==== 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 OXIDOREDUCTASE 03-JUL-08 3DO5 . COMPND 2 MOLECULE: HOMOSERINE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 320 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14159.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 230 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 7.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 10.9 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 . 2 0.6 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 . 23 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 32.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.5 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 1 1 0 1 2 1 1 1 1 2 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 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 . 1 0 2 0 0 2 0 0 1 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 0 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 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 0 155 0, 0.0 2,-0.6 0, 0.0 33,-0.2 0.000 360.0 360.0 360.0 107.5 51.9 13.3 9.9 2 2 A I E -a 34 0A 17 31,-2.9 33,-2.0 79,-0.1 2,-0.6 -0.720 360.0-151.1 -81.8 120.7 49.0 13.7 7.3 3 3 A K E -a 35 0A 58 -2,-0.6 78,-3.7 31,-0.2 79,-2.2 -0.836 12.9-168.3-103.5 121.1 48.7 17.3 6.2 4 4 A I E -ab 36 82A 0 31,-2.3 33,-1.7 -2,-0.6 34,-1.1 -0.902 11.3-165.2-113.2 131.8 45.3 18.5 5.1 5 5 A A E -ab 38 83A 0 77,-2.2 79,-3.0 -2,-0.4 2,-0.5 -0.921 10.2-155.7-108.0 139.8 44.3 21.7 3.3 6 6 A I E -ab 39 84A 0 32,-2.1 34,-1.8 -2,-0.4 2,-0.5 -0.988 8.9-172.6-114.5 123.1 40.6 22.6 3.2 7 7 A V E +ab 40 85A 1 77,-2.9 79,-2.7 -2,-0.5 34,-0.2 -0.974 62.4 38.4-118.5 120.5 39.5 24.9 0.4 8 8 A G - 0 0 4 32,-3.3 33,-0.2 -2,-0.5 78,-0.2 0.306 58.7-168.9 103.6 116.9 36.0 26.2 0.6 9 9 A F + 0 0 1 4,-0.1 32,-0.1 30,-0.1 78,-0.1 -0.148 47.6 105.8-137.4 40.3 34.7 27.0 4.0 10 10 A G S > S- 0 0 21 76,-0.5 4,-2.5 31,-0.0 5,-0.3 0.094 98.5 -43.5 -87.9-147.1 31.0 27.5 3.7 11 11 A T H > S+ 0 0 96 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.865 140.8 42.2 -52.3 -47.0 28.6 24.9 5.0 12 12 A V H > S+ 0 0 36 2,-0.2 4,-2.3 74,-0.2 -1,-0.2 0.958 115.8 46.7 -69.5 -51.7 30.5 21.8 3.8 13 13 A G H > S+ 0 0 0 73,-0.5 4,-1.7 1,-0.2 -2,-0.2 0.851 113.9 48.4 -60.5 -39.4 34.0 22.9 4.6 14 14 A Q H X S+ 0 0 25 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.884 109.2 55.4 -68.5 -37.1 33.0 24.0 8.1 15 15 A G H X S+ 0 0 0 -4,-1.8 4,-2.2 -5,-0.3 -2,-0.2 0.885 106.2 50.9 -57.3 -42.3 31.2 20.6 8.4 16 16 A V H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.913 110.7 48.0 -64.5 -42.2 34.5 18.9 7.6 17 17 A A H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.922 110.7 51.4 -65.7 -43.6 36.4 20.9 10.3 18 18 A E H X S+ 0 0 54 -4,-2.6 4,-3.1 1,-0.2 -2,-0.2 0.934 114.0 44.1 -57.7 -44.3 33.7 20.2 12.8 19 19 A L H X S+ 0 0 9 -4,-2.2 4,-3.3 1,-0.2 -2,-0.2 0.922 109.9 53.9 -69.8 -44.8 33.9 16.4 12.1 20 20 A L H < S+ 0 0 1 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.836 116.1 41.9 -55.6 -35.8 37.7 16.4 12.1 21 21 A I H >< S+ 0 0 70 -4,-1.9 3,-1.4 -5,-0.2 4,-0.2 0.957 117.3 44.6 -73.8 -58.2 37.6 18.0 15.5 22 22 A R H 3< S+ 0 0 155 -4,-3.1 3,-0.3 1,-0.3 -2,-0.2 0.869 123.3 35.6 -55.1 -43.9 34.7 15.9 17.0 23 23 A K T 3X S+ 0 0 79 -4,-3.3 4,-2.6 -5,-0.2 -1,-0.3 -0.001 80.1 122.4-100.9 28.8 36.1 12.6 15.7 24 24 A R H <> S+ 0 0 68 -3,-1.4 4,-2.5 2,-0.2 5,-0.2 0.906 73.5 48.3 -60.1 -44.0 39.9 13.4 16.1 25 25 A E H > S+ 0 0 104 -3,-0.3 4,-2.2 -4,-0.2 -1,-0.2 0.975 116.1 43.1 -62.7 -51.0 40.7 10.4 18.4 26 26 A E H 4 S+ 0 0 84 1,-0.2 4,-0.3 2,-0.2 -2,-0.2 0.899 114.5 50.2 -63.9 -39.6 38.9 7.8 16.2 27 27 A I H >X S+ 0 0 20 -4,-2.6 4,-2.7 1,-0.2 3,-1.1 0.924 111.9 48.1 -63.4 -44.2 40.4 9.3 13.0 28 28 A E H 3X S+ 0 0 75 -4,-2.5 4,-1.6 -5,-0.3 -2,-0.2 0.861 109.2 51.3 -68.6 -34.8 43.9 9.3 14.4 29 29 A K H 3< S+ 0 0 160 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.475 117.0 43.5 -80.6 1.8 43.7 5.7 15.6 30 30 A A H <4 S+ 0 0 41 -3,-1.1 291,-0.9 -4,-0.3 -2,-0.2 0.746 135.5 7.9-108.2 -44.1 42.5 4.7 12.1 31 31 A I H < S- 0 0 24 -4,-2.7 -3,-0.2 1,-0.3 -2,-0.2 0.418 104.8-114.1-121.2 -1.6 44.8 6.7 9.7 32 32 A G < - 0 0 31 -4,-1.6 -1,-0.3 -5,-0.5 -2,-0.2 -0.394 60.8 -13.6 95.6-174.5 47.5 8.2 12.1 33 33 A E + 0 0 47 -2,-0.1 -31,-2.9 -4,-0.1 2,-0.3 -0.308 63.2 178.6 -65.5 140.3 48.3 11.7 13.1 34 34 A F E -a 2 0A 17 -33,-0.2 2,-0.3 -10,-0.1 -31,-0.2 -0.994 14.1-174.7-141.9 152.1 46.9 14.6 11.1 35 35 A K E -a 3 0A 34 -33,-2.0 -31,-2.3 -2,-0.3 2,-0.8 -0.995 27.7-128.3-141.6 138.7 46.9 18.4 11.1 36 36 A V E -a 4 0A 14 -2,-0.3 14,-0.3 -33,-0.2 -31,-0.2 -0.826 27.0-178.6 -86.1 113.8 45.0 20.9 8.9 37 37 A T E + 0 0 31 -33,-1.7 11,-1.1 -2,-0.8 2,-0.3 0.571 62.5 18.7 -92.4 -12.6 47.8 23.2 7.7 38 38 A A E -aC 5 47A 0 -34,-1.1 -32,-2.1 9,-0.2 2,-0.3 -0.983 53.7-174.8-157.0 145.6 45.7 25.6 5.6 39 39 A V E -aC 6 46A 0 7,-2.5 7,-2.5 -2,-0.3 2,-0.3 -0.990 11.7-177.8-138.8 140.9 42.0 26.7 5.2 40 40 A A E -aC 7 45A 0 -34,-1.8 -32,-3.3 -2,-0.3 5,-0.2 -0.999 8.1-171.0-142.8 139.4 40.7 29.1 2.6 41 41 A D - 0 0 8 3,-2.3 30,-0.5 -2,-0.3 23,-0.1 -0.262 57.1 -67.6-107.5-157.7 37.3 30.5 1.8 42 42 A S S S+ 0 0 104 1,-0.2 3,-0.1 -2,-0.1 28,-0.1 0.581 128.5 8.5 -76.2 -8.3 36.3 32.6 -1.2 43 43 A K S S+ 0 0 112 1,-0.2 2,-0.3 26,-0.1 -1,-0.2 0.420 123.5 32.7-149.4 1.8 38.5 35.6 -0.3 44 44 A S - 0 0 0 2,-0.0 -3,-2.3 22,-0.0 2,-0.3 -0.887 54.8-159.8-152.2 178.3 40.8 34.8 2.6 45 45 A S E -CD 40 67A 0 22,-2.2 22,-3.7 -2,-0.3 21,-0.5 -0.961 13.9-143.5-159.1 168.8 42.8 32.1 4.3 46 46 A I E +C 39 0A 0 -7,-2.5 -7,-2.5 -2,-0.3 2,-0.3 -0.971 31.9 153.3-142.8 130.2 44.6 30.8 7.4 47 47 A S E +C 38 0A 39 -2,-0.3 2,-0.2 -9,-0.2 -9,-0.2 -0.872 35.0 54.1-148.0 176.0 47.8 28.8 7.3 48 48 A G S S- 0 0 56 -11,-1.1 2,-0.6 -2,-0.3 -2,-0.0 -0.628 111.6 -20.2 86.6-154.0 50.9 28.1 9.5 49 49 A D S S+ 0 0 162 -2,-0.2 2,-0.3 -11,-0.0 -2,-0.1 -0.819 87.7 130.0 -92.3 125.8 50.2 26.8 13.0 50 50 A F - 0 0 16 -2,-0.6 2,-0.3 -14,-0.3 -14,-0.1 -0.910 55.5-104.6-160.0 165.0 46.6 27.7 14.0 51 51 A S > - 0 0 52 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.778 17.3-129.8-102.2 151.6 43.8 25.5 15.5 52 52 A L H > S+ 0 0 25 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.869 114.5 53.0 -61.2 -37.1 40.8 24.3 13.5 53 53 A V H > S+ 0 0 75 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.797 107.2 53.7 -69.5 -27.2 38.6 25.5 16.2 54 54 A E H > S+ 0 0 67 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.960 110.1 46.0 -65.8 -52.3 40.4 28.9 15.8 55 55 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.880 115.1 47.9 -55.7 -41.2 39.6 28.9 12.1 56 56 A L H X S+ 0 0 14 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.909 111.4 48.3 -70.8 -45.7 36.0 27.9 12.7 57 57 A R H X S+ 0 0 69 -4,-2.3 4,-3.0 1,-0.2 5,-0.2 0.939 112.5 50.0 -60.1 -47.0 35.5 30.5 15.4 58 58 A X H X S+ 0 0 41 -4,-2.7 4,-2.2 2,-0.2 6,-0.6 0.897 110.0 49.5 -60.3 -43.8 37.0 33.2 13.2 59 59 A K H X S+ 0 0 34 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.935 116.5 41.7 -63.8 -44.2 34.8 32.3 10.2 60 60 A R H < S+ 0 0 129 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.923 118.7 46.0 -69.1 -44.2 31.6 32.3 12.2 61 61 A E H < S+ 0 0 148 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.764 132.9 13.5 -68.2 -34.0 32.5 35.4 14.2 62 62 A T H < S- 0 0 84 -4,-2.2 -3,-0.2 2,-0.3 -2,-0.2 0.524 92.9-117.8-125.0 -11.3 33.7 37.5 11.2 63 63 A G S < S+ 0 0 39 -4,-2.3 2,-0.3 -5,-0.4 -4,-0.2 0.453 89.9 49.8 81.7 2.0 32.6 35.9 8.0 64 64 A X S S- 0 0 74 -6,-0.6 -2,-0.3 -23,-0.1 -1,-0.2 -0.905 79.1-105.6-154.7-179.7 36.2 35.4 6.8 65 65 A L - 0 0 9 -2,-0.3 -19,-0.2 2,-0.2 -25,-0.1 -0.089 39.6 -90.4-103.7-156.7 39.6 34.1 7.8 66 66 A R S S+ 0 0 111 -21,-0.5 2,-0.3 -2,-0.1 -20,-0.2 0.832 91.5 52.3 -94.1 -39.0 42.9 35.7 8.8 67 67 A D B -D 45 0A 47 -22,-3.7 -22,-2.2 2,-0.2 -2,-0.2 -0.722 66.4-133.8-108.9 159.3 45.0 36.3 5.7 68 68 A D + 0 0 126 -2,-0.3 -1,-0.1 -24,-0.2 -22,-0.1 0.723 69.3 116.1 -82.9 -24.7 44.4 37.9 2.4 69 69 A A - 0 0 48 -24,-0.1 -2,-0.2 1,-0.1 -26,-0.1 -0.224 63.5-130.0 -50.8 127.0 46.0 35.1 0.4 70 70 A K >> - 0 0 91 -30,-0.1 4,-1.7 1,-0.1 3,-0.6 -0.245 22.7 -99.1 -82.1 164.4 43.4 33.4 -1.8 71 71 A A H 3> S+ 0 0 3 -30,-0.5 4,-2.7 1,-0.2 5,-0.2 0.840 121.3 59.5 -49.5 -40.5 42.5 29.7 -2.2 72 72 A I H 3> S+ 0 0 50 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.927 105.1 48.7 -61.8 -41.9 44.6 29.5 -5.3 73 73 A E H <>>S+ 0 0 38 -3,-0.6 4,-1.9 1,-0.2 5,-0.5 0.885 111.5 49.5 -64.3 -40.8 47.8 30.6 -3.4 74 74 A V H X5S+ 0 0 7 -4,-1.7 4,-1.7 3,-0.2 -1,-0.2 0.905 112.6 48.9 -63.1 -41.2 47.1 28.0 -0.7 75 75 A V H <5S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.924 119.0 36.7 -64.8 -44.4 46.6 25.3 -3.3 76 76 A R H <5S+ 0 0 136 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.649 134.7 19.1 -86.6 -11.4 49.8 26.2 -5.2 77 77 A S H <5S+ 0 0 95 -4,-1.9 -3,-0.2 -5,-0.2 -2,-0.2 0.659 90.8 102.5-130.1 -26.5 52.0 27.0 -2.2 78 78 A A S < 0 0 131 0, 0.0 4,-2.0 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -49.0 38.0 27.9 -9.9 93 96 A G H > + 0 0 9 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.861 360.0 51.8 -51.0 -47.1 37.2 24.4 -8.5 94 97 A V H > S+ 0 0 35 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.879 111.2 48.8 -59.4 -41.0 38.6 22.6 -11.6 95 98 A N H > S+ 0 0 89 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.807 108.0 53.5 -70.3 -34.3 41.9 24.7 -11.2 96 99 A Y H X S+ 0 0 25 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.926 113.8 43.2 -66.7 -42.7 42.2 23.9 -7.5 97 100 A I H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 3,-0.3 0.982 115.6 46.7 -64.0 -58.0 41.9 20.1 -8.3 98 101 A R H X S+ 0 0 65 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.892 114.5 48.7 -51.0 -44.8 44.2 20.2 -11.4 99 102 A E H < S+ 0 0 51 -4,-2.2 4,-0.5 2,-0.2 -1,-0.2 0.825 112.6 45.9 -71.9 -32.5 46.8 22.2 -9.4 100 103 A A H ><>S+ 0 0 0 -4,-1.8 5,-1.9 -3,-0.3 3,-0.8 0.940 116.2 46.7 -72.5 -42.4 46.8 20.0 -6.3 101 104 A L H ><5S+ 0 0 0 -4,-2.9 3,-1.8 1,-0.2 -2,-0.2 0.911 109.5 53.7 -62.7 -43.1 47.0 16.9 -8.6 102 105 A K T 3<5S+ 0 0 123 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.622 106.2 53.6 -66.5 -15.8 49.8 18.4 -10.7 103 106 A R T < 5S- 0 0 76 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.405 125.1-108.1 -92.0 -3.2 51.7 19.0 -7.4 104 107 A G T < 5S+ 0 0 33 -3,-1.8 2,-0.4 1,-0.3 -3,-0.2 0.910 72.4 142.2 75.3 43.9 51.2 15.3 -6.7 105 108 A K < - 0 0 31 -5,-1.9 -1,-0.3 26,-0.1 -23,-0.2 -0.918 53.4-116.0-115.5 144.6 48.6 15.8 -3.9 106 109 A H E -e 82 0A 32 -25,-1.8 -23,-2.6 -2,-0.4 2,-0.4 -0.400 30.6-152.1 -68.4 155.3 45.6 13.7 -3.3 107 110 A V E -ef 83 133A 0 25,-2.4 27,-3.1 -25,-0.2 2,-0.5 -0.998 16.8-174.4-136.9 129.7 42.2 15.4 -3.7 108 111 A V E -ef 84 134A 0 -25,-2.9 -23,-2.8 -2,-0.4 2,-0.3 -0.996 24.1-177.8-117.5 120.0 38.8 14.7 -2.0 109 112 A T E -e 85 0A 0 25,-2.6 28,-0.6 -2,-0.5 29,-0.4 -0.858 38.8-172.3-124.4 157.7 36.1 16.9 -3.5 110 113 A S + 0 0 19 -25,-1.9 2,-0.5 -2,-0.3 -24,-0.1 0.260 62.7 107.5-117.8 0.7 32.4 17.7 -3.1 111 114 A N - 0 0 11 -26,-0.6 4,-0.5 1,-0.1 27,-0.1 -0.756 47.8-169.3 -87.7 126.4 32.2 19.8 -6.3 112 115 A K S >> S+ 0 0 31 -2,-0.5 4,-2.1 1,-0.2 3,-0.6 0.850 70.8 76.4 -78.7 -39.5 30.4 18.3 -9.2 113 116 A G H 3> S+ 0 0 43 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.787 93.8 46.6 -43.3 -53.2 31.4 20.8 -11.9 114 117 A P H 3> S+ 0 0 10 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.857 114.2 49.0 -61.3 -38.5 35.0 19.8 -12.6 115 118 A L H <> S+ 0 0 0 -3,-0.6 4,-0.7 -4,-0.5 -2,-0.2 0.850 112.4 48.0 -69.9 -37.1 34.0 16.1 -12.8 116 119 A V H < S+ 0 0 22 -4,-2.1 3,-0.3 2,-0.2 110,-0.2 0.933 119.8 38.1 -69.6 -42.9 31.1 16.8 -15.2 117 120 A A H < S+ 0 0 81 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.801 136.2 13.8 -75.9 -31.9 33.3 19.0 -17.4 118 121 A E H X S+ 0 0 66 -4,-2.1 4,-2.3 -5,-0.2 5,-0.3 -0.181 72.3 147.2-147.7 43.3 36.5 17.0 -17.3 119 122 A F H X S+ 0 0 16 -4,-0.7 4,-2.2 -3,-0.3 3,-0.2 0.924 81.0 32.4 -53.9 -63.0 36.0 13.5 -15.8 120 123 A H H > S+ 0 0 97 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.875 116.3 59.2 -68.1 -33.2 38.6 11.4 -17.7 121 124 A G H > S+ 0 0 35 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.880 111.9 40.2 -59.6 -38.5 41.0 14.4 -18.0 122 125 A L H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.869 113.0 52.2 -80.4 -40.2 41.1 14.7 -14.2 123 126 A X H X S+ 0 0 44 -4,-2.2 4,-2.0 -5,-0.3 -2,-0.2 0.903 113.2 47.2 -60.0 -41.1 41.2 10.9 -13.4 124 127 A S H X S+ 0 0 61 -4,-2.4 4,-3.2 2,-0.2 -1,-0.2 0.832 108.8 53.0 -68.3 -39.0 44.1 10.6 -15.8 125 128 A L H X S+ 0 0 3 -4,-1.2 4,-2.0 -5,-0.2 -2,-0.2 0.912 110.7 47.9 -63.4 -43.1 46.0 13.6 -14.3 126 129 A A H <>S+ 0 0 2 -4,-2.2 5,-2.0 2,-0.2 -2,-0.2 0.909 114.4 46.6 -61.7 -44.8 45.6 11.9 -10.9 127 130 A E H <5S+ 0 0 77 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.923 109.5 53.5 -64.0 -44.9 46.9 8.6 -12.4 128 131 A R H <5S+ 0 0 137 -4,-3.2 -2,-0.2 2,-0.1 -1,-0.2 0.851 114.4 45.0 -60.7 -39.6 49.8 10.4 -14.2 129 132 A N T <5S- 0 0 47 -4,-2.0 2,-0.2 -5,-0.2 -27,-0.1 -0.400 112.8-105.3 -86.0 179.1 50.9 11.9 -10.9 130 133 A G T 5S+ 0 0 80 -2,-0.2 2,-0.2 -29,-0.1 -3,-0.2 -0.161 81.9 95.2-107.8 50.2 50.7 9.2 -8.3 131 134 A V < - 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0 0 8 88,-0.2 4,-1.7 116,-0.2 116,-0.2 -0.931 54.0-167.8-138.4 108.3 17.9 15.2 -5.5 167 170 A G H > S+ 0 0 15 -2,-0.4 4,-2.8 1,-0.2 115,-0.3 0.823 86.8 58.6 -59.5 -37.8 16.3 15.3 -2.0 168 171 A T H > S+ 0 0 17 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.928 108.8 42.9 -63.2 -47.8 14.5 18.6 -2.7 169 172 A C H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.867 113.7 53.1 -64.5 -36.3 12.5 17.2 -5.7 170 173 A N H X S+ 0 0 2 -4,-1.7 4,-2.6 1,-0.2 110,-0.5 0.934 111.6 45.8 -66.0 -41.8 11.9 14.0 -3.7 171 174 A Y H X S+ 0 0 32 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.917 112.0 50.6 -62.8 -46.3 10.5 16.1 -0.9 172 175 A I H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.928 114.2 44.1 -61.4 -44.3 8.4 18.2 -3.2 173 176 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.918 115.2 47.5 -67.1 -45.5 6.8 15.2 -4.9 174 177 A S H X S+ 0 0 12 -4,-2.6 4,-1.8 -5,-0.2 -2,-0.2 0.885 114.8 47.3 -60.0 -41.9 6.3 13.3 -1.6 175 178 A R H X S+ 0 0 56 -4,-2.7 4,-3.0 -5,-0.2 5,-0.4 0.895 111.2 50.0 -68.3 -43.0 4.7 16.3 -0.1 176 179 A X H X S+ 0 0 0 -4,-2.4 4,-1.8 -5,-0.3 -2,-0.2 0.872 109.6 53.3 -62.1 -37.2 2.5 16.9 -3.1 177 180 A E H < S+ 0 0 29 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.923 116.3 38.0 -61.7 -44.3 1.4 13.3 -2.9 178 181 A E H < S+ 0 0 142 -4,-1.8 -2,-0.2 -5,-0.1 -3,-0.2 0.931 127.9 30.0 -75.9 -49.3 0.4 13.6 0.7 179 182 A E H < S- 0 0 59 -4,-3.0 -3,-0.2 -5,-0.1 -2,-0.2 0.743 86.6-145.3 -84.3 -27.5 -1.1 17.1 0.7 180 183 A R < + 0 0 75 -4,-1.8 -4,-0.1 -5,-0.4 -3,-0.1 0.916 48.6 142.1 59.8 47.2 -2.4 17.3 -2.8 181 184 A L - 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