==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 03-FEB-11 3QM0 . COMPND 2 MOLECULE: HISTONE ACETYLTRANSFERASE RTT109; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR Y.TANG,R.MARMORSTEIN . 355 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16668.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 247 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 17.5 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 . 1 0.3 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 . 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 . 31 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 24.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 2 0 1 1 0 1 1 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 PARALLEL BRIDGES PER LADDER . 2 0 1 1 1 0 2 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 1 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 0 A S 0 0 154 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 111.0 89.2 66.4 97.4 2 1 A M - 0 0 98 1,-0.1 2,-0.2 2,-0.0 3,-0.0 -0.190 360.0-127.1 -70.9 160.5 93.0 66.5 97.5 3 2 A S > - 0 0 24 1,-0.1 4,-3.0 292,-0.0 5,-0.2 -0.547 29.3-105.9-101.3 168.7 95.4 68.6 95.5 4 3 A L H > S+ 0 0 1 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.931 126.0 53.7 -58.7 -42.4 98.4 67.5 93.4 5 4 A N H > S+ 0 0 25 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.864 110.7 44.8 -58.8 -40.2 100.5 69.0 96.2 6 5 A D H > S+ 0 0 83 2,-0.2 4,-1.5 3,-0.1 -2,-0.2 0.905 114.3 49.5 -71.1 -43.2 98.6 66.9 98.8 7 6 A F H < S+ 0 0 13 -4,-3.0 4,-0.4 2,-0.2 -2,-0.2 0.960 113.9 45.0 -58.7 -56.4 98.8 63.7 96.7 8 7 A L H >X S+ 0 0 3 -4,-3.2 3,-4.1 1,-0.2 4,-1.0 0.979 112.2 46.5 -52.3 -73.6 102.5 64.0 96.1 9 8 A S H >< S+ 0 0 8 -4,-1.4 344,-0.6 1,-0.3 3,-0.5 0.804 103.6 67.3 -41.0 -37.5 103.8 64.9 99.6 10 9 A S T 3< S+ 0 0 46 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.697 112.6 30.5 -61.1 -17.4 101.5 62.1 100.9 11 10 A V T <4 S+ 0 0 14 -3,-4.1 89,-0.4 -4,-0.4 -1,-0.2 0.477 100.8 91.9-122.2 -3.3 103.8 59.5 99.2 12 11 A L S << S- 0 0 2 -4,-1.0 341,-2.0 -3,-0.5 340,-1.8 -0.588 93.3 -71.0 -88.3 154.6 107.2 61.2 99.2 13 12 A P B > -a 353 0A 11 0, 0.0 3,-0.6 0, 0.0 339,-0.3 0.062 63.3 -89.4 -42.3 150.8 109.7 60.6 102.0 14 13 A V T 3 S- 0 0 53 339,-1.0 337,-0.1 337,-0.3 3,-0.1 -0.395 100.2 -5.6 -70.0 140.3 108.9 62.1 105.4 15 14 A S T 3 S+ 0 0 86 336,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.902 97.8 130.3 40.0 65.5 110.1 65.6 106.2 16 15 A E < - 0 0 50 -3,-0.6 335,-2.4 -4,-0.1 2,-0.6 -0.985 57.2-116.3-142.3 145.7 112.2 66.0 103.0 17 16 A Q E +B 350 0B 93 -2,-0.3 42,-0.6 333,-0.2 2,-0.3 -0.765 40.3 157.3 -97.2 120.6 112.1 68.9 100.6 18 17 A F E -BC 349 58B 2 331,-2.2 331,-2.8 -2,-0.6 2,-0.4 -0.910 21.3-159.7-130.9 157.1 111.0 68.4 97.0 19 18 A E E -BC 348 57B 39 38,-1.4 38,-2.6 -2,-0.3 2,-0.3 -0.988 15.5-158.6-136.2 143.5 109.6 70.8 94.4 20 19 A Y E -BC 347 56B 8 327,-1.9 327,-0.9 -2,-0.4 2,-0.5 -0.878 15.3-139.7-128.6 162.5 107.6 69.8 91.3 21 20 A L E - C 0 55B 4 34,-2.7 34,-1.9 -2,-0.3 2,-0.6 -0.973 12.7-175.8-119.5 120.3 106.5 70.9 87.8 22 21 A S E + C 0 54B 3 -2,-0.5 279,-2.9 32,-0.2 2,-0.5 -0.766 14.2 178.6-118.5 84.0 103.0 70.3 86.6 23 22 A L E +dC 301 53B 0 30,-2.2 30,-3.5 -2,-0.6 2,-0.3 -0.759 1.2 179.0 -91.9 122.4 102.9 71.5 83.0 24 23 A Q E - C 0 52B 0 277,-1.9 28,-0.2 -2,-0.5 2,-0.2 -0.914 19.5-133.4-121.3 150.3 99.7 71.1 81.1 25 24 A S - 0 0 16 26,-2.0 279,-0.1 -2,-0.3 281,-0.0 -0.502 36.6 -86.7 -96.4 168.7 98.9 72.2 77.5 26 25 A I - 0 0 55 277,-0.2 23,-0.1 -2,-0.2 -1,-0.1 -0.637 53.5-101.3 -78.5 124.4 95.8 74.1 76.2 27 26 A P - 0 0 9 0, 0.0 2,-0.3 0, 0.0 98,-0.3 -0.178 47.0-161.2 -46.7 127.8 93.0 71.7 75.4 28 27 A L E -E 49 0B 64 21,-2.4 21,-2.4 96,-0.1 2,-0.6 -0.880 20.2-130.7-120.1 144.8 92.9 71.2 71.7 29 28 A E E +E 48 0B 100 -2,-0.3 19,-0.2 19,-0.2 2,-0.2 -0.863 48.9 148.6 -93.3 119.3 90.2 70.0 69.2 30 29 A T E -E 47 0B 55 17,-2.1 17,-0.5 -2,-0.6 2,-0.2 -0.525 44.0 -52.5-133.6-159.6 91.8 67.3 67.0 31 30 A H - 0 0 146 -2,-0.2 -1,-0.1 1,-0.1 4,-0.1 -0.536 68.2 -74.9 -89.2 154.1 91.1 64.1 65.1 32 31 A A - 0 0 20 -2,-0.2 -1,-0.1 1,-0.2 203,-0.1 -0.073 32.7-139.1 -43.3 127.9 89.5 60.9 66.3 33 32 A V S S+ 0 0 16 1,-0.2 202,-2.6 -3,-0.1 2,-0.5 0.793 96.0 43.2 -64.3 -24.3 91.9 58.9 68.5 34 33 A V S S- 0 0 44 200,-0.2 -1,-0.2 197,-0.1 197,-0.1 -0.984 104.8-102.5-126.0 124.8 90.5 55.8 66.7 35 34 A T - 0 0 47 198,-0.5 -2,-0.1 -2,-0.5 198,-0.0 -0.194 44.3-120.3 -47.3 120.3 89.9 55.8 62.9 36 35 A P - 0 0 64 0, 0.0 2,-0.5 0, 0.0 7,-0.1 -0.161 17.5-137.9 -62.1 155.2 86.2 56.2 62.3 37 36 A N > - 0 0 27 5,-0.3 3,-0.6 1,-0.1 5,-0.1 -0.964 3.1-149.2-125.4 115.6 84.1 53.6 60.5 38 37 A K T 3 S+ 0 0 169 -2,-0.5 2,-1.9 1,-0.3 -1,-0.1 0.864 98.2 60.5 -44.5 -48.8 81.5 54.7 57.9 39 38 A D T 3 S+ 0 0 119 2,-0.0 2,-0.4 3,-0.0 -1,-0.3 -0.168 88.7 103.1 -77.4 45.7 79.4 51.7 58.6 40 39 A D < - 0 0 82 -2,-1.9 -3,-0.1 -3,-0.6 -1,-0.0 -0.959 65.0-151.4-136.3 118.4 79.1 52.9 62.2 41 40 A K S S+ 0 0 209 -2,-0.4 2,-0.5 1,-0.1 -1,-0.1 0.763 88.4 64.6 -55.2 -24.4 76.0 54.6 63.7 42 41 A R + 0 0 109 -5,-0.1 -5,-0.3 -3,-0.1 -1,-0.1 -0.906 53.1 157.7-114.8 123.6 78.5 56.3 66.0 43 42 A V - 0 0 72 -2,-0.5 -5,-0.0 32,-0.1 -2,-0.0 -0.986 46.6-107.0-137.9 122.4 81.2 58.8 65.0 44 43 A P - 0 0 26 0, 0.0 31,-0.3 0, 0.0 3,-0.1 -0.154 17.4-157.7 -51.7 135.4 82.6 61.2 67.6 45 44 A K S S+ 0 0 112 29,-2.3 2,-0.3 1,-0.3 30,-0.2 0.875 79.2 14.2 -82.9 -39.7 81.6 64.9 67.3 46 45 A S E - F 0 74B 18 28,-1.4 28,-3.1 2,-0.0 2,-0.5 -0.995 53.1-170.4-143.4 135.6 84.7 66.1 69.2 47 46 A T E -EF 30 73B 6 -17,-0.5 -17,-2.1 -2,-0.3 2,-0.6 -0.866 15.9-164.9-124.0 94.1 88.0 64.7 70.4 48 47 A I E -EF 29 72B 0 24,-2.8 24,-2.9 -2,-0.5 2,-0.4 -0.716 8.1-168.9 -85.1 117.0 89.7 67.1 72.9 49 48 A K E +EF 28 71B 65 -21,-2.4 -21,-2.4 -2,-0.6 2,-0.3 -0.842 11.4 166.1-107.6 141.3 93.4 66.2 73.4 50 49 A T E - F 0 70B 2 20,-1.7 20,-3.0 -2,-0.4 2,-0.4 -0.987 23.9-134.1-154.5 143.8 95.6 67.7 76.0 51 50 A Q E - F 0 69B 20 -2,-0.3 -26,-2.0 18,-0.2 2,-0.5 -0.814 7.8-164.1-106.1 141.1 99.1 66.8 77.5 52 51 A H E -CF 24 68B 0 16,-3.4 16,-3.2 -2,-0.4 2,-0.5 -0.986 9.9-176.8-120.0 119.8 100.2 66.7 81.1 53 52 A F E -CF 23 67B 0 -30,-3.5 -30,-2.2 -2,-0.5 2,-0.3 -0.986 8.0-171.4-120.1 123.5 104.0 66.7 81.6 54 53 A F E -CF 22 66B 3 12,-2.8 12,-2.1 -2,-0.5 2,-0.3 -0.853 7.0-174.8-116.7 154.3 105.2 66.3 85.2 55 54 A S E -CF 21 65B 0 -34,-1.9 -34,-2.7 -2,-0.3 2,-0.4 -0.997 10.6-154.9-147.8 138.7 108.7 66.6 86.8 56 55 A L E -CF 20 64B 3 8,-1.8 7,-2.4 -2,-0.3 8,-1.2 -0.957 12.7-168.8-117.3 133.4 110.0 66.1 90.3 57 56 A F E -CF 19 62B 0 -38,-2.6 -38,-1.4 -2,-0.4 2,-0.4 -0.866 9.2-161.7-118.4 152.7 113.2 67.8 91.6 58 57 A H E S-C 18 0B 6 3,-2.6 3,-0.3 -2,-0.3 38,-0.2 -0.966 76.1 -22.9-135.6 114.8 115.3 67.1 94.7 59 58 A Q S S- 0 0 108 -42,-0.6 -1,-0.2 -2,-0.4 37,-0.1 0.954 129.8 -41.4 45.5 77.8 117.6 69.9 95.9 60 59 A G S S+ 0 0 20 -3,-0.1 2,-0.4 1,-0.1 272,-0.3 0.688 120.0 102.6 45.1 30.2 118.0 71.7 92.5 61 60 A K - 0 0 37 -3,-0.3 -3,-2.6 270,-0.1 2,-0.3 -0.954 64.3-138.9-143.2 120.8 118.2 68.5 90.5 62 61 A V E +F 57 0B 0 265,-1.5 -5,-0.3 -2,-0.4 268,-0.1 -0.603 28.6 164.4 -78.0 135.8 115.5 66.9 88.4 63 62 A F E + 0 0 4 -7,-2.4 29,-1.2 -2,-0.3 30,-0.5 0.529 55.0 36.5-128.6 -10.7 115.3 63.1 88.7 64 63 A F E -FG 56 91B 1 -8,-1.2 -8,-1.8 27,-0.2 2,-0.3 -0.991 52.7-177.7-146.9 151.2 111.9 62.0 87.3 65 64 A S E -FG 55 90B 0 25,-2.1 25,-2.5 -2,-0.3 2,-0.4 -0.984 7.0-164.0-153.6 142.0 109.4 62.9 84.6 66 65 A L E -FG 54 89B 0 -12,-2.1 -12,-2.8 -2,-0.3 2,-0.6 -0.987 3.5-163.1-131.8 123.1 106.0 61.7 83.4 67 66 A E E +FG 53 88B 8 21,-3.1 20,-2.2 -2,-0.4 21,-1.6 -0.918 20.2 172.5-108.2 113.0 104.4 62.4 80.0 68 67 A V E -FG 52 86B 0 -16,-3.2 -16,-3.4 -2,-0.6 2,-0.4 -0.945 17.6-156.8-123.5 140.9 100.6 61.7 80.0 69 68 A Y E -FG 51 85B 24 16,-2.9 16,-3.4 -2,-0.4 2,-0.5 -0.934 4.5-159.9-116.6 138.9 97.9 62.4 77.4 70 69 A V E -FG 50 84B 2 -20,-3.0 -20,-1.7 -2,-0.4 2,-0.5 -0.979 4.3-167.6-121.3 125.4 94.2 62.8 78.1 71 70 A Y E -FG 49 83B 8 12,-3.1 12,-3.1 -2,-0.5 2,-0.7 -0.950 3.5-166.4-112.1 122.5 91.7 62.4 75.4 72 71 A V E -FG 48 82B 0 -24,-2.9 -24,-2.8 -2,-0.5 2,-0.5 -0.947 12.0-168.8-109.4 112.4 88.1 63.5 76.0 73 72 A T E -FG 47 81B 7 8,-3.2 8,-2.1 -2,-0.7 2,-0.4 -0.924 3.8-163.8-108.6 123.7 85.8 62.1 73.2 74 73 A L E +FG 46 80B 2 -28,-3.1 -29,-2.3 -2,-0.5 -28,-1.4 -0.884 15.2 165.1-106.6 131.1 82.2 63.3 72.8 75 74 A W + 0 0 49 4,-1.9 2,-0.5 -2,-0.4 -32,-0.1 0.850 63.6 10.9-108.8 -69.9 79.6 61.3 70.8 76 75 A D S > S- 0 0 43 3,-0.1 3,-0.7 -32,-0.1 -1,-0.1 -0.726 100.5 -86.8-121.9 85.3 75.9 62.1 71.1 77 76 A E T 3 S+ 0 0 144 -2,-0.5 3,-0.1 1,-0.3 53,-0.1 0.704 130.6 36.1 19.1 40.7 75.2 65.3 73.1 78 77 A A T 3 S+ 0 0 47 1,-0.5 54,-0.5 53,-0.0 -1,-0.3 0.100 96.1 81.6-172.4 -57.2 75.3 62.9 76.1 79 78 A D < + 0 0 61 -3,-0.7 -4,-1.9 52,-0.1 -1,-0.5 -0.370 50.3 164.4 -72.3 148.4 78.0 60.2 75.7 80 79 A A E -G 74 0B 8 55,-0.4 57,-2.0 -6,-0.2 2,-0.3 -0.990 20.7-161.6-159.9 156.7 81.6 60.7 76.4 81 80 A E E -Gh 73 137B 42 -8,-2.1 -8,-3.2 -2,-0.3 2,-0.5 -0.984 5.8-158.0-141.0 145.3 84.9 58.9 77.1 82 81 A R E -Gh 72 138B 3 55,-2.5 57,-3.0 -2,-0.3 2,-0.6 -0.975 10.7-164.2-128.7 115.4 88.1 60.1 78.7 83 82 A L E -Gh 71 139B 13 -12,-3.1 -12,-3.1 -2,-0.5 2,-0.7 -0.898 5.3-158.9-104.0 122.5 91.2 58.1 77.8 84 83 A I E -Gh 70 140B 2 55,-4.0 57,-2.1 -2,-0.6 2,-0.6 -0.903 12.8-167.8-100.0 109.8 94.3 58.7 79.9 85 84 A F E -Gh 69 141B 3 -16,-3.4 -16,-2.9 -2,-0.7 2,-0.7 -0.887 11.6-150.9-104.8 112.5 97.3 57.5 77.9 86 85 A V E +Gh 68 142B 7 55,-1.9 57,-0.5 -2,-0.6 -18,-0.2 -0.732 24.2 169.9 -81.7 115.5 100.5 57.1 79.8 87 86 A S E + 0 0 27 -20,-2.2 2,-0.3 -2,-0.7 -19,-0.2 0.883 53.2 3.4 -96.3 -48.2 103.3 57.8 77.2 88 87 A K E +G 67 0B 31 -21,-1.6 -21,-3.1 2,-0.0 2,-0.4 -0.995 48.5 179.2-147.4 140.3 106.7 58.1 78.9 89 88 A A E +G 66 0B 28 -2,-0.3 2,-0.3 -23,-0.2 -23,-0.2 -0.994 18.5 166.6-138.9 130.2 108.1 57.8 82.4 90 89 A D E -G 65 0B 13 -25,-2.5 -25,-2.1 -2,-0.4 2,-0.3 -0.991 19.3-168.3-148.6 154.6 111.8 58.2 83.1 91 90 A T E -G 64 0B 31 -2,-0.3 -27,-0.2 -27,-0.2 61,-0.2 -0.799 7.5-167.9-128.5 171.2 114.3 58.7 85.9 92 91 A N - 0 0 0 -29,-1.2 -28,-0.1 -2,-0.3 235,-0.1 0.265 40.6-118.8-145.5 7.5 118.0 59.7 85.8 93 92 A G S S+ 0 0 24 -30,-0.5 67,-0.2 1,-0.1 -30,-0.1 0.956 70.3 125.6 48.0 73.9 119.2 59.0 89.4 94 93 A Y + 0 0 23 -33,-0.1 2,-0.6 3,-0.1 -36,-0.2 0.012 36.8 107.8-145.2 26.2 120.3 62.4 90.6 95 94 A C - 0 0 29 2,-0.2 4,-0.1 -32,-0.1 -36,-0.1 -0.955 62.5-144.4-113.0 118.4 118.3 62.7 93.8 96 95 A N S S+ 0 0 118 -2,-0.6 2,-0.2 -38,-0.2 -1,-0.1 0.513 83.8 59.1 -59.6 -5.9 120.3 62.4 97.1 97 96 A T S S- 0 0 20 -84,-0.0 2,-0.5 -39,-0.0 -2,-0.2 -0.706 87.1-113.8-117.9 171.4 117.4 60.6 98.7 98 97 A R + 0 0 212 -2,-0.2 2,-0.3 2,-0.0 -2,-0.1 -0.931 35.9 176.8-109.2 127.1 115.5 57.4 97.8 99 98 A V - 0 0 28 -2,-0.5 2,-1.1 -4,-0.1 3,-0.1 -0.895 38.1-109.2-127.6 158.1 111.9 57.7 96.7 100 99 A S > - 0 0 39 -89,-0.4 4,-2.3 -2,-0.3 3,-0.2 -0.758 29.5-175.8 -88.5 98.2 109.3 55.2 95.5 101 100 A V H > S+ 0 0 37 -2,-1.1 4,-2.1 1,-0.2 5,-0.2 0.862 84.0 60.8 -63.0 -31.6 109.0 56.0 91.8 102 101 A R H > S+ 0 0 60 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.930 108.8 42.2 -60.6 -42.6 106.3 53.4 91.7 103 102 A D H > S+ 0 0 28 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.891 109.2 55.7 -73.2 -40.9 104.2 55.4 94.2 104 103 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.968 111.1 46.1 -54.2 -52.5 104.8 58.8 92.8 105 104 A T H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.924 110.3 52.0 -56.1 -52.4 103.5 57.7 89.4 106 105 A K H X S+ 0 0 15 -4,-1.9 4,-2.4 1,-0.2 3,-0.3 0.938 112.3 46.9 -50.7 -51.8 100.4 55.9 90.9 107 106 A I H X S+ 0 0 10 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.859 108.0 54.1 -60.9 -38.3 99.5 59.1 92.8 108 107 A I H X S+ 0 0 1 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.831 110.5 49.0 -66.6 -28.0 100.0 61.4 89.8 109 108 A L H X S+ 0 0 1 -4,-1.9 4,-3.0 -3,-0.3 -2,-0.2 0.913 106.6 54.0 -75.9 -41.2 97.6 59.1 88.0 110 109 A E H X S+ 0 0 37 -4,-2.4 4,-0.9 2,-0.2 -2,-0.2 0.831 112.0 48.0 -58.5 -32.8 95.1 59.2 90.9 111 110 A F H >< S+ 0 0 0 -4,-1.7 3,-1.3 2,-0.2 4,-0.4 0.975 112.1 44.4 -71.8 -59.6 95.3 63.0 90.5 112 111 A I H >< S+ 0 0 1 -4,-2.5 3,-1.2 1,-0.3 -2,-0.2 0.869 112.0 57.8 -53.2 -34.9 94.9 63.1 86.7 113 112 A L H 3< S+ 0 0 10 -4,-3.0 -1,-0.3 1,-0.2 -2,-0.2 0.807 101.7 54.2 -66.0 -29.9 92.1 60.6 87.3 114 113 A S T << S+ 0 0 32 -3,-1.3 179,-1.9 -4,-0.9 2,-0.7 0.412 79.3 116.1 -87.0 3.7 90.2 63.0 89.6 115 114 A I B < S-l 293 0C 0 -3,-1.2 179,-0.2 -4,-0.4 5,-0.1 -0.633 73.0-119.9 -81.0 115.3 90.1 65.9 87.1 116 115 A D > - 0 0 18 177,-1.9 3,-2.6 -2,-0.7 4,-0.5 -0.293 20.3-132.0 -51.0 121.8 86.5 66.8 86.1 117 116 A P T >> S+ 0 0 0 0, 0.0 4,-1.4 0, 0.0 3,-0.7 0.730 103.7 64.7 -50.9 -29.0 86.4 66.2 82.3 118 117 A N H 3> S+ 0 0 14 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.715 83.6 76.5 -71.6 -17.8 84.7 69.6 81.8 119 118 A Y H <> S+ 0 0 16 -3,-2.6 4,-0.6 1,-0.2 -1,-0.2 0.923 102.5 38.8 -55.8 -44.4 87.9 71.2 83.0 120 119 A Y H X> S+ 0 0 3 -3,-0.7 4,-0.7 -4,-0.5 3,-0.6 0.913 114.2 55.1 -73.5 -41.6 89.4 70.4 79.6 121 120 A L H >< S+ 0 0 1 -4,-1.4 3,-1.0 1,-0.2 7,-0.5 0.896 101.1 56.7 -59.0 -44.4 86.2 71.2 77.7 122 121 A Q H 3< S+ 0 0 136 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.766 103.2 55.2 -59.8 -28.9 85.8 74.8 79.1 123 122 A K H << S+ 0 0 82 -4,-0.6 -1,-0.2 -3,-0.6 -2,-0.2 0.707 85.1 103.4 -78.0 -22.1 89.2 75.8 77.9 124 123 A V S << S- 0 0 5 -3,-1.0 4,-0.2 -4,-0.7 -96,-0.1 -0.375 75.7-112.8 -65.3 136.3 88.5 74.8 74.3 125 124 A K S S+ 0 0 197 -98,-0.3 -96,-0.2 2,-0.1 2,-0.2 -0.976 98.8 33.7-120.6 126.9 87.8 77.7 71.9 126 125 A P S S- 0 0 102 0, 0.0 -2,-0.0 0, 0.0 -3,-0.0 0.578 116.7 -89.1 -73.8 168.6 85.1 78.1 70.7 127 126 A A - 0 0 97 -2,-0.2 2,-0.4 1,-0.1 -2,-0.1 -0.057 42.6-151.1 -44.6 136.0 83.0 76.8 73.6 128 127 A I - 0 0 28 -7,-0.5 -4,-0.1 -4,-0.2 -1,-0.1 -0.967 25.5 -99.8-118.2 129.2 82.3 73.0 73.5 129 128 A R - 0 0 75 -2,-0.4 2,-0.4 1,-0.1 -1,-0.1 0.146 40.8-121.5 -35.5 159.9 79.2 71.4 75.0 130 129 A S - 0 0 84 -53,-0.1 2,-0.2 -8,-0.0 -1,-0.1 -0.909 20.4-151.2-115.1 141.3 79.7 69.9 78.5 131 180 A T - 0 0 9 -2,-0.4 -13,-0.1 1,-0.0 -52,-0.1 -0.595 29.5 -93.8-104.3 171.4 79.1 66.3 79.4 132 181 A C > - 0 0 54 -54,-0.5 3,-1.3 -2,-0.2 -52,-0.1 -0.779 26.0-155.7 -91.6 117.9 78.1 64.7 82.7 133 182 A P G > S+ 0 0 25 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.786 88.2 66.4 -55.6 -41.8 81.1 63.5 84.8 134 183 A R G 3 S+ 0 0 166 1,-0.3 158,-0.0 156,-0.2 -2,-0.0 0.675 112.9 34.2 -59.7 -19.2 79.2 60.9 86.8 135 184 A E G < S+ 0 0 98 -3,-1.3 2,-0.5 2,-0.1 -55,-0.4 0.040 82.0 122.7-130.2 29.1 78.7 58.9 83.6 136 185 A I < - 0 0 3 -3,-1.4 151,-0.4 -57,-0.1 2,-0.3 -0.811 62.1-126.0 -92.9 130.2 81.8 59.5 81.5 137 186 A L E -h 81 0B 29 -57,-2.0 -55,-2.5 -2,-0.5 2,-0.5 -0.578 28.2-154.8 -71.8 130.3 83.5 56.2 80.6 138 187 A T E -hI 82 285B 0 147,-2.5 147,-2.2 -2,-0.3 2,-0.3 -0.933 13.3-176.6-117.8 132.5 87.2 56.5 81.6 139 188 A K E -hI 83 284B 32 -57,-3.0 -55,-4.0 -2,-0.5 2,-0.4 -0.931 13.2-161.9-124.7 149.8 90.0 54.5 80.1 140 189 A I E -hI 84 283B 2 143,-2.1 143,-2.4 -2,-0.3 2,-0.4 -0.987 13.3-177.7-126.3 135.5 93.7 54.1 80.8 141 190 A C E +hI 85 282B 0 -57,-2.1 -55,-1.9 -2,-0.4 2,-0.3 -0.997 7.0 163.8-135.4 143.3 96.1 52.8 78.1 142 191 A L E -hI 86 281B 2 139,-1.8 139,-1.8 -2,-0.4 2,-0.5 -0.990 25.2-149.4-158.5 149.0 99.8 52.1 78.4 143 192 A F E - I 0 280B 27 -57,-0.5 2,-0.8 -2,-0.3 137,-0.2 -0.925 16.3-150.5-126.2 104.9 102.5 50.2 76.5 144 193 A T E + I 0 279B 2 135,-1.7 135,-1.7 -2,-0.5 26,-0.1 -0.654 32.5 150.2 -84.0 107.4 105.4 48.9 78.6 145 194 A R - 0 0 40 -2,-0.8 133,-0.1 133,-0.2 -2,-0.1 -0.957 40.6-133.7-133.1 108.7 108.6 48.6 76.6 146 195 A P + 0 0 19 0, 0.0 2,-0.3 0, 0.0 20,-0.1 -0.309 33.8 169.5 -64.6 149.4 111.7 49.1 78.7 147 196 A A - 0 0 38 1,-0.2 3,-0.1 17,-0.1 17,-0.1 -0.964 46.2-107.1-155.3 170.4 114.4 51.4 77.5 148 197 A S S S- 0 0 69 -2,-0.3 2,-0.3 1,-0.3 -1,-0.2 0.990 97.1 -15.7 -64.1 -63.6 117.6 53.3 78.2 149 198 A Q + 0 0 74 1,-0.1 -1,-0.3 -3,-0.1 -59,-0.1 -0.962 50.5 171.4-142.0 157.8 116.1 56.8 78.3 150 199 A Y S S+ 0 0 94 -2,-0.3 -60,-0.1 -59,-0.2 -1,-0.1 0.545 89.4 10.8-136.1 -37.1 112.8 58.4 77.3 151 200 A L S S+ 0 0 4 1,-0.2 -61,-0.1 -60,-0.2 -85,-0.1 0.549 122.3 61.3-119.7 -21.2 112.8 61.9 78.7 152 201 A F S > S- 0 0 0 -61,-0.2 3,-1.8 -87,-0.1 4,-0.3 -0.837 80.7-140.9-113.4 96.7 116.4 62.3 79.9 153 202 A P T 3 S- 0 0 41 0, 0.0 168,-2.1 0, 0.0 169,-0.1 -0.267 81.7 -2.5 -56.7 132.3 118.9 62.0 77.0 154 203 A D T > S+ 0 0 62 166,-0.1 3,-1.6 1,-0.1 4,-0.4 0.551 87.2 125.9 65.1 8.1 122.0 60.0 77.9 155 204 A S T < + 0 0 0 -3,-1.8 -1,-0.1 1,-0.3 -6,-0.0 0.628 53.2 88.8 -71.0 -7.2 121.0 59.6 81.6 156 205 A S T 3 S+ 0 0 42 -4,-0.3 -1,-0.3 1,-0.1 5,-0.2 0.814 83.3 57.6 -55.2 -32.5 121.6 55.9 80.7 157 206 A K < + 0 0 126 -3,-1.6 4,-0.2 3,-0.1 -2,-0.2 0.982 68.5 104.0 -60.0 -86.3 125.2 56.6 81.8 158 207 A N S S- 0 0 27 -4,-0.4 165,-0.1 163,-0.4 3,-0.1 0.468 76.1-133.7 -2.9 81.5 124.8 57.9 85.4 159 208 A S S S+ 0 0 128 1,-0.2 2,-1.4 3,-0.0 -1,-0.1 0.669 95.0 53.4 -15.8 -61.4 126.0 54.6 87.1 160 209 A K S S+ 0 0 135 -67,-0.2 2,-0.4 -68,-0.1 -1,-0.2 -0.483 70.9 118.3 -91.3 72.2 123.1 54.6 89.7 161 210 A K - 0 0 15 -2,-1.4 -1,-0.1 -4,-0.2 -70,-0.1 -0.832 59.5-137.4-131.6 92.4 120.0 54.8 87.6 162 211 A H - 0 0 127 -2,-0.4 2,-0.5 1,-0.1 -71,-0.1 -0.211 21.1-171.4 -52.7 131.7 117.8 51.7 88.1 163 212 A I - 0 0 72 -17,-0.0 2,-0.1 -7,-0.0 -15,-0.1 -0.993 12.9-143.8-128.6 120.4 116.4 50.5 84.7 164 213 A L - 0 0 36 -2,-0.5 2,-0.3 -17,-0.1 -17,-0.1 -0.384 16.6-123.4 -78.8 164.9 113.8 47.7 84.9 165 214 A N > - 0 0 72 -19,-0.1 4,-4.1 -2,-0.1 5,-0.4 -0.708 38.0 -86.4-104.4 161.9 113.8 45.0 82.2 166 215 A G H > S+ 0 0 0 -2,-0.3 4,-1.3 1,-0.2 5,-0.1 0.800 129.1 33.9 -29.0 -61.1 110.8 44.2 80.1 167 216 A E H > S+ 0 0 98 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.914 119.6 49.8 -67.4 -46.9 109.3 41.7 82.6 168 217 A E H >> S+ 0 0 96 1,-0.2 4,-1.4 2,-0.2 3,-0.8 0.957 114.3 47.5 -55.8 -49.7 110.4 43.6 85.7 169 218 A L H 3X S+ 0 0 24 -4,-4.1 4,-1.7 1,-0.2 -1,-0.2 0.755 108.2 55.5 -62.6 -29.2 108.9 46.7 84.1 170 219 A M H 3X S+ 0 0 5 -4,-1.3 4,-1.2 -5,-0.4 -1,-0.2 0.724 107.8 47.6 -78.2 -23.5 105.7 44.9 83.3 171 220 A K H S+ 0 0 0 -4,-2.0 4,-0.9 2,-0.2 5,-0.6 0.924 110.0 50.9 -68.3 -46.3 94.4 52.2 90.8 181 230 A L H >X5S+ 0 0 2 -4,-2.6 4,-1.4 3,-0.2 3,-0.6 0.919 111.1 49.2 -56.1 -48.3 91.7 49.6 89.9 182 231 A I H 3<5S+ 0 0 63 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.917 122.9 28.8 -58.9 -51.0 91.3 48.6 93.6 183 232 A E H 3<5S+ 0 0 82 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.196 130.8 30.1-101.7 16.5 90.9 52.2 95.0 184 233 A C H <<5S+ 0 0 18 -4,-0.9 104,-3.4 -3,-0.6 105,-0.3 0.566 103.0 63.1-142.9 -24.6 89.4 54.1 92.1 185 234 A F B < - 0 0 67 100,-1.3 3,-2.2 -2,-0.2 100,-0.1 -0.584 40.7 -99.1 -90.2 154.8 84.0 50.0 90.2 187 236 A N T 3 S+ 0 0 151 1,-0.3 -1,-0.1 -2,-0.2 -5,-0.0 0.535 120.7 50.7 -45.6 -14.6 83.7 46.3 90.8 188 237 A D T 3 S+ 0 0 115 98,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.066 77.6 137.4-115.6 24.5 82.9 45.6 87.2 189 238 A T < - 0 0 2 -3,-2.2 2,-0.4 -8,-0.1 96,-0.2 -0.510 56.8-117.9 -76.1 138.0 85.8 47.6 85.5 190 239 A Q E -J 284 0B 73 94,-2.3 94,-2.3 -2,-0.2 2,-0.5 -0.608 31.4-176.0 -78.4 126.2 87.6 45.9 82.6 191 240 A A E -Jk 283 215B 1 23,-0.6 25,-1.7 -2,-0.4 2,-0.4 -0.970 8.4-174.4-126.4 113.0 91.3 45.3 83.3 192 241 A K E +Jk 282 216B 25 90,-3.9 90,-2.6 -2,-0.5 2,-0.4 -0.880 14.9 179.3-117.9 143.7 93.3 43.9 80.4 193 242 A L E +Jk 281 217B 3 23,-1.5 25,-2.1 -2,-0.4 2,-0.3 -0.995 6.0 173.5-135.6 138.6 96.9 42.7 80.0 194 243 A R E -J 280 0B 30 86,-1.1 86,-2.8 -2,-0.4 -2,-0.0 -0.941 12.4-167.6-149.8 119.9 98.3 41.4 76.7 195 244 A I > - 0 0 31 -2,-0.3 2,-3.8 84,-0.2 3,-1.8 -0.857 10.8-156.7-113.2 96.2 102.0 40.4 76.2 196 245 A P T 3 S+ 0 0 3 0, 0.0 83,-0.1 0, 0.0 3,-0.0 -0.114 83.1 86.0 -67.1 48.1 102.6 39.9 72.4 197 246 A G T 3 S- 0 0 52 -2,-3.8 82,-0.1 1,-0.1 80,-0.0 0.193 97.6-133.9-120.5 -2.8 105.6 37.8 73.4 198 247 A E < + 0 0 81 -3,-1.8 -1,-0.1 1,-0.1 -4,-0.0 0.111 67.7 128.5 70.8 177.1 103.0 35.0 73.6 199 248 A D >> - 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