==== 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 GENE REGULATION, TRANSFERASE 21-MAY-01 1J8F . COMPND 2 MOLECULE: SIRTUIN 2, ISOFORM 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.P.PAVLETICH,M.S.FINNIN,J.R.DONIGIAN . 927 5 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45640.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 612 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 90 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 1 0.1 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 . 61 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 111 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 277 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 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 4 0 5 2 2 7 6 5 1 1 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 3 3 9 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 . 3 2 1 3 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 3 0 0 3 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 34 A G > 0 0 78 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -55.8 27.9 21.0 57.5 2 35 A E H > + 0 0 167 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.851 360.0 54.8 -67.9 -31.6 24.9 18.5 57.8 3 36 A A H > S+ 0 0 69 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.905 106.9 50.4 -66.0 -41.7 23.2 20.6 55.1 4 37 A D H > S+ 0 0 96 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.899 111.8 48.0 -62.1 -42.6 26.2 20.2 52.8 5 38 A M H X S+ 0 0 34 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.915 111.2 48.5 -67.0 -41.2 26.2 16.5 53.4 6 39 A D H X S+ 0 0 89 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.911 109.5 55.6 -62.2 -41.3 22.4 16.2 52.7 7 40 A F H X S+ 0 0 54 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.940 113.2 39.5 -54.4 -52.5 23.0 18.3 49.6 8 41 A L H X S+ 0 0 5 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.881 111.7 57.6 -68.3 -39.2 25.6 15.8 48.2 9 42 A R H < S+ 0 0 117 -4,-2.7 -2,-0.2 304,-0.4 -1,-0.2 0.918 107.7 46.6 -59.9 -42.5 23.7 12.7 49.4 10 43 A N H < S+ 0 0 86 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.861 114.4 48.5 -68.2 -33.2 20.6 13.6 47.4 11 44 A L H < 0 0 2 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.846 360.0 360.0 -74.9 -35.0 22.6 14.4 44.3 12 45 A F < 0 0 50 -4,-2.5 -3,-0.2 -5,-0.1 -2,-0.2 0.894 360.0 360.0-107.6 360.0 24.7 11.3 44.3 13 ! 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 14 57 A R 0 0 102 0, 0.0 2,-0.2 0, 0.0 13,-0.0 0.000 360.0 360.0 360.0 24.4 42.0 49.4 35.8 15 58 A L - 0 0 105 222,-0.1 2,-0.2 1,-0.0 258,-0.1 -0.725 360.0 -94.8-122.1 169.2 44.5 47.7 33.6 16 59 A L - 0 0 10 256,-0.4 3,-0.1 -2,-0.2 8,-0.1 -0.523 14.4-145.3 -80.4 139.5 47.1 45.0 33.4 17 60 A D S S+ 0 0 40 6,-0.3 2,-0.3 1,-0.3 329,-0.2 0.871 92.6 4.2 -67.7 -39.3 50.9 45.6 33.9 18 61 A E S S- 0 0 22 2,-0.2 2,-2.0 326,-0.1 -1,-0.3 -0.993 77.6-112.6-146.3 151.0 51.4 43.0 31.3 19 62 A L S S+ 0 0 60 -2,-0.3 2,-0.3 -3,-0.1 257,-0.2 -0.431 81.5 100.3 -83.7 66.0 49.2 40.9 29.0 20 63 A T S > S- 0 0 40 -2,-2.0 4,-2.1 255,-0.1 5,-0.2 -0.901 89.4-102.6-140.9 168.0 50.0 37.6 30.7 21 64 A L H > S+ 0 0 7 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.892 125.5 54.6 -60.0 -37.4 48.5 35.2 33.2 22 65 A E H > S+ 0 0 49 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.908 105.3 52.2 -61.4 -43.0 50.9 36.8 35.7 23 66 A G H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -6,-0.3 0.891 109.5 49.3 -59.4 -41.5 49.6 40.2 34.9 24 67 A V H X S+ 0 0 1 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.913 107.8 54.1 -65.1 -41.9 46.1 39.1 35.5 25 68 A A H X S+ 0 0 3 -4,-2.3 4,-1.0 1,-0.2 -2,-0.2 0.928 109.5 47.2 -60.2 -43.6 47.0 37.6 38.8 26 69 A R H >X S+ 0 0 29 -4,-2.2 3,-0.6 1,-0.2 4,-0.5 0.913 111.1 51.6 -65.0 -39.9 48.6 40.9 40.0 27 70 A Y H >< S+ 0 0 9 -4,-2.1 3,-1.6 1,-0.2 6,-0.5 0.921 105.0 56.7 -60.9 -42.2 45.5 42.8 38.8 28 71 A M H 3< S+ 0 0 16 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.747 107.1 49.5 -61.4 -23.3 43.3 40.4 40.8 29 72 A Q H << S+ 0 0 118 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.506 93.1 95.0 -94.4 -4.9 45.2 41.3 43.9 30 73 A S S X< S- 0 0 40 -3,-1.6 3,-0.9 -4,-0.5 -3,-0.0 -0.422 87.4-117.0 -79.8 161.5 44.9 45.0 43.3 31 74 A E T 3 S+ 0 0 105 1,-0.2 -1,-0.1 -2,-0.1 -3,-0.1 0.668 109.7 70.3 -74.0 -13.3 42.0 46.8 45.0 32 75 A R T 3 S+ 0 0 96 1,-0.2 2,-1.2 -5,-0.2 3,-0.3 0.731 82.4 76.7 -74.7 -23.3 40.6 47.7 41.6 33 76 A C < + 0 0 5 -3,-0.9 -1,-0.2 -6,-0.5 3,-0.1 -0.710 51.3 130.6 -93.8 90.1 39.6 44.1 41.0 34 77 A R + 0 0 136 -2,-1.2 2,-0.5 1,-0.2 -1,-0.2 0.694 61.6 50.2-109.9 -28.7 36.4 43.6 43.1 35 78 A R - 0 0 104 -3,-0.3 177,-2.4 175,-0.2 178,-1.3 -0.965 62.1-177.6-122.6 119.9 33.9 42.0 40.7 36 79 A V E -ab 118 213A 0 81,-2.7 83,-3.2 -2,-0.5 84,-1.3 -0.933 7.2-165.2-118.0 137.6 34.8 39.0 38.5 37 80 A I E -ab 120 214A 0 176,-2.5 178,-3.0 -2,-0.4 2,-0.4 -0.985 6.4-157.7-121.2 130.7 32.5 37.4 36.0 38 81 A C E -ab 121 215A 0 82,-2.3 84,-3.3 -2,-0.4 2,-0.5 -0.913 3.3-165.4-107.4 138.5 33.3 33.9 34.6 39 82 A L E -ab 122 216A 0 176,-2.6 178,-2.7 -2,-0.4 2,-0.3 -0.997 22.7-176.7-122.3 115.2 31.8 32.8 31.2 40 83 A V E +ab 123 217A 0 82,-3.0 84,-2.0 -2,-0.5 85,-0.3 -0.906 13.9 178.2-126.1 149.5 32.2 29.0 31.0 41 84 A G > - 0 0 2 176,-1.9 3,-2.2 -2,-0.3 4,-0.2 -0.597 54.1 -62.3-129.0-169.5 31.5 26.3 28.4 42 85 A A G >> S+ 0 0 67 1,-0.3 3,-1.8 -2,-0.2 4,-0.7 0.706 116.1 75.3 -51.5 -28.9 31.9 22.5 27.9 43 86 A G G 34 S+ 0 0 20 175,-2.5 238,-0.4 1,-0.3 4,-0.4 0.696 86.5 61.8 -62.4 -19.5 35.7 22.7 28.2 44 87 A I G <4 S+ 0 0 0 -3,-2.2 62,-0.3 174,-0.4 -1,-0.3 0.612 108.7 41.7 -84.9 -5.9 35.5 23.1 31.9 45 88 A S T X>>S+ 0 0 1 -3,-1.8 5,-1.5 -4,-0.2 3,-1.3 0.466 84.6 92.4-114.3 -5.3 33.9 19.7 32.4 46 89 A T G ><5S+ 0 0 71 -4,-0.7 3,-1.3 1,-0.3 -2,-0.1 0.880 84.8 55.4 -58.7 -36.0 35.8 17.6 30.0 47 90 A S G 345S+ 0 0 63 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.675 98.7 62.6 -73.0 -13.4 38.3 16.5 32.7 48 91 A A G <45S- 0 0 26 -3,-1.3 53,-0.3 2,-0.1 -1,-0.3 0.654 124.2-103.4 -80.8 -15.8 35.4 15.3 34.9 49 92 A G T <<5 + 0 0 44 -3,-1.3 -3,-0.2 -4,-0.6 -2,-0.1 0.451 65.0 158.0 107.3 3.2 34.6 12.8 32.1 50 93 A I < - 0 0 23 -5,-1.5 -1,-0.3 -8,-0.1 -2,-0.1 -0.408 42.9-121.1 -60.3 126.9 31.6 14.6 30.6 51 94 A P - 0 0 47 0, 0.0 2,-1.0 0, 0.0 -1,-0.1 -0.164 19.4 -99.1 -72.0 165.8 31.4 13.1 27.1 52 95 A D > - 0 0 76 1,-0.2 3,-1.6 -6,-0.0 6,-0.2 -0.771 35.1-159.2 -81.0 104.5 31.6 14.9 23.7 53 96 A F T 3 S+ 0 0 82 -2,-1.0 -1,-0.2 1,-0.3 -3,-0.0 0.646 80.7 73.6 -65.5 -12.9 27.9 15.1 23.0 54 97 A R T 3 S+ 0 0 211 2,-0.0 -1,-0.3 -3,-0.0 -2,-0.0 0.719 81.1 83.2 -72.9 -21.6 28.6 15.6 19.3 55 98 A S < - 0 0 39 -3,-1.6 3,-0.4 1,-0.1 5,-0.2 -0.733 58.4-163.9 -92.2 127.9 29.6 12.0 18.8 56 99 A P S S+ 0 0 103 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 0.572 74.8 97.3 -77.6 -8.7 26.9 9.3 18.3 57 100 A S + 0 0 109 2,-0.1 -3,-0.0 3,-0.1 -2,-0.0 0.902 69.0 66.4 -44.0 -61.6 29.8 7.0 19.1 58 101 A T S > S- 0 0 53 -3,-0.4 3,-0.5 -6,-0.2 4,-0.1 -0.063 99.8-106.6 -58.3 167.7 28.9 6.5 22.7 59 102 A G T 3 S+ 0 0 43 1,-0.2 4,-0.5 2,-0.1 3,-0.4 0.150 87.6 113.6 -85.2 22.8 25.7 4.7 23.7 60 103 A L T 3 S+ 0 0 16 1,-0.2 3,-0.2 -5,-0.2 -1,-0.2 0.896 83.8 28.4 -60.0 -45.2 24.2 8.1 24.7 61 104 A Y S X> S+ 0 0 63 -3,-0.5 4,-1.3 -5,-0.2 3,-1.2 0.371 90.6 100.6-101.0 4.2 21.5 8.3 22.0 62 105 A D T 34 S+ 0 0 83 -3,-0.4 3,-0.4 1,-0.3 -1,-0.2 0.891 82.1 52.5 -54.2 -45.5 21.0 4.5 21.4 63 106 A N T 34 S+ 0 0 70 -4,-0.5 -1,-0.3 -3,-0.2 -2,-0.1 0.675 107.1 56.2 -66.4 -16.8 17.8 4.5 23.5 64 107 A L T X> S+ 0 0 17 -3,-1.2 2,-4.3 1,-0.2 3,-2.7 0.802 78.4 84.8 -86.6 -33.2 16.5 7.4 21.4 65 108 A E T 3< S+ 0 0 153 -4,-1.3 -1,-0.2 -3,-0.4 -3,-0.1 -0.235 88.3 61.4 -67.4 57.1 16.7 5.8 18.0 66 109 A K T 34 S+ 0 0 128 -2,-4.3 -1,-0.3 -3,-0.1 -2,-0.1 0.291 91.6 58.7-156.0 -18.9 13.3 4.3 18.8 67 110 A Y T <4 S- 0 0 91 -3,-2.7 -2,-0.2 19,-0.0 -3,-0.1 0.536 91.9-139.5 -96.6 -11.0 11.1 7.4 19.3 68 111 A H < - 0 0 162 -4,-0.6 -3,-0.1 1,-0.1 -4,-0.0 0.961 16.5-147.4 47.5 75.6 11.8 8.8 15.8 69 112 A L - 0 0 49 -5,-0.2 -1,-0.1 1,-0.1 4,-0.0 -0.492 10.7-133.4 -71.4 136.5 12.1 12.5 16.5 70 113 A P S S- 0 0 84 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.782 87.6 -6.1 -61.1 -29.1 10.9 14.8 13.7 71 114 A Y S > S- 0 0 98 1,-0.1 3,-1.8 0, 0.0 4,-0.4 -0.949 80.0-103.3-160.6 151.4 14.0 16.9 13.9 72 115 A P G > S+ 0 0 110 0, 0.0 3,-1.1 0, 0.0 4,-0.2 0.850 116.8 53.7 -49.2 -43.6 17.0 16.9 16.2 73 116 A E G > S+ 0 0 97 1,-0.2 3,-2.1 2,-0.1 119,-0.3 0.642 84.8 87.8 -70.0 -12.6 16.0 20.0 18.2 74 117 A A G X S+ 0 0 0 -3,-1.8 3,-2.0 1,-0.3 -1,-0.2 0.826 75.7 66.3 -56.6 -32.1 12.6 18.5 19.0 75 118 A I G < S+ 0 0 17 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.1 0.731 111.5 35.9 -65.8 -17.1 13.9 16.7 22.1 76 119 A F G < S+ 0 0 62 -3,-2.1 116,-3.0 -4,-0.2 2,-0.5 0.007 94.3 106.5-119.7 26.6 14.4 20.2 23.6 77 120 A E B <> -f 192 0B 25 -3,-2.0 4,-2.5 114,-0.2 116,-0.2 -0.920 64.3-141.5-110.7 131.8 11.4 21.9 22.1 78 121 A I H > S+ 0 0 17 114,-2.6 4,-2.1 -2,-0.5 5,-0.1 0.856 97.4 50.2 -62.4 -40.1 8.5 22.6 24.4 79 122 A S H > S+ 0 0 71 113,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.902 114.1 46.8 -68.0 -34.3 5.5 21.9 22.2 80 123 A Y H >> S+ 0 0 35 1,-0.2 4,-3.1 2,-0.2 3,-0.8 0.930 110.1 54.1 -69.1 -43.8 7.1 18.6 21.2 81 124 A F H 3< S+ 0 0 2 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.899 103.3 55.9 -55.1 -44.8 7.8 17.8 24.9 82 125 A K H 3< S+ 0 0 111 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.782 117.8 34.2 -61.7 -28.6 4.2 18.4 25.9 83 126 A K H << S+ 0 0 163 -4,-0.9 -2,-0.2 -3,-0.8 -1,-0.2 0.748 135.4 22.3 -95.1 -31.2 3.0 15.8 23.3 84 127 A H < + 0 0 88 -4,-3.1 4,-0.5 -5,-0.1 -1,-0.2 -0.641 63.4 158.2-140.1 78.7 6.0 13.4 23.6 85 128 A P > + 0 0 8 0, 0.0 4,-2.1 0, 0.0 3,-0.3 0.753 58.7 82.8 -73.5 -24.4 7.9 13.7 26.9 86 129 A E H > S+ 0 0 81 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.858 85.6 53.2 -49.5 -51.4 9.4 10.2 26.8 87 130 A P H > S+ 0 0 1 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.939 110.8 46.6 -54.1 -49.2 12.4 11.0 24.5 88 131 A F H > S+ 0 0 3 -4,-0.5 4,-3.3 -3,-0.3 -2,-0.2 0.935 113.4 48.7 -59.3 -46.0 13.6 13.9 26.7 89 132 A F H X S+ 0 0 15 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.836 108.0 54.0 -65.7 -29.4 13.3 11.8 29.9 90 133 A A H X S+ 0 0 18 -4,-2.4 4,-0.6 -5,-0.2 -1,-0.2 0.930 114.1 42.6 -69.2 -41.6 15.1 8.9 28.3 91 134 A L H >X S+ 0 0 10 -4,-2.2 3,-1.4 -5,-0.2 4,-1.3 0.914 109.3 57.2 -68.0 -41.9 18.0 11.3 27.5 92 135 A A H 3X S+ 0 0 0 -4,-3.3 4,-2.9 1,-0.3 -1,-0.2 0.806 93.6 68.4 -59.9 -28.1 17.7 13.1 30.9 93 136 A K H 3< S+ 0 0 74 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.860 106.7 41.2 -58.6 -32.7 18.3 9.7 32.6 94 137 A E H << S+ 0 0 71 -3,-1.4 -1,-0.2 -4,-0.6 -2,-0.2 0.786 118.8 45.4 -83.9 -31.0 21.8 10.0 31.1 95 138 A L H < S+ 0 0 26 -4,-1.3 -2,-0.2 2,-0.0 -3,-0.2 0.717 80.8 108.9 -89.8 -24.4 22.3 13.7 31.9 96 139 A Y S < S- 0 0 10 -4,-2.9 3,-0.4 -5,-0.1 31,-0.1 -0.230 78.9 -99.5 -55.1 142.0 21.1 14.0 35.5 97 140 A P S S+ 0 0 9 0, 0.0 -1,-0.1 0, 0.0 31,-0.1 -0.167 87.2 86.8 -60.3 156.6 23.8 14.6 37.9 98 141 A G S S+ 0 0 26 2,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.086 76.1 66.8 140.3 -25.3 25.3 11.8 40.0 99 142 A Q S S+ 0 0 148 -3,-0.4 2,-0.3 -4,-0.1 -87,-0.1 0.588 96.1 52.0-100.8 -9.0 28.0 10.2 37.9 100 143 A F - 0 0 46 27,-0.1 -2,-0.3 -51,-0.0 -51,-0.1 -0.904 63.8-142.8-130.8 153.9 30.5 13.1 37.8 101 144 A K - 0 0 56 -2,-0.3 28,-0.1 -53,-0.3 205,-0.1 -0.832 36.5 -94.5-111.5 152.9 32.4 15.3 40.2 102 145 A P - 0 0 1 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.216 44.4-123.9 -60.0 156.1 33.2 19.0 39.7 103 146 A T > - 0 0 6 -59,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.419 27.2 -95.2 -98.1 175.3 36.7 19.8 38.3 104 147 A I H > S+ 0 0 39 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.900 127.2 56.8 -53.2 -43.5 39.6 21.9 39.6 105 148 A C H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.910 105.7 49.4 -57.8 -44.8 38.2 24.7 37.4 106 149 A H H > S+ 0 0 1 -62,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.927 111.0 48.5 -62.0 -45.8 34.8 24.5 39.1 107 150 A Y H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.772 104.2 61.2 -66.9 -23.7 36.4 24.7 42.6 108 151 A F H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.921 106.0 46.5 -65.8 -44.0 38.5 27.7 41.4 109 152 A M H X S+ 0 0 1 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.848 106.9 58.5 -66.0 -30.3 35.2 29.5 40.8 110 153 A R H X S+ 0 0 42 -4,-1.6 4,-3.1 2,-0.2 -1,-0.2 0.907 105.7 49.6 -64.3 -37.8 34.1 28.2 44.3 111 154 A L H X S+ 0 0 2 -4,-1.9 4,-2.8 2,-0.2 6,-0.2 0.932 106.4 54.3 -66.0 -43.6 37.1 30.0 45.7 112 155 A L H <>S+ 0 0 0 -4,-2.1 5,-2.4 1,-0.2 6,-1.6 0.901 112.2 46.2 -55.6 -39.6 36.2 33.2 43.8 113 156 A K H ><5S+ 0 0 52 -4,-2.1 3,-2.5 4,-0.2 -2,-0.2 0.983 110.9 50.6 -64.0 -56.0 32.8 32.9 45.5 114 157 A D H 3<5S+ 0 0 81 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.820 110.6 50.8 -51.8 -38.0 34.3 32.2 49.0 115 158 A K T 3<5S- 0 0 69 -4,-2.8 -1,-0.3 -5,-0.1 -2,-0.2 0.365 114.8-113.0 -84.2 3.3 36.5 35.3 48.7 116 159 A G T < 5S+ 0 0 65 -3,-2.5 -3,-0.2 -4,-0.2 -2,-0.1 0.687 89.4 109.4 73.7 19.0 33.7 37.7 47.7 117 160 A L < + 0 0 32 -5,-2.4 -81,-2.7 -6,-0.2 2,-0.6 0.729 46.8 95.3 -95.8 -27.9 35.2 38.2 44.2 118 161 A L E +a 36 0A 18 -6,-1.6 -81,-0.2 -83,-0.2 3,-0.1 -0.547 36.7 169.0 -77.0 112.7 32.5 36.3 42.1 119 162 A L E S- 0 0 37 -83,-3.2 2,-0.3 -2,-0.6 -82,-0.2 0.901 70.1 -22.5 -82.3 -46.3 29.9 38.6 40.7 120 163 A R E -a 37 0A 46 -84,-1.3 -82,-2.3 87,-0.1 2,-0.5 -0.983 45.8-143.2-165.9 148.0 28.4 35.9 38.4 121 164 A C E -ac 38 140A 0 18,-3.0 20,-2.4 -2,-0.3 2,-0.6 -0.985 17.2-163.1-115.4 117.1 29.2 32.7 36.6 122 165 A Y E -ac 39 141A 6 -84,-3.3 -82,-3.0 -2,-0.5 2,-0.4 -0.921 18.7-174.4 -97.9 120.8 27.5 32.5 33.1 123 166 A T E -ac 40 142A 0 18,-2.5 20,-2.3 -2,-0.6 21,-0.4 -0.938 34.1-165.4-124.5 143.6 27.6 28.8 32.0 124 167 A Q + 0 0 33 -84,-2.0 -83,-0.2 -2,-0.4 -1,-0.1 0.465 66.2 102.4 -95.1 -4.8 26.6 27.0 28.8 125 168 A N - 0 0 15 -85,-0.3 19,-0.3 1,-0.1 -2,-0.1 -0.345 51.1-167.8 -85.4 157.8 26.7 23.6 30.6 126 169 A I + 0 0 42 1,-0.1 -1,-0.1 -2,-0.1 21,-0.1 -0.070 63.7 101.4-128.8 35.6 23.9 21.4 32.0 127 170 A D S S- 0 0 18 -31,-0.1 -27,-0.1 19,-0.0 -1,-0.1 0.442 81.4-132.8 -96.0 -3.7 26.0 19.0 34.1 128 171 A T > + 0 0 3 1,-0.1 4,-2.0 -3,-0.1 5,-0.2 0.565 66.4 130.2 65.0 10.4 25.1 20.8 37.3 129 172 A L H > + 0 0 2 1,-0.2 4,-1.9 2,-0.2 6,-0.2 0.810 63.2 59.2 -68.9 -26.9 28.8 20.8 38.4 130 173 A E H 4>S+ 0 0 1 1,-0.2 5,-2.2 2,-0.2 4,-0.2 0.933 110.3 43.0 -65.3 -45.1 28.8 24.5 39.2 131 174 A R H >45S+ 0 0 19 1,-0.2 3,-1.3 3,-0.2 -2,-0.2 0.861 111.3 54.1 -66.2 -37.5 26.1 23.9 41.8 132 175 A I H 3<5S+ 0 0 3 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.867 104.5 56.7 -66.4 -31.7 27.7 20.7 43.1 133 176 A A T 3<5S- 0 0 0 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.544 130.4 -93.2 -73.6 -10.1 30.9 22.7 43.6 134 177 A G T < 5S+ 0 0 21 -3,-1.3 2,-0.2 1,-0.4 -3,-0.2 0.363 77.8 139.3 115.0 -6.9 29.1 25.2 45.9 135 178 A L < - 0 0 4 -5,-2.2 -1,-0.4 -6,-0.2 2,-0.2 -0.547 44.0-140.6 -72.1 136.0 28.0 28.0 43.6 136 179 A E >> - 0 0 90 -2,-0.2 3,-1.8 1,-0.1 4,-0.8 -0.546 24.7-101.0 -94.5 164.4 24.5 29.1 44.5 137 180 A Q G >4 S+ 0 0 69 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.883 122.4 59.0 -46.7 -46.5 21.6 30.0 42.2 138 181 A E G 34 S+ 0 0 100 1,-0.3 -1,-0.3 -18,-0.1 -3,-0.0 0.782 104.3 49.9 -55.5 -29.9 22.3 33.7 42.9 139 182 A D G <4 S+ 0 0 23 -3,-1.8 -18,-3.0 -19,-0.1 2,-0.3 0.623 105.0 78.0 -84.7 -12.5 25.9 33.3 41.5 140 183 A L E << -c 121 0A 0 -3,-1.6 2,-0.5 -4,-0.8 -18,-0.2 -0.796 44.9-177.0-112.9 141.5 24.7 31.6 38.3 141 184 A V E -c 122 0A 5 -20,-2.4 -18,-2.5 -2,-0.3 2,-1.0 -0.952 22.7-164.4-124.3 101.2 23.2 32.4 34.9 142 185 A E E > -c 123 0A 6 -2,-0.5 3,-2.5 -20,-0.2 -18,-0.2 -0.817 6.9-155.5 -92.5 102.6 22.8 28.9 33.4 143 186 A A T 3 S+ 0 0 30 -20,-2.3 -1,-0.2 -2,-1.0 -19,-0.2 0.745 93.1 31.2 -50.1 -33.3 22.2 29.7 29.7 144 187 A H T 3 S- 0 0 89 -21,-0.4 46,-2.0 1,-0.4 -1,-0.3 0.238 115.1-117.2-111.5 14.1 20.4 26.5 29.1 145 188 A G E < -G 189 0C 5 -3,-2.5 -1,-0.4 44,-0.3 2,-0.3 -0.392 33.3 -82.6 86.6-162.7 18.8 26.2 32.5 146 189 A T E - 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0 0 155 -3,-1.4 -3,-0.1 -4,-0.5 -2,-0.1 0.930 14.8-146.4 43.6 64.6 105.4 61.6 53.4 383 112 B L - 0 0 50 -5,-0.3 -1,-0.1 1,-0.1 4,-0.0 -0.393 7.5-136.8 -60.4 131.7 101.7 62.5 52.8 384 113 B P S S- 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.764 84.6 -9.4 -59.4 -31.2 100.4 64.7 55.7 385 114 B Y S > S- 0 0 95 1,-0.1 3,-1.4 0, 0.0 4,-0.4 -0.947 77.3-102.9-163.6 153.9 97.1 62.7 55.7 386 115 B P G > S+ 0 0 114 0, 0.0 3,-1.0 0, 0.0 4,-0.2 0.842 116.0 59.3 -53.9 -37.5 95.6 60.1 53.4 387 116 B E G > S+ 0 0 80 1,-0.2 3,-1.6 2,-0.2 119,-0.3 0.696 84.5 79.6 -67.1 -20.6 93.2 62.6 51.8 388 117 B A G X S+ 0 0 0 -3,-1.4 3,-2.1 1,-0.3 7,-0.3 0.821 79.6 68.8 -55.9 -36.3 96.0 64.8 50.6 389 118 B I G < S+ 0 0 18 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.772 113.3 30.2 -52.5 -32.0 96.6 62.5 47.6 390 119 B F G < S+ 0 0 60 -3,-1.6 116,-3.1 -4,-0.2 2,-0.5 -0.079 95.0 111.3-119.8 28.8 93.2 63.6 46.3 391 120 B E B <> -o 506 0F 27 -3,-2.1 4,-2.9 114,-0.2 5,-0.2 -0.933 58.0-148.9-106.2 124.7 93.1 67.2 47.7 392 121 B I H > S+ 0 0 23 114,-2.5 4,-2.1 -2,-0.5 115,-0.1 0.820 96.0 51.5 -64.4 -32.3 93.4 69.9 45.0 393 122 B S H > S+ 0 0 71 113,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.893 114.6 43.9 -71.2 -37.7 95.2 72.4 47.2 394 123 B Y H >> S+ 0 0 20 2,-0.2 4,-3.2 1,-0.2 3,-0.9 0.944 111.5 54.5 -69.5 -47.8 97.8 69.8 48.2 395 124 B F H 3< S+ 0 0 2 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.898 103.5 55.3 -51.8 -45.9 98.0 68.7 44.6 396 125 B K H 3< S+ 0 0 132 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.810 117.1 36.1 -62.5 -26.7 98.8 72.2 43.4 397 126 B K H << S+ 0 0 139 -3,-0.9 -2,-0.2 -4,-0.9 -1,-0.2 0.795 137.3 16.6 -94.6 -30.7 101.7 72.4 45.8 398 127 B H < + 0 0 77 -4,-3.2 4,-0.4 -5,-0.1 -1,-0.2 -0.608 65.1 160.5-144.1 76.7 102.9 68.8 45.6 399 128 B P > + 0 0 7 0, 0.0 4,-1.9 0, 0.0 3,-0.2 0.685 57.3 86.4 -70.7 -20.6 101.5 67.0 42.5 400 129 B E H > S+ 0 0 80 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.858 82.3 54.4 -51.2 -47.7 104.1 64.2 42.5 401 130 B P H > S+ 0 0 2 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.929 109.5 47.3 -55.8 -49.8 102.4 61.8 45.0 402 131 B F H > S+ 0 0 3 -4,-0.4 4,-3.3 -3,-0.2 -2,-0.2 0.928 111.4 51.0 -57.6 -48.5 99.2 61.6 43.0 403 132 B F H X S+ 0 0 14 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.817 107.5 53.0 -62.8 -27.9 101.0 61.1 39.7 404 133 B A H X S+ 0 0 12 -4,-1.9 4,-0.5 -3,-0.2 -1,-0.2 0.867 113.2 43.7 -72.7 -36.8 103.0 58.2 41.3 405 134 B L H >X S+ 0 0 8 -4,-1.9 3,-1.5 -5,-0.2 4,-1.0 0.907 107.5 61.1 -72.2 -39.3 99.7 56.6 42.4 406 135 B A H 3X S+ 0 0 0 -4,-3.3 4,-2.9 1,-0.3 3,-0.4 0.817 91.9 66.2 -55.5 -34.4 98.2 57.4 39.0 407 136 B K H 3< S+ 0 0 46 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.839 105.5 43.9 -58.6 -31.5 100.8 55.2 37.3 408 137 B E H << S+ 0 0 66 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.688 118.8 43.4 -84.9 -21.3 99.3 52.2 39.0 409 138 B L H < S+ 0 0 24 -4,-1.0 -2,-0.2 -3,-0.4 -3,-0.2 0.760 80.9 103.5-100.2 -27.0 95.7 53.3 38.3 410 139 B Y S < S- 0 0 11 -4,-2.9 3,-0.3 -5,-0.1 31,-0.1 -0.274 84.0 -95.7 -53.8 144.5 95.7 54.5 34.7 411 140 B P S S+ 0 0 16 0, 0.0 -1,-0.1 0, 0.0 31,-0.1 -0.123 87.6 90.4 -61.8 159.3 94.1 51.7 32.5 412 141 B G S S+ 0 0 33 2,-0.4 -2,-0.1 -3,-0.1 -3,-0.0 0.071 75.2 67.3 142.1 -23.2 96.2 49.1 30.6 413 142 B Q S S+ 0 0 144 -3,-0.3 2,-0.3 -5,-0.1 -87,-0.1 0.646 96.4 52.8 -98.4 -17.4 96.5 46.2 33.0 414 143 B F - 0 0 33 27,-0.1 -2,-0.4 -51,-0.0 -51,-0.1 -0.914 61.5-148.0-128.1 149.8 92.9 45.1 33.1 415 144 B K - 0 0 56 -2,-0.3 28,-0.1 -53,-0.3 205,-0.1 -0.784 39.0 -95.4-107.8 153.1 90.1 44.1 30.8 416 145 B P - 0 0 1 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.189 44.2-121.2 -61.9 160.5 86.4 44.7 31.5 417 146 B T > - 0 0 5 -59,-0.2 4,-2.3 1,-0.1 3,-0.4 -0.486 27.4 -95.6-100.7 174.2 84.5 41.8 33.1 418 147 B I H > S+ 0 0 39 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.902 127.3 56.9 -50.8 -42.9 81.5 39.8 32.0 419 148 B C H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.900 105.1 49.7 -57.6 -43.5 79.5 42.3 34.3 420 149 B H H > S+ 0 0 1 -3,-0.4 4,-1.6 -62,-0.3 -1,-0.2 0.926 111.7 47.8 -63.9 -42.8 80.9 45.3 32.3 421 150 B Y H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.800 103.2 62.1 -70.1 -23.5 79.9 43.7 29.0 422 151 B F H X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.3 -1,-0.2 0.930 106.4 46.2 -64.5 -40.6 76.5 42.9 30.4 423 152 B M H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.853 107.6 56.3 -68.3 -32.8 76.1 46.7 30.7 424 153 B R H X S+ 0 0 45 -4,-1.6 4,-3.0 2,-0.2 -1,-0.2 0.893 106.1 51.8 -63.2 -40.4 77.4 47.1 27.2 425 154 B L H X S+ 0 0 3 -4,-2.4 4,-1.9 2,-0.2 6,-0.2 0.913 107.2 52.1 -61.2 -41.1 74.6 44.8 26.1 426 155 B L H <>S+ 0 0 0 -4,-1.8 5,-2.7 2,-0.2 6,-1.3 0.907 111.4 47.7 -61.1 -40.3 72.1 47.0 27.9 427 156 B K H ><5S+ 0 0 41 -4,-2.2 3,-1.7 4,-0.2 -2,-0.2 0.954 112.6 47.2 -64.0 -49.3 73.5 50.0 26.0 428 157 B D H 3<5S+ 0 0 89 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.769 110.7 52.1 -65.9 -24.1 73.4 48.3 22.7 429 158 B K T 3<5S- 0 0 78 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.380 116.2-116.3 -91.1 2.3 69.8 47.1 23.3 430 159 B G T < 5S+ 0 0 61 -3,-1.7 -3,-0.2 -4,-0.2 -2,-0.1 0.645 86.7 111.2 72.3 21.1 68.8 50.6 24.1 431 160 B L < + 0 0 30 -5,-2.7 -81,-3.3 -6,-0.2 2,-0.8 0.628 43.9 99.2 -97.8 -18.2 68.0 49.8 27.7 432 161 B L E +j 350 0E 18 -6,-1.3 -81,-0.2 -83,-0.2 3,-0.1 -0.621 34.9 168.5 -79.9 108.6 70.7 51.6 29.6 433 162 B L E S- 0 0 33 -83,-2.8 2,-0.3 -2,-0.8 -82,-0.2 0.901 70.7 -26.4 -80.1 -45.1 69.6 55.0 30.9 434 163 B R E -j 351 0E 52 -84,-1.3 -82,-2.5 87,-0.1 2,-0.5 -0.975 43.8-142.1-167.5 151.8 72.7 55.4 33.0 435 164 B C E -jl 352 454E 0 18,-2.4 20,-2.5 -2,-0.3 2,-0.6 -0.989 18.3-162.3-118.9 115.0 75.5 53.6 34.8 436 165 B Y E -jl 353 455E 8 -84,-3.0 -82,-2.6 -2,-0.5 2,-0.4 -0.910 19.4-171.7 -95.9 119.6 76.5 55.4 38.1 437 166 B T E -jl 354 456E 0 18,-2.6 20,-2.1 -2,-0.6 21,-0.5 -0.944 34.6-167.9-125.6 139.2 79.9 54.1 39.0 438 167 B Q + 0 0 40 -84,-2.0 -83,-0.2 -2,-0.4 2,-0.1 0.455 66.2 102.6 -92.5 -6.2 82.1 54.4 42.1 439 168 B N - 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0 0 152 -3,-2.0 -3,-0.1 -4,-0.4 -2,-0.1 0.912 15.3-153.8 47.1 52.9 69.7 3.0 -14.4 687 112 C L - 0 0 49 -5,-0.4 -1,-0.1 1,-0.1 4,-0.0 -0.351 9.4-140.0 -54.9 134.3 67.7 6.2 -14.2 688 113 C P S S- 0 0 85 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.842 82.6 -4.6 -65.1 -36.8 65.3 6.4 -17.2 689 114 C Y S > S- 0 0 90 1,-0.1 3,-1.6 -3,-0.0 4,-0.4 -0.972 78.6-104.9-155.6 152.7 65.9 10.1 -17.6 690 115 C P G > S+ 0 0 99 0, 0.0 3,-1.0 0, 0.0 4,-0.2 0.831 114.8 55.9 -51.6 -40.4 67.9 12.7 -15.6 691 116 C E G > S+ 0 0 91 1,-0.2 3,-1.8 2,-0.1 119,-0.2 0.671 85.0 84.9 -71.5 -14.2 65.0 14.4 -14.0 692 117 C A G X S+ 0 0 0 -3,-1.6 3,-1.7 1,-0.3 7,-0.3 0.830 78.1 65.5 -57.8 -29.4 63.7 11.2 -12.5 693 118 C I G < S+ 0 0 14 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.1 0.758 110.2 37.6 -67.6 -18.6 66.0 11.5 -9.5 694 119 C F G < S+ 0 0 68 -3,-1.8 116,-3.3 -4,-0.2 2,-0.5 0.147 93.3 106.4-114.0 14.3 64.0 14.6 -8.5 695 120 C E B <> -x 810 0J 38 -3,-1.7 4,-2.8 114,-0.2 3,-0.3 -0.867 60.6-148.8-100.8 124.8 60.5 13.3 -9.6 696 121 C I H > S+ 0 0 22 114,-2.6 4,-2.1 -2,-0.5 5,-0.2 0.857 96.5 53.5 -60.1 -35.2 58.2 12.4 -6.7 697 122 C S H > S+ 0 0 66 113,-0.3 4,-0.7 2,-0.2 -1,-0.2 0.900 112.6 43.6 -68.8 -37.4 56.4 9.7 -8.7 698 123 C Y H >> S+ 0 0 25 -3,-0.3 4,-3.1 1,-0.2 3,-1.1 0.939 111.5 56.2 -69.5 -45.9 59.7 8.0 -9.6 699 124 C F H 3< S+ 0 0 2 -4,-2.8 -2,-0.2 -7,-0.3 -1,-0.2 0.869 101.3 55.8 -52.0 -44.6 61.0 8.4 -6.1 700 125 C K H 3< S+ 0 0 115 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.775 117.9 34.9 -65.8 -23.9 58.0 6.6 -4.5 701 126 C K H << S+ 0 0 130 -3,-1.1 -2,-0.2 -4,-0.7 -1,-0.2 0.798 135.6 19.5 -96.2 -34.5 58.7 3.5 -6.7 702 127 C H < + 0 0 85 -4,-3.1 4,-0.4 -5,-0.1 -1,-0.2 -0.637 67.2 161.9-137.7 77.1 62.5 3.6 -6.8 703 128 C P > + 0 0 11 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.638 53.7 87.7 -74.7 -13.1 63.9 5.8 -3.9 704 129 C E H > S+ 0 0 91 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.896 82.7 53.2 -56.9 -46.7 67.5 4.5 -4.0 705 130 C P H > S+ 0 0 2 0, 0.0 4,-1.8 0, 0.0 3,-0.3 0.932 110.8 47.3 -55.4 -48.0 69.0 6.9 -6.5 706 131 C F H > S+ 0 0 3 -4,-0.4 4,-3.3 1,-0.2 -2,-0.2 0.912 110.6 51.3 -61.3 -43.7 67.7 10.0 -4.7 707 132 C F H X S+ 0 0 18 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.794 105.1 56.7 -66.3 -23.6 69.0 8.7 -1.4 708 133 C A H X S+ 0 0 17 -4,-1.8 4,-1.5 -3,-0.3 -1,-0.2 0.900 111.6 43.2 -70.4 -39.1 72.4 8.0 -2.9 709 134 C L H X S+ 0 0 12 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.927 112.5 53.2 -67.0 -46.6 72.4 11.7 -3.9 710 135 C A H X S+ 0 0 0 -4,-3.3 4,-1.6 1,-0.2 3,-0.3 0.939 106.7 52.3 -55.0 -45.3 71.1 12.7 -0.5 711 136 C K H < S+ 0 0 66 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.898 108.1 52.2 -60.0 -38.2 73.9 10.8 1.2 712 137 C E H < S+ 0 0 60 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.841 122.3 28.4 -65.1 -36.2 76.4 12.7 -0.9 713 138 C L H < S+ 0 0 10 -4,-1.8 -1,-0.2 -3,-0.3 -2,-0.2 0.396 89.9 140.9-105.5 0.7 75.1 16.1 0.0 714 139 C Y >< - 0 0 1 -4,-1.6 3,-2.8 -5,-0.2 4,-0.3 -0.047 66.5 -89.5 -56.0 141.0 73.7 15.3 3.5 715 140 C P T 3 S+ 0 0 4 0, 0.0 -1,-0.1 0, 0.0 31,-0.1 -0.247 119.9 37.8 -46.0 128.4 74.1 17.8 6.4 716 141 C G T 3 S+ 0 0 51 2,-0.6 -2,-0.1 -3,-0.1 3,-0.1 0.117 92.4 88.9 110.6 -20.4 77.3 16.8 8.0 717 142 C Q S < S+ 0 0 92 -3,-2.8 2,-0.3 -4,-0.1 -3,-0.1 0.762 95.3 28.2 -79.8 -25.9 79.2 16.1 4.7 718 143 C F S S- 0 0 37 -4,-0.3 -2,-0.6 27,-0.2 -1,-0.1 -0.963 72.3-130.8-136.7 153.2 80.4 19.6 4.3 719 144 C K - 0 0 54 -53,-0.3 28,-0.1 -2,-0.3 205,-0.1 -0.795 36.1-105.1-100.2 145.4 81.2 22.6 6.5 720 145 C P - 0 0 1 0, 0.0 2,-0.1 0, 0.0 -57,-0.1 -0.269 38.1-127.7 -64.9 157.5 79.8 26.1 5.8 721 146 C T > - 0 0 7 -59,-0.3 4,-2.3 1,-0.0 3,-0.4 -0.374 31.2 -87.0-100.4 178.0 82.1 28.7 4.2 722 147 C I H > S+ 0 0 34 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.857 127.1 57.9 -50.0 -40.5 83.1 32.2 5.1 723 148 C C H > S+ 0 0 0 -61,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.902 105.8 48.0 -61.0 -42.7 80.0 33.4 3.1 724 149 C H H > S+ 0 0 0 -3,-0.4 4,-1.6 -62,-0.3 -2,-0.2 0.923 113.2 47.4 -66.3 -41.4 77.7 31.4 5.2 725 150 C Y H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.798 105.3 59.8 -70.4 -25.1 79.2 32.7 8.4 726 151 C F H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.924 106.2 47.8 -65.3 -41.7 79.1 36.3 7.0 727 152 C M H X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.861 106.6 57.6 -65.0 -33.5 75.3 35.8 6.8 728 153 C R H X S+ 0 0 28 -4,-1.6 4,-2.7 2,-0.2 -1,-0.2 0.887 107.8 47.7 -61.0 -42.4 75.4 34.4 10.4 729 154 C L H X S+ 0 0 3 -4,-2.1 4,-2.3 2,-0.2 6,-0.3 0.928 108.2 53.7 -66.6 -43.2 77.0 37.8 11.4 730 155 C L H <>S+ 0 0 0 -4,-2.5 5,-2.4 1,-0.2 6,-1.4 0.937 111.8 47.1 -54.9 -42.0 74.4 39.7 9.5 731 156 C K H ><5S+ 0 0 42 -4,-2.3 3,-1.6 4,-0.2 -2,-0.2 0.955 113.4 46.4 -62.7 -49.0 71.8 37.7 11.5 732 157 C D H 3<5S+ 0 0 72 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.739 110.4 52.6 -70.1 -20.9 73.5 38.3 14.8 733 158 C K T 3<5S- 0 0 67 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.304 117.0-112.9 -95.3 8.8 74.0 42.0 14.3 734 159 C G T < 5S+ 0 0 47 -3,-1.6 -3,-0.2 -5,-0.2 -2,-0.1 0.642 88.4 108.9 73.0 18.6 70.3 42.4 13.4 735 160 C L < + 0 0 25 -5,-2.4 -81,-3.3 -6,-0.3 2,-0.7 0.695 48.0 96.7 -97.0 -20.8 70.7 43.2 9.8 736 161 C L E +s 654 0I 10 -6,-1.4 -81,-0.2 -83,-0.2 3,-0.1 -0.598 34.3 167.6 -82.8 112.8 69.4 40.1 8.2 737 162 C L E S- 0 0 10 -83,-2.8 2,-0.3 -2,-0.7 -82,-0.2 0.883 70.5 -27.3 -82.8 -45.6 65.8 40.2 7.1 738 163 C R E -s 655 0I 44 -84,-1.2 -82,-2.3 87,-0.1 2,-0.5 -0.976 45.5-138.0-167.3 154.1 66.1 37.0 5.0 739 164 C C E -su 656 758I 0 18,-2.8 20,-2.4 -2,-0.3 2,-0.6 -0.989 16.7-161.4-119.3 118.4 68.4 34.7 3.0 740 165 C Y E -su 657 759I 0 -84,-3.3 -82,-2.9 -2,-0.5 2,-0.4 -0.917 19.4-169.9 -99.3 118.1 66.9 33.4 -0.3 741 166 C T E -su 658 760I 0 18,-2.4 20,-2.8 -2,-0.6 21,-0.4 -0.915 32.7-168.8-120.2 140.2 69.0 30.4 -1.3 742 167 C Q + 0 0 40 -84,-2.3 -83,-0.2 -2,-0.4 -1,-0.1 0.586 64.9 103.0 -92.4 -14.0 69.1 28.3 -4.5 743 168 C N - 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