==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 25-FEB-13 4JDY . COMPND 2 MOLECULE: PYRIDOXAL BIOSYNTHESIS LYASE PDXS; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR S.KIM,K.-J.KIM . 792 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32147.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 541 68.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 100 12.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 32 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 85 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 274 34.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 2.1 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 4 4 9 9 0 0 3 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 12 8 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 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 3 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 11 A T 0 0 172 0, 0.0 189,-0.1 0, 0.0 188,-0.1 0.000 360.0 360.0 360.0 114.9 46.9 1.5 68.7 2 12 A A - 0 0 18 187,-0.3 2,-0.7 1,-0.1 133,-0.0 -0.225 360.0-100.6 -77.9 159.2 43.5 3.4 68.5 3 13 A R + 0 0 174 2,-0.1 2,-0.3 132,-0.0 134,-0.2 -0.621 58.1 147.6 -83.4 114.9 42.6 6.5 66.3 4 14 A V - 0 0 17 -2,-0.7 2,-1.3 132,-0.1 135,-0.1 -0.994 55.1-118.9-143.0 145.0 42.7 9.6 68.4 5 15 A K - 0 0 37 133,-0.5 3,-0.4 -2,-0.3 2,-0.1 -0.707 51.0-172.1 -86.8 94.6 43.7 13.2 67.7 6 16 A R + 0 0 102 -2,-1.3 196,-0.1 1,-0.2 134,-0.0 -0.397 47.8 12.1 -92.3 154.4 46.5 13.3 70.2 7 17 A G S S+ 0 0 48 -2,-0.1 3,-0.4 1,-0.1 -1,-0.2 0.702 75.0 131.0 59.1 33.8 48.7 16.2 71.5 8 18 A M S S+ 0 0 63 -3,-0.4 -1,-0.1 131,-0.4 -2,-0.1 0.481 71.9 41.0 -99.5 4.3 46.7 19.1 70.1 9 19 A A >> + 0 0 2 130,-0.1 3,-2.2 1,-0.1 4,-0.8 0.107 67.2 126.2-136.5 24.9 46.4 21.2 73.3 10 20 A E G >4 S+ 0 0 101 -3,-0.4 3,-0.6 1,-0.3 -2,-0.1 0.826 75.9 55.0 -56.9 -33.5 49.9 21.0 74.8 11 21 A M G 34 S+ 0 0 126 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.549 104.7 54.1 -77.7 -13.4 50.3 24.8 75.0 12 22 A L G X4 S+ 0 0 0 -3,-2.2 3,-1.6 3,-0.1 -1,-0.2 0.657 80.1 115.5 -92.5 -16.4 47.0 25.1 76.9 13 23 A K T << S+ 0 0 76 -4,-0.8 213,-0.2 -3,-0.6 3,-0.1 -0.244 80.0 20.1 -58.8 133.1 48.0 22.7 79.8 14 24 A G T 3 S+ 0 0 37 211,-3.5 -1,-0.3 1,-0.3 212,-0.2 0.467 111.6 108.1 93.1 2.1 48.3 24.4 83.2 15 25 A G < - 0 0 6 -3,-1.6 212,-2.5 210,-0.5 2,-0.4 -0.548 65.5-117.9-117.9 176.1 46.2 27.3 82.0 16 26 A V E -a 227 0A 1 17,-0.3 19,-2.5 210,-0.2 20,-1.1 -0.931 15.5-156.3-112.8 133.2 42.9 29.2 82.1 17 27 A I E -ab 228 36A 0 210,-2.9 212,-3.1 -2,-0.4 2,-0.5 -0.945 17.9-158.3-107.7 124.2 40.6 29.7 79.2 18 28 A M E -ab 229 37A 0 18,-1.6 20,-2.2 -2,-0.5 2,-0.2 -0.897 16.0-126.9-111.1 132.5 38.3 32.7 79.6 19 29 A D E - b 0 38A 12 210,-2.5 2,-0.4 -2,-0.5 20,-0.2 -0.502 32.2-174.2 -65.7 138.2 35.0 33.5 78.0 20 30 A V E - b 0 39A 0 18,-2.7 20,-2.3 -2,-0.2 45,-0.1 -0.992 25.2-176.5-139.2 136.2 35.1 37.1 76.3 21 31 A V S S+ 0 0 42 -2,-0.4 -1,-0.1 18,-0.2 18,-0.1 0.582 75.5 34.0-107.4 -7.5 32.2 39.0 74.7 22 32 A T S > S- 0 0 54 1,-0.1 4,-2.5 42,-0.0 5,-0.1 -0.924 81.3-112.4-145.1 154.8 34.4 42.1 73.6 23 33 A P H > S+ 0 0 50 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.877 118.8 56.7 -57.6 -32.5 38.0 42.8 72.3 24 34 A E H > S+ 0 0 124 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.941 106.5 46.8 -65.2 -46.8 38.5 44.7 75.6 25 35 A Q H > S+ 0 0 36 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.941 111.1 54.6 -58.2 -43.0 37.6 41.6 77.7 26 36 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.907 108.0 47.7 -58.1 -42.4 39.9 39.7 75.4 27 37 A R H X S+ 0 0 134 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.939 111.8 49.9 -64.6 -43.9 42.9 42.1 76.2 28 38 A I H X S+ 0 0 19 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.937 110.9 50.8 -59.0 -46.1 42.2 41.9 79.9 29 39 A A H <>S+ 0 0 0 -4,-2.9 5,-2.3 1,-0.2 4,-0.5 0.929 112.4 44.2 -53.0 -49.9 42.2 38.1 79.7 30 40 A E H ><5S+ 0 0 58 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.904 112.6 53.3 -67.7 -36.9 45.5 38.0 77.8 31 41 A G H 3<5S+ 0 0 72 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.888 104.9 56.3 -63.1 -35.1 47.0 40.6 80.2 32 42 A A T 3<5S- 0 0 16 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.593 126.4-101.3 -75.6 -8.3 46.0 38.4 83.2 33 43 A G T < 5 + 0 0 40 -3,-1.1 -17,-0.3 -4,-0.5 -3,-0.2 0.592 60.2 168.3 93.1 16.3 47.9 35.5 81.7 34 44 A A < - 0 0 6 -5,-2.3 -17,-0.2 -6,-0.2 -1,-0.2 -0.218 33.1-143.3 -48.2 140.9 45.0 33.4 80.2 35 45 A V S S- 0 0 34 -19,-2.5 2,-0.3 1,-0.3 -18,-0.2 0.671 77.1 -11.2 -85.1 -17.1 46.2 30.7 77.9 36 46 A A E -b 17 0A 0 -20,-1.1 -18,-1.6 35,-0.2 2,-0.3 -0.948 65.2-129.2-165.5 165.3 43.3 31.2 75.4 37 47 A V E -bc 18 73A 0 35,-1.9 37,-3.0 -2,-0.3 2,-0.6 -0.922 10.4-139.0-123.5 158.9 40.0 33.0 75.1 38 48 A M E -bc 19 74A 0 -20,-2.2 -18,-2.7 -2,-0.3 2,-0.4 -0.967 22.5-144.7-115.5 110.9 36.5 31.7 74.1 39 49 A A E +bc 20 75A 0 35,-2.9 37,-0.6 -2,-0.6 2,-0.3 -0.633 31.6 155.7 -73.5 127.1 34.7 34.2 71.9 40 50 A L - 0 0 6 -20,-2.3 3,-0.1 -2,-0.4 16,-0.1 -0.986 41.7-144.5-153.5 146.2 31.0 34.5 72.4 41 51 A E S S+ 0 0 97 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.800 89.7 22.9 -74.8 -36.7 28.3 37.0 71.9 42 52 A R S S- 0 0 68 3,-0.0 -1,-0.2 2,-0.0 5,-0.1 -0.995 84.6-116.7-141.2 141.3 26.1 36.2 74.9 43 53 A V > - 0 0 16 -2,-0.4 4,-1.7 -3,-0.1 3,-0.3 -0.110 18.1-117.1 -82.8 160.3 27.1 34.5 78.1 44 54 A P H > S+ 0 0 14 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.842 119.0 53.8 -56.1 -36.2 26.0 31.1 79.9 45 55 A A H > S+ 0 0 36 2,-0.2 4,-0.9 1,-0.2 -2,-0.0 0.796 113.8 41.6 -62.8 -35.4 24.6 33.2 82.8 46 56 A D H >>S+ 0 0 86 -3,-0.3 4,-2.7 2,-0.2 5,-0.5 0.647 113.9 52.8 -80.7 -26.7 22.4 35.3 80.2 47 57 A I H X5S+ 0 0 26 -4,-1.7 4,-1.1 2,-0.2 -2,-0.2 0.937 113.4 42.5 -70.6 -51.2 21.5 32.1 78.2 48 58 A R H <5S+ 0 0 144 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.866 120.2 46.0 -60.5 -42.7 20.3 30.4 81.4 49 59 A A H <5S+ 0 0 81 -4,-0.9 -2,-0.2 -5,-0.2 -1,-0.2 0.867 128.6 17.7 -68.8 -43.1 18.6 33.7 82.4 50 60 A Q H <5S- 0 0 167 -4,-2.7 -3,-0.2 1,-0.1 -2,-0.1 0.892 81.1-169.2 -97.5 -46.9 16.9 34.6 79.0 51 61 A G << + 0 0 25 -4,-1.1 2,-0.2 -5,-0.5 -1,-0.1 -0.513 29.6 131.2 79.0-160.6 16.6 31.6 76.8 52 62 A G S S- 0 0 66 -2,-0.1 2,-0.4 2,-0.1 363,-0.1 -0.423 79.4 -43.1 87.8-179.1 15.6 31.7 73.1 53 63 A V - 0 0 26 361,-0.2 2,-0.5 -2,-0.2 49,-0.1 -0.705 56.3-154.1 -90.2 136.3 17.9 29.8 70.7 54 64 A S + 0 0 5 -2,-0.4 49,-1.8 47,-0.1 2,-0.2 -0.934 23.9 167.6-106.3 126.8 21.7 30.1 71.2 55 65 A R - 0 0 71 -2,-0.5 21,-0.1 1,-0.2 3,-0.1 -0.566 44.3 -53.1-126.6-179.9 23.8 29.6 68.1 56 66 A M S S- 0 0 24 -2,-0.2 -1,-0.2 1,-0.1 21,-0.1 -0.257 70.2-103.4 -48.1 143.1 27.4 30.1 66.7 57 67 A S - 0 0 12 19,-0.4 -1,-0.1 -18,-0.2 5,-0.1 -0.425 44.8 -80.3 -72.9 154.4 28.4 33.7 67.2 58 68 A D >> - 0 0 59 1,-0.2 4,-2.0 -2,-0.1 3,-0.7 -0.264 39.8-129.6 -50.5 128.1 28.5 36.2 64.3 59 69 A P H 3> S+ 0 0 2 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.770 107.1 56.3 -56.1 -29.3 31.7 35.6 62.5 60 70 A D H 3> S+ 0 0 81 2,-0.2 4,-2.1 468,-0.2 5,-0.1 0.885 105.5 52.6 -68.2 -41.6 32.6 39.4 62.6 61 71 A M H <> S+ 0 0 37 -3,-0.7 4,-1.5 1,-0.2 -1,-0.2 0.961 111.7 45.7 -58.4 -49.3 32.4 39.3 66.4 62 72 A I H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.908 110.5 51.8 -59.6 -44.6 34.7 36.3 66.5 63 73 A E H X S+ 0 0 60 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.853 103.9 59.7 -63.0 -33.9 37.2 37.9 64.0 64 74 A G H X S+ 0 0 29 -4,-2.1 4,-1.1 1,-0.2 -1,-0.2 0.885 108.0 45.5 -58.8 -38.8 37.2 41.0 66.3 65 75 A I H X S+ 0 0 1 -4,-1.5 4,-0.7 1,-0.2 3,-0.5 0.922 109.3 53.2 -74.7 -41.2 38.5 38.8 69.1 66 76 A I H >< S+ 0 0 57 -4,-2.4 3,-0.5 1,-0.2 -1,-0.2 0.860 110.2 49.7 -58.9 -35.4 41.1 37.0 67.0 67 77 A A H 3< S+ 0 0 89 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.749 106.1 58.5 -73.1 -24.9 42.5 40.5 66.0 68 78 A A H 3< S+ 0 0 18 -4,-1.1 2,-0.3 -3,-0.5 -1,-0.2 0.581 108.1 33.5 -85.5 -11.5 42.6 41.7 69.6 69 79 A V << - 0 0 15 -4,-0.7 -42,-0.1 -3,-0.5 4,-0.1 -0.916 56.0-142.7-141.9 166.3 45.0 39.1 71.1 70 80 A T S S+ 0 0 135 -2,-0.3 3,-0.1 2,-0.1 -1,-0.1 0.662 77.5 88.5 -97.9 -24.9 48.0 36.8 70.3 71 81 A I S S- 0 0 34 1,-0.2 -35,-0.2 -37,-0.1 -2,-0.1 -0.336 95.1 -76.0 -78.3 159.9 46.8 33.8 72.3 72 82 A P - 0 0 29 0, 0.0 -35,-1.9 0, 0.0 2,-0.4 -0.086 44.8-146.0 -53.9 146.8 44.6 31.1 70.8 73 83 A V E -c 37 0A 2 -37,-0.2 21,-2.5 19,-0.2 22,-1.1 -0.975 12.6-167.4-120.7 131.3 40.9 31.9 70.3 74 84 A M E -cd 38 95A 0 -37,-3.0 -35,-2.9 -2,-0.4 2,-0.3 -0.800 3.3-172.3-105.7 162.1 38.1 29.3 70.6 75 85 A A E -cd 39 96A 1 20,-1.5 22,-2.5 -2,-0.3 2,-0.2 -0.986 18.6-114.8-152.4 160.8 34.5 29.6 69.6 76 86 A K E - d 0 97A 17 -37,-0.6 -19,-0.4 -2,-0.3 2,-0.3 -0.583 19.8-174.3 -96.7 148.7 31.4 27.5 70.1 77 87 A V E - d 0 98A 0 20,-2.2 22,-2.2 -2,-0.2 25,-0.2 -0.929 37.2 -96.0-129.4 163.2 29.0 25.6 67.8 78 88 A R > - 0 0 0 -2,-0.3 3,-2.4 20,-0.2 7,-0.1 -0.412 54.4 -87.4 -71.6 143.6 25.7 23.8 68.5 79 89 A I T 3 S+ 0 0 20 20,-0.5 26,-2.2 1,-0.3 27,-0.9 -0.388 116.0 8.2 -53.1 129.5 26.0 20.0 69.2 80 90 A G T 3 S+ 0 0 1 25,-0.2 2,-1.8 1,-0.2 -1,-0.3 0.406 90.6 130.9 82.3 -1.1 25.7 18.3 65.8 81 91 A H <> + 0 0 0 -3,-2.4 4,-1.9 1,-0.2 -1,-0.2 -0.552 23.4 167.3 -90.4 77.7 25.9 21.6 63.8 82 92 A F H > S+ 0 0 30 -2,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.783 72.6 55.2 -65.0 -19.6 28.6 20.5 61.4 83 93 A V H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.903 103.1 53.1 -85.9 -37.5 28.0 23.5 59.1 84 94 A E H > S+ 0 0 2 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.937 112.0 48.8 -52.1 -43.1 28.5 26.1 62.0 85 95 A A H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.874 106.5 54.5 -65.0 -39.6 31.9 24.1 62.4 86 96 A Q H X S+ 0 0 33 -4,-1.7 4,-1.3 2,-0.2 -1,-0.2 0.916 111.4 47.0 -56.7 -40.9 32.7 24.4 58.6 87 97 A I H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 3,-0.5 0.944 112.1 48.2 -69.4 -50.7 32.2 28.1 58.9 88 98 A L H X>S+ 0 0 0 -4,-2.7 5,-1.2 1,-0.2 4,-0.7 0.884 105.3 58.5 -58.7 -42.5 34.4 28.4 62.1 89 99 A Q H ><5S+ 0 0 64 -4,-2.7 3,-0.9 1,-0.2 -1,-0.2 0.878 106.2 48.8 -53.9 -40.6 37.2 26.4 60.6 90 100 A T H 3<5S+ 0 0 47 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.769 102.1 64.3 -74.9 -24.6 37.5 28.9 57.7 91 101 A L H 3<5S- 0 0 13 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.648 111.4-122.9 -64.4 -18.9 37.5 31.8 60.2 92 102 A G T <<5 + 0 0 46 -3,-0.9 -19,-0.2 -4,-0.7 -3,-0.2 0.693 48.5 165.3 79.9 22.3 40.8 30.4 61.5 93 103 A V < - 0 0 7 -5,-1.2 -1,-0.2 1,-0.1 -19,-0.2 -0.328 40.0-131.6 -57.4 153.3 39.8 29.9 65.2 94 104 A D S S+ 0 0 72 -21,-2.5 2,-0.3 1,-0.3 -20,-0.2 0.750 82.8 11.1 -83.4 -29.9 42.3 27.7 66.9 95 105 A Y E -d 74 0A 11 -22,-1.1 -20,-1.5 23,-0.1 2,-0.5 -0.991 64.0-142.4-144.1 151.1 39.7 25.3 68.5 96 106 A I E -de 75 120A 0 23,-2.4 25,-2.9 -2,-0.3 2,-0.7 -0.957 12.1-149.6-115.4 137.1 36.0 24.7 68.2 97 107 A D E -de 76 121A 1 -22,-2.5 -20,-2.2 -2,-0.5 2,-1.2 -0.882 5.1-151.8-103.8 113.1 34.0 23.9 71.3 98 108 A E E -de 77 122A 2 23,-2.8 25,-0.6 -2,-0.7 2,-0.5 -0.765 37.6-160.2 -85.3 99.7 31.0 21.6 70.4 99 109 A S > - 0 0 0 -22,-2.2 3,-1.3 -2,-1.2 -20,-0.5 -0.769 44.1-162.3-111.9 129.3 29.1 23.0 73.3 100 110 A E T 3 S+ 0 0 52 -2,-0.5 -1,-0.1 1,-0.3 -22,-0.1 0.583 91.2 76.2 -75.5 -5.3 26.1 21.9 75.3 101 111 A V T 3 S+ 0 0 24 2,-0.1 -1,-0.3 -54,-0.0 2,-0.1 0.826 90.3 64.4 -72.1 -26.4 25.8 25.5 76.5 102 112 A L S < S- 0 0 14 -3,-1.3 -23,-0.2 -25,-0.2 -47,-0.2 -0.456 109.6 -83.7 -89.6 170.4 24.3 26.4 73.1 103 113 A T - 0 0 25 -49,-1.8 -1,-0.1 -2,-0.1 -2,-0.1 -0.601 53.8-112.7 -72.7 122.3 20.9 25.0 71.8 104 114 A P - 0 0 27 0, 0.0 314,-0.3 0, 0.0 3,-0.2 -0.277 23.3-163.8 -58.6 142.2 21.6 21.5 70.3 105 115 A A S S+ 0 0 0 -26,-2.2 2,-0.3 1,-0.3 316,-0.2 0.542 83.5 32.7 -96.3 -16.1 21.1 21.3 66.6 106 116 A D - 0 0 4 -27,-0.9 -1,-0.3 315,-0.1 -25,-0.1 -0.948 64.5-165.4-143.0 115.1 21.0 17.5 66.5 107 117 A Y S S+ 0 0 148 -2,-0.3 3,-0.1 311,-0.3 -1,-0.1 0.637 88.9 32.4 -82.4 -6.0 19.6 15.6 69.5 108 118 A A S S+ 0 0 74 1,-0.2 2,-0.4 -28,-0.0 -1,-0.1 0.777 112.9 47.1-112.2 -43.1 21.0 12.3 68.5 109 119 A H - 0 0 98 -30,-0.1 -1,-0.2 -29,-0.0 2,-0.1 -0.892 60.7-147.9-112.6 139.7 24.3 12.7 66.7 110 120 A H - 0 0 49 -2,-0.4 2,-0.1 1,-0.1 -31,-0.1 -0.444 46.5 -76.8 -87.1 171.1 27.4 14.8 67.5 111 121 A I - 0 0 2 -2,-0.1 2,-1.1 1,-0.1 -1,-0.1 -0.427 40.8-119.1 -66.4 139.6 29.6 16.3 64.7 112 122 A D > - 0 0 82 1,-0.2 3,-1.5 -32,-0.1 25,-0.1 -0.721 33.1-170.0 -74.4 103.4 31.9 13.8 63.0 113 123 A K G > S+ 0 0 0 23,-1.7 3,-1.1 -2,-1.1 24,-0.2 0.603 71.2 77.4 -86.5 -4.9 35.0 15.7 64.0 114 124 A W G 3 S+ 0 0 54 22,-0.6 -1,-0.3 1,-0.2 23,-0.1 0.637 81.2 71.8 -71.7 -15.2 37.3 13.7 61.8 115 125 A N G < S+ 0 0 119 -3,-1.5 2,-0.3 2,-0.0 -1,-0.2 0.296 94.3 71.7 -82.0 7.3 36.0 15.7 58.8 116 126 A F < - 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