==== 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 ACETYLTRANSFERASE 02-JUL-98 1BOB . COMPND 2 MOLECULE: HISTONE ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR R.N.DUTNALL,S.T.TAFROV,R.STERNGLANZ,V.RAMAKRISHNAN . 306 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16564.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 224 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 17.6 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 28 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 27.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 3 0 2 0 0 0 1 1 0 0 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 0 0 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 PARALLEL BRIDGES PER LADDER . 0 1 1 1 0 2 2 1 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 . 2 0 0 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 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 6 A F 0 0 158 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -75.3 60.4 4.9 33.6 2 7 A K > - 0 0 128 1,-0.1 3,-1.5 2,-0.1 4,-0.2 0.960 360.0-146.3 65.9 94.2 59.4 5.1 29.9 3 8 A P G > S+ 0 0 56 0, 0.0 3,-0.7 0, 0.0 40,-0.2 0.490 88.8 78.2 -67.4 -3.6 59.9 8.7 28.5 4 9 A E G 3 S+ 0 0 125 1,-0.2 3,-0.3 2,-0.2 -2,-0.1 0.675 83.5 64.8 -77.6 -19.7 56.8 8.4 26.2 5 10 A T G < S+ 0 0 65 -3,-1.5 41,-0.3 1,-0.2 -1,-0.2 0.673 108.3 41.4 -73.7 -16.0 54.6 9.0 29.2 6 11 A W S < S+ 0 0 38 -3,-0.7 37,-2.5 -4,-0.2 38,-1.3 0.350 105.7 77.8-109.1 -1.7 56.2 12.5 29.4 7 12 A T E +A 42 0A 53 -3,-0.3 2,-0.3 35,-0.2 35,-0.2 -0.911 56.3 170.3-112.8 139.0 56.2 13.1 25.6 8 13 A S E -A 41 0A 28 33,-2.1 33,-3.1 -2,-0.4 2,-0.4 -0.991 38.8-105.1-147.8 150.5 53.1 14.1 23.7 9 14 A S E >> -A 40 0A 20 -2,-0.3 4,-2.3 31,-0.2 3,-0.5 -0.665 23.0-146.5 -75.8 126.4 52.1 15.3 20.2 10 15 A A H 3> S+ 0 0 0 29,-2.2 4,-1.9 -2,-0.4 -1,-0.2 0.771 98.8 59.5 -63.9 -25.5 51.4 19.1 20.3 11 16 A N H 34 S+ 0 0 30 28,-0.6 -1,-0.2 2,-0.2 29,-0.1 0.845 111.7 38.2 -72.5 -32.3 48.8 18.5 17.6 12 17 A E H <4 S+ 0 0 144 -3,-0.5 -2,-0.2 1,-0.1 -1,-0.2 0.810 115.7 52.9 -86.7 -31.5 46.8 16.1 19.8 13 18 A A H < S+ 0 0 5 -4,-2.3 36,-2.7 35,-0.1 2,-0.7 0.835 95.1 75.0 -74.0 -35.9 47.4 18.0 23.0 14 19 A L E < -b 49 0B 0 -4,-1.9 2,-0.6 -5,-0.2 36,-0.2 -0.714 63.5-175.0 -84.6 116.0 46.2 21.4 21.7 15 20 A R E -b 50 0B 71 34,-3.2 36,-2.7 -2,-0.7 2,-0.3 -0.965 3.7-167.5-113.9 115.8 42.4 21.3 21.5 16 21 A V E +bC 51 26B 0 10,-2.6 10,-3.2 -2,-0.6 2,-0.3 -0.757 8.4 177.4-100.8 148.3 40.8 24.4 19.9 17 22 A S E -bC 52 25B 9 34,-1.8 36,-2.2 -2,-0.3 2,-0.6 -0.987 24.9-144.6-153.6 140.1 37.1 25.2 20.1 18 23 A I E -bC 53 24B 2 6,-1.7 6,-2.0 -2,-0.3 2,-0.6 -0.958 25.8-151.6-107.3 122.8 34.8 28.0 18.9 19 24 A V E +bC 54 23B 28 34,-3.3 36,-2.8 -2,-0.6 37,-0.3 -0.865 43.3 113.9-106.4 116.6 32.0 28.5 21.4 20 25 A G S S- 0 0 28 2,-1.1 3,-0.1 -2,-0.6 -1,-0.1 0.154 94.0 -1.0-134.9-104.9 28.5 29.8 20.5 21 26 A E S S- 0 0 185 1,-0.3 2,-0.3 -2,-0.0 -2,-0.1 0.832 145.2 -18.1 -62.5 -31.2 25.4 27.7 20.8 22 27 A N S S- 0 0 96 -4,-0.2 -2,-1.1 2,-0.0 2,-0.5 -0.957 83.9 -84.4-169.1 157.6 27.9 25.1 21.9 23 28 A A E -C 19 0B 59 -2,-0.3 2,-0.7 -4,-0.2 -4,-0.2 -0.616 33.0-163.8 -76.4 118.4 31.6 24.4 21.8 24 29 A V E -C 18 0B 57 -6,-2.0 -6,-1.7 -2,-0.5 2,-0.4 -0.933 16.5-156.7-105.2 110.5 32.7 22.7 18.6 25 30 A Q E +C 17 0B 107 -2,-0.7 2,-0.3 -8,-0.2 -8,-0.3 -0.771 20.1 159.4 -94.9 137.6 36.2 21.3 19.3 26 31 A F E -C 16 0B 31 -10,-3.2 -10,-2.6 -2,-0.4 -2,-0.0 -0.922 33.4-108.5-148.7 167.1 38.9 20.5 16.7 27 32 A S - 0 0 64 -2,-0.3 -12,-0.1 -12,-0.2 2,-0.1 -0.665 33.0-109.5-100.3 153.7 42.7 19.9 16.4 28 33 A P - 0 0 7 0, 0.0 127,-0.2 0, 0.0 3,-0.1 -0.488 10.7-146.4 -79.2 154.4 45.3 22.2 14.8 29 34 A L S S+ 0 0 111 125,-2.0 2,-0.4 1,-0.3 126,-0.2 0.815 87.9 27.7 -85.6 -30.9 46.9 21.1 11.5 30 35 A F + 0 0 44 124,-2.7 -1,-0.3 1,-0.1 126,-0.1 -0.991 48.8 157.7-136.0 137.1 50.2 22.8 12.5 31 36 A T >> + 0 0 0 -2,-0.4 4,-2.8 -3,-0.1 3,-1.6 0.412 54.3 99.3-131.0 -7.6 51.8 23.5 15.9 32 37 A Y H 3> S+ 0 0 69 1,-0.3 4,-1.2 2,-0.2 6,-0.1 0.795 74.2 64.1 -56.0 -32.4 55.4 23.9 15.0 33 38 A P H 34 S+ 0 0 39 0, 0.0 -1,-0.3 0, 0.0 4,-0.1 0.866 120.2 24.5 -61.2 -28.8 55.3 27.7 14.9 34 39 A I H <4 S+ 0 0 4 -3,-1.6 -2,-0.2 2,-0.2 3,-0.1 0.879 133.2 31.0 -98.6 -54.5 54.6 27.5 18.7 35 40 A Y H <>S- 0 0 18 -4,-2.8 5,-0.5 1,-0.2 -3,-0.2 0.134 113.3 -96.3 -99.2 24.1 56.0 24.2 20.0 36 41 A G T ><5 - 0 0 32 -4,-1.2 3,-2.3 -5,-0.3 -1,-0.2 0.163 45.9 -63.7 84.9 159.7 58.9 23.7 17.7 37 42 A D T 3 5S+ 0 0 150 1,-0.3 -1,-0.2 2,-0.1 -5,-0.2 0.711 128.6 56.0 -50.7 -35.3 59.7 21.8 14.5 38 43 A S T 3 5S- 0 0 86 -3,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.623 95.0-142.2 -76.3 -15.0 59.1 18.3 16.1 39 44 A E T < 5 + 0 0 40 -3,-2.3 -29,-2.2 1,-0.2 -28,-0.6 0.858 60.4 123.8 52.5 38.8 55.6 19.4 17.1 40 45 A K E < -A 9 0A 99 -5,-0.5 2,-0.5 -31,-0.3 -31,-0.2 -0.952 52.6-148.7-127.3 145.1 56.2 17.4 20.3 41 46 A I E -A 8 0A 2 -33,-3.1 -33,-2.1 -2,-0.3 2,-0.4 -0.977 14.2-161.7-119.1 125.6 56.0 18.5 24.0 42 47 A Y E +A 7 0A 95 -2,-0.5 34,-0.4 -35,-0.2 -35,-0.2 -0.913 61.8 37.9-109.7 138.6 58.3 16.9 26.6 43 48 A G S S+ 0 0 0 -37,-2.5 27,-2.3 -2,-0.4 2,-0.4 0.583 87.0 94.5 105.8 10.6 57.8 17.0 30.4 44 49 A Y E -F 69 0C 6 -38,-1.3 2,-0.4 -3,-0.3 3,-0.3 -0.997 53.4-150.4-137.1 143.1 54.1 16.6 31.0 45 50 A K E S+F 68 0C 74 23,-2.3 22,-2.5 -2,-0.4 23,-0.9 -0.912 83.6 3.4-113.3 136.2 51.8 13.7 31.7 46 51 A D S S- 0 0 103 -2,-0.4 -1,-0.2 -41,-0.3 -40,-0.1 0.835 89.9-172.5 57.9 37.9 48.1 13.6 30.6 47 52 A L + 0 0 15 -3,-0.3 2,-0.3 19,-0.1 19,-0.2 -0.327 14.7 171.7 -64.8 138.5 48.7 17.0 29.0 48 53 A I E - D 0 65B 40 17,-1.9 17,-2.5 -2,-0.1 2,-0.6 -0.899 12.9-167.3-152.4 117.0 45.7 18.9 27.6 49 54 A I E -bD 14 64B 0 -36,-2.7 -34,-3.2 -2,-0.3 2,-0.5 -0.934 8.9-160.2-111.8 113.5 45.8 22.5 26.3 50 55 A H E +bD 15 63B 38 13,-2.5 13,-1.6 -2,-0.6 2,-0.5 -0.836 11.4 178.5 -96.6 126.9 42.4 24.1 25.8 51 56 A L E +bD 16 62B 0 -36,-2.7 -34,-1.8 -2,-0.5 2,-0.3 -0.985 12.7 174.9-128.5 115.1 42.1 27.1 23.5 52 57 A A E -bD 17 61B 6 9,-2.4 9,-1.6 -2,-0.5 2,-0.4 -0.941 14.9-165.1-127.0 150.1 38.7 28.5 23.1 53 58 A F E -bD 18 60B 0 -36,-2.2 -34,-3.3 -2,-0.3 2,-0.3 -0.975 30.3-112.1-132.9 142.7 37.1 31.5 21.3 54 59 A D E > -b 19 0B 0 5,-0.8 4,-1.6 -2,-0.4 -34,-0.2 -0.582 31.0-128.3 -69.2 136.1 33.7 33.1 21.6 55 60 A S T 4 S+ 0 0 1 -36,-2.8 127,-1.7 -2,-0.3 -35,-0.2 0.700 102.8 32.8 -61.3 -19.0 32.0 32.5 18.3 56 61 A V T 4 S+ 0 0 13 -37,-0.3 -1,-0.2 125,-0.3 -36,-0.1 0.872 134.0 19.2-102.4 -54.7 31.2 36.2 17.9 57 62 A T T 4 S- 0 0 0 2,-0.1 -2,-0.1 124,-0.1 90,-0.1 0.605 88.6-134.5 -94.7 -16.8 33.9 38.3 19.5 58 63 A F < + 0 0 0 -4,-1.6 -3,-0.1 1,-0.2 123,-0.0 0.833 33.9 178.2 60.7 37.4 36.6 35.6 19.5 59 64 A K - 0 0 16 1,-0.1 -5,-0.8 40,-0.1 -1,-0.2 -0.556 28.1-124.3 -69.6 120.7 37.7 36.4 23.1 60 65 A P E -D 53 0B 0 0, 0.0 32,-2.0 0, 0.0 2,-0.4 -0.442 27.1-172.5 -75.0 148.6 40.4 33.8 23.9 61 66 A Y E -De 52 92B 18 -9,-1.6 -9,-2.4 30,-0.2 2,-0.4 -0.994 4.6-168.0-139.2 129.3 40.4 31.4 26.8 62 67 A V E +De 51 93B 0 30,-2.0 32,-2.5 -2,-0.4 2,-0.2 -0.933 11.5 169.5-123.4 144.9 43.3 29.2 27.7 63 68 A N E -D 50 0B 21 -13,-1.6 -13,-2.5 -2,-0.4 2,-0.5 -0.750 11.1-166.8-158.5 108.0 43.6 26.3 30.1 64 69 A V E -D 49 0B 21 -2,-0.2 2,-0.4 -15,-0.2 -15,-0.2 -0.815 13.6-179.4 -96.8 128.0 46.5 23.9 30.5 65 70 A K E +D 48 0B 103 -17,-2.5 -17,-1.9 -2,-0.5 2,-0.3 -0.976 8.2 158.4-130.6 144.1 46.0 20.7 32.5 66 71 A Y - 0 0 107 -2,-0.4 -20,-0.2 -19,-0.2 -19,-0.1 -0.981 38.6-138.0-158.3 154.0 48.3 17.8 33.4 67 72 A S S S- 0 0 65 -22,-2.5 2,-0.3 -2,-0.3 -21,-0.2 0.867 88.6 -6.1 -81.9 -40.1 48.5 15.1 36.0 68 73 A A E -F 45 0C 35 -23,-0.9 -23,-2.3 2,-0.0 2,-0.3 -0.933 61.7-155.1-148.3 169.9 52.2 15.5 36.5 69 74 A K E -F 44 0C 86 -2,-0.3 -25,-0.2 -25,-0.2 -26,-0.1 -0.996 25.4-104.9-152.2 145.8 55.3 17.4 35.2 70 75 A L - 0 0 29 -27,-2.3 5,-0.1 -2,-0.3 -28,-0.0 -0.333 16.8-141.0 -71.6 152.9 59.0 17.0 35.1 71 76 A G + 0 0 74 -2,-0.0 -1,-0.1 3,-0.0 4,-0.1 0.441 57.8 127.7 -93.9 -0.7 61.3 19.0 37.3 72 77 A D > - 0 0 93 1,-0.1 3,-0.9 2,-0.1 -2,-0.0 -0.151 64.5-124.0 -56.3 150.0 64.0 19.5 34.7 73 78 A D T 3 S+ 0 0 154 1,-0.2 2,-0.7 3,-0.0 -1,-0.1 0.952 104.1 48.4 -61.5 -56.4 65.2 23.1 34.1 74 79 A N T 3 S+ 0 0 165 2,-0.0 2,-0.7 3,-0.0 -1,-0.2 -0.094 73.0 136.8 -82.6 37.6 64.6 23.4 30.4 75 80 A I < - 0 0 22 -3,-0.9 -32,-0.1 -2,-0.7 -34,-0.0 -0.779 61.9-115.0 -84.8 118.9 61.0 22.0 30.5 76 81 A V - 0 0 49 -2,-0.7 2,-1.3 -34,-0.4 3,-0.1 -0.243 17.3-121.3 -57.3 137.8 59.1 24.3 28.2 77 82 A D > - 0 0 78 1,-0.2 4,-2.5 2,-0.1 5,-0.2 -0.724 26.8-166.2 -84.1 94.3 56.3 26.4 29.8 78 83 A V H > S+ 0 0 0 -2,-1.3 4,-1.8 1,-0.2 -1,-0.2 0.866 83.3 44.6 -48.6 -46.0 53.4 25.2 27.7 79 84 A E H > S+ 0 0 73 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.947 112.1 49.5 -68.4 -50.4 51.1 28.0 28.8 80 85 A K H > S+ 0 0 151 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.893 109.7 54.4 -55.2 -43.3 53.5 30.9 28.4 81 86 A K H < S+ 0 0 89 -4,-2.5 4,-0.4 2,-0.2 3,-0.4 0.945 109.7 45.0 -57.0 -51.9 54.4 29.6 25.0 82 87 A L H >< S+ 0 0 0 -4,-1.8 3,-1.7 1,-0.2 4,-0.5 0.937 111.4 53.5 -60.4 -45.7 50.8 29.6 23.8 83 88 A L H >< S+ 0 0 45 -4,-2.5 3,-1.1 1,-0.3 -1,-0.2 0.792 95.2 69.1 -59.3 -31.9 50.1 33.0 25.3 84 89 A S T 3< S+ 0 0 82 -4,-1.8 -1,-0.3 -3,-0.4 -2,-0.2 0.646 104.6 42.6 -63.2 -17.0 53.1 34.6 23.5 85 90 A F T < S+ 0 0 48 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.478 104.6 79.1-105.3 -8.8 51.2 34.1 20.2 86 91 A L S < S- 0 0 9 -3,-1.1 61,-0.1 -4,-0.5 2,-0.1 -0.610 102.1 -73.9 -96.9 158.0 47.9 35.3 21.6 87 92 A P > - 0 0 15 0, 0.0 3,-1.4 0, 0.0 4,-0.3 -0.337 57.8-105.0 -57.6 123.8 46.9 39.0 22.2 88 93 A K T 3 S- 0 0 179 1,-0.3 -4,-0.1 2,-0.1 58,-0.0 -0.272 96.6 -5.9 -53.5 121.3 48.8 40.5 25.2 89 94 A D T 3 S+ 0 0 157 1,-0.1 -1,-0.3 -3,-0.1 3,-0.0 0.873 111.0 95.5 58.4 43.9 46.5 40.9 28.2 90 95 A D < + 0 0 26 -3,-1.4 2,-0.4 57,-0.0 -2,-0.1 0.259 60.9 93.1-138.5 1.9 43.3 39.9 26.3 91 96 A V - 0 0 21 -4,-0.3 2,-0.6 -32,-0.1 -30,-0.2 -0.870 63.9-144.9-107.9 130.6 43.3 36.2 27.2 92 97 A I E -e 61 0B 21 -32,-2.0 -30,-2.0 -2,-0.4 2,-0.4 -0.846 20.9-156.6 -93.7 120.9 41.3 34.8 30.2 93 98 A V E -e 62 0B 47 -2,-0.6 2,-3.3 -32,-0.2 -30,-0.2 -0.849 58.9 -27.0-103.6 137.9 43.3 31.9 31.8 94 99 A R S S+ 0 0 198 -32,-2.5 2,-1.6 -2,-0.4 3,-0.1 -0.160 106.0 99.7 59.0 -48.5 41.7 29.1 33.8 95 100 A D > + 0 0 87 -2,-3.3 4,-1.7 1,-0.2 3,-0.2 -0.532 46.4 176.0 -73.3 91.5 38.7 31.2 35.1 96 101 A E H > S+ 0 0 122 -2,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.804 77.5 52.9 -65.0 -34.8 36.0 29.9 32.7 97 102 A A H > S+ 0 0 59 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.821 106.7 52.7 -72.4 -32.1 33.3 31.9 34.3 98 103 A K H > S+ 0 0 86 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.913 108.6 52.1 -67.1 -42.2 35.3 35.2 34.0 99 104 A W H X S+ 0 0 12 -4,-1.7 4,-2.4 1,-0.2 5,-0.3 0.949 108.9 48.0 -57.8 -53.7 35.7 34.5 30.3 100 105 A V H X S+ 0 0 55 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.867 111.9 50.5 -56.9 -41.0 32.0 34.0 29.7 101 106 A D H X S+ 0 0 101 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.926 109.4 52.2 -64.2 -44.6 31.2 37.2 31.6 102 107 A C H X S+ 0 0 35 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.953 116.5 36.8 -57.5 -53.7 33.7 39.1 29.6 103 108 A F H X S+ 0 0 14 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.778 113.0 55.0 -73.7 -29.5 32.4 38.0 26.2 104 109 A A H < S+ 0 0 50 -4,-2.3 -1,-0.2 -5,-0.3 4,-0.2 0.828 114.5 44.8 -70.5 -28.7 28.7 38.1 27.0 105 110 A E H >X S+ 0 0 117 -4,-1.6 3,-1.5 -5,-0.2 4,-0.5 0.930 113.4 47.4 -77.3 -49.2 29.3 41.7 28.1 106 111 A E H 3X S+ 0 0 28 -4,-2.5 4,-1.7 1,-0.3 3,-0.4 0.836 97.4 72.8 -62.5 -33.2 31.4 42.6 25.1 107 112 A R H 3< S+ 0 0 90 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.688 87.5 67.8 -56.2 -19.4 28.8 41.0 22.8 108 113 A K H <4 S+ 0 0 150 -3,-1.5 -1,-0.2 -4,-0.2 -2,-0.2 0.982 111.5 25.0 -66.3 -59.0 26.6 44.0 23.6 109 114 A T H < S+ 0 0 124 -4,-0.5 2,-0.9 -3,-0.4 -2,-0.2 0.606 92.0 118.3 -83.5 -11.8 28.6 46.8 21.9 110 115 A H < + 0 0 6 -4,-1.7 2,-0.4 2,-0.0 -1,-0.0 -0.393 33.8 147.7 -61.9 98.2 30.2 44.4 19.4 111 116 A N > - 0 0 39 -2,-0.9 3,-0.7 1,-0.1 4,-0.5 -0.895 30.2-178.5-142.9 111.3 29.0 45.6 16.0 112 117 A L T 3> S+ 0 0 6 -2,-0.4 4,-2.0 1,-0.2 -1,-0.1 0.564 81.3 72.3 -80.6 -10.7 31.0 45.4 12.7 113 118 A S T 34 S+ 0 0 53 1,-0.2 -1,-0.2 2,-0.2 5,-0.1 0.705 94.8 52.7 -77.3 -20.6 28.2 47.2 10.8 114 119 A D T <4 S+ 0 0 130 -3,-0.7 -1,-0.2 1,-0.1 -2,-0.2 0.751 124.1 22.2 -85.2 -27.9 29.0 50.5 12.5 115 120 A V T 4 S+ 0 0 81 -4,-0.5 2,-0.2 2,-0.0 -2,-0.2 0.700 110.4 70.6-112.1 -28.0 32.7 50.6 11.7 116 121 A F S < S- 0 0 11 -4,-2.0 2,-0.5 -5,-0.1 18,-0.2 -0.656 75.5-119.9 -97.4 153.2 33.3 48.3 8.6 117 122 A E E -G 133 0D 124 16,-1.7 16,-1.9 -2,-0.2 2,-0.2 -0.751 28.9-124.4 -91.8 127.5 32.3 48.7 5.0 118 123 A K E +G 132 0D 92 -2,-0.5 14,-0.3 14,-0.2 3,-0.1 -0.550 28.7 178.2 -73.3 136.8 30.0 46.1 3.6 119 124 A V E - 0 0 34 12,-3.7 2,-0.3 1,-0.4 13,-0.2 0.754 56.9 -32.0-107.0 -36.6 31.3 44.4 0.5 120 125 A S E -G 131 0D 42 11,-1.3 11,-2.5 2,-0.0 -1,-0.4 -0.982 46.2-137.9-173.3 172.7 28.7 41.8 -0.3 121 126 A E E +G 130 0D 71 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.983 20.2 167.4-145.0 153.5 26.0 39.3 0.9 122 127 A Y E -G 129 0D 34 7,-1.7 7,-2.7 -2,-0.3 2,-0.4 -0.983 26.2-126.1-161.2 163.4 24.9 35.8 0.0 123 128 A S E +G 128 0D 76 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.896 19.4 175.7-120.7 135.4 22.8 32.9 1.3 124 129 A L E > S-G 127 0D 41 3,-1.7 3,-0.8 -2,-0.4 94,-0.0 -0.880 81.2 -8.8-132.3 102.2 23.9 29.1 1.9 125 130 A N T 3 S- 0 0 171 -2,-0.3 3,-0.1 1,-0.2 2,-0.1 0.912 129.6 -53.5 78.0 40.0 21.1 26.8 3.4 126 131 A G T 3 S+ 0 0 72 1,-0.2 -1,-0.2 0, 0.0 2,-0.2 -0.064 111.9 112.9 90.4 -34.4 18.7 29.6 4.2 127 132 A E E < -G 124 0D 86 -3,-0.8 -3,-1.7 -2,-0.1 2,-0.3 -0.534 61.0-132.1 -82.5 141.3 21.0 31.7 6.2 128 133 A E E -G 123 0D 95 -2,-0.2 49,-2.3 -5,-0.2 50,-0.4 -0.628 20.9-165.2 -88.2 141.5 22.3 35.1 5.1 129 134 A F E -GH 122 176D 8 -7,-2.7 -7,-1.7 -2,-0.3 2,-0.4 -0.967 4.1-151.1-130.7 142.5 26.0 36.0 5.3 130 135 A V E -GH 121 175D 1 45,-2.9 45,-2.6 -2,-0.4 2,-0.5 -0.915 3.3-153.9-120.1 142.1 27.8 39.3 5.1 131 136 A V E +GH 120 174D 0 -11,-2.5 -12,-3.7 -2,-0.4 -11,-1.3 -0.960 21.2 174.2-113.2 123.5 31.3 40.3 3.9 132 137 A Y E -GH 118 173D 13 41,-2.4 41,-3.1 -2,-0.5 2,-0.3 -0.848 12.1-155.7-122.7 164.6 32.8 43.4 5.4 133 138 A K E +GH 117 172D 37 -16,-1.9 -16,-1.7 -2,-0.3 2,-0.3 -0.948 16.2 160.6-139.6 159.4 36.3 44.9 5.0 134 139 A S E - H 0 171D 12 37,-2.0 37,-2.5 -2,-0.3 2,-0.1 -0.973 33.5-111.9-166.4 169.2 38.5 47.2 7.0 135 140 A S - 0 0 41 -2,-0.3 35,-0.2 35,-0.2 36,-0.1 -0.125 32.4-115.8 -91.8-164.6 42.0 48.4 7.5 136 141 A L S S+ 0 0 4 33,-0.4 34,-0.1 30,-0.1 30,-0.0 -0.041 90.8 93.3-124.8 26.6 44.0 47.6 10.6 137 142 A V + 0 0 101 30,-0.1 2,-0.1 5,-0.0 -1,-0.1 0.887 69.2 75.7 -87.4 -40.7 44.4 51.2 11.8 138 143 A D S > S- 0 0 50 1,-0.1 4,-2.0 4,-0.0 5,-0.2 -0.360 84.9-121.4 -75.4 150.1 41.4 51.4 14.1 139 144 A D H > S+ 0 0 142 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.810 107.2 56.3 -56.6 -38.6 41.4 49.7 17.6 140 145 A F H > S+ 0 0 31 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.955 110.2 42.1 -62.9 -53.0 38.4 47.4 16.9 141 146 A A H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.903 114.2 52.5 -62.4 -40.9 39.9 45.7 13.8 142 147 A R H X S+ 0 0 58 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.877 109.2 50.6 -62.8 -36.6 43.3 45.4 15.4 143 148 A R H X S+ 0 0 88 -4,-1.9 4,-0.8 2,-0.2 -2,-0.2 0.937 112.9 44.2 -66.9 -47.6 41.7 43.8 18.4 144 149 A M H >X S+ 0 0 3 -4,-2.3 4,-2.1 1,-0.2 3,-0.6 0.908 111.9 53.9 -64.8 -40.2 39.8 41.2 16.4 145 150 A H H 3X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.3 -1,-0.2 0.891 105.6 51.4 -62.8 -42.6 42.8 40.5 14.1 146 151 A R H 3< S+ 0 0 89 -4,-1.9 4,-0.3 1,-0.2 -1,-0.3 0.711 111.2 51.4 -68.0 -19.0 45.1 39.7 17.0 147 152 A R H << S+ 0 0 2 -4,-0.8 3,-0.3 -3,-0.6 -2,-0.2 0.886 118.8 32.3 -83.7 -41.0 42.4 37.3 18.3 148 153 A V H >< S+ 0 0 0 -4,-2.1 3,-2.4 1,-0.2 4,-0.4 0.724 96.7 90.4 -87.9 -20.7 41.9 35.3 15.0 149 154 A Q T >X S+ 0 0 19 -4,-2.4 3,-1.4 1,-0.3 4,-0.7 0.770 75.1 64.8 -43.0 -43.9 45.5 35.7 13.8 150 155 A I H 3> S+ 0 0 0 -4,-0.3 4,-1.7 -3,-0.3 -1,-0.3 0.751 87.8 71.5 -59.2 -23.9 46.7 32.4 15.5 151 156 A F H <> S+ 0 0 0 -3,-2.4 4,-1.8 1,-0.2 5,-0.3 0.848 91.1 57.9 -61.6 -33.7 44.4 30.4 13.2 152 157 A S H <> S+ 0 0 0 -3,-1.4 4,-2.5 -4,-0.4 7,-0.3 0.912 108.6 45.5 -62.6 -42.1 46.7 31.2 10.3 153 158 A L H < S+ 0 0 7 -4,-0.7 -1,-0.2 -3,-0.2 -2,-0.2 0.792 115.5 47.0 -70.4 -33.1 49.7 29.6 12.1 154 159 A L H < S+ 0 0 1 -4,-1.7 -124,-2.7 1,-0.1 -125,-2.0 0.692 129.3 19.7 -83.0 -20.4 47.6 26.6 13.2 155 160 A F H < S+ 0 0 25 -4,-1.8 2,-0.6 -126,-0.2 -2,-0.2 0.540 111.6 66.7-128.4 -9.7 46.1 25.9 9.8 156 161 A I S >< S- 0 0 31 -4,-2.5 3,-1.5 -5,-0.3 -1,-0.2 -0.949 77.1-134.3-119.5 111.2 48.1 27.5 7.1 157 162 A E T 3 S+ 0 0 127 -2,-0.6 -3,-0.1 1,-0.2 -4,-0.0 -0.336 87.6 14.1 -63.9 143.8 51.6 26.0 6.7 158 163 A A T 3 S+ 0 0 73 1,-0.2 -1,-0.2 -5,-0.1 -5,-0.1 0.453 91.6 147.6 69.8 5.0 54.5 28.5 6.4 159 164 A A < - 0 0 20 -3,-1.5 2,-0.3 -7,-0.3 -1,-0.2 -0.286 26.0-170.2 -68.6 152.0 52.2 31.4 7.6 160 165 A N - 0 0 124 -2,-0.0 2,-0.2 -127,-0.0 -8,-0.0 -0.970 32.9 -93.2-140.8 153.4 53.7 34.3 9.6 161 166 A Y - 0 0 73 -2,-0.3 2,-0.1 1,-0.1 -11,-0.0 -0.521 43.8-130.0 -69.9 132.0 52.1 37.1 11.5 162 167 A I - 0 0 23 -2,-0.2 2,-0.9 1,-0.1 -1,-0.1 -0.375 24.3-100.6 -78.7 160.1 51.8 40.3 9.4 163 168 A D > - 0 0 98 1,-0.2 3,-1.6 -2,-0.1 6,-0.2 -0.741 29.8-157.2 -83.3 110.2 52.9 43.7 10.6 164 169 A E T 3 S+ 0 0 42 -2,-0.9 -1,-0.2 1,-0.3 -28,-0.1 0.655 86.0 63.4 -63.6 -16.7 49.7 45.4 11.7 165 170 A T T 3 S+ 0 0 89 3,-0.0 -1,-0.3 -3,-0.0 -2,-0.0 0.600 73.2 106.5 -84.4 -11.7 51.1 48.9 11.2 166 171 A D X - 0 0 47 -3,-1.6 3,-1.5 1,-0.2 -30,-0.1 -0.585 63.5-151.6 -70.0 116.0 51.6 48.5 7.4 167 172 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.2 0, 0.0 -31,-0.1 0.666 86.5 75.2 -63.4 -18.9 48.8 50.6 5.9 168 173 A S T 3 S+ 0 0 31 21,-0.1 22,-1.9 -33,-0.1 2,-0.2 0.575 74.9 102.0 -72.1 -10.0 48.6 48.4 2.8 169 174 A W E < + I 0 189D 22 -3,-1.5 -33,-0.4 20,-0.2 2,-0.3 -0.541 44.3 173.4 -79.3 140.9 46.8 45.7 4.8 170 175 A Q E - 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