==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 31-OCT-08 3F4A . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN YGR203W; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR A.U.SINGER,X.XU,H.CUI,J.OSIPIUK,A.JOACHIMIAK,A.M.EDWARDS, . 288 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14973.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 212 73.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 13.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 2.1 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 . 17 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 32.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 1 1 2 0 0 2 2 1 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 2 4 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 . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 5 A S 0 0 79 0, 0.0 2,-0.2 0, 0.0 270,-0.1 0.000 360.0 360.0 360.0 167.9 33.4 55.5 -14.2 2 6 A I - 0 0 98 287,-0.2 2,-0.2 285,-0.1 231,-0.0 -0.648 360.0 -78.4-117.0-176.4 29.9 56.4 -13.2 3 7 A T - 0 0 9 -2,-0.2 285,-0.2 1,-0.1 284,-0.1 -0.552 20.9-152.9 -93.7 152.0 28.9 57.3 -9.7 4 8 A N S S+ 0 0 27 283,-1.8 110,-0.6 -2,-0.2 2,-0.4 0.321 83.2 50.6-108.9 10.4 28.2 54.9 -6.7 5 9 A V E +a 114 0A 0 282,-0.2 2,-0.3 180,-0.2 110,-0.2 -0.976 67.6 171.3-139.4 135.1 25.8 57.1 -4.8 6 10 A K E -a 115 0A 74 108,-1.7 110,-2.1 -2,-0.4 2,-0.3 -0.881 33.7 -97.1-131.9 166.0 22.7 58.8 -6.4 7 11 A Y E -a 116 0A 52 175,-2.9 2,-0.4 -2,-0.3 110,-0.2 -0.686 28.2-161.5 -84.6 142.9 19.7 60.7 -5.4 8 12 A L E -a 117 0A 0 108,-2.8 110,-3.0 -2,-0.3 107,-0.0 -0.964 16.5-131.2-120.0 131.9 16.3 59.1 -5.0 9 13 A D >> - 0 0 25 -2,-0.4 4,-2.0 108,-0.2 3,-1.3 -0.615 19.3-121.6 -80.5 142.6 13.1 61.1 -5.0 10 14 A P H 3> S+ 0 0 2 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.870 113.4 61.2 -46.9 -36.1 10.4 60.6 -2.2 11 15 A T H 3> S+ 0 0 79 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.864 106.2 45.5 -63.4 -31.2 7.9 59.7 -4.9 12 16 A E H <> S+ 0 0 55 -3,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.939 111.9 48.8 -77.7 -46.9 10.1 56.8 -6.0 13 17 A L H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.927 111.2 53.2 -55.4 -45.5 10.7 55.5 -2.5 14 18 A H H X S+ 0 0 31 -4,-2.9 4,-2.4 -5,-0.2 -1,-0.2 0.901 107.9 48.7 -56.1 -46.3 6.9 55.8 -1.9 15 19 A R H X S+ 0 0 92 -4,-1.7 4,-2.6 2,-0.2 6,-0.2 0.906 110.9 51.3 -57.5 -44.1 6.2 53.7 -5.0 16 20 A W H X>S+ 0 0 15 -4,-2.4 4,-2.2 1,-0.2 5,-0.6 0.914 111.3 47.9 -63.3 -42.1 8.7 51.1 -3.9 17 21 A X H <5S+ 0 0 31 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.893 112.0 49.1 -64.7 -36.8 7.0 51.0 -0.5 18 22 A Q H <5S+ 0 0 117 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.900 119.1 38.5 -69.4 -37.6 3.6 50.7 -2.0 19 23 A E H <5S- 0 0 89 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.670 106.4-122.6 -89.3 -21.0 4.7 47.9 -4.3 20 24 A G T <5S+ 0 0 53 -4,-2.2 2,-0.3 -5,-0.2 9,-0.2 0.316 84.6 30.0 97.4 -2.5 7.0 46.1 -1.8 21 25 A H S - 0 0 8 5,-2.5 4,-0.6 -2,-0.3 -9,-0.0 -0.290 54.4-123.4 -62.0 155.9 11.7 48.5 -6.6 23 27 A T T 4 S+ 0 0 41 2,-0.1 -1,-0.1 1,-0.1 -11,-0.0 0.961 96.7 33.3 -75.9 -49.2 9.4 48.6 -9.6 24 28 A T T 4 S+ 0 0 132 1,-0.2 -1,-0.1 2,-0.0 -2,-0.0 0.916 132.9 23.5 -74.5 -50.3 11.5 47.5 -12.5 25 29 A L T 4 S- 0 0 109 2,-0.1 -1,-0.2 52,-0.0 -2,-0.1 0.483 94.1-130.2-103.2 -5.3 13.9 44.9 -11.0 26 30 A R < + 0 0 162 -4,-0.6 51,-0.2 1,-0.2 -3,-0.1 0.830 49.9 165.5 62.6 36.3 11.7 44.0 -8.0 27 31 A E - 0 0 12 1,-0.1 -5,-2.5 49,-0.1 -1,-0.2 -0.471 38.1-107.8 -85.5 151.5 14.7 44.6 -5.8 28 32 A P - 0 0 26 0, 0.0 53,-2.4 0, 0.0 2,-0.3 -0.315 34.6-164.8 -70.5 159.5 14.7 44.9 -2.0 29 33 A F E -b 81 0A 34 51,-0.2 2,-0.3 -9,-0.2 53,-0.2 -0.966 11.2-161.4-143.2 161.1 15.4 48.3 -0.3 30 34 A Q E -b 82 0A 8 51,-2.7 53,-2.7 -2,-0.3 2,-0.3 -0.917 12.4-144.5-148.8 120.3 16.2 49.5 3.2 31 35 A V E -b 83 0A 4 -2,-0.3 17,-2.5 51,-0.2 2,-0.5 -0.632 11.8-165.4 -82.6 137.3 15.8 53.1 4.5 32 36 A V E -bc 84 48A 0 51,-3.1 53,-2.0 -2,-0.3 2,-0.6 -0.963 4.2-159.5-125.9 112.4 18.5 54.4 7.0 33 37 A D E -bc 85 49A 4 15,-3.0 17,-1.9 -2,-0.5 53,-0.2 -0.825 7.9-175.5 -95.0 121.2 17.6 57.5 8.9 34 38 A V + 0 0 0 51,-2.7 18,-2.9 -2,-0.6 19,-0.4 0.209 35.9 129.9-109.8 15.5 20.8 59.2 10.2 35 39 A R + 0 0 0 50,-0.3 -2,-0.1 16,-0.2 16,-0.0 -0.375 28.9 177.3 -63.0 142.7 19.1 62.0 12.2 36 40 A G S > S+ 0 0 30 15,-0.1 3,-1.5 14,-0.1 4,-0.2 0.558 73.5 13.2-105.9 -88.1 20.2 62.5 15.8 37 41 A S T 3 S+ 0 0 124 1,-0.3 3,-0.3 2,-0.1 -2,-0.1 0.685 131.1 48.7 -69.0 -18.4 18.7 65.4 17.7 38 42 A D T 3 S+ 0 0 44 1,-0.2 -1,-0.3 3,-0.0 -3,-0.1 0.065 77.2 103.4-114.5 27.6 16.0 66.1 15.2 39 43 A Y X + 0 0 53 -3,-1.5 3,-0.6 -5,-0.1 -1,-0.2 0.834 56.8 97.3 -73.6 -32.3 14.7 62.5 14.8 40 44 A X T 3 + 0 0 134 -3,-0.3 98,-0.1 -4,-0.2 97,-0.0 -0.199 63.5 53.1 -64.6 148.3 11.6 63.0 16.9 41 45 A G T 3 S- 0 0 5 96,-0.3 98,-2.2 97,-0.0 -1,-0.2 0.403 116.3 -30.1 113.1 1.1 8.2 63.8 15.1 42 46 A G < - 0 0 2 -3,-0.6 2,-0.3 96,-0.3 95,-0.2 -0.454 53.1-159.1 130.3 146.1 8.0 61.0 12.7 43 47 A H E -E 136 0B 50 93,-2.3 93,-2.5 -2,-0.2 2,-0.3 -0.956 40.1 -79.4-148.9 167.7 10.1 58.6 10.6 44 48 A I E > -E 135 0B 2 -2,-0.3 3,-1.8 91,-0.2 91,-0.3 -0.555 57.3-103.4 -74.0 133.5 9.7 56.5 7.5 45 49 A K T 3 S+ 0 0 77 89,-2.5 -14,-0.1 -2,-0.3 -1,-0.1 -0.307 101.7 8.7 -60.2 135.1 8.0 53.2 8.3 46 50 A D T 3 S+ 0 0 128 1,-0.3 -1,-0.2 -16,-0.1 -15,-0.1 0.378 96.5 132.0 76.7 -0.3 10.3 50.1 8.4 47 51 A G < - 0 0 23 -3,-1.8 2,-0.4 -17,-0.1 -1,-0.3 -0.276 55.6-122.3 -72.7 165.8 13.5 52.3 8.2 48 52 A W E -c 32 0A 39 -17,-2.5 -15,-3.0 -3,-0.1 2,-0.7 -0.899 15.5-136.1-109.6 146.9 16.4 51.8 10.6 49 53 A H E +c 33 0A 66 -2,-0.4 2,-0.4 -17,-0.2 -15,-0.2 -0.871 34.5 156.1-109.9 109.9 17.7 54.6 12.8 50 54 A Y - 0 0 5 -17,-1.9 -14,-0.1 -2,-0.7 -2,-0.1 -0.857 37.4-138.2-129.1 97.3 21.5 55.0 12.9 51 55 A A >> - 0 0 15 -2,-0.4 4,-2.6 1,-0.1 3,-0.8 -0.278 7.6-137.6 -59.6 131.8 22.4 58.6 13.9 52 56 A Y H 3> S+ 0 0 50 -18,-2.9 4,-2.7 1,-0.2 5,-0.3 0.883 101.4 63.5 -58.6 -38.6 25.3 59.8 11.8 53 57 A S H 3> S+ 0 0 62 -19,-0.4 4,-0.6 1,-0.2 -1,-0.2 0.867 111.3 38.3 -57.6 -33.3 26.9 61.5 14.8 54 58 A R H X> S+ 0 0 124 -3,-0.8 4,-2.3 2,-0.2 3,-0.6 0.890 112.0 55.6 -83.1 -43.2 27.3 58.0 16.4 55 59 A L H 3< S+ 0 0 3 -4,-2.6 7,-0.4 1,-0.2 -2,-0.2 0.902 110.7 47.3 -54.8 -38.7 28.2 56.2 13.1 56 60 A K H 3< S+ 0 0 108 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.718 121.2 35.8 -74.9 -25.7 31.1 58.6 12.6 57 61 A Q H << S+ 0 0 151 -3,-0.6 -2,-0.2 -4,-0.6 -1,-0.2 0.605 113.9 57.3 -98.7 -20.5 32.4 58.3 16.3 58 62 A D >X - 0 0 45 -4,-2.3 4,-1.7 1,-0.1 3,-1.6 -0.819 57.8-172.0-126.2 90.0 31.7 54.6 16.9 59 63 A P H 3> S+ 0 0 96 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.779 88.6 56.3 -56.1 -30.8 33.3 52.1 14.4 60 64 A E H 3> S+ 0 0 130 2,-0.2 4,-1.6 1,-0.2 -5,-0.1 0.739 104.5 53.8 -70.4 -27.3 31.4 49.2 15.9 61 65 A Y H <> S+ 0 0 33 -3,-1.6 4,-2.2 -7,-0.2 -1,-0.2 0.899 109.6 46.3 -72.6 -44.8 28.1 51.0 15.2 62 66 A L H X S+ 0 0 24 -4,-1.7 4,-2.7 -7,-0.4 -2,-0.2 0.911 111.5 52.8 -60.9 -41.4 29.1 51.5 11.5 63 67 A R H X S+ 0 0 116 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.889 108.3 51.5 -60.1 -39.7 30.2 47.8 11.3 64 68 A E H X S+ 0 0 86 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.932 109.8 48.0 -64.2 -44.6 26.8 46.8 12.7 65 69 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.933 113.7 47.8 -58.9 -47.9 24.9 48.8 10.1 66 70 A K H X S+ 0 0 30 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.927 112.9 48.7 -62.5 -44.6 27.1 47.4 7.3 67 71 A H H X S+ 0 0 69 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.913 111.2 49.8 -56.3 -47.0 26.6 43.8 8.6 68 72 A R H X S+ 0 0 94 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.891 111.9 47.7 -62.9 -42.6 22.9 44.3 8.9 69 73 A L H X S+ 0 0 2 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.943 113.0 47.7 -64.6 -46.7 22.6 45.6 5.4 70 74 A L H X S+ 0 0 17 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.867 111.2 51.9 -62.6 -38.2 24.8 42.8 3.9 71 75 A E H X S+ 0 0 114 -4,-2.6 4,-0.7 -5,-0.2 -1,-0.2 0.861 109.8 48.2 -63.4 -40.6 22.7 40.2 5.7 72 76 A K H >< S+ 0 0 66 -4,-1.7 3,-1.1 1,-0.2 4,-0.4 0.928 110.4 52.8 -66.5 -44.9 19.5 41.6 4.4 73 77 A Q H >< S+ 0 0 25 -4,-2.6 3,-1.5 1,-0.2 -2,-0.2 0.875 102.2 58.2 -56.6 -39.7 20.9 41.6 0.9 74 78 A A H 3< S+ 0 0 72 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.765 105.9 51.7 -63.8 -23.1 21.9 38.0 1.2 75 79 A D T << S+ 0 0 138 -3,-1.1 -1,-0.3 -4,-0.7 2,-0.2 0.453 107.7 59.7 -87.2 -10.1 18.2 37.1 1.8 76 80 A G S < S- 0 0 30 -3,-1.5 2,-0.4 -4,-0.4 4,-0.1 -0.655 87.0 -91.6-122.3 174.9 16.8 38.9 -1.2 77 81 A R S S- 0 0 208 -51,-0.2 -2,-0.1 -2,-0.2 -3,-0.0 -0.693 82.6 -18.8 -93.4 136.6 17.0 39.0 -5.0 78 82 A G S S- 0 0 44 -2,-0.4 2,-0.2 -51,-0.1 -2,-0.2 -0.228 109.2 -17.0 72.6-156.1 19.4 41.3 -6.7 79 83 A A - 0 0 8 33,-0.1 2,-0.5 1,-0.1 33,-0.3 -0.535 65.8-117.8 -87.0 147.2 21.1 44.2 -5.2 80 84 A L E - d 0 112A 0 31,-2.6 33,-2.1 -2,-0.2 2,-0.9 -0.782 21.1-139.1 -85.8 125.2 19.9 45.9 -2.0 81 85 A N E -bd 29 113A 3 -53,-2.4 -51,-2.7 -2,-0.5 2,-0.5 -0.756 19.0-163.1 -89.3 103.4 18.8 49.5 -2.5 82 86 A V E -bd 30 114A 0 31,-2.4 33,-3.1 -2,-0.9 2,-0.7 -0.820 2.0-164.1 -92.0 122.1 20.1 51.4 0.6 83 87 A I E -bd 31 115A 0 -53,-2.7 -51,-3.1 -2,-0.5 2,-0.3 -0.896 4.1-169.1-117.8 105.3 18.5 54.7 1.1 84 88 A F E +bd 32 116A 0 31,-3.0 33,-2.5 -2,-0.7 2,-0.3 -0.691 15.8 156.1 -87.8 142.6 20.1 57.2 3.4 85 89 A H E -b 33 0A 0 -53,-2.0 -51,-2.7 -2,-0.3 -50,-0.3 -0.990 18.2-179.9-155.9 161.5 18.5 60.4 4.6 86 90 A C - 0 0 2 -2,-0.3 35,-2.6 31,-0.3 36,-0.2 -0.250 63.0 -58.7-130.2-137.4 18.5 62.9 7.4 87 91 A X S S+ 0 0 34 33,-0.2 35,-2.6 34,-0.2 36,-0.4 0.952 132.2 1.7 -77.8 -48.6 16.4 66.1 7.8 88 92 A L S S- 0 0 82 32,-0.2 31,-0.6 33,-0.1 32,-0.2 0.498 88.5-130.6-109.5 -12.6 17.3 67.8 4.6 89 93 A S S S+ 0 0 7 30,-0.2 30,-0.2 29,-0.1 31,-0.1 0.837 80.1 108.1 51.2 40.3 19.7 65.2 3.0 90 94 A Q S S- 0 0 125 29,-0.1 -1,-0.1 28,-0.1 28,-0.0 0.754 91.0 -0.3-106.6 -40.0 22.2 68.0 2.4 91 95 A Q S > S+ 0 0 136 3,-0.1 4,-2.5 4,-0.0 5,-0.2 0.745 132.4 33.7-116.9 -67.6 24.9 67.2 5.0 92 96 A R H > S+ 0 0 68 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.911 115.8 53.2 -67.0 -46.2 24.3 64.2 7.3 93 97 A G H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.951 115.0 39.8 -53.6 -58.6 22.5 61.9 4.8 94 98 A P H > S+ 0 0 13 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.916 115.3 53.1 -59.2 -39.8 25.2 62.2 2.1 95 99 A S H X S+ 0 0 34 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.896 109.4 48.9 -60.7 -41.2 28.0 62.0 4.7 96 100 A A H X S+ 0 0 1 -4,-2.9 4,-2.5 2,-0.2 5,-0.2 0.896 109.5 52.2 -65.9 -39.4 26.6 58.8 6.2 97 101 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.2 -2,-0.2 0.923 112.4 45.5 -61.6 -42.7 26.3 57.3 2.6 98 102 A X H X S+ 0 0 24 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.879 109.0 56.2 -71.6 -30.3 29.9 58.1 2.0 99 103 A L H X S+ 0 0 29 -4,-2.2 4,-0.9 -5,-0.2 -2,-0.2 0.943 112.5 42.1 -66.4 -43.2 30.9 56.7 5.4 100 104 A L H >< S+ 0 0 2 -4,-2.5 3,-1.1 1,-0.2 4,-0.4 0.955 111.7 56.2 -64.6 -46.2 29.3 53.4 4.6 101 105 A L H >< S+ 0 0 0 -4,-2.7 3,-1.7 1,-0.3 -2,-0.2 0.885 102.4 54.4 -51.0 -46.3 30.7 53.4 1.0 102 106 A R H 3< S+ 0 0 127 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.809 107.0 53.1 -63.2 -26.4 34.2 53.8 2.2 103 107 A S T << S+ 0 0 29 -3,-1.1 2,-0.5 -4,-0.9 -1,-0.3 0.359 90.5 95.0 -86.4 -1.3 33.7 50.6 4.4 104 108 A L < - 0 0 4 -3,-1.7 -4,-0.0 -4,-0.4 -38,-0.0 -0.852 65.6-142.2-100.8 127.4 32.5 48.4 1.5 105 109 A D > - 0 0 110 -2,-0.5 4,-2.5 1,-0.1 5,-0.2 -0.064 36.8 -95.0 -67.3 176.8 34.8 46.1 -0.4 106 110 A T H > S+ 0 0 116 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.949 126.3 47.7 -64.2 -49.2 34.3 45.7 -4.2 107 111 A A H 4 S+ 0 0 69 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.875 114.5 48.1 -57.9 -40.8 32.2 42.6 -3.9 108 112 A E H >4 S+ 0 0 38 1,-0.2 3,-1.2 2,-0.2 4,-0.3 0.897 109.2 50.6 -71.2 -42.4 30.1 44.2 -1.2 109 113 A L H >< S+ 0 0 27 -4,-2.5 3,-1.9 1,-0.3 -1,-0.2 0.899 104.6 58.1 -65.4 -36.9 29.5 47.5 -3.1 110 114 A S T 3< S+ 0 0 92 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.671 101.2 58.4 -65.2 -12.7 28.4 45.5 -6.2 111 115 A R T < S+ 0 0 75 -3,-1.2 -31,-2.6 -4,-0.4 2,-0.3 0.493 107.8 55.5 -90.2 -7.5 25.7 43.9 -4.0 112 116 A C E < - d 0 80A 13 -3,-1.9 2,-0.4 -4,-0.3 -31,-0.2 -0.794 61.1-152.9-124.1 161.2 24.2 47.3 -3.1 113 117 A R E - d 0 81A 108 -33,-2.1 -31,-2.4 -2,-0.3 2,-0.5 -0.978 28.2-148.3-126.3 121.6 22.8 50.4 -4.8 114 118 A L E +ad 5 82A 6 -110,-0.6 -108,-1.7 -2,-0.4 2,-0.3 -0.805 20.8 177.0-102.5 130.6 23.4 53.4 -2.5 115 119 A W E -ad 6 83A 24 -33,-3.1 -31,-3.0 -2,-0.5 2,-0.4 -0.918 25.9-148.7-128.0 153.5 20.9 56.3 -2.5 116 120 A V E -ad 7 84A 0 -110,-2.1 -108,-2.8 -2,-0.3 2,-0.7 -0.995 31.3-122.7-113.6 130.0 20.3 59.6 -0.7 117 121 A L E > -a 8 0A 0 -33,-2.5 3,-2.0 -2,-0.4 -31,-0.3 -0.607 31.3-122.6 -74.6 114.0 16.6 60.6 -0.4 118 122 A R T 3 S+ 0 0 69 -110,-3.0 -29,-0.1 -2,-0.7 -1,-0.1 -0.311 92.2 10.9 -63.8 126.9 16.3 64.0 -2.0 119 123 A G T 3> S- 0 0 24 -31,-0.6 4,-1.3 -30,-0.2 3,-0.4 0.281 102.5-128.4 90.2 -11.9 14.9 66.6 0.4 120 124 A G H <> - 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