==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR 07-APR-12 4EJU . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR TCAR; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS EPIDERMIDIS; . AUTHOR Y.M.CHANG,C.K.M.CHEN,A.H.J.WANG . 296 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17112.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 234 79.1 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 . 13 4.4 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 . 11 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 180 60.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 0 2 0 1 0 1 0 1 2 0 0 0 0 0 0 2 0 2 1 0 0 0 0 0 0 1 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 . 2 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A R > 0 0 206 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -64.5 -17.1 -19.0 16.5 2 4 A R H >> + 0 0 136 2,-0.2 4,-1.9 3,-0.1 3,-0.7 0.975 360.0 34.8 -70.6 -64.5 -15.0 -17.0 14.1 3 5 A I H 3> S+ 0 0 35 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.871 116.2 60.8 -60.2 -34.4 -12.7 -19.9 13.4 4 6 A E H 3> S+ 0 0 44 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.855 104.9 45.8 -64.8 -33.6 -15.8 -22.1 13.8 5 7 A D H < S+ 0 0 44 -4,-1.4 3,-0.5 2,-0.2 4,-0.4 0.894 112.7 48.2 -71.7 -40.5 -20.7 -34.6 -12.0 24 26 A L H 3< S+ 0 0 36 -4,-2.5 4,-0.3 1,-0.2 3,-0.2 0.835 119.7 41.5 -69.4 -29.5 -18.1 -33.4 -14.5 25 27 A L H 3X S+ 0 0 1 -4,-2.6 4,-2.5 -5,-0.2 5,-0.3 0.407 83.4 97.1 -96.5 -0.7 -16.4 -36.8 -14.3 26 28 A K H S+ 0 0 138 -4,-0.4 4,-2.3 -3,-0.2 -1,-0.2 0.927 112.4 47.1 -66.5 -45.5 -19.2 -39.9 -18.0 28 30 A L H > S+ 0 0 15 -4,-0.3 4,-1.5 2,-0.2 -2,-0.2 0.916 114.3 48.5 -62.8 -45.5 -15.4 -40.5 -18.1 29 31 A Q H ><>S+ 0 0 13 -4,-2.5 5,-2.2 1,-0.2 3,-0.5 0.945 110.3 50.7 -60.4 -46.9 -15.6 -42.8 -15.1 30 32 A T H ><5S+ 0 0 97 -4,-2.4 3,-1.1 -5,-0.3 -1,-0.2 0.886 106.6 56.8 -57.1 -39.5 -18.5 -44.7 -16.7 31 33 A E H 3<5S+ 0 0 129 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.813 110.7 42.9 -61.9 -36.2 -16.4 -45.0 -19.9 32 34 A Y T <<5S- 0 0 12 -4,-1.5 -1,-0.3 -3,-0.5 -2,-0.2 0.368 115.6-112.6 -91.4 1.6 -13.6 -46.8 -18.0 33 35 A G T < 5S+ 0 0 59 -3,-1.1 2,-0.3 -4,-0.5 -3,-0.2 0.828 73.7 122.8 72.6 31.5 -15.9 -49.0 -15.9 34 36 A I < - 0 0 13 -5,-2.2 -1,-0.2 -6,-0.1 2,-0.2 -0.860 55.0-126.4-128.7 161.0 -15.2 -47.4 -12.5 35 37 A S >> - 0 0 38 -2,-0.3 4,-1.9 1,-0.1 3,-0.6 -0.498 40.3 -97.7 -94.2 167.0 -16.9 -45.7 -9.6 36 38 A A H 3> S+ 0 0 42 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.912 123.2 46.3 -50.1 -49.3 -16.0 -42.3 -8.1 37 39 A E H 3> S+ 0 0 86 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.751 108.8 53.4 -70.7 -22.8 -13.9 -43.8 -5.3 38 40 A Q H <> S+ 0 0 13 -3,-0.6 4,-1.4 2,-0.2 -1,-0.2 0.836 108.6 53.2 -76.8 -31.4 -12.1 -46.2 -7.6 39 41 A S H X S+ 0 0 5 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.835 102.4 57.9 -68.8 -33.7 -11.3 -43.1 -9.5 40 42 A H H X S+ 0 0 57 -4,-1.4 4,-1.9 1,-0.2 -1,-0.2 0.864 102.3 53.9 -63.5 -40.5 -10.0 -41.5 -6.3 41 43 A V H X S+ 0 0 4 -4,-1.3 4,-1.8 1,-0.2 -1,-0.2 0.918 105.5 54.0 -61.8 -42.9 -7.5 -44.2 -5.9 42 44 A L H X S+ 0 0 0 -4,-1.4 4,-0.7 1,-0.2 -1,-0.2 0.841 106.1 51.8 -62.2 -32.0 -6.3 -43.5 -9.4 43 45 A N H < S+ 0 0 10 -4,-1.4 3,-0.4 1,-0.2 4,-0.3 0.877 108.7 51.7 -72.7 -35.5 -5.7 -39.8 -8.5 44 46 A M H X S+ 0 0 15 -4,-1.9 4,-0.8 1,-0.2 3,-0.4 0.841 111.0 46.7 -67.1 -35.0 -3.6 -40.8 -5.5 45 47 A L H < S+ 0 0 7 -4,-1.8 52,-0.4 2,-0.2 -1,-0.2 0.568 98.4 67.2 -85.0 -10.5 -1.4 -43.1 -7.5 46 48 A S T < S+ 0 0 40 -4,-0.7 -1,-0.2 -3,-0.4 -2,-0.2 0.563 104.1 50.2 -81.3 -12.0 -0.8 -40.5 -10.3 47 49 A I T 4 S- 0 0 107 -3,-0.4 2,-0.3 1,-0.4 -2,-0.2 0.802 134.4 -26.5 -89.7 -39.6 1.0 -38.8 -7.5 48 50 A E < - 0 0 81 -4,-0.8 -1,-0.4 0, 0.0 2,-0.2 -0.972 68.2 -91.6-169.9 159.8 3.0 -41.8 -6.6 49 51 A A + 0 0 29 -2,-0.3 2,-0.3 -3,-0.1 47,-0.3 -0.593 54.8 174.2 -78.5 141.2 3.1 -45.7 -6.7 50 52 A L B -A 95 0A 5 45,-3.5 45,-4.3 -2,-0.2 2,-0.3 -0.874 31.0-117.8-143.1 177.4 1.6 -47.1 -3.5 51 53 A T >> - 0 0 26 -2,-0.3 4,-1.7 43,-0.2 3,-0.9 -0.899 37.9-107.8-118.6 150.0 0.5 -50.2 -1.6 52 54 A V H 3> S+ 0 0 51 -2,-0.3 4,-1.4 1,-0.3 -1,-0.1 0.813 120.9 54.6 -43.0 -39.6 -3.0 -50.9 -0.3 53 55 A G H 3> S+ 0 0 38 1,-0.2 4,-1.3 2,-0.2 5,-0.3 0.923 105.3 50.3 -65.1 -43.9 -1.8 -50.2 3.2 54 56 A Q H <> S+ 0 0 80 -3,-0.9 4,-0.6 1,-0.2 -1,-0.2 0.814 114.8 43.9 -65.9 -29.6 -0.4 -46.8 2.4 55 57 A I H < S+ 0 0 3 -4,-1.7 -1,-0.2 2,-0.1 -2,-0.2 0.697 105.3 64.8 -90.2 -16.9 -3.6 -45.7 0.7 56 58 A T H X>S+ 0 0 22 -4,-1.4 5,-0.6 -5,-0.3 4,-0.5 0.998 109.1 32.2 -69.9 -63.6 -5.9 -47.1 3.4 57 59 A E H <5S+ 0 0 95 -4,-1.3 2,-1.1 1,-0.3 -1,-0.2 0.774 109.9 69.6 -65.9 -20.1 -5.0 -45.0 6.4 58 60 A K T <5S+ 0 0 83 -4,-0.6 -1,-0.3 -5,-0.3 109,-0.1 -0.332 116.5 25.0 -90.1 50.9 -4.2 -42.0 4.2 59 61 A Q T 45S- 0 0 44 -2,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 -0.065 113.7-137.8 175.4 -15.5 -7.9 -41.7 3.4 60 62 A G T <5 + 0 0 29 -4,-0.5 2,-0.3 1,-0.1 -3,-0.2 0.886 48.8 122.3 37.5 80.3 -8.5 -43.5 6.7 61 63 A V < - 0 0 69 -5,-0.6 -1,-0.1 122,-0.0 -2,-0.0 -0.897 66.2 -43.3-149.4 179.3 -11.3 -46.1 6.4 62 64 A N > - 0 0 101 -2,-0.3 4,-1.0 1,-0.1 3,-0.4 -0.251 52.7-132.0 -50.7 120.2 -12.1 -49.8 6.8 63 65 A K H > S+ 0 0 152 1,-0.2 4,-1.6 2,-0.2 3,-0.1 0.795 96.3 53.6 -41.7 -51.8 -9.2 -51.9 5.4 64 66 A A H > S+ 0 0 55 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.912 100.8 58.1 -56.6 -50.5 -11.2 -54.4 3.2 65 67 A A H > S+ 0 0 16 -3,-0.4 4,-2.1 1,-0.3 -1,-0.2 0.885 108.3 46.9 -49.8 -46.6 -13.2 -51.9 1.1 66 68 A V H X S+ 0 0 2 -4,-1.0 4,-2.0 1,-0.2 -1,-0.3 0.908 109.7 53.6 -64.8 -40.7 -10.0 -50.3 -0.1 67 69 A S H X S+ 0 0 64 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.916 108.1 52.6 -59.0 -40.8 -8.6 -53.8 -0.9 68 70 A R H X S+ 0 0 142 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.912 108.7 47.5 -58.8 -50.2 -11.8 -54.5 -2.9 69 71 A R H X S+ 0 0 66 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.803 109.1 53.3 -65.6 -31.9 -11.4 -51.3 -5.0 70 72 A V H X S+ 0 0 8 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.895 109.7 49.8 -70.5 -35.4 -7.8 -52.0 -5.8 71 73 A K H X S+ 0 0 133 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.899 109.1 51.5 -67.9 -38.6 -8.8 -55.5 -7.0 72 74 A K H X S+ 0 0 133 -4,-2.1 4,-0.7 1,-0.2 -1,-0.2 0.882 112.1 46.8 -65.2 -38.5 -11.5 -54.0 -9.2 73 75 A L H <>S+ 0 0 0 -4,-1.8 5,-2.2 2,-0.2 6,-0.8 0.867 108.5 54.3 -71.3 -37.3 -8.9 -51.6 -10.7 74 76 A L H ><5S+ 0 0 51 -4,-2.3 3,-1.5 1,-0.2 5,-0.2 0.969 111.9 44.4 -61.0 -50.8 -6.3 -54.3 -11.2 75 77 A N H 3<5S+ 0 0 131 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.655 109.9 55.2 -68.1 -15.1 -8.9 -56.4 -13.2 76 78 A A T 3<5S- 0 0 27 -4,-0.7 -1,-0.3 -5,-0.2 -2,-0.2 0.501 111.0-131.4 -89.8 -6.6 -9.9 -53.2 -15.1 77 79 A E T < 5S+ 0 0 146 -3,-1.5 23,-0.4 -4,-0.4 24,-0.3 0.805 75.0 119.2 60.8 37.1 -6.2 -53.0 -15.9 78 80 A L S - 0 0 16 -20,-1.4 4,-1.2 -2,-0.2 5,-0.1 -0.262 39.8 -96.9 -89.2-175.8 -0.9 -48.9 -16.1 99 101 A N H > S+ 0 0 130 2,-0.2 4,-1.2 1,-0.2 -21,-0.1 0.626 127.2 53.9 -82.2 -10.3 -0.9 -46.8 -19.2 100 102 A K H > S+ 0 0 87 -23,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.785 105.8 54.9 -85.6 -30.4 -4.7 -46.9 -19.5 101 103 A G H > S+ 0 0 0 -24,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.871 109.5 45.4 -67.3 -38.0 -4.8 -45.6 -15.9 102 104 A K H X S+ 0 0 107 -4,-1.2 4,-2.4 2,-0.2 5,-0.2 0.858 107.5 58.1 -74.0 -37.8 -2.6 -42.6 -16.9 103 105 A K H X S+ 0 0 114 -4,-1.2 4,-1.7 1,-0.2 -2,-0.2 0.905 109.1 46.8 -57.2 -39.6 -4.7 -42.0 -20.0 104 106 A Y H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.928 108.7 53.5 -65.6 -49.1 -7.7 -41.6 -17.7 105 107 A I H X S+ 0 0 4 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.873 109.7 49.1 -55.8 -36.9 -5.8 -39.3 -15.3 106 108 A K H X S+ 0 0 138 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.858 109.6 50.9 -73.2 -31.5 -5.0 -37.1 -18.3 107 109 A E H X S+ 0 0 68 -4,-1.7 4,-1.2 -5,-0.2 -2,-0.2 0.894 112.9 47.2 -69.1 -37.4 -8.6 -37.1 -19.5 108 110 A R H X S+ 0 0 19 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.915 111.1 50.2 -67.9 -44.5 -9.6 -36.1 -16.0 109 111 A K H X S+ 0 0 71 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.894 109.4 51.4 -60.6 -44.2 -6.9 -33.3 -15.7 110 112 A A H X S+ 0 0 63 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.836 111.1 47.8 -64.4 -32.9 -7.9 -31.7 -19.0 111 113 A I H X S+ 0 0 58 -4,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.897 114.6 45.6 -74.8 -39.7 -11.5 -31.6 -17.9 112 114 A M H X S+ 0 0 16 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.866 112.4 51.4 -70.8 -37.3 -10.7 -30.1 -14.5 113 115 A S H X S+ 0 0 26 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.896 107.8 49.9 -66.3 -45.4 -8.3 -27.6 -16.0 114 116 A H H X S+ 0 0 125 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.924 116.8 42.4 -59.1 -47.4 -10.6 -26.2 -18.7 115 117 A I H X S+ 0 0 16 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.879 115.8 47.7 -69.3 -41.5 -13.4 -25.7 -16.1 116 118 A A H < S+ 0 0 36 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.936 114.5 47.7 -65.3 -43.1 -11.1 -24.3 -13.4 117 119 A S H >X S+ 0 0 66 -4,-2.9 3,-2.4 1,-0.2 4,-1.2 0.962 110.2 51.1 -58.9 -57.0 -9.5 -21.9 -16.0 118 120 A D H >< S+ 0 0 85 -4,-2.6 3,-0.7 1,-0.3 -1,-0.2 0.908 110.8 48.4 -47.9 -51.4 -12.9 -20.7 -17.3 119 121 A M T 3< S+ 0 0 28 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.485 119.6 40.8 -69.6 0.1 -14.1 -19.9 -13.8 120 122 A T T X4 S+ 0 0 53 -3,-2.4 3,-2.0 -4,-0.1 -2,-0.2 0.448 77.0 104.6-131.1 1.0 -10.9 -18.1 -13.1 121 123 A S T << S+ 0 0 98 -4,-1.2 -2,-0.1 -3,-0.7 -3,-0.1 0.565 84.0 51.4 -63.0 -13.0 -10.0 -16.1 -16.2 122 124 A D T 3 S+ 0 0 98 -4,-0.2 -1,-0.3 2,-0.1 2,-0.1 0.354 90.9 107.0-103.0 0.8 -11.1 -12.8 -14.7 123 125 A F S < S- 0 0 34 -3,-2.0 2,-0.7 1,-0.1 -3,-0.1 -0.425 77.6-111.2 -83.3 158.3 -9.1 -13.3 -11.6 124 126 A D >> - 0 0 77 1,-0.1 4,-1.9 -2,-0.1 3,-1.2 -0.790 20.9-143.9 -90.9 121.0 -5.9 -11.5 -10.7 125 127 A S H 3> S+ 0 0 67 -2,-0.7 4,-1.9 1,-0.3 -1,-0.1 0.796 99.6 50.8 -47.6 -42.6 -3.0 -13.9 -10.9 126 128 A K H 3> S+ 0 0 128 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.707 107.7 54.5 -73.7 -21.8 -1.1 -12.4 -8.0 127 129 A E H <> S+ 0 0 74 -3,-1.2 4,-1.5 2,-0.2 -2,-0.2 0.893 109.3 46.0 -78.4 -40.2 -4.3 -12.6 -5.9 128 130 A I H X S+ 0 0 29 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.896 110.6 54.8 -67.8 -38.7 -4.6 -16.3 -6.5 129 131 A E H X S+ 0 0 93 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.909 107.0 49.0 -59.6 -44.9 -0.9 -16.8 -5.8 130 132 A K H X S+ 0 0 88 -4,-1.5 4,-1.4 2,-0.2 -1,-0.2 0.859 111.6 51.1 -61.8 -38.3 -1.2 -15.1 -2.3 131 133 A V H X S+ 0 0 12 -4,-1.5 4,-2.0 2,-0.2 5,-0.2 0.923 108.8 50.0 -65.8 -49.0 -4.2 -17.3 -1.5 132 134 A R H X S+ 0 0 35 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.879 105.6 57.9 -57.3 -39.1 -2.3 -20.4 -2.5 133 135 A Q H X S+ 0 0 109 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.915 107.7 46.9 -58.4 -40.0 0.5 -19.3 -0.3 134 136 A V H X S+ 0 0 8 -4,-1.4 4,-1.5 1,-0.2 -1,-0.2 0.846 113.8 46.4 -72.0 -34.8 -1.8 -19.2 2.7 135 137 A L H X S+ 0 0 16 -4,-2.0 4,-3.6 2,-0.2 -1,-0.2 0.812 106.0 62.1 -77.6 -25.7 -3.3 -22.6 1.9 136 138 A E H X S+ 0 0 85 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.907 107.1 43.1 -64.7 -38.4 0.2 -23.9 1.4 137 139 A I H X S+ 0 0 64 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.875 113.6 51.0 -77.9 -30.4 1.1 -23.2 4.9 138 140 A I H X S+ 0 0 31 -4,-1.5 4,-2.4 2,-0.2 5,-0.2 0.961 111.5 48.6 -65.6 -46.5 -2.2 -24.5 6.2 139 141 A D H X S+ 0 0 8 -4,-3.6 4,-2.7 1,-0.2 -2,-0.2 0.914 111.5 51.2 -55.0 -45.1 -1.6 -27.7 4.1 140 142 A Y H X S+ 0 0 160 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.896 111.2 45.9 -58.8 -46.7 1.9 -27.9 5.6 141 143 A R H X S+ 0 0 61 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.854 112.4 50.7 -66.9 -35.6 0.6 -27.6 9.2 142 144 A I H X S+ 0 0 12 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.934 112.6 48.1 -65.5 -48.3 -2.2 -30.2 8.6 143 145 A Q H X S+ 0 0 78 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.934 113.4 44.6 -59.1 -50.4 0.4 -32.6 7.2 144 146 A S H < S+ 0 0 39 -4,-2.6 4,-0.5 1,-0.2 -1,-0.2 0.871 113.5 51.8 -67.3 -30.1 2.9 -32.2 10.0 145 147 A Y H >< S+ 0 0 72 -4,-1.9 3,-0.6 1,-0.2 -1,-0.2 0.858 108.2 51.3 -70.5 -35.4 0.1 -32.4 12.6 146 148 A T H >< S+ 0 0 24 -4,-2.1 3,-2.8 1,-0.2 -2,-0.2 0.901 101.3 60.8 -67.3 -43.7 -1.2 -35.6 11.1 147 149 A S T 3< S+ 0 0 96 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.699 103.8 51.6 -59.4 -18.9 2.2 -37.2 11.1 148 150 A K T < 0 0 160 -3,-0.6 -1,-0.3 -4,-0.5 -2,-0.2 0.111 360.0 360.0-102.2 16.0 2.0 -36.7 14.9 149 151 A L < 0 0 148 -3,-2.8 -2,-0.2 0, 0.0 -3,-0.1 0.824 360.0 360.0 97.4 360.0 -1.4 -38.5 15.0 150 !* 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 0.0 151 5 B I 0 0 148 0, 0.0 -22,-0.0 0, 0.0 -26,-0.0 0.000 360.0 360.0 360.0 15.1 -1.6 -22.1 -12.9 152 6 B E > + 0 0 76 2,-0.0 4,-1.0 -36,-0.0 -39,-0.0 -0.087 360.0 75.3-156.8 -1.1 -3.2 -25.6 -13.2 153 7 B D H > S+ 0 0 84 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.605 88.4 69.3 -84.4 -12.9 -0.4 -26.8 -10.9 154 8 B H H > S+ 0 0 41 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.844 93.8 48.6 -67.6 -37.5 -3.1 -24.9 -8.9 155 9 B I H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.885 109.8 52.2 -69.7 -41.9 -5.7 -27.7 -9.5 156 10 B S H X S+ 0 0 51 -4,-1.0 4,-2.2 1,-0.2 -2,-0.2 0.910 109.6 49.2 -60.2 -47.2 -3.2 -30.3 -8.4 157 11 B F H X S+ 0 0 20 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.857 110.7 49.5 -63.0 -40.9 -2.5 -28.4 -5.2 158 12 B L H X S+ 0 0 47 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.905 109.8 51.3 -66.8 -38.2 -6.1 -27.9 -4.3 159 13 B E H X S+ 0 0 35 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.958 114.4 43.9 -63.3 -45.6 -6.8 -31.6 -4.9 160 14 B K H X S+ 0 0 93 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.837 111.9 52.9 -65.3 -35.0 -3.9 -32.5 -2.6 161 15 B F H X S+ 0 0 4 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.893 108.5 51.8 -69.0 -37.7 -5.0 -29.9 -0.0 162 16 B I H X S+ 0 0 7 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.913 110.3 47.5 -65.7 -40.5 -8.4 -31.4 -0.0 163 17 B N H X S+ 0 0 28 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.818 109.8 52.2 -72.4 -29.9 -7.1 -34.9 0.6 164 18 B D H X S+ 0 0 26 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.942 110.7 48.7 -70.1 -44.5 -4.9 -33.8 3.4 165 19 B V H X S+ 0 0 20 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.961 114.6 45.0 -54.1 -53.0 -7.8 -32.1 5.0 166 20 B N H X S+ 0 0 44 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.874 110.6 54.3 -59.2 -43.3 -9.9 -35.3 4.6 167 21 B T H X S+ 0 0 16 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.928 111.2 44.5 -56.7 -50.9 -7.1 -37.5 5.9 168 22 B L H X S+ 0 0 8 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.900 112.8 51.8 -63.0 -41.3 -6.7 -35.5 9.1 169 23 B T H X S+ 0 0 20 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.862 108.7 49.8 -63.5 -38.1 -10.5 -35.4 9.6 170 24 B A H < S+ 0 0 18 -4,-2.2 4,-0.4 2,-0.2 -1,-0.2 0.879 113.3 49.6 -67.2 -36.8 -10.9 -39.2 9.2 171 25 B K H >< S+ 0 0 70 -4,-1.9 3,-0.8 -5,-0.2 4,-0.3 0.951 113.1 43.3 -69.8 -46.2 -8.1 -39.5 11.7 172 26 B L H 3< S+ 0 0 36 -4,-3.0 4,-0.3 1,-0.2 -1,-0.2 0.787 120.5 40.6 -69.8 -27.8 -9.5 -37.1 14.3 173 27 B L T 3X S+ 0 0 0 -4,-1.8 4,-2.4 -5,-0.2 5,-0.3 0.231 79.3 105.4-107.1 13.5 -13.1 -38.4 14.1 174 28 B K H <> S+ 0 0 131 -3,-0.8 4,-1.7 -4,-0.4 5,-0.2 0.973 88.3 40.8 -56.5 -54.5 -12.5 -42.2 13.8 175 29 B D H > S+ 0 0 127 -4,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.878 115.6 51.0 -60.1 -42.8 -13.6 -42.8 17.4 176 30 B L H > S+ 0 0 12 -4,-0.3 4,-0.8 1,-0.2 -1,-0.2 0.879 112.4 45.1 -62.5 -42.6 -16.6 -40.4 17.2 177 31 B Q H <>S+ 0 0 19 -4,-2.4 5,-2.0 2,-0.2 4,-0.4 0.796 109.8 54.8 -75.4 -30.1 -18.0 -41.8 14.0 178 32 B T H ><5S+ 0 0 101 -4,-1.7 3,-1.5 -5,-0.3 -2,-0.2 0.962 107.1 50.4 -66.8 -50.0 -17.6 -45.4 15.1 179 33 B E H 3<5S+ 0 0 153 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.700 111.2 48.0 -59.9 -26.4 -19.6 -44.8 18.4 180 34 B Y T 3<5S- 0 0 54 -4,-0.8 -1,-0.3 -5,-0.1 -2,-0.2 0.489 114.2-116.1 -95.1 -3.5 -22.5 -43.1 16.5 181 35 B G T < 5 + 0 0 66 -3,-1.5 -3,-0.2 -4,-0.4 -2,-0.1 0.646 68.3 142.4 77.6 17.6 -22.6 -45.9 13.9 182 36 B I < - 0 0 20 -5,-2.0 2,-0.3 -6,-0.2 -1,-0.2 -0.306 45.0-145.7 -88.9 167.0 -21.7 -43.6 11.1 183 37 B S > - 0 0 37 -2,-0.1 4,-1.2 1,-0.0 3,-0.5 -0.822 37.3-104.9-122.8 163.6 -19.5 -43.7 8.0 184 38 B A H > S+ 0 0 34 -2,-0.3 4,-1.4 1,-0.2 3,-0.1 0.833 118.2 54.4 -60.4 -36.8 -17.5 -40.7 6.7 185 39 B E H > S+ 0 0 95 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.796 106.8 51.6 -68.7 -29.3 -19.9 -39.9 3.8 186 40 B Q H > S+ 0 0 24 -3,-0.5 4,-2.3 2,-0.2 -1,-0.2 0.775 103.9 57.2 -76.8 -29.6 -22.9 -39.8 6.2 187 41 B S H X S+ 0 0 0 -4,-1.2 4,-4.2 1,-0.2 5,-0.2 0.898 103.3 55.4 -65.3 -42.6 -21.2 -37.3 8.5 188 42 B H H X S+ 0 0 51 -4,-1.4 4,-1.9 2,-0.2 -1,-0.2 0.823 107.7 47.4 -59.7 -36.3 -20.8 -35.1 5.5 189 43 B V H X S+ 0 0 0 -4,-0.8 4,-2.1 2,-0.2 -1,-0.2 0.924 116.0 45.4 -70.2 -45.5 -24.5 -35.2 4.9 190 44 B L H X S+ 0 0 0 -4,-2.3 4,-0.9 2,-0.2 -2,-0.2 0.942 111.9 50.4 -60.6 -50.6 -25.1 -34.5 8.6 191 45 B N H >X S+ 0 0 8 -4,-4.2 3,-1.0 1,-0.2 4,-0.9 0.917 111.4 50.8 -53.6 -45.6 -22.5 -31.7 8.7 192 46 B M H >X S+ 0 0 5 -4,-1.9 4,-1.5 1,-0.3 3,-0.7 0.861 105.1 54.7 -59.2 -43.3 -24.2 -30.2 5.7 193 47 B L H 3< S+ 0 0 8 -4,-2.1 52,-0.4 1,-0.3 -1,-0.3 0.623 100.9 60.5 -68.6 -15.2 -27.6 -30.3 7.3 194 48 B S H << S+ 0 0 49 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.779 101.0 54.3 -83.0 -25.6 -26.3 -28.4 10.2 195 49 B I H << S- 0 0 56 -4,-0.9 2,-0.3 -3,-0.7 -2,-0.2 0.952 130.6 -14.1 -69.5 -46.8 -25.4 -25.6 7.7 196 50 B E < - 0 0 60 -4,-1.5 2,-0.3 2,-0.0 -1,-0.3 -0.997 68.0-103.0-156.6 152.8 -29.1 -25.5 6.5 197 51 B A - 0 0 54 -2,-0.3 2,-0.3 -3,-0.1 47,-0.2 -0.619 54.0-166.0 -73.7 131.6 -32.4 -27.5 6.6 198 52 B L B -C 243 0B 2 45,-1.7 45,-2.9 -2,-0.3 2,-0.2 -0.920 28.0-131.3-132.0 153.7 -32.7 -29.1 3.2 199 53 B T > - 0 0 20 -2,-0.3 4,-2.8 43,-0.2 43,-0.1 -0.534 34.4-119.4 -86.3 158.4 -35.0 -30.9 0.7 200 54 B V H > S+ 0 0 21 2,-0.2 4,-4.1 1,-0.2 5,-0.3 0.933 117.3 53.8 -65.3 -45.4 -33.7 -34.2 -0.8 201 55 B G H > S+ 0 0 34 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.875 112.0 48.6 -55.4 -31.8 -33.8 -32.8 -4.3 202 56 B Q H > S+ 0 0 90 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.966 112.9 44.6 -68.6 -55.6 -31.8 -30.1 -2.8 203 57 B I H X>S+ 0 0 1 -4,-2.8 4,-1.1 1,-0.2 5,-0.5 0.827 110.9 55.1 -58.7 -38.6 -29.3 -32.5 -1.1 204 58 B T H X5S+ 0 0 25 -4,-4.1 4,-1.2 2,-0.2 -1,-0.2 0.888 112.9 41.6 -64.3 -41.2 -29.1 -34.6 -4.3 205 59 B E H <5S+ 0 0 75 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.817 118.8 47.4 -76.0 -28.8 -28.1 -31.5 -6.4 206 60 B K H <5S+ 0 0 29 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.499 130.1 21.6 -90.2 -6.4 -25.8 -30.3 -3.6 207 61 B Q H <5S+ 0 0 19 -4,-1.1 -3,-0.2 -3,-0.2 -2,-0.2 0.392 95.7 175.7-127.6 -16.6 -24.1 -33.7 -3.0 208 62 B G << + 0 0 4 -4,-1.2 2,-0.2 -5,-0.5 -185,-0.1 0.571 24.4 116.6 1.0 91.4 -25.1 -34.9 -6.4 209 63 B V S S- 0 0 49 1,-0.4 2,-0.1 -5,-0.1 -1,-0.1 -0.262 87.6 -12.2-133.2-138.1 -23.7 -38.3 -7.4 210 64 B N S > S- 0 0 96 -2,-0.2 4,-0.7 1,-0.2 -1,-0.4 -0.493 70.3-140.9 -65.2 131.8 -26.1 -41.1 -8.1 211 65 B K H >> S+ 0 0 131 1,-0.2 4,-1.7 2,-0.2 3,-0.7 0.887 98.9 51.0 -62.9 -41.3 -29.4 -39.7 -6.8 212 66 B A H 3> S+ 0 0 53 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.794 104.2 58.7 -66.9 -29.5 -30.5 -43.1 -5.3 213 67 B A H 3> S+ 0 0 26 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.734 110.7 41.3 -73.3 -22.0 -27.2 -43.5 -3.5 214 68 B V H S+ 0 0 2 -4,-1.0 5,-2.6 2,-0.2 6,-1.1 0.853 112.6 46.0 -71.3 -30.4 -29.9 -41.4 8.8 222 76 B L H <5S+ 0 0 51 -4,-1.7 3,-0.4 2,-0.2 -2,-0.2 0.856 108.2 54.4 -77.5 -37.0 -33.6 -41.4 9.5 223 77 B N H <5S+ 0 0 143 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.886 113.9 43.5 -61.7 -33.8 -33.6 -45.1 10.2 224 78 B A T <5S- 0 0 39 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.584 110.4-129.4 -86.0 -10.3 -30.9 -44.2 12.8 225 79 B E T 5S+ 0 0 141 -3,-0.4 24,-0.4 -4,-0.3 23,-0.4 0.759 72.7 126.8 65.3 29.1 -33.0 -41.2 13.9 226 80 B L S - 0 0 12 -20,-1.7 4,-1.8 -21,-0.0 5,-0.1 -0.344 37.0 -86.8-103.8-171.0 -32.5 -34.4 15.4 247 101 B N H > S+ 0 0 110 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.905 129.7 47.2 -67.9 -41.4 -31.2 -34.1 19.0 248 102 B K H >> S+ 0 0 110 -23,-0.4 4,-1.7 1,-0.2 3,-0.6 0.960 114.0 48.3 -61.7 -49.9 -29.0 -37.1 18.7 249 103 B G H 3> S+ 0 0 0 -24,-0.4 4,-1.6 1,-0.3 -1,-0.2 0.834 108.8 55.2 -58.1 -33.9 -27.7 -35.8 15.4 250 104 B K H 3X S+ 0 0 84 -4,-1.8 4,-0.9 1,-0.2 -1,-0.3 0.804 105.0 51.9 -69.5 -34.8 -27.2 -32.4 17.0 251 105 B K H X S+ 0 0 9 -4,-2.7 4,-1.1 1,-0.2 3,-0.7 0.967 113.3 48.5 -59.5 -46.7 -8.0 -25.4 13.5 265 119 B S H 3X S+ 0 0 55 -4,-2.2 4,-0.9 -5,-0.3 3,-0.3 0.841 107.9 55.2 -57.9 -39.0 -7.5 -22.7 16.2 266 120 B D H 3< S+ 0 0 91 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.793 111.6 44.1 -65.9 -30.8 -4.2 -24.3 17.2 267 121 B M H << S+ 0 0 24 -4,-1.6 -1,-0.2 -3,-0.7 -2,-0.2 0.548 117.3 43.9 -89.4 -15.0 -3.0 -24.1 13.6 268 122 B T H >< S+ 0 0 37 -4,-1.1 3,-2.5 -3,-0.3 -2,-0.2 0.464 76.4 107.1-112.8 1.4 -4.1 -20.6 13.0 269 123 B S T 3< S+ 0 0 97 -4,-0.9 -1,-0.1 1,-0.3 -2,-0.1 0.730 83.4 47.3 -51.6 -31.0 -3.1 -18.8 16.2 270 124 B D T 3 S+ 0 0 99 -3,-0.1 -1,-0.3 -4,-0.1 2,-0.2 0.497 93.9 114.8 -88.9 -5.7 -0.2 -16.9 14.6 271 125 B F S < S- 0 0 25 -3,-2.5 2,-0.5 1,-0.1 -3,-0.1 -0.445 70.6-124.6 -73.0 139.7 -2.5 -15.9 11.7 272 126 B D >> - 0 0 79 -2,-0.2 4,-1.9 1,-0.1 3,-1.0 -0.703 17.5-138.6 -80.3 121.2 -3.6 -12.4 11.0 273 127 B S H 3> S+ 0 0 72 -2,-0.5 4,-2.2 1,-0.3 -1,-0.1 0.899 103.4 50.8 -45.5 -51.3 -7.4 -12.2 11.0 274 128 B K H 3> S+ 0 0 134 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.739 105.3 54.6 -59.8 -32.4 -7.4 -10.0 8.0 275 129 B E H <> S+ 0 0 55 -3,-1.0 4,-1.6 2,-0.2 -1,-0.2 0.933 113.4 43.9 -70.7 -41.8 -5.0 -12.2 5.9 276 130 B I H X S+ 0 0 29 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.839 109.8 55.1 -69.7 -34.7 -7.5 -15.1 6.5 277 131 B E H X S+ 0 0 64 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.941 107.9 49.0 -64.1 -47.6 -10.6 -13.0 5.8 278 132 B K H X S+ 0 0 122 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.886 111.0 50.3 -59.8 -40.3 -9.3 -12.0 2.4 279 133 B V H X S+ 0 0 9 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.905 110.5 50.5 -64.4 -40.2 -8.5 -15.6 1.6 280 134 B R H X S+ 0 0 38 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.884 106.2 55.4 -63.3 -40.4 -12.0 -16.5 2.6 281 135 B Q H X S+ 0 0 109 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.909 108.3 47.6 -58.9 -46.7 -13.5 -13.8 0.4 282 136 B V H X S+ 0 0 15 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.856 112.7 48.6 -64.3 -38.7 -11.7 -15.2 -2.7 283 137 B L H X S+ 0 0 16 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.810 104.8 59.6 -75.6 -25.0 -12.8 -18.8 -1.9 284 138 B E H X S+ 0 0 92 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.902 105.0 49.8 -64.8 -36.9 -16.4 -17.6 -1.4 285 139 B I H X S+ 0 0 68 -4,-1.3 4,-3.1 2,-0.2 -2,-0.2 0.934 112.7 46.7 -65.2 -46.5 -16.3 -16.3 -5.0 286 140 B I H X S+ 0 0 29 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.852 111.9 49.9 -66.8 -32.8 -15.1 -19.6 -6.2 287 141 B D H X S+ 0 0 7 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.925 110.3 51.9 -70.3 -39.5 -17.6 -21.5 -4.1 288 142 B Y H X S+ 0 0 166 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.962 113.2 43.7 -58.6 -53.1 -20.3 -19.2 -5.6 289 143 B R H X S+ 0 0 70 -4,-3.1 4,-3.2 2,-0.2 5,-0.2 0.914 111.4 52.5 -60.2 -46.0 -19.2 -20.0 -9.1 290 144 B I H X S+ 0 0 10 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.938 113.1 46.0 -54.8 -46.9 -18.8 -23.7 -8.4 291 145 B Q H X S+ 0 0 57 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.952 112.4 50.0 -61.6 -48.7 -22.4 -23.8 -7.1 292 146 B S H X S+ 0 0 49 -4,-2.9 4,-0.7 -5,-0.2 -2,-0.2 0.930 115.4 43.5 -55.4 -46.1 -23.6 -21.7 -10.0 293 147 B Y H < S+ 0 0 74 -4,-3.2 3,-0.5 1,-0.2 -1,-0.2 0.831 112.4 51.7 -67.5 -37.6 -21.9 -24.1 -12.4 294 148 B T H < S+ 0 0 11 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.865 99.4 68.2 -66.1 -36.8 -23.0 -27.2 -10.6 295 149 B S H < S+ 0 0 82 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.809 108.0 33.9 -51.4 -40.5 -26.5 -25.9 -10.8 296 150 B K < 0 0 155 -4,-0.7 -3,-0.1 -3,-0.5 -2,-0.0 0.536 360.0 360.0 -87.0-125.7 -26.7 -26.3 -14.6 297 151 B L 0 0 175 -273,-0.0 -1,-0.0 0, 0.0 -4,-0.0 0.704 360.0 360.0-111.5 360.0 -25.0 -29.2 -16.3