==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-SEP-07 2R9Z . COMPND 2 MOLECULE: GLUTATHIONE AMIDE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MARICHROMATIUM GRACILE; . AUTHOR F.VAN PETEGEM,B.VERGAUWEN,S.SAVVIDES,D.DE VOS,J.VAN BEEUMEN . 904 4 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34615.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 623 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 76 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 124 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 . 1 0.1 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 . 67 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 226 25.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.0 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 3 2 4 1 3 0 0 0 4 1 1 0 2 0 0 2 0 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 4 6 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 0 PARALLEL BRIDGES PER LADDER . 9 2 5 4 2 1 2 2 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 . 2 5 0 2 2 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 2 A T 0 0 100 0, 0.0 126,-1.6 0, 0.0 127,-0.0 0.000 360.0 360.0 360.0 -4.5 7.1 9.3 139.5 2 3 A Q + 0 0 60 124,-0.2 124,-0.1 116,-0.0 126,-0.0 0.198 360.0 81.3-163.2 -3.0 10.5 7.6 138.8 3 4 A H + 0 0 106 125,-0.1 2,-0.2 3,-0.0 25,-0.2 0.220 63.6 121.5 -99.2 12.2 9.4 4.8 136.4 4 5 A F E -a 128 0A 13 123,-0.9 125,-1.6 1,-0.2 25,-0.2 -0.563 52.1-158.0 -73.8 135.8 9.5 7.2 133.4 5 6 A D E S+ 0 0 36 23,-2.1 125,-1.6 1,-0.3 2,-0.4 0.840 81.0 24.6 -68.7 -41.6 11.8 6.2 130.6 6 7 A L E -ab 130 29A 0 22,-2.0 24,-3.2 123,-0.2 2,-0.5 -0.986 52.5-171.6-136.0 133.1 11.7 9.9 129.5 7 8 A I E -ab 131 30A 0 123,-2.7 125,-3.5 -2,-0.4 2,-0.7 -0.990 14.2-165.1-110.3 120.4 11.2 13.3 130.9 8 9 A A E -ab 132 31A 0 22,-2.8 24,-3.1 -2,-0.5 2,-0.8 -0.931 8.8-152.6-100.0 118.3 11.1 16.0 128.2 9 10 A I E +ab 133 32A 7 123,-3.4 125,-2.7 -2,-0.7 24,-0.1 -0.831 69.9 26.9 -89.4 110.8 11.4 19.5 129.7 10 11 A G - 0 0 10 22,-3.0 23,-0.2 -2,-0.8 22,-0.1 0.273 66.6-136.8 106.1 125.1 9.6 21.9 127.4 11 12 A G + 0 0 0 4,-0.2 27,-2.7 25,-0.1 28,-0.5 -0.260 68.2 108.3-106.7 43.7 6.7 21.1 125.1 12 13 A G S > S- 0 0 10 122,-0.5 4,-2.4 26,-0.2 5,-0.3 -0.081 93.1 -55.9 -96.9-158.6 8.0 23.1 122.1 13 14 A S H > S+ 0 0 24 25,-0.3 4,-1.4 1,-0.2 5,-0.1 0.881 135.6 37.8 -49.9 -52.6 9.5 21.9 118.8 14 15 A G H > S+ 0 0 5 2,-0.2 4,-2.4 3,-0.1 5,-0.2 0.918 117.2 47.0 -68.0 -50.9 12.2 19.7 120.4 15 16 A G H > S+ 0 0 0 119,-0.4 4,-2.9 2,-0.2 5,-0.2 0.913 112.9 49.6 -58.3 -47.4 10.4 18.3 123.4 16 17 A L H X S+ 0 0 7 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.900 111.6 50.6 -56.7 -45.0 7.3 17.4 121.5 17 18 A A H X S+ 0 0 3 -4,-1.4 4,-2.1 -5,-0.3 5,-0.2 0.915 115.1 40.2 -62.9 -48.9 9.4 15.6 118.9 18 19 A V H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.928 118.2 48.0 -65.0 -45.6 11.4 13.5 121.4 19 20 A A H X S+ 0 0 0 -4,-2.9 4,-3.1 -5,-0.2 5,-0.2 0.951 113.7 47.5 -60.3 -50.2 8.3 12.8 123.5 20 21 A E H X S+ 0 0 31 -4,-2.9 4,-2.0 -5,-0.2 -1,-0.2 0.922 115.5 43.3 -57.1 -49.6 6.2 11.8 120.5 21 22 A K H X S+ 0 0 58 -4,-2.1 4,-1.2 -5,-0.2 -1,-0.2 0.900 115.8 48.5 -68.0 -42.6 8.8 9.5 119.0 22 23 A A H <>S+ 0 0 0 -4,-2.8 5,-2.1 -5,-0.2 3,-0.4 0.919 111.4 49.9 -61.7 -43.7 9.7 7.9 122.4 23 24 A A H ><5S+ 0 0 16 -4,-3.1 3,-1.5 -5,-0.3 -2,-0.2 0.893 107.6 55.5 -63.1 -33.9 5.9 7.4 123.1 24 25 A A H 3<5S+ 0 0 71 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.759 100.2 58.3 -69.4 -26.6 5.7 5.8 119.7 25 26 A F T 3<5S- 0 0 50 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.194 127.2-101.6 -82.6 16.3 8.4 3.3 120.6 26 27 A G T < 5S+ 0 0 68 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.2 0.684 74.3 147.9 74.4 21.3 6.2 2.2 123.5 27 28 A K < - 0 0 76 -5,-2.1 2,-0.6 -6,-0.1 -1,-0.2 -0.487 54.3-112.9 -89.1 159.0 8.1 4.2 126.2 28 29 A R - 0 0 124 -25,-0.2 -23,-2.1 -2,-0.1 -22,-2.0 -0.841 44.7-173.5 -92.8 117.6 6.7 5.8 129.3 29 30 A V E -b 6 0A 3 -2,-0.6 76,-3.3 74,-0.3 2,-0.4 -0.939 23.1-165.2-125.9 132.3 7.0 9.5 128.8 30 31 A A E -bc 7 105A 0 -24,-3.2 -22,-2.8 -2,-0.4 2,-0.5 -0.951 11.9-162.6-108.9 134.7 6.5 12.6 131.0 31 32 A L E -bc 8 106A 0 74,-3.0 76,-3.0 -2,-0.4 2,-0.5 -0.974 3.3-157.9-118.5 123.0 6.3 16.0 129.2 32 33 A I E +bc 9 107A 2 -24,-3.1 -22,-3.0 -2,-0.5 2,-0.3 -0.868 17.6 167.7-102.7 132.8 6.8 19.2 131.3 33 34 A E E - c 0 108A 18 74,-2.4 76,-1.9 -2,-0.5 77,-0.1 -0.945 23.2-170.4-147.5 124.2 5.4 22.5 130.0 34 35 A S S S+ 0 0 68 -2,-0.3 76,-0.2 74,-0.3 -1,-0.1 0.697 83.2 7.6 -83.3 -24.5 5.0 25.8 131.8 35 36 A K S S- 0 0 175 1,-0.2 2,-0.4 74,-0.1 -2,-0.1 0.275 113.7 -20.2-123.6-110.9 3.0 27.6 129.1 36 37 A A > - 0 0 39 1,-0.0 3,-1.5 -2,-0.0 -1,-0.2 -0.881 57.9-111.1-118.2 141.5 1.5 26.3 125.8 37 38 A L T 3 S+ 0 0 0 -2,-0.4 -25,-0.2 1,-0.2 59,-0.1 -0.361 101.9 49.5 -62.0 146.4 2.3 23.2 123.7 38 39 A G T 3> S- 0 0 1 -27,-2.7 4,-1.7 -26,-0.1 3,-0.4 0.100 93.7-145.4 106.3 -18.1 3.9 24.0 120.4 39 40 A G H <> - 0 0 17 -3,-1.5 4,-1.7 -28,-0.5 5,-0.4 -0.109 54.6 -28.3 60.5-154.1 6.4 26.3 122.0 40 41 A T H >>S+ 0 0 49 3,-0.2 4,-2.0 1,-0.2 5,-0.5 0.868 134.0 59.0 -61.6 -40.2 7.7 29.4 120.3 41 42 A a H >5S+ 0 0 6 -3,-0.4 6,-2.1 4,-0.2 4,-0.8 0.947 113.2 33.9 -62.4 -53.1 7.2 28.2 116.8 42 43 A V H <5S+ 0 0 12 -4,-1.7 -1,-0.2 4,-0.2 -2,-0.2 0.889 129.8 32.6 -65.3 -44.6 3.4 27.5 117.0 43 44 A N H <5S- 0 0 39 -4,-1.7 -3,-0.2 -7,-0.1 -2,-0.2 0.869 139.8 -0.8 -89.8 -43.8 2.5 30.4 119.4 44 45 A V H <5S+ 0 0 42 -4,-2.0 -3,-0.2 -5,-0.4 -2,-0.1 0.070 122.8 46.0-138.3 25.6 4.8 33.3 118.8 45 46 A G S X S+ 0 0 22 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.831 124.6 48.3 -42.6 -51.2 7.1 30.5 112.6 47 48 A V H > S+ 0 0 5 -6,-2.1 4,-2.5 2,-0.2 5,-0.2 0.970 114.3 39.4 -70.9 -57.4 3.4 30.0 112.3 48 49 A P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.922 117.5 53.3 -58.9 -39.4 2.0 33.5 113.2 49 50 A K H X S+ 0 0 22 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.937 110.8 44.8 -55.4 -49.4 4.8 35.0 111.2 50 51 A K H X S+ 0 0 1 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.867 110.6 54.5 -68.1 -36.9 4.0 33.0 108.1 51 52 A V H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.971 112.4 43.3 -58.2 -52.1 0.3 33.6 108.4 52 53 A M H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.861 109.0 59.4 -61.8 -34.9 1.0 37.4 108.5 53 54 A W H X S+ 0 0 9 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.898 102.2 53.2 -59.8 -42.6 3.5 36.9 105.6 54 55 A Y H X S+ 0 0 6 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.942 107.3 50.8 -56.3 -48.3 0.7 35.5 103.5 55 56 A A H X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.928 112.5 47.2 -51.8 -47.5 -1.4 38.6 104.2 56 57 A S H X S+ 0 0 2 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.859 111.1 51.1 -61.6 -39.2 1.6 40.7 103.2 57 58 A H H X S+ 0 0 52 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.842 111.4 48.2 -66.3 -38.7 2.1 38.6 100.0 58 59 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.864 106.9 55.6 -74.2 -35.4 -1.6 39.1 99.1 59 60 A A H X S+ 0 0 17 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.893 110.9 45.9 -59.1 -41.4 -1.3 42.9 99.7 60 61 A E H X S+ 0 0 48 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.935 108.6 55.1 -66.9 -47.4 1.5 42.9 97.2 61 62 A A H X S+ 0 0 3 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.882 109.3 47.9 -49.3 -44.8 -0.4 40.7 94.8 62 63 A V H < S+ 0 0 12 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.878 109.6 53.0 -68.5 -35.9 -3.3 43.3 94.9 63 64 A R H < S+ 0 0 184 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.854 116.8 39.2 -55.1 -39.2 -0.8 46.1 94.3 64 65 A D H >X S+ 0 0 20 -4,-2.0 4,-0.8 1,-0.2 3,-0.6 0.590 92.7 88.4 -95.0 -17.6 0.5 44.3 91.2 65 66 A A G ><>S+ 0 0 0 -4,-1.3 5,-2.5 1,-0.2 3,-0.9 0.835 81.4 55.3 -54.3 -47.5 -2.8 43.0 89.9 66 67 A P G >45S+ 0 0 50 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.819 98.4 63.5 -61.5 -31.0 -3.8 46.0 87.7 67 68 A G G <45S+ 0 0 18 -3,-0.6 -2,-0.2 1,-0.3 471,-0.1 0.845 106.0 45.9 -58.4 -35.3 -0.5 45.8 85.8 68 69 A F G <<5S- 0 0 0 -3,-0.9 -1,-0.3 -4,-0.8 -3,-0.1 0.264 129.0 -99.0 -88.3 9.3 -1.7 42.4 84.6 69 70 A G T < 5S+ 0 0 4 -3,-1.8 462,-3.8 1,-0.2 2,-0.7 0.547 84.5 129.5 87.3 6.3 -5.2 43.7 83.7 70 71 A V B < -F 530 0B 2 -5,-2.5 -1,-0.2 460,-0.2 460,-0.2 -0.866 56.0-132.5-100.1 113.8 -6.8 42.5 87.0 71 72 A Q + 0 0 44 458,-2.4 2,-0.3 -2,-0.7 456,-0.2 -0.338 36.2 168.3 -60.9 142.7 -8.8 45.2 88.8 72 73 A A 0 0 22 1,-0.1 453,-0.1 454,-0.1 452,-0.0 -0.987 360.0 360.0-154.5 160.8 -8.1 45.4 92.6 73 74 A S 0 0 107 -2,-0.3 -1,-0.1 442,-0.1 452,-0.1 0.349 360.0 360.0 45.4 360.0 -8.6 47.5 95.9 74 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 75 78 A L 0 0 64 0, 0.0 2,-1.0 0, 0.0 448,-0.2 0.000 360.0 360.0 360.0 119.8 -5.3 46.0 105.9 76 79 A D > - 0 0 87 446,-3.1 4,-2.1 1,-0.2 5,-0.1 -0.872 360.0-174.4 -90.8 93.2 -7.9 45.2 108.6 77 80 A W H > S+ 0 0 3 -2,-1.0 4,-3.2 1,-0.2 5,-0.2 0.892 78.3 56.4 -65.8 -43.9 -5.3 44.2 111.2 78 81 A P H > S+ 0 0 53 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.913 108.8 49.5 -51.4 -39.9 -7.9 43.1 113.8 79 82 A R H > S+ 0 0 85 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.934 111.2 47.3 -67.6 -45.2 -9.2 40.7 111.2 80 83 A L H X S+ 0 0 0 -4,-2.1 4,-3.2 2,-0.2 5,-0.2 0.964 113.4 49.6 -53.9 -52.9 -5.7 39.4 110.3 81 84 A V H X S+ 0 0 3 -4,-3.2 4,-2.4 1,-0.2 -2,-0.2 0.921 112.0 48.4 -53.6 -49.0 -5.0 39.0 114.1 82 85 A A H X S+ 0 0 53 -4,-2.8 4,-1.7 2,-0.2 -1,-0.2 0.886 114.9 43.0 -58.9 -48.8 -8.3 37.1 114.6 83 86 A G H X S+ 0 0 4 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.937 114.9 50.6 -65.2 -46.8 -7.8 34.7 111.7 84 87 A R H X S+ 0 0 5 -4,-3.2 4,-2.6 -5,-0.3 -2,-0.2 0.913 111.4 47.9 -52.1 -47.0 -4.2 34.1 112.6 85 88 A D H X S+ 0 0 73 -4,-2.4 4,-3.0 -5,-0.2 -1,-0.2 0.863 110.7 50.7 -68.3 -38.0 -5.0 33.4 116.3 86 89 A R H X S+ 0 0 208 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.901 111.6 48.2 -65.5 -43.4 -7.8 30.9 115.4 87 90 A Y H X S+ 0 0 64 -4,-2.3 4,-1.3 2,-0.2 -2,-0.2 0.941 114.8 45.0 -60.8 -48.3 -5.4 29.1 113.1 88 91 A I H X S+ 0 0 11 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.898 109.0 58.7 -60.8 -43.6 -2.7 29.0 115.8 89 92 A G H X S+ 0 0 26 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.912 102.4 52.3 -52.3 -47.4 -5.3 27.9 118.3 90 93 A A H X S+ 0 0 63 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.863 108.4 50.3 -64.9 -35.8 -6.2 24.8 116.3 91 94 A I H X S+ 0 0 40 -4,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.943 111.2 49.3 -64.6 -45.9 -2.6 23.8 116.2 92 95 A N H X S+ 0 0 30 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.928 112.0 48.7 -52.0 -48.2 -2.4 24.2 119.9 93 96 A S H X S+ 0 0 78 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.880 108.1 54.3 -65.4 -41.5 -5.5 22.1 120.3 94 97 A F H X S+ 0 0 105 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.936 111.1 44.9 -52.5 -51.1 -4.2 19.4 118.0 95 98 A W H X S+ 0 0 47 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.893 109.6 55.2 -69.0 -36.9 -1.0 19.1 120.1 96 99 A D H X S+ 0 0 67 -4,-2.6 4,-1.3 -5,-0.2 -1,-0.2 0.933 114.9 39.3 -57.8 -45.8 -2.9 19.1 123.4 97 100 A G H X S+ 0 0 35 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.850 115.0 53.2 -72.2 -34.5 -5.1 16.2 122.2 98 101 A Y H X S+ 0 0 45 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.930 105.2 52.9 -69.7 -43.7 -2.3 14.4 120.5 99 102 A V H <>S+ 0 0 6 -4,-2.8 5,-1.9 1,-0.2 4,-0.4 0.917 114.2 44.3 -56.0 -41.6 -0.1 14.4 123.6 100 103 A E H ><5S+ 0 0 160 -4,-1.3 3,-1.1 -5,-0.2 -2,-0.2 0.898 110.8 54.5 -65.4 -44.2 -3.1 12.8 125.4 101 104 A R H 3<5S+ 0 0 210 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.888 105.3 54.1 -57.2 -42.6 -3.7 10.4 122.5 102 105 A L T 3<5S- 0 0 44 -4,-2.8 -1,-0.2 -5,-0.1 -2,-0.2 0.546 113.2-117.5 -71.4 -11.2 -0.0 9.2 122.8 103 106 A G T < 5 + 0 0 61 -3,-1.1 -74,-0.3 -4,-0.4 2,-0.2 0.666 58.6 157.5 83.6 17.4 -0.4 8.4 126.5 104 107 A I < - 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0 0 52 -3,-1.5 29,-1.8 1,-0.2 -3,-0.2 0.914 27.5-164.7 48.2 51.2 33.2 22.2 91.9 396 399 A R E < -UT 423 391G 112 -5,-2.1 -5,-2.2 27,-0.3 2,-0.8 -0.442 26.2-113.7 -57.0 132.2 31.2 20.5 94.7 397 400 A V E + T 0 390G 3 25,-3.2 -7,-0.3 -7,-0.2 25,-0.1 -0.657 45.6 165.5 -78.1 112.2 28.3 22.7 95.5 398 401 A V E + 0 0 10 -9,-2.9 -48,-2.7 -2,-0.8 2,-0.3 0.640 64.3 23.8-103.6 -19.0 28.9 24.0 99.1 399 402 A G E -QT 349 389G 0 -10,-2.1 -10,-3.2 -50,-0.3 2,-0.4 -0.972 54.2-168.9-149.3 136.0 26.3 26.9 99.2 400 403 A V E -QT 348 388G 0 -52,-2.9 -52,-1.8 -2,-0.3 2,-0.4 -0.997 17.3-178.1-121.8 126.6 23.1 27.7 97.3 401 404 A H E +QT 347 387G 1 -14,-2.3 -14,-2.2 -2,-0.4 2,-0.3 -0.991 6.3 165.6-134.5 127.8 21.7 31.2 97.8 402 405 A V E +QT 346 386G 0 -56,-2.6 -56,-3.2 -2,-0.4 2,-0.4 -0.999 12.4 177.5-146.6 138.8 18.5 32.8 96.5 403 406 A I E +QT 345 385G 0 -18,-1.9 -18,-2.3 -2,-0.3 2,-0.3 -0.976 47.4 60.8-138.0 129.6 16.4 35.9 97.1 404 407 A G S > S- 0 0 1 -60,-2.8 3,-2.0 -2,-0.4 4,-0.2 -0.828 87.9 -15.7 145.4-178.3 13.3 36.7 95.0 405 408 A D T 3 S+ 0 0 19 -2,-0.3 32,-0.1 1,-0.3 -2,-0.1 -0.169 126.3 12.0 -54.5 135.9 9.9 35.4 94.1 406 409 A G T > S+ 0 0 14 1,-0.1 3,-1.8 31,-0.1 4,-0.5 0.340 86.7 123.9 78.5 -7.2 9.3 31.6 94.8 407 410 A A G X> + 0 0 0 -3,-2.0 3,-0.7 -63,-0.3 4,-0.7 0.779 63.1 66.7 -57.5 -26.3 12.5 31.4 96.9 408 411 A D G 34 S+ 0 0 17 1,-0.2 -1,-0.3 -4,-0.2 -3,-0.1 0.669 112.7 29.3 -71.5 -18.2 10.4 30.1 99.9 409 412 A E G <4 S+ 0 0 6 -3,-1.8 -1,-0.2 482,-0.1 -2,-0.2 0.260 106.0 82.4-116.5 9.7 9.6 26.8 98.1 410 413 A M T <4 S+ 0 0 0 -3,-0.7 4,-0.5 -4,-0.5 458,-0.5 0.862 83.7 44.6 -87.2 -39.2 12.7 26.5 95.9 411 414 A L S X S+ 0 0 0 -4,-0.7 4,-2.1 1,-0.2 5,-0.2 0.483 78.8 89.7 -99.4 -5.7 15.6 25.0 97.9 412 415 A Q H > S+ 0 0 1 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.929 98.3 43.3 -55.3 -46.4 14.2 22.0 99.9 413 416 A G H > S+ 0 0 0 452,-0.5 4,-1.7 -3,-0.3 3,-0.4 0.914 111.8 52.9 -62.5 -46.9 15.1 19.8 96.9 414 417 A F H > S+ 0 0 0 -4,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.800 103.3 59.2 -58.7 -31.5 18.5 21.5 96.4 415 418 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.876 103.3 51.5 -64.4 -38.3 19.2 20.8 100.0 416 419 A V H X S+ 0 0 0 -4,-1.2 4,-1.6 -3,-0.4 -2,-0.2 0.921 111.8 47.0 -61.2 -47.3 18.8 17.0 99.3 417 420 A A H <>S+ 0 0 0 -4,-1.7 5,-1.9 2,-0.2 -2,-0.2 0.908 111.8 49.2 -60.9 -47.6 21.2 17.3 96.4 418 421 A V H ><5S+ 0 0 6 -4,-2.5 3,-1.6 3,-0.2 -2,-0.2 0.886 108.3 54.1 -59.5 -41.9 23.8 19.3 98.5 419 422 A K H 3<5S+ 0 0 47 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.891 106.2 54.5 -58.1 -35.9 23.5 16.7 101.3 420 423 A M T 3<5S- 0 0 45 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.444 125.3-105.3 -79.4 1.8 24.3 14.1 98.6 421 424 A G T < 5 - 0 0 33 -3,-1.6 -3,-0.2 1,-0.1 -2,-0.1 0.880 49.3-167.2 73.6 40.9 27.5 16.0 97.6 422 425 A A < - 0 0 0 -5,-1.9 -25,-3.2 -8,-0.1 2,-0.2 -0.260 2.4-156.3 -55.6 141.0 26.1 17.5 94.4 423 426 A T B > -U 396 0G 27 -27,-0.3 4,-1.8 -33,-0.1 -27,-0.3 -0.660 35.5 -99.1-107.9 175.1 28.7 19.1 92.0 424 427 A K H > S+ 0 0 11 -29,-1.8 4,-3.3 -30,-0.4 5,-0.3 0.888 126.1 58.4 -61.1 -38.8 28.1 21.8 89.4 425 428 A A H > S+ 0 0 50 -31,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.886 103.4 52.0 -55.6 -41.0 28.0 18.9 86.8 426 429 A D H 4 S+ 0 0 49 -3,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.925 113.4 44.4 -63.4 -43.1 25.1 17.4 88.8 427 430 A F H >< S+ 0 0 0 -4,-1.8 3,-1.8 1,-0.2 -2,-0.2 0.962 115.2 46.2 -63.9 -53.1 23.3 20.7 88.6 428 431 A D H 3< S+ 0 0 56 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.782 106.7 59.0 -65.4 -29.6 24.1 21.4 84.9 429 432 A N T 3< S+ 0 0 50 -4,-2.1 2,-0.5 -5,-0.3 -1,-0.3 0.495 88.0 93.0 -78.3 -0.9 23.1 17.8 83.9 430 433 A T S < S- 0 0 4 -3,-1.8 441,-0.1 -4,-0.2 2,-0.1 -0.841 83.7-121.0 -94.2 127.1 19.7 18.4 85.3 431 434 A V - 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