==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-MAY-11 3RZI . COMPND 2 MOLECULE: PROBABLE 3-DEOXY-D-ARABINO-HEPTULOSONATE 7-PHOSPH . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR W.JIAO,G.B.JAMESON,R.D.HUTTON,E.J.PARKER . 914 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34015.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 622 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 87 9.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 46 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 329 36.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.4 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 2 0 2 0 0 5 1 1 3 2 3 0 2 0 1 1 3 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 2 5 3 4 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 PARALLEL BRIDGES PER LADDER . 4 0 4 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 0 ANTIPARALLEL BRIDGES PER LADDER . 5 0 0 0 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 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 N 0 0 173 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 18.5 -106.4 71.1 -8.3 2 3 A W + 0 0 179 1,-0.2 461,-2.5 460,-0.1 2,-0.3 0.800 360.0 112.4 63.1 33.3 -103.3 71.9 -10.4 3 4 A T E -A 462 0A 45 459,-0.3 2,-0.4 461,-0.0 459,-0.2 -0.860 50.9-149.3-125.4 167.8 -100.7 70.6 -8.0 4 5 A V E -A 461 0A 16 457,-2.3 457,-2.8 -2,-0.3 2,-0.3 -0.990 16.5-134.6-141.1 132.8 -98.2 67.7 -8.0 5 6 A D E -A 460 0A 80 -2,-0.4 455,-0.3 455,-0.2 614,-0.0 -0.656 12.2-159.6 -88.3 137.0 -97.0 65.9 -4.9 6 7 A I E -A 459 0A 0 453,-4.3 453,-2.8 -2,-0.3 614,-0.0 -0.949 21.8-128.1-121.7 109.9 -93.2 65.2 -4.4 7 8 A P E -A 458 0A 43 0, 0.0 2,-0.4 0, 0.0 451,-0.3 -0.114 13.4-142.8 -62.0 147.0 -92.4 62.4 -2.0 8 9 A I - 0 0 17 449,-2.9 2,-0.8 2,-0.1 36,-0.0 -0.917 20.5-117.2-103.9 138.7 -90.0 62.7 0.9 9 10 A D 0 0 90 -2,-0.4 449,-0.0 38,-0.0 0, 0.0 -0.717 360.0 360.0 -78.7 107.5 -87.7 59.9 2.1 10 11 A Q 0 0 179 -2,-0.8 -2,-0.1 447,-0.0 33,-0.1 -0.802 360.0 360.0 109.8 360.0 -88.5 58.9 5.6 11 ! 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 12 16 A P 0 0 175 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 129.9 -75.1 61.5 11.8 13 17 A P - 0 0 100 0, 0.0 3,-0.1 0, 0.0 6,-0.0 -0.028 360.0 -90.3 -63.6 156.2 -76.5 64.1 14.4 14 18 A L - 0 0 48 1,-0.2 5,-0.0 2,-0.1 242,-0.0 -0.207 67.8 -70.5 -51.8 162.9 -74.7 67.3 15.6 15 19 A P > - 0 0 46 0, 0.0 4,-2.7 0, 0.0 5,-0.2 -0.229 39.2-120.2 -67.4 151.1 -72.6 66.7 18.7 16 20 A T H > S+ 0 0 95 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.872 110.2 52.3 -56.3 -39.3 -74.2 66.0 22.1 17 21 A D H > S+ 0 0 106 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.965 113.8 41.2 -70.3 -45.7 -72.7 69.1 23.8 18 22 A L H > S+ 0 0 29 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.876 113.6 54.4 -69.3 -33.0 -73.8 71.6 21.1 19 23 A R H X S+ 0 0 96 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.894 106.9 52.0 -61.7 -37.9 -77.3 69.8 20.9 20 24 A T H X S+ 0 0 93 -4,-2.4 4,-1.1 -5,-0.2 -2,-0.2 0.846 111.2 47.1 -64.1 -37.3 -77.5 70.3 24.7 21 25 A R H X S+ 0 0 123 -4,-1.7 4,-1.5 -5,-0.2 -2,-0.2 0.924 112.7 49.6 -67.7 -47.5 -76.8 74.0 24.3 22 26 A L H X S+ 0 0 11 -4,-2.7 4,-3.0 1,-0.2 -2,-0.2 0.901 108.3 51.1 -57.6 -47.0 -79.3 74.4 21.5 23 27 A D H X S+ 0 0 89 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.835 108.7 52.8 -68.1 -27.6 -82.2 72.7 23.3 24 28 A A H < S+ 0 0 66 -4,-1.1 -1,-0.2 2,-0.2 -2,-0.2 0.866 112.8 43.7 -65.7 -39.8 -81.6 75.0 26.3 25 29 A A H >< S+ 0 0 13 -4,-1.5 3,-1.7 1,-0.2 -2,-0.2 0.920 112.8 52.6 -75.2 -38.8 -81.8 78.0 24.0 26 30 A L H 3< S+ 0 0 29 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.607 91.0 74.3 -80.6 -7.3 -84.8 76.7 22.1 27 31 A A T 3< S+ 0 0 83 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.551 77.6 100.8 -71.6 -12.3 -86.8 76.0 25.3 28 32 A K S < S- 0 0 64 -3,-1.7 255,-0.1 1,-0.1 256,-0.1 -0.507 93.5 -92.3 -70.7 149.5 -87.2 79.8 25.4 29 33 A P - 0 0 106 0, 0.0 255,-2.2 0, 0.0 2,-0.5 -0.361 40.2-150.5 -65.7 143.2 -90.6 80.9 24.2 30 34 A A > - 0 0 43 253,-0.2 3,-0.6 254,-0.2 2,-0.1 -0.953 6.2-144.5-117.6 116.1 -90.7 81.7 20.4 31 35 A A T 3 S+ 0 0 27 -2,-0.5 247,-0.0 1,-0.2 246,-0.0 -0.414 74.9 15.7 -71.7 159.5 -93.1 84.3 19.0 32 36 A Q T 3 S+ 0 0 49 1,-0.2 -1,-0.2 99,-0.1 97,-0.1 0.648 82.2 155.9 59.3 33.1 -94.8 84.1 15.6 33 37 A Q < - 0 0 46 -3,-0.6 -1,-0.2 1,-0.1 214,-0.1 -0.514 46.5-100.5 -93.1 152.8 -94.2 80.4 15.0 34 38 A P - 0 0 17 0, 0.0 -1,-0.1 0, 0.0 114,-0.0 -0.224 23.0-131.1 -66.9 161.1 -96.3 78.2 12.7 35 39 A T + 0 0 93 2,-0.0 3,-0.1 3,-0.0 125,-0.0 0.084 55.6 132.9-107.9 36.8 -99.0 75.9 14.2 36 40 A W - 0 0 23 1,-0.1 125,-0.1 2,-0.1 2,-0.0 -0.231 67.9 -79.0 -84.7 166.6 -98.3 72.6 12.4 37 41 A P > - 0 0 59 0, 0.0 4,-2.9 0, 0.0 3,-0.3 -0.387 34.4-131.6 -67.4 143.7 -98.1 69.3 14.2 38 42 A A H > S+ 0 0 83 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.798 106.7 54.9 -62.9 -34.1 -94.8 68.6 16.0 39 43 A D H > S+ 0 0 113 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.922 110.2 45.5 -74.3 -33.7 -94.4 65.2 14.5 40 44 A Q H > S+ 0 0 70 -3,-0.3 4,-2.4 2,-0.2 5,-0.3 0.971 111.9 51.4 -72.0 -45.3 -94.8 66.6 11.0 41 45 A A H X S+ 0 0 4 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.950 110.2 50.9 -49.0 -53.1 -92.3 69.4 11.8 42 46 A L H X S+ 0 0 89 -4,-3.0 4,-3.0 1,-0.2 -1,-0.2 0.910 108.1 51.1 -53.5 -51.7 -89.9 66.8 13.1 43 47 A A H X S+ 0 0 40 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.937 113.4 45.9 -47.8 -50.1 -90.2 64.7 9.9 44 48 A M H X S+ 0 0 1 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.863 109.8 52.9 -71.7 -34.9 -89.5 67.7 7.8 45 49 A R H X S+ 0 0 43 -4,-2.8 4,-2.5 -5,-0.3 -1,-0.2 0.956 105.1 57.2 -62.7 -46.0 -86.6 68.8 10.0 46 50 A T H < S+ 0 0 47 -4,-3.0 4,-0.3 1,-0.2 -2,-0.2 0.929 107.2 47.3 -48.4 -46.6 -85.1 65.4 9.5 47 51 A V H >< S+ 0 0 14 -4,-2.1 3,-1.8 1,-0.2 4,-0.5 0.963 113.3 48.1 -54.0 -53.0 -85.1 65.8 5.7 48 52 A L H >< S+ 0 0 0 -4,-2.1 3,-0.9 1,-0.3 -2,-0.2 0.831 97.2 70.8 -70.7 -22.8 -83.6 69.3 6.0 49 53 A E T 3< S+ 0 0 94 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.593 108.6 35.3 -66.4 -5.1 -80.8 68.1 8.4 50 54 A S T < S+ 0 0 70 -3,-1.8 498,-0.3 -4,-0.3 -1,-0.2 0.358 89.2 109.8-131.4 7.8 -79.2 66.2 5.5 51 55 A V S < S- 0 0 4 -3,-0.9 496,-0.1 -4,-0.5 497,-0.1 -0.444 82.2 -90.6 -80.8 154.5 -79.7 68.3 2.4 52 56 A P - 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.395 55.7-105.1 -59.9 141.5 -76.8 70.1 0.8 53 57 A P - 0 0 4 0, 0.0 215,-0.1 0, 0.0 3,-0.1 -0.180 7.8-136.3 -76.5 162.3 -76.5 73.6 2.3 54 58 A V S S+ 0 0 0 213,-2.0 2,-0.2 200,-0.1 214,-0.2 0.898 92.6 13.4 -76.9 -41.9 -77.4 76.9 0.7 55 59 A T S S- 0 0 0 212,-1.3 -1,-0.1 214,-0.2 579,-0.0 -0.738 76.8-129.4-122.2 167.5 -74.2 78.6 1.9 56 60 A V >> - 0 0 9 -2,-0.2 4,-1.3 -3,-0.1 3,-0.9 -0.900 24.2-113.6-123.3 151.7 -70.9 77.2 3.3 57 61 A P H 3> S+ 0 0 29 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.861 112.5 56.4 -56.6 -38.3 -68.9 78.2 6.4 58 62 A S H 3> S+ 0 0 53 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.870 105.3 54.5 -66.3 -26.0 -65.9 79.7 4.7 59 63 A E H <> S+ 0 0 19 -3,-0.9 4,-1.9 2,-0.2 -1,-0.2 0.880 110.2 45.6 -63.3 -41.2 -68.2 82.1 2.7 60 64 A I H X S+ 0 0 1 -4,-1.3 4,-2.5 2,-0.2 -2,-0.2 0.845 109.4 54.5 -72.7 -40.0 -69.7 83.4 6.0 61 65 A V H X S+ 0 0 62 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.948 109.6 48.7 -59.8 -44.7 -66.3 83.7 7.6 62 66 A R H X S+ 0 0 116 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.913 109.2 52.2 -59.2 -39.5 -65.3 85.9 4.6 63 67 A L H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.920 105.9 54.7 -63.3 -41.3 -68.5 87.9 5.0 64 68 A Q H X S+ 0 0 37 -4,-2.5 4,-3.1 2,-0.2 -2,-0.2 0.970 108.2 49.3 -60.9 -44.9 -67.6 88.5 8.7 65 69 A E H X S+ 0 0 116 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.931 113.2 47.0 -55.8 -39.3 -64.2 89.9 7.6 66 70 A Q H X S+ 0 0 42 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.900 112.3 49.1 -76.9 -28.6 -65.9 92.2 5.1 67 71 A L H X S+ 0 0 3 -4,-2.6 4,-2.9 1,-0.3 -1,-0.2 0.890 103.7 60.0 -81.4 -31.3 -68.4 93.3 7.7 68 72 A A H X S+ 0 0 14 -4,-3.1 4,-1.6 2,-0.2 -1,-0.3 0.816 103.9 52.3 -53.9 -38.8 -65.7 94.0 10.2 69 73 A Q H <>S+ 0 0 70 -4,-1.3 5,-2.4 -3,-0.2 6,-0.5 0.871 108.1 50.8 -72.8 -30.6 -64.4 96.5 7.7 70 74 A V H ><5S+ 0 0 0 -4,-1.4 3,-2.2 4,-0.2 5,-0.4 0.956 107.9 52.1 -67.2 -50.3 -67.8 98.0 7.5 71 75 A A H 3<5S+ 0 0 13 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.851 107.1 54.6 -50.1 -40.4 -68.0 98.3 11.3 72 76 A K T 3<5S- 0 0 93 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.363 120.7-105.1 -81.2 4.0 -64.6 100.1 11.3 73 77 A G T < 5S+ 0 0 26 -3,-2.2 -3,-0.2 2,-0.2 -2,-0.1 0.670 96.3 103.2 85.5 19.2 -65.7 102.8 8.8 74 78 A E S S+ 0 0 1 -2,-0.3 3,-1.3 1,-0.2 -1,-0.1 0.919 110.5 51.2 -62.2 -38.8 -92.5 80.4 -4.8 88 92 A M T 3 S+ 0 0 67 1,-0.3 -1,-0.2 828,-0.1 -3,-0.0 0.813 111.5 46.4 -78.8 -9.5 -94.4 81.3 -7.9 89 93 A D T 3 S+ 0 0 90 -3,-0.3 2,-1.8 1,-0.1 -1,-0.3 0.261 79.7 107.8-109.5 14.5 -92.2 84.5 -8.6 90 94 A N < + 0 0 4 -3,-1.3 2,-0.2 -4,-0.2 -1,-0.1 -0.482 54.9 137.8 -90.2 64.4 -88.9 82.6 -7.9 91 95 A T > - 0 0 35 -2,-1.8 4,-2.4 416,-0.1 5,-0.3 -0.683 69.6-107.6-112.4 165.5 -88.1 82.7 -11.6 92 96 A E H > S+ 0 0 44 -2,-0.2 4,-2.5 414,-0.2 5,-0.2 0.910 116.4 46.6 -63.7 -43.5 -85.0 83.4 -13.6 93 97 A P H > S+ 0 0 74 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.890 114.6 47.7 -72.2 -29.4 -86.1 86.9 -14.9 94 98 A H H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 313,-0.4 0.948 114.6 44.5 -72.2 -48.3 -87.3 88.0 -11.4 95 99 A I H X S+ 0 0 2 -4,-2.4 4,-2.1 2,-0.2 5,-0.2 0.906 116.4 46.9 -63.4 -47.1 -84.1 86.8 -9.7 96 100 A R H X S+ 0 0 91 -4,-2.5 4,-3.4 -5,-0.3 5,-0.2 0.948 110.0 54.2 -59.0 -46.7 -81.9 88.3 -12.3 97 101 A G H X S+ 0 0 6 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.914 109.9 46.6 -57.3 -43.3 -83.8 91.5 -12.2 98 102 A N H X S+ 0 0 6 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.852 112.9 47.9 -68.7 -40.4 -83.3 91.8 -8.5 99 103 A V H X S+ 0 0 2 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.896 110.8 53.6 -61.2 -45.9 -79.6 91.0 -8.7 100 104 A R H X S+ 0 0 56 -4,-3.4 4,-2.0 -5,-0.2 -2,-0.2 0.955 108.4 48.8 -53.4 -48.3 -79.3 93.6 -11.5 101 105 A A H X S+ 0 0 1 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.900 112.2 48.1 -66.8 -45.4 -81.0 96.3 -9.3 102 106 A L H X S+ 0 0 2 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.946 111.3 51.3 -50.8 -46.8 -78.7 95.6 -6.3 103 107 A L H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.901 109.1 49.4 -68.3 -31.4 -75.6 95.7 -8.6 104 108 A Q H X S+ 0 0 13 -4,-2.0 4,-1.5 1,-0.2 3,-0.4 0.915 111.6 48.0 -75.5 -47.2 -76.6 99.0 -10.1 105 109 A M H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.947 110.0 56.9 -53.2 -39.9 -77.2 100.6 -6.7 106 110 A A H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.766 101.1 53.2 -64.3 -37.2 -73.8 99.1 -5.8 107 111 A V H X S+ 0 0 5 -4,-1.5 4,-2.1 -3,-0.4 -1,-0.2 0.915 113.4 44.4 -62.2 -49.8 -71.7 100.8 -8.6 108 112 A V H X S+ 0 0 0 -4,-1.5 4,-2.4 1,-0.2 -2,-0.2 0.926 114.4 48.1 -65.5 -42.8 -73.1 104.2 -7.5 109 113 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 6,-0.3 0.873 108.8 53.3 -63.8 -38.9 -72.6 103.6 -3.9 110 114 A T H X>S+ 0 0 35 -4,-2.3 4,-1.3 -5,-0.2 5,-0.8 0.960 112.7 44.6 -60.4 -51.7 -69.0 102.3 -4.3 111 115 A Y H <5S+ 0 0 74 -4,-2.1 3,-0.4 1,-0.2 -2,-0.2 0.946 116.5 46.1 -57.0 -38.7 -68.1 105.4 -6.2 112 116 A G H <5S+ 0 0 3 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.888 116.6 42.6 -77.8 -39.5 -69.8 107.8 -3.8 113 117 A A H <5S- 0 0 13 -4,-2.7 -1,-0.3 2,-0.2 -2,-0.2 0.592 95.9-139.8 -66.0 -31.4 -68.5 106.2 -0.6 114 118 A S T <5S+ 0 0 109 -4,-1.3 -3,-0.2 -3,-0.4 -4,-0.1 0.836 73.8 78.4 64.5 30.6 -65.0 105.8 -2.0 115 119 A M S - 0 0 29 4,-3.1 3,-2.2 -2,-0.5 -2,-0.0 -0.044 39.2 -86.5 -68.2 179.2 -107.3 89.2 8.1 137 141 A A T 3 S+ 0 0 109 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.662 127.7 56.6 -58.1 -25.0 -109.8 91.5 6.5 138 142 A L T 3 S- 0 0 122 2,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.271 120.4-106.9 -94.3 1.4 -111.4 88.7 4.5 139 143 A G S < S+ 0 0 53 -3,-2.2 2,-0.2 1,-0.3 -2,-0.1 0.678 81.3 125.2 83.4 21.7 -112.0 86.7 7.7 140 144 A L S S- 0 0 37 1,-0.1 -4,-3.1 14,-0.0 -1,-0.3 -0.677 73.7 -90.1-110.2 152.2 -109.3 84.3 6.9 141 145 A R B -J 135 0C 84 -2,-0.2 -6,-0.2 -6,-0.2 -7,-0.1 -0.515 62.7 -96.7 -44.1 136.5 -106.2 83.1 8.8 142 146 A S - 0 0 8 -8,-0.9 2,-0.2 -9,-0.3 -1,-0.1 -0.181 32.0-109.0 -69.1 144.2 -103.4 85.5 7.8 143 147 A Y - 0 0 6 8,-0.1 -1,-0.1 1,-0.1 8,-0.1 -0.529 31.9-173.8 -58.0 135.0 -100.9 84.6 5.1 144 148 A R - 0 0 24 1,-0.4 -15,-2.0 -2,-0.2 3,-0.2 0.158 50.6 -76.3-119.5 16.2 -97.6 84.0 6.8 145 149 A G >> - 0 0 3 -17,-0.3 4,-2.6 1,-0.1 3,-2.2 -0.115 53.8 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201 A N H X S+ 0 0 3 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.942 107.6 51.3 -60.5 -40.9 -76.7 103.0 -15.2 198 202 A R H X S+ 0 0 104 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.892 107.4 51.2 -62.1 -39.3 -76.0 105.2 -18.2 199 203 A E H X S+ 0 0 94 -4,-1.8 4,-1.9 1,-0.2 5,-0.2 0.891 109.2 52.6 -69.0 -29.5 -79.1 104.1 -20.1 200 204 A F H X S+ 0 0 18 -4,-2.0 4,-3.0 2,-0.2 -2,-0.2 0.925 108.6 48.6 -66.8 -45.7 -81.2 105.0 -16.9 201 205 A V H < S+ 0 0 15 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.867 112.8 50.7 -62.0 -32.6 -79.7 108.5 -16.7 202 206 A R H < S+ 0 0 179 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.823 122.3 27.9 -72.9 -42.2 -80.4 109.0 -20.4 203 207 A T H < S+ 0 0 85 -4,-1.9 -2,-0.2 -5,-0.1 -3,-0.2 0.657 94.7 106.6 -98.7 -17.9 -84.1 107.9 -20.2 204 208 A S S >< S- 0 0 11 -4,-3.0 3,-1.0 -5,-0.2 4,-0.2 -0.223 71.0-130.9 -60.0 146.7 -85.0 108.8 -16.6 205 209 A P T 3 S+ 0 0 95 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.868 113.4 36.6 -70.0 -28.9 -87.2 111.9 -16.1 206 210 A A T >> S+ 0 0 26 1,-0.2 3,-1.9 2,-0.1 4,-0.5 0.175 83.8 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