==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 19-JAN-10 3LG2 . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN YKR043C; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR A.SINGER,X.XU,H.CUI,A.DONG,A.M.EDWARDS,A.JOACHIMIAK,A.F.YAKU . 1076 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43807.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 701 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 86 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 75 7.0 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 . 4 0.4 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 . 72 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 120 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 285 26.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 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 9 6 0 0 0 0 8 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 0 6 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 PARALLEL BRIDGES PER LADDER . 8 0 1 11 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 . 4 0 0 0 0 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 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 3 A S 0 0 92 0, 0.0 2,-0.1 0, 0.0 164,-0.1 0.000 360.0 360.0 360.0 141.7 -1.1 0.9 -4.4 2 4 A L - 0 0 51 162,-0.1 165,-0.3 1,-0.1 162,-0.0 -0.417 360.0-104.3 -81.3 147.1 2.8 0.8 -4.0 3 5 A T - 0 0 23 -2,-0.1 -1,-0.1 163,-0.1 163,-0.1 -0.489 43.8-115.8 -68.1 131.6 4.7 1.1 -0.7 4 6 A P - 0 0 1 0, 0.0 2,-0.3 0, 0.0 164,-0.2 -0.312 32.3-160.3 -67.4 153.4 6.2 4.5 -0.5 5 7 A R E -a 168 0A 10 162,-1.6 164,-2.7 234,-0.1 2,-0.5 -0.972 20.0-149.7-135.6 147.7 10.0 4.8 -0.4 6 8 A C E -aB 169 238A 0 232,-2.5 232,-2.9 -2,-0.3 2,-0.6 -0.988 23.6-161.5-115.4 117.5 12.6 7.4 0.7 7 9 A I E -aB 170 237A 1 162,-2.8 164,-2.7 -2,-0.5 2,-0.4 -0.884 2.6-158.1-112.8 111.6 15.5 6.9 -1.6 8 10 A I E -aB 171 236A 0 228,-2.3 228,-2.5 -2,-0.6 2,-0.4 -0.783 9.9-176.2-102.1 137.2 18.7 8.4 -0.3 9 11 A V E -aB 172 235A 3 162,-3.0 164,-1.8 -2,-0.4 2,-0.3 -0.993 20.7-136.1-135.5 124.7 21.6 9.3 -2.6 10 12 A R E -a 173 0A 12 224,-2.6 223,-0.8 -2,-0.4 164,-0.2 -0.624 37.6-102.9 -79.0 139.4 25.0 10.6 -1.7 11 13 A H - 0 0 4 162,-2.0 222,-0.9 -2,-0.3 223,-0.2 -0.118 47.3 -88.3 -53.1 155.3 26.3 13.5 -3.9 12 14 A G - 0 0 0 55,-0.5 22,-0.1 220,-0.2 23,-0.1 -0.012 63.4 -59.7 -60.1 170.7 28.9 12.6 -6.6 13 15 A Q - 0 0 2 21,-0.2 18,-2.8 219,-0.1 21,-0.3 -0.237 52.0-169.8 -57.9 134.1 32.6 12.7 -6.0 14 16 A T B > -G 30 0B 0 16,-0.3 4,-2.2 -3,-0.1 5,-0.2 -0.824 37.8-107.0-112.5 164.4 34.3 16.0 -4.9 15 17 A E H > S+ 0 0 149 14,-0.6 4,-0.7 -2,-0.3 6,-0.2 0.921 121.4 43.3 -52.7 -50.6 38.0 16.8 -4.7 16 18 A W H >4>S+ 0 0 64 1,-0.2 5,-2.1 2,-0.2 3,-0.8 0.901 112.1 52.6 -60.6 -45.4 37.9 16.7 -0.8 17 19 A S H >45S+ 0 0 5 1,-0.3 3,-0.9 2,-0.2 518,-0.3 0.870 106.1 54.1 -64.3 -38.2 35.7 13.5 -0.6 18 20 A K H 3<5S+ 0 0 96 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.738 110.6 47.3 -61.7 -26.3 38.1 11.6 -2.9 19 21 A S T <<5S- 0 0 60 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.380 118.5-103.6-106.1 3.0 41.0 12.4 -0.6 20 22 A G T < 5S+ 0 0 7 -3,-0.9 517,-0.5 -4,-0.4 88,-0.4 0.477 70.5 146.0 91.2 5.9 39.4 11.5 2.7 21 23 A Q < - 0 0 46 -5,-2.1 2,-0.6 -6,-0.2 -1,-0.3 -0.525 55.4-111.9 -82.1 144.6 38.8 15.1 3.9 22 24 A Y - 0 0 10 84,-2.5 83,-2.8 81,-0.3 2,-0.7 -0.645 34.4-169.2 -72.0 114.8 35.8 16.1 6.0 23 25 A T + 0 0 9 -2,-0.6 75,-0.1 81,-0.2 81,-0.1 -0.916 24.1 142.2-113.2 106.5 33.6 18.3 3.8 24 26 A G S S- 0 0 0 -2,-0.7 73,-0.2 73,-0.1 75,-0.1 0.526 76.3 -7.2-103.6-107.4 30.9 20.1 5.6 25 27 A L S S+ 0 0 79 73,-0.1 -2,-0.1 71,-0.1 74,-0.1 0.709 98.9 113.6 -68.3 -18.7 29.7 23.6 4.8 26 28 A T - 0 0 46 1,-0.1 2,-1.1 39,-0.1 79,-0.0 -0.315 69.1-137.2 -53.9 127.9 32.6 24.1 2.3 27 29 A D + 0 0 73 38,-0.1 -1,-0.1 39,-0.1 -2,-0.1 -0.269 34.3 171.5 -96.3 57.7 30.8 24.3 -0.9 28 30 A L - 0 0 28 -2,-1.1 39,-0.9 1,-0.1 2,-0.2 -0.179 26.4-128.3 -62.6 148.5 32.9 22.2 -3.3 29 31 A P - 0 0 70 0, 0.0 -14,-0.6 0, 0.0 2,-0.1 -0.576 34.3 -89.5 -83.1 160.9 31.8 21.2 -6.8 30 32 A L B -G 14 0B 8 -2,-0.2 -16,-0.3 -16,-0.2 -17,-0.1 -0.405 42.5-119.9 -55.5 138.7 31.7 17.7 -8.2 31 33 A T > - 0 0 15 -18,-2.8 4,-1.9 1,-0.1 3,-0.2 -0.451 32.3-102.9 -68.0 157.3 35.0 16.6 -9.8 32 34 A P H > S+ 0 0 114 0, 0.0 4,-2.1 0, 0.0 5,-0.3 0.932 127.4 53.5 -47.6 -44.7 34.6 15.7 -13.5 33 35 A Y H > S+ 0 0 65 1,-0.2 4,-2.1 2,-0.2 -20,-0.1 0.894 105.8 54.5 -57.6 -39.1 34.8 12.1 -12.4 34 36 A G H > S+ 0 0 0 -21,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.880 106.2 51.3 -58.7 -41.4 31.9 12.8 -10.0 35 37 A E H >X S+ 0 0 79 -4,-1.9 4,-2.8 1,-0.2 3,-0.5 0.982 111.2 44.8 -63.8 -56.5 29.8 14.2 -12.8 36 38 A G H 3X S+ 0 0 27 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.874 109.9 60.1 -52.0 -37.5 30.2 11.3 -15.0 37 39 A Q H 3X S+ 0 0 5 -4,-2.1 4,-1.2 -5,-0.3 -1,-0.2 0.907 111.0 37.8 -59.9 -43.5 29.6 9.2 -11.9 38 40 A X H < S+ 0 0 14 -4,-1.9 3,-2.4 -5,-0.2 -1,-0.2 0.590 81.7 133.2-101.8 -12.4 15.8 5.2 -14.5 47 49 A R G >X S- 0 0 84 -4,-1.4 3,-1.4 -5,-0.3 4,-0.5 -0.083 89.8 -18.9 -37.4 118.2 16.6 2.5 -16.9 48 50 A N G 34 S- 0 0 117 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.569 102.9 -90.9 51.4 15.7 13.3 0.9 -18.2 49 51 A N G <4 S+ 0 0 83 -3,-2.4 -1,-0.3 3,-0.2 -2,-0.1 0.589 96.7 119.8 67.9 7.5 11.3 2.3 -15.1 50 52 A Q T <4 S+ 0 0 58 -3,-1.4 207,-1.3 2,-0.1 3,-0.2 0.910 81.1 24.9 -79.4 -39.6 11.9 -0.9 -13.1 51 53 A F S < S+ 0 0 34 -4,-0.5 2,-0.4 1,-0.3 -5,-0.1 0.918 138.3 13.9 -83.5 -51.3 13.8 0.5 -10.1 52 54 A L - 0 0 0 -7,-1.0 -1,-0.3 -5,-0.2 -3,-0.2 -0.984 63.3-161.9-132.3 120.6 12.4 4.0 -10.2 53 55 A N > - 0 0 35 -2,-0.4 3,-2.6 -3,-0.2 4,-0.5 -0.912 16.1-145.9-100.1 118.7 9.4 5.2 -12.2 54 56 A P G > S+ 0 0 8 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.775 98.3 68.0 -50.5 -30.0 9.4 9.0 -12.6 55 57 A D G 3 S+ 0 0 116 1,-0.2 111,-0.1 -3,-0.0 -3,-0.0 0.797 101.1 47.2 -54.0 -34.8 5.5 8.7 -12.5 56 58 A N G < S+ 0 0 39 -3,-2.6 112,-2.6 111,-0.1 2,-0.5 0.449 86.4 104.4 -94.5 -6.9 5.8 7.7 -8.9 57 59 A I E < +c 168 0A 5 -3,-1.0 112,-0.2 -4,-0.5 3,-0.1 -0.674 33.2 162.8 -81.3 126.1 8.2 10.4 -7.7 58 60 A T E + 0 0 11 110,-1.9 30,-2.1 -2,-0.5 2,-0.4 0.794 61.0 19.9-103.8 -52.2 6.5 13.1 -5.7 59 61 A Y E -cd 169 88A 4 109,-0.6 111,-2.4 28,-0.2 2,-0.4 -0.926 48.7-167.5-128.7 145.9 9.3 14.9 -3.9 60 62 A I E -cd 170 89A 0 28,-2.6 30,-3.2 -2,-0.4 2,-0.4 -0.981 15.5-165.8-128.0 116.6 13.0 15.4 -4.2 61 63 A F E -cd 171 90A 3 109,-3.8 111,-2.5 -2,-0.4 2,-0.4 -0.812 7.9-174.6-100.5 143.8 14.7 16.9 -1.2 62 64 A T E -cd 172 91A 1 28,-2.3 30,-3.3 -2,-0.4 33,-0.2 -0.999 28.4-117.0-139.0 140.4 18.3 18.2 -1.4 63 65 A S - 0 0 0 109,-2.3 30,-0.2 -2,-0.4 6,-0.1 -0.325 38.5-114.4 -54.0 150.9 20.9 19.6 0.9 64 66 A P S S+ 0 0 20 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.750 80.0 117.2 -67.3 -21.1 21.7 23.2 -0.0 65 67 A R S > S- 0 0 37 1,-0.1 4,-2.3 3,-0.1 3,-0.4 -0.105 72.2-127.2 -49.0 141.6 25.3 22.3 -0.9 66 68 A L H > S+ 0 0 52 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.939 107.8 56.8 -51.5 -52.9 26.4 22.7 -4.6 67 69 A R H > S+ 0 0 1 -39,-0.9 4,-1.7 1,-0.2 -55,-0.5 0.818 109.1 45.5 -50.1 -37.6 27.6 19.1 -4.8 68 70 A A H > S+ 0 0 0 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.939 114.1 48.0 -76.1 -45.0 24.2 17.7 -3.8 69 71 A R H X S+ 0 0 106 -4,-2.3 4,-1.8 1,-0.2 3,-0.3 0.946 109.3 53.3 -61.4 -47.1 22.3 20.1 -6.2 70 72 A Q H X S+ 0 0 48 -4,-3.5 4,-2.1 1,-0.2 -1,-0.2 0.918 107.4 52.8 -50.7 -46.9 24.6 19.2 -9.0 71 73 A T H X S+ 0 0 0 -4,-1.7 4,-2.8 -5,-0.3 5,-0.3 0.876 103.0 57.8 -60.3 -39.0 23.9 15.6 -8.4 72 74 A V H X S+ 0 0 7 -4,-1.9 4,-1.6 -3,-0.3 -1,-0.2 0.951 109.5 44.1 -54.5 -51.9 20.1 16.2 -8.6 73 75 A D H < S+ 0 0 104 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.916 115.4 49.0 -61.1 -40.1 20.4 17.6 -12.1 74 76 A L H >< S+ 0 0 22 -4,-2.1 3,-1.0 1,-0.2 -2,-0.2 0.888 111.3 46.9 -69.7 -40.0 22.7 14.9 -13.2 75 77 A V H 3< S+ 0 0 3 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.782 112.5 51.5 -73.6 -28.3 20.7 12.0 -11.9 76 78 A L T >< S+ 0 0 9 -4,-1.6 3,-1.6 -5,-0.3 -1,-0.3 0.273 74.8 104.3 -95.2 7.4 17.5 13.4 -13.4 77 79 A K T < S+ 0 0 133 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.882 71.8 65.3 -55.0 -42.1 18.9 13.9 -16.9 78 80 A P T 3 S+ 0 0 55 0, 0.0 -1,-0.3 0, 0.0 2,-0.1 0.640 87.3 98.4 -54.3 -15.4 17.0 10.8 -18.2 79 81 A L < - 0 0 10 -3,-1.6 2,-0.2 1,-0.1 -3,-0.0 -0.404 69.7-130.7 -78.5 149.2 13.7 12.7 -17.5 80 82 A S > - 0 0 52 -2,-0.1 4,-2.8 1,-0.1 5,-0.2 -0.549 29.4-110.5 -84.2 163.8 11.4 14.5 -19.9 81 83 A D H > S+ 0 0 126 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.892 122.2 54.0 -60.8 -41.0 10.2 18.0 -19.1 82 84 A E H > S+ 0 0 138 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.943 110.9 46.9 -56.8 -44.0 6.7 16.6 -18.7 83 85 A Q H 4 S+ 0 0 56 1,-0.2 3,-0.2 2,-0.2 -2,-0.2 0.894 112.8 48.7 -64.2 -41.0 8.1 14.1 -16.2 84 86 A R H >< S+ 0 0 84 -4,-2.8 3,-1.0 1,-0.2 -1,-0.2 0.749 102.3 62.1 -73.8 -23.6 10.1 16.8 -14.4 85 87 A A H 3< S+ 0 0 85 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.871 99.3 55.8 -69.9 -33.6 7.1 19.2 -14.1 86 88 A K T 3< S+ 0 0 127 -4,-1.2 2,-0.4 -3,-0.2 -1,-0.2 0.463 99.1 79.9 -76.6 0.3 5.2 16.6 -12.0 87 89 A I < - 0 0 18 -3,-1.0 2,-0.5 -4,-0.1 -28,-0.2 -0.934 67.5-148.9-115.5 132.8 8.1 16.5 -9.5 88 90 A R E -d 59 0A 122 -30,-2.1 -28,-2.6 -2,-0.4 2,-0.5 -0.839 6.9-158.5 -97.9 131.4 8.8 19.0 -6.7 89 91 A V E -d 60 0A 71 -2,-0.5 2,-0.5 -30,-0.2 -28,-0.2 -0.930 10.2-167.6-110.6 128.5 12.4 19.7 -5.7 90 92 A V E -d 61 0A 3 -30,-3.2 -28,-2.3 -2,-0.5 2,-0.4 -0.965 15.6-143.7-124.8 116.2 12.8 21.1 -2.3 91 93 A V E -d 62 0A 67 -2,-0.5 116,-0.5 -30,-0.2 2,-0.5 -0.691 23.6-170.9 -75.9 127.9 16.1 22.6 -0.9 92 94 A D B > -H 206 0C 0 -30,-3.3 3,-2.5 -2,-0.4 114,-0.2 -0.923 23.4-165.1-131.8 106.3 16.3 21.7 2.8 93 95 A D G > S+ 0 0 68 112,-3.2 3,-1.7 -2,-0.5 113,-0.1 0.787 89.8 71.6 -57.2 -28.8 19.0 23.2 5.1 94 96 A D G 3 S+ 0 0 2 1,-0.3 -1,-0.3 51,-0.1 55,-0.2 0.609 91.3 62.4 -62.2 -10.5 18.1 20.5 7.6 95 97 A L G < S+ 0 0 1 -3,-2.5 79,-0.4 -33,-0.2 -32,-0.3 0.328 76.8 122.8-101.4 11.1 19.8 18.1 5.2 96 98 A R < - 0 0 32 -3,-1.7 78,-0.1 1,-0.1 3,-0.1 -0.063 69.5 -88.1 -65.5 168.4 23.4 19.5 5.3 97 99 A E - 0 0 4 -73,-0.2 -1,-0.1 1,-0.2 -73,-0.1 -0.340 59.9 -76.3 -70.4 156.1 26.5 17.6 6.2 98 100 A W - 0 0 0 1,-0.1 2,-0.8 -75,-0.1 -1,-0.2 -0.276 52.6-112.2 -45.7 138.3 27.6 17.4 9.8 99 101 A E - 0 0 55 1,-0.2 38,-2.1 -75,-0.1 34,-0.3 -0.724 31.6-168.7 -83.7 114.1 29.2 20.8 10.7 100 102 A Y > - 0 0 1 -2,-0.8 3,-2.8 1,-0.2 36,-0.2 0.607 13.2-179.8 -84.0 -12.2 32.8 19.8 11.2 101 103 A G G > S+ 0 0 28 1,-0.3 3,-2.1 34,-0.2 34,-0.2 -0.243 72.5 10.8 54.1-124.0 33.7 23.1 12.8 102 104 A D G 3 S+ 0 0 56 32,-3.1 -1,-0.3 1,-0.3 33,-0.1 0.709 130.5 57.6 -56.6 -23.4 37.4 23.0 13.7 103 105 A Y G X S+ 0 0 0 -3,-2.8 3,-2.2 31,-0.3 -81,-0.3 0.385 72.2 136.8 -93.9 5.7 37.9 19.8 11.7 104 106 A E T < S+ 0 0 50 -3,-2.1 -81,-0.2 1,-0.3 3,-0.1 -0.275 78.5 5.6 -57.9 127.3 36.6 21.2 8.4 105 107 A G T 3 S+ 0 0 14 -83,-2.8 -1,-0.3 1,-0.3 -82,-0.1 0.254 104.8 121.6 90.4 -13.8 38.9 20.1 5.6 106 108 A X < - 0 0 40 -3,-2.2 -84,-2.5 -84,-0.1 2,-0.3 -0.164 60.6-118.4 -79.9 170.7 41.0 17.8 7.7 107 109 A L > - 0 0 37 -86,-0.2 4,-2.4 -3,-0.1 5,-0.2 -0.759 29.5-110.8 -99.0 156.3 41.7 14.1 7.6 108 110 A T H > S+ 0 0 4 -88,-0.4 4,-2.5 -2,-0.3 5,-0.3 0.945 119.8 51.2 -50.5 -52.0 40.8 11.7 10.4 109 111 A R H > S+ 0 0 188 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.899 112.0 49.0 -54.2 -39.2 44.5 11.1 11.4 110 112 A E H > S+ 0 0 84 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.870 108.5 52.7 -67.6 -39.7 44.8 14.9 11.5 111 113 A I H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.942 110.5 47.3 -62.6 -48.1 41.7 15.2 13.7 112 114 A I H X S+ 0 0 49 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.908 111.7 50.1 -59.4 -45.6 43.0 12.7 16.2 113 115 A E H X S+ 0 0 144 -4,-2.3 4,-2.1 -5,-0.3 -2,-0.2 0.939 112.5 47.4 -60.6 -46.0 46.4 14.4 16.3 114 116 A L H X S+ 0 0 46 -4,-2.6 4,-0.6 1,-0.2 -2,-0.2 0.931 114.1 46.4 -60.3 -49.3 44.8 17.8 16.9 115 117 A R H ><>S+ 0 0 16 -4,-2.9 5,-2.2 2,-0.2 3,-1.1 0.907 110.5 52.8 -58.2 -47.1 42.5 16.5 19.6 116 118 A K H ><5S+ 0 0 155 -4,-2.8 3,-1.8 1,-0.3 -1,-0.2 0.905 106.4 53.5 -56.1 -43.5 45.3 14.6 21.4 117 119 A S H 3<5S+ 0 0 92 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.667 106.2 54.4 -65.5 -17.9 47.3 17.8 21.5 118 120 A R T <<5S- 0 0 109 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.349 121.2-107.8 -94.3 3.7 44.3 19.5 23.2 119 121 A G T < 5S+ 0 0 34 -3,-1.8 3,-0.3 1,-0.2 -3,-0.2 0.509 75.6 135.9 79.6 8.3 44.2 16.8 25.9 120 122 A L < + 0 0 56 -5,-2.2 -1,-0.2 1,-0.2 6,-0.1 -0.222 50.7 32.1 -81.6 173.1 41.0 15.2 24.5 121 123 A D + 0 0 46 1,-0.1 -1,-0.2 4,-0.1 5,-0.1 0.843 69.6 151.0 49.3 43.6 40.2 11.5 24.1 122 124 A K S S+ 0 0 182 -3,-0.3 -1,-0.1 1,-0.1 -2,-0.1 0.872 74.9 27.3 -73.2 -36.5 42.3 10.7 27.1 123 125 A E S S+ 0 0 179 1,-0.3 -1,-0.1 2,-0.0 -3,-0.0 0.780 132.9 10.0 -98.9 -36.2 40.2 7.6 28.0 124 126 A R S S- 0 0 113 3,-0.0 -1,-0.3 0, 0.0 3,-0.1 -0.987 85.6 -91.6-142.0 159.5 38.7 6.5 24.6 125 127 A P - 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