==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ACTIVATION DOMAIN 23-JUN-98 1BJA . COMPND 2 MOLECULE: TRANSCRIPTION REGULATORY PROTEIN MOTA; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.S.FINNIN,M.P.CICERO,C.DAVIES,S.J.PORTER,S.W.WHITE, . 190 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9695.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 148 77.9 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 . 14 7.4 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 . 2 1.1 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 . 3 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 50.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.1 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 1 0 3 1 0 0 0 0 3 1 0 0 0 1 0 0 0 0 0 1 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 . 2 0 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 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 2 A S 0 0 67 0, 0.0 2,-1.7 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 126.7 -18.8 21.0 123.2 2 3 A K >> + 0 0 60 188,-2.8 4,-1.2 1,-0.2 3,-1.0 -0.273 360.0 150.7 -87.9 58.1 -15.4 20.6 121.5 3 4 A V H 3> + 0 0 27 -2,-1.7 4,-3.4 1,-0.3 5,-0.3 0.740 61.2 68.5 -69.4 -22.8 -14.5 17.0 122.3 4 5 A T H 3> S+ 0 0 105 -3,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.895 101.5 47.7 -63.7 -40.2 -12.4 16.3 119.2 5 6 A Y H <> S+ 0 0 42 -3,-1.0 4,-2.7 2,-0.2 5,-0.2 0.942 114.0 48.2 -64.0 -39.7 -9.8 18.7 120.5 6 7 A I H X S+ 0 0 0 -4,-1.2 4,-1.9 1,-0.2 -2,-0.2 0.964 110.0 49.5 -66.2 -51.6 -9.9 17.0 123.9 7 8 A I H <>S+ 0 0 26 -4,-3.4 5,-2.5 1,-0.2 7,-0.3 0.862 113.5 51.1 -55.0 -32.3 -9.7 13.5 122.5 8 9 A K H ><5S+ 0 0 125 -4,-1.7 3,-2.3 -5,-0.3 -2,-0.2 0.982 109.1 45.0 -71.1 -57.8 -6.7 14.7 120.5 9 10 A A H 3<5S+ 0 0 31 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.719 109.4 60.5 -58.8 -20.4 -4.7 16.3 123.3 10 11 A S T ><5S- 0 0 6 -4,-1.9 3,-1.6 -5,-0.2 -1,-0.3 0.295 111.9-121.3 -87.7 6.7 -5.5 13.2 125.4 11 12 A N T < 5 - 0 0 136 -3,-2.3 -3,-0.2 1,-0.3 -2,-0.1 0.821 67.8 -62.3 49.8 34.9 -3.7 11.0 122.8 12 13 A D T 3 - 0 0 59 -2,-0.3 4,-1.8 1,-0.0 5,-0.2 -0.413 43.8 -85.2-100.6-172.5 -13.7 9.1 124.1 16 17 A E H > S+ 0 0 113 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.804 127.3 46.2 -65.8 -21.0 -16.5 11.5 123.2 17 18 A K H > S+ 0 0 73 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.917 112.0 44.6 -91.1 -46.8 -18.2 10.8 126.6 18 19 A T H > S+ 0 0 5 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.789 114.7 54.1 -68.5 -25.5 -15.3 11.0 129.0 19 20 A A H X S+ 0 0 0 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.882 107.9 46.4 -73.3 -45.1 -14.2 14.1 127.2 20 21 A T H X S+ 0 0 18 -4,-1.2 4,-1.5 2,-0.2 -2,-0.2 0.881 112.4 50.6 -69.3 -34.6 -17.5 15.9 127.6 21 22 A I H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 5,-0.2 0.947 106.7 57.0 -68.8 -36.4 -17.8 15.0 131.2 22 23 A L H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.830 104.3 51.2 -58.7 -40.6 -14.2 16.4 131.7 23 24 A I H X S+ 0 0 0 -4,-1.4 4,-1.4 2,-0.2 -1,-0.2 0.886 106.8 53.7 -65.4 -43.3 -15.2 19.8 130.4 24 25 A T H X S+ 0 0 5 -4,-1.5 4,-0.6 -3,-0.2 3,-0.3 0.928 112.6 43.1 -57.5 -44.2 -18.2 20.1 132.7 25 26 A I H >< S+ 0 0 0 -4,-1.8 3,-1.1 1,-0.2 6,-0.3 0.929 111.0 55.6 -69.8 -36.8 -16.0 19.4 135.8 26 27 A A H 3< S+ 0 0 12 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.763 105.7 54.3 -62.4 -30.5 -13.2 21.7 134.5 27 28 A K H 3< S+ 0 0 76 -4,-1.4 2,-0.4 -3,-0.3 -1,-0.3 0.623 113.9 35.3 -83.6 -21.9 -15.7 24.5 134.2 28 29 A K S X< S- 0 0 98 -3,-1.1 3,-1.4 -4,-0.6 -1,-0.2 -0.893 78.2-137.7-143.7 105.3 -17.0 24.5 137.8 29 30 A D T 3 S+ 0 0 96 -2,-0.4 40,-0.2 1,-0.2 -3,-0.1 -0.432 89.4 11.8 -58.5 135.0 -14.8 23.6 140.8 30 31 A F T 3 S+ 0 0 132 38,-1.2 -1,-0.2 1,-0.2 39,-0.2 0.583 86.0 162.8 69.5 17.1 -16.5 21.3 143.4 31 32 A I B < -A 68 0A 5 -3,-1.4 37,-3.3 37,-0.7 2,-0.2 -0.181 32.9-125.4 -58.0 152.1 -19.3 20.5 141.0 32 33 A T >> - 0 0 44 35,-0.2 4,-2.1 1,-0.1 3,-0.5 -0.705 14.3-114.0-101.4 166.9 -21.2 17.3 142.1 33 34 A A H 3> S+ 0 0 29 33,-0.5 4,-2.4 1,-0.2 5,-0.2 0.908 116.1 59.7 -62.0 -35.6 -22.1 14.1 140.2 34 35 A A H 3> S+ 0 0 54 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.833 107.5 43.8 -67.0 -33.4 -25.7 15.0 140.3 35 36 A E H <> S+ 0 0 69 -3,-0.5 4,-1.5 2,-0.2 -1,-0.2 0.851 109.0 56.2 -80.5 -31.9 -25.1 18.2 138.4 36 37 A V H < S+ 0 0 0 -4,-2.1 4,-0.4 1,-0.2 3,-0.3 0.935 108.2 51.0 -58.8 -37.7 -22.8 16.6 135.9 37 38 A R H >< S+ 0 0 64 -4,-2.4 3,-1.0 1,-0.2 6,-0.2 0.896 106.7 53.0 -67.9 -35.9 -25.7 14.2 135.2 38 39 A E H 3< S+ 0 0 154 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.2 0.780 105.4 51.9 -76.6 -27.9 -28.3 17.0 134.7 39 40 A V T 3< S+ 0 0 75 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.456 107.9 56.3 -88.2 2.5 -26.3 18.9 132.0 40 41 A H X + 0 0 7 -3,-1.0 3,-2.3 -4,-0.4 -1,-0.2 -0.412 56.3 154.7-127.1 66.0 -25.9 15.7 130.0 41 42 A P T 3 + 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.866 69.2 72.7 -56.3 -34.4 -29.5 14.5 129.4 42 43 A D T 3 S+ 0 0 124 -3,-0.1 2,-0.3 2,-0.1 -2,-0.0 0.719 94.6 64.4 -48.7 -28.5 -28.1 12.8 126.3 43 44 A L S < S- 0 0 30 -3,-2.3 2,-0.1 -6,-0.2 -3,-0.1 -0.709 91.6-100.4-109.0 153.4 -26.4 10.2 128.5 44 45 A G > - 0 0 36 -2,-0.3 4,-2.4 1,-0.1 3,-0.3 -0.417 30.3-124.6 -64.4 145.5 -27.6 7.6 130.9 45 46 A N H > S+ 0 0 106 1,-0.3 4,-1.7 2,-0.2 -1,-0.1 0.925 115.1 42.2 -62.5 -37.6 -27.5 8.5 134.6 46 47 A A H > S+ 0 0 69 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.711 108.9 61.0 -81.1 -18.8 -25.4 5.4 135.4 47 48 A V H > S+ 0 0 51 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.906 104.6 47.7 -67.5 -46.5 -23.3 6.1 132.2 48 49 A V H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.955 112.1 50.1 -59.4 -44.0 -22.3 9.5 133.6 49 50 A N H X S+ 0 0 68 -4,-1.7 4,-2.1 -5,-0.2 -2,-0.2 0.926 111.3 48.8 -61.4 -42.9 -21.3 7.9 136.9 50 51 A S H X S+ 0 0 73 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.952 113.1 46.1 -58.4 -51.2 -19.3 5.2 135.2 51 52 A N H X S+ 0 0 23 -4,-2.4 4,-1.3 1,-0.3 -2,-0.2 0.829 109.0 54.8 -73.6 -24.7 -17.4 7.6 133.1 52 53 A I H X S+ 0 0 10 -4,-2.6 4,-1.3 2,-0.2 -1,-0.3 0.921 109.5 49.4 -65.3 -40.6 -16.8 9.9 136.0 53 54 A G H X S+ 0 0 35 -4,-2.1 4,-2.5 1,-0.2 3,-0.5 0.914 106.3 54.6 -66.9 -38.2 -15.3 6.8 137.7 54 55 A V H < S+ 0 0 62 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.823 107.8 52.1 -62.4 -27.8 -13.1 6.1 134.6 55 56 A L H <>S+ 0 0 0 -4,-1.3 6,-2.4 -5,-0.2 5,-2.0 0.736 108.6 48.7 -81.4 -28.4 -11.8 9.7 135.0 56 57 A I H ><5S+ 0 0 50 -4,-1.3 3,-1.0 -3,-0.5 -2,-0.2 0.882 108.1 54.5 -76.8 -32.5 -10.9 9.3 138.6 57 58 A K T 3<5S+ 0 0 192 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.553 108.2 51.8 -75.9 -4.3 -9.1 6.0 137.9 58 59 A K T 3 5S- 0 0 98 -4,-0.2 -1,-0.2 -5,-0.2 -2,-0.2 0.463 113.8-111.5-109.1 -12.8 -7.0 7.8 135.3 59 60 A G T < 5S+ 0 0 31 -3,-1.0 15,-0.5 2,-0.4 14,-0.3 0.694 91.4 105.5 91.3 25.9 -5.8 10.7 137.4 60 61 A L S -B 67 0A 61 3,-3.2 3,-2.3 -2,-0.4 2,-0.7 -0.871 67.3 -63.3-110.6 97.9 -13.1 16.5 147.3 65 66 A G T 3 S- 0 0 81 -2,-0.6 -2,-0.0 1,-0.3 -35,-0.0 -0.552 121.5 -15.0 60.7-103.3 -15.6 15.3 149.8 66 67 A D T 3 S+ 0 0 141 -2,-0.7 -33,-0.5 -3,-0.1 -1,-0.3 0.499 125.4 82.2-102.7 -12.2 -18.8 15.5 147.8 67 68 A G E < - B 0 64A 6 -3,-2.3 -3,-3.2 -35,-0.1 2,-0.4 -0.591 69.5-128.5-103.2 163.3 -17.5 17.5 144.9 68 69 A L E +AB 31 63A 12 -37,-3.3 -38,-1.2 -5,-0.2 -37,-0.7 -0.854 26.5 173.6-114.1 137.2 -15.5 16.8 141.8 69 70 A I E - B 0 62A 32 -7,-1.8 -7,-2.6 -2,-0.4 2,-0.3 -0.993 28.4-114.1-146.4 145.5 -12.3 18.7 140.7 70 71 A I E - B 0 61A 28 -2,-0.3 -9,-0.3 -9,-0.2 -10,-0.1 -0.633 25.4-128.6 -90.7 145.1 -9.8 18.2 137.9 71 72 A T > - 0 0 22 -11,-3.2 4,-1.9 -2,-0.3 5,-0.2 -0.309 30.1-102.9 -79.2 168.6 -6.2 17.2 138.4 72 73 A G H > S+ 0 0 55 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.893 123.3 57.8 -57.8 -43.0 -3.1 19.1 137.0 73 74 A E H >> S+ 0 0 112 -14,-0.3 4,-1.5 1,-0.2 3,-1.4 0.979 107.0 48.5 -47.9 -54.1 -2.9 16.3 134.4 74 75 A A H 3> S+ 0 0 0 -15,-0.5 4,-2.1 1,-0.3 -1,-0.2 0.811 106.8 55.0 -56.5 -39.9 -6.4 17.1 133.3 75 76 A Q H 3X S+ 0 0 66 -4,-1.9 4,-1.8 2,-0.2 -1,-0.3 0.736 102.6 57.6 -75.3 -13.5 -5.8 20.8 133.1 76 77 A D H X S+ 0 0 102 -4,-2.8 4,-2.4 2,-0.2 3,-0.7 0.992 113.7 49.1 -55.5 -57.3 -3.7 22.2 125.0 81 82 A A H 3X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.3 -2,-0.2 0.884 111.6 46.7 -51.4 -46.9 -7.1 21.5 123.6 82 83 A A H 3X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.3 0.766 110.9 52.4 -72.3 -28.3 -8.4 25.1 123.9 83 84 A T H X S+ 0 0 27 -4,-2.4 4,-1.7 1,-0.2 3,-0.9 0.976 111.1 55.1 -53.7 -53.4 -9.2 25.1 118.9 86 87 A A H 3< S+ 0 0 0 -4,-2.4 4,-0.2 1,-0.3 -1,-0.2 0.799 108.5 48.0 -55.0 -36.7 -8.5 28.8 119.4 87 88 A Q H >< S+ 0 0 81 -4,-2.0 3,-0.5 2,-0.2 -1,-0.3 0.857 110.5 51.1 -74.7 -30.2 -5.8 28.9 116.7 88 89 A E H << S+ 0 0 126 -4,-1.6 -2,-0.2 -3,-0.9 -1,-0.2 0.760 123.1 31.1 -79.6 -15.8 -8.1 27.1 114.2 89 90 A N T >X S+ 0 0 44 -4,-1.7 4,-1.9 -5,-0.2 3,-1.5 0.197 80.7 129.6-122.1 14.0 -10.9 29.5 114.8 90 91 A A H <> S+ 0 0 1 -3,-0.5 4,-2.3 1,-0.3 3,-0.4 0.831 72.8 45.3 -51.6 -47.5 -9.0 32.7 115.6 91 92 A P H 34 S+ 0 0 28 0, 0.0 4,-0.3 0, 0.0 -1,-0.3 0.797 115.3 50.1 -70.3 -21.6 -10.7 35.2 113.3 92 93 A E H <4 S+ 0 0 125 -3,-1.5 3,-0.3 1,-0.1 -2,-0.2 0.821 114.9 42.5 -79.0 -35.3 -14.1 33.9 114.3 93 94 A L H < S+ 0 0 28 -4,-1.9 -3,-0.1 -3,-0.4 -1,-0.1 0.820 109.0 58.4 -76.0 -34.4 -13.3 34.1 118.1 94 95 A L < 0 0 0 -4,-2.3 4,-0.7 -5,-0.3 8,-0.2 0.405 360.0 360.0 -86.1 -4.5 -11.6 37.5 118.0 95 96 A K 0 0 111 -4,-0.3 3,-0.7 -3,-0.3 21,-0.1 -0.265 360.0 360.0 -59.6 360.0 -14.4 39.8 116.5 96 !* 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 97 2 B S 0 0 92 0, 0.0 -2,-0.2 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 133.0 -15.2 42.6 120.5 98 3 B K > + 0 0 79 -3,-0.7 3,-1.3 -4,-0.7 4,-0.4 -0.077 360.0 121.8-114.4 32.4 -12.3 40.5 121.8 99 4 B V T >> + 0 0 1 1,-0.3 3,-1.7 2,-0.2 4,-1.6 0.803 51.1 74.7 -71.1 -27.7 -10.1 42.8 119.7 100 5 B T H 3> S+ 0 0 80 1,-0.3 4,-2.5 2,-0.2 -1,-0.3 0.768 87.2 64.6 -61.9 -20.0 -7.9 44.0 122.6 101 6 B Y H <> S+ 0 0 31 -3,-1.3 4,-2.9 2,-0.2 -1,-0.3 0.879 100.8 50.4 -68.8 -30.8 -6.2 40.6 122.5 102 7 B I H <> S+ 0 0 0 -3,-1.7 4,-2.4 -4,-0.4 -2,-0.2 0.901 108.7 52.7 -69.2 -40.6 -4.9 41.5 119.0 103 8 B I H <>S+ 0 0 20 -4,-1.6 5,-3.3 2,-0.2 7,-0.3 0.924 113.0 43.1 -60.6 -45.7 -3.7 44.7 120.5 104 9 B K H ><5S+ 0 0 104 -4,-2.5 3,-2.4 3,-0.2 -2,-0.2 0.957 112.9 51.5 -60.5 -55.0 -1.8 42.8 123.2 105 10 B A H 3<5S+ 0 0 24 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.876 107.7 53.8 -54.1 -34.4 -0.5 40.2 120.8 106 11 B S T ><5S- 0 0 10 -4,-2.4 3,-1.3 -5,-0.2 -1,-0.3 0.234 122.2-109.2 -81.0 10.7 0.8 43.1 118.6 107 12 B N T < 5 - 0 0 133 -3,-2.4 -3,-0.2 1,-0.2 -2,-0.2 0.903 67.5 -66.8 52.2 42.8 2.6 44.5 121.6 108 13 B D T 3 - 0 0 78 -2,-0.3 4,-1.2 1,-0.0 5,-0.2 -0.354 39.5 -83.1-107.0-171.6 -5.5 50.2 118.2 112 17 B E H > S+ 0 0 107 3,-0.1 4,-1.8 2,-0.1 5,-0.1 0.922 124.8 45.5 -62.0 -29.7 -9.2 49.2 118.3 113 18 B K H > S+ 0 0 92 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.975 112.1 42.7 -85.2 -51.5 -9.7 50.3 114.7 114 19 B T H > S+ 0 0 6 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.827 116.7 53.5 -57.9 -31.3 -6.8 49.0 112.7 115 20 B A H X S+ 0 0 0 -4,-1.2 4,-2.2 2,-0.2 -1,-0.2 0.902 107.6 48.8 -73.7 -41.0 -7.3 45.8 114.7 116 21 B T H X S+ 0 0 37 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.914 112.8 48.1 -57.1 -50.2 -10.9 45.6 113.7 117 22 B I H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.933 108.8 54.5 -62.2 -38.7 -10.0 46.2 110.1 118 23 B L H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.921 107.5 50.3 -58.2 -45.7 -7.3 43.5 110.3 119 24 B I H X S+ 0 0 4 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.928 107.1 53.8 -60.3 -44.5 -9.9 41.0 111.6 120 25 B T H X S+ 0 0 14 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.907 112.7 44.0 -57.6 -39.4 -12.3 41.8 108.7 121 26 B I H >< S+ 0 0 0 -4,-2.0 3,-0.7 1,-0.2 45,-0.3 0.846 107.5 57.5 -77.6 -34.7 -9.5 41.1 106.1 122 27 B A H 3< S+ 0 0 17 -4,-2.3 3,-0.2 1,-0.2 -1,-0.2 0.774 102.9 57.6 -65.4 -27.6 -8.3 37.9 107.8 123 28 B K H 3< S+ 0 0 82 -4,-1.5 2,-0.4 1,-0.2 -1,-0.2 0.734 114.3 34.8 -73.4 -23.1 -11.8 36.5 107.5 124 29 B K S X< S- 0 0 107 -3,-0.7 3,-1.8 -4,-0.5 -1,-0.2 -0.823 74.8-143.4-142.7 101.5 -11.8 37.0 103.7 125 30 B D T 3 S+ 0 0 94 -2,-0.4 40,-0.2 1,-0.3 -3,-0.1 -0.310 91.0 12.1 -53.9 130.6 -8.8 36.5 101.4 126 31 B F T 3 S+ 0 0 110 38,-1.5 -1,-0.3 1,-0.2 39,-0.2 0.587 84.7 161.7 73.8 12.6 -8.9 39.0 98.5 127 32 B I B < -C 164 0B 9 -3,-1.8 37,-2.5 37,-0.7 -1,-0.2 -0.324 37.8-121.5 -56.9 141.1 -11.7 41.1 100.1 128 33 B T > - 0 0 29 35,-0.3 4,-1.8 1,-0.1 3,-0.4 -0.551 13.6-115.8 -86.2 160.4 -11.7 44.6 98.5 129 34 B A H > S+ 0 0 20 33,-0.4 4,-2.5 1,-0.2 5,-0.2 0.885 117.0 59.4 -59.6 -34.9 -11.3 47.9 100.3 130 35 B A H > S+ 0 0 50 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.861 103.7 49.9 -65.4 -34.1 -14.9 48.7 99.3 131 36 B E H > S+ 0 0 45 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.897 109.7 50.5 -69.2 -43.5 -16.2 45.7 101.1 132 37 B V H < S+ 0 0 0 -4,-1.8 4,-0.4 2,-0.2 -2,-0.2 0.930 113.0 45.9 -54.3 -51.6 -14.3 46.5 104.3 133 38 B R H >< S+ 0 0 70 -4,-2.5 3,-0.9 1,-0.2 7,-0.2 0.844 107.8 60.8 -60.6 -31.5 -15.7 50.1 104.2 134 39 B E H 3< S+ 0 0 130 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.960 106.8 42.2 -65.1 -45.7 -19.1 48.6 103.5 135 40 B V T 3< S+ 0 0 72 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.451 113.9 56.7 -81.8 3.2 -19.2 46.6 106.8 136 41 B H X> + 0 0 21 -3,-0.9 3,-1.8 -4,-0.4 4,-1.3 -0.257 54.0 146.9-130.7 59.5 -17.8 49.6 108.7 137 42 B P T 34 S+ 0 0 106 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.713 70.8 64.8 -66.8 -23.2 -20.1 52.6 108.2 138 43 B D T 34 S+ 0 0 135 1,-0.2 -2,-0.1 -3,-0.1 -3,-0.0 0.654 104.7 46.2 -73.5 -18.1 -19.5 54.0 111.7 139 44 B L T <4 S- 0 0 35 -3,-1.8 4,-0.4 -6,-0.2 -1,-0.2 0.827 103.6-139.1 -89.3 -40.1 -15.8 54.5 110.8 140 45 B G X - 0 0 31 -4,-1.3 4,-2.5 -7,-0.2 5,-0.2 0.128 25.4 -80.3 92.1 155.7 -16.2 56.2 107.4 141 46 B N H > S+ 0 0 108 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.911 125.3 51.7 -58.3 -52.2 -14.4 55.9 104.1 142 47 B A H > S+ 0 0 78 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.927 113.7 42.7 -52.0 -48.5 -11.4 58.1 105.0 143 48 B V H > S+ 0 0 58 -4,-0.4 4,-2.6 2,-0.2 5,-0.2 0.931 115.6 47.9 -72.2 -40.7 -10.7 56.2 108.3 144 49 B V H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.967 115.0 45.5 -61.9 -48.5 -11.2 52.7 106.8 145 50 B N H X S+ 0 0 67 -4,-3.0 4,-2.4 -5,-0.2 -2,-0.2 0.917 113.2 51.9 -59.5 -43.7 -8.9 53.6 103.8 146 51 B S H X S+ 0 0 74 -4,-2.7 4,-2.0 -5,-0.3 -1,-0.2 0.939 110.7 45.8 -58.6 -48.0 -6.4 55.2 106.1 147 52 B N H X S+ 0 0 18 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.886 109.7 54.3 -71.8 -35.2 -6.1 52.2 108.5 148 53 B I H X S+ 0 0 6 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.942 107.6 52.4 -57.4 -43.9 -5.9 49.8 105.6 149 54 B G H X S+ 0 0 24 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.890 107.3 51.6 -60.6 -38.7 -3.0 51.9 104.4 150 55 B V H X S+ 0 0 57 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.930 109.4 49.4 -62.9 -46.1 -1.3 51.6 107.8 151 56 B L H <>S+ 0 0 0 -4,-2.3 5,-2.5 2,-0.2 6,-1.3 0.907 112.2 48.6 -63.9 -40.2 -1.6 47.8 107.8 152 57 B I H ><5S+ 0 0 49 -4,-2.5 3,-2.0 4,-0.2 -2,-0.2 0.979 112.2 47.8 -61.8 -49.2 -0.1 47.7 104.3 153 58 B K H 3<5S+ 0 0 169 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.805 111.4 52.4 -65.3 -24.3 2.8 49.9 105.2 154 59 B K T 3<5S- 0 0 82 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.484 113.6-118.4 -86.0 -9.0 3.3 47.8 108.4 155 60 B G T < 5S+ 0 0 35 -3,-2.0 14,-0.3 -4,-0.4 15,-0.3 0.731 86.5 112.1 77.9 18.8 3.5 44.6 106.4 156 61 B L S -D 163 0B 46 3,-3.0 3,-1.2 -2,-0.3 2,-0.4 -0.846 57.6 -51.9-136.3 97.1 -3.2 41.6 95.9 161 66 B G T 3 S- 0 0 72 -2,-0.3 -35,-0.0 1,-0.2 -2,-0.0 -0.551 120.1 -19.9 73.2-129.0 -5.1 42.6 92.7 162 67 B D T 3 S+ 0 0 127 -2,-0.4 -33,-0.4 -3,-0.1 -1,-0.2 0.190 131.6 58.5 -90.4 9.4 -8.2 44.5 93.5 163 68 B G E < S- D 0 160B 0 -3,-1.2 -3,-3.0 -35,-0.2 2,-0.4 -0.702 76.7-106.9-136.9-173.1 -8.3 43.0 97.0 164 69 B L E -CD 127 159B 0 -37,-2.5 -38,-1.5 -5,-0.2 -37,-0.7 -0.900 23.0-179.3-128.5 138.1 -6.5 42.6 100.4 165 70 B I E - D 0 158B 35 -7,-2.3 -7,-3.0 -2,-0.4 2,-0.2 -0.997 27.1-118.6-137.8 142.2 -4.8 39.7 102.0 166 71 B I E - D 0 157B 27 -2,-0.3 -9,-0.3 -45,-0.3 2,-0.1 -0.508 29.5-130.1 -77.3 154.2 -3.0 39.3 105.4 167 72 B T > - 0 0 26 -11,-2.6 4,-1.4 -2,-0.2 5,-0.1 -0.306 27.7 -98.5 -92.8 177.7 0.6 38.4 105.6 168 73 B G H > S+ 0 0 56 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.893 123.1 59.1 -63.0 -36.4 2.5 35.8 107.6 169 74 B E H > S+ 0 0 107 -14,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.938 106.6 47.2 -59.3 -41.0 3.4 38.5 110.2 170 75 B A H > S+ 0 0 0 -15,-0.3 4,-2.4 -14,-0.3 -1,-0.2 0.792 105.6 58.5 -71.6 -28.3 -0.3 39.1 110.8 171 76 B Q H X S+ 0 0 86 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.909 107.0 49.3 -65.1 -42.6 -1.1 35.4 111.0 172 77 B D H X S+ 0 0 88 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.937 110.7 48.3 -55.1 -57.0 1.4 35.2 113.9 173 78 B I H X S+ 0 0 19 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.939 113.8 48.4 -51.3 -43.6 -0.2 38.2 115.7 174 79 B I H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.821 111.6 47.5 -74.2 -31.1 -3.6 36.6 115.2 175 80 B S H X S+ 0 0 32 -4,-2.0 4,-3.1 2,-0.2 -1,-0.2 0.935 111.6 51.4 -74.2 -39.3 -2.6 33.2 116.5 176 81 B N H X S+ 0 0 91 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.899 109.7 50.8 -59.0 -41.9 -0.9 34.8 119.5 177 82 B A H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.923 112.2 45.6 -61.9 -46.6 -4.1 36.7 120.2 178 83 B A H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.922 113.3 51.1 -62.1 -43.6 -6.2 33.5 120.0 179 84 B T H X S+ 0 0 25 -4,-3.1 4,-3.0 2,-0.2 5,-0.2 0.944 109.1 49.1 -62.1 -46.9 -3.6 31.8 122.2 180 85 B L H X S+ 0 0 42 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.968 113.9 47.0 -54.1 -50.1 -3.7 34.5 124.9 181 86 B Y H X S+ 0 0 28 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.881 113.0 48.6 -62.0 -40.3 -7.5 34.4 125.0 182 87 B A H X S+ 0 0 0 -4,-2.5 4,-0.8 1,-0.2 3,-0.3 0.933 107.2 54.9 -68.6 -44.0 -7.6 30.6 125.2 183 88 B Q H < S+ 0 0 117 -4,-3.0 3,-0.3 1,-0.2 -1,-0.2 0.848 112.8 44.6 -59.4 -28.4 -5.0 30.5 128.0 184 89 B E H < S+ 0 0 100 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.747 129.2 22.3 -87.8 -26.3 -7.2 32.9 130.0 185 90 B N H >X S+ 0 0 38 -4,-1.5 4,-1.5 -3,-0.3 3,-0.8 -0.010 76.5 147.9-131.5 36.8 -10.6 31.2 129.3 186 91 B A H >X S+ 0 0 5 -4,-0.8 4,-1.2 -3,-0.3 3,-1.0 0.825 73.2 38.4 -49.2 -58.4 -9.7 27.6 128.4 187 92 B P H 3> S+ 0 0 18 0, 0.0 4,-0.5 0, 0.0 -1,-0.3 0.813 113.4 58.4 -70.0 -20.1 -12.7 25.5 129.6 188 93 B E H <4 S+ 0 0 113 -3,-0.8 -2,-0.2 1,-0.2 3,-0.2 0.786 104.6 51.7 -74.7 -27.3 -15.1 28.2 128.6 189 94 B L H << S+ 0 0 9 -4,-1.5 -1,-0.2 -3,-1.0 -3,-0.1 0.775 109.3 48.4 -70.3 -39.1 -13.9 27.9 125.0 190 95 B L H < 0 0 0 -4,-1.2 -188,-2.8 -189,-0.1 -1,-0.2 0.532 360.0 360.0 -83.8 -6.9 -14.4 24.2 124.8 191 96 B K < 0 0 100 -4,-0.5 -3,-0.0 -190,-0.2 -171,-0.0 -0.198 360.0 360.0 -61.5 360.0 -17.9 24.2 126.2