==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 31-OCT-12 2YPP . COMPND 2 MOLECULE: PHOSPHO-2-DEHYDRO-3-DEOXYHEPTONATE ALDOLASE AROG; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR N.J.BLACKMORE,S.REICHAU,W.JIAO,R.D.HUTTON,E.N.BAKER,G.B.JAME . 922 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34235.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 647 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 90 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 56 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 95 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 328 35.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.3 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 3 0 2 0 0 5 1 1 3 2 2 0 2 0 4 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 2 4 4 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 3 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 0 ANTIPARALLEL BRIDGES PER LADDER . 4 1 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 1 A M 0 0 190 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -6.6 91.4 -58.4 -21.0 2 2 A N - 0 0 127 2,-0.2 467,-0.1 466,-0.0 3,-0.1 0.534 360.0-138.4-112.0 -15.4 91.4 -55.4 -18.6 3 3 A W + 0 0 158 1,-0.2 466,-2.9 465,-0.1 2,-0.3 0.878 63.9 116.0 56.1 39.9 92.0 -52.5 -21.2 4 4 A T E -A 468 0A 46 464,-0.3 2,-0.4 2,-0.0 464,-0.2 -0.818 53.3-148.9-127.7 168.2 94.4 -50.8 -18.8 5 5 A V E -A 467 0A 19 462,-1.8 462,-3.4 -2,-0.3 2,-0.3 -0.980 16.7-135.0-137.2 137.9 98.0 -49.9 -18.8 6 6 A D E -A 466 0A 73 -2,-0.4 460,-0.2 460,-0.2 621,-0.0 -0.708 10.6-156.9 -98.5 144.0 100.2 -49.7 -15.8 7 7 A I E -A 465 0A 0 458,-3.7 458,-3.2 -2,-0.3 621,-0.0 -0.973 15.1-136.2-127.4 116.7 102.6 -47.0 -15.2 8 8 A P E -A 464 0A 45 0, 0.0 2,-0.3 0, 0.0 456,-0.2 -0.300 13.5-155.2 -74.1 154.9 105.5 -47.6 -12.9 9 9 A I 0 0 12 454,-1.4 41,-0.0 917,-0.0 38,-0.0 -0.955 360.0 360.0-129.6 147.0 106.7 -45.2 -10.3 10 10 A D 0 0 103 -2,-0.3 454,-0.1 2,-0.0 0, 0.0 -0.295 360.0 360.0-104.1 360.0 110.1 -44.8 -8.7 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 13 A P 0 0 102 0, 0.0 2,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 116.1 114.5 -40.3 -5.5 13 14 A S - 0 0 86 1,-0.1 40,-0.1 0, 0.0 37,-0.1 -0.177 360.0-125.4-102.6 172.9 113.6 -37.2 -3.5 14 15 A L - 0 0 65 1,-0.3 -1,-0.1 38,-0.1 39,-0.0 -0.063 61.4 -48.4 -93.8-170.5 114.6 -33.6 -2.5 15 16 A P - 0 0 115 0, 0.0 -1,-0.3 0, 0.0 0, 0.0 -0.397 64.9-115.6 -58.1 147.0 115.1 -32.0 1.0 16 17 A P - 0 0 101 0, 0.0 3,-0.1 0, 0.0 6,-0.0 -0.247 42.6 -82.8 -66.7 172.6 112.2 -32.8 3.4 17 18 A L - 0 0 46 1,-0.1 5,-0.1 2,-0.1 242,-0.0 -0.415 69.0 -76.9 -64.5 153.2 110.0 -30.0 4.6 18 19 A P > - 0 0 47 0, 0.0 4,-2.2 0, 0.0 5,-0.2 -0.290 40.5-121.1 -52.5 146.0 111.8 -28.2 7.7 19 20 A T H > S+ 0 0 87 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.871 109.2 53.7 -57.2 -44.0 111.5 -30.2 10.9 20 21 A D H > S+ 0 0 114 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.898 112.6 44.0 -63.0 -42.7 109.7 -27.4 12.8 21 22 A L H > S+ 0 0 10 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.863 112.1 52.4 -65.7 -38.0 107.0 -27.0 10.2 22 23 A R H X S+ 0 0 91 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.888 105.9 56.2 -63.0 -40.0 106.7 -30.9 9.9 23 24 A T H X S+ 0 0 87 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.924 110.0 44.6 -58.6 -44.3 106.2 -30.9 13.7 24 25 A R H X S+ 0 0 140 -4,-1.6 4,-2.5 2,-0.2 5,-0.2 0.942 113.3 49.2 -66.6 -45.3 103.3 -28.5 13.4 25 26 A L H X S+ 0 0 13 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.926 108.1 54.2 -60.7 -43.4 101.7 -30.3 10.4 26 27 A D H X S+ 0 0 91 -4,-3.0 4,-0.6 1,-0.2 -1,-0.2 0.911 109.1 49.7 -61.7 -38.9 101.9 -33.7 12.3 27 28 A A H >< S+ 0 0 68 -4,-1.7 3,-0.6 1,-0.2 4,-0.2 0.882 112.1 46.0 -64.6 -43.9 100.0 -32.2 15.2 28 29 A A H >< S+ 0 0 15 -4,-2.5 3,-1.4 1,-0.2 -1,-0.2 0.896 112.8 50.7 -66.3 -37.8 97.3 -30.7 13.1 29 30 A L H 3< S+ 0 0 27 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.545 91.5 74.0 -87.0 -1.8 96.9 -33.9 11.1 30 31 A A T << S+ 0 0 86 -4,-0.6 -1,-0.3 -3,-0.6 -2,-0.2 0.547 78.8 101.9 -77.0 -9.7 96.6 -36.1 14.2 31 32 A K S < S- 0 0 63 -3,-1.4 258,-0.1 -4,-0.2 259,-0.1 -0.447 91.7 -90.3 -70.7 149.0 93.1 -34.6 14.4 32 33 A P - 0 0 103 0, 0.0 258,-2.8 0, 0.0 2,-0.5 -0.293 40.8-155.0 -64.6 149.8 90.4 -36.9 13.2 33 34 A A > - 0 0 37 256,-0.2 3,-0.6 257,-0.2 2,-0.1 -0.976 4.2-144.8-130.3 114.7 89.5 -36.6 9.6 34 35 A A T 3 S+ 0 0 33 -2,-0.5 250,-0.0 1,-0.2 257,-0.0 -0.365 75.3 19.4 -72.3 157.8 86.1 -37.5 8.2 35 36 A Q T 3 S+ 0 0 52 1,-0.2 -1,-0.2 99,-0.1 97,-0.1 0.676 80.3 157.6 65.0 30.1 85.5 -39.1 4.8 36 37 A Q < - 0 0 47 -3,-0.6 -1,-0.2 1,-0.1 214,-0.1 -0.583 47.2-102.1 -85.8 147.8 89.0 -40.4 4.2 37 38 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 114,-0.0 -0.135 24.9-135.5 -58.3 159.5 89.8 -43.2 1.8 38 39 A T + 0 0 86 2,-0.0 3,-0.1 3,-0.0 125,-0.0 0.199 55.8 130.9-111.6 25.8 90.4 -46.6 3.5 39 40 A W - 0 0 22 1,-0.1 2,-0.1 2,-0.1 125,-0.1 -0.207 67.7 -76.9 -67.9 164.1 93.5 -47.7 1.6 40 41 A P >> - 0 0 58 0, 0.0 4,-2.7 0, 0.0 3,-0.6 -0.357 31.4-129.7 -71.5 144.8 96.6 -49.0 3.5 41 42 A A H 3> S+ 0 0 81 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.816 104.2 53.5 -59.2 -39.7 99.0 -46.6 5.2 42 43 A D H 3> S+ 0 0 112 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.875 112.9 44.4 -70.0 -32.3 102.2 -48.0 3.8 43 44 A Q H <> S+ 0 0 92 -3,-0.6 4,-2.1 2,-0.2 -2,-0.2 0.912 111.6 51.7 -77.9 -44.4 100.9 -47.6 0.2 44 45 A A H X S+ 0 0 2 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.890 109.4 53.7 -51.0 -41.3 99.4 -44.1 0.8 45 46 A L H X S+ 0 0 84 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.911 106.9 48.9 -64.3 -43.7 102.9 -43.2 2.2 46 47 A A H X S+ 0 0 30 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.891 112.6 49.1 -63.4 -36.7 104.7 -44.4 -0.9 47 48 A M H X S+ 0 0 10 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.906 109.6 51.2 -73.7 -38.4 102.3 -42.4 -3.1 48 49 A R H X S+ 0 0 38 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.875 105.2 56.8 -60.6 -37.4 102.7 -39.4 -1.0 49 50 A T H < S+ 0 0 57 -4,-2.1 4,-0.5 2,-0.2 -2,-0.2 0.922 106.4 50.6 -62.8 -38.2 106.5 -39.7 -1.3 50 51 A V H >< S+ 0 0 16 -4,-1.7 3,-1.8 1,-0.2 4,-0.3 0.976 111.4 47.1 -63.0 -48.3 106.1 -39.6 -5.0 51 52 A L H >< S+ 0 0 0 -4,-2.3 3,-1.2 1,-0.3 -1,-0.2 0.817 96.6 72.7 -68.3 -25.4 104.0 -36.5 -4.9 52 53 A E T 3< S+ 0 0 93 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.720 107.0 36.7 -60.9 -21.7 106.3 -34.7 -2.5 53 54 A S T < S+ 0 0 20 -3,-1.8 503,-0.3 -4,-0.5 -1,-0.2 0.337 90.2 106.4-115.7 14.8 108.8 -34.3 -5.3 54 55 A V S < S- 0 0 4 -3,-1.2 501,-0.1 -4,-0.3 -3,-0.0 -0.560 83.9 -85.0 -82.9 158.5 106.7 -33.6 -8.4 55 56 A P - 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.345 55.5-110.6 -54.9 133.6 106.5 -30.1 -10.1 56 57 A P - 0 0 6 0, 0.0 218,-0.2 0, 0.0 3,-0.1 -0.187 10.0-131.5 -69.7 157.0 103.8 -28.2 -8.3 57 58 A V S S+ 0 0 0 216,-2.2 2,-0.3 200,-0.1 217,-0.2 0.784 91.9 12.9 -70.9 -35.0 100.4 -27.4 -10.1 58 59 A T S S- 0 0 0 215,-1.2 -1,-0.1 217,-0.2 217,-0.1 -0.872 76.3-130.5-135.3 171.4 100.7 -23.8 -9.0 59 60 A V >> - 0 0 9 -2,-0.3 3,-1.3 -3,-0.1 4,-1.1 -0.915 27.2-106.9-129.4 158.8 103.3 -21.6 -7.5 60 61 A P H 3> S+ 0 0 33 0, 0.0 4,-2.8 0, 0.0 3,-0.3 0.799 111.3 57.3 -56.7 -41.0 103.3 -19.2 -4.6 61 62 A S H 3> S+ 0 0 45 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.788 104.0 54.2 -64.6 -25.7 103.3 -15.9 -6.3 62 63 A E H <> S+ 0 0 23 -3,-1.3 4,-2.3 2,-0.2 -1,-0.3 0.853 110.2 47.5 -69.9 -35.1 100.1 -16.8 -8.1 63 64 A I H X S+ 0 0 2 -4,-1.1 4,-2.5 -3,-0.3 -2,-0.2 0.909 110.6 50.7 -71.3 -44.0 98.5 -17.6 -4.8 64 65 A V H X S+ 0 0 55 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.938 111.9 49.9 -58.0 -42.3 99.8 -14.3 -3.2 65 66 A R H X S+ 0 0 78 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.948 108.5 50.2 -60.8 -46.5 98.3 -12.5 -6.3 66 67 A L H X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.2 5,-0.3 0.938 107.5 57.0 -55.5 -43.1 95.0 -14.3 -5.9 67 68 A Q H X S+ 0 0 40 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.910 105.8 48.7 -54.8 -46.5 95.0 -13.2 -2.2 68 69 A E H X S+ 0 0 125 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.875 112.6 48.1 -62.6 -36.3 95.4 -9.6 -3.2 69 70 A Q H X S+ 0 0 34 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.902 111.4 49.0 -73.9 -35.4 92.5 -9.9 -5.7 70 71 A L H X S+ 0 0 4 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.786 103.6 61.0 -73.9 -25.0 90.3 -11.6 -3.1 71 72 A A H X S+ 0 0 16 -4,-1.7 4,-2.0 -5,-0.3 -1,-0.2 0.953 104.4 50.5 -63.7 -40.6 91.1 -8.8 -0.6 72 73 A Q H <>S+ 0 0 71 -4,-1.4 5,-2.6 2,-0.2 6,-0.6 0.874 108.7 50.9 -60.0 -39.8 89.5 -6.5 -3.2 73 74 A V H ><5S+ 0 0 0 -4,-1.5 3,-1.9 4,-0.3 5,-0.4 0.958 109.6 51.1 -63.1 -47.9 86.4 -8.7 -3.4 74 75 A A H 3<5S+ 0 0 12 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.842 105.9 55.2 -62.8 -34.1 86.1 -8.7 0.5 75 76 A K T 3<5S- 0 0 102 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.443 122.4-104.7 -78.9 4.2 86.3 -4.9 0.5 76 77 A G T < 5S+ 0 0 22 -3,-1.9 -3,-0.2 -4,-0.2 -2,-0.1 0.696 95.8 102.6 87.5 17.0 83.3 -4.6 -1.9 77 78 A E S S+ 0 0 1 -2,-0.4 3,-0.7 1,-0.2 -1,-0.1 0.842 107.5 53.7 -63.5 -38.5 89.8 -38.6 -15.5 91 92 A M T 3 S+ 0 0 77 1,-0.2 -1,-0.2 833,-0.1 -3,-0.0 0.732 113.0 42.9 -73.1 -19.9 88.1 -39.9 -18.7 92 93 A D T 3 S+ 0 0 85 -3,-0.4 2,-2.4 1,-0.1 -1,-0.2 0.283 79.7 109.8-104.1 5.2 86.5 -36.6 -19.4 93 94 A N < + 0 0 3 -3,-0.7 2,-0.3 -4,-0.3 -1,-0.1 -0.517 55.5 138.0 -83.1 69.5 89.6 -34.5 -18.6 94 95 A T S > S- 0 0 33 -2,-2.4 4,-3.0 421,-0.1 5,-0.3 -0.792 70.5-104.6-114.6 164.9 90.0 -33.7 -22.3 95 96 A E H > S+ 0 0 48 419,-0.3 4,-3.0 -2,-0.3 5,-0.3 0.922 118.4 46.8 -54.6 -47.5 90.9 -30.7 -24.3 96 97 A P H > S+ 0 0 69 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.906 114.1 45.7 -69.1 -31.5 87.3 -30.1 -25.4 97 98 A H H > S+ 0 0 16 2,-0.2 4,-2.2 1,-0.2 316,-0.3 0.959 115.8 45.5 -76.0 -44.8 85.8 -30.5 -22.1 98 99 A I H X S+ 0 0 2 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.931 112.8 51.4 -60.2 -44.7 88.4 -28.3 -20.4 99 100 A R H X S+ 0 0 103 -4,-3.0 4,-3.0 -5,-0.3 -1,-0.2 0.910 108.9 52.7 -54.3 -45.6 88.1 -25.7 -23.3 100 101 A G H X S+ 0 0 4 -4,-2.2 4,-2.5 -5,-0.3 -2,-0.2 0.933 110.7 45.1 -61.9 -44.2 84.3 -25.7 -22.8 101 102 A N H X S+ 0 0 11 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.898 114.0 49.7 -67.7 -37.5 84.4 -25.0 -19.0 102 103 A V H X S+ 0 0 4 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.953 112.0 47.3 -64.9 -47.4 87.0 -22.3 -19.5 103 104 A R H X S+ 0 0 49 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.924 110.6 53.1 -53.5 -46.8 84.9 -20.6 -22.2 104 105 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.917 110.1 47.3 -65.3 -34.3 81.8 -20.8 -20.1 105 106 A L H X S+ 0 0 2 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.891 111.4 48.9 -74.0 -43.5 83.5 -19.2 -17.2 106 107 A L H X S+ 0 0 14 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.902 112.0 50.8 -60.1 -45.0 85.0 -16.4 -19.3 107 108 A Q H X S+ 0 0 7 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.941 112.7 45.7 -57.5 -46.7 81.4 -15.8 -20.9 108 109 A M H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.3 0.918 111.0 54.7 -61.9 -42.8 79.8 -15.6 -17.5 109 110 A A H X S+ 0 0 6 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.847 104.7 50.2 -61.4 -43.0 82.6 -13.3 -16.2 110 111 A V H X S+ 0 0 14 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.962 114.3 46.9 -64.4 -41.1 82.3 -10.6 -19.0 111 112 A V H X S+ 0 0 2 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.920 114.4 45.1 -65.3 -46.1 78.5 -10.5 -18.3 112 113 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 6,-0.3 0.810 109.6 57.2 -68.0 -30.0 78.9 -10.3 -14.5 113 114 A T H X>S+ 0 0 52 -4,-2.1 4,-1.7 -5,-0.3 5,-0.9 0.934 108.8 45.8 -63.3 -41.9 81.7 -7.7 -14.9 114 115 A Y H <5S+ 0 0 74 -4,-2.0 3,-0.2 1,-0.2 -2,-0.2 0.959 114.5 48.1 -63.1 -51.5 79.3 -5.5 -16.8 115 116 A G H <5S+ 0 0 4 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.856 119.2 38.1 -52.5 -43.4 76.5 -6.0 -14.3 116 117 A A H <5S- 0 0 14 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.607 91.9-140.8 -88.6 -21.2 78.7 -5.3 -11.3 117 118 A S T <5S+ 0 0 109 -4,-1.7 -3,-0.2 -3,-0.2 -4,-0.1 0.871 72.9 88.5 56.6 36.5 80.8 -2.5 -12.8 118 119 A M S - 0 0 31 4,-3.2 3,-2.6 -2,-0.4 -2,-0.1 -0.310 37.7 -87.1 -95.3-177.7 74.8 -47.1 -2.8 140 141 A A T 3 S+ 0 0 105 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.759 125.2 54.3 -63.3 -28.2 71.7 -47.9 -4.6 141 142 A L T 3 S- 0 0 121 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.372 119.8-106.9 -83.8 3.0 73.3 -50.7 -6.7 142 143 A G S < S+ 0 0 56 -3,-2.6 2,-0.3 1,-0.3 -2,-0.2 0.601 82.4 119.5 83.7 12.1 74.6 -52.4 -3.4 143 144 A L S S- 0 0 34 1,-0.1 -4,-3.2 -4,-0.0 -1,-0.3 -0.700 75.6 -89.9-105.6 155.1 78.2 -51.4 -4.0 144 145 A R B -J 138 0C 65 -2,-0.3 -6,-0.2 -6,-0.2 -7,-0.1 -0.486 63.9 -89.7 -62.9 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4,-2.1 -5,-0.2 -1,-0.2 0.942 111.2 44.9 -57.1 -39.5 102.8 -26.5 -16.7 642 182 B L H X S+ 0 0 0 -4,-1.6 4,-2.8 1,-0.2 -2,-0.2 0.862 107.3 56.0 -76.0 -41.3 105.6 -25.2 -14.5 643 183 B V H X S+ 0 0 1 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.902 110.0 47.7 -53.4 -43.5 107.6 -23.6 -17.2 644 184 B R H X S+ 0 0 27 -4,-2.3 4,-0.9 2,-0.2 -2,-0.2 0.918 113.1 48.0 -67.1 -39.1 104.4 -21.6 -18.0 645 185 B A H < S+ 0 0 0 -4,-2.1 3,-0.5 1,-0.2 -2,-0.2 0.911 113.5 48.9 -64.2 -42.1 104.0 -20.7 -14.3 646 186 B L H >< S+ 0 0 10 -4,-2.8 3,-1.3 1,-0.2 6,-0.4 0.866 105.6 54.6 -68.6 -31.8 107.6 -19.7 -14.1 647 187 B T H 3< S+ 0 0 14 -4,-2.0 54,-0.8 1,-0.3 -1,-0.2 0.682 109.9 48.0 -82.1 -12.4 107.6 -17.5 -17.1 648 188 B S T 3< S+ 0 0 71 -4,-0.9 -1,-0.3 -3,-0.5 2,-0.2 0.173 103.3 78.9-110.7 19.7 104.7 -15.4 -15.8 649 189 B S S X S- 0 0 27 -3,-1.3 3,-2.0 -5,-0.0 4,-0.2 -0.549 104.0 -84.0-107.3-178.2 106.2 -15.0 -12.3 650 190 B G G > S+ 0 0 50 1,-0.3 3,-2.5 2,-0.2 6,-0.2 0.741 114.6 83.6 -63.5 -18.8 109.0 -12.7 -11.0 651 191 B L G 3 S+ 0 0 14 1,-0.3 -1,-0.3 -5,-0.2 -4,-0.1 0.817 90.1 52.5 -50.7 -33.6 111.5 -15.2 -12.2 652 192 B A G < S+ 0 0 19 -3,-2.0 -1,-0.3 -6,-0.4 2,-0.2 0.390 75.0 122.2 -87.3 2.4 111.2 -13.5 -15.5 653 193 B S <> - 0 0 26 -3,-2.5 4,-2.6 1,-0.2 3,-0.4 -0.516 60.1-142.1 -64.9 129.3 111.8 -10.0 -14.4 654 194 B L H > S+ 0 0 52 -2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.866 99.3 54.3 -55.3 -40.6 114.8 -8.8 -16.4 655 195 B H H > S+ 0 0 56 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.828 111.9 44.2 -72.3 -28.2 116.2 -6.9 -13.5 656 196 B L H >> S+ 0 0 65 -3,-0.4 4,-1.4 -6,-0.2 3,-0.9 0.958 112.6 51.5 -73.6 -47.6 116.2 -10.0 -11.2 657 197 B V H 3X S+ 0 0 1 -4,-2.6 4,-0.7 1,-0.3 3,-0.4 0.880 109.5 50.4 -58.9 -40.7 117.5 -12.2 -13.9 658 198 B H H >X S+ 0 0 2 -4,-2.4 4,-1.1 1,-0.2 3,-0.7 0.825 98.5 67.2 -63.1 -33.6 120.4 -9.8 -14.5 659 199 B D H XX S+ 0 0 58 -4,-1.0 4,-1.3 -3,-0.9 3,-0.7 0.874 93.5 58.6 -60.5 -38.3 121.2 -9.7 -10.8 660 200 B W H 3X S+ 0 0 30 -4,-1.4 4,-2.4 -3,-0.4 3,-0.3 0.891 96.8 61.6 -57.8 -39.5 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