==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 25-SEP-01 1K1S . COMPND 2 MOLECULE: DBH PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS; . AUTHOR L.F.SILVIAN,E.A.TOTH,P.PHAM,M.F.GOODMAN,T.ELLENBERGER . 340 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16949.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 253 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 18.2 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 . 2 0.6 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 . 22 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 107 31.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 1 0 2 2 1 0 0 0 0 0 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 PARALLEL BRIDGES PER LADDER . 2 1 0 0 3 1 1 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 . 0 1 1 0 0 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 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 0 103 0, 0.0 2,-0.6 0, 0.0 106,-0.0 0.000 360.0 360.0 360.0 130.6 -3.8 42.4 -17.4 2 2 A I - 0 0 6 2,-0.0 106,-2.5 140,-0.0 107,-0.5 -0.951 360.0-172.4-116.6 115.7 -2.2 39.1 -16.2 3 3 A V E -AB 107 143A 0 140,-2.5 140,-1.8 -2,-0.6 2,-0.5 -0.897 7.7-162.8-111.2 137.2 -0.7 39.1 -12.7 4 4 A I E -AB 106 142A 0 102,-2.7 102,-1.9 -2,-0.4 2,-0.5 -0.975 5.4-161.8-118.9 122.8 1.4 36.3 -11.1 5 5 A F E -AB 105 141A 0 136,-3.1 136,-2.4 -2,-0.5 2,-0.5 -0.910 5.1-168.1-106.9 126.7 1.8 36.2 -7.4 6 6 A V E -AB 104 140A 0 98,-2.1 98,-1.5 -2,-0.5 2,-0.4 -0.964 5.7-179.1-118.3 125.8 4.7 34.1 -6.0 7 7 A D E -AB 103 139A 14 132,-2.6 132,-2.9 -2,-0.5 2,-0.4 -0.982 26.6-129.2-128.2 121.4 4.9 33.4 -2.3 8 8 A F E > - B 0 138A 1 94,-1.8 3,-1.2 -2,-0.4 2,-0.3 -0.541 32.5-116.3 -70.1 119.7 7.8 31.3 -0.8 9 9 A D T 3 S- 0 0 2 128,-1.4 5,-0.3 -2,-0.4 128,-0.2 -0.412 81.9 -34.2 -61.9 118.3 6.2 28.6 1.4 10 10 A Y T >> S- 0 0 22 -2,-0.3 4,-2.1 3,-0.1 3,-1.4 0.805 86.3-169.6 31.1 45.7 7.3 29.1 5.0 11 11 A F H <> S+ 0 0 1 -3,-1.2 4,-2.1 1,-0.3 5,-0.2 0.740 70.8 48.0 -25.9 -72.4 10.5 30.4 3.5 12 12 A F H 3> S+ 0 0 29 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.836 118.5 42.8 -47.8 -39.5 12.9 30.8 6.5 13 13 A A H <> S+ 0 0 0 -3,-1.4 4,-1.0 1,-0.2 -1,-0.2 0.858 111.1 54.5 -77.2 -36.4 12.0 27.3 7.7 14 14 A Q H X S+ 0 0 10 -4,-2.1 4,-0.9 -5,-0.3 -2,-0.2 0.782 105.0 54.2 -69.1 -27.9 12.1 25.7 4.3 15 15 A V H >X S+ 0 0 0 -4,-2.1 4,-1.6 -5,-0.2 3,-0.7 0.925 104.0 53.9 -71.6 -44.1 15.6 26.9 3.7 16 16 A E H 3< S+ 0 0 4 -4,-1.2 4,-0.4 1,-0.3 -1,-0.2 0.780 108.1 52.0 -60.0 -26.6 16.9 25.3 6.9 17 17 A E H 3< S+ 0 0 8 -4,-1.0 7,-0.3 2,-0.2 -1,-0.3 0.760 106.1 53.4 -79.4 -26.5 15.4 22.1 5.6 18 18 A V H << S+ 0 0 43 -4,-0.9 -2,-0.2 -3,-0.7 -1,-0.2 0.754 114.3 41.8 -76.9 -25.0 17.3 22.5 2.3 19 19 A L S < S+ 0 0 72 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.494 126.3 35.3 -97.1 -7.6 20.5 22.9 4.3 20 20 A N >> + 0 0 35 -4,-0.4 3,-2.2 -5,-0.2 4,-0.8 -0.541 65.6 178.4-145.6 71.3 19.5 20.1 6.7 21 21 A P G >4 S+ 0 0 85 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.799 79.8 66.9 -44.7 -36.3 17.6 17.4 4.7 22 22 A Q G 34 S+ 0 0 130 1,-0.3 4,-0.2 -3,-0.1 -5,-0.1 0.859 95.7 55.9 -56.3 -36.2 17.4 15.3 7.9 23 23 A Y G X4 S+ 0 0 64 -3,-2.2 3,-2.4 -7,-0.2 -1,-0.3 0.802 80.1 111.7 -66.2 -29.6 15.1 17.9 9.4 24 24 A K T << S+ 0 0 122 -3,-0.9 -10,-0.0 -4,-0.8 -6,-0.0 -0.252 84.1 20.5 -49.2 114.4 12.8 17.5 6.4 25 25 A G T 3 S+ 0 0 44 1,-0.5 -1,-0.3 -2,-0.1 -2,-0.1 -0.123 104.0 96.1 116.3 -37.0 9.7 16.0 7.8 26 26 A K S < S- 0 0 32 -3,-2.4 2,-1.6 -4,-0.2 -1,-0.5 -0.500 93.1 -85.7 -87.2 157.2 10.1 16.9 11.5 27 27 A P - 0 0 21 0, 0.0 42,-1.8 0, 0.0 2,-0.3 -0.415 54.7-172.6 -63.3 84.8 8.5 20.0 13.2 28 28 A L E -h 69 0B 0 -2,-1.6 16,-1.2 40,-0.2 2,-0.4 -0.598 6.9-173.1 -83.4 142.1 11.1 22.6 12.3 29 29 A V E -hI 70 43B 0 40,-2.4 42,-1.5 -2,-0.3 2,-0.4 -0.872 17.7-144.3-141.8 106.3 10.8 26.1 13.9 30 30 A V E -hI 71 42B 0 12,-1.3 11,-2.5 -2,-0.4 12,-1.6 -0.552 27.9-156.6 -69.9 120.6 13.0 29.1 13.0 31 31 A S E - I 0 40B 4 40,-2.8 9,-0.2 -2,-0.4 2,-0.1 -0.490 17.8-160.6 -97.9 166.5 13.5 31.0 16.2 32 32 A V E + I 0 39B 65 7,-1.5 7,-0.5 -2,-0.2 2,-0.2 -0.607 36.0 133.4-149.4 82.4 14.4 34.7 16.8 33 33 A Y E I 0 38B 129 5,-0.3 5,-0.2 -2,-0.1 40,-0.2 -0.705 360.0 360.0-125.0 176.2 15.9 35.4 20.3 34 34 A S 0 0 137 3,-1.9 3,-0.0 -2,-0.2 -2,-0.0 -0.904 360.0 360.0-172.0 360.0 18.8 37.3 21.8 35 ! 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 36 39 A T 0 0 161 0, 0.0 2,-0.1 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0-158.7 16.4 34.1 27.4 37 40 A S + 0 0 88 -3,-0.0 -3,-1.9 2,-0.0 2,-0.3 -0.504 360.0 100.0 170.8 115.3 13.9 36.1 25.3 38 41 A G E -I 33 0B 31 -5,-0.2 20,-0.5 -2,-0.1 2,-0.3 -0.926 39.6-129.9-174.0-161.4 12.6 35.5 21.8 39 42 A A E -I 32 0B 27 -7,-0.5 -7,-1.5 18,-0.3 2,-0.5 -0.984 35.9 -76.5-166.8 169.4 9.8 34.3 19.6 40 43 A V E +I 31 0B 7 16,-2.5 15,-2.6 -2,-0.3 -9,-0.2 -0.658 36.8 173.7 -80.7 123.4 8.8 32.1 16.6 41 44 A A E - 0 0 29 -11,-2.5 2,-0.3 -2,-0.5 -10,-0.2 0.877 67.2 -9.7 -92.5 -51.3 9.7 33.6 13.3 42 45 A T E -I 30 0B 24 -12,-1.6 -12,-1.3 11,-0.1 -1,-0.4 -0.953 57.7-179.6-145.8 161.9 8.8 30.7 10.9 43 46 A A E -I 29 0B 4 -2,-0.3 -14,-0.2 -14,-0.3 11,-0.1 -0.891 27.8-119.1-165.5 132.1 7.8 27.1 11.2 44 47 A N >> - 0 0 0 -16,-1.2 4,-1.0 -2,-0.3 3,-1.0 -0.033 39.9 -99.0 -64.0 177.9 7.0 24.4 8.6 45 48 A Y H 3> S+ 0 0 55 1,-0.3 4,-2.4 2,-0.2 5,-0.3 0.853 119.9 68.7 -70.2 -35.4 3.6 22.8 8.6 46 49 A E H 34 S+ 0 0 70 1,-0.3 -1,-0.3 -20,-0.2 4,-0.1 0.599 114.3 33.7 -59.4 -6.9 4.7 19.7 10.4 47 50 A A H <4>S+ 0 0 0 -3,-1.0 5,-1.2 -19,-0.1 -1,-0.3 0.538 109.6 64.4-119.7 -21.6 5.1 22.2 13.2 48 51 A R H ><5S+ 0 0 92 -4,-1.0 3,-1.8 1,-0.2 4,-0.4 0.906 98.8 54.4 -70.5 -42.9 2.1 24.5 12.4 49 52 A K T 3<5S+ 0 0 186 -4,-2.4 -1,-0.2 1,-0.3 -3,-0.1 0.873 97.3 64.5 -58.7 -38.7 -0.4 21.7 13.0 50 53 A L T 3 5S- 0 0 74 -5,-0.3 -1,-0.3 1,-0.1 -2,-0.2 0.388 131.8 -93.3 -67.5 7.0 1.0 21.2 16.5 51 54 A G T < 5S+ 0 0 38 -3,-1.8 2,-0.5 1,-0.2 -3,-0.2 0.748 80.8 141.1 88.1 26.8 -0.2 24.7 17.2 52 55 A V < + 0 0 3 -5,-1.2 2,-0.3 -4,-0.4 -1,-0.2 -0.896 18.0 155.5-108.3 126.7 3.0 26.6 16.4 53 56 A K > - 0 0 55 -2,-0.5 3,-1.1 -11,-0.1 -13,-0.3 -0.884 45.1 -75.9-140.6 170.8 2.8 30.0 14.5 54 57 A A T 3 S+ 0 0 74 -2,-0.3 -13,-0.2 1,-0.2 -12,-0.1 -0.393 111.9 28.5 -70.5 144.0 4.7 33.2 14.0 55 58 A G T 3 S+ 0 0 61 -15,-2.6 -1,-0.2 1,-0.3 -14,-0.1 0.109 88.2 128.8 93.4 -21.2 4.7 35.8 16.8 56 59 A M < - 0 0 49 -3,-1.1 -16,-2.5 -16,-0.2 -1,-0.3 -0.535 69.2-107.2 -72.2 124.1 4.3 33.1 19.4 57 60 A P > - 0 0 63 0, 0.0 4,-2.0 0, 0.0 -18,-0.3 -0.197 24.6-120.3 -51.6 137.0 6.8 33.3 22.2 58 61 A I H > S+ 0 0 18 -20,-0.5 4,-3.1 1,-0.2 5,-0.2 0.888 112.8 55.1 -45.6 -47.6 9.4 30.5 22.0 59 62 A I H > S+ 0 0 122 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.943 106.1 48.2 -53.1 -56.3 8.3 29.3 25.4 60 63 A K H 4 S+ 0 0 41 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.854 115.5 47.1 -54.5 -36.9 4.7 28.8 24.5 61 64 A A H >X S+ 0 0 0 -4,-2.0 4,-1.3 2,-0.2 3,-1.3 0.897 110.4 50.4 -72.2 -42.3 5.8 27.0 21.4 62 65 A M H 3< S+ 0 0 82 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.863 107.7 55.5 -63.2 -34.8 8.3 24.8 23.3 63 66 A Q T 3< S+ 0 0 82 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.541 118.8 32.8 -75.2 -7.6 5.5 24.0 25.7 64 67 A I T <4 S+ 0 0 70 -3,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.392 127.9 36.7-125.7 -4.3 3.3 22.8 22.7 65 68 A A >< + 0 0 1 -4,-1.3 3,-1.0 -3,-0.1 -2,-0.1 -0.375 60.4 151.9-147.8 61.0 6.1 21.4 20.5 66 69 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.874 79.8 50.5 -60.4 -40.4 8.8 19.7 22.6 67 70 A S T 3 S+ 0 0 97 2,-0.1 2,-0.1 -3,-0.1 -5,-0.1 0.566 89.1 115.5 -75.8 -7.8 9.8 17.3 19.9 68 71 A A S < S- 0 0 8 -3,-1.0 2,-0.7 -7,-0.1 -40,-0.2 -0.357 71.6-122.3 -66.3 139.9 10.1 20.2 17.5 69 72 A I E -h 28 0B 43 -42,-1.8 -40,-2.4 -46,-0.1 2,-0.5 -0.752 28.4-160.1 -86.3 112.1 13.5 21.0 16.1 70 73 A Y E +h 29 0B 67 -2,-0.7 -40,-0.2 -42,-0.2 -42,-0.1 -0.812 12.1 178.5 -98.6 131.6 14.4 24.6 17.0 71 74 A V E -h 30 0B 12 -42,-1.5 -40,-2.8 -2,-0.5 3,-0.1 -0.991 29.0-114.0-132.0 138.4 17.1 26.5 15.0 72 75 A P - 0 0 72 0, 0.0 2,-0.5 0, 0.0 -40,-0.1 -0.074 43.0 -93.9 -61.0 170.1 18.4 30.1 15.4 73 76 A M - 0 0 70 -40,-0.2 2,-0.5 -43,-0.1 -40,-0.0 -0.793 34.2-178.0 -96.2 127.1 17.7 32.6 12.6 74 77 A R >> + 0 0 108 -2,-0.5 3,-1.4 1,-0.1 4,-1.1 -0.720 8.2 173.4-119.6 76.3 20.4 33.1 10.0 75 78 A K H 3> + 0 0 96 -2,-0.5 4,-3.2 1,-0.3 5,-0.3 0.792 69.9 69.1 -55.9 -35.4 18.8 35.8 7.9 76 79 A P H 3> S+ 0 0 95 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.839 101.8 48.9 -55.8 -29.7 21.9 36.4 5.7 77 80 A I H <> S+ 0 0 42 -3,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.916 111.4 47.0 -74.3 -44.3 21.2 32.9 4.2 78 81 A Y H X S+ 0 0 0 -4,-1.1 4,-3.0 1,-0.2 5,-0.2 0.909 111.2 53.1 -62.7 -42.8 17.5 33.6 3.6 79 82 A E H X S+ 0 0 74 -4,-3.2 4,-2.8 2,-0.2 5,-0.2 0.923 107.3 52.0 -57.6 -46.2 18.5 37.0 2.0 80 83 A A H X S+ 0 0 31 -4,-1.7 4,-2.2 -5,-0.3 -2,-0.2 0.959 112.9 43.3 -55.1 -55.9 20.9 35.2 -0.3 81 84 A F H X S+ 0 0 20 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.903 112.7 54.3 -56.4 -45.0 18.2 32.7 -1.5 82 85 A S H X S+ 0 0 2 -4,-3.0 4,-2.9 1,-0.2 5,-0.2 0.931 108.2 47.9 -56.0 -50.3 15.6 35.5 -1.8 83 86 A N H X S+ 0 0 89 -4,-2.8 4,-2.1 1,-0.2 5,-0.2 0.918 110.7 52.6 -57.5 -46.0 17.9 37.6 -4.0 84 87 A R H X S+ 0 0 115 -4,-2.2 4,-0.8 -5,-0.2 -1,-0.2 0.892 114.8 40.2 -58.3 -44.0 18.6 34.6 -6.2 85 88 A I H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.910 112.1 54.6 -73.9 -43.7 14.9 33.8 -6.7 86 89 A M H X S+ 0 0 9 -4,-2.9 4,-1.7 1,-0.3 -2,-0.2 0.881 110.6 46.0 -57.7 -41.2 13.7 37.4 -7.1 87 90 A N H X S+ 0 0 110 -4,-2.1 4,-0.7 -5,-0.2 -1,-0.3 0.753 109.6 55.8 -72.8 -25.3 16.2 38.0 -9.9 88 91 A L H < S+ 0 0 16 -4,-0.8 3,-0.2 -5,-0.2 -2,-0.2 0.836 110.3 45.6 -73.2 -32.7 15.1 34.7 -11.4 89 92 A L H >< S+ 0 0 0 -4,-1.9 3,-1.4 1,-0.2 4,-0.3 0.795 100.0 70.3 -77.5 -32.3 11.6 36.1 -11.4 90 93 A N H >< S+ 0 0 74 -4,-1.7 3,-0.8 1,-0.3 -1,-0.2 0.796 94.6 53.5 -56.7 -33.6 12.7 39.4 -12.8 91 94 A K T 3< S+ 0 0 106 -4,-0.7 -1,-0.3 -3,-0.2 -2,-0.2 0.628 102.4 60.0 -79.6 -12.3 13.4 38.0 -16.3 92 95 A H T < S+ 0 0 36 -3,-1.4 2,-0.3 -4,-0.2 -1,-0.2 0.427 103.6 52.0 -95.3 0.7 10.0 36.4 -16.5 93 96 A A < - 0 0 10 -3,-0.8 15,-0.2 -4,-0.3 3,-0.1 -0.954 66.8-134.9-141.2 159.8 8.0 39.6 -16.3 94 97 A D S S+ 0 0 40 13,-2.1 2,-0.3 -2,-0.3 14,-0.1 0.843 102.0 15.6 -73.7 -36.7 7.5 43.1 -17.7 95 98 A K E -C 107 0A 88 12,-1.0 12,-2.0 -3,-0.1 2,-0.4 -0.997 69.8-165.0-139.9 140.6 7.2 44.6 -14.2 96 99 A I E -C 106 0A 4 -2,-0.3 2,-0.6 10,-0.2 142,-0.5 -0.996 3.7-165.1-131.8 133.0 8.1 43.0 -10.9 97 100 A E E -C 105 0A 12 8,-2.6 8,-1.5 -2,-0.4 2,-1.1 -0.886 10.3-153.8-120.8 99.6 7.1 44.2 -7.4 98 101 A V E +Cd 104 239A 13 140,-2.0 142,-2.8 -2,-0.6 6,-0.2 -0.600 16.2 177.8 -74.6 100.4 9.1 42.8 -4.5 99 102 A A E - 0 0 28 4,-1.2 2,-0.2 -2,-1.1 5,-0.2 0.890 62.3 -30.0 -70.8 -42.1 6.6 43.0 -1.6 100 103 A S E > S-C 103 0A 29 3,-1.8 3,-0.7 -3,-0.1 141,-0.1 -0.849 82.1 -66.0-157.1-168.2 8.9 41.3 0.9 101 104 A I T 3 S+ 0 0 31 -2,-0.2 -15,-0.1 1,-0.2 3,-0.1 0.569 136.2 21.7 -69.9 -7.2 11.7 38.8 1.3 102 105 A D T 3 S+ 0 0 42 1,-0.1 -94,-1.8 -95,-0.0 2,-0.4 0.171 112.2 75.6-146.7 20.7 9.2 36.1 0.2 103 106 A E E < +AC 7 100A 45 -3,-0.7 -3,-1.8 -96,-0.2 -4,-1.2 -1.000 48.0 161.7-139.0 136.7 6.5 37.9 -1.7 104 107 A A E -AC 6 98A 0 -98,-1.5 -98,-2.1 -2,-0.4 2,-0.4 -0.997 23.6-145.9-153.7 153.2 6.4 39.3 -5.3 105 108 A Y E -AC 5 97A 26 -8,-1.5 -8,-2.6 -2,-0.3 2,-0.4 -0.953 14.2-165.1-122.0 140.8 4.0 40.4 -8.0 106 109 A L E -AC 4 96A 0 -102,-1.9 -102,-2.7 -2,-0.4 2,-0.7 -0.990 13.0-154.3-130.5 134.0 4.6 40.0 -11.7 107 110 A D E +AC 3 95A 8 -12,-2.0 -13,-2.1 -2,-0.4 -12,-1.0 -0.936 23.3 164.2-104.1 115.6 2.8 41.6 -14.6 108 111 A V > + 0 0 0 -106,-2.5 4,-1.9 -2,-0.7 6,-0.4 0.123 31.6 123.0-118.8 19.2 3.2 39.3 -17.6 109 112 A T T 4>S+ 0 0 34 -107,-0.5 5,-0.8 1,-0.2 -1,-0.1 0.696 85.6 37.4 -54.4 -19.8 0.5 40.8 -19.9 110 113 A N T >45S+ 0 0 112 3,-0.2 3,-1.8 -3,-0.2 -1,-0.2 0.812 108.7 56.7-101.8 -40.6 3.2 41.3 -22.5 111 114 A K T 345S+ 0 0 125 1,-0.3 -2,-0.2 -4,-0.1 -1,-0.1 0.764 117.1 40.4 -62.8 -23.3 5.4 38.3 -22.1 112 115 A V T ><5S- 0 0 10 -4,-1.9 3,-3.1 -110,-0.1 -1,-0.3 0.096 112.2-120.5-110.8 19.7 2.3 36.2 -22.8 113 116 A E T < 5S- 0 0 95 -3,-1.8 -3,-0.2 1,-0.3 -4,-0.1 0.711 70.7 -59.7 48.2 26.5 0.9 38.5 -25.5 114 117 A G T 3 - 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0 0 2 -3,-1.2 24,-3.3 -5,-0.2 25,-0.3 -0.778 59.3-134.6 -91.3 121.2 -15.3 34.8 -0.9 177 180 A D B > -J 199 0C 49 -2,-0.6 3,-2.2 22,-0.2 4,-0.3 -0.488 12.1-128.0 -75.3 141.8 -15.3 34.7 2.9 178 181 A I G > S+ 0 0 0 20,-1.8 3,-1.6 1,-0.3 6,-0.1 0.856 109.5 62.7 -54.2 -37.1 -14.3 37.8 4.9 179 182 A D G 3 S+ 0 0 77 19,-0.4 -1,-0.3 1,-0.3 10,-0.1 0.520 97.5 57.1 -68.8 -6.1 -11.8 35.6 6.7 180 183 A E G < S+ 0 0 60 -3,-2.2 -1,-0.3 2,-0.1 -2,-0.2 0.449 83.2 104.6-102.8 -3.0 -9.9 35.0 3.5 181 184 A I S X S- 0 0 8 -3,-1.6 3,-1.1 -4,-0.3 2,-0.1 -0.688 70.0-129.8 -86.6 124.4 -9.4 38.7 2.7 182 185 A P T 3 S+ 0 0 30 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.418 89.7 36.1 -69.5 142.2 -5.8 40.1 3.3 183 186 A G T 3 S+ 0 0 59 1,-0.3 2,-0.5 -2,-0.1 36,-0.1 0.232 89.9 107.7 100.6 -15.4 -5.6 43.2 5.4 184 187 A I S < S- 0 0 22 -3,-1.1 -1,-0.3 -6,-0.1 2,-0.1 -0.841 71.3-122.8 -98.8 131.4 -8.5 42.3 7.7 185 188 A G > - 0 0 31 -2,-0.5 4,-1.9 1,-0.1 5,-0.2 -0.386 16.8-122.2 -70.4 150.8 -7.5 41.4 11.3 186 189 A S H > S+ 0 0 99 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.777 116.9 52.6 -62.0 -23.3 -8.6 38.0 12.5 187 190 A V H > S+ 0 0 91 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.909 106.1 48.6 -77.7 -45.7 -10.3 40.1 15.2 188 191 A L H > S+ 0 0 27 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.792 110.5 54.6 -65.7 -26.8 -12.2 42.4 12.9 189 192 A A H X S+ 0 0 7 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.910 104.8 51.5 -72.8 -43.8 -13.4 39.3 11.0 190 193 A R H X S+ 0 0 162 -4,-1.3 4,-2.2 1,-0.2 -2,-0.2 0.956 111.8 47.6 -56.6 -50.6 -14.9 37.6 14.0 191 194 A R H X S+ 0 0 119 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.889 111.0 51.2 -58.4 -40.8 -16.8 40.8 14.8 192 195 A L H <>S+ 0 0 3 -4,-1.7 5,-2.8 1,-0.2 4,-0.2 0.922 109.9 49.4 -62.8 -43.6 -18.0 41.0 11.2 193 196 A N H ><5S+ 0 0 49 -4,-2.9 3,-1.1 1,-0.2 -1,-0.2 0.853 108.3 53.8 -63.1 -34.9 -19.1 37.4 11.3 194 197 A E H 3<5S+ 0 0 131 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.820 108.3 51.5 -67.8 -29.8 -20.9 38.3 14.6 195 198 A L T 3<5S- 0 0 69 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.382 128.0 -95.6 -88.5 2.5 -22.6 41.1 12.7 196 199 A G T < 5S+ 0 0 49 -3,-1.1 2,-1.0 -4,-0.2 3,-0.3 0.450 83.5 130.6 99.8 -0.6 -23.8 38.9 9.8 197 200 A I < + 0 0 10 -5,-2.8 -1,-0.2 1,-0.2 -2,-0.1 -0.769 15.1 142.0 -90.7 100.4 -21.0 39.6 7.4 198 201 A Q + 0 0 96 -2,-1.0 -20,-1.8 1,-0.2 -19,-0.4 0.798 62.9 36.1-103.7 -44.8 -19.9 36.1 6.3 199 202 A K B > S-J 177 0C 43 -3,-0.3 3,-1.1 -22,-0.2 -22,-0.2 -0.741 84.0-114.1-109.6 159.3 -19.1 36.6 2.6 200 203 A L G > S+ 0 0 0 -24,-3.3 3,-1.3 -27,-0.4 4,-0.3 0.813 115.7 61.1 -60.9 -30.3 -17.5 39.6 0.8 201 204 A R G > S+ 0 0 108 -27,-0.9 3,-1.9 -28,-0.3 -1,-0.3 0.776 84.7 75.0 -68.9 -25.8 -20.8 40.2 -1.0 202 205 A D G X S+ 0 0 42 -3,-1.1 3,-0.7 1,-0.3 -1,-0.3 0.656 85.3 68.7 -60.7 -12.1 -22.7 40.7 2.3 203 206 A I G X S+ 0 0 7 -3,-1.3 3,-0.6 1,-0.3 2,-0.3 0.826 87.2 63.3 -74.4 -32.2 -20.9 44.1 2.2 204 207 A L G < S+ 0 0 87 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.1 -0.068 100.5 57.8 -83.1 35.2 -23.0 45.2 -0.7 205 208 A S G < S+ 0 0 101 -3,-0.7 -1,-0.3 -2,-0.3 2,-0.3 -0.188 93.4 69.1-158.9 49.4 -26.0 44.9 1.6 206 209 A K S < S- 0 0 45 -3,-0.6 -1,-0.1 0, 0.0 5,-0.1 -0.872 88.4 -87.8-171.5 136.0 -25.3 47.2 4.6 207 210 A N > - 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