5,-0.3 0.917 106.6 57.2 -60.1 -43.5 -9.4 40.0 -4.8 52 137 A A H X>S+ 0 0 15 -4,-2.6 5,-2.1 2,-0.2 6,-0.9 0.878 110.5 42.1 -56.3 -42.3 -5.8 39.7 -3.6 53 138 A V H <5S+ 0 0 0 -4,-1.5 3,-0.3 4,-0.2 -1,-0.2 0.909 116.6 48.8 -73.3 -38.6 -5.4 43.5 -3.2 54 139 A S H <5S+ 0 0 39 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.818 110.7 49.2 -70.3 -34.5 -8.9 43.8 -1.6 55 140 A K H <5S- 0 0 70 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.615 119.9-112.7 -78.7 -14.3 -8.3 41.0 0.9 56 141 A G T <5S+ 0 0 33 -4,-0.6 -3,-0.2 -3,-0.3 -4,-0.1 0.564 84.7 119.3 94.9 9.9 -5.0 42.7 1.7 57 142 A N S S+ 0 0 8 1,-0.2 3,-2.7 2,-0.1 4,-0.2 0.056 91.9 105.4 61.8 -34.6 -12.2 43.3 -13.7 67 152 A L G > S+ 0 0 0 -2,-3.3 3,-1.6 1,-0.3 -1,-0.2 0.830 72.1 60.7 -52.1 -39.4 -10.5 46.0 -11.7 68 153 A H G 3 S+ 0 0 107 -4,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.646 92.8 67.8 -61.9 -16.4 -13.3 48.5 -12.3 69 154 A L G < S+ 0 0 120 -3,-2.7 2,-0.5 1,-0.2 -1,-0.3 0.449 88.2 70.2 -86.4 0.9 -15.7 46.2 -10.5 70 155 A Y X + 0 0 44 -3,-1.6 3,-2.1 -4,-0.2 -1,-0.2 -0.700 53.9 171.2-119.6 76.9 -14.0 46.7 -7.1 71 156 A D T 3 S+ 0 0 126 -2,-0.5 -1,-0.1 1,-0.3 153,-0.1 0.473 71.5 80.1 -72.3 2.7 -14.8 50.3 -6.1 72 157 A D T 3 S+ 0 0 93 -3,-0.1 119,-0.5 2,-0.1 2,-0.3 0.410 91.9 66.6 -76.4 -0.1 -13.2 49.4 -2.7 73 158 A L E < S-E 190 0A 0 -3,-2.1 2,-0.5 -6,-0.2 117,-0.2 -0.887 87.2-126.9-115.3 149.2 -10.1 50.0 -4.7 74 159 A V E -E 189 0A 0 115,-2.7 115,-1.2 -2,-0.3 2,-0.4 -0.881 29.8-151.2 -93.6 131.3 -8.9 53.3 -6.2 75 160 A M E -E 188 0A 14 -2,-0.5 113,-0.2 113,-0.2 152,-0.0 -0.871 12.2-169.1-109.1 135.3 -8.1 52.8 -9.9 76 161 A L E -E 187 0A 0 111,-2.3 111,-2.5 -2,-0.4 2,-0.2 -0.988 23.9-125.4-125.6 123.1 -5.6 54.8 -11.8 77 162 A P E +E 186 0A 12 0, 0.0 109,-0.2 0, 0.0 3,-0.1 -0.495 29.8 174.7 -63.3 131.2 -5.3 54.6 -15.6 78 163 A C E - 0 0 1 107,-2.5 2,-0.3 1,-0.4 131,-0.2 0.754 56.3 -26.1-108.5 -41.3 -1.8 53.7 -16.7 79 164 A Y E -E 185 0A 3 106,-1.2 106,-1.1 157,-0.1 -1,-0.4 -0.980 51.4-117.2-165.8 169.4 -2.0 53.3 -20.4 80 165 A H E +Ef 184 238A 39 157,-2.4 159,-2.5 -2,-0.3 2,-0.3 -0.868 32.8 175.7-111.7 150.0 -4.1 52.5 -23.5 81 166 A W E -E 183 0A 0 102,-2.3 102,-3.1 -2,-0.3 2,-0.3 -0.981 10.4-162.6-148.8 161.2 -3.6 49.6 -25.7 82 167 A N - 0 0 15 157,-0.7 78,-2.3 -2,-0.3 79,-0.3 -0.907 22.6 -94.3-142.4 178.5 -5.1 47.8 -28.7 83 168 A R E -K 159 0B 4 -2,-0.3 93,-1.6 76,-0.2 2,-0.3 -0.423 17.8-160.2 -96.2 158.9 -5.1 44.6 -30.6 84 169 A S E -KL 158 175B 9 74,-2.1 74,-1.8 91,-0.2 2,-0.4 -0.967 20.4-131.1-122.4 147.4 -3.4 43.1 -33.6 85 170 A I E -KL 157 174B 2 89,-2.9 89,-2.7 -2,-0.3 2,-0.4 -0.805 28.1-160.6 -91.8 150.9 -4.5 40.2 -35.6 86 171 A V E +KL 156 173B 0 70,-2.6 70,-2.4 -2,-0.4 2,-0.3 -0.994 16.8 162.6-140.7 130.8 -1.7 37.7 -36.1 87 172 A V E - L 0 172B 2 85,-2.0 85,-3.5 -2,-0.4 68,-0.1 -0.940 42.7 -93.3-144.1 162.0 -1.4 35.0 -38.7 88 173 A T > - 0 0 28 -2,-0.3 3,-2.1 61,-0.3 6,-0.2 -0.447 51.5-100.3 -73.1 156.0 1.3 32.8 -40.3 89 174 A P T 3 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 82,-0.1 0.771 119.4 55.4 -47.2 -33.2 2.8 34.2 -43.5 90 175 A D T 3 S+ 0 0 135 4,-0.0 5,-0.1 3,-0.0 -2,-0.0 0.410 80.1 115.0 -88.2 0.5 0.6 31.9 -45.7 91 176 A H S X S- 0 0 38 -3,-2.1 3,-0.9 1,-0.1 4,-0.3 -0.354 74.9-119.2 -74.3 151.9 -2.8 32.9 -44.4 92 177 A P G > S+ 0 0 78 0, 0.0 3,-0.8 0, 0.0 4,-0.3 0.782 114.9 54.5 -55.5 -33.5 -5.4 34.7 -46.6 93 178 A L G > S+ 0 0 15 1,-0.2 3,-1.0 2,-0.2 5,-0.2 0.719 89.2 77.0 -76.1 -21.3 -5.4 37.7 -44.3 94 179 A A G < S+ 0 0 26 -3,-0.9 -1,-0.2 1,-0.2 79,-0.1 0.705 85.9 66.6 -59.6 -19.3 -1.6 38.0 -44.6 95 180 A A G < S+ 0 0 92 -3,-0.8 -1,-0.2 -4,-0.3 -2,-0.2 0.820 102.2 40.1 -76.2 -35.7 -2.3 39.6 -48.0 96 181 A T < - 0 0 71 -3,-1.0 3,-0.1 -4,-0.3 -3,-0.0 -0.107 52.6-156.2 -96.6-163.5 -3.9 42.8 -46.8 97 182 A S S S+ 0 0 82 77,-0.1 2,-0.4 -2,-0.0 78,-0.1 -0.170 74.7 100.2-160.5 35.5 -3.5 45.3 -44.1 98 183 A S - 0 0 80 -5,-0.2 2,-0.6 2,-0.1 -2,-0.1 -0.965 54.7-174.7-139.6 104.8 -7.1 46.2 -44.5 99 184 A V - 0 0 14 -2,-0.4 2,-0.3 76,-0.2 80,-0.1 -0.896 8.1-176.7-121.3 95.4 -9.1 44.6 -41.8 100 185 A T > - 0 0 69 -2,-0.6 4,-2.2 1,-0.1 5,-0.1 -0.735 33.2-128.2 -89.9 149.3 -12.9 44.8 -41.8 101 186 A I H > S+ 0 0 15 -2,-0.3 4,-2.1 1,-0.2 -1,-0.1 0.826 112.4 55.3 -67.0 -27.8 -14.6 43.2 -38.8 102 187 A E H 4 S+ 0 0 89 2,-0.2 4,-0.2 1,-0.2 -1,-0.2 0.874 106.5 49.7 -69.6 -39.7 -16.8 41.4 -41.3 103 188 A A H >4 S+ 0 0 35 1,-0.2 3,-1.2 2,-0.2 -2,-0.2 0.923 111.8 49.3 -60.0 -44.5 -13.7 40.0 -43.1 104 189 A L H >< S+ 0 0 1 -4,-2.2 3,-2.3 1,-0.2 -2,-0.2 0.899 100.4 62.7 -64.1 -41.3 -12.3 38.8 -39.7 105 190 A A T 3< S+ 0 0 13 -4,-2.1 -1,-0.2 1,-0.3 29,-0.2 0.531 89.4 72.5 -64.6 -5.3 -15.5 37.1 -38.6 106 191 A Q T < S+ 0 0 131 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 0.628 93.1 69.9 -79.0 -15.1 -15.0 34.7 -41.6 107 192 A Y S < S- 0 0 53 -3,-2.3 27,-0.6 -4,-0.2 2,-0.4 -0.691 89.6-105.5-112.1 155.1 -12.2 33.0 -39.8 108 193 A P E -m 134 0B 32 0, 0.0 47,-3.5 0, 0.0 2,-0.4 -0.656 45.6-137.5 -75.5 130.2 -11.7 30.8 -36.8 109 194 A L E -mn 135 155B 0 25,-3.6 27,-1.6 -2,-0.4 28,-1.4 -0.764 22.2-165.1-108.0 132.8 -10.3 32.8 -34.0 110 195 A V E +mn 137 156B 0 45,-2.7 47,-1.9 -2,-0.4 2,-0.2 -0.932 45.5 125.1-102.6 104.7 -7.6 32.1 -31.4 111 196 A T E -m 138 0B 3 26,-1.9 28,-3.1 -2,-0.6 2,-0.2 -0.657 57.2 -51.3-143.2-163.8 -8.0 34.8 -28.7 112 197 A Y E -m 139 0B 5 45,-0.4 28,-0.2 26,-0.2 3,-0.1 -0.506 51.6-111.6 -79.6 147.2 -8.5 35.5 -25.0 113 198 A T > - 0 0 23 26,-3.1 3,-1.6 -2,-0.2 6,-0.3 -0.426 50.8 -79.2 -66.5 149.4 -11.2 33.9 -22.8 114 199 A F T 3 S+ 0 0 152 1,-0.3 -1,-0.1 5,-0.1 3,-0.1 -0.256 122.0 33.5 -44.7 131.2 -13.9 36.1 -21.5 115 200 A G T 3 S+ 0 0 19 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.444 101.6 100.3 95.1 1.9 -12.6 38.1 -18.5 116 201 A F S X S- 0 0 32 -3,-1.6 3,-1.8 1,-0.1 -1,-0.2 -0.973 86.6 -27.1-127.9 136.8 -9.1 38.4 -19.8 117 202 A T T 3 S- 0 0 7 -2,-0.4 -5,-0.2 1,-0.3 -1,-0.1 0.758 121.5 -37.9 37.4 60.9 -7.0 41.1 -21.6 118 203 A G T >> S+ 0 0 1 1,-0.1 4,-1.2 66,-0.1 3,-0.8 0.647 88.4 141.4 76.8 14.7 -9.6 43.2 -23.4 119 204 A R H X> + 0 0 32 -3,-1.8 4,-2.1 -6,-0.3 3,-0.6 0.892 69.4 60.2 -54.9 -41.7 -11.9 40.3 -24.4 120 205 A S H 3> S+ 0 0 41 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.805 99.6 56.1 -58.3 -34.5 -15.0 42.5 -23.7 121 206 A E H <> S+ 0 0 45 -3,-0.8 4,-1.9 2,-0.2 60,-0.3 0.867 107.8 49.1 -62.7 -35.9 -13.8 44.9 -26.3 122 207 A L H < S+ 0 0 125 -4,-3.2 3,-1.9 1,-0.2 -2,-0.2 0.938 109.6 48.6 -68.3 -44.8 -22.0 42.2 -31.2 128 213 A R H 3< S+ 0 0 200 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.717 108.5 55.8 -67.8 -19.0 -22.6 45.7 -32.4 129 214 A A T 3< S- 0 0 36 -4,-0.9 2,-0.8 -5,-0.3 -1,-0.3 0.337 114.8-121.0 -90.4 8.7 -21.7 44.6 -35.9 130 215 A G S < S+ 0 0 62 -3,-1.9 -3,-0.1 1,-0.2 -2,-0.1 -0.160 71.6 131.7 81.8 -40.2 -24.4 42.0 -35.6 131 216 A L - 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0 0 26 -3,-1.2 2,-0.5 -134,-0.1 -134,-0.0 -0.821 70.0-133.7 -95.3 120.8 -19.1 10.8 -22.5 434 279 B F - 0 0 161 -2,-0.6 2,-1.2 1,-0.1 -2,-0.1 -0.606 24.4-136.5 -68.8 120.2 -19.5 8.7 -25.6 435 280 B L - 0 0 18 -2,-0.5 -1,-0.1 4,-0.1 5,-0.1 -0.692 17.6-154.6 -89.1 99.2 -15.9 8.1 -26.6 436 281 B R > - 0 0 70 -2,-1.2 4,-1.4 1,-0.1 3,-0.3 -0.238 28.3-110.1 -62.7 160.5 -15.7 8.5 -30.3 437 282 B S H > S+ 0 0 46 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.837 118.9 59.1 -64.4 -31.2 -12.9 6.7 -32.0 438 283 B Y H > S+ 0 0 5 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.865 103.2 55.3 -65.8 -31.3 -11.1 10.0 -32.8 439 284 B M H > S+ 0 0 7 -3,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.928 105.2 49.6 -62.2 -46.9 -11.0 10.5 -29.0 440 285 B Y H X S+ 0 0 26 -4,-1.4 4,-2.1 1,-0.2 -2,-0.2 0.890 110.9 51.4 -60.2 -43.3 -9.3 7.1 -28.4 441 286 B D H X S+ 0 0 28 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.905 111.1 47.8 -56.0 -45.7 -6.7 8.0 -31.0 442 287 B F H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 5,-0.2 0.973 111.7 48.8 -62.3 -54.7 -6.1 11.4 -29.3 443 288 B I H X S+ 0 0 2 -4,-2.7 4,-2.5 1,-0.2 7,-0.2 0.878 114.9 45.2 -48.1 -44.7 -5.8 9.8 -25.8 444 289 B Q H < S+ 0 0 70 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.800 108.5 55.7 -79.3 -30.8 -3.3 7.2 -27.1 445 290 B R H < S+ 0 0 79 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.843 115.3 40.2 -61.4 -36.0 -1.3 9.8 -29.1 446 291 B F H < S+ 0 0 10 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.869 134.6 19.2 -84.7 -39.5 -0.8 11.7 -25.9 447 292 B A >< - 0 0 0 -4,-2.5 3,-2.9 -5,-0.2 -1,-0.3 -0.856 70.0-162.3-135.9 94.0 -0.3 8.7 -23.6 448 293 B P T 3 S+ 0 0 74 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.794 89.5 58.5 -50.0 -37.4 0.7 5.5 -25.6 449 294 B H T 3 S+ 0 0 31 1,-0.2 2,-1.4 -131,-0.2 5,-0.1 0.616 84.4 84.0 -69.5 -14.7 -0.2 3.2 -22.8 450 295 B L < + 0 0 1 -3,-2.9 -1,-0.2 -7,-0.2 -3,-0.1 -0.386 64.5 163.6 -90.1 61.8 -3.7 4.5 -22.7 451 296 B T > - 0 0 52 -2,-1.4 4,-2.6 -7,-0.1 5,-0.2 -0.155 55.4 -94.9 -64.2 168.5 -4.9 2.1 -25.5 452 297 B R H > S+ 0 0 113 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.862 124.9 47.8 -59.0 -36.3 -8.6 1.6 -26.0 453 298 B D H > S+ 0 0 114 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.929 112.1 48.5 -78.6 -40.5 -8.7 -1.5 -23.9 454 299 B V H > S+ 0 0 43 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.912 114.1 48.3 -56.2 -42.7 -6.8 0.0 -21.1 455 300 B V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.947 112.3 47.1 -67.8 -48.2 -9.1 3.0 -21.3 456 301 B D H X S+ 0 0 59 -4,-2.8 4,-1.7 2,-0.2 -1,-0.2 0.881 112.6 49.3 -60.4 -43.4 -12.3 0.9 -21.3 457 302 B T H >X S+ 0 0 78 -4,-2.6 4,-1.5 2,-0.2 3,-0.6 0.975 112.8 48.2 -56.2 -56.3 -11.1 -1.2 -18.4 458 303 B A H 3< S+ 0 0 0 -4,-2.6 -2,-0.2 1,-0.2 3,-0.2 0.892 110.1 52.7 -49.6 -44.4 -10.2 2.0 -16.5 459 304 B V H 3< S+ 0 0 28 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.817 104.0 57.5 -64.3 -33.8 -13.6 3.4 -17.3 460 305 B A H << S+ 0 0 81 -4,-1.7 -1,-0.2 -3,-0.6 -2,-0.2 0.856 87.2 82.7 -71.1 -39.8 -15.5 0.4 -15.9 461 306 B L S < S- 0 0 45 -4,-1.5 6,-0.0 -3,-0.2 0, 0.0 -0.415 76.5-141.1 -59.5 144.2 -14.0 0.5 -12.4 462 307 B R S S+ 0 0 230 -2,-0.1 2,-0.5 -148,-0.0 -1,-0.1 0.314 76.6 82.8 -89.7 10.9 -16.0 3.0 -10.3 463 308 B S > - 0 0 23 -5,-0.2 4,-1.3 1,-0.1 -2,-0.1 -0.953 55.7-166.0-129.3 123.2 -12.8 4.1 -8.6 464 309 B N H > S+ 0 0 33 -2,-0.5 4,-2.8 2,-0.2 5,-0.2 0.861 102.1 59.4 -63.5 -37.0 -10.1 6.6 -9.6 465 310 B E H > S+ 0 0 165 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.936 105.2 46.9 -54.6 -49.2 -8.2 4.9 -6.8 466 311 B E H > S+ 0 0 99 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.818 109.6 54.9 -63.2 -32.3 -8.5 1.5 -8.6 467 312 B I H X S+ 0 0 0 -4,-1.3 4,-1.0 2,-0.2 -2,-0.2 0.938 107.9 47.6 -69.1 -46.8 -7.4 3.2 -11.8 468 313 B E H >X S+ 0 0 147 -4,-2.8 3,-1.3 1,-0.2 4,-0.7 0.957 111.8 51.7 -54.4 -49.8 -4.2 4.5 -10.2 469 314 B A H >< S+ 0 0 65 -4,-2.6 3,-0.8 1,-0.3 4,-0.3 0.826 99.9 64.4 -55.5 -34.6 -3.7 1.0 -8.8 470 315 B M H 3< S+ 0 0 58 -4,-1.7 3,-0.4 1,-0.2 -1,-0.3 0.832 106.3 42.7 -60.2 -31.0 -4.1 -0.4 -12.3 471 316 B F H X< S+ 0 0 18 -3,-1.3 3,-2.2 -4,-1.0 -1,-0.2 0.534 83.2 101.6 -95.9 -4.8 -1.0 1.4 -13.5 472 317 B Q T << S+ 0 0 77 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.1 0.741 87.9 41.9 -50.2 -30.0 1.1 0.6 -10.4 473 318 B D T 3 S+ 0 0 163 -3,-0.4 2,-0.3 -4,-0.3 -1,-0.3 0.479 102.8 85.2 -98.3 -3.9 3.0 -2.2 -12.2 474 319 B I S < S- 0 0 86 -3,-2.2 2,-0.1 1,-0.1 -3,-0.0 -0.732 76.3-125.8 -97.3 144.6 3.4 -0.2 -15.5 475 320 B K - 0 0 155 -2,-0.3 -2,-0.1 1,-0.0 -1,-0.1 -0.333 26.7-147.1 -66.8 169.6 6.1 2.3 -16.3 476 321 B L - 0 0 23 -2,-0.1 -157,-0.1 -27,-0.0 -158,-0.1 -0.975 20.9-100.8-136.0 152.6 4.9 5.7 -17.4 477 322 B P - 0 0 41 0, 0.0 -157,-2.4 0, 0.0 2,-0.4 -0.316 35.4-140.0 -66.5 160.9 6.5 8.1 -19.9 478 323 B E B t 320 0B 129 -159,-0.2 -157,-0.2 -157,-0.0 -159,-0.0 -0.994 360.0 360.0-127.4 127.3 8.5 10.9 -18.4 479 324 B K 0 0 98 -159,-2.5 -157,-0.7 -2,-0.4 -79,-0.2 -0.672 360.0 360.0-115.3 360.0 8.5 14.5 -19.7