==== 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 10-NOV-03 1RFY . COMPND 2 MOLECULE: TRANSCRIPTIONAL REPRESSOR TRAM; . SOURCE 2 ORGANISM_SCIENTIFIC: AGROBACTERIUM TUMEFACIENS; . AUTHOR G.CHEN,J.W.MALENKOS,M.R.CHA,C.FUQUA,L.CHEN . 177 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10568.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 138 78.0 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 . 0 0.0 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 . 4 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 112 63.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 10 A K 0 0 139 0, 0.0 2,-0.3 0, 0.0 78,-0.0 0.000 360.0 360.0 360.0 160.0 56.5 34.0 21.6 2 11 A K - 0 0 60 73,-0.0 2,-0.9 80,-0.0 80,-0.3 -0.756 360.0 -99.1-114.1 159.8 58.4 31.2 23.2 3 12 A V + 0 0 52 -2,-0.3 3,-0.2 1,-0.2 76,-0.1 -0.683 48.0 160.9 -78.4 107.9 61.3 29.0 22.2 4 13 A E S S+ 0 0 100 -2,-0.9 2,-0.4 71,-0.5 -1,-0.2 0.640 71.7 41.6-101.1 -20.8 59.6 25.8 21.0 5 14 A L S > S- 0 0 66 70,-0.4 3,-2.1 71,-0.1 4,-0.3 -0.749 70.6-172.7-130.3 82.5 62.6 24.4 19.0 6 15 A R T >> S+ 0 0 64 -2,-0.4 3,-2.2 1,-0.3 4,-0.7 0.758 74.5 71.2 -49.4 -37.0 65.7 25.1 21.0 7 16 A P H 3> S+ 0 0 85 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 0.745 85.9 71.3 -56.8 -19.0 68.3 24.0 18.4 8 17 A L H <> S+ 0 0 25 -3,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.763 88.3 61.4 -68.6 -24.1 67.4 27.2 16.5 9 18 A I H <> S+ 0 0 4 -3,-2.2 4,-0.7 -4,-0.3 -1,-0.2 0.957 107.4 43.1 -66.9 -47.8 69.1 29.4 19.1 10 19 A G H >< S+ 0 0 42 -4,-0.7 3,-0.7 1,-0.2 -2,-0.2 0.909 113.2 53.6 -62.9 -40.9 72.5 27.7 18.5 11 20 A L H 3< S+ 0 0 137 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.864 116.8 36.2 -61.8 -37.8 71.9 27.8 14.7 12 21 A T H >< S+ 0 0 12 -4,-1.9 3,-2.1 -5,-0.1 -1,-0.2 0.336 82.6 139.3 -99.8 6.3 71.2 31.6 14.7 13 22 A R T << S- 0 0 103 -3,-0.7 108,-0.1 -4,-0.7 -3,-0.1 -0.255 81.0 -1.8 -53.3 129.2 73.7 32.6 17.4 14 23 A G T 3 S+ 0 0 59 1,-0.2 -1,-0.3 106,-0.1 -2,-0.1 0.493 89.5 156.6 67.6 3.9 75.4 35.8 16.4 15 24 A L < - 0 0 44 -3,-2.1 -1,-0.2 1,-0.1 5,-0.1 -0.351 53.6 -98.9 -62.4 137.8 73.6 36.1 13.1 16 25 A P >> - 0 0 66 0, 0.0 4,-2.1 0, 0.0 3,-0.6 -0.288 32.7-115.4 -57.1 143.3 73.5 39.7 11.8 17 26 A P H 3> S+ 0 0 81 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.888 115.0 50.6 -45.9 -49.7 70.2 41.4 12.6 18 27 A T H 3> S+ 0 0 75 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.859 109.6 51.5 -60.7 -36.8 69.2 41.8 8.9 19 28 A D H <> S+ 0 0 78 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.910 111.0 45.6 -68.4 -43.0 70.0 38.1 8.3 20 29 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.888 112.8 52.7 -67.1 -36.7 67.8 36.8 11.1 21 30 A E H X S+ 0 0 35 -4,-2.4 4,-2.7 -5,-0.3 -2,-0.2 0.925 108.5 50.2 -61.8 -45.2 65.1 39.2 10.0 22 31 A T H X S+ 0 0 68 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.915 111.5 47.6 -59.6 -46.2 65.3 37.9 6.5 23 32 A I H X S+ 0 0 77 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.914 114.2 47.0 -62.6 -43.2 65.0 34.3 7.7 24 33 A T H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.888 109.2 53.5 -67.7 -39.4 62.1 35.1 9.9 25 34 A I H X S+ 0 0 45 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.930 110.7 46.7 -61.5 -44.2 60.3 37.1 7.2 26 35 A D H X S+ 0 0 75 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.857 109.4 55.0 -66.7 -32.7 60.5 34.1 4.9 27 36 A A H X S+ 0 0 11 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.819 105.5 53.0 -68.5 -30.7 59.3 31.8 7.7 28 37 A I H X S+ 0 0 19 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.921 110.1 47.4 -69.4 -41.9 56.2 34.0 8.1 29 38 A R H X S+ 0 0 155 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.903 112.2 49.9 -64.5 -40.6 55.5 33.7 4.4 30 39 A T H X S+ 0 0 48 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.914 108.7 52.8 -63.8 -42.8 56.0 29.9 4.6 31 40 A H H X S+ 0 0 43 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.918 106.9 52.0 -58.3 -46.9 53.7 29.7 7.6 32 41 A R H X S+ 0 0 162 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.896 111.1 48.0 -57.5 -42.0 50.9 31.6 5.7 33 42 A R H X S+ 0 0 145 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.917 112.8 47.3 -65.9 -44.6 51.2 29.1 2.8 34 43 A L H X S+ 0 0 5 -4,-2.6 4,-2.4 2,-0.2 36,-0.2 0.864 112.0 50.0 -66.5 -36.6 51.1 26.1 5.1 35 44 A V H X S+ 0 0 58 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.924 110.8 49.9 -66.9 -43.4 48.1 27.4 7.0 36 45 A E H X S+ 0 0 46 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.898 112.4 47.6 -61.6 -41.8 46.3 28.1 3.8 37 46 A K H X S+ 0 0 86 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.943 113.5 46.0 -65.8 -48.6 47.0 24.6 2.5 38 47 A A H X S+ 0 0 7 -4,-2.4 4,-2.2 28,-0.2 -2,-0.2 0.904 113.5 50.7 -61.9 -40.1 46.0 22.8 5.7 39 48 A D H X S+ 0 0 84 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.913 107.1 53.4 -64.3 -43.9 42.8 25.0 5.9 40 49 A E H X S+ 0 0 126 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.897 112.4 44.4 -58.3 -42.2 41.9 24.1 2.3 41 50 A L H < S+ 0 0 30 -4,-1.9 4,-0.5 2,-0.2 -1,-0.2 0.864 111.2 53.5 -72.5 -35.7 42.1 20.4 3.0 42 51 A F H >< S+ 0 0 63 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.931 105.2 54.5 -64.1 -43.8 40.2 20.7 6.3 43 52 A Q H 3< S+ 0 0 105 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.837 106.1 52.3 -58.8 -34.7 37.3 22.5 4.6 44 53 A A T 3< S+ 0 0 67 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.514 85.8 108.1 -81.4 -6.3 36.9 19.7 2.1 45 54 A L S < S- 0 0 7 -3,-1.5 5,-0.1 -4,-0.5 -3,-0.0 -0.429 81.4-101.7 -71.3 146.2 36.7 17.0 4.8 46 55 A P >> - 0 0 57 0, 0.0 4,-1.9 0, 0.0 3,-1.1 -0.283 34.6-108.7 -62.6 156.5 33.3 15.4 5.4 47 56 A E H 3> S+ 0 0 126 1,-0.3 4,-1.9 2,-0.2 6,-0.2 0.871 119.0 60.4 -54.8 -39.0 31.5 16.6 8.5 48 57 A T H 34>S+ 0 0 63 1,-0.2 6,-2.0 2,-0.2 5,-1.6 0.802 107.4 45.1 -60.8 -30.1 32.2 13.3 10.2 49 58 A Y H X45S+ 0 0 62 -3,-1.1 3,-0.7 4,-0.2 -1,-0.2 0.847 109.1 54.8 -81.5 -35.2 35.9 13.8 9.9 50 59 A K H 3<5S+ 0 0 64 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.815 112.6 44.5 -66.1 -29.9 35.8 17.5 11.0 51 60 A T T 3<5S- 0 0 68 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.468 113.6-118.5 -93.1 -3.4 34.0 16.3 14.2 52 61 A G T < 5S+ 0 0 49 -3,-0.7 -3,-0.2 2,-0.2 -4,-0.1 0.567 82.6 117.8 79.2 8.6 36.4 13.4 14.7 53 62 A Q S S- 0 0 37 1,-0.1 4,-2.5 2,-0.1 -1,-0.2 -0.094 79.0 -71.6 101.9 157.9 41.6 7.1 4.5 58 67 A P H > S+ 0 0 109 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.875 127.4 49.7 -52.5 -49.0 43.6 8.9 1.8 59 68 A Q H > S+ 0 0 93 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.926 113.0 46.6 -61.5 -44.5 41.9 12.2 2.1 60 69 A H H > S+ 0 0 28 -4,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.916 110.2 54.0 -63.6 -43.3 42.3 12.3 5.9 61 70 A I H X S+ 0 0 90 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.917 107.5 50.9 -57.2 -45.1 45.9 11.3 5.7 62 71 A R H X S+ 0 0 137 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.891 110.8 48.0 -62.0 -40.3 46.6 14.2 3.3 63 72 A Y H X S+ 0 0 50 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.935 111.7 50.4 -64.4 -46.4 45.0 16.7 5.6 64 73 A I H X S+ 0 0 68 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.920 109.9 49.8 -58.8 -44.8 46.9 15.3 8.6 65 74 A E H X S+ 0 0 124 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.905 111.4 48.8 -63.2 -39.6 50.2 15.5 6.7 66 75 A A H X S+ 0 0 14 -4,-2.0 4,-1.9 1,-0.2 -28,-0.2 0.902 113.3 47.5 -65.9 -38.8 49.5 19.1 5.7 67 76 A S H X S+ 0 0 16 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.878 109.2 54.2 -68.8 -38.2 48.6 20.0 9.3 68 77 A I H X S+ 0 0 104 -4,-2.8 4,-2.7 2,-0.2 5,-0.2 0.942 109.2 47.2 -61.0 -47.6 51.7 18.3 10.6 69 78 A E H X S+ 0 0 108 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.907 112.5 51.1 -61.6 -39.6 54.0 20.3 8.3 70 79 A M H X S+ 0 0 29 -4,-1.9 4,-2.4 -36,-0.2 -2,-0.2 0.961 112.7 44.3 -61.8 -51.6 52.1 23.5 9.4 71 80 A H H X S+ 0 0 117 -4,-2.9 4,-1.8 2,-0.2 -2,-0.2 0.902 113.8 50.3 -60.9 -43.3 52.5 22.7 13.1 72 81 A A H X S+ 0 0 58 -4,-2.7 4,-1.2 -5,-0.2 3,-0.2 0.948 113.9 43.8 -60.4 -50.0 56.1 21.8 12.8 73 82 A Q H X S+ 0 0 31 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.847 109.1 58.6 -65.9 -33.3 57.1 24.9 10.8 74 83 A M H X S+ 0 0 33 -4,-2.4 4,-2.9 -5,-0.2 5,-0.3 0.877 100.9 55.1 -64.5 -36.1 55.0 27.0 13.2 75 84 A S H X S+ 0 0 23 -4,-1.8 4,-1.5 -3,-0.2 -71,-0.5 0.885 110.2 47.6 -64.0 -34.6 57.1 25.8 16.1 76 85 A A H X S+ 0 0 22 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.925 111.9 48.8 -70.1 -45.2 60.2 27.0 14.2 77 86 A L H X S+ 0 0 5 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.919 110.2 50.4 -62.1 -45.0 58.6 30.4 13.4 78 87 A N H X S+ 0 0 22 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.889 111.3 50.3 -60.1 -38.1 57.5 31.0 17.0 79 88 A T H X S+ 0 0 0 -4,-1.5 4,-2.3 -5,-0.3 -2,-0.2 0.914 109.2 49.8 -66.7 -43.3 61.1 30.2 18.0 80 89 A L H X S+ 0 0 12 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.905 112.0 48.5 -61.8 -41.9 62.6 32.6 15.5 81 90 A I H X>S+ 0 0 12 -4,-2.5 4,-2.8 1,-0.2 5,-0.6 0.891 109.6 53.3 -64.6 -38.7 60.2 35.4 16.7 82 91 A S H <5S+ 0 0 16 -4,-2.1 -2,-0.2 -80,-0.3 -1,-0.2 0.906 111.9 44.8 -62.6 -42.8 61.2 34.6 20.3 83 92 A I H <5S+ 0 0 4 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.934 115.3 46.4 -66.9 -47.4 64.9 35.0 19.5 84 93 A L H <5S- 0 0 2 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.882 101.8-134.9 -63.8 -39.6 64.4 38.1 17.4 85 94 A G T <5S+ 0 0 6 -4,-2.8 2,-0.3 -5,-0.2 -3,-0.2 0.476 74.3 43.3 95.9 3.5 62.2 39.7 20.1 86 95 A F S - 0 0 67 70,-0.4 3,-2.3 1,-0.2 4,-0.4 -0.707 69.6-179.0-112.7 79.0 56.8 48.2 32.5 94 15 B R T >> S+ 0 0 62 -2,-0.7 3,-1.9 -3,-0.3 4,-0.8 0.788 74.3 69.0 -47.2 -38.6 54.7 51.4 32.7 95 16 B P H 3> S+ 0 0 99 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.786 87.6 68.6 -56.2 -24.1 57.5 53.3 34.4 96 17 B L H <> S+ 0 0 32 -3,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.810 92.0 60.1 -65.0 -28.0 59.4 53.2 31.2 97 18 B I H <> S+ 0 0 89 -3,-1.9 4,-0.5 -4,-0.4 -1,-0.2 0.957 109.6 39.1 -65.4 -50.2 56.8 55.5 29.5 98 19 B G H >< S+ 0 0 48 -4,-0.8 3,-0.8 1,-0.2 -2,-0.2 0.887 113.7 57.8 -66.3 -36.1 57.4 58.4 32.0 99 20 B L H 3< S+ 0 0 139 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.863 111.5 39.8 -61.0 -38.8 61.1 57.7 31.9 100 21 B T H >< S+ 0 0 18 -4,-1.9 3,-2.2 -5,-0.1 -1,-0.2 0.402 84.4 131.5 -93.2 0.5 61.4 58.1 28.2 101 22 B R T << S+ 0 0 211 -3,-0.8 -3,-0.1 -4,-0.5 -4,-0.0 -0.333 77.7 12.0 -57.2 125.3 59.0 61.1 28.0 102 23 B G T 3 S+ 0 0 77 1,-0.3 -1,-0.3 -2,-0.1 -2,-0.1 0.342 88.4 145.9 89.6 -8.3 60.6 63.9 26.0 103 24 B L < - 0 0 60 -3,-2.2 -1,-0.3 1,-0.1 5,-0.1 -0.402 60.7-104.7 -64.1 134.2 63.4 61.8 24.6 104 25 B P >> - 0 0 68 0, 0.0 4,-1.8 0, 0.0 3,-1.1 -0.385 31.2-119.5 -58.7 136.6 64.3 62.8 21.0 105 26 B P H 3> S+ 0 0 94 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.853 113.2 56.8 -45.1 -43.2 62.9 60.1 18.7 106 27 B T H 3> S+ 0 0 95 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.880 107.1 48.4 -58.6 -40.4 66.4 59.2 17.5 107 28 B D H <> S+ 0 0 78 -3,-1.1 4,-2.4 2,-0.2 -1,-0.2 0.877 110.0 49.8 -70.2 -39.0 67.5 58.5 21.0 108 29 B L H X S+ 0 0 16 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.909 111.4 51.1 -65.0 -39.2 64.6 56.3 21.8 109 30 B E H X S+ 0 0 61 -4,-2.5 4,-2.8 -5,-0.2 -2,-0.2 0.923 109.3 50.0 -61.1 -46.0 65.2 54.4 18.6 110 31 B T H X S+ 0 0 67 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.916 111.4 48.3 -59.1 -45.1 68.9 54.0 19.5 111 32 B I H X S+ 0 0 75 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.895 112.9 48.7 -62.9 -39.6 67.9 52.6 23.0 112 33 B T H X S+ 0 0 0 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.893 108.7 52.3 -68.7 -40.6 65.4 50.3 21.3 113 34 B I H X S+ 0 0 62 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.918 111.7 47.1 -61.4 -42.6 67.9 49.0 18.8 114 35 B D H X S+ 0 0 61 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.809 107.2 57.1 -70.1 -28.2 70.3 48.2 21.6 115 36 B A H X S+ 0 0 8 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.848 105.4 51.1 -70.0 -33.8 67.5 46.5 23.6 116 37 B I H X S+ 0 0 21 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.928 111.6 47.7 -66.9 -43.1 67.0 44.2 20.6 117 38 B R H X S+ 0 0 160 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.912 111.5 49.9 -62.8 -43.6 70.7 43.4 20.6 118 39 B T H X S+ 0 0 61 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.905 107.0 55.9 -62.6 -41.9 70.7 42.9 24.4 119 40 B H H X S+ 0 0 2 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.935 108.4 46.5 -57.0 -48.4 67.7 40.5 24.1 120 41 B R H X S+ 0 0 17 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.870 110.9 52.2 -65.0 -34.8 69.6 38.3 21.6 121 42 B R H X S+ 0 0 53 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.908 111.8 47.2 -66.1 -39.0 72.7 38.3 23.8 122 43 B L H X S+ 0 0 21 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.852 111.4 50.2 -70.1 -35.7 70.6 37.2 26.8 123 44 B V H X S+ 0 0 8 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.930 112.8 47.3 -66.8 -45.3 68.8 34.5 24.8 124 45 B E H X S+ 0 0 34 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.916 112.1 50.2 -61.9 -43.9 72.1 33.2 23.5 125 46 B K H X S+ 0 0 43 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.932 110.3 48.4 -61.8 -48.2 73.6 33.2 27.1 126 47 B A H X S+ 0 0 8 -4,-2.3 4,-2.2 28,-0.2 -1,-0.2 0.910 112.9 48.5 -60.7 -43.0 70.7 31.4 28.7 127 48 B D H X S+ 0 0 1 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.902 106.9 55.6 -65.3 -40.7 70.8 28.7 25.9 128 49 B E H X S+ 0 0 87 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.919 109.8 47.0 -58.1 -41.3 74.6 28.3 26.3 129 50 B L H < S+ 0 0 70 -4,-2.0 4,-0.4 1,-0.2 3,-0.3 0.909 111.9 50.8 -66.7 -40.1 74.1 27.5 30.0 130 51 B F H >< S+ 0 0 31 -4,-2.2 3,-1.8 1,-0.2 -2,-0.2 0.932 105.8 55.1 -61.5 -47.0 71.2 25.1 29.2 131 52 B Q H 3< S+ 0 0 79 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.801 106.9 51.6 -57.6 -30.1 73.3 23.2 26.7 132 53 B A T 3< S+ 0 0 66 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.480 86.2 108.5 -87.3 -4.0 76.0 22.6 29.3 133 54 B L S < S- 0 0 6 -3,-1.8 5,-0.1 -4,-0.4 -3,-0.0 -0.397 84.3 -95.3 -71.8 149.5 73.6 21.2 31.9 134 55 B P >> - 0 0 55 0, 0.0 3,-1.5 0, 0.0 4,-1.4 -0.332 39.4-108.7 -61.5 151.6 73.8 17.5 32.6 135 56 B E H 3> S+ 0 0 127 1,-0.3 4,-1.2 2,-0.2 6,-0.2 0.818 117.4 63.5 -51.3 -34.6 71.2 15.6 30.5 136 57 B T H 34>S+ 0 0 60 1,-0.2 5,-2.1 2,-0.2 6,-0.8 0.831 103.3 47.2 -60.8 -34.6 69.2 14.9 33.6 137 58 B Y H X45S+ 0 0 62 -3,-1.5 3,-1.2 4,-0.2 -1,-0.2 0.853 104.8 59.4 -76.1 -35.3 68.5 18.6 34.1 138 59 B K H 3<5S+ 0 0 55 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.783 110.2 44.0 -62.8 -27.4 67.5 19.2 30.5 139 60 B T T 3<5S- 0 0 81 -4,-1.2 -1,-0.3 -3,-0.1 -2,-0.2 0.349 116.3-109.9-100.2 3.7 64.7 16.7 30.9 140 61 B G T < 5S+ 0 0 58 -3,-1.2 -3,-0.2 2,-0.2 -2,-0.1 0.627 85.6 122.9 77.4 12.2 63.5 17.9 34.3 141 62 B Q S S- 0 0 35 1,-0.1 4,-2.5 2,-0.1 5,-0.2 0.014 79.0 -76.0 97.1 153.5 72.3 23.1 42.5 146 67 B P H > S+ 0 0 92 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.865 127.5 50.3 -52.5 -45.2 74.6 26.0 41.6 147 68 B Q H > S+ 0 0 78 2,-0.2 4,-1.6 1,-0.2 -2,-0.1 0.935 113.5 44.5 -62.9 -46.2 74.9 25.2 37.9 148 69 B H H > S+ 0 0 24 -4,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.901 110.5 56.1 -64.6 -40.4 71.1 25.0 37.4 149 70 B I H X S+ 0 0 82 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.909 105.7 51.2 -57.9 -43.3 70.6 28.1 39.5 150 71 B R H X S+ 0 0 136 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.875 109.7 49.7 -64.1 -35.7 72.9 30.0 37.2 151 72 B Y H X S+ 0 0 35 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.938 111.6 49.0 -66.1 -45.6 70.9 28.8 34.2 152 73 B I H X S+ 0 0 71 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.919 110.8 50.0 -59.7 -44.0 67.7 29.9 35.9 153 74 B E H X S+ 0 0 118 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.872 109.7 50.8 -64.3 -36.3 69.1 33.3 36.7 154 75 B A H X S+ 0 0 17 -4,-2.0 4,-1.8 2,-0.2 -28,-0.2 0.900 112.0 47.7 -66.8 -39.1 70.3 33.8 33.1 155 76 B S H X S+ 0 0 23 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.888 109.5 53.6 -68.0 -38.9 66.8 32.9 31.9 156 77 B I H X S+ 0 0 101 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.921 108.3 48.9 -62.1 -44.3 65.2 35.2 34.5 157 78 B E H X S+ 0 0 118 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.900 111.0 52.0 -63.4 -37.7 67.3 38.1 33.2 158 79 B M H X S+ 0 0 24 -4,-1.8 4,-2.0 -36,-0.2 -2,-0.2 0.966 112.0 44.1 -62.7 -52.0 66.3 37.2 29.6 159 80 B H H X S+ 0 0 117 -4,-2.8 4,-1.4 1,-0.2 -2,-0.2 0.896 113.8 51.1 -61.0 -39.7 62.6 37.2 30.4 160 81 B A H X S+ 0 0 58 -4,-2.6 4,-1.2 1,-0.2 3,-0.3 0.937 112.3 44.9 -63.3 -47.6 62.8 40.5 32.5 161 82 B Q H X S+ 0 0 30 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.810 106.0 61.3 -67.8 -29.4 64.7 42.3 29.7 162 83 B M H X S+ 0 0 31 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.878 100.8 54.4 -64.7 -35.6 62.2 41.0 27.1 163 84 B S H X S+ 0 0 21 -4,-1.4 4,-2.0 -3,-0.3 -70,-0.4 0.905 108.8 48.8 -63.1 -39.4 59.5 42.8 29.0 164 85 B A H X S+ 0 0 22 -4,-1.2 4,-2.7 2,-0.2 -2,-0.2 0.912 110.2 50.7 -66.0 -42.5 61.5 46.0 28.7 165 86 B L H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.923 108.7 51.7 -61.3 -44.9 62.0 45.4 25.0 166 87 B N H X S+ 0 0 66 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.921 112.3 46.7 -56.7 -45.4 58.3 44.9 24.5 167 88 B T H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.893 110.2 51.7 -65.3 -43.0 57.6 48.2 26.3 168 89 B L H X S+ 0 0 15 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.908 110.1 49.2 -61.9 -42.0 60.2 50.1 24.4 169 90 B I H X S+ 0 0 28 -4,-2.5 4,-2.4 1,-0.2 5,-0.4 0.884 110.4 51.6 -65.2 -36.9 58.8 48.9 21.0 170 91 B S H < S+ 0 0 67 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.908 112.8 45.2 -65.1 -41.9 55.3 49.9 22.2 171 92 B I H < S+ 0 0 50 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.936 113.4 48.7 -67.4 -47.6 56.5 53.4 23.1 172 93 B L H < S- 0 0 24 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.905 98.8-139.5 -60.5 -43.5 58.5 53.9 19.9 173 94 B G S < S+ 0 0 62 -4,-2.4 2,-0.3 -5,-0.2 -3,-0.1 0.381 70.1 37.2 98.7 -4.7 55.6 52.8 17.8 174 95 B F S S- 0 0 95 -5,-0.4 -1,-0.2 2,-0.0 -2,-0.1 -0.969 86.0 -94.1-163.9 172.4 57.6 50.8 15.3 175 96 B I - 0 0 49 -2,-0.3 2,-0.8 -3,-0.1 -86,-0.1 -0.885 39.0-126.5-101.3 120.2 60.6 48.5 14.9 176 97 B P - 0 0 11 0, 0.0 2,-0.9 0, 0.0 -7,-0.0 -0.534 23.5-161.7 -69.8 105.9 63.8 50.2 13.9 177 98 B K 0 0 85 -2,-0.8 -64,-0.0 1,-0.2 -2,-0.0 -0.800 360.0 360.0 -93.1 106.1 65.1 48.5 10.8 178 99 B V 0 0 117 -2,-0.9 -1,-0.2 -65,-0.0 -65,-0.0 0.906 360.0 360.0 -95.2 360.0 68.8 49.3 10.3