==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REPRESSOR 25-SEP-03 1R1U . COMPND 2 MOLECULE: REPRESSOR PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR C.EICKEN,M.A.PENNELLA,X.CHEN,K.M.KOSHLAP,M.L.VANZILE, . 380 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18619.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 284 74.7 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 . 36 9.5 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 . 4 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 . 9 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 205 53.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 0 0 0 0 4 0 1 0 3 5 4 3 0 0 0 0 0 0 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 . 2 2 0 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 9 A N > 0 0 126 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 178.1 46.9 -10.4 -14.7 2 10 A T H > + 0 0 76 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.875 360.0 41.3 -68.0 -48.6 43.2 -11.0 -13.8 3 11 A D H > S+ 0 0 99 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.827 113.3 53.6 -78.6 -33.0 43.4 -13.1 -10.6 4 12 A T H > S+ 0 0 5 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.930 110.1 49.3 -56.5 -48.2 46.3 -11.1 -9.2 5 13 A L H X S+ 0 0 18 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.792 109.0 52.1 -71.7 -23.8 44.2 -7.9 -9.7 6 14 A E H X S+ 0 0 54 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.893 109.0 50.3 -74.8 -40.4 41.2 -9.5 -8.0 7 15 A R H X S+ 0 0 118 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.945 112.9 45.8 -61.8 -44.3 43.2 -10.4 -4.9 8 16 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.829 109.4 54.6 -71.1 -30.1 44.6 -6.9 -4.7 9 17 A T H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.903 109.7 48.2 -59.5 -43.3 41.1 -5.5 -5.2 10 18 A E H X S+ 0 0 94 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.862 109.8 53.6 -63.0 -40.3 40.1 -7.7 -2.2 11 19 A I H X S+ 0 0 6 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.928 111.2 44.1 -62.1 -47.1 43.2 -6.4 -0.2 12 20 A F H < S+ 0 0 0 -4,-2.3 4,-0.5 2,-0.2 99,-0.3 0.860 109.7 54.6 -73.1 -33.0 42.3 -2.8 -0.8 13 21 A K H >< S+ 0 0 77 -4,-2.0 3,-1.4 1,-0.2 -2,-0.2 0.954 108.9 51.5 -60.8 -47.0 38.5 -3.3 0.0 14 22 A A H 3< S+ 0 0 6 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.830 110.0 48.7 -56.0 -37.9 39.6 -4.9 3.4 15 23 A L T 3< S+ 0 0 0 -4,-1.4 2,-2.1 1,-0.2 -1,-0.3 0.515 83.7 96.5 -80.6 -8.5 41.7 -1.9 4.1 16 24 A G < + 0 0 13 -3,-1.4 2,-0.3 -4,-0.5 -1,-0.2 -0.255 67.3 88.8 -82.6 59.5 39.1 0.6 3.3 17 25 A D S > S- 0 0 4 -2,-2.1 4,-2.3 1,-0.1 5,-0.2 -0.971 70.8-136.5-165.0 126.0 37.9 1.1 6.9 18 26 A Y H > S+ 0 0 28 -2,-0.3 4,-2.2 1,-0.2 -1,-0.1 0.921 106.3 43.0 -51.4 -54.4 39.0 3.4 9.8 19 27 A N H > S+ 0 0 5 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.883 112.2 52.4 -69.5 -31.9 39.0 0.7 12.5 20 28 A R H > S+ 0 0 8 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.911 110.3 50.4 -69.7 -29.8 40.7 -1.9 10.3 21 29 A I H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.886 107.3 53.0 -69.7 -43.9 43.5 0.7 9.5 22 30 A R H X S+ 0 0 50 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.934 111.2 47.6 -54.9 -43.4 43.9 1.4 13.3 23 31 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.914 112.4 48.1 -67.2 -47.2 44.3 -2.4 13.8 24 32 A M H X S+ 0 0 0 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.846 110.9 51.2 -56.0 -43.0 46.9 -2.7 10.9 25 33 A E H X S+ 0 0 68 -4,-2.6 4,-0.9 2,-0.2 -2,-0.2 0.912 109.6 49.5 -65.8 -42.3 48.8 0.3 12.2 26 34 A L H >X S+ 0 0 17 -4,-2.2 4,-2.3 1,-0.2 3,-1.3 0.947 109.4 51.4 -60.8 -47.9 49.0 -1.1 15.7 27 35 A L H 3< S+ 0 0 8 -4,-2.4 47,-0.3 1,-0.3 -1,-0.2 0.829 103.7 59.8 -54.6 -34.3 50.2 -4.5 14.4 28 36 A S H 3< S+ 0 0 31 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.724 105.3 49.2 -69.4 -23.3 52.9 -2.6 12.4 29 37 A V H << S- 0 0 105 -3,-1.3 2,-0.3 -4,-0.9 -2,-0.2 0.921 134.5 -27.2 -76.3 -49.2 54.2 -1.3 15.7 30 38 A S < - 0 0 63 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.0 -0.972 67.4 -94.0-163.5 149.2 54.2 -4.8 17.3 31 39 A E - 0 0 122 -2,-0.3 2,-0.3 -3,-0.1 42,-0.2 -0.288 55.2-177.5 -62.4 154.7 52.6 -8.2 17.1 32 40 A A B -A 72 0A 6 40,-2.0 40,-2.9 4,-0.0 2,-0.1 -0.999 29.8-114.8-158.9 154.3 49.7 -8.5 19.6 33 41 A S > - 0 0 33 -2,-0.3 4,-2.5 38,-0.2 5,-0.2 -0.429 42.2-105.7 -82.9 160.6 47.0 -10.5 21.2 34 42 A V H > S+ 0 0 18 36,-0.5 4,-2.9 1,-0.2 5,-0.2 0.917 120.4 54.7 -51.8 -43.0 43.3 -9.6 20.8 35 43 A G H > S+ 0 0 28 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.894 109.3 46.8 -64.8 -34.1 43.1 -8.3 24.3 36 44 A H H > S+ 0 0 72 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.933 112.2 49.2 -71.0 -44.0 46.0 -5.9 23.7 37 45 A I H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.950 112.4 49.8 -55.3 -48.8 44.5 -4.7 20.4 38 46 A S H X>S+ 0 0 21 -4,-2.9 5,-1.3 1,-0.2 4,-1.3 0.917 112.5 46.8 -54.5 -45.5 41.1 -4.2 22.2 39 47 A H H <5S+ 0 0 148 -4,-2.1 3,-0.3 -5,-0.2 -1,-0.2 0.928 113.7 46.1 -69.1 -44.2 42.7 -2.2 25.1 40 48 A Q H <5S+ 0 0 107 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.867 122.8 33.1 -69.7 -36.5 44.8 0.0 23.0 41 49 A L H <5S- 0 0 14 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.399 102.4-122.7-101.1 0.0 42.2 1.0 20.4 42 50 A N T <5 + 0 0 93 -4,-1.3 2,-0.3 -3,-0.3 293,-0.3 0.976 66.7 134.1 50.2 60.0 39.1 0.9 22.7 43 51 A L < - 0 0 3 -5,-1.3 -1,-0.2 -6,-0.1 -2,-0.2 -0.981 61.5-101.1-131.4 145.9 37.4 -1.7 20.6 44 52 A S > - 0 0 13 -2,-0.3 4,-3.2 286,-0.2 5,-0.2 -0.291 23.8-123.6 -66.5 152.2 35.6 -4.8 21.9 45 53 A Q H > S+ 0 0 109 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.903 114.9 55.6 -62.9 -43.6 37.4 -8.1 21.7 46 54 A S H > S+ 0 0 62 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.901 111.5 43.9 -59.1 -36.4 34.4 -9.5 19.7 47 55 A N H > S+ 0 0 3 283,-0.3 4,-2.5 2,-0.2 5,-0.3 0.972 112.9 51.4 -68.0 -50.3 34.9 -6.6 17.2 48 56 A V H X S+ 0 0 0 -4,-3.2 4,-2.6 1,-0.3 5,-0.2 0.927 110.8 48.6 -51.4 -49.7 38.7 -6.9 17.0 49 57 A S H X S+ 0 0 55 -4,-2.7 4,-2.2 1,-0.2 -1,-0.3 0.885 109.5 52.3 -56.9 -43.3 38.4 -10.7 16.3 50 58 A H H X S+ 0 0 37 -4,-1.5 4,-1.5 -5,-0.2 -1,-0.2 0.904 112.6 44.8 -59.2 -45.2 35.8 -10.1 13.6 51 59 A Q H X S+ 0 0 4 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.872 110.9 53.4 -69.3 -39.0 38.1 -7.6 11.9 52 60 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.3 -2,-0.2 0.877 106.5 52.6 -66.8 -35.1 41.1 -9.8 12.2 53 61 A K H X S+ 0 0 152 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.917 111.9 46.2 -66.6 -37.0 39.3 -12.8 10.6 54 62 A L H X S+ 0 0 45 -4,-1.5 4,-0.8 2,-0.2 -2,-0.2 0.944 114.5 47.0 -68.7 -48.6 38.4 -10.5 7.7 55 63 A L H ><>S+ 0 0 0 -4,-2.8 5,-2.7 1,-0.2 6,-0.7 0.883 113.8 49.4 -58.4 -35.6 42.0 -9.2 7.4 56 64 A K H ><5S+ 0 0 98 -4,-2.6 3,-2.4 3,-0.2 -2,-0.2 0.914 100.6 62.7 -73.0 -41.5 43.3 -12.8 7.7 57 65 A S H 3<5S+ 0 0 82 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.701 110.5 40.6 -56.6 -23.5 40.9 -14.1 4.9 58 66 A V T <<5S- 0 0 20 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.052 119.7-112.9-108.8 15.5 42.7 -11.7 2.4 59 67 A H T < 5S+ 0 0 120 -3,-2.4 -3,-0.2 2,-0.2 -2,-0.1 0.763 81.2 123.6 60.4 36.7 46.1 -12.5 3.9 60 68 A L S -B 69 0A 139 3,-2.0 3,-1.4 1,-0.1 2,-0.2 -0.853 65.9 -54.4-141.6 99.5 52.5 -18.5 21.6 67 75 A G T 3 S- 0 0 58 -2,-0.3 -1,-0.1 1,-0.2 0, 0.0 -0.491 121.4 -17.3 59.5-125.5 51.8 -20.6 24.7 68 76 A Q T 3 S+ 0 0 210 -2,-0.2 -1,-0.2 -3,-0.1 2,-0.1 0.633 124.9 62.3 -85.8 -17.1 48.0 -20.4 25.4 69 77 A S E < S- B 0 66A 69 -3,-1.4 -3,-2.0 -5,-0.0 2,-0.5 -0.479 78.0-113.6-108.3-178.9 47.0 -17.3 23.2 70 78 A M E - B 0 65A 84 -5,-0.2 2,-0.5 -2,-0.1 -36,-0.5 -0.926 25.0-151.7-114.8 129.7 47.0 -16.4 19.6 71 79 A I E - B 0 64A 31 -7,-2.2 -7,-2.2 -2,-0.5 2,-0.3 -0.915 7.4-151.7-112.3 128.1 49.3 -13.6 18.4 72 80 A Y E +AB 32 63A 32 -40,-2.9 -40,-2.0 -2,-0.5 2,-0.3 -0.709 19.6 165.9 -98.8 150.2 48.5 -11.5 15.3 73 81 A S E - B 0 62A 17 -11,-2.0 -11,-2.5 -2,-0.3 -45,-0.1 -0.985 47.1 -82.8-153.8 152.2 51.0 -9.8 13.0 74 82 A L E - B 0 61A 18 -47,-0.3 -13,-0.3 -2,-0.3 -14,-0.1 -0.279 50.5-116.6 -50.0 145.7 51.1 -8.2 9.7 75 83 A D S S- 0 0 40 -15,-2.0 2,-0.3 1,-0.1 -14,-0.1 0.952 74.8 -34.4 -64.7 -50.5 51.4 -11.1 7.1 76 84 A D S > S- 0 0 49 -16,-0.2 4,-2.0 -14,-0.0 3,-0.4 -0.907 71.0 -75.8-154.9-174.6 54.8 -10.1 5.7 77 85 A I H > S+ 0 0 117 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.703 121.5 60.0 -62.8 -31.0 57.1 -7.2 4.8 78 86 A H H > S+ 0 0 41 2,-0.2 4,-2.6 3,-0.2 -1,-0.2 0.924 107.6 45.4 -67.2 -42.2 55.2 -6.3 1.7 79 87 A V H > S+ 0 0 1 -3,-0.4 4,-2.7 2,-0.2 5,-0.2 0.941 115.7 47.8 -61.7 -47.5 52.0 -5.7 3.8 80 88 A A H X S+ 0 0 14 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.915 113.4 47.5 -57.9 -40.8 54.1 -3.7 6.3 81 89 A T H X S+ 0 0 31 -4,-2.4 4,-2.2 2,-0.2 5,-0.3 0.929 110.6 50.9 -71.7 -43.1 55.8 -1.7 3.5 82 90 A M H X S+ 0 0 2 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.955 115.2 44.5 -55.3 -50.5 52.5 -1.0 1.7 83 91 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.918 112.6 48.2 -63.7 -45.6 51.0 0.3 4.9 84 92 A K H X S+ 0 0 110 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.861 113.1 48.1 -67.7 -34.2 53.9 2.3 6.1 85 93 A Q H X S+ 0 0 52 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.923 111.3 50.3 -73.6 -39.9 54.3 4.1 2.8 86 94 A A H X S+ 0 0 1 -4,-2.2 4,-2.3 -5,-0.3 5,-0.2 0.933 112.0 48.7 -59.1 -45.1 50.5 4.8 2.6 87 95 A I H X S+ 0 0 34 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.943 110.7 50.5 -58.8 -47.9 50.6 6.3 6.1 88 96 A H H < S+ 0 0 93 -4,-2.2 4,-0.4 1,-0.2 -1,-0.2 0.922 109.6 50.5 -60.5 -44.3 53.6 8.4 5.3 89 97 A H H >< S+ 0 0 13 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.910 111.6 47.6 -59.6 -40.4 51.9 9.7 2.1 90 98 A A H 3< S+ 0 0 5 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.770 110.6 53.8 -72.0 -22.8 48.8 10.7 4.1 91 99 A N T 3< S+ 0 0 91 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.507 105.4 80.1 -84.9 -1.7 51.0 12.3 6.7 92 100 A H S < S- 0 0 36 -3,-1.2 -3,-0.0 -4,-0.4 -4,-0.0 -0.447 72.6 -87.7-123.1 166.4 52.8 14.5 4.2 93 101 A P 0 0 106 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.610 360.0 360.0 -31.8-164.5 53.2 17.6 1.8 94 102 A K 0 0 195 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.711 360.0 360.0 66.8 360.0 52.2 18.3 -1.8 95 !* 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 96 9 B N >> 0 0 126 0, 0.0 4,-2.7 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 154.7 46.8 10.0 14.5 97 10 B T H 3> + 0 0 84 1,-0.2 4,-1.0 2,-0.2 5,-0.1 0.601 360.0 31.8 -35.6 -50.4 43.1 11.0 13.8 98 11 B D H 3> S+ 0 0 97 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.879 117.7 52.4 -86.4 -40.6 43.5 13.0 10.5 99 12 B T H <> S+ 0 0 6 -3,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.917 111.5 51.3 -47.7 -46.9 46.4 11.1 9.0 100 13 B L H X S+ 0 0 13 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.795 107.2 51.2 -74.3 -23.5 44.3 8.0 9.7 101 14 B E H X S+ 0 0 59 -4,-1.0 4,-2.1 -5,-0.3 -1,-0.2 0.856 109.7 50.6 -76.8 -36.9 41.2 9.5 7.9 102 15 B R H X S+ 0 0 112 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.929 111.3 47.7 -65.9 -40.7 43.2 10.3 4.9 103 16 B V H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.870 109.6 53.1 -70.1 -33.7 44.7 6.8 4.7 104 17 B T H X S+ 0 0 2 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.889 110.6 47.5 -57.9 -43.4 41.2 5.4 5.1 105 18 B E H X S+ 0 0 107 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.910 110.6 53.2 -66.6 -42.5 40.1 7.6 2.1 106 19 B I H X S+ 0 0 6 -4,-2.7 4,-1.1 1,-0.2 -2,-0.2 0.946 112.2 42.9 -52.2 -54.8 43.2 6.4 0.2 107 20 B F H X S+ 0 0 0 -4,-2.4 4,-0.9 2,-0.2 3,-0.4 0.893 109.8 56.3 -69.2 -34.1 42.4 2.8 0.7 108 21 B K H >< S+ 0 0 85 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.955 108.8 50.2 -57.4 -45.6 38.5 3.3 -0.0 109 22 B A H 3< S+ 0 0 5 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.739 109.5 50.1 -60.3 -28.9 39.6 4.8 -3.4 110 23 B L H 3< S+ 0 0 0 -4,-1.1 2,-2.3 -3,-0.4 -1,-0.3 0.613 83.5 96.0 -88.2 -12.4 41.8 1.8 -4.2 111 24 B G << + 0 0 13 -3,-1.0 2,-0.3 -4,-0.9 -1,-0.2 -0.209 68.1 87.8 -73.8 58.1 39.0 -0.7 -3.4 112 25 B D S > S- 0 0 5 -2,-2.3 4,-2.3 1,-0.1 5,-0.2 -0.967 71.8-134.8-163.1 126.7 37.9 -1.1 -7.0 113 26 B Y H > S+ 0 0 25 -2,-0.3 4,-2.2 1,-0.2 -1,-0.1 0.897 106.4 43.2 -48.6 -50.2 39.0 -3.4 -9.8 114 27 B N H > S+ 0 0 5 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.852 111.8 52.6 -72.8 -31.5 39.1 -0.7 -12.5 115 28 B R H > S+ 0 0 8 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.889 109.9 50.8 -69.3 -31.5 40.8 1.9 -10.4 116 29 B I H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.915 107.6 52.2 -69.4 -42.0 43.5 -0.7 -9.6 117 30 B R H X S+ 0 0 48 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.918 111.5 47.3 -58.4 -44.8 43.9 -1.4 -13.3 118 31 B I H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.894 112.9 48.9 -63.2 -45.4 44.4 2.4 -13.9 119 32 B M H X S+ 0 0 0 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.894 110.8 49.7 -57.0 -45.0 46.9 2.6 -11.0 120 33 B E H X S+ 0 0 71 -4,-2.8 4,-0.8 2,-0.2 -2,-0.2 0.904 111.0 50.2 -63.1 -41.5 48.8 -0.3 -12.2 121 34 B L H >X S+ 0 0 14 -4,-2.2 4,-1.9 1,-0.3 3,-1.0 0.929 109.7 49.7 -65.4 -44.7 49.0 1.2 -15.7 122 35 B L H 3< S+ 0 0 7 -4,-2.4 47,-0.3 1,-0.2 -1,-0.3 0.804 103.3 61.5 -59.5 -31.8 50.2 4.5 -14.4 123 36 B S H 3< S+ 0 0 35 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.703 104.6 50.0 -68.6 -24.8 52.9 2.6 -12.4 124 37 B V H << S- 0 0 99 -3,-1.0 2,-0.3 -4,-0.8 -2,-0.2 0.888 133.6 -28.1 -75.5 -49.9 54.2 1.4 -15.8 125 38 B S < - 0 0 63 -4,-1.9 -1,-0.3 2,-0.0 -2,-0.0 -0.945 68.3 -91.2-164.8 150.9 54.3 4.9 -17.3 126 39 B E - 0 0 128 -2,-0.3 2,-0.3 -3,-0.1 42,-0.2 -0.239 56.0-174.8 -58.5 152.6 52.6 8.3 -17.1 127 40 B A B -C 167 0B 5 40,-2.3 40,-2.7 4,-0.0 2,-0.1 -0.996 28.8-118.4-160.1 148.3 49.7 8.5 -19.5 128 41 B S > - 0 0 34 -2,-0.3 4,-2.8 38,-0.2 3,-0.2 -0.415 41.7-106.5 -75.4 156.3 47.0 10.5 -21.2 129 42 B V H > S+ 0 0 17 36,-0.5 4,-3.1 1,-0.2 5,-0.2 0.920 119.8 55.5 -46.8 -47.2 43.3 9.6 -20.8 130 43 B G H > S+ 0 0 28 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.884 109.4 44.8 -62.2 -39.2 43.2 8.3 -24.4 131 44 B H H > S+ 0 0 69 2,-0.2 4,-2.5 -3,-0.2 5,-0.2 0.938 113.3 50.5 -69.8 -42.7 46.0 5.9 -23.8 132 45 B I H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.955 112.6 47.6 -57.4 -48.5 44.6 4.8 -20.5 133 46 B S H X>S+ 0 0 22 -4,-3.1 5,-1.5 1,-0.2 4,-1.0 0.908 112.8 49.1 -55.1 -44.7 41.1 4.2 -22.2 134 47 B H H <5S+ 0 0 152 -4,-2.1 3,-0.5 -5,-0.2 -1,-0.2 0.933 113.5 44.6 -66.7 -47.1 42.7 2.3 -25.2 135 48 B Q H <5S+ 0 0 113 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.829 122.5 34.6 -69.7 -35.9 44.8 -0.1 -23.0 136 49 B L H <5S- 0 0 16 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.345 102.6-121.9 -99.0 0.8 42.2 -1.0 -20.4 137 50 B N T <5 + 0 0 90 -4,-1.0 2,-0.4 -3,-0.5 102,-0.3 0.964 67.0 135.5 49.8 57.1 39.1 -1.0 -22.8 138 51 B L < - 0 0 4 -5,-1.5 -1,-0.2 -6,-0.1 -2,-0.2 -0.984 60.8-101.7-127.6 144.7 37.4 1.7 -20.6 139 52 B S > - 0 0 13 -2,-0.4 4,-3.0 95,-0.2 5,-0.2 -0.292 24.1-124.0 -63.1 147.0 35.6 4.7 -21.9 140 53 B Q H > S+ 0 0 111 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.909 115.3 54.8 -58.2 -44.9 37.4 8.1 -21.8 141 54 B S H > S+ 0 0 58 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.889 110.8 44.8 -55.4 -42.9 34.4 9.4 -19.8 142 55 B N H > S+ 0 0 3 92,-0.3 4,-2.6 2,-0.2 3,-0.3 0.983 113.4 51.0 -63.4 -52.0 34.9 6.5 -17.2 143 56 B V H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.3 5,-0.2 0.908 110.8 47.6 -48.7 -51.6 38.7 7.0 -17.1 144 57 B S H X S+ 0 0 53 -4,-2.7 4,-1.9 1,-0.2 -1,-0.3 0.847 110.3 52.6 -59.4 -42.1 38.4 10.7 -16.4 145 58 B H H X S+ 0 0 39 -4,-1.6 4,-1.5 -3,-0.3 -1,-0.2 0.912 112.9 44.5 -58.7 -44.4 35.7 10.0 -13.7 146 59 B Q H X S+ 0 0 4 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.844 111.3 53.4 -74.2 -30.8 38.1 7.5 -11.9 147 60 B L H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.3 -1,-0.2 0.878 106.2 52.5 -71.6 -35.9 41.1 9.8 -12.3 148 61 B K H X S+ 0 0 152 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.916 111.8 46.5 -67.6 -38.6 39.2 12.7 -10.7 149 62 B L H X S+ 0 0 41 -4,-1.5 4,-0.9 2,-0.2 -2,-0.2 0.946 114.4 46.7 -64.8 -50.8 38.4 10.5 -7.7 150 63 B L H ><>S+ 0 0 0 -4,-2.7 5,-2.4 1,-0.2 3,-0.6 0.912 113.6 50.0 -57.5 -37.0 42.1 9.2 -7.5 151 64 B K H ><5S+ 0 0 107 -4,-2.8 3,-1.7 1,-0.2 -1,-0.2 0.877 100.5 62.2 -74.4 -36.2 43.3 12.7 -7.7 152 65 B S H 3<5S+ 0 0 81 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.729 109.6 41.7 -61.7 -25.5 41.0 14.0 -5.0 153 66 B V T <<5S- 0 0 18 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.103 119.9-112.0-105.1 15.9 42.7 11.7 -2.4 154 67 B H T < 5S+ 0 0 102 -3,-1.7 -3,-0.2 2,-0.2 -2,-0.1 0.811 81.8 123.3 64.7 38.0 46.2 12.5 -3.9 155 68 B L S -D 164 0B 146 3,-1.8 3,-1.3 1,-0.0 2,-0.6 -0.791 66.1 -64.3-146.1 90.6 52.3 18.8 -21.8 162 75 B G T 3 S- 0 0 65 -2,-0.3 -2,-0.0 1,-0.2 -1,-0.0 -0.460 120.3 -1.6 63.7-109.2 51.3 21.0 -24.6 163 76 B Q T 3 S+ 0 0 205 -2,-0.6 2,-0.2 -3,-0.1 -1,-0.2 0.578 123.7 44.5 -90.9 -21.2 47.6 20.1 -25.5 164 77 B S E < S- D 0 161B 69 -3,-1.3 -3,-1.8 -5,-0.1 2,-0.5 -0.755 78.5-106.9-126.8 176.2 46.7 17.2 -23.1 165 78 B M E - D 0 160B 69 -2,-0.2 2,-0.5 -5,-0.2 -36,-0.5 -0.869 25.0-149.1-104.8 129.4 47.0 16.3 -19.5 166 79 B I E - D 0 159B 34 -7,-1.8 -7,-2.0 -2,-0.5 2,-0.3 -0.908 12.2-151.5-104.7 126.7 49.4 13.6 -18.5 167 80 B Y E +CD 127 158B 32 -40,-2.7 -40,-2.3 -2,-0.5 2,-0.3 -0.695 20.0 167.1 -97.5 147.4 48.5 11.5 -15.4 168 81 B S E - D 0 157B 17 -11,-2.0 -11,-3.0 -2,-0.3 -45,-0.1 -0.989 45.8 -86.1-151.8 152.2 51.0 9.9 -13.1 169 82 B L E - D 0 156B 15 -47,-0.3 -13,-0.3 -2,-0.3 -14,-0.1 -0.333 49.5-117.5 -52.4 145.3 51.0 8.3 -9.7 170 83 B D S S- 0 0 18 -15,-2.1 2,-0.3 1,-0.1 -14,-0.1 0.928 74.0 -32.4 -65.8 -50.2 51.5 11.1 -7.2 171 84 B D S >> S- 0 0 25 -16,-0.2 4,-2.2 -14,-0.0 3,-0.6 -0.924 70.7 -76.5-156.8-176.1 54.9 10.0 -5.8 172 85 B I H 3> S+ 0 0 117 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.694 121.5 60.7 -64.3 -26.4 57.1 7.1 -4.9 173 86 B H H 3> S+ 0 0 37 2,-0.2 4,-2.4 3,-0.2 -1,-0.2 0.904 108.0 43.6 -67.9 -40.4 55.1 6.3 -1.7 174 87 B V H <> S+ 0 0 2 -3,-0.6 4,-2.5 2,-0.2 -2,-0.2 0.933 116.4 48.3 -70.2 -46.6 52.0 5.6 -3.8 175 88 B A H X S+ 0 0 13 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.935 113.8 46.4 -57.7 -42.6 54.1 3.7 -6.3 176 89 B T H X S+ 0 0 32 -4,-2.4 4,-2.1 2,-0.2 5,-0.3 0.916 111.5 50.4 -69.9 -41.2 55.8 1.7 -3.6 177 90 B M H X S+ 0 0 2 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.963 114.7 45.9 -58.2 -48.1 52.5 1.0 -1.7 178 91 B L H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.918 113.2 46.4 -64.2 -45.7 51.0 -0.2 -5.0 179 92 B K H X S+ 0 0 110 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.847 112.4 49.9 -70.1 -33.1 53.9 -2.4 -6.2 180 93 B Q H X S+ 0 0 55 -4,-2.1 4,-2.6 -5,-0.3 -1,-0.2 0.925 110.5 50.6 -72.8 -39.6 54.3 -4.0 -2.8 181 94 B A H X S+ 0 0 2 -4,-2.2 4,-2.5 -5,-0.3 -2,-0.2 0.913 112.2 47.6 -59.2 -44.3 50.5 -4.9 -2.6 182 95 B I H X S+ 0 0 33 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.939 110.7 50.9 -65.1 -44.2 50.6 -6.4 -6.1 183 96 B H H X S+ 0 0 69 -4,-2.3 4,-1.1 2,-0.2 -2,-0.2 0.928 111.0 48.9 -58.2 -47.5 53.7 -8.4 -5.3 184 97 B H H >< S+ 0 0 21 -4,-2.6 3,-0.7 1,-0.2 -2,-0.2 0.927 111.6 49.6 -58.8 -42.9 52.0 -9.7 -2.2 185 98 B A H 3< S+ 0 0 4 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.807 108.4 54.6 -63.8 -30.3 48.9 -10.6 -4.2 186 99 B N H 3< S+ 0 0 82 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.813 106.5 62.4 -73.9 -22.6 51.0 -12.4 -6.7 187 100 B H << 0 0 105 -4,-1.1 -3,-0.0 -3,-0.7 -4,-0.0 -0.124 360.0 360.0-114.5 174.2 52.7 -14.7 -4.3 188 101 B P 0 0 173 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 0.057 360.0 360.0 -33.7 360.0 52.9 -17.5 -1.7 189 !* 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 0.0 190 6 C S 0 0 140 0, 0.0 124,-0.0 0, 0.0 139,-0.0 0.000 360.0 360.0 360.0 48.4 18.1 -8.9 19.5 191 7 C E + 0 0 127 1,-0.1 123,-0.1 2,-0.0 122,-0.0 0.594 360.0 44.6 -99.3-116.2 17.5 -9.4 15.8 192 8 C I - 0 0 34 1,-0.1 -1,-0.1 118,-0.1 5,-0.1 0.234 68.1-106.5 -76.2 149.0 19.0 -10.6 12.6 193 9 C N > - 0 0 85 1,-0.1 4,-1.9 3,-0.1 3,-0.3 -0.153 27.1-119.0 -69.9 151.3 21.1 -13.7 12.0 194 10 C T H > S+ 0 0 82 1,-0.3 4,-1.4 2,-0.2 -1,-0.1 0.775 113.0 50.9 -67.4 -29.4 24.8 -13.4 11.5 195 11 C D H > S+ 0 0 94 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.853 107.7 54.3 -71.9 -39.1 24.8 -14.9 8.0 196 12 C T H > S+ 0 0 1 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.883 107.3 50.6 -59.7 -41.6 22.0 -12.5 7.0 197 13 C L H X S+ 0 0 5 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.869 109.0 50.8 -70.2 -36.1 24.1 -9.5 8.1 198 14 C E H X S+ 0 0 68 -4,-1.4 4,-2.7 2,-0.2 -1,-0.2 0.899 110.6 50.1 -59.8 -44.0 27.1 -10.7 6.1 199 15 C R H X S+ 0 0 96 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.904 111.9 45.5 -67.9 -40.1 24.9 -11.1 3.1 200 16 C V H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.872 111.0 55.1 -71.7 -33.2 23.4 -7.5 3.4 201 17 C T H X S+ 0 0 1 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.946 108.3 48.5 -56.0 -51.4 27.0 -6.2 4.0 202 18 C E H X S+ 0 0 105 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.944 111.0 52.2 -53.4 -49.2 28.0 -7.9 0.7 203 19 C I H X S+ 0 0 7 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.945 112.4 42.3 -51.8 -52.7 25.0 -6.3 -1.0 204 20 C F H X S+ 0 0 0 -4,-2.6 4,-0.9 2,-0.2 3,-0.3 0.943 111.1 54.2 -73.3 -38.2 25.8 -2.8 0.2 205 21 C K H >< S+ 0 0 73 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.934 108.9 51.8 -51.7 -44.3 29.6 -3.1 -0.6 206 22 C A H 3< S+ 0 0 6 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.844 109.6 48.9 -61.7 -33.6 28.6 -4.1 -4.1 207 23 C L H 3< S+ 0 0 0 -4,-1.5 2,-2.1 -3,-0.3 -1,-0.3 0.544 84.2 96.6 -85.6 -7.0 26.4 -1.1 -4.5 208 24 C G << + 0 0 11 -3,-1.1 2,-0.3 -4,-0.9 -1,-0.2 -0.379 65.6 88.8 -82.0 65.7 29.0 1.3 -3.3 209 25 C D S > S- 0 0 5 -2,-2.1 4,-2.1 1,-0.1 5,-0.2 -0.911 71.6-134.6-167.1 126.0 30.3 2.4 -6.7 210 26 C Y H > S+ 0 0 29 -2,-0.3 4,-1.9 1,-0.2 -1,-0.1 0.896 105.1 44.2 -52.3 -54.5 29.1 5.2 -9.0 211 27 C N H > S+ 0 0 6 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.852 111.2 53.3 -69.4 -31.4 29.1 3.2 -12.2 212 28 C R H > S+ 0 0 10 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.867 108.1 51.4 -69.6 -31.8 27.3 0.1 -10.6 213 29 C I H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.840 108.4 53.4 -64.5 -45.0 24.6 2.5 -9.3 214 30 C R H X S+ 0 0 51 -4,-1.9 4,-2.3 -5,-0.2 -2,-0.2 0.916 111.1 45.0 -54.0 -44.1 24.3 3.8 -12.9 215 31 C I H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.916 114.4 47.7 -67.3 -44.7 23.8 0.2 -14.2 216 32 C M H X S+ 0 0 0 -4,-2.3 4,-0.9 2,-0.2 -1,-0.2 0.890 112.0 51.5 -63.7 -41.4 21.3 -0.7 -11.5 217 33 C E H >X S+ 0 0 71 -4,-2.5 4,-1.1 2,-0.2 3,-0.8 0.923 108.8 48.1 -62.7 -52.4 19.4 2.5 -12.1 218 34 C L H >X S+ 0 0 16 -4,-2.3 4,-2.2 1,-0.2 3,-0.9 0.913 110.9 53.6 -52.5 -44.0 19.1 1.9 -15.8 219 35 C L H 3< S+ 0 0 8 -4,-2.4 47,-0.6 1,-0.3 -1,-0.2 0.714 101.9 58.2 -65.9 -22.9 18.0 -1.7 -15.0 220 36 C S H << S+ 0 0 36 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.726 108.6 46.9 -76.7 -27.8 15.2 -0.3 -12.8 221 37 C V H << S- 0 0 108 -4,-1.1 2,-0.3 -3,-0.9 -2,-0.2 0.905 134.5 -17.9 -71.5 -46.2 14.0 1.6 -15.8 222 38 C S < - 0 0 61 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.1 -0.911 67.4-103.2-170.1 127.1 14.1 -1.4 -18.1 223 39 C E - 0 0 100 -2,-0.3 2,-0.3 -3,-0.1 42,-0.2 -0.088 53.6-173.1 -45.9 156.6 15.7 -4.9 -18.4 224 40 C A E -E 264 0C 2 40,-2.3 40,-3.3 -5,-0.0 2,-0.2 -1.000 29.8-112.9-165.1 149.8 18.6 -4.8 -20.8 225 41 C S E > -E 263 0C 25 -2,-0.3 4,-2.1 38,-0.2 3,-0.2 -0.539 40.3-112.3 -80.3 153.5 21.3 -6.4 -22.9 226 42 C V H > S+ 0 0 24 36,-0.6 4,-2.6 1,-0.2 5,-0.2 0.936 119.8 54.2 -43.1 -50.9 25.0 -5.8 -22.1 227 43 C G H > S+ 0 0 26 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.875 106.8 48.1 -56.6 -40.8 25.2 -4.0 -25.4 228 44 C H H > S+ 0 0 78 -3,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.899 111.6 49.1 -73.8 -36.0 22.4 -1.7 -24.6 229 45 C I H X S+ 0 0 0 -4,-2.1 4,-3.3 2,-0.2 5,-0.3 0.967 111.7 51.2 -64.4 -50.1 23.8 -0.8 -21.2 230 46 C S H X>S+ 0 0 19 -4,-2.6 4,-2.0 1,-0.2 5,-1.3 0.948 114.5 42.8 -47.1 -54.9 27.2 -0.1 -22.8 231 47 C H H <5S+ 0 0 150 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.902 116.9 46.5 -62.4 -46.1 25.6 2.2 -25.4 232 48 C Q H <5S+ 0 0 113 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.875 123.2 30.9 -70.2 -39.1 23.4 3.9 -23.0 233 49 C L H <5S- 0 0 17 -4,-3.3 -2,-0.2 -5,-0.2 -1,-0.2 0.554 102.0-119.1 -98.3 -5.0 26.0 4.6 -20.2 234 50 C N T <5 + 0 0 92 -4,-2.0 2,-0.4 1,-0.3 -92,-0.3 0.973 69.5 133.7 59.7 54.6 29.2 5.0 -22.3 235 51 C L < - 0 0 3 -5,-1.3 -1,-0.3 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-64.2 -44.8 29.8 8.8 9.6 343 63 D L H ><>S+ 0 0 0 -4,-2.4 5,-2.4 1,-0.2 3,-1.0 0.928 110.9 49.4 -65.5 -39.8 26.2 7.6 9.1 344 64 D K H ><5S+ 0 0 98 -4,-2.6 3,-1.7 1,-0.2 -1,-0.2 0.804 98.5 68.2 -67.7 -27.4 24.8 11.1 9.9 345 65 D S H 3<5S+ 0 0 78 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.672 109.7 35.1 -70.1 -17.8 27.2 12.7 7.4 346 66 D V T <<5S- 0 0 17 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 -0.116 120.7-107.6-119.4 25.2 25.4 11.1 4.5 347 67 D H T < 5S+ 0 0 72 -3,-1.7 -3,-0.2 2,-0.1 -2,-0.1 0.783 81.4 124.4 54.1 44.3 21.9 11.4 6.1 348 68 D L S S- 0 0 40 -16,-0.2 4,-2.3 -14,-0.0 3,-0.4 -0.919 71.9 -70.8-164.6-177.8 13.3 8.7 7.7 365 85 D I H > S+ 0 0 115 -2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.804 121.5 61.3 -61.7 -31.1 11.0 6.1 6.1 366 86 D H H > S+ 0 0 34 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.904 109.2 42.0 -61.8 -40.3 13.1 5.9 2.9 367 87 D V H > S+ 0 0 2 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.923 114.7 51.1 -71.3 -46.0 16.2 4.8 4.8 368 88 D A H X S+ 0 0 14 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.932 113.6 44.8 -57.3 -46.0 14.1 2.5 6.9 369 89 D T H X S+ 0 0 31 -4,-2.9 4,-2.9 2,-0.2 5,-0.3 0.959 110.6 53.0 -64.5 -52.2 12.5 0.9 3.8 370 90 D M H X S+ 0 0 2 -4,-2.4 4,-2.5 -5,-0.2 5,-0.2 0.957 114.5 44.0 -41.4 -54.0 15.8 0.6 1.9 371 91 D L H X S+ 0 0 1 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.946 114.0 46.2 -64.8 -51.7 17.2 -1.3 4.9 372 92 D K H X S+ 0 0 120 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.833 113.5 50.5 -63.5 -32.3 14.3 -3.6 5.6 373 93 D Q H X S+ 0 0 53 -4,-2.9 4,-3.0 -5,-0.2 -1,-0.2 0.955 110.9 48.4 -72.5 -44.0 14.0 -4.5 2.0 374 94 D A H X S+ 0 0 1 -4,-2.5 4,-2.6 -5,-0.3 -2,-0.2 0.926 112.5 48.6 -55.4 -50.7 17.7 -5.3 1.6 375 95 D I H X S+ 0 0 16 -4,-2.9 4,-0.7 2,-0.2 -1,-0.2 0.883 111.5 50.1 -57.1 -41.6 17.6 -7.4 4.8 376 96 D H H >X S+ 0 0 92 -4,-1.7 4,-2.1 -5,-0.2 3,-1.3 0.951 109.6 50.0 -64.2 -47.1 14.6 -9.2 3.5 377 97 D H H 3< S+ 0 0 2 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.929 107.3 54.9 -55.0 -45.8 16.3 -9.9 0.2 378 98 D A H 3< S+ 0 0 1 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.636 111.1 47.5 -64.6 -15.4 19.3 -11.2 2.0 379 99 D N H << S+ 0 0 83 -3,-1.3 -1,-0.2 -4,-0.7 -2,-0.2 0.889 95.7 86.2 -85.5 -42.9 17.0 -13.7 3.8 380 100 D H S < S- 0 0 35 -4,-2.1 2,-0.2 1,-0.1 -3,-0.0 0.067 79.3 -98.0 -73.7 164.9 14.9 -15.1 0.9 381 101 D P + 0 0 120 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.612 38.2 167.4 -85.0 143.8 15.5 -18.1 -1.5 382 102 D K 0 0 58 -2,-0.2 -131,-0.0 1,-0.0 0, 0.0 -0.800 360.0 360.0-160.2 103.3 16.9 -17.6 -5.1 383 103 D E 0 0 242 -2,-0.2 -1,-0.0 0, 0.0 0, 0.0 0.220 360.0 360.0-100.3 360.0 18.1 -20.6 -7.3