==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-DEC-06 2OD9 . COMPND 2 MOLECULE: NAD-DEPENDENT DEACETYLASE HST2; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR R.MARMORSTEIN,B.D.SANDERS . 298 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14236.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 195 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 18 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 1 1 1 1 1 1 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 1 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 PARALLEL BRIDGES PER LADDER . 3 1 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 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 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 M 0 0 128 0, 0.0 2,-0.2 0, 0.0 97,-0.1 0.000 360.0 360.0 360.0 -26.2 6.2 87.7 -4.0 2 -1 A A - 0 0 103 1,-0.0 2,-0.3 96,-0.0 269,-0.1 -0.438 360.0-176.8 -70.1 136.6 7.5 91.0 -5.5 3 0 A S - 0 0 41 -2,-0.2 2,-0.3 267,-0.1 -1,-0.0 -0.826 16.5-163.2-131.7 170.9 11.1 91.9 -4.8 4 1 A M - 0 0 144 -2,-0.3 264,-0.3 0, 0.0 267,-0.2 -0.922 37.7 -83.1-145.0 165.9 13.6 94.6 -5.4 5 2 A S - 0 0 41 -2,-0.3 262,-0.1 1,-0.1 5,-0.1 -0.383 31.6-126.9 -73.0 152.9 17.4 94.8 -5.1 6 3 A V S S+ 0 0 56 260,-0.2 2,-0.2 3,-0.1 -1,-0.1 0.808 86.6 2.0 -70.6 -30.9 19.1 95.4 -1.8 7 4 A S S S- 0 0 67 2,-0.4 -2,-0.1 259,-0.2 0, 0.0 -0.825 85.0 -90.3-144.1-177.4 21.1 98.4 -3.0 8 5 A T S S+ 0 0 152 -2,-0.2 -3,-0.0 2,-0.1 2,-0.0 0.770 97.2 97.4 -71.8 -22.9 21.6 100.5 -6.1 9 6 A A S S- 0 0 58 1,-0.1 -2,-0.4 2,-0.0 2,-0.3 -0.358 76.9-126.8 -64.9 143.8 24.4 98.2 -7.2 10 7 A S - 0 0 86 1,-0.1 4,-0.1 -5,-0.1 -1,-0.1 -0.730 21.5-173.3 -95.4 143.8 23.4 95.5 -9.7 11 8 A T > + 0 0 15 -2,-0.3 4,-2.8 2,-0.1 5,-0.2 0.292 61.3 101.0-113.7 3.3 24.1 91.8 -9.0 12 9 A E H > S+ 0 0 76 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.853 80.0 52.2 -58.9 -37.4 22.9 90.7 -12.5 13 10 A M H > S+ 0 0 98 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.911 112.0 45.1 -67.0 -42.5 26.5 90.3 -13.8 14 11 A S H > S+ 0 0 36 1,-0.2 4,-1.1 2,-0.2 3,-0.5 0.930 113.7 49.7 -65.5 -43.9 27.5 88.2 -10.8 15 12 A V H X S+ 0 0 0 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.827 104.4 61.1 -63.3 -30.5 24.3 86.1 -11.2 16 13 A R H X S+ 0 0 116 -4,-1.8 4,-2.2 -5,-0.2 -1,-0.2 0.874 95.8 59.8 -64.4 -37.0 25.1 85.8 -14.9 17 14 A K H X S+ 0 0 116 -4,-1.3 4,-2.2 -3,-0.5 -1,-0.2 0.910 104.1 50.9 -56.8 -43.0 28.4 84.0 -14.0 18 15 A I H X S+ 0 0 1 -4,-1.1 4,-2.1 1,-0.2 -1,-0.2 0.934 110.4 47.8 -60.0 -48.7 26.4 81.3 -12.2 19 16 A A H X S+ 0 0 2 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.830 110.6 53.7 -61.7 -32.5 24.1 80.8 -15.3 20 17 A A H X S+ 0 0 44 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.888 106.4 50.8 -69.9 -40.5 27.2 80.7 -17.4 21 18 A H H X S+ 0 0 42 -4,-2.2 4,-1.1 1,-0.2 -2,-0.2 0.913 112.1 47.3 -62.8 -42.7 28.7 77.9 -15.3 22 19 A M H < S+ 0 0 24 -4,-2.1 -1,-0.2 1,-0.2 6,-0.2 0.764 109.7 54.4 -70.2 -25.6 25.5 75.9 -15.6 23 20 A K H < S+ 0 0 123 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.877 109.3 46.2 -74.9 -36.7 25.4 76.6 -19.4 24 21 A S H < S+ 0 0 90 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.689 118.8 43.5 -76.8 -20.6 28.9 75.2 -19.9 25 22 A N >< + 0 0 24 -4,-1.1 3,-1.9 -5,-0.2 -1,-0.3 -0.561 68.9 165.4-125.7 65.7 28.1 72.2 -17.7 26 23 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.633 76.0 48.0 -56.3 -21.4 24.6 71.2 -18.9 27 24 A N T 3 S+ 0 0 123 -3,-0.1 2,-0.2 2,-0.1 -5,-0.0 0.228 91.4 104.8-107.1 13.5 24.6 67.7 -17.2 28 25 A A < - 0 0 14 -3,-1.9 2,-0.3 -6,-0.2 187,-0.1 -0.489 57.5-144.4 -90.9 162.8 25.8 69.0 -13.8 29 26 A K - 0 0 59 185,-0.3 188,-1.0 -2,-0.2 2,-0.3 -0.816 8.7-128.8-123.5 165.8 23.6 69.4 -10.7 30 27 A V E -ab 112 217A 3 81,-2.8 83,-2.8 -2,-0.3 84,-1.2 -0.889 6.0-151.4-119.1 145.7 23.6 71.9 -7.9 31 28 A I E -ab 114 218A 0 186,-2.5 188,-2.4 -2,-0.3 2,-0.3 -0.972 16.0-158.8-114.7 124.3 23.6 71.4 -4.1 32 29 A F E -ab 115 219A 0 82,-2.7 84,-3.2 -2,-0.5 2,-0.4 -0.798 10.5-168.1-103.8 149.2 21.9 74.1 -2.0 33 30 A M E +ab 116 220A 1 186,-1.9 188,-2.4 -2,-0.3 2,-0.3 -0.977 24.7 179.6-132.7 114.7 22.5 74.8 1.6 34 31 A V E -ab 117 221A 0 82,-2.9 84,-2.2 -2,-0.4 85,-0.3 -0.861 15.8-178.9-127.3 159.4 19.9 77.2 3.1 35 32 A G > - 0 0 0 186,-1.7 3,-1.8 -2,-0.3 4,-0.3 -0.599 54.9 -56.7-134.5-166.6 18.8 79.0 6.2 36 33 A A G >> S+ 0 0 57 1,-0.3 3,-1.7 -2,-0.2 4,-0.5 0.728 114.5 77.3 -52.1 -28.0 16.2 81.4 7.7 37 34 A G G >4 S+ 0 0 25 185,-2.5 3,-0.7 1,-0.3 4,-0.4 0.807 86.9 58.4 -56.0 -31.7 16.9 84.0 5.1 38 35 A I G <4 S+ 0 0 0 -3,-1.8 62,-0.3 184,-0.4 -1,-0.3 0.598 109.2 43.9 -77.6 -8.2 15.0 82.2 2.3 39 36 A S G X4>S+ 0 0 4 -3,-1.7 3,-1.2 -4,-0.3 5,-1.0 0.354 83.6 94.7-114.7 2.8 11.7 82.2 4.3 40 37 A T G X<5S+ 0 0 95 -3,-0.7 3,-2.0 -4,-0.5 4,-0.1 0.930 83.1 55.3 -61.8 -42.1 11.8 85.8 5.6 41 38 A S G 3 5S+ 0 0 67 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.599 93.9 71.8 -66.4 -9.4 9.6 87.0 2.7 42 39 A C G < 5S- 0 0 25 -3,-1.2 53,-0.3 2,-0.1 -1,-0.3 0.565 114.0-113.6 -82.8 -6.9 7.0 84.4 3.7 43 40 A G T < 5 + 0 0 54 -3,-2.0 -3,-0.1 1,-0.3 -2,-0.1 0.647 58.4 160.4 86.3 13.4 6.2 86.4 6.7 44 41 A I < - 0 0 40 -5,-1.0 -1,-0.3 -4,-0.1 2,-0.2 -0.576 41.6-122.3 -71.5 122.7 7.5 83.9 9.2 45 42 A P - 0 0 23 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.474 14.4-127.2 -71.7 133.5 8.0 85.8 12.5 46 43 A D > - 0 0 61 -2,-0.2 3,-2.0 1,-0.1 9,-0.2 -0.716 11.8-152.5 -80.1 113.2 11.5 85.7 14.0 47 44 A F T 3 S+ 0 0 27 -2,-0.7 -1,-0.1 1,-0.3 5,-0.1 0.660 94.9 56.7 -61.6 -16.7 11.1 84.5 17.6 48 45 A R T 3 S+ 0 0 120 2,-0.1 -1,-0.3 18,-0.1 19,-0.1 0.472 90.3 92.1 -93.4 -3.7 14.3 86.4 18.5 49 46 A S X - 0 0 48 -3,-2.0 3,-0.9 17,-0.0 6,-0.4 -0.810 68.8-142.2-100.0 120.3 12.9 89.7 17.2 50 47 A P T 3 S+ 0 0 76 0, 0.0 3,-0.1 0, 0.0 -4,-0.1 -0.192 91.6 51.7 -62.7 170.9 11.1 92.2 19.5 51 48 A G T 3 S+ 0 0 74 1,-0.3 2,-0.4 2,-0.1 3,-0.1 0.619 87.4 108.2 76.2 1.4 8.2 93.8 17.6 52 49 A T S <> S- 0 0 19 -3,-0.9 4,-1.6 1,-0.1 -1,-0.3 -0.915 73.9-135.6-109.2 139.5 7.1 90.2 16.7 53 50 A G H > S+ 0 0 47 -2,-0.4 4,-1.7 1,-0.2 5,-0.2 0.877 105.7 57.0 -63.1 -33.9 3.9 89.1 18.5 54 51 A L H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.922 102.6 53.0 -61.7 -47.3 5.6 85.7 19.1 55 52 A Y H > S+ 0 0 72 -6,-0.4 4,-2.2 -9,-0.2 -1,-0.2 0.929 111.2 46.1 -56.0 -48.4 8.6 87.3 20.9 56 53 A H H X S+ 0 0 69 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.807 110.2 52.5 -68.6 -29.0 6.3 89.2 23.3 57 54 A N H X S+ 0 0 70 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.923 111.5 47.1 -71.0 -41.2 4.1 86.2 24.0 58 55 A L H <>S+ 0 0 4 -4,-2.4 5,-2.3 2,-0.2 -2,-0.2 0.877 112.9 49.5 -65.4 -38.1 7.2 84.1 24.9 59 56 A A H ><5S+ 0 0 50 -4,-2.2 3,-2.1 -5,-0.2 -2,-0.2 0.931 108.5 52.3 -66.6 -44.5 8.5 87.0 27.1 60 57 A R H 3<5S+ 0 0 178 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.842 105.2 57.4 -58.5 -33.1 5.2 87.2 28.8 61 58 A L T 3<5S- 0 0 51 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.359 121.2-109.4 -80.7 5.9 5.4 83.5 29.5 62 59 A K T < 5 + 0 0 170 -3,-2.1 -3,-0.2 1,-0.3 -2,-0.1 0.658 54.7 167.5 76.6 17.4 8.7 84.0 31.3 63 60 A L < - 0 0 18 -5,-2.3 -1,-0.3 1,-0.2 4,-0.0 -0.498 32.8-142.1 -60.6 131.5 11.0 82.4 28.6 64 61 A P S S- 0 0 81 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.795 74.2 -13.0 -68.1 -31.1 14.5 83.5 29.9 65 62 A Y S > S- 0 0 128 1,-0.1 3,-2.4 -7,-0.1 4,-0.3 -0.918 79.0 -96.0-167.8 147.7 15.9 84.1 26.4 66 63 A P G > S+ 0 0 37 0, 0.0 3,-2.0 0, 0.0 4,-0.2 0.817 116.5 52.2 -36.1 -58.1 14.7 83.2 22.8 67 64 A E G > S+ 0 0 48 1,-0.3 3,-1.3 2,-0.2 120,-0.3 0.547 86.9 81.0 -68.1 -3.4 16.7 80.1 22.3 68 65 A A G X S+ 0 0 1 -3,-2.4 3,-1.3 1,-0.3 -1,-0.3 0.660 79.3 72.5 -71.8 -13.7 15.5 78.5 25.5 69 66 A V G < S+ 0 0 2 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.752 101.4 42.8 -71.0 -22.4 12.4 77.6 23.5 70 67 A F G < S+ 0 0 8 -3,-1.3 117,-2.5 -4,-0.2 2,-0.5 -0.190 91.9 110.6-113.7 36.8 14.6 75.0 21.7 71 68 A D B <> -f 187 0B 44 -3,-1.3 4,-2.8 115,-0.2 5,-0.2 -0.960 59.6-148.0-116.6 126.2 16.3 73.7 24.9 72 69 A V H > S+ 0 0 33 115,-0.7 4,-2.3 -2,-0.5 5,-0.2 0.929 97.4 49.3 -56.2 -52.4 15.6 70.2 26.1 73 70 A D H > S+ 0 0 127 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.912 114.2 46.0 -55.3 -46.1 16.0 71.0 29.8 74 71 A F H >> S+ 0 0 40 1,-0.2 4,-2.3 2,-0.2 3,-0.7 0.965 109.5 53.8 -63.9 -50.6 13.8 74.0 29.6 75 72 A F H 3< S+ 0 0 3 -4,-2.8 3,-0.2 1,-0.3 -2,-0.2 0.918 108.2 50.1 -49.1 -49.3 11.1 72.3 27.6 76 73 A Q H 3< S+ 0 0 84 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.832 113.5 45.8 -63.0 -29.5 10.8 69.5 30.2 77 74 A S H << S+ 0 0 91 -4,-1.4 -1,-0.2 -3,-0.7 -2,-0.2 0.761 138.0 1.7 -82.9 -25.6 10.5 72.0 33.0 78 75 A D < + 0 0 55 -4,-2.3 4,-0.4 -3,-0.2 -1,-0.3 -0.655 60.2 177.7-163.5 97.7 7.9 74.2 31.1 79 76 A P > + 0 0 12 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.605 62.1 91.2 -81.1 -9.8 6.6 73.1 27.7 80 77 A L H > S+ 0 0 43 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.853 82.3 52.9 -54.9 -45.8 4.2 76.0 27.2 81 78 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.936 112.3 46.0 -58.3 -44.5 6.6 78.4 25.4 82 79 A F H > S+ 0 0 3 -4,-0.4 4,-2.9 2,-0.2 -2,-0.2 0.931 112.5 50.2 -62.7 -44.7 7.5 75.7 22.9 83 80 A Y H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.894 110.4 51.3 -59.7 -39.1 3.8 74.9 22.4 84 81 A T H X S+ 0 0 27 -4,-2.6 4,-1.4 -5,-0.2 -1,-0.2 0.894 111.3 46.5 -65.2 -41.5 3.1 78.6 21.9 85 82 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.906 110.7 53.8 -67.5 -40.7 5.8 78.9 19.3 86 83 A A H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.886 103.1 56.6 -61.5 -39.4 4.5 75.7 17.5 87 84 A K H < S+ 0 0 86 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.924 114.7 38.3 -59.1 -42.7 1.0 77.1 17.3 88 85 A E H < S+ 0 0 74 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.835 124.3 38.4 -78.9 -32.4 2.3 80.1 15.4 89 86 A L H < S+ 0 0 22 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.439 78.5 136.6-100.0 2.3 5.0 78.4 13.3 90 87 A Y >< - 0 0 25 -4,-1.8 3,-1.5 -5,-0.2 4,-0.1 -0.187 66.2 -98.3 -54.4 135.6 3.2 75.1 12.5 91 88 A P T 3 S+ 0 0 29 0, 0.0 -1,-0.1 0, 0.0 31,-0.1 -0.240 110.4 45.8 -54.0 137.7 3.6 74.0 8.8 92 89 A G T 3 S+ 0 0 44 29,-0.2 -2,-0.1 2,-0.2 -3,-0.0 0.178 86.6 92.1 110.1 -15.0 0.6 75.1 6.7 93 90 A N S < S+ 0 0 91 -3,-1.5 2,-0.2 -4,-0.1 -3,-0.1 0.598 89.5 38.3 -85.7 -11.8 0.4 78.6 8.2 94 91 A F S S- 0 0 35 27,-0.1 -2,-0.2 -4,-0.1 -51,-0.1 -0.788 73.4-126.4-132.4 173.6 2.6 80.0 5.4 95 92 A R - 0 0 161 -53,-0.3 28,-0.1 -2,-0.2 32,-0.1 -0.931 36.4 -95.3-123.0 148.6 3.2 79.8 1.7 96 93 A P - 0 0 11 0, 0.0 2,-0.1 0, 0.0 -57,-0.1 -0.204 38.4-123.7 -62.3 150.2 6.5 79.1 -0.1 97 94 A S > - 0 0 6 -59,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.286 30.3 -97.4 -85.0 175.1 8.6 82.1 -1.5 98 95 A K H > S+ 0 0 4 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.876 126.9 53.9 -61.1 -36.6 9.8 82.7 -5.0 99 96 A F H > S+ 0 0 0 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.891 103.8 53.9 -67.4 -39.0 13.1 81.1 -3.9 100 97 A H H > S+ 0 0 0 -62,-0.3 4,-1.3 1,-0.2 3,-0.3 0.915 108.2 50.6 -60.4 -40.7 11.5 78.0 -2.7 101 98 A Y H X S+ 0 0 49 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.785 101.1 63.2 -68.5 -24.0 9.8 77.6 -6.1 102 99 A L H X S+ 0 0 0 -4,-1.2 4,-2.7 2,-0.2 -1,-0.2 0.910 99.1 53.8 -64.1 -41.6 13.2 78.0 -7.7 103 100 A L H X S+ 0 0 0 -4,-1.4 4,-2.0 -3,-0.3 -1,-0.2 0.926 108.4 50.6 -56.8 -43.2 14.3 74.8 -6.0 104 101 A K H X S+ 0 0 47 -4,-1.3 4,-2.6 2,-0.2 -1,-0.2 0.877 108.0 52.2 -61.9 -40.9 11.2 73.2 -7.6 105 102 A L H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.944 108.6 50.2 -61.0 -48.8 12.2 74.5 -11.0 106 103 A F H <>S+ 0 0 0 -4,-2.7 5,-2.9 1,-0.2 6,-0.6 0.877 110.7 49.9 -57.3 -39.8 15.7 73.1 -10.6 107 104 A Q H ><5S+ 0 0 21 -4,-2.0 3,-1.8 1,-0.2 -1,-0.2 0.932 109.4 50.8 -64.4 -46.3 14.2 69.7 -9.7 108 105 A D H 3<5S+ 0 0 88 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.857 112.0 48.2 -58.4 -35.2 11.9 69.9 -12.7 109 106 A K T 3<5S- 0 0 69 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.326 112.3-123.7 -87.6 6.2 15.0 70.6 -14.8 110 107 A D T < 5S+ 0 0 108 -3,-1.8 -3,-0.2 -5,-0.2 -2,-0.1 0.756 82.2 114.7 56.9 27.5 16.8 67.7 -13.2 111 108 A V < + 0 0 18 -5,-2.9 -81,-2.8 -6,-0.2 2,-0.7 0.217 45.0 101.4-109.1 15.4 19.6 70.0 -12.0 112 109 A L E +a 30 0A 4 -6,-0.6 -81,-0.2 -83,-0.2 3,-0.1 -0.878 36.3 169.3-104.7 114.5 18.9 69.6 -8.3 113 110 A K E - 0 0 37 -83,-2.8 2,-0.3 -2,-0.7 -82,-0.2 0.883 66.9 -33.2 -86.9 -44.1 21.3 67.2 -6.5 114 111 A R E -a 31 0A 28 -84,-1.2 -82,-2.7 2,-0.0 2,-0.5 -0.963 43.5-141.4-172.0 153.1 20.2 68.1 -2.9 115 112 A V E -ac 32 134A 0 18,-2.5 20,-2.4 -2,-0.3 2,-0.6 -0.972 14.5-163.1-128.8 116.1 19.0 70.9 -0.7 116 113 A Y E -ac 33 135A 0 -84,-3.2 -82,-2.9 -2,-0.5 2,-0.4 -0.888 17.4-173.2 -96.1 118.1 20.3 71.0 2.9 117 114 A T E -ac 34 136A 0 18,-2.8 20,-1.6 -2,-0.6 21,-0.6 -0.935 31.9-167.2-122.9 140.5 18.1 73.2 5.0 118 115 A Q + 0 0 24 -84,-2.2 -83,-0.2 -2,-0.4 2,-0.1 0.510 65.4 104.1 -91.2 -10.1 18.4 74.5 8.6 119 116 A N - 0 0 13 -85,-0.3 19,-0.3 1,-0.1 3,-0.2 -0.411 55.9-160.7 -77.5 150.8 14.8 75.6 8.6 120 117 A I S S+ 0 0 22 1,-0.1 21,-0.4 -2,-0.1 -1,-0.1 0.251 74.6 90.2-109.9 9.1 12.0 73.8 10.3 121 118 A D S S- 0 0 19 19,-0.1 -29,-0.2 -31,-0.1 -27,-0.1 0.693 79.2-146.4 -78.2 -15.9 9.2 75.5 8.2 122 119 A T > + 0 0 17 -3,-0.2 4,-2.4 1,-0.1 5,-0.2 0.738 48.7 143.8 53.5 30.0 9.4 72.6 5.6 123 120 A L H > + 0 0 2 2,-0.2 4,-1.3 1,-0.2 6,-0.1 0.718 64.6 61.5 -68.3 -21.0 8.5 75.1 2.8 124 121 A E H 4>S+ 0 0 0 2,-0.2 5,-2.2 1,-0.2 4,-0.2 0.954 110.6 38.9 -68.0 -49.4 10.8 73.3 0.4 125 122 A R H >45S+ 0 0 87 1,-0.2 3,-1.8 3,-0.2 -2,-0.2 0.909 114.1 54.2 -65.4 -43.0 8.7 70.1 0.7 126 123 A Q H 3<5S+ 0 0 74 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.814 105.2 56.2 -62.3 -27.8 5.5 72.1 0.8 127 124 A A T 3<5S- 0 0 11 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.497 129.1 -95.2 -82.1 -6.8 6.7 73.7 -2.5 128 125 A G T < 5S+ 0 0 33 -3,-1.8 2,-0.3 1,-0.3 -3,-0.2 0.567 70.2 149.8 106.5 6.7 7.0 70.3 -4.1 129 126 A V < - 0 0 4 -5,-2.2 -1,-0.3 -6,-0.1 -25,-0.1 -0.608 53.7-107.3 -73.1 132.6 10.7 69.4 -3.7 130 127 A K >> - 0 0 132 -2,-0.3 3,-1.2 1,-0.1 4,-0.6 -0.248 15.7-121.0 -64.5 146.8 10.9 65.6 -3.5 131 128 A D G >4 S+ 0 0 112 1,-0.3 3,-1.0 2,-0.2 -1,-0.1 0.852 111.6 58.8 -52.6 -39.5 11.6 63.8 -0.2 132 129 A D G 34 S+ 0 0 116 1,-0.2 -1,-0.3 3,-0.0 -2,-0.0 0.790 106.4 48.0 -63.1 -30.3 14.7 62.2 -1.7 133 130 A L G <4 S+ 0 0 25 -3,-1.2 -18,-2.5 -19,-0.1 2,-0.4 0.501 98.1 85.7 -91.3 -3.5 16.3 65.6 -2.5 134 131 A I E << -c 115 0A 8 -3,-1.0 2,-0.5 -4,-0.6 -18,-0.2 -0.822 47.8-174.3-108.2 138.0 15.7 67.2 0.9 135 132 A I E -c 116 0A 12 -20,-2.4 -18,-2.8 -2,-0.4 2,-1.5 -0.914 7.9-165.1-127.0 101.5 17.8 67.1 4.1 136 133 A E E > -c 117 0A 26 -2,-0.5 3,-1.9 1,-0.2 -18,-0.1 -0.710 8.9-172.6 -87.2 87.0 16.0 68.8 7.0 137 134 A A T 3 S+ 0 0 0 -20,-1.6 -1,-0.2 -2,-1.5 -19,-0.2 0.752 80.3 41.5 -55.0 -30.8 19.1 69.1 9.2 138 135 A H T 3 S- 0 0 1 -21,-0.6 47,-2.3 1,-0.4 -1,-0.3 0.118 110.4-120.0-108.3 23.4 17.1 70.4 12.2 139 136 A G E < -G 184 0C 11 -3,-1.9 -1,-0.4 45,-0.3 45,-0.3 -0.255 25.5-124.3 76.3-165.0 14.1 68.1 11.9 140 137 A S E > - 0 0 5 43,-1.1 3,-0.6 3,-0.2 43,-0.4 -0.947 26.6 -95.0-167.1 177.8 10.5 69.2 11.4 141 138 A F E 3 S+ 0 0 2 -21,-0.4 18,-0.1 -2,-0.3 43,-0.1 0.424 97.7 94.4 -86.0 -0.5 7.0 68.9 13.0 142 139 A A E 3 S+ 0 0 50 41,-0.1 2,-0.3 40,-0.1 -1,-0.2 0.588 88.3 38.4 -69.9 -12.1 6.2 65.9 10.6 143 140 A H E < - 0 0 128 -3,-0.6 40,-3.3 11,-0.1 2,-0.3 -0.977 66.0-166.6-137.3 152.4 7.2 63.3 13.2 144 141 A C E +GH 182 153C 3 9,-1.0 9,-2.4 -2,-0.3 2,-0.3 -0.980 9.0 171.7-138.8 148.9 6.9 63.1 17.0 145 142 A H E -GH 181 152C 56 36,-2.0 36,-2.2 -2,-0.3 2,-0.3 -0.992 40.2 -94.6-155.2 155.1 8.4 60.8 19.7 146 143 A C E > -G 180 0C 1 5,-2.3 4,-1.4 -2,-0.3 34,-0.2 -0.559 27.7-143.2 -72.1 130.9 8.6 60.5 23.4 147 144 A I T 4 S+ 0 0 41 32,-2.5 -1,-0.1 -2,-0.3 33,-0.1 0.687 96.3 43.8 -70.1 -15.8 11.7 62.2 24.8 148 145 A G T 4 S+ 0 0 51 31,-0.3 -1,-0.2 3,-0.1 32,-0.1 0.897 131.8 10.3 -95.3 -49.2 12.2 59.5 27.4 149 146 A C T 4 S- 0 0 64 2,-0.1 -2,-0.1 29,-0.0 -1,-0.0 0.509 91.7-123.7-110.3 -7.2 11.6 56.1 25.7 150 147 A G < + 0 0 40 -4,-1.4 -3,-0.1 1,-0.2 30,-0.0 0.529 47.4 165.7 78.0 6.8 11.5 57.2 22.0 151 148 A K - 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