==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN 17-MAR-11 3R4K . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR, ICLR FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: RUEGERIA SP. TM1040; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 1017 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43428.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 703 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 187 18.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 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 . 54 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 353 34.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 3 7 6 0 2 2 4 4 0 4 0 0 0 0 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 6 1 11 4 0 4 4 0 4 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 4 0 0 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 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 1 A X 0 0 211 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 20.5 164.3 28.9 32.1 2 2 A G > - 0 0 31 1,-0.1 4,-2.3 4,-0.0 5,-0.1 -0.159 360.0 -94.3 -73.1 173.1 166.3 25.6 32.1 3 3 A T H > S+ 0 0 70 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.808 125.5 51.3 -63.9 -33.0 166.9 23.4 28.9 4 4 A V H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.954 113.2 45.8 -69.2 -47.0 163.8 21.2 29.6 5 5 A S H > S+ 0 0 21 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.846 112.3 52.1 -57.9 -42.9 161.6 24.3 30.0 6 6 A K H X S+ 0 0 74 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.908 110.0 48.1 -62.0 -46.4 163.2 25.9 26.8 7 7 A A H X S+ 0 0 0 -4,-2.0 4,-0.7 1,-0.2 3,-0.5 0.905 112.2 48.2 -62.6 -44.5 162.5 22.7 24.7 8 8 A L H X S+ 0 0 7 -4,-2.2 4,-0.6 1,-0.2 3,-0.5 0.800 103.6 61.4 -71.4 -26.5 158.8 22.5 25.9 9 9 A T H >< S+ 0 0 56 -4,-1.6 3,-1.0 1,-0.2 4,-0.4 0.838 96.0 61.9 -64.6 -35.2 158.3 26.3 25.1 10 10 A L H >< S+ 0 0 0 -4,-1.1 3,-1.1 -3,-0.5 4,-0.2 0.843 97.8 57.3 -59.9 -34.6 159.1 25.5 21.4 11 11 A L H >< S+ 0 0 1 -4,-0.7 3,-1.1 -3,-0.5 -1,-0.3 0.721 93.0 68.5 -67.8 -26.7 156.0 23.1 21.3 12 12 A T T << S+ 0 0 79 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 0.692 87.1 67.3 -67.3 -21.8 153.7 26.0 22.3 13 13 A Y T < S+ 0 0 48 -3,-1.1 2,-0.3 -4,-0.4 -1,-0.2 0.686 82.7 90.0 -74.7 -19.5 154.3 27.7 18.9 14 14 A F < + 0 0 0 -3,-1.1 2,-0.3 -4,-0.2 5,-0.2 -0.617 53.0 152.1 -77.0 134.8 152.4 24.9 17.2 15 15 A N B > -A 18 0A 65 3,-1.6 3,-2.2 -2,-0.3 5,-0.1 -0.919 63.3 -87.2-153.9 168.3 148.6 25.5 16.8 16 16 A H T 3 S+ 0 0 41 1,-0.3 3,-0.3 -2,-0.3 -2,-0.0 0.723 131.7 48.9 -56.6 -21.1 145.8 24.4 14.4 17 17 A G T 3 S+ 0 0 66 1,-0.2 -1,-0.3 2,-0.1 2,-0.2 0.476 120.5 36.3 -92.1 -8.7 146.8 27.5 12.3 18 18 A R B < +A 15 0A 86 -3,-2.2 -3,-1.6 1,-0.1 -1,-0.2 -0.674 63.4 150.4-145.9 78.7 150.6 26.6 12.4 19 19 A L S S+ 0 0 42 -3,-0.3 42,-0.5 -5,-0.2 2,-0.4 0.690 70.5 44.5 -87.6 -21.5 151.0 22.8 12.3 20 20 A E E -B 60 0B 95 40,-0.1 2,-0.4 -5,-0.1 40,-0.2 -0.992 66.9-177.1-127.1 129.0 154.4 22.9 10.5 21 21 A I E -B 59 0B 5 38,-2.5 38,-2.6 -2,-0.4 2,-0.1 -0.998 18.7-135.7-130.9 131.3 157.2 25.3 11.5 22 22 A G E > -B 58 0B 22 -2,-0.4 4,-2.2 36,-0.3 36,-0.3 -0.375 28.5-110.1 -76.5 158.4 160.6 25.7 9.8 23 23 A L H > S+ 0 0 19 34,-2.2 4,-1.5 1,-0.2 35,-0.1 0.858 118.7 49.2 -57.3 -40.5 163.9 26.0 11.8 24 24 A S H > S+ 0 0 46 33,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.892 111.7 47.1 -68.5 -43.9 164.3 29.7 10.8 25 25 A D H > S+ 0 0 86 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.844 111.7 51.8 -66.6 -35.6 160.7 30.6 11.8 26 26 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 6,-0.3 0.839 108.1 52.1 -66.7 -36.6 161.1 28.7 15.2 27 27 A T H X S+ 0 0 29 -4,-1.5 4,-1.9 2,-0.2 5,-0.2 0.914 113.4 44.1 -65.4 -44.3 164.4 30.7 15.8 28 28 A R H < S+ 0 0 168 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.875 116.5 45.5 -68.4 -43.2 162.5 34.0 15.2 29 29 A L H < S+ 0 0 63 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.837 120.0 38.9 -69.1 -39.2 159.4 33.1 17.2 30 30 A S H < S- 0 0 22 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.767 95.1-133.4 -85.0 -31.9 161.3 31.7 20.2 31 31 A G < + 0 0 73 -4,-1.9 2,-0.1 1,-0.3 -3,-0.1 0.382 64.9 124.2 89.3 -1.0 164.2 34.2 20.4 32 32 A X S S- 0 0 30 -6,-0.3 -1,-0.3 -5,-0.2 -2,-0.1 -0.466 70.7 -90.7 -86.6 160.5 166.8 31.4 20.7 33 33 A N > - 0 0 115 -2,-0.1 4,-2.3 1,-0.1 3,-0.3 -0.380 34.9-115.7 -67.8 151.7 169.8 30.8 18.5 34 34 A K H > S+ 0 0 102 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.883 117.4 52.1 -53.0 -45.6 169.3 28.5 15.4 35 35 A A H > S+ 0 0 57 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.836 109.6 48.9 -62.1 -38.8 171.8 25.9 16.9 36 36 A T H > S+ 0 0 12 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.944 113.0 46.9 -64.9 -50.1 169.9 25.8 20.2 37 37 A V H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.917 113.4 49.1 -58.3 -46.8 166.5 25.3 18.4 38 38 A Y H X S+ 0 0 115 -4,-2.9 4,-1.7 1,-0.2 -1,-0.2 0.884 112.2 47.9 -59.8 -45.2 168.0 22.6 16.2 39 39 A R H X S+ 0 0 144 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.874 115.7 43.8 -62.8 -44.7 169.6 20.8 19.3 40 40 A L H X S+ 0 0 4 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.862 113.0 50.6 -71.1 -41.3 166.3 20.9 21.3 41 41 A X H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.828 108.7 53.9 -69.3 -28.2 164.1 19.9 18.3 42 42 A S H X S+ 0 0 33 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.889 108.4 48.7 -69.0 -40.4 166.5 16.9 17.7 43 43 A E H X S+ 0 0 47 -4,-1.4 4,-1.1 2,-0.2 -2,-0.2 0.854 112.0 48.5 -67.2 -37.7 166.0 15.8 21.3 44 44 A L H <>S+ 0 0 0 -4,-1.8 5,-2.6 2,-0.2 6,-0.8 0.855 110.2 53.6 -71.2 -33.5 162.2 16.1 21.0 45 45 A Q H ><5S+ 0 0 66 -4,-1.9 3,-1.2 4,-0.2 -2,-0.2 0.895 104.7 52.5 -65.8 -44.7 162.5 14.1 17.7 46 46 A E H 3<5S+ 0 0 174 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.824 110.6 49.6 -62.6 -30.2 164.3 11.2 19.4 47 47 A A T 3<5S- 0 0 18 -4,-1.1 -1,-0.3 -5,-0.1 -2,-0.2 0.513 117.4-115.5 -84.6 -8.0 161.5 11.1 22.0 48 48 A G T < 5S+ 0 0 9 -3,-1.2 16,-2.1 -4,-0.3 17,-0.4 0.590 86.3 114.9 82.0 14.6 158.8 11.1 19.3 49 49 A F S - 0 0 0 -13,-2.9 3,-0.7 -18,-0.1 4,-0.1 -0.378 13.9-113.0 -88.4 169.7 155.3 13.6 16.5 63 63 A P T > S+ 0 0 33 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.671 97.1 80.4 -81.5 -17.6 153.3 10.4 17.1 64 64 A Q T 3> S+ 0 0 39 -16,-2.1 4,-0.8 1,-0.3 3,-0.2 0.622 80.7 68.7 -69.5 -7.5 154.4 9.6 20.7 65 65 A V H <> S+ 0 0 0 -3,-0.7 4,-2.3 -17,-0.4 -1,-0.3 0.677 85.7 72.5 -77.7 -20.2 151.9 12.2 22.3 66 66 A L H <> S+ 0 0 10 -3,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.901 96.6 45.8 -65.3 -42.7 149.0 10.0 21.1 67 67 A R H > S+ 0 0 10 -4,-0.4 4,-1.5 -3,-0.2 -1,-0.2 0.892 114.5 49.3 -64.9 -41.8 149.6 7.3 23.8 68 68 A L H X S+ 0 0 5 -4,-0.8 4,-2.2 2,-0.2 -2,-0.2 0.847 107.9 53.0 -68.7 -38.4 150.1 9.9 26.5 69 69 A A H X S+ 0 0 3 -4,-2.3 4,-2.6 251,-0.3 -1,-0.2 0.894 107.4 52.6 -63.8 -38.9 146.8 11.7 25.5 70 70 A A H X S+ 0 0 14 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.873 111.7 45.4 -63.9 -38.6 144.9 8.4 25.8 71 71 A L H X S+ 0 0 1 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.873 111.5 52.5 -73.0 -36.7 146.3 7.9 29.4 72 72 A R H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.912 108.9 50.1 -62.9 -45.6 145.5 11.6 30.3 73 73 A E H < S+ 0 0 116 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.915 113.2 46.7 -56.3 -44.8 141.9 11.1 29.0 74 74 A A H < S+ 0 0 60 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.901 115.1 46.6 -65.9 -42.2 141.7 7.9 31.2 75 75 A S H < S+ 0 0 18 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.862 128.4 20.5 -67.2 -48.8 143.2 9.7 34.3 76 76 A V S < S- 0 0 5 -4,-3.0 -1,-0.3 -5,-0.1 -2,-0.1 -0.784 73.8-167.6-127.4 89.4 141.0 12.9 34.0 77 77 A P >> - 0 0 68 0, 0.0 4,-1.9 0, 0.0 3,-0.8 -0.359 40.9-103.2 -66.5 156.1 137.7 12.5 32.1 78 78 A I H 3> S+ 0 0 39 1,-0.2 4,-1.5 2,-0.2 166,-0.0 0.842 123.5 52.0 -49.7 -39.4 135.9 16.0 31.2 79 79 A L H 3> S+ 0 0 47 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.827 108.2 50.5 -72.0 -28.2 133.3 15.4 34.0 80 80 A S H <4 S+ 0 0 58 -3,-0.8 4,-0.5 1,-0.2 3,-0.4 0.899 111.3 48.5 -72.7 -39.4 136.1 14.7 36.6 81 81 A A H X S+ 0 0 1 -4,-1.9 4,-0.8 1,-0.2 3,-0.3 0.773 106.6 58.9 -67.4 -30.5 137.8 18.0 35.5 82 82 A S H X S+ 0 0 0 -4,-1.5 4,-3.2 -5,-0.2 5,-0.3 0.783 85.6 78.9 -70.7 -30.7 134.5 19.8 35.8 83 83 A R H X S+ 0 0 119 -4,-0.9 4,-1.9 -3,-0.4 -1,-0.2 0.870 100.2 37.0 -48.1 -51.7 134.0 19.0 39.6 84 84 A R H > S+ 0 0 154 -4,-0.5 4,-2.3 -3,-0.3 -1,-0.2 0.868 118.1 51.4 -71.0 -38.6 136.5 21.7 40.9 85 85 A V H X S+ 0 0 7 -4,-0.8 4,-2.6 2,-0.2 -2,-0.2 0.941 113.2 43.8 -61.7 -51.4 135.4 24.2 38.2 86 86 A L H X S+ 0 0 2 -4,-3.2 4,-2.5 2,-0.2 -2,-0.2 0.901 113.9 51.1 -61.8 -46.8 131.7 23.9 39.0 87 87 A R H X S+ 0 0 142 -4,-1.9 4,-1.5 -5,-0.3 -1,-0.2 0.902 114.3 43.5 -53.8 -51.5 132.3 23.9 42.8 88 88 A E H X S+ 0 0 82 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.902 114.1 49.0 -66.8 -43.8 134.4 27.2 42.5 89 89 A L H X S+ 0 0 2 -4,-2.6 4,-2.4 1,-0.2 6,-0.3 0.881 110.0 52.2 -64.8 -39.0 132.0 28.9 40.1 90 90 A S H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.853 112.1 46.9 -64.9 -34.0 129.0 28.0 42.3 91 91 A E H < S+ 0 0 78 -4,-1.5 -2,-0.2 2,-0.2 -1,-0.2 0.880 113.8 46.8 -75.1 -37.6 130.8 29.6 45.3 92 92 A D H < S+ 0 0 102 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.845 124.3 31.2 -71.7 -37.2 131.9 32.7 43.4 93 93 A T H < S- 0 0 1 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.646 95.0-133.4 -95.2 -22.6 128.4 33.4 41.9 94 94 A G S < S+ 0 0 2 -4,-1.6 24,-0.4 1,-0.3 2,-0.2 0.560 73.3 103.0 75.6 12.0 126.2 31.9 44.8 95 95 A E S S- 0 0 3 -6,-0.3 -1,-0.3 -5,-0.2 2,-0.3 -0.689 82.3 -82.2-124.0 168.2 124.2 30.1 42.1 96 96 A T E -D 216 0C 0 120,-1.2 120,-2.9 -2,-0.2 2,-0.3 -0.559 43.4-163.7 -72.2 132.5 123.8 26.6 40.5 97 97 A T E -DE 215 113C 0 16,-2.0 16,-2.2 -2,-0.3 2,-0.3 -0.881 8.7-178.9-117.3 148.8 126.4 25.8 37.8 98 98 A H E -DE 214 112C 11 116,-2.2 116,-2.8 -2,-0.3 2,-0.5 -0.996 22.1-144.3-152.2 147.1 126.2 23.0 35.3 99 99 A L E -DE 213 111C 0 12,-2.8 11,-2.4 -2,-0.3 12,-1.4 -0.941 19.3-169.8-108.4 125.4 128.2 21.4 32.4 100 100 A S E -DE 212 109C 0 112,-2.8 112,-2.2 -2,-0.5 2,-0.4 -0.924 5.2-160.6-116.7 141.5 126.2 20.1 29.4 101 101 A L E -DE 211 108C 23 7,-2.6 7,-2.5 -2,-0.4 2,-0.4 -0.952 26.1-106.9-125.2 149.0 127.8 18.0 26.7 102 102 A L E - E 0 107C 50 108,-3.0 2,-0.6 -2,-0.4 5,-0.2 -0.565 30.1-173.1 -70.8 120.3 126.9 17.1 23.1 103 103 A Q E > - E 0 106C 109 3,-3.3 3,-1.2 -2,-0.4 2,-0.6 -0.814 66.1 -61.1-117.7 79.9 125.7 13.4 23.1 104 104 A G T 3 S- 0 0 70 -2,-0.6 -2,-0.0 1,-0.2 0, 0.0 -0.677 120.3 -12.8 80.5-116.3 125.3 12.9 19.4 105 105 A E T 3 S+ 0 0 153 -2,-0.6 2,-0.3 -3,-0.1 -1,-0.2 0.393 126.8 73.2 -98.4 2.9 122.7 15.4 18.1 106 106 A Q E < S-E 103 0C 89 -3,-1.2 -3,-3.3 25,-0.0 2,-0.5 -0.784 72.9-130.2-118.4 160.7 121.4 16.3 21.6 107 107 A L E -EF 102 130C 0 23,-0.6 23,-2.9 -2,-0.3 2,-0.4 -0.948 27.6-173.7-110.7 117.1 122.7 18.5 24.5 108 108 A A E -EF 101 129C 2 -7,-2.5 -7,-2.6 -2,-0.5 2,-0.5 -0.961 26.6-128.9-119.6 129.8 122.6 16.8 28.0 109 109 A S E +EF 100 128C 0 19,-2.8 18,-3.2 -2,-0.4 19,-0.7 -0.644 36.6 167.1 -73.7 116.2 123.4 18.3 31.4 110 110 A L E + 0 0 35 -11,-2.4 2,-0.3 -2,-0.5 -10,-0.2 0.607 56.0 24.3-114.6 -12.6 125.8 15.8 32.9 111 111 A S E +E 99 0C 0 -12,-1.4 -12,-2.8 14,-0.1 -1,-0.3 -0.984 62.8 169.4-152.1 142.1 127.5 17.4 36.0 112 112 A H E -E 98 0C 46 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.2 -0.962 16.4-152.1-146.8 165.6 126.3 20.2 38.3 113 113 A A E -E 97 0C 17 -16,-2.2 -16,-2.0 -2,-0.3 2,-0.3 -0.986 9.9-143.8-141.3 145.6 127.1 21.9 41.6 114 114 A Y - 0 0 66 -2,-0.3 2,-0.2 -18,-0.2 -18,-0.1 -0.850 23.5-120.1-106.0 145.4 125.0 23.8 44.2 115 115 A S - 0 0 5 -2,-0.3 -24,-0.1 -21,-0.2 -19,-0.1 -0.571 4.4-141.6 -83.2 152.5 126.3 26.9 46.1 116 116 A S S S+ 0 0 89 -2,-0.2 -1,-0.1 1,-0.1 -25,-0.1 0.753 90.6 72.7 -78.3 -26.3 126.5 26.9 49.9 117 117 A R S S+ 0 0 130 -27,-0.2 2,-0.4 -22,-0.1 -1,-0.1 0.860 91.4 43.9 -61.6 -56.0 125.3 30.6 50.0 118 118 A N - 0 0 49 -24,-0.4 -3,-0.1 1,-0.1 516,-0.1 -0.860 56.2-155.5-106.8 141.6 121.6 30.6 49.1 119 119 A A S S+ 0 0 9 -2,-0.4 515,-3.4 585,-0.3 2,-0.6 0.803 87.9 65.9 -74.4 -34.1 118.9 28.1 50.5 120 120 A T E S+I 633 0D 12 513,-0.3 2,-0.3 511,-0.1 513,-0.3 -0.845 75.7 165.5 -92.7 116.6 116.6 28.7 47.4 121 121 A K E -I 632 0D 28 511,-2.8 511,-2.6 -2,-0.6 2,-0.7 -0.901 48.1-101.3-129.3 161.8 118.5 27.3 44.4 122 122 A V E -I 631 0D 7 94,-0.4 2,-0.3 -2,-0.3 509,-0.2 -0.765 49.5-145.8 -80.7 113.7 117.9 26.3 40.7 123 123 A X - 0 0 55 507,-2.9 2,-0.3 -2,-0.7 -9,-0.0 -0.666 20.6-177.1 -90.2 145.2 117.6 22.5 41.1 124 124 A X - 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H 0 195C 4 0, 0.0 3,-1.6 0, 0.0 4,-0.3 -0.478 31.2-127.8 -68.1 142.5 116.4 32.7 39.9 219 219 A T G > S+ 0 0 47 -25,-2.1 3,-2.1 1,-0.3 -24,-0.1 0.902 109.1 64.9 -55.5 -39.7 115.3 35.8 38.1 220 220 A S G 3 S+ 0 0 81 -26,-0.3 -1,-0.3 1,-0.3 -25,-0.1 0.662 104.5 46.0 -57.3 -21.8 114.5 37.3 41.6 221 221 A R G < S+ 0 0 39 -3,-1.6 2,-2.0 1,-0.1 -1,-0.3 0.320 78.0 108.7-105.2 3.9 118.3 37.2 42.4 222 222 A X < + 0 0 18 -3,-2.1 -1,-0.1 -4,-0.3 -3,-0.1 -0.526 52.1 168.0 -83.6 71.9 119.5 38.7 39.0 223 223 A T > - 0 0 63 -2,-2.0 4,-2.8 1,-0.1 5,-0.2 -0.356 53.1-100.3 -78.7 165.2 120.6 42.0 40.6 224 224 A P H > S+ 0 0 81 0, 0.0 4,-1.0 0, 0.0 5,-0.1 0.891 126.4 50.0 -54.3 -39.8 122.7 44.7 38.9 225 225 A D H > S+ 0 0 101 2,-0.2 4,-1.5 1,-0.2 3,-0.4 0.897 112.0 46.3 -65.2 -43.0 125.8 43.4 40.9 226 226 A Q H > S+ 0 0 33 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.882 107.4 58.0 -66.8 -39.3 125.1 39.7 39.8 227 227 A K H < S+ 0 0 112 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.760 115.6 36.9 -61.0 -25.9 124.5 40.8 36.2 228 228 A R H < S+ 0 0 164 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.667 119.6 45.9-102.4 -20.0 128.0 42.2 36.2 229 229 A T H X S+ 0 0 54 -4,-1.5 4,-1.5 2,-0.1 -2,-0.2 0.785 104.2 59.8 -90.0 -37.0 129.8 39.6 38.4 230 230 A I H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 5,-0.3 0.963 100.3 54.1 -62.0 -53.4 128.5 36.4 36.7 231 231 A P H > S+ 0 0 21 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.895 111.5 42.4 -53.8 -49.5 129.9 37.0 33.2 232 232 A P H > S+ 0 0 78 0, 0.0 4,-2.0 0, 0.0 -2,-0.2 0.897 118.0 47.6 -61.6 -39.1 133.6 37.6 34.2 233 233 A A H X S+ 0 0 23 -4,-1.5 4,-2.1 2,-0.2 -3,-0.1 0.905 115.1 44.7 -65.8 -43.7 133.5 34.6 36.6 234 234 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 -1,-0.2 0.910 111.8 52.2 -68.2 -44.2 131.8 32.3 34.1 235 235 A R H X S+ 0 0 90 -4,-2.6 4,-1.9 -5,-0.3 -2,-0.2 0.913 112.5 46.3 -56.7 -45.8 134.2 33.3 31.2 236 236 A A H X S+ 0 0 57 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.910 113.0 48.6 -63.3 -46.9 137.2 32.6 33.4 237 237 A A H X S+ 0 0 14 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.871 109.7 53.4 -63.3 -39.2 135.8 29.2 34.6 238 238 A G H X S+ 0 0 4 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.905 111.3 44.5 -60.4 -45.3 135.0 28.2 30.9 239 239 A L H X S+ 0 0 75 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.891 111.6 54.2 -67.3 -41.4 138.6 28.9 29.9 240 240 A S H X S+ 0 0 50 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.874 111.2 45.1 -59.2 -41.0 139.9 27.1 33.0 241 241 A L H X S+ 0 0 0 -4,-2.1 4,-0.8 2,-0.2 -2,-0.2 0.914 109.4 54.8 -70.3 -42.1 137.8 24.0 32.0 242 242 A T H ><>S+ 0 0 9 -4,-2.2 5,-3.1 1,-0.2 3,-0.7 0.892 109.4 49.5 -57.0 -40.7 138.9 24.2 28.3 243 243 A E H ><5S+ 0 0 135 -4,-2.1 3,-1.5 1,-0.2 -1,-0.2 0.879 103.8 57.7 -67.3 -41.6 142.6 24.1 29.6 244 244 A R H 3<5S+ 0 0 46 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.635 114.0 40.5 -65.7 -14.8 141.9 21.0 31.9 245 245 A I T <<5S- 0 0 18 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.250 115.9-112.2-116.4 10.3 140.8 19.1 28.7 246 246 A G T < 5 + 0 0 5 -3,-1.5 -3,-0.2 1,-0.2 79,-0.1 0.761 60.1 165.9 64.3 29.5 143.5 20.5 26.4 247 247 A G < - 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0 0 100 40,-0.1 2,-0.4 33,-0.0 40,-0.2 -0.995 67.0-179.3-128.0 127.7 149.2 7.9 39.2 276 21 B I B -K 314 0F 5 38,-2.7 38,-3.5 -2,-0.4 2,-0.1 -0.998 18.5-138.6-131.8 132.9 152.8 7.6 40.4 277 22 B G > - 0 0 21 -2,-0.4 4,-2.1 36,-0.3 5,-0.2 -0.448 30.2-109.4 -80.0 159.4 154.4 8.9 43.6 278 23 B L H > S+ 0 0 35 34,-0.5 4,-1.8 1,-0.2 5,-0.1 0.842 118.4 49.6 -56.9 -40.7 157.9 10.6 43.6 279 24 B S H > S+ 0 0 50 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.900 112.0 46.6 -67.3 -45.4 159.5 7.5 45.5 280 25 B D H > S+ 0 0 82 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.855 112.2 51.1 -65.1 -35.6 158.0 4.9 43.1 281 26 B L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 6,-0.3 0.875 108.7 51.0 -70.3 -36.6 159.1 7.0 40.1 282 27 B T H X S+ 0 0 31 -4,-1.8 4,-2.0 2,-0.2 5,-0.3 0.915 112.4 48.1 -63.0 -45.7 162.7 7.2 41.6 283 28 B R H < S+ 0 0 175 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.878 115.9 43.5 -58.4 -49.1 162.6 3.3 42.0 284 29 B L H < S+ 0 0 66 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.805 118.9 40.6 -70.7 -39.9 161.3 2.8 38.4 285 30 B S H < S- 0 0 23 -4,-2.4 -2,-0.2 2,-0.1 -1,-0.2 0.762 94.1-134.3 -83.8 -31.2 163.6 5.2 36.6 286 31 B G < + 0 0 70 -4,-2.0 2,-0.2 1,-0.3 -3,-0.1 0.404 64.9 124.0 87.4 -0.0 166.8 4.5 38.5 287 32 B X S S- 0 0 31 -6,-0.3 -1,-0.3 -5,-0.3 -2,-0.1 -0.512 71.7 -90.0 -87.0 159.7 167.5 8.3 38.8 288 33 B N > - 0 0 120 -2,-0.2 4,-2.3 1,-0.1 3,-0.3 -0.355 34.9-115.2 -67.5 151.3 168.0 10.1 42.2 289 34 B K H > S+ 0 0 100 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.881 117.7 52.1 -52.5 -45.4 164.9 11.5 43.9 290 35 B A H > S+ 0 0 61 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.833 109.7 48.7 -61.6 -39.5 166.2 15.1 43.5 291 36 B T H > S+ 0 0 32 -3,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.939 113.6 46.4 -65.4 -49.6 166.7 14.5 39.7 292 37 B V H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.914 113.1 50.1 -58.7 -46.7 163.2 13.1 39.3 293 38 B Y H X S+ 0 0 130 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.877 112.4 46.2 -61.1 -44.3 161.7 15.9 41.4 294 39 B R H X S+ 0 0 143 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.910 116.2 44.9 -64.8 -45.4 163.5 18.7 39.3 295 40 B L H X S+ 0 0 6 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.899 114.5 48.3 -65.9 -43.4 162.5 17.0 35.9 296 41 B X H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.818 110.5 51.7 -68.8 -30.6 158.9 16.4 37.1 297 42 B S H X S+ 0 0 25 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.875 109.0 50.8 -74.1 -31.8 158.6 20.1 38.3 298 43 B E H X S+ 0 0 26 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.901 113.0 45.6 -68.5 -38.3 159.8 21.3 34.9 299 44 B L H <>S+ 0 0 0 -4,-1.9 5,-2.7 2,-0.2 6,-0.8 0.849 112.0 53.0 -70.4 -35.0 157.2 19.0 33.2 300 45 B Q H ><5S+ 0 0 73 -4,-2.0 3,-1.1 4,-0.2 -2,-0.2 0.895 104.9 53.2 -66.1 -44.3 154.6 20.3 35.8 301 46 B E H 3<5S+ 0 0 145 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.851 111.6 47.8 -60.1 -34.6 155.4 24.0 35.0 302 47 B A T 3<5S- 0 0 34 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.495 117.4-114.1 -84.3 -8.4 154.7 23.1 31.2 303 48 B G T < 5S+ 0 0 20 -3,-1.1 16,-2.3 -4,-0.4 17,-0.3 0.635 86.1 115.9 82.5 17.4 151.4 21.3 32.0 304 49 B F S - 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