==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-JAN-07 2OM6 . COMPND 2 MOLECULE: PROBABLE PHOSPHOSERINE PHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR J.JEYAKANTHAN,S.VAIJAYANTHIMALA,D.GAYATHRI,D.VELMURUGAN,S.BA . 466 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20079.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 352 75.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 54 11.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 3.0 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 16 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 184 39.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 22 4.7 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 2 0 1 3 0 0 6 1 0 1 2 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 10 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 . 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 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 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 X 0 0 153 0, 0.0 3,-0.1 0, 0.0 176,-0.0 0.000 360.0 360.0 360.0 135.8 1.8 37.9 79.1 2 2 A R - 0 0 137 1,-0.1 2,-0.2 231,-0.0 0, 0.0 -0.222 360.0-103.0 -58.9 148.6 0.9 37.1 75.5 3 3 A E - 0 0 84 1,-0.1 2,-0.3 230,-0.1 -1,-0.1 -0.536 35.9-111.5 -76.6 137.5 1.9 33.7 74.2 4 4 A V + 0 0 9 -2,-0.2 174,-0.2 228,-0.2 173,-0.1 -0.538 38.3 170.0 -73.2 129.6 4.9 33.5 71.9 5 5 A K + 0 0 109 172,-2.6 112,-2.3 -2,-0.3 2,-0.4 0.560 62.4 48.5-111.2 -19.5 4.0 32.5 68.4 6 6 A L E -ab 117 178A 0 171,-2.4 173,-2.4 110,-0.2 2,-0.5 -0.979 53.6-170.5-133.9 133.3 7.4 33.2 66.7 7 7 A V E -ab 118 179A 0 110,-2.2 112,-1.3 -2,-0.4 2,-0.3 -0.977 14.9-159.7-119.2 121.2 11.0 32.2 67.5 8 8 A T E -ab 119 180A 1 171,-3.3 173,-2.3 -2,-0.5 2,-0.4 -0.792 7.0-150.0-102.6 147.1 13.7 33.9 65.4 9 9 A F E -ab 120 181A 0 110,-2.7 112,-3.1 -2,-0.3 173,-0.2 -0.949 11.8-148.3-125.9 134.4 17.2 32.5 65.0 10 10 A D - 0 0 12 171,-2.1 112,-0.2 -2,-0.4 3,-0.1 -0.476 21.2-153.5 -80.6 162.2 20.6 34.0 64.5 11 11 A V >>> + 0 0 1 110,-0.2 4,-3.1 1,-0.2 3,-2.2 0.809 65.2 66.6-105.3 -72.2 22.8 31.5 62.4 12 12 A W B 345S+g 16 0B 27 1,-0.3 171,-0.3 2,-0.2 5,-0.2 -0.384 121.4 2.5 -62.9 115.9 26.5 31.8 62.9 13 13 A N T 345S+ 0 0 30 3,-4.1 -1,-0.3 -2,-0.3 4,-0.2 0.623 131.6 61.3 80.8 19.3 27.5 30.7 66.5 14 14 A T T <45S+ 0 0 1 -3,-2.2 208,-0.3 2,-0.5 -2,-0.2 0.470 127.3 1.2-130.9 -52.9 23.8 29.9 67.3 15 15 A L T <5S+ 0 0 0 -4,-3.1 86,-2.7 1,-0.3 2,-0.3 0.769 134.8 34.5-107.4 -43.4 23.0 27.1 64.8 16 16 A L B - 0 0 37 82,-2.7 4,-1.3 -2,-0.3 -5,-0.1 -0.685 26.0-171.4 -83.5 109.9 29.9 27.0 64.1 18 18 A L H > S+ 0 0 12 -2,-0.8 4,-3.0 2,-0.2 5,-0.3 0.790 81.2 60.6 -72.6 -29.9 31.5 30.2 62.7 19 19 A N H > S+ 0 0 103 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.964 104.9 48.5 -62.0 -49.7 35.0 29.4 63.9 20 20 A I H > S+ 0 0 58 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.896 115.5 45.6 -56.4 -41.6 35.1 26.2 61.7 21 21 A X H X S+ 0 0 2 -4,-1.3 4,-3.3 2,-0.2 5,-0.2 0.954 112.3 47.5 -68.2 -52.1 33.8 28.2 58.7 22 22 A L H X S+ 0 0 18 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.856 114.8 49.7 -57.3 -34.6 36.0 31.2 59.0 23 23 A D H X S+ 0 0 99 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.884 111.3 46.3 -71.4 -41.9 38.9 28.8 59.4 24 24 A E H X S+ 0 0 31 -4,-2.1 4,-2.7 -5,-0.2 -2,-0.2 0.934 115.6 48.3 -66.1 -42.7 38.0 26.7 56.4 25 25 A F H X S+ 0 0 0 -4,-3.3 4,-2.8 2,-0.2 -2,-0.2 0.891 111.3 48.3 -61.9 -45.1 37.5 30.0 54.5 26 26 A S H X S+ 0 0 5 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.2 0.888 112.9 49.6 -64.7 -39.2 40.9 31.4 55.6 27 27 A H H X S+ 0 0 70 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.941 113.6 44.8 -64.1 -48.2 42.6 28.2 54.6 28 28 A Q H X S+ 0 0 9 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.900 115.3 47.7 -64.3 -41.1 40.9 28.1 51.2 29 29 A L H X S+ 0 0 0 -4,-2.8 4,-1.2 2,-0.2 6,-0.3 0.905 113.9 46.6 -67.1 -40.5 41.7 31.8 50.6 30 30 A A H X>S+ 0 0 8 -4,-2.6 4,-1.7 -5,-0.2 5,-1.4 0.882 111.8 54.3 -67.1 -38.2 45.3 31.4 51.7 31 31 A K H <5S+ 0 0 124 -4,-2.5 3,-0.3 1,-0.2 -2,-0.2 0.959 112.3 38.8 -61.7 -54.9 45.6 28.3 49.6 32 32 A I H <5S+ 0 0 35 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.676 118.8 49.9 -73.1 -15.2 44.4 29.8 46.3 33 33 A S H <5S- 0 0 27 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.710 103.0-125.3 -93.7 -22.1 46.3 33.1 46.9 34 34 A G T <5 + 0 0 69 -4,-1.7 2,-0.2 1,-0.3 -3,-0.2 0.721 69.5 126.6 82.7 21.1 49.7 31.6 47.8 35 35 A L < - 0 0 51 -5,-1.4 -1,-0.3 -6,-0.3 -2,-0.2 -0.705 67.5 -96.4-107.7 162.3 49.6 33.5 51.1 36 36 A H > - 0 0 149 -2,-0.2 4,-1.8 1,-0.1 3,-0.2 -0.480 29.3-121.8 -77.0 148.7 50.1 32.1 54.7 37 37 A I H > S+ 0 0 89 1,-0.2 4,-3.6 2,-0.2 5,-0.2 0.860 112.1 60.5 -58.5 -36.0 46.9 31.4 56.7 38 38 A K H > S+ 0 0 127 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.931 103.0 50.4 -57.0 -49.4 48.1 33.8 59.4 39 39 A D H > S+ 0 0 85 -3,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.948 116.2 42.4 -52.6 -52.2 48.1 36.7 56.9 40 40 A V H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.886 110.2 54.5 -64.2 -44.6 44.6 35.8 55.8 41 41 A A H X S+ 0 0 31 -4,-3.6 4,-2.7 1,-0.2 -1,-0.2 0.912 109.1 50.0 -58.8 -41.4 43.2 35.1 59.2 42 42 A N H X S+ 0 0 54 -4,-2.3 4,-2.9 -5,-0.2 -1,-0.2 0.890 109.2 50.0 -64.9 -40.4 44.3 38.6 60.3 43 43 A A H X S+ 0 0 3 -4,-1.7 4,-2.7 2,-0.2 5,-0.2 0.898 111.1 50.4 -64.8 -38.6 42.7 40.3 57.4 44 44 A V H X S+ 0 0 5 -4,-2.4 4,-3.2 2,-0.2 -2,-0.2 0.945 112.1 47.5 -62.8 -47.6 39.5 38.4 58.1 45 45 A I H X S+ 0 0 89 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.914 112.4 49.1 -59.1 -46.2 39.6 39.5 61.7 46 46 A E H X S+ 0 0 93 -4,-2.9 4,-2.1 2,-0.2 -1,-0.2 0.911 115.7 42.2 -62.4 -43.5 40.3 43.1 60.7 47 47 A V H X S+ 0 0 2 -4,-2.7 4,-2.0 2,-0.2 5,-0.2 0.919 113.1 54.3 -68.8 -42.9 37.4 43.2 58.2 48 48 A R H X S+ 0 0 57 -4,-3.2 4,-1.8 -5,-0.2 -2,-0.2 0.899 112.9 41.9 -57.2 -45.2 35.1 41.3 60.6 49 49 A N H X S+ 0 0 91 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.939 112.1 52.5 -70.7 -46.5 35.7 43.9 63.4 50 50 A E H X S+ 0 0 111 -4,-2.1 4,-1.6 -5,-0.2 -1,-0.2 0.833 112.4 47.6 -59.6 -30.8 35.6 47.0 61.2 51 51 A I H X S+ 0 0 17 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.885 108.3 53.6 -76.8 -39.4 32.2 45.7 59.9 52 52 A K H X S+ 0 0 47 -4,-1.8 4,-1.7 -5,-0.2 3,-0.4 0.935 108.9 50.9 -58.7 -45.7 30.9 45.0 63.4 53 53 A K H X S+ 0 0 146 -4,-2.6 4,-2.0 1,-0.2 3,-0.3 0.926 105.0 54.5 -59.3 -47.5 31.7 48.5 64.4 54 54 A X H <>S+ 0 0 93 -4,-1.6 5,-2.3 1,-0.2 -1,-0.2 0.818 108.3 50.7 -58.0 -30.2 29.9 50.1 61.5 55 55 A R H ><5S+ 0 0 7 -4,-1.4 3,-1.4 -3,-0.4 -1,-0.2 0.841 105.9 54.2 -74.6 -35.3 26.8 48.2 62.5 56 56 A A H 3<5S+ 0 0 64 -4,-1.7 -2,-0.2 -3,-0.3 -1,-0.2 0.866 108.2 51.5 -63.8 -34.7 27.1 49.4 66.0 57 57 A Q T 3<5S- 0 0 109 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.421 105.9-133.2 -80.8 -0.1 27.2 52.9 64.4 58 58 A A T < 5S+ 0 0 58 -3,-1.4 -3,-0.2 -5,-0.2 -2,-0.1 0.840 77.1 115.5 48.2 34.0 24.0 52.1 62.5 59 59 A S < + 0 0 60 -5,-2.3 2,-0.4 2,-0.0 -4,-0.1 -0.227 37.6 114.8-126.0 42.8 25.9 53.5 59.6 60 60 A E - 0 0 24 -5,-0.1 97,-0.1 -6,-0.1 3,-0.1 -0.909 64.1-124.8-116.8 144.0 26.3 50.5 57.3 61 61 A D >> - 0 0 44 -2,-0.4 3,-2.3 1,-0.2 4,-1.4 -0.767 12.7-157.9 -92.1 106.8 24.8 50.1 53.8 62 62 A P T 34 S+ 0 0 13 0, 0.0 4,-0.3 0, 0.0 93,-0.3 0.725 93.1 54.2 -50.1 -28.7 22.8 46.8 53.7 63 63 A R T 34 S+ 0 0 179 92,-0.2 4,-0.2 1,-0.2 -2,-0.0 0.571 115.0 36.9 -86.8 -11.0 23.2 46.8 49.9 64 64 A K T <> S+ 0 0 117 -3,-2.3 4,-3.2 2,-0.1 5,-0.2 0.477 86.0 99.9-118.0 -6.8 27.0 47.0 49.9 65 65 A V H X S+ 0 0 11 -4,-1.4 4,-2.7 2,-0.2 5,-0.2 0.918 85.6 42.5 -46.3 -62.1 27.8 44.9 52.9 66 66 A L H > S+ 0 0 31 -4,-0.3 4,-1.9 1,-0.2 60,-0.4 0.954 120.0 41.3 -52.6 -59.5 28.8 41.6 51.1 67 67 A T H > S+ 0 0 50 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.854 113.7 56.0 -59.4 -35.3 30.8 43.3 48.3 68 68 A G H X S+ 0 0 29 -4,-3.2 4,-2.6 1,-0.2 -1,-0.2 0.952 107.6 46.6 -61.5 -49.3 32.3 45.7 50.8 69 69 A S H X S+ 0 0 2 -4,-2.7 4,-1.4 -5,-0.2 -1,-0.2 0.831 115.4 47.1 -62.7 -34.1 33.6 42.8 53.0 70 70 A Q H X S+ 0 0 7 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.881 114.6 44.9 -76.2 -38.5 35.0 41.0 50.0 71 71 A E H X S+ 0 0 114 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.828 112.5 52.9 -72.8 -32.9 36.7 44.1 48.5 72 72 A A H X S+ 0 0 40 -4,-2.6 4,-1.6 -5,-0.2 -2,-0.2 0.878 113.1 43.5 -68.3 -39.3 38.0 45.1 51.9 73 73 A L H X S+ 0 0 0 -4,-1.4 4,-2.0 -5,-0.2 5,-0.2 0.912 112.5 52.2 -72.9 -43.4 39.6 41.6 52.4 74 74 A A H X>S+ 0 0 6 -4,-2.3 5,-2.4 1,-0.2 4,-1.1 0.870 111.2 48.6 -61.2 -37.6 40.9 41.6 48.8 75 75 A G H <5S+ 0 0 53 -4,-1.8 -1,-0.2 3,-0.2 -2,-0.2 0.855 108.1 52.5 -71.6 -36.8 42.6 44.9 49.3 76 76 A K H <5S+ 0 0 75 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.880 119.5 35.8 -66.1 -36.8 44.2 44.0 52.6 77 77 A L H <5S- 0 0 20 -4,-2.0 -1,-0.2 2,-0.1 -2,-0.2 0.590 106.5-125.9 -92.4 -12.2 45.7 40.9 51.0 78 78 A K T <5 + 0 0 197 -4,-1.1 2,-0.3 1,-0.2 -3,-0.2 0.915 64.6 130.5 66.3 45.2 46.4 42.5 47.6 79 79 A V < - 0 0 28 -5,-2.4 -1,-0.2 -6,-0.1 -2,-0.1 -0.843 67.8 -89.2-124.0 162.8 44.5 39.9 45.7 80 80 A D >> - 0 0 80 -2,-0.3 3,-1.3 1,-0.2 4,-0.8 -0.454 35.5-124.4 -68.3 142.8 41.8 39.9 43.0 81 81 A V H 3> S+ 0 0 32 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.679 108.6 72.8 -63.2 -14.0 38.4 39.9 44.6 82 82 A E H 3> S+ 0 0 3 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.871 90.7 55.3 -67.9 -37.6 37.8 36.9 42.4 83 83 A L H <> S+ 0 0 45 -3,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.852 105.9 52.7 -65.3 -31.0 40.0 34.8 44.7 84 84 A V H X S+ 0 0 0 -4,-0.8 4,-1.3 2,-0.2 -1,-0.2 0.906 110.7 46.0 -69.3 -41.7 37.9 35.8 47.6 85 85 A K H X S+ 0 0 28 -4,-1.6 4,-1.5 2,-0.2 3,-0.3 0.912 112.1 51.1 -67.3 -43.4 34.7 34.7 45.9 86 86 A R H X S+ 0 0 40 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.916 106.1 56.0 -60.2 -42.8 36.3 31.4 44.8 87 87 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.838 105.2 51.4 -59.3 -35.3 37.5 30.7 48.4 88 88 A T H X S+ 0 0 3 -4,-1.3 4,-1.9 -3,-0.3 -1,-0.2 0.851 111.4 47.5 -71.5 -33.2 33.9 31.0 49.7 89 89 A A H X S+ 0 0 0 -4,-1.5 4,-1.4 -3,-0.2 -2,-0.2 0.922 114.6 47.1 -71.7 -41.1 32.7 28.5 47.1 90 90 A R H X S+ 0 0 57 -4,-2.8 4,-1.0 2,-0.2 -2,-0.2 0.852 111.4 50.3 -68.2 -35.3 35.6 26.2 48.0 91 91 A A H >X S+ 0 0 1 -4,-2.3 4,-1.1 2,-0.2 3,-0.8 0.936 107.8 52.6 -67.7 -46.0 35.0 26.5 51.7 92 92 A I H 3< S+ 0 0 4 -4,-1.9 3,-0.3 1,-0.3 -1,-0.2 0.851 111.8 48.7 -56.8 -34.2 31.4 25.7 51.3 93 93 A L H 3< S+ 0 0 71 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.695 112.1 47.8 -80.1 -19.8 32.5 22.6 49.4 94 94 A N H << S+ 0 0 94 -4,-1.0 -2,-0.2 -3,-0.8 -1,-0.2 0.463 95.2 85.3-102.4 -0.6 35.0 21.5 52.0 95 95 A V < - 0 0 8 -4,-1.1 2,-0.2 -3,-0.3 -74,-0.0 -0.508 54.6-175.5 -94.4 167.2 32.9 21.8 55.2 96 96 A D > - 0 0 82 -2,-0.2 3,-1.7 43,-0.0 4,-0.1 -0.731 47.3 -59.5-143.9-165.7 30.6 19.2 56.6 97 97 A E G > S+ 0 0 116 1,-0.3 3,-2.5 -2,-0.2 -2,-0.0 0.659 111.0 83.6 -58.8 -18.3 28.0 18.4 59.3 98 98 A S G 3 S+ 0 0 74 1,-0.3 -1,-0.3 -82,-0.0 -78,-0.1 0.581 79.2 73.4 -63.3 -3.9 30.6 19.1 62.1 99 99 A L G < S+ 0 0 0 -3,-1.7 -82,-2.7 -83,-0.1 2,-0.4 0.698 73.7 94.5 -81.4 -22.4 29.4 22.6 61.4 100 100 A V B < S-H 16 0B 33 -3,-2.5 -84,-0.2 -84,-0.2 2,-0.2 -0.596 80.4-125.9 -75.6 125.6 26.1 22.0 63.2 101 101 A L > - 0 0 46 -86,-2.7 3,-2.3 -2,-0.4 4,-0.3 -0.502 38.0 -87.3 -73.5 139.3 26.3 23.1 66.8 102 102 A E T 3 S+ 0 0 173 1,-0.3 121,-0.2 -2,-0.2 120,-0.1 -0.148 112.0 13.0 -50.2 127.6 25.3 20.5 69.4 103 103 A G T 3> S+ 0 0 15 -3,-0.1 4,-2.7 119,-0.1 -1,-0.3 0.391 89.2 120.2 87.2 -2.1 21.6 20.4 70.1 104 104 A T H <> S+ 0 0 0 -3,-2.3 4,-2.7 2,-0.2 5,-0.2 0.953 75.7 43.8 -60.9 -51.7 20.7 22.6 67.2 105 105 A K H > S+ 0 0 75 -4,-0.3 4,-3.2 1,-0.2 -1,-0.2 0.926 116.3 47.4 -60.2 -46.1 18.4 20.1 65.4 106 106 A E H > S+ 0 0 143 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.926 111.7 50.9 -59.8 -47.1 16.7 19.0 68.7 107 107 A A H X S+ 0 0 11 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.933 113.5 44.6 -56.9 -48.3 16.2 22.7 69.6 108 108 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 3,-0.4 0.956 113.3 50.9 -62.0 -48.6 14.7 23.5 66.3 109 109 A Q H X S+ 0 0 61 -4,-3.2 4,-3.3 1,-0.2 5,-0.3 0.896 107.0 54.7 -55.6 -43.2 12.5 20.3 66.4 110 110 A F H X S+ 0 0 43 -4,-3.1 4,-0.7 1,-0.2 -1,-0.2 0.864 109.8 46.5 -58.9 -40.0 11.3 21.2 69.9 111 111 A V H <>S+ 0 0 0 -4,-1.6 5,-1.8 -3,-0.4 -1,-0.2 0.893 115.6 45.7 -70.4 -41.3 10.1 24.6 68.7 112 112 A K H ><5S+ 0 0 48 -4,-2.4 3,-2.7 1,-0.2 -2,-0.2 0.948 111.2 50.1 -67.4 -49.9 8.4 23.1 65.6 113 113 A E H 3<5S+ 0 0 154 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.730 102.8 63.7 -61.4 -19.4 6.7 20.3 67.5 114 114 A R T 3<5S- 0 0 81 -4,-0.7 -1,-0.3 -5,-0.3 -2,-0.2 0.578 119.9-114.9 -79.5 -8.9 5.5 22.9 69.9 115 115 A G T < 5 + 0 0 67 -3,-2.7 2,-0.2 1,-0.3 -3,-0.2 0.738 68.0 139.0 83.4 25.1 3.6 24.4 66.9 116 116 A L < - 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