==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR 12-NOV-08 3F8F . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR, PADR-LIKE FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOCOCCUS LACTIS SUBSP. CREMORIS; . AUTHOR P.K.MADOORI,H.AGUSTIANDARI,A.J.M.DRIESSEN,A.-M.W.H.THUNNISSE . 225 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14336.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 177 78.7 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 . 17 7.6 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 . 7 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 131 58.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.2 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 0 0 1 1 0 1 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 2 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 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 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 1 A M 0 0 67 0, 0.0 173,-0.2 0, 0.0 171,-0.0 0.000 360.0 360.0 360.0 175.9 40.4 34.6 40.9 2 2 A A + 0 0 20 171,-0.1 201,-0.1 2,-0.1 171,-0.0 0.574 360.0 123.8 -91.5 -11.5 36.8 33.3 41.0 3 3 A E S S- 0 0 164 1,-0.2 197,-0.1 200,-0.0 201,-0.0 -0.032 75.9 -91.9 -55.8 150.4 36.5 32.5 44.7 4 4 A I - 0 0 25 1,-0.1 -1,-0.2 199,-0.1 -2,-0.1 -0.483 50.7-126.0 -57.2 123.4 33.8 34.0 46.9 5 5 A P >> - 0 0 33 0, 0.0 4,-2.3 0, 0.0 3,-0.8 -0.319 17.7-107.3 -78.4 162.8 35.3 37.1 48.3 6 6 A K H 3> S+ 0 0 159 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.750 117.6 58.6 -64.0 -25.9 35.5 37.9 52.0 7 7 A E H 3> S+ 0 0 104 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.862 110.0 42.5 -70.6 -37.5 32.8 40.6 51.7 8 8 A M H <> S+ 0 0 43 -3,-0.8 4,-2.2 2,-0.2 -2,-0.2 0.871 113.0 53.6 -74.3 -38.5 30.3 38.0 50.4 9 9 A L H X S+ 0 0 85 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.910 110.4 46.7 -58.7 -45.2 31.4 35.4 52.9 10 10 A R H X S+ 0 0 91 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.904 110.5 52.6 -64.1 -43.4 30.8 37.9 55.7 11 11 A A H X S+ 0 0 39 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.884 110.4 49.9 -55.9 -40.7 27.4 38.8 54.2 12 12 A Q H X S+ 0 0 15 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.901 111.1 46.4 -68.9 -44.3 26.6 35.0 54.2 13 13 A T H X S+ 0 0 28 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.914 111.1 54.6 -59.9 -45.7 27.6 34.5 57.8 14 14 A N H X S+ 0 0 31 -4,-2.7 4,-3.0 1,-0.2 5,-0.3 0.960 107.3 48.7 -50.0 -57.6 25.6 37.5 58.7 15 15 A V H X S+ 0 0 46 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.875 111.4 50.0 -54.6 -43.2 22.4 36.2 57.1 16 16 A I H X S+ 0 0 5 -4,-1.9 4,-2.2 2,-0.2 3,-0.4 0.962 113.8 43.8 -61.8 -52.9 22.8 32.8 58.8 17 17 A L H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.876 112.0 53.0 -61.1 -39.7 23.3 34.4 62.3 18 18 A L H X S+ 0 0 24 -4,-3.0 4,-1.4 -5,-0.2 -1,-0.2 0.773 109.7 50.2 -68.6 -24.8 20.4 36.9 61.8 19 19 A N H X S+ 0 0 17 -4,-1.3 4,-1.2 -3,-0.4 -2,-0.2 0.823 106.1 53.7 -81.7 -34.7 18.2 33.9 60.9 20 20 A V H >X S+ 0 0 1 -4,-2.2 4,-0.9 2,-0.2 3,-0.5 0.959 113.7 44.0 -54.2 -52.9 19.2 32.0 64.0 21 21 A L H 3< S+ 0 0 3 -4,-2.3 59,-0.4 1,-0.2 3,-0.3 0.833 106.5 60.1 -62.9 -36.2 18.1 35.1 66.0 22 22 A K H 3< S+ 0 0 109 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.817 103.8 51.8 -62.3 -30.8 15.0 35.6 64.0 23 23 A Q H << S- 0 0 32 -4,-1.2 -1,-0.2 -3,-0.5 2,-0.2 0.800 132.8 -39.1 -73.5 -28.6 13.9 32.1 65.1 24 24 A G < - 0 0 31 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.0 -0.802 69.2 -76.7 168.7 143.9 14.5 33.0 68.8 25 25 A D + 0 0 67 -2,-0.2 2,-0.3 -3,-0.1 54,-0.2 -0.257 59.8 176.1 -49.7 143.2 16.8 34.8 71.2 26 26 A N B -A 78 0A 18 52,-1.9 52,-2.8 4,-0.0 2,-0.3 -0.982 30.7-120.8-154.5 159.6 19.9 32.8 71.8 27 27 A Y > - 0 0 44 -2,-0.3 4,-2.4 50,-0.2 3,-0.2 -0.777 39.3-104.8-106.8 156.0 23.3 32.6 73.4 28 28 A V H > S+ 0 0 12 48,-0.5 4,-2.7 -2,-0.3 5,-0.2 0.845 118.8 47.4 -51.0 -49.9 26.5 32.2 71.5 29 29 A Y H > S+ 0 0 168 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.946 113.5 48.1 -55.6 -52.7 27.1 28.6 72.5 30 30 A G H > S+ 0 0 8 -3,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.858 111.4 52.3 -56.4 -38.0 23.5 27.7 71.6 31 31 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.943 109.4 47.0 -64.5 -49.9 23.8 29.5 68.3 32 32 A I H X S+ 0 0 25 -4,-2.7 4,-1.8 1,-0.2 13,-0.3 0.871 112.9 51.2 -60.5 -37.4 27.0 27.7 67.3 33 33 A K H X S+ 0 0 113 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.904 108.6 50.2 -68.4 -42.2 25.5 24.4 68.2 34 34 A Q H X S+ 0 0 52 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.916 110.9 48.6 -62.9 -45.4 22.3 25.1 66.2 35 35 A V H X S+ 0 0 0 -4,-2.3 4,-1.3 2,-0.2 8,-0.3 0.848 109.6 53.2 -63.6 -36.4 24.3 26.0 63.0 36 36 A K H <>S+ 0 0 80 -4,-1.8 5,-3.6 -5,-0.2 6,-0.3 0.908 111.1 46.0 -64.9 -42.1 26.5 22.9 63.4 37 37 A E H ><5S+ 0 0 89 -4,-2.0 3,-0.9 3,-0.2 -2,-0.2 0.860 113.4 49.2 -65.5 -36.8 23.4 20.8 63.5 38 38 A A H 3<5S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.669 111.8 48.1 -81.0 -17.4 21.8 22.5 60.5 39 39 A S T ><5S- 0 0 0 -4,-1.3 3,-1.4 4,-0.2 -1,-0.2 0.187 117.6-113.0-103.8 13.5 25.0 22.2 58.5 40 40 A N T < 5S- 0 0 116 -3,-0.9 -3,-0.2 1,-0.3 -2,-0.1 0.823 74.1 -51.6 58.1 34.6 25.2 18.5 59.4 41 41 A G T 3 > - 0 0 109 1,-0.1 4,-1.2 -14,-0.0 3,-0.8 -0.689 20.1-133.3 -74.1 133.8 34.5 30.1 66.1 47 47 A E H 3> S+ 0 0 98 -2,-0.4 4,-2.2 1,-0.3 5,-0.2 0.842 106.2 61.5 -59.7 -34.3 32.9 32.1 68.9 48 48 A A H 3> S+ 0 0 51 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.846 99.2 55.3 -57.3 -38.1 35.4 34.9 68.2 49 49 A T H <> S+ 0 0 59 -3,-0.8 4,-2.1 2,-0.2 -1,-0.2 0.884 109.2 47.5 -64.3 -37.9 33.8 35.2 64.7 50 50 A L H X S+ 0 0 0 -4,-1.2 4,-3.8 2,-0.2 5,-0.2 0.903 111.7 49.5 -65.6 -43.5 30.4 35.7 66.3 51 51 A Y H X S+ 0 0 102 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.897 111.0 49.7 -65.2 -43.0 31.7 38.3 68.8 52 52 A T H X S+ 0 0 88 -4,-2.6 4,-1.2 2,-0.2 -1,-0.2 0.938 117.9 40.1 -55.7 -49.5 33.4 40.1 65.9 53 53 A I H X S+ 0 0 9 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.894 115.2 50.9 -70.5 -40.2 30.1 40.1 64.0 54 54 A F H X S+ 0 0 2 -4,-3.8 4,-3.3 1,-0.2 5,-0.3 0.873 101.9 62.4 -67.7 -37.4 27.8 40.8 67.0 55 55 A K H X S+ 0 0 158 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.949 110.9 37.7 -45.7 -56.4 29.9 43.7 68.0 56 56 A R H X S+ 0 0 94 -4,-1.2 4,-1.8 2,-0.2 -2,-0.2 0.877 116.5 51.5 -69.9 -40.5 29.0 45.5 64.7 57 57 A L H <>S+ 0 0 7 -4,-2.3 5,-2.6 2,-0.2 6,-0.9 0.920 113.2 45.6 -61.3 -45.5 25.4 44.2 64.6 58 58 A E H ><5S+ 0 0 72 -4,-3.3 3,-1.0 1,-0.2 -2,-0.2 0.894 111.6 52.7 -63.5 -41.0 24.9 45.5 68.2 59 59 A K H 3<5S+ 0 0 174 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.818 108.5 50.9 -62.7 -32.3 26.6 48.8 67.3 60 60 A D T 3<5S- 0 0 74 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.509 115.7-114.9 -86.3 -6.6 24.2 49.2 64.3 61 61 A G T < 5S+ 0 0 29 -3,-1.0 23,-0.4 -4,-0.5 22,-0.3 0.660 85.2 117.3 83.0 18.3 21.2 48.6 66.5 62 62 A I S - 0 0 17 -19,-2.0 4,-2.3 -2,-0.3 5,-0.1 -0.299 24.7-102.9 -79.2 174.0 15.8 44.2 67.6 82 83 A E H > S+ 0 0 160 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.894 127.8 49.4 -64.5 -39.8 12.7 45.8 65.9 83 84 A I H > S+ 0 0 106 -22,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.853 107.9 55.8 -64.9 -35.9 15.0 47.6 63.5 84 85 A G H > S+ 0 0 0 -23,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.950 108.7 46.0 -56.2 -52.4 16.8 44.3 62.9 85 86 A H H X S+ 0 0 89 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.923 113.5 48.8 -58.1 -49.6 13.5 42.7 61.9 86 87 A E H X S+ 0 0 71 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.934 109.4 53.6 -53.4 -51.2 12.6 45.7 59.6 87 88 A N H X S+ 0 0 66 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.921 106.9 51.1 -50.3 -50.3 16.0 45.6 58.0 88 89 A M H X S+ 0 0 40 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.875 111.7 47.5 -58.7 -39.8 15.6 41.9 57.1 89 90 A R H X S+ 0 0 118 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.949 112.7 47.8 -66.3 -49.1 12.3 42.6 55.5 90 91 A L H X S+ 0 0 82 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.806 112.2 51.1 -61.1 -31.5 13.6 45.6 53.6 91 92 A A H X S+ 0 0 22 -4,-2.4 4,-2.3 -5,-0.3 5,-0.2 0.894 109.3 49.6 -73.6 -41.7 16.6 43.5 52.5 92 93 A F H X S+ 0 0 154 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.935 115.8 43.9 -56.8 -48.0 14.3 40.7 51.3 93 94 A E H X S+ 0 0 85 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.920 112.9 50.8 -65.2 -45.7 12.2 43.3 49.3 94 95 A S H X S+ 0 0 30 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.924 114.6 42.8 -56.8 -47.3 15.3 45.1 47.9 95 96 A W H X S+ 0 0 67 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.748 107.7 60.0 -77.1 -27.3 16.9 42.0 46.7 96 97 A S H X S+ 0 0 61 -4,-1.7 4,-1.4 -5,-0.2 -1,-0.2 0.859 105.7 49.1 -65.6 -38.7 13.6 40.6 45.3 97 98 A R H X S+ 0 0 154 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.882 107.4 55.1 -64.4 -41.3 13.5 43.7 43.1 98 99 A V H X S+ 0 0 3 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.942 106.4 51.6 -53.1 -50.1 17.1 43.0 42.0 99 100 A D H X S+ 0 0 92 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.853 108.5 50.8 -57.5 -38.9 16.0 39.5 40.9 100 101 A K H X S+ 0 0 104 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.893 108.6 51.7 -66.0 -40.9 13.1 41.0 38.9 101 102 A I H X S+ 0 0 15 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.885 111.5 47.4 -60.8 -39.4 15.6 43.4 37.2 102 103 A I H X S+ 0 0 18 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.942 110.1 52.3 -66.8 -48.1 17.8 40.4 36.3 103 104 A E H X S+ 0 0 107 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.875 110.7 48.3 -47.9 -43.9 14.7 38.5 35.1 104 105 A N H X S+ 0 0 34 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.862 106.5 55.6 -72.1 -37.1 13.9 41.5 32.8 105 106 A L H X S+ 0 0 2 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.901 112.4 43.9 -59.4 -43.5 17.5 41.8 31.5 106 107 A E H X S+ 0 0 57 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.923 113.7 49.8 -66.3 -47.0 17.2 38.2 30.4 107 108 A A H X S+ 0 0 44 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.898 111.5 48.3 -60.2 -43.8 13.7 38.5 29.0 108 109 A N H X S+ 0 0 62 -4,-2.9 4,-2.6 2,-0.2 -1,-0.2 0.893 112.8 48.7 -64.5 -41.7 14.6 41.6 26.9 109 110 A K H X S+ 0 0 108 -4,-1.8 4,-0.9 -5,-0.2 -2,-0.2 0.931 114.8 45.4 -58.8 -48.5 17.7 39.8 25.6 110 111 A K H X S+ 0 0 134 -4,-2.8 4,-1.2 1,-0.2 -2,-0.2 0.887 117.4 43.6 -62.3 -41.0 15.6 36.8 24.7 111 112 A S H X S+ 0 0 41 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.862 110.3 53.1 -79.7 -37.1 12.8 38.9 23.1 112 113 A E H < S+ 0 0 145 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.683 106.5 56.8 -68.2 -18.8 15.1 41.2 21.2 113 114 A A H < S+ 0 0 78 -4,-0.9 -2,-0.2 2,-0.2 -1,-0.2 0.863 105.6 48.4 -79.5 -39.7 16.8 38.1 19.7 114 115 A I H < 0 0 149 -4,-1.2 -2,-0.2 -5,-0.1 -3,-0.1 0.954 360.0 360.0 -60.3 -53.9 13.5 36.7 18.3 115 116 A K < 0 0 200 -4,-2.0 -2,-0.2 0, 0.0 -3,-0.2 0.982 360.0 360.0 -66.6 360.0 12.7 40.1 16.8 116 !* 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 0.0 117 5 B P > 0 0 130 0, 0.0 4,-1.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 146.8 22.4 50.5 53.2 118 6 B K H > + 0 0 173 1,-0.2 4,-1.6 2,-0.2 3,-0.4 0.986 360.0 33.7 -64.8 -68.3 26.1 50.8 52.1 119 7 B E H > S+ 0 0 108 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.713 116.7 53.6 -73.9 -23.8 27.5 47.4 51.5 120 8 B M H > S+ 0 0 72 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.811 105.7 52.2 -83.9 -32.3 24.3 45.7 50.3 121 9 B L H X S+ 0 0 96 -4,-1.2 4,-2.6 -3,-0.4 -2,-0.2 0.879 112.4 47.2 -64.9 -39.6 23.6 48.3 47.6 122 10 B R H X S+ 0 0 95 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.939 111.1 50.5 -65.7 -47.4 27.2 47.7 46.3 123 11 B A H X S+ 0 0 39 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.866 112.1 49.2 -55.9 -37.6 26.7 44.0 46.5 124 12 B Q H X S+ 0 0 7 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.927 109.6 49.1 -69.7 -46.6 23.4 44.5 44.5 125 13 B T H X S+ 0 0 6 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.894 109.6 55.7 -57.0 -41.7 25.1 46.6 41.8 126 14 B N H X S+ 0 0 38 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.948 109.4 44.0 -52.3 -56.5 27.8 43.9 41.6 127 15 B V H X S+ 0 0 44 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.880 114.6 49.6 -58.4 -42.9 25.2 41.2 40.9 128 16 B I H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.900 111.4 48.6 -67.1 -42.8 23.3 43.3 38.4 129 17 B L H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 3,-0.3 0.941 108.4 52.5 -63.6 -52.2 26.4 44.3 36.5 130 18 B L H X S+ 0 0 13 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.864 110.7 51.1 -48.4 -38.7 27.7 40.7 36.3 131 19 B N H X S+ 0 0 18 -4,-1.6 4,-0.8 2,-0.2 -1,-0.2 0.825 106.5 51.5 -75.9 -32.1 24.3 39.9 34.8 132 20 B V H >X S+ 0 0 1 -4,-1.7 4,-0.7 -3,-0.3 3,-0.6 0.912 111.5 47.7 -65.5 -44.6 24.3 42.6 32.2 133 21 B L H 3< S+ 0 0 4 -4,-2.3 60,-0.6 1,-0.3 -2,-0.2 0.779 105.0 59.5 -69.2 -27.9 27.8 41.4 31.0 134 22 B K H 3< S+ 0 0 101 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.796 103.2 53.6 -65.7 -28.2 26.5 37.8 31.0 135 23 B Q H << S- 0 0 33 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.697 133.0 -56.0 -80.7 -22.8 24.0 39.1 28.5 136 24 B G < - 0 0 33 -4,-0.7 -1,-0.3 -3,-0.2 55,-0.1 -0.709 67.9 -60.4 157.8 159.3 26.8 40.5 26.3 137 25 B D + 0 0 63 -2,-0.2 2,-0.3 -3,-0.1 55,-0.2 -0.232 61.5 170.0 -54.3 147.5 29.8 42.9 26.3 138 26 B N B -C 191 0B 17 53,-1.8 53,-3.3 4,-0.0 2,-0.3 -0.969 30.5-122.4-156.1 167.4 28.8 46.4 27.1 139 27 B Y > - 0 0 55 -2,-0.3 4,-2.4 51,-0.2 3,-0.3 -0.746 40.3 -98.2-116.0 167.0 30.1 49.9 27.9 140 28 B V H > S+ 0 0 12 49,-0.5 4,-2.0 1,-0.3 5,-0.1 0.838 120.2 44.6 -60.5 -41.8 29.4 52.0 31.0 141 29 B Y H > S+ 0 0 146 2,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.888 114.3 50.1 -67.2 -39.8 26.7 54.2 29.6 142 30 B G H > S+ 0 0 7 -3,-0.3 4,-2.9 2,-0.2 -2,-0.2 0.872 109.9 50.8 -67.3 -38.9 24.9 51.3 27.9 143 31 B I H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.935 112.1 46.4 -61.4 -49.4 25.0 49.3 31.1 144 32 B I H X S+ 0 0 35 -4,-2.0 4,-2.1 -5,-0.2 13,-0.3 0.923 115.9 45.7 -62.1 -46.5 23.4 52.1 33.1 145 33 B K H X S+ 0 0 134 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.953 112.8 50.1 -58.1 -53.1 20.8 52.7 30.4 146 34 B Q H X S+ 0 0 58 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.882 112.1 47.9 -55.3 -44.1 20.0 49.0 30.1 147 35 B V H < S+ 0 0 0 -4,-2.5 4,-0.5 2,-0.2 8,-0.3 0.885 111.0 49.8 -65.6 -41.1 19.6 48.6 33.9 148 36 B K H ><>S+ 0 0 83 -4,-2.1 5,-3.7 -5,-0.2 3,-0.7 0.894 111.8 49.8 -63.6 -39.3 17.3 51.7 34.1 149 37 B E H ><5S+ 0 0 107 -4,-2.5 3,-1.0 1,-0.2 -2,-0.2 0.865 107.8 52.4 -67.2 -37.9 15.2 50.3 31.2 150 38 B A T 3<5S+ 0 0 1 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.545 114.1 45.2 -73.2 -7.4 14.9 46.9 33.0 151 39 B S T X 5S- 0 0 8 -3,-0.7 3,-1.3 -4,-0.5 -1,-0.2 0.216 115.2-111.5-118.9 12.0 13.7 48.7 36.1 152 40 B N T < 5S- 0 0 132 -3,-1.0 -3,-0.2 1,-0.3 -4,-0.1 0.874 78.5 -52.5 55.9 40.3 11.2 51.0 34.4 153 41 B G T 3 - 0 0 93 1,-0.2 4,-2.0 -2,-0.1 3,-0.4 -0.605 15.6-150.5 -69.8 113.7 25.9 55.3 40.2 159 47 B E H > S+ 0 0 75 -2,-0.6 4,-2.1 1,-0.2 5,-0.2 0.902 98.7 56.5 -44.6 -48.4 28.6 55.7 37.5 160 48 B A H > S+ 0 0 52 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.885 108.5 45.7 -55.4 -41.6 31.1 56.3 40.4 161 49 B T H > S+ 0 0 36 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.803 106.8 58.0 -77.0 -30.7 30.2 53.0 41.9 162 50 B L H X S+ 0 0 0 -4,-2.0 4,-3.0 2,-0.2 -1,-0.2 0.930 107.2 49.2 -59.2 -46.6 30.4 51.1 38.6 163 51 B Y H X S+ 0 0 93 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.852 109.7 49.6 -64.9 -38.6 34.0 52.3 38.2 164 52 B T H X S+ 0 0 66 -4,-1.4 4,-1.3 -5,-0.2 -1,-0.2 0.910 115.3 44.8 -66.9 -39.7 35.0 51.2 41.7 165 53 B I H X S+ 0 0 1 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.906 112.7 50.8 -69.9 -41.3 33.4 47.8 41.1 166 54 B F H X S+ 0 0 2 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.917 106.1 54.8 -61.7 -46.8 35.0 47.4 37.6 167 55 B K H X S+ 0 0 170 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.871 113.7 42.9 -52.6 -41.0 38.4 48.3 39.0 168 56 B R H X S+ 0 0 76 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.889 113.7 49.0 -74.4 -43.0 38.0 45.4 41.5 169 57 B L H X>S+ 0 0 7 -4,-2.8 5,-1.9 1,-0.2 6,-1.2 0.838 110.4 52.4 -68.1 -32.8 36.5 42.9 39.1 170 58 B E H ><5S+ 0 0 67 -4,-2.8 3,-0.6 -5,-0.2 -1,-0.2 0.899 107.5 51.0 -66.7 -40.9 39.2 43.6 36.6 171 59 B K H 3<5S+ 0 0 168 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.831 111.2 49.1 -61.9 -32.8 41.9 42.9 39.3 172 60 B D H 3<5S- 0 0 31 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.591 112.3-122.5 -84.6 -11.2 40.1 39.6 40.1 173 61 B G T <<5S+ 0 0 25 -3,-0.6 24,-0.4 -4,-0.6 23,-0.3 0.564 78.5 123.5 80.4 9.8 40.1 38.7 36.4 174 62 B I S + 0 0 63 -2,-0.3 5,-2.0 6,-0.2 3,-0.4 0.695 63.0 132.5 74.2 23.5 34.6 52.3 17.8 182 70 B E T > 5 + 0 0 91 1,-0.2 3,-1.6 3,-0.2 -1,-0.1 0.733 66.9 66.7 -75.7 -23.8 38.0 53.6 16.8 183 71 B S T 3 5S+ 0 0 119 1,-0.3 -1,-0.2 2,-0.1 4,-0.0 0.769 100.7 50.7 -65.2 -25.2 37.0 53.2 13.2 184 72 B Q T 3 5S- 0 0 148 -3,-0.4 -1,-0.3 2,-0.0 -2,-0.2 0.279 129.4 -98.9 -92.4 8.8 34.4 55.9 13.8 185 73 B G T < 5S+ 0 0 73 -3,-1.6 -3,-0.2 1,-0.3 -2,-0.1 0.579 91.3 114.6 81.0 11.0 37.1 58.2 15.3 186 74 B G < - 0 0 30 -5,-2.0 -1,-0.3 2,-0.0 2,-0.1 -0.340 53.6-156.1 -99.6-175.4 36.0 57.2 18.8 187 75 B R + 0 0 158 -2,-0.1 2,-0.4 -3,-0.1 -6,-0.2 -0.528 24.8 167.2-165.6 89.5 37.7 55.3 21.6 188 76 B R E - D 0 180B 100 -8,-2.1 -8,-2.6 -2,-0.1 2,-0.5 -0.890 32.8-124.0-119.7 135.6 35.2 53.7 24.0 189 77 B K E - D 0 179B 64 -2,-0.4 -49,-0.5 -10,-0.2 2,-0.4 -0.678 25.9-168.4 -85.6 125.0 35.9 51.1 26.6 190 78 B Y E - D 0 178B 42 -12,-3.3 -12,-2.2 -2,-0.5 2,-0.3 -0.871 7.4-148.4-108.7 146.0 33.9 47.9 26.5 191 79 B Y E -CD 138 177B 19 -53,-3.3 -53,-1.8 -2,-0.4 2,-0.3 -0.871 10.5-167.9-114.5 150.5 33.7 45.3 29.2 192 80 B R E - D 0 176B 117 -16,-2.8 -16,-2.2 -2,-0.3 2,-0.6 -0.965 25.2-117.7-134.6 147.7 33.3 41.5 28.8 193 81 B L E - D 0 175B 15 -60,-0.6 -18,-0.2 -2,-0.3 -19,-0.1 -0.777 34.9-150.2 -86.4 124.2 32.6 38.7 31.3 194 82 B T > - 0 0 29 -20,-2.1 4,-2.2 -2,-0.6 5,-0.2 -0.295 29.4-101.8 -87.0 173.5 35.5 36.3 31.4 195 83 B E H > S+ 0 0 127 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.913 126.9 54.7 -60.0 -43.5 35.4 32.5 32.1 196 84 B I H > S+ 0 0 71 -23,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.855 107.6 52.3 -54.2 -36.5 36.6 33.3 35.7 197 85 B G H > S+ 0 0 0 -23,-0.4 4,-1.8 -24,-0.4 -2,-0.2 0.897 106.7 50.2 -69.2 -43.2 33.6 35.7 35.8 198 86 B H H X S+ 0 0 60 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.927 112.6 48.5 -57.3 -46.9 31.1 32.9 34.8 199 87 B E H X S+ 0 0 60 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.899 106.9 55.4 -59.9 -42.4 32.6 30.7 37.5 200 88 B N H X S+ 0 0 9 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.887 109.1 47.4 -60.1 -39.2 32.3 33.4 40.1 201 89 B M H X S+ 0 0 29 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.900 111.1 51.8 -68.7 -42.5 28.6 33.7 39.3 202 90 B R H X S+ 0 0 103 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.936 112.4 45.7 -54.1 -48.6 28.3 29.9 39.5 203 91 B L H X S+ 0 0 49 -4,-2.9 4,-2.8 2,-0.2 5,-0.2 0.822 109.4 54.5 -69.5 -34.4 30.0 29.8 42.9 204 92 B A H X S+ 0 0 18 -4,-2.0 4,-2.5 -5,-0.2 5,-0.3 0.954 111.4 45.0 -63.1 -50.3 28.0 32.7 44.2 205 93 B F H X S+ 0 0 146 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.876 115.6 48.2 -58.6 -38.5 24.8 30.9 43.3 206 94 B E H X S+ 0 0 103 -4,-2.0 4,-1.4 -5,-0.2 -2,-0.2 0.894 113.4 45.3 -72.0 -38.0 26.1 27.6 44.8 207 95 B S H X S+ 0 0 23 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.873 114.1 48.4 -76.3 -36.8 27.3 29.2 48.1 208 96 B W H X S+ 0 0 80 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.815 109.1 54.0 -69.4 -32.6 24.1 31.2 48.6 209 97 B S H X S+ 0 0 45 -4,-1.6 4,-1.9 -5,-0.3 -2,-0.2 0.882 108.1 50.9 -62.5 -38.3 22.1 28.0 47.9 210 98 B R H X S+ 0 0 103 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.892 108.6 50.6 -68.3 -41.4 24.2 26.4 50.6 211 99 B V H X S+ 0 0 4 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.921 108.7 53.0 -57.4 -46.4 23.3 29.2 52.9 212 100 B D H X S+ 0 0 97 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.873 107.3 50.8 -59.3 -42.2 19.6 28.8 52.1 213 101 B K H X S+ 0 0 103 -4,-1.9 4,-3.4 2,-0.2 5,-0.2 0.943 108.9 50.8 -61.9 -49.6 19.7 25.1 52.9 214 102 B I H X S+ 0 0 3 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.902 112.7 46.3 -54.8 -44.8 21.3 25.7 56.3 215 103 B I H X S+ 0 0 15 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.893 113.1 49.5 -64.7 -41.6 18.6 28.3 57.1 216 104 B E H X S+ 0 0 93 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.886 111.2 50.1 -60.4 -41.0 15.9 25.9 55.9 217 105 B N H X S+ 0 0 33 -4,-3.4 4,-2.8 2,-0.2 5,-0.2 0.857 106.7 55.3 -64.7 -36.7 17.5 23.2 58.1 218 106 B L H X S+ 0 0 1 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.884 109.7 46.3 -62.8 -40.8 17.4 25.7 61.0 219 107 B E H X S+ 0 0 88 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.863 114.7 46.9 -70.0 -37.6 13.7 26.1 60.6 220 108 B A H X S+ 0 0 46 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.897 113.1 47.6 -73.3 -42.2 13.1 22.4 60.3 221 109 B N H X S+ 0 0 59 -4,-2.8 4,-1.1 2,-0.2 -2,-0.2 0.878 111.5 51.1 -66.0 -39.8 15.2 21.5 63.3 222 110 B K H < S+ 0 0 103 -4,-2.0 3,-0.4 -5,-0.2 -1,-0.2 0.908 111.5 48.8 -54.8 -43.3 13.4 24.2 65.2 223 111 B K H >X S+ 0 0 141 -4,-1.7 4,-1.4 1,-0.2 3,-0.9 0.797 104.8 58.1 -72.5 -29.0 10.2 22.6 64.0 224 112 B S H 3< S+ 0 0 69 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.802 106.3 50.9 -63.5 -29.4 11.5 19.2 65.1 225 113 B E T 3< S+ 0 0 169 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.292 106.0 53.0-100.4 8.3 11.8 20.6 68.6 226 114 B A T <4 0 0 86 -3,-0.9 -1,-0.2 -5,-0.1 -2,-0.2 0.652 360.0 360.0 -99.8 -32.9 8.3 22.0 68.7 227 115 B I < 0 0 172 -4,-1.4 -3,-0.1 0, 0.0 0, 0.0 -0.042 360.0 360.0-121.5 360.0 6.8 18.6 67.8