==== 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 HYDROLASE 21-NOV-06 2NYR . COMPND 2 MOLECULE: NAD-DEPENDENT DEACETYLASE SIRTUIN-5; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.R.MIN,T.ANTOSHENKO,A.ALLALI-HASSANI,A.DONG,J.WEIGELT,M.SUN . 517 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23907.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 342 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 58 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 0.4 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 . 38 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 131 25.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.5 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 3 4 3 0 3 0 1 0 0 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 4 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 PARALLEL BRIDGES PER LADDER . 3 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 2 0 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 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 36 A P 0 0 130 0, 0.0 244,-0.3 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 113.9 14.9 -8.8 33.1 2 37 A S B -a 245 0A 48 242,-3.2 244,-2.9 1,-0.1 0, 0.0 -0.367 360.0-161.9 -70.6 145.2 16.6 -5.9 35.0 3 38 A S + 0 0 87 242,-0.2 2,-0.8 -2,-0.1 -1,-0.1 0.029 47.3 132.1-109.2 22.1 15.2 -2.4 35.0 4 39 A S > - 0 0 39 1,-0.2 4,-1.8 2,-0.1 5,-0.1 -0.679 35.4-174.2 -83.0 110.5 18.5 -0.9 36.2 5 40 A M H > S+ 0 0 36 -2,-0.8 4,-3.0 2,-0.2 -1,-0.2 0.882 87.3 54.5 -66.7 -40.1 19.5 2.0 34.1 6 41 A A H > S+ 0 0 73 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.879 109.4 47.1 -61.0 -41.3 22.9 2.3 35.9 7 42 A D H > S+ 0 0 64 2,-0.2 4,-0.9 1,-0.2 3,-0.2 0.848 114.0 47.9 -69.4 -36.0 23.6 -1.4 35.2 8 43 A F H >X S+ 0 0 0 -4,-1.8 4,-2.6 1,-0.2 3,-0.6 0.917 106.9 56.4 -66.3 -46.1 22.6 -0.9 31.5 9 44 A R H 3X S+ 0 0 88 -4,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.675 100.9 59.7 -59.8 -20.1 24.8 2.3 31.2 10 45 A K H 3X S+ 0 0 112 -4,-0.7 4,-0.7 -3,-0.2 -1,-0.2 0.868 110.0 39.7 -78.4 -38.3 27.8 0.3 32.3 11 46 A F H XX S+ 0 0 86 -4,-0.9 4,-1.8 -3,-0.6 3,-0.6 0.885 113.9 55.9 -71.4 -43.0 27.6 -2.1 29.4 12 47 A F H 3< S+ 0 0 9 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.867 103.3 55.0 -57.7 -39.2 26.6 0.8 27.1 13 48 A A H 3< S+ 0 0 60 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.827 117.7 34.5 -62.3 -33.8 29.8 2.6 28.1 14 49 A K H << S+ 0 0 152 -4,-0.7 -2,-0.2 -3,-0.6 -1,-0.2 0.566 88.8 115.9-100.9 -12.9 32.0 -0.3 27.1 15 50 A A < - 0 0 4 -4,-1.8 3,-0.2 1,-0.1 194,-0.0 -0.401 36.0-179.4 -67.4 126.6 30.0 -1.6 24.1 16 51 A K S S+ 0 0 127 1,-0.3 83,-3.8 -2,-0.2 2,-0.4 0.694 74.4 35.1 -97.7 -24.3 31.9 -1.4 20.8 17 52 A H E S-b 99 0A 27 81,-0.2 191,-2.2 189,-0.1 192,-1.2 -0.866 71.0-175.2-139.9 98.7 29.2 -2.8 18.4 18 53 A I E -bc 100 209A 1 81,-3.5 83,-2.4 -2,-0.4 2,-0.6 -0.857 9.2-161.4-103.4 125.8 25.6 -2.0 19.2 19 54 A V E -bc 101 210A 0 190,-2.3 192,-3.3 -2,-0.5 2,-0.6 -0.924 6.8-164.6-103.3 118.0 22.7 -3.5 17.2 20 55 A I E -bc 102 211A 0 81,-3.1 83,-2.9 -2,-0.6 2,-0.7 -0.908 4.0-159.5-105.5 114.4 19.4 -1.6 17.6 21 56 A I E -bc 103 212A 4 190,-3.9 192,-3.2 -2,-0.6 2,-0.6 -0.854 15.2-158.5 -94.8 118.2 16.3 -3.5 16.5 22 57 A S E -bc 104 213A 1 81,-3.7 83,-2.0 -2,-0.7 84,-0.4 -0.859 10.2-173.3-112.5 116.0 13.6 -1.0 15.9 23 58 A G >> - 0 0 0 190,-3.3 3,-1.4 -2,-0.6 4,-0.7 -0.271 45.0 -82.4 -97.0-173.5 9.9 -1.8 15.8 24 59 A A H 3> S+ 0 0 6 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.673 115.2 75.2 -66.6 -24.1 6.7 0.0 15.0 25 60 A G H 3> S+ 0 0 25 189,-2.4 4,-1.3 2,-0.2 -1,-0.3 0.824 94.0 53.7 -54.2 -35.4 6.5 1.7 18.5 26 61 A V H <4 S+ 0 0 0 -3,-1.4 -1,-0.2 187,-0.4 3,-0.2 0.943 112.1 42.7 -67.0 -46.6 9.3 4.0 17.4 27 62 A S H ><>S+ 0 0 2 -4,-0.7 3,-1.8 1,-0.2 5,-1.5 0.883 109.6 57.8 -64.6 -41.1 7.3 5.1 14.3 28 63 A A H ><5S+ 0 0 41 -4,-2.8 3,-1.8 1,-0.3 -1,-0.2 0.815 95.3 64.6 -60.6 -33.4 4.0 5.3 16.2 29 64 A E T 3<5S+ 0 0 64 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.543 100.2 54.0 -68.1 -7.7 5.6 7.9 18.6 30 65 A S T < 5S- 0 0 19 -3,-1.8 48,-0.5 -4,-0.2 -1,-0.3 0.299 128.5 -97.2-104.0 4.1 5.9 10.2 15.5 31 66 A G T < 5S+ 0 0 41 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.1 0.452 72.7 150.4 93.3 0.3 2.2 9.9 14.7 32 67 A V < - 0 0 11 -5,-1.5 2,-0.7 -8,-0.1 -1,-0.3 -0.529 51.6-124.0 -59.4 120.8 2.6 7.1 12.0 33 68 A P - 0 0 57 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.639 25.8-126.4 -74.6 115.2 -0.7 5.2 12.2 34 69 A T - 0 0 45 -2,-0.7 2,-1.6 1,-0.1 5,-0.1 -0.489 11.1-146.0 -67.3 117.9 0.4 1.6 12.9 35 70 A F + 0 0 39 -2,-0.4 2,-0.3 5,-0.1 5,-0.2 -0.315 66.2 93.9 -84.5 54.4 -1.1 -0.7 10.2 36 71 A R S > S- 0 0 152 -2,-1.6 3,-1.9 5,-0.1 5,-0.1 -0.970 82.6 -10.8-141.7 155.6 -1.5 -3.7 12.6 37 72 A G G > S- 0 0 58 -2,-0.3 3,-1.6 1,-0.3 0, 0.0 -0.322 134.7 -1.6 58.3-131.7 -4.4 -5.0 14.7 38 73 A A G 3 S+ 0 0 100 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.679 140.2 52.7 -61.3 -20.9 -7.3 -2.5 15.1 39 74 A G G < S+ 0 0 39 -3,-1.9 2,-1.9 1,-0.2 -1,-0.3 0.536 80.5 95.1 -91.7 -9.9 -5.3 -0.1 12.9 40 75 A G < + 0 0 6 -3,-1.6 7,-0.5 -5,-0.2 2,-0.4 -0.279 66.1 105.0 -80.9 53.0 -4.7 -2.5 10.1 41 76 A Y E +G 46 0B 127 -2,-1.9 2,-0.3 5,-0.2 5,-0.2 -0.999 37.8 172.1-141.6 135.6 -7.7 -1.3 8.1 42 77 A W E > S-G 45 0B 0 3,-2.1 3,-2.3 -2,-0.4 114,-0.1 -0.955 72.0 -44.7-143.8 119.3 -8.2 0.8 5.0 43 78 A R T 3 S- 0 0 17 112,-2.4 113,-0.0 -2,-0.3 111,-0.0 -0.384 125.1 -21.3 50.3-123.2 -11.7 1.1 3.6 44 79 A K T 3 S+ 0 0 144 112,-0.2 -1,-0.3 -2,-0.1 2,-0.2 0.437 121.7 86.0 -89.5 1.3 -13.1 -2.5 3.6 45 80 A W E < -G 42 0B 51 -3,-2.3 -3,-2.1 2,-0.0 2,-0.2 -0.670 57.6-146.0-120.3 155.8 -9.7 -4.2 3.7 46 81 A Q E >> -G 41 0B 75 -2,-0.2 3,-1.7 -5,-0.2 4,-0.9 -0.568 45.8 -93.6-100.2 173.4 -6.9 -5.6 5.9 47 82 A A H >> S+ 0 0 14 -7,-0.5 4,-3.5 1,-0.3 3,-0.7 0.852 124.3 59.0 -55.2 -39.8 -3.1 -5.7 5.1 48 83 A Q H 34 S+ 0 0 102 1,-0.3 -1,-0.3 2,-0.2 7,-0.1 0.567 106.2 49.2 -71.5 -9.5 -3.4 -9.3 3.7 49 84 A D H <4 S+ 0 0 79 -3,-1.7 -1,-0.3 5,-0.0 -2,-0.2 0.646 126.6 25.1 -93.5 -22.4 -5.9 -8.0 1.1 50 85 A L H << S+ 0 0 2 -4,-0.9 2,-1.6 -3,-0.7 -2,-0.2 0.831 111.0 60.8-109.2 -50.4 -3.7 -5.1 0.1 51 86 A A S < S+ 0 0 9 -4,-3.5 137,-2.3 -5,-0.2 -1,-0.1 -0.439 84.0 98.6 -88.9 62.6 -0.0 -5.9 0.8 52 87 A T S > S- 0 0 21 -2,-1.6 4,-2.1 135,-0.2 5,-0.2 -0.995 75.5-126.4-146.1 147.1 0.4 -9.0 -1.4 53 88 A P H > S+ 0 0 54 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.805 114.5 54.1 -62.4 -28.8 1.8 -9.6 -4.9 54 89 A L H > S+ 0 0 137 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.883 106.3 50.7 -70.7 -42.9 -1.6 -11.3 -5.8 55 90 A A H > S+ 0 0 18 1,-0.2 4,-2.4 2,-0.2 8,-0.2 0.924 110.8 49.5 -56.5 -46.9 -3.5 -8.2 -4.7 56 91 A F H < S+ 0 0 18 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.850 109.7 52.2 -63.6 -36.9 -1.3 -6.1 -6.9 57 92 A A H < S+ 0 0 77 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.943 115.5 38.9 -61.7 -49.9 -1.8 -8.4 -9.9 58 93 A H H < S+ 0 0 162 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.848 138.4 6.8 -72.4 -38.2 -5.6 -8.3 -9.7 59 94 A N X + 0 0 39 -4,-2.4 4,-1.8 -5,-0.2 3,-0.3 -0.579 60.8 165.5-150.9 76.7 -6.1 -4.6 -8.8 60 95 A P H > S+ 0 0 16 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.782 80.0 61.7 -66.3 -27.2 -2.9 -2.5 -8.9 61 96 A S H > S+ 0 0 6 2,-0.2 4,-2.0 1,-0.2 101,-0.1 0.891 106.4 44.3 -63.1 -42.2 -5.0 0.7 -8.9 62 97 A R H > S+ 0 0 52 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.904 114.0 48.9 -70.1 -44.0 -6.4 -0.2 -5.5 63 98 A V H X S+ 0 0 2 -4,-1.8 4,-2.0 -8,-0.2 -2,-0.2 0.865 113.8 47.4 -61.0 -40.4 -3.0 -1.3 -4.1 64 99 A W H X S+ 0 0 3 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.824 107.3 56.6 -71.4 -34.5 -1.5 2.0 -5.4 65 100 A E H X S+ 0 0 3 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.909 110.8 45.0 -56.9 -45.3 -4.4 4.0 -3.9 66 101 A F H X S+ 0 0 4 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.895 114.1 46.7 -67.6 -44.7 -3.6 2.5 -0.5 67 102 A Y H X S+ 0 0 13 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.795 109.9 54.6 -72.5 -26.3 0.2 3.1 -0.8 68 103 A H H X S+ 0 0 5 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.902 109.8 47.9 -65.9 -45.0 -0.4 6.6 -2.0 69 104 A Y H X S+ 0 0 58 -4,-1.8 4,-2.5 2,-0.2 5,-0.3 0.950 112.5 48.6 -55.3 -54.2 -2.5 7.1 1.2 70 105 A R H X S+ 0 0 25 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.906 112.9 47.6 -53.2 -46.3 0.3 5.6 3.2 71 106 A R H X S+ 0 0 10 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.898 111.1 52.2 -63.4 -41.3 2.9 7.8 1.5 72 107 A E H < S+ 0 0 88 -4,-2.5 4,-0.3 1,-0.2 -2,-0.2 0.901 113.3 41.9 -63.2 -43.8 0.7 10.9 2.1 73 108 A V H < S+ 0 0 29 -4,-2.5 3,-0.5 1,-0.2 -1,-0.2 0.835 117.1 49.9 -72.1 -31.3 0.3 10.3 5.8 74 109 A M H >< S+ 0 0 4 -4,-2.0 3,-1.5 -5,-0.3 -2,-0.2 0.827 100.1 61.1 -75.3 -36.6 4.0 9.3 6.2 75 110 A G T 3< S+ 0 0 56 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.1 0.500 99.3 57.1 -76.0 -5.8 5.6 12.3 4.4 76 111 A S T 3 S+ 0 0 80 -3,-0.5 -1,-0.3 -4,-0.3 2,-0.2 0.399 91.1 98.2 -99.2 -1.4 4.1 14.8 6.9 77 112 A K < - 0 0 56 -3,-1.5 -46,-0.1 31,-0.1 -3,-0.0 -0.475 58.3-148.4 -93.9 159.6 5.7 13.0 9.9 78 113 A E - 0 0 127 -48,-0.5 32,-0.1 -2,-0.2 -2,-0.0 -0.949 26.7 -95.4-131.3 144.8 8.9 13.9 11.8 79 114 A P - 0 0 16 0, 0.0 2,-0.1 0, 0.0 32,-0.1 -0.274 44.3-143.0 -52.6 138.3 11.6 12.0 13.7 80 115 A N > - 0 0 18 -54,-0.2 4,-2.3 1,-0.0 5,-0.2 -0.399 33.7 -83.8 -97.3 179.4 10.9 11.9 17.4 81 116 A A H > S+ 0 0 29 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.792 129.3 54.3 -52.2 -35.3 13.3 12.1 20.4 82 117 A G H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.945 108.1 47.2 -66.1 -50.4 13.9 8.3 20.1 83 118 A H H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.892 114.7 49.4 -53.1 -43.7 14.9 8.6 16.5 84 119 A R H X S+ 0 0 120 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.906 109.4 48.8 -67.5 -44.9 17.2 11.5 17.4 85 120 A A H X S+ 0 0 7 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.902 111.9 51.4 -59.6 -41.2 18.9 9.8 20.4 86 121 A I H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.918 113.7 42.6 -62.9 -48.8 19.5 6.7 18.1 87 122 A A H X S+ 0 0 3 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.899 113.6 51.4 -62.4 -45.4 21.1 8.8 15.4 88 123 A E H X S+ 0 0 115 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.828 109.2 51.6 -66.4 -32.3 23.1 11.0 17.8 89 124 A C H X S+ 0 0 0 -4,-1.9 4,-3.1 -5,-0.2 5,-0.3 0.923 109.7 48.8 -68.4 -47.5 24.5 7.9 19.5 90 125 A E H X S+ 0 0 17 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.916 115.0 45.1 -56.6 -47.8 25.6 6.4 16.1 91 126 A T H X S+ 0 0 74 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.961 116.9 44.9 -59.9 -53.1 27.3 9.7 15.1 92 127 A R H >< S+ 0 0 82 -4,-2.6 3,-0.6 1,-0.2 4,-0.4 0.925 116.4 44.1 -58.3 -51.9 28.9 10.1 18.6 93 128 A L H ><>S+ 0 0 1 -4,-3.1 5,-2.6 1,-0.2 3,-1.2 0.822 106.6 62.3 -64.9 -32.8 30.1 6.4 18.9 94 129 A G H ><5S+ 0 0 46 -4,-1.9 3,-1.2 -5,-0.3 -1,-0.2 0.787 95.1 59.5 -64.7 -31.9 31.3 6.4 15.3 95 130 A K T <<5S+ 0 0 178 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.643 107.0 48.9 -69.8 -16.2 33.9 9.1 16.0 96 131 A Q T < 5S- 0 0 115 -3,-1.2 -1,-0.2 -4,-0.4 -2,-0.2 0.299 123.6-104.4-102.1 4.2 35.4 6.8 18.6 97 132 A G T < 5S+ 0 0 72 -3,-1.2 2,-0.4 1,-0.3 -3,-0.2 0.636 80.1 133.3 77.2 16.2 35.5 3.8 16.2 98 133 A R < - 0 0 42 -5,-2.6 2,-0.3 -6,-0.1 -1,-0.3 -0.820 49.6-128.4-103.1 144.1 32.5 2.2 17.9 99 134 A R E +b 17 0A 81 -83,-3.8 -81,-3.5 -2,-0.4 2,-0.4 -0.703 24.2 177.7-106.3 137.5 29.6 0.8 15.8 100 135 A V E -b 18 0A 1 -2,-0.3 2,-0.4 -83,-0.2 18,-0.3 -0.997 7.5-178.9-132.1 127.6 25.9 1.3 15.9 101 136 A V E -b 19 0A 2 -83,-2.4 -81,-3.1 -2,-0.4 2,-0.5 -0.967 14.1-148.9-123.4 142.5 23.5 -0.3 13.4 102 137 A V E -bd 20 119A 0 16,-3.1 18,-3.3 -2,-0.4 2,-0.6 -0.958 6.3-168.1-113.2 125.4 19.7 0.1 13.2 103 138 A I E -bd 21 120A 2 -83,-2.9 -81,-3.7 -2,-0.5 2,-0.4 -0.965 19.7-173.2-107.5 114.9 17.5 -2.8 11.9 104 139 A T E -bd 22 121A 4 16,-2.5 18,-1.1 -2,-0.6 19,-0.6 -0.910 34.7-162.7-117.2 139.4 14.0 -1.4 11.3 105 140 A Q + 0 0 29 -83,-2.0 2,-0.1 -2,-0.4 -82,-0.1 0.563 69.8 102.6 -80.5 -10.6 10.7 -3.0 10.4 106 141 A N - 0 0 20 -84,-0.4 17,-0.2 1,-0.1 3,-0.2 -0.433 53.7-165.7 -90.7 153.6 9.5 0.5 9.4 107 142 A I + 0 0 29 -2,-0.1 19,-2.3 1,-0.1 20,-0.4 0.139 68.5 88.7-123.1 14.9 9.1 1.9 5.9 108 143 A D S S- 0 0 9 17,-0.2 -1,-0.1 18,-0.1 -31,-0.1 0.454 85.7-130.2 -96.2 -6.9 8.7 5.6 6.6 109 144 A E > + 0 0 7 -3,-0.2 4,-2.5 1,-0.1 5,-0.2 0.665 61.9 138.1 63.8 20.9 12.4 6.5 6.6 110 145 A L H > S+ 0 0 1 1,-0.2 4,-1.4 2,-0.2 6,-0.1 0.835 70.9 53.1 -66.7 -33.0 12.2 8.4 9.9 111 146 A H H >>S+ 0 0 5 2,-0.2 5,-2.6 1,-0.2 4,-0.7 0.888 110.0 48.8 -63.2 -43.0 15.5 6.9 11.1 112 147 A R H >45S+ 0 0 77 3,-0.2 3,-0.9 1,-0.2 -2,-0.2 0.932 110.2 50.4 -61.9 -46.2 17.1 8.1 7.9 113 148 A K H 3<5S+ 0 0 111 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.789 107.0 55.4 -63.8 -28.2 15.6 11.7 8.4 114 149 A A H 3<5S- 0 0 27 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.663 128.9 -95.1 -77.0 -20.2 16.9 11.7 12.0 115 150 A G T <<5 + 0 0 26 -3,-0.9 2,-0.2 -4,-0.7 -3,-0.2 0.469 69.4 152.4 118.6 4.7 20.5 11.0 10.7 116 151 A T < + 0 0 0 -5,-2.6 -1,-0.3 1,-0.2 3,-0.1 -0.491 11.2 171.2 -65.6 129.3 20.9 7.2 11.0 117 152 A K + 0 0 151 -2,-0.2 2,-1.7 1,-0.2 -1,-0.2 0.759 66.0 65.3-110.8 -41.7 23.4 6.0 8.4 118 153 A N S S+ 0 0 58 -18,-0.3 -16,-3.1 2,-0.0 2,-0.5 -0.628 78.3 156.1 -80.1 82.8 24.0 2.3 9.4 119 154 A L E -d 102 0A 21 -2,-1.7 2,-0.6 -18,-0.2 -16,-0.2 -0.956 32.7-168.3-124.9 123.1 20.4 1.5 8.5 120 155 A L E -d 103 0A 11 -18,-3.3 -16,-2.5 -2,-0.5 2,-1.0 -0.939 6.2-166.3-113.1 109.6 18.9 -1.9 7.5 121 156 A E E > -d 104 0A 22 -2,-0.6 3,-1.5 -18,-0.2 -16,-0.1 -0.753 7.4-179.7 -99.9 88.3 15.4 -1.6 6.2 122 157 A I T 3 S+ 0 0 3 -18,-1.1 71,-0.3 -2,-1.0 -1,-0.2 0.700 84.1 39.9 -65.1 -22.9 14.1 -5.2 6.1 123 158 A H T 3 S- 0 0 26 -19,-0.6 63,-1.8 1,-0.4 -1,-0.3 0.292 108.6-131.7-106.6 6.4 10.6 -4.3 4.7 124 159 A G E < -H 185 0C 11 -3,-1.5 -1,-0.4 61,-0.2 2,-0.3 -0.571 31.9 -70.1 81.5-141.3 12.0 -1.7 2.3 125 160 A S E > -H 184 0C 0 59,-2.4 3,-1.1 -2,-0.2 59,-0.5 -0.986 13.3-141.1-156.7 139.7 10.6 1.8 2.0 126 161 A L E 3 S+ 0 0 3 -19,-2.3 -18,-0.1 -2,-0.3 -55,-0.1 0.559 105.2 64.9 -84.7 -3.4 7.3 3.3 0.7 127 162 A F E 3 S+ 0 0 14 -20,-0.4 13,-2.8 57,-0.1 2,-0.3 0.009 95.9 72.5-101.0 22.0 9.5 6.2 -0.7 128 163 A K E < - I 0 139C 42 -3,-1.1 56,-2.9 11,-0.3 2,-0.3 -0.987 68.6-157.0-128.7 145.7 11.2 3.7 -3.0 129 164 A T E -HI 183 138C 3 9,-2.8 9,-2.2 -2,-0.3 2,-0.4 -0.838 3.5-151.4-113.9 154.2 9.6 2.1 -6.1 130 165 A R E -HI 182 137C 70 52,-3.1 52,-2.6 -2,-0.3 2,-0.5 -0.999 18.2-129.8-123.3 133.8 10.5 -1.1 -7.9 131 166 A C E > -H 181 0C 2 5,-1.7 4,-1.4 -2,-0.4 50,-0.2 -0.706 6.5-153.7 -82.6 123.1 9.9 -1.6 -11.6 132 167 A T T 4 S+ 0 0 75 48,-2.6 -1,-0.1 -2,-0.5 49,-0.1 0.540 93.8 42.1 -72.2 -8.2 8.0 -4.9 -12.3 133 168 A S T 4 S+ 0 0 89 47,-0.2 -1,-0.2 3,-0.1 48,-0.1 0.848 129.9 16.4 -99.9 -57.1 9.6 -4.9 -15.8 134 169 A C T 4 S- 0 0 62 2,-0.1 -2,-0.1 40,-0.0 43,-0.0 0.655 91.5-128.8 -98.4 -19.1 13.2 -3.9 -15.5 135 170 A G < + 0 0 42 -4,-1.4 2,-0.2 1,-0.3 -3,-0.1 0.502 50.0 155.6 86.0 5.7 13.7 -4.4 -11.7 136 171 A V - 0 0 53 -6,-0.1 -5,-1.7 1,-0.0 2,-0.6 -0.477 34.9-145.7 -71.0 129.0 15.2 -1.0 -11.0 137 172 A V E +I 130 0C 68 -2,-0.2 2,-0.3 -7,-0.2 -7,-0.2 -0.874 26.4 179.3 -95.8 124.0 14.7 0.3 -7.5 138 173 A A E -I 129 0C 39 -9,-2.2 -9,-2.8 -2,-0.6 2,-0.3 -0.907 31.1-113.0-128.5 151.0 14.3 4.1 -7.4 139 174 A E E +I 128 0C 137 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.3 -0.679 35.2 178.7 -80.2 134.6 13.7 6.8 -4.8 140 175 A N + 0 0 20 -13,-2.8 5,-0.1 -2,-0.3 -2,-0.0 -0.858 23.5 151.3-144.3 107.9 10.3 8.4 -5.0 141 176 A Y + 0 0 110 -2,-0.3 -1,-0.1 3,-0.1 2,-0.1 0.300 34.5 137.9-111.9 4.7 9.2 11.2 -2.6 142 177 A K - 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