==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 25-MAR-04 1VDX . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN PH0099; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR P.H.REHSE,T.H.TAHIROV,RIKEN STRUCTURAL GENOMICS/PROTEOMICS . 184 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10387.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 141 76.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 61 33.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 45 24.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 0 0 0 0 0 1 0 0 0 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 3 1 1 1 0 1 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 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 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 1 A M 0 0 27 0, 0.0 48,-3.1 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 161.3 3.1 -7.5 48.2 2 2 A R E +AB 48 165A 121 163,-0.6 163,-2.0 46,-0.2 2,-0.3 -0.865 360.0 175.1 -92.4 131.6 4.0 -6.0 51.6 3 3 A A E +AB 47 164A 5 44,-2.1 43,-2.5 -2,-0.5 44,-0.6 -0.968 20.8 175.4-144.1 159.1 2.4 -2.6 51.8 4 4 A F E -AB 45 163A 7 159,-2.5 159,-3.8 -2,-0.3 2,-0.5 -0.987 28.1-120.6-156.3 157.9 1.8 0.5 54.0 5 5 A I E +AB 44 162A 0 39,-2.4 38,-3.2 -2,-0.3 39,-1.6 -0.896 41.5 170.3-104.9 130.8 0.4 4.0 53.9 6 6 A A E -AB 42 161A 1 155,-3.1 155,-3.3 -2,-0.5 2,-0.4 -0.935 36.8-141.8-144.2 163.8 2.7 6.9 54.7 7 7 A I E -A 41 0A 2 34,-2.0 34,-2.8 -2,-0.3 2,-0.3 -0.983 33.3-142.1-118.0 128.1 3.4 10.6 54.9 8 8 A D E -A 40 0A 36 -2,-0.4 150,-0.3 151,-0.2 151,-0.2 -0.689 5.0-134.1 -99.6 152.6 6.9 11.6 54.0 9 9 A V - 0 0 10 30,-0.7 2,-0.1 -2,-0.3 -1,-0.1 -0.264 23.7-108.7 -90.4 177.1 9.1 14.3 55.6 10 10 A N > - 0 0 52 -2,-0.1 4,-1.8 1,-0.0 -1,-0.1 -0.460 35.2 -95.2-101.3 179.2 11.3 16.8 53.8 11 11 A E H > S+ 0 0 99 2,-0.2 4,-3.9 1,-0.2 5,-0.3 0.910 117.6 54.8 -63.3 -45.6 15.1 17.0 53.6 12 12 A S H > S+ 0 0 72 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.909 113.2 43.2 -55.5 -44.9 15.8 19.4 56.5 13 13 A V H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.863 115.0 52.2 -67.9 -35.5 13.9 17.2 58.9 14 14 A R H X S+ 0 0 16 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.943 111.3 44.5 -66.9 -48.3 15.6 14.2 57.3 15 15 A D H X S+ 0 0 53 -4,-3.9 4,-2.0 1,-0.2 5,-0.2 0.942 115.2 49.4 -60.7 -47.2 19.1 15.7 57.7 16 16 A S H X S+ 0 0 33 -4,-2.6 4,-1.8 -5,-0.3 -2,-0.2 0.920 111.0 49.4 -58.3 -45.9 18.3 16.7 61.3 17 17 A L H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.871 108.6 51.9 -64.9 -36.5 16.9 13.3 62.2 18 18 A V H X S+ 0 0 43 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.902 109.4 49.8 -67.0 -40.0 20.0 11.4 60.8 19 19 A R H X S+ 0 0 173 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.873 109.7 51.9 -65.4 -35.7 22.4 13.5 62.8 20 20 A A H X S+ 0 0 11 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.901 109.2 50.4 -66.2 -39.0 20.2 12.8 65.9 21 21 A Q H X S+ 0 0 12 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.913 109.3 50.7 -62.4 -44.7 20.5 9.1 65.1 22 22 A D H < S+ 0 0 130 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.894 108.4 53.3 -61.4 -39.3 24.2 9.5 64.8 23 23 A Y H < S+ 0 0 127 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.921 107.0 50.1 -64.9 -42.0 24.2 11.2 68.2 24 24 A I H < S+ 0 0 2 -4,-2.2 4,-0.5 -5,-0.1 3,-0.4 0.923 93.8 165.6 -61.0 -42.1 22.3 8.4 69.8 25 25 A G < - 0 0 19 -4,-2.2 -1,-0.1 1,-0.2 -2,-0.1 -0.121 49.9 -72.9 64.6-156.0 24.9 6.0 68.3 26 26 A S S S+ 0 0 63 -4,-0.1 -1,-0.2 4,-0.1 -2,-0.1 0.185 101.7 88.7-128.6 15.3 25.5 2.3 69.2 27 27 A K S S+ 0 0 169 -3,-0.4 109,-0.1 1,-0.1 -2,-0.1 0.936 91.9 40.0 -81.1 -51.7 27.2 2.5 72.6 28 28 A E S S- 0 0 28 -4,-0.5 107,-2.5 1,-0.2 108,-2.3 0.796 132.4 -2.0 -68.5 -27.2 24.3 2.4 75.0 29 29 A A E S-D 134 0B 1 105,-0.3 2,-0.7 106,-0.2 105,-0.2 -0.996 70.0-103.5-163.7 157.1 22.5 -0.1 72.8 30 30 A K E +D 133 0B 94 103,-2.3 102,-2.6 -2,-0.3 103,-1.0 -0.770 52.3 176.9 -83.5 113.4 22.5 -2.2 69.7 31 31 A I E -D 131 0B 14 -2,-0.7 2,-0.9 100,-0.2 100,-0.2 -0.984 34.9-144.7-130.7 133.7 20.1 -0.4 67.4 32 32 A K E -D 130 0B 67 98,-2.7 98,-2.2 -2,-0.4 2,-0.2 -0.846 31.3-153.9 -91.4 107.4 18.9 -0.9 63.8 33 33 A F E -D 129 0B 42 -2,-0.9 96,-0.3 96,-0.2 2,-0.2 -0.558 19.0-107.7 -82.2 149.3 18.5 2.7 62.6 34 34 A V - 0 0 25 94,-2.3 5,-0.1 -2,-0.2 -1,-0.1 -0.552 38.9-107.1 -76.9 140.0 16.1 3.5 59.9 35 35 A E > - 0 0 88 -2,-0.2 3,-1.8 137,-0.1 4,-0.5 -0.359 29.0-111.0 -66.6 148.4 17.7 4.4 56.6 36 36 A R G > S+ 0 0 72 1,-0.3 3,-1.0 2,-0.2 -1,-0.1 0.855 118.3 48.6 -45.8 -46.2 17.6 8.1 55.6 37 37 A E G 3 S+ 0 0 119 1,-0.2 -1,-0.3 3,-0.0 -2,-0.0 0.635 107.1 57.1 -75.1 -14.3 15.2 7.4 52.7 38 38 A N G < S+ 0 0 19 -3,-1.8 2,-0.5 2,-0.1 -1,-0.2 0.374 73.6 116.5 -98.5 2.7 12.9 5.3 54.9 39 39 A L < + 0 0 1 -3,-1.0 -30,-0.7 -4,-0.5 2,-0.3 -0.632 42.8 121.0 -76.0 123.0 12.1 7.9 57.5 40 40 A H E -A 8 0A 18 -2,-0.5 2,-0.6 87,-0.2 87,-0.4 -0.911 66.2 -87.7-161.2-176.4 8.4 8.7 57.4 41 41 A I E -A 7 0A 0 -34,-2.8 -34,-2.0 -2,-0.3 2,-0.5 -0.953 39.6-138.8-108.9 118.1 5.2 8.8 59.4 42 42 A T E +A 6 0A 17 83,-0.8 83,-0.3 -2,-0.6 -36,-0.2 -0.662 23.1 178.0 -80.6 121.9 3.4 5.5 59.2 43 43 A L E S- 0 0 9 -38,-3.2 2,-0.2 -2,-0.5 -37,-0.2 0.785 71.8 -16.0 -91.3 -31.7 -0.3 6.0 58.7 44 44 A K E -A 5 0A 12 -39,-1.6 -39,-2.4 63,-0.0 2,-0.4 -0.699 54.1-135.1-177.2 121.1 -1.0 2.3 58.5 45 45 A F E -A 4 0A 115 -41,-0.2 -41,-0.2 -2,-0.2 -39,-0.0 -0.644 19.1-170.9 -75.6 127.9 0.8 -1.0 58.0 46 46 A L E - 0 0 8 -43,-2.5 -42,-0.2 -2,-0.4 -1,-0.1 0.476 17.1-157.0-100.3 -4.1 -1.2 -3.1 55.5 47 47 A G E -A 3 0A 27 -44,-0.6 -44,-2.1 2,-0.0 2,-0.5 -0.294 58.8 -4.1 62.7-146.7 0.7 -6.3 55.8 48 48 A E E S+A 2 0A 121 -46,-0.2 2,-0.3 0, 0.0 -46,-0.2 -0.691 78.5 163.9 -83.3 123.4 0.5 -8.7 52.8 49 49 A I - 0 0 2 -48,-3.1 2,-0.1 -2,-0.5 -2,-0.0 -0.952 33.0-112.6-138.6 159.5 -2.0 -7.5 50.1 50 50 A T > - 0 0 68 -2,-0.3 4,-2.3 1,-0.1 5,-0.1 -0.409 29.2-114.6 -86.5 163.5 -2.8 -8.3 46.5 51 51 A E H > S+ 0 0 125 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.895 120.8 54.9 -59.6 -41.1 -2.3 -6.0 43.5 52 52 A E H > S+ 0 0 153 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.871 108.9 44.3 -61.3 -41.8 -6.1 -6.0 43.3 53 53 A Q H > S+ 0 0 61 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.849 106.5 63.4 -71.2 -33.9 -6.5 -4.8 46.9 54 54 A A H X S+ 0 0 2 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.862 103.9 47.6 -56.0 -39.4 -3.7 -2.3 46.2 55 55 A E H X S+ 0 0 92 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.898 107.8 53.0 -70.9 -44.3 -6.0 -0.7 43.6 56 56 A E H X S+ 0 0 84 -4,-1.5 4,-1.2 1,-0.2 -2,-0.2 0.902 109.6 51.1 -56.5 -43.1 -9.1 -0.6 45.9 57 57 A I H >X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 3,-0.5 0.920 104.4 56.6 -62.1 -44.3 -7.0 1.2 48.5 58 58 A K H 3X S+ 0 0 50 -4,-1.6 4,-2.0 1,-0.3 5,-0.2 0.943 105.6 50.8 -52.5 -53.4 -5.8 3.8 46.0 59 59 A N H 3X S+ 0 0 112 -4,-1.9 4,-1.1 1,-0.2 -1,-0.3 0.796 112.6 46.8 -56.6 -31.8 -9.3 4.8 45.1 60 60 A I H < S+ 0 0 0 -4,-1.2 3,-1.4 2,-0.1 -2,-0.2 0.857 107.3 59.9 -92.9 -44.5 -9.8 11.0 51.6 65 65 A A H >< S+ 0 0 2 -4,-3.3 118,-0.8 1,-0.3 3,-0.7 0.762 104.0 52.4 -55.3 -29.9 -6.6 12.8 50.7 66 66 A E T 3< S+ 0 0 99 -4,-1.2 -1,-0.3 1,-0.2 118,-0.1 0.673 96.1 68.2 -82.9 -17.2 -8.6 15.6 49.0 67 67 A K T < S+ 0 0 127 -3,-1.4 2,-0.4 -4,-0.1 -1,-0.2 0.410 95.7 66.0 -81.9 3.8 -10.7 16.1 52.0 68 68 A Y S < S- 0 0 32 -3,-0.7 115,-2.3 -4,-0.2 2,-0.3 -0.985 77.0-133.2-130.1 137.1 -7.8 17.5 54.0 69 69 A K B -h 183 0C 128 -2,-0.4 115,-0.2 113,-0.2 88,-0.1 -0.606 31.8-100.0 -89.1 147.5 -5.8 20.7 53.5 70 70 A K + 0 0 53 113,-1.7 2,-0.3 -2,-0.3 88,-0.2 -0.311 49.8 169.6 -61.8 144.0 -2.0 20.8 53.5 71 71 A H E -E 157 0B 39 86,-1.3 86,-2.6 113,-0.1 2,-0.4 -0.971 34.3-105.9-152.2 163.5 -0.4 22.0 56.7 72 72 A E E -E 156 0B 135 -2,-0.3 2,-0.3 84,-0.3 84,-0.2 -0.770 32.4-171.0 -97.4 139.2 2.9 22.3 58.4 73 73 A V E -E 155 0B 4 82,-2.3 82,-1.5 -2,-0.4 2,-0.4 -0.866 16.2-131.7-123.7 161.4 3.8 20.0 61.3 74 74 A K E -EF 154 95B 72 21,-0.9 21,-4.1 -2,-0.3 2,-0.8 -0.956 9.8-139.7-119.2 129.2 6.8 20.1 63.7 75 75 A V E +EF 153 94B 0 78,-3.4 77,-2.5 -2,-0.4 78,-0.9 -0.786 39.7 162.8 -89.1 114.2 8.9 17.1 64.6 76 76 A K E +EF 151 93B 83 17,-1.4 17,-0.9 -2,-0.8 75,-0.2 -0.980 27.6 3.2-140.4 147.2 9.6 17.3 68.2 77 77 A G E - 0 0 10 73,-3.6 16,-1.4 -2,-0.4 2,-0.5 0.365 63.2-101.5 69.3 160.1 10.8 15.1 71.1 78 78 A I E - F 0 92B 20 70,-0.8 2,-0.3 69,-0.3 14,-0.2 -0.982 37.0-177.3-119.4 126.6 12.0 11.5 71.4 79 79 A G E - F 0 91B 14 12,-3.2 12,-2.6 -2,-0.5 2,-0.3 -0.816 13.5-141.1-120.0 162.1 9.6 8.9 72.7 80 80 A V E - F 0 90B 29 -2,-0.3 10,-0.2 10,-0.2 7,-0.1 -0.938 19.8-113.8-126.1 149.6 10.1 5.2 73.5 81 81 A F E S- F 0 89B 107 8,-1.6 7,-3.1 -2,-0.3 8,-2.7 -0.996 83.5 -0.3-133.9 139.4 7.9 2.2 72.9 82 82 A P E S- F 0 87B 50 0, 0.0 5,-0.2 0, 0.0 -2,-0.1 -0.725 126.6 -25.7 -71.8 -56.3 6.5 0.3 74.8 83 83 A N - 0 0 97 3,-1.7 3,-0.2 -2,-0.2 -2,-0.1 -0.726 53.2-111.3-119.1 167.9 7.7 1.7 78.1 84 84 A P S S+ 0 0 82 0, 0.0 3,-0.2 0, 0.0 -3,-0.1 0.682 126.4 44.4 -69.2 -14.6 10.7 3.8 79.3 85 85 A N S S+ 0 0 141 1,-0.3 2,-0.4 56,-0.0 56,-0.0 0.579 118.4 42.6-102.2 -16.0 11.6 0.6 81.1 86 86 A Y S S- 0 0 161 -3,-0.2 -3,-1.7 -6,-0.0 2,-0.6 -0.793 81.3-179.7-130.5 84.1 11.0 -1.7 78.1 87 87 A I E +F 82 0B 26 -2,-0.4 3,-0.1 -3,-0.2 47,-0.0 -0.802 25.4 135.3 -98.0 119.4 12.4 0.2 75.2 88 88 A R E + 0 0 112 -7,-3.1 43,-2.5 -2,-0.6 2,-0.5 0.627 66.0 48.2-126.1 -39.8 12.3 -1.3 71.7 89 89 A V E -FG 81 130B 11 -8,-2.7 -8,-1.6 41,-0.2 2,-0.6 -0.941 62.3-161.5-114.4 119.1 11.2 1.5 69.4 90 90 A I E +FG 80 129B 2 39,-3.1 38,-3.0 -2,-0.5 39,-1.9 -0.891 28.0 170.8 -96.3 123.6 13.0 4.9 69.5 91 91 A W E -FG 79 127B 52 -12,-2.6 -12,-3.2 -2,-0.6 2,-0.4 -0.947 35.3-130.3-138.2 158.0 10.8 7.5 67.8 92 92 A A E -FG 78 126B 0 34,-2.3 34,-2.8 -2,-0.3 -14,-0.2 -0.888 30.8-140.9-104.9 134.0 10.3 11.2 67.1 93 93 A G E -FG 76 125B 8 -16,-1.4 -17,-1.4 -17,-0.9 2,-0.4 -0.249 9.7-118.4 -88.3 177.5 6.9 12.7 67.8 94 94 A I E -F 75 0B 19 30,-0.7 2,-1.0 -19,-0.2 3,-0.2 -0.975 16.8-126.5-124.3 127.1 4.9 15.3 66.0 95 95 A E E S-F 74 0B 89 -21,-4.1 -21,-0.9 -2,-0.4 -18,-0.0 -0.602 92.8 -10.0 -74.8 105.1 3.7 18.6 67.4 96 96 A N + 0 0 97 -2,-1.0 -1,-0.2 -23,-0.1 -22,-0.1 0.940 64.8 169.3 61.8 104.5 -0.0 18.4 66.7 97 97 A D > + 0 0 27 -3,-0.2 4,-4.1 2,-0.1 5,-0.2 -0.134 38.1 120.6-125.8 28.4 -1.1 15.5 64.5 98 98 A E H > S+ 0 0 102 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.915 81.3 44.7 -64.1 -41.2 -4.8 15.8 65.1 99 99 A I H > S+ 0 0 71 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.889 118.3 44.8 -67.2 -37.5 -5.4 16.3 61.4 100 100 A I H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.884 113.4 50.6 -69.8 -40.7 -3.0 13.4 60.8 101 101 A R H X S+ 0 0 121 -4,-4.1 4,-1.7 1,-0.2 -2,-0.2 0.882 110.1 50.2 -64.5 -40.1 -4.7 11.5 63.6 102 102 A E H X S+ 0 0 62 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.891 109.8 50.4 -68.4 -38.6 -8.1 12.2 61.9 103 103 A M H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 5,-0.2 0.942 108.6 52.2 -62.7 -47.7 -6.8 11.0 58.6 104 104 A A H X S+ 0 0 7 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.863 109.2 49.9 -57.0 -38.9 -5.5 7.8 60.1 105 105 A R H X S+ 0 0 135 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.906 111.1 48.2 -67.6 -43.1 -8.8 7.0 61.7 106 106 A E H X S+ 0 0 31 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.831 113.7 47.3 -66.7 -33.0 -10.7 7.6 58.4 107 107 A I H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.871 112.9 50.8 -73.5 -37.7 -8.2 5.4 56.6 108 108 A E H X S+ 0 0 36 -4,-2.1 4,-1.0 -5,-0.2 -2,-0.2 0.907 112.9 42.4 -66.8 -46.3 -8.6 2.7 59.3 109 109 A D H X S+ 0 0 54 -4,-2.6 4,-0.9 2,-0.2 -1,-0.2 0.876 114.5 52.1 -71.0 -37.7 -12.3 2.6 59.3 110 110 A E H >< S+ 0 0 38 -4,-1.6 3,-0.6 -5,-0.3 4,-0.4 0.915 113.2 42.6 -65.5 -43.4 -12.5 2.7 55.5 111 111 A L H ><>S+ 0 0 0 -4,-2.2 5,-1.9 1,-0.2 3,-0.7 0.695 101.2 70.7 -76.4 -18.2 -10.1 -0.2 55.1 112 112 A A H ><5S+ 0 0 32 -4,-1.0 3,-1.7 1,-0.2 -1,-0.2 0.841 89.9 63.3 -64.7 -30.6 -11.8 -2.1 57.9 113 113 A K T <<5S+ 0 0 143 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.814 99.4 53.6 -61.2 -31.6 -14.7 -2.5 55.5 114 114 A L T < 5S- 0 0 62 -3,-0.7 -1,-0.3 -4,-0.4 -2,-0.2 0.348 133.3 -88.7 -87.2 6.3 -12.4 -4.5 53.3 115 115 A G T < 5S+ 0 0 71 -3,-1.7 2,-0.4 1,-0.3 -3,-0.2 0.590 78.5 149.0 97.2 13.0 -11.4 -6.9 56.1 116 116 A F < - 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