==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 30-MAR-11 2YES . COMPND 2 MOLECULE: MOCA-RELATED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR H.J.CHO,B.S.KANG . 370 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17243.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 242 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 52 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 8.1 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 . 4 1.1 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 . 24 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 20.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 0 4 2 2 0 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 2 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 PARALLEL BRIDGES PER LADDER . 0 2 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 4 A T 0 0 60 0, 0.0 2,-0.3 0, 0.0 86,-0.2 0.000 360.0 360.0 360.0 166.4 9.3 10.5 -16.6 2 5 A Q E -a 87 0A 26 84,-1.6 86,-1.8 82,-0.1 2,-0.4 -0.906 360.0-143.9-133.5 157.9 11.0 9.7 -20.0 3 6 A I E - 0 0 15 -2,-0.3 38,-2.1 84,-0.2 39,-1.0 -0.995 17.5-163.5-123.0 125.7 11.2 7.1 -22.7 4 7 A T E -ab 90 42A 0 85,-1.2 87,-2.3 -2,-0.4 2,-0.4 -0.894 6.6-149.4-108.6 134.3 14.5 6.4 -24.4 5 8 A G E -ab 91 43A 0 37,-2.9 39,-2.8 -2,-0.4 2,-0.5 -0.868 9.0-161.7-100.7 139.1 14.8 4.5 -27.6 6 9 A V E -ab 92 44A 0 85,-2.9 87,-3.1 -2,-0.4 2,-0.6 -0.988 3.1-165.2-123.4 123.7 17.9 2.4 -28.4 7 10 A V E -ab 93 45A 0 37,-3.2 39,-2.5 -2,-0.5 2,-0.6 -0.943 9.9-152.6-107.7 115.4 18.9 1.4 -31.9 8 11 A L E +ab 94 46A 13 85,-2.7 87,-4.0 -2,-0.6 88,-0.4 -0.807 33.1 150.1 -87.5 118.6 21.5 -1.4 -32.0 9 12 A A E + b 0 47A 5 37,-1.2 39,-0.6 -2,-0.6 9,-0.1 -0.039 35.6 107.1-138.7 31.7 23.5 -1.1 -35.3 10 13 A A + 0 0 8 37,-0.3 39,-0.4 63,-0.1 37,-0.1 0.441 45.7 131.5 -91.6 -1.3 26.9 -2.5 -34.3 11 14 A G - 0 0 33 37,-0.1 7,-0.2 1,-0.1 6,-0.2 -0.273 57.9-120.8 -60.5 132.0 26.3 -5.8 -36.2 12 15 A R 0 0 76 1,-0.1 -1,-0.1 4,-0.1 -2,-0.0 -0.395 360.0 360.0 -73.6 149.8 29.2 -6.9 -38.5 13 16 A S 0 0 100 -2,-0.1 -1,-0.1 162,-0.0 162,-0.1 -0.716 360.0 360.0 -88.5 360.0 28.6 -7.3 -42.3 14 ! 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 15 21 A T 0 0 145 0, 0.0 2,-0.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 127.9 30.2 -2.5 -47.9 16 22 A P > - 0 0 33 0, 0.0 3,-1.7 0, 0.0 4,-0.3 -0.425 360.0-132.8 -61.5 132.8 28.7 -2.1 -44.4 17 23 A K G > S+ 0 0 16 1,-0.3 3,-1.0 2,-0.2 10,-0.3 0.786 105.1 64.1 -55.8 -31.4 25.2 -3.6 -44.2 18 24 A Q G 3 S+ 0 0 12 1,-0.2 10,-2.1 -7,-0.2 11,-0.5 0.754 103.4 47.6 -63.2 -27.1 24.0 -0.3 -42.5 19 25 A L G < S+ 0 0 31 -3,-1.7 -1,-0.2 7,-0.2 -2,-0.2 0.371 77.8 126.2-102.7 2.3 24.8 1.6 -45.7 20 26 A L S < S- 0 0 20 -3,-1.0 7,-1.9 -4,-0.3 8,-0.1 -0.392 71.1-100.5 -60.4 134.9 23.1 -0.7 -48.2 21 27 A P E +G 26 0B 84 0, 0.0 5,-0.3 0, 0.0 2,-0.3 -0.321 51.1 162.6 -62.8 138.5 20.6 1.3 -50.3 22 28 A Y E > -G 25 0B 25 3,-3.1 3,-2.2 -3,-0.1 8,-0.1 -0.890 62.6 -15.0-160.0 127.2 16.9 1.1 -49.4 23 29 A R T 3 S- 0 0 167 1,-0.3 3,-0.1 -2,-0.3 163,-0.0 0.875 125.9 -50.6 43.4 55.4 13.9 3.3 -50.3 24 30 A D T 3 S+ 0 0 186 1,-0.3 -1,-0.3 6,-0.0 2,-0.2 0.389 136.5 55.4 67.7 -2.1 16.0 6.2 -51.5 25 31 A T E < S-G 22 0B 54 -3,-2.2 -3,-3.1 1,-0.1 -1,-0.3 -0.401 97.1 -76.0-128.5-152.7 18.0 6.1 -48.3 26 32 A T E > -G 21 0B 27 -5,-0.3 4,-2.6 -2,-0.2 5,-0.2 -0.676 37.5-107.4-108.6 169.1 20.0 3.4 -46.5 27 33 A V H > S+ 0 0 1 -7,-1.9 4,-1.7 -10,-0.3 -8,-0.2 0.953 123.4 38.7 -58.3 -51.9 18.9 0.4 -44.4 28 34 A L H > S+ 0 0 0 -10,-2.1 4,-2.8 2,-0.2 5,-0.2 0.888 113.8 55.9 -66.1 -41.4 20.1 2.1 -41.1 29 35 A G H > S+ 0 0 6 -11,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.889 107.1 49.9 -57.0 -42.5 18.8 5.5 -42.3 30 36 A A H X S+ 0 0 11 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.906 110.9 49.1 -62.1 -44.6 15.3 4.1 -42.9 31 37 A T H X S+ 0 0 6 -4,-1.7 4,-2.3 64,-0.3 -2,-0.2 0.928 112.8 47.1 -60.0 -47.7 15.4 2.6 -39.4 32 38 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.866 107.2 57.4 -64.2 -37.6 16.5 5.9 -37.8 33 39 A D H < S+ 0 0 75 -4,-2.3 4,-0.5 -5,-0.2 -1,-0.2 0.878 109.3 46.2 -57.6 -40.1 13.8 7.7 -39.8 34 40 A V H >X S+ 0 0 20 -4,-1.7 3,-1.2 2,-0.2 4,-0.5 0.930 111.7 50.1 -67.9 -47.1 11.2 5.5 -38.2 35 41 A A H ><>S+ 0 0 1 -4,-2.3 3,-1.0 1,-0.3 5,-0.5 0.854 105.2 57.9 -60.4 -37.1 12.7 5.9 -34.7 36 42 A R T 3<5S+ 0 0 104 -4,-2.5 -1,-0.3 1,-0.2 3,-0.2 0.671 104.2 53.2 -67.6 -18.2 12.7 9.7 -35.1 37 43 A Q T <45S+ 0 0 105 -3,-1.2 -1,-0.2 -4,-0.5 -2,-0.2 0.577 91.2 77.0 -90.1 -12.4 8.9 9.6 -35.7 38 44 A A T <<5S- 0 0 8 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.2 0.685 101.7-116.6 -78.1 -22.0 8.1 7.7 -32.5 39 45 A G T 5 + 0 0 58 -4,-0.4 2,-0.2 -3,-0.2 -36,-0.1 0.811 46.4 173.7 89.4 33.7 8.5 10.6 -30.1 40 46 A F < - 0 0 31 -5,-0.5 -1,-0.2 1,-0.1 -36,-0.2 -0.492 33.0-145.6 -70.8 141.4 11.4 9.4 -28.0 41 47 A D S S+ 0 0 93 -38,-2.1 2,-0.3 1,-0.3 -37,-0.2 0.767 90.8 17.5 -72.4 -28.5 12.8 11.9 -25.4 42 48 A Q E -b 4 0A 8 -39,-1.0 -37,-2.9 2,-0.0 2,-0.5 -0.995 67.7-160.3-146.2 138.1 16.2 10.4 -26.1 43 49 A L E -b 5 0A 13 19,-0.4 21,-3.2 -2,-0.3 2,-0.4 -0.978 8.5-170.5-126.4 119.9 17.6 8.3 -29.0 44 50 A I E -bc 6 64A 0 -39,-2.8 -37,-3.2 -2,-0.5 2,-0.4 -0.906 1.5-167.8-109.3 132.6 20.8 6.3 -28.6 45 51 A L E -bc 7 65A 0 19,-2.6 21,-3.1 -2,-0.4 2,-0.4 -0.983 7.0-153.4-120.1 130.2 22.5 4.6 -31.6 46 52 A T E -bc 8 66A 0 -39,-2.5 -37,-1.2 -2,-0.4 2,-0.3 -0.861 15.4-177.5-101.5 138.2 25.2 2.0 -31.2 47 53 A L E -bc 9 67A 2 19,-2.8 21,-2.9 -2,-0.4 -37,-0.3 -0.935 7.5-167.7-131.4 155.6 27.8 1.5 -34.0 48 54 A G > - 0 0 6 -39,-0.6 3,-1.2 -2,-0.3 -37,-0.1 0.269 64.5 -28.1-109.3-126.6 30.7 -0.9 -34.5 49 55 A G T 3 S+ 0 0 66 -39,-0.4 3,-0.4 1,-0.3 4,-0.2 0.699 131.0 60.6 -70.1 -21.7 33.6 -1.0 -36.9 50 56 A A T 3> S+ 0 0 24 1,-0.2 4,-2.6 2,-0.1 -1,-0.3 0.294 71.1 112.3 -88.4 9.2 31.6 0.8 -39.6 51 57 A A H <> S+ 0 0 8 -3,-1.2 4,-2.6 1,-0.2 -1,-0.2 0.879 76.1 47.0 -49.5 -51.5 31.2 3.9 -37.3 52 58 A S H > S+ 0 0 96 -3,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.902 113.5 48.5 -59.8 -45.2 33.3 6.2 -39.4 53 59 A A H > S+ 0 0 42 -4,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.898 112.3 48.3 -62.7 -43.8 31.6 5.2 -42.7 54 60 A V H >X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 3,-0.8 0.935 110.1 52.2 -62.2 -47.8 28.2 5.7 -41.2 55 61 A R H 3< S+ 0 0 123 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.863 111.0 46.9 -55.6 -42.0 29.1 9.1 -39.8 56 62 A A H 3< S+ 0 0 95 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.669 115.0 47.3 -76.1 -18.1 30.3 10.3 -43.2 57 63 A A H << S+ 0 0 65 -4,-0.9 2,-0.3 -3,-0.8 -2,-0.2 0.712 117.1 29.2 -97.9 -25.7 27.3 9.0 -45.1 58 64 A M S < S- 0 0 31 -4,-1.9 2,-0.5 -5,-0.1 -1,-0.2 -0.996 75.2-116.3-141.5 143.9 24.5 10.3 -42.8 59 65 A A - 0 0 68 -2,-0.3 -3,-0.1 1,-0.1 -4,-0.1 -0.674 22.8-163.7 -74.3 121.6 23.8 13.2 -40.5 60 66 A L > + 0 0 24 -2,-0.5 3,-1.6 -5,-0.2 -1,-0.1 -0.139 26.3 164.2-102.1 37.4 23.3 11.7 -37.0 61 67 A D T 3 + 0 0 124 1,-0.2 3,-0.1 3,-0.0 -2,-0.0 -0.260 63.4 10.3 -59.4 135.1 21.6 14.9 -35.6 62 68 A G T 3 S+ 0 0 79 1,-0.2 -19,-0.4 -20,-0.0 2,-0.4 0.476 103.0 111.2 76.5 3.9 19.7 14.5 -32.4 63 69 A T < - 0 0 14 -3,-1.6 2,-0.9 -21,-0.1 -19,-0.2 -0.925 67.6-130.8-114.7 135.6 21.0 11.0 -31.7 64 70 A D E -c 44 0A 50 -21,-3.2 -19,-2.6 -2,-0.4 2,-0.5 -0.746 29.8-151.7 -81.9 106.9 23.5 9.9 -29.0 65 71 A V E -c 45 0A 27 -2,-0.9 2,-0.4 -21,-0.2 -19,-0.2 -0.705 13.6-172.4 -89.7 126.8 26.1 7.9 -30.8 66 72 A V E -c 46 0A 13 -21,-3.1 -19,-2.8 -2,-0.5 2,-0.4 -0.972 9.2-152.8-118.9 130.6 27.9 5.1 -28.9 67 73 A V E +c 47 0A 77 -2,-0.4 2,-0.3 -21,-0.2 -19,-0.2 -0.891 15.0 175.8-111.5 130.0 30.8 3.2 -30.5 68 74 A V - 0 0 21 -21,-2.9 2,-0.3 -2,-0.4 -17,-0.2 -0.832 29.8-111.6-120.8 164.8 32.0 -0.3 -29.8 69 75 A E 0 0 181 -2,-0.3 -59,-0.0 1,-0.1 -21,-0.0 -0.744 360.0 360.0 -96.2 146.0 34.7 -2.6 -31.3 70 76 A D 0 0 115 -2,-0.3 -1,-0.1 3,-0.1 -59,-0.1 0.377 360.0 360.0 -93.3 360.0 33.8 -5.7 -33.3 71 ! 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 72 81 A C 0 0 124 0, 0.0 2,-0.1 0, 0.0 75,-0.1 0.000 360.0 360.0 360.0 160.4 28.1 -10.1 -31.1 73 82 A A - 0 0 30 72,-0.1 73,-2.0 -63,-0.1 2,-1.2 -0.366 360.0-109.9 -75.8 162.5 29.6 -7.2 -29.2 74 83 A A > + 0 0 19 71,-0.3 4,-0.9 1,-0.2 71,-0.1 -0.557 62.1 143.7 -93.2 68.3 28.0 -5.9 -26.0 75 84 A S H > + 0 0 0 -2,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.783 65.4 60.4 -78.3 -27.5 26.7 -2.7 -27.4 76 85 A L H > S+ 0 0 3 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.903 99.9 57.1 -65.6 -41.0 23.5 -2.7 -25.3 77 86 A R H > S+ 0 0 114 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.900 111.3 41.3 -54.1 -46.3 25.6 -2.6 -22.1 78 87 A V H < S+ 0 0 57 -4,-0.9 4,-0.4 1,-0.2 -1,-0.2 0.783 110.6 57.5 -77.4 -26.9 27.4 0.6 -23.2 79 88 A A H >X S+ 0 0 0 -4,-1.8 3,-1.5 1,-0.2 4,-0.6 0.884 99.5 59.8 -65.8 -39.0 24.1 2.1 -24.5 80 89 A L H >< S+ 0 0 21 -4,-2.3 3,-1.0 1,-0.3 -1,-0.2 0.836 94.7 63.6 -58.2 -34.1 22.6 1.7 -21.1 81 90 A A T 3< S+ 0 0 86 -4,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.740 103.2 49.7 -60.4 -24.7 25.3 3.9 -19.6 82 91 A R T <4 S+ 0 0 120 -3,-1.5 -1,-0.2 -4,-0.4 -2,-0.2 0.591 81.8 116.7 -90.8 -14.9 23.9 6.8 -21.8 83 92 A V S << S- 0 0 14 -3,-1.0 7,-0.0 -4,-0.6 -3,-0.0 -0.372 74.2-110.3 -62.7 126.0 20.2 6.3 -20.8 84 93 A H > - 0 0 75 -2,-0.2 3,-1.6 1,-0.1 -82,-0.1 -0.242 20.5-122.2 -57.4 140.8 18.9 9.4 -18.9 85 94 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -83,-0.1 0.781 110.3 56.3 -55.4 -32.6 18.2 8.9 -15.2 86 95 A R T 3 S+ 0 0 163 -85,-0.1 -84,-1.6 2,-0.0 2,-0.3 0.524 81.8 106.5 -83.4 -5.9 14.6 9.9 -15.5 87 96 A A E < -a 2 0A 1 -3,-1.6 -84,-0.2 -86,-0.2 3,-0.1 -0.569 57.8-158.0 -71.3 133.0 13.9 7.2 -18.1 88 97 A T E - 0 0 10 -86,-1.8 46,-2.6 -2,-0.3 47,-0.3 0.454 68.3 -36.2 -92.7 -2.8 11.9 4.4 -16.7 89 98 A G E - D 0 133A 0 -87,-0.4 -85,-1.2 44,-0.3 2,-0.4 -0.975 66.0 -90.1 171.1-171.5 13.1 2.0 -19.3 90 99 A I E -aD 4 132A 0 42,-2.8 42,-2.6 -2,-0.3 2,-0.6 -0.955 11.8-140.3-127.6 147.9 14.1 1.6 -23.0 91 100 A V E -aD 5 131A 0 -87,-2.3 -85,-2.9 -2,-0.4 2,-0.5 -0.945 31.5-148.2 -96.6 123.7 12.4 0.7 -26.3 92 101 A L E +aD 6 130A 1 38,-3.1 38,-1.9 -2,-0.6 2,-0.3 -0.844 21.9 171.3-102.6 127.5 14.9 -1.5 -28.1 93 102 A M E -a 7 0A 5 -87,-3.1 -85,-2.7 -2,-0.5 2,-0.4 -0.908 27.1-126.7-128.4 155.1 15.2 -1.6 -31.9 94 103 A L E > -a 8 0A 30 -2,-0.3 3,-1.7 -87,-0.2 -85,-0.2 -0.887 12.5-136.9-106.8 136.7 17.6 -3.1 -34.4 95 104 A G T 3 S+ 0 0 2 -87,-4.0 -64,-0.3 -2,-0.4 -86,-0.2 0.736 103.4 53.9 -60.6 -26.8 19.4 -1.1 -37.0 96 105 A D T 3 S+ 0 0 18 -88,-0.4 77,-2.4 1,-0.2 -1,-0.3 0.083 90.1 80.5 -98.7 22.8 18.8 -3.8 -39.7 97 106 A Q X + 0 0 9 -3,-1.7 3,-1.1 75,-0.2 -3,-0.2 -0.624 46.9 157.5-123.7 72.4 15.1 -3.9 -39.2 98 107 A P T 3 + 0 0 7 0, 0.0 -1,-0.1 0, 0.0 -64,-0.1 0.630 60.0 75.5 -75.6 -12.1 13.8 -0.9 -41.2 99 108 A Q T 3 + 0 0 68 72,-0.3 2,-0.0 -3,-0.1 -3,-0.0 0.503 61.5 124.6 -80.0 -5.8 10.2 -2.3 -41.6 100 109 A V < - 0 0 12 -3,-1.1 69,-0.0 1,-0.1 -7,-0.0 -0.356 64.7-123.3 -55.2 128.3 9.2 -1.6 -38.0 101 110 A A >> - 0 0 40 1,-0.1 4,-1.5 -2,-0.0 3,-0.5 -0.589 1.9-135.2 -79.8 136.4 6.0 0.6 -38.2 102 111 A P H 3> S+ 0 0 35 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.856 107.9 58.5 -55.1 -35.5 6.0 4.0 -36.5 103 112 A A H 3> S+ 0 0 57 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.858 101.6 53.1 -62.4 -39.0 2.5 3.1 -35.1 104 113 A T H <> S+ 0 0 9 -3,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.884 108.5 51.1 -62.9 -39.9 3.9 -0.0 -33.4 105 114 A L H X S+ 0 0 0 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.877 109.5 49.3 -65.0 -39.8 6.5 2.2 -31.7 106 115 A R H X S+ 0 0 123 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.877 111.3 50.6 -67.3 -36.7 3.9 4.6 -30.5 107 116 A R H X S+ 0 0 105 -4,-2.1 4,-2.3 2,-0.2 5,-0.4 0.910 112.1 45.2 -66.4 -44.9 1.8 1.7 -29.1 108 117 A I H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.839 110.4 54.7 -71.0 -32.2 4.7 0.1 -27.2 109 118 A I H < S+ 0 0 24 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.874 111.7 47.9 -62.5 -36.9 5.7 3.6 -25.9 110 119 A D H < S+ 0 0 76 -4,-1.5 -2,-0.2 -5,-0.1 -1,-0.1 0.968 128.2 17.1 -69.2 -56.5 2.2 3.8 -24.6 111 120 A V H >< S+ 0 0 50 -4,-2.3 3,-1.4 1,-0.1 -3,-0.2 0.674 105.4 82.7 -98.3 -21.1 1.6 0.5 -22.8 112 121 A G G >< S+ 0 0 0 -4,-1.9 3,-2.0 -5,-0.4 -3,-0.1 0.862 81.6 63.2 -48.8 -46.9 5.2 -0.7 -22.4 113 122 A P G 3 S+ 0 0 4 0, 0.0 -1,-0.2 0, 0.0 158,-0.1 0.680 93.7 62.9 -60.3 -19.1 6.0 1.3 -19.2 114 123 A A G < S+ 0 0 6 -3,-1.4 2,-0.3 156,-0.1 -2,-0.2 0.223 103.5 62.9 -86.0 13.0 3.3 -0.7 -17.3 115 124 A T S < S- 0 0 11 -3,-2.0 3,-0.2 1,-0.1 156,-0.2 -0.899 74.4-137.1-132.4 160.4 5.3 -3.9 -17.9 116 125 A E S S+ 0 0 35 43,-0.6 17,-2.9 1,-0.4 2,-0.4 0.887 97.2 3.6 -80.4 -46.5 8.7 -5.2 -16.9 117 126 A I E S-Ef 132 160A 0 42,-0.8 44,-3.1 15,-0.2 2,-0.4 -0.994 70.0-173.2-138.9 133.7 9.4 -6.6 -20.4 118 127 A M E -Ef 131 161A 12 13,-2.1 13,-2.8 -2,-0.4 2,-0.3 -0.997 2.9-178.8-128.4 135.2 7.2 -6.3 -23.5 119 128 A V E - f 0 162A 2 42,-2.4 44,-2.9 -2,-0.4 2,-0.4 -0.836 30.7-109.1-120.1 162.2 7.7 -8.0 -26.8 120 129 A C E -Ef 127 163A 0 7,-2.0 7,-2.3 9,-0.3 2,-0.7 -0.810 21.9-147.6 -93.0 133.9 5.6 -7.7 -30.0 121 130 A R E +Ef 126 164A 100 42,-3.3 44,-2.6 -2,-0.4 5,-0.2 -0.906 24.1 178.4-101.2 106.8 3.6 -10.8 -31.1 122 131 A Y E > -E 125 0A 15 3,-2.8 3,-0.7 -2,-0.7 46,-0.2 -0.315 46.1 -92.8 -93.9-176.6 3.4 -11.0 -34.9 123 132 A A T 3 S+ 0 0 87 44,-2.7 45,-0.2 1,-0.2 3,-0.1 0.821 126.4 37.8 -68.6 -32.4 1.7 -13.6 -37.0 124 133 A D T 3 S- 0 0 100 1,-0.3 2,-0.3 43,-0.2 -1,-0.2 0.165 126.7 -76.0-108.0 16.1 4.9 -15.7 -37.3 125 134 A G E < S- E 0 122A 18 -3,-0.7 -3,-2.8 2,-0.0 -1,-0.3 -0.785 72.8 -16.4 131.1-168.2 6.2 -15.2 -33.7 126 135 A V E + E 0 121A 17 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.441 63.6 153.9 -75.2 143.8 7.9 -12.8 -31.3 127 136 A G E - E 0 120A 2 -7,-2.3 -7,-2.0 2,-0.2 -2,-0.0 -0.980 26.4 -34.7-161.3 171.5 9.7 -9.7 -32.6 128 137 A H E S+ 0 0 17 -2,-0.3 2,-0.1 -9,-0.1 -35,-0.1 -0.306 80.3 71.0 -71.0 159.9 11.0 -6.2 -32.1 129 138 A P E - 0 0 0 0, 0.0 2,-0.3 0, 0.0 -9,-0.3 0.507 66.5-172.7 -73.2 154.1 10.5 -3.6 -30.8 130 139 A F E -D 92 0A 0 -38,-1.9 -38,-3.1 -11,-0.2 2,-0.4 -0.842 14.5-146.4-107.9 152.3 11.1 -4.7 -27.2 131 140 A W E -DE 91 118A 1 -13,-2.8 -13,-2.1 -2,-0.3 2,-0.4 -0.979 13.9-173.4-113.4 134.3 10.4 -2.7 -24.0 132 141 A F E -DE 90 117A 0 -42,-2.6 -42,-2.8 -2,-0.4 -15,-0.2 -0.990 16.8-138.4-125.7 124.0 12.7 -3.2 -21.0 133 142 A S E > -D 89 0A 13 -17,-2.9 3,-2.1 -2,-0.4 -44,-0.3 -0.389 29.1-109.6 -69.9 153.5 12.0 -1.5 -17.7 134 143 A R G > S+ 0 0 101 -46,-2.6 3,-1.9 1,-0.3 4,-0.4 0.802 113.9 75.6 -49.4 -33.7 14.8 -0.0 -15.6 135 144 A T G 3 S+ 0 0 76 -47,-0.3 -1,-0.3 1,-0.3 4,-0.2 0.735 100.1 41.5 -54.8 -24.2 14.3 -2.9 -13.2 136 145 A V G <> S+ 0 0 1 -3,-2.1 4,-2.3 -20,-0.2 -1,-0.3 0.335 82.0 101.5-107.5 7.4 16.1 -5.2 -15.7 137 146 A F H <> S+ 0 0 21 -3,-1.9 4,-2.3 1,-0.2 5,-0.2 0.885 81.7 54.2 -57.7 -42.4 18.9 -2.9 -16.8 138 147 A G H > S+ 0 0 49 -4,-0.4 4,-1.1 2,-0.2 -1,-0.2 0.918 109.7 46.3 -56.9 -48.2 21.4 -4.7 -14.5 139 148 A E H 4 S+ 0 0 95 1,-0.2 4,-0.4 2,-0.2 3,-0.4 0.891 111.0 52.5 -62.1 -42.5 20.5 -8.1 -16.1 140 149 A L H >< S+ 0 0 3 -4,-2.3 3,-1.0 1,-0.2 -2,-0.2 0.899 108.7 50.9 -59.2 -42.8 20.8 -6.6 -19.6 141 150 A A H 3< S+ 0 0 27 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.731 105.8 56.5 -67.5 -24.4 24.2 -5.3 -18.8 142 151 A R T 3< S+ 0 0 216 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.462 80.0 109.5 -92.6 -2.0 25.4 -8.7 -17.5 143 152 A L S < S- 0 0 37 -3,-1.0 -66,-0.1 -4,-0.4 3,-0.1 -0.499 77.3-125.5 -66.5 142.5 24.5 -10.5 -20.8 144 153 A H S S- 0 0 178 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.880 81.1 -22.6 -58.6 -41.2 27.7 -11.6 -22.6 145 154 A G S > S- 0 0 7 -71,-0.1 3,-1.5 -72,-0.1 -71,-0.3 -0.905 78.8 -77.2-156.2-176.9 26.6 -9.7 -25.8 146 155 A D G > S+ 0 0 31 -73,-2.0 3,-1.1 -2,-0.3 4,-0.3 0.703 118.3 70.3 -63.7 -21.2 23.6 -8.3 -27.7 147 156 A K G > S+ 0 0 68 1,-0.2 3,-0.8 -74,-0.1 4,-0.4 0.738 84.0 70.5 -67.6 -23.8 22.8 -11.9 -28.8 148 157 A G G <> S+ 0 0 25 -3,-1.5 4,-1.4 1,-0.2 -1,-0.2 0.548 76.7 80.2 -73.9 -9.5 21.7 -12.8 -25.3 149 158 A V H <> S+ 0 0 7 -3,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.873 83.9 61.4 -64.2 -39.3 18.5 -10.7 -25.4 150 159 A W H <> S+ 0 0 138 -3,-0.8 4,-0.6 -4,-0.3 -1,-0.2 0.892 106.0 45.2 -56.9 -45.4 16.6 -13.3 -27.4 151 160 A K H >4 S+ 0 0 177 -4,-0.4 3,-0.6 1,-0.2 4,-0.4 0.882 111.2 54.9 -64.9 -39.6 16.9 -15.9 -24.6 152 161 A L H >< S+ 0 0 15 -4,-1.4 3,-1.3 1,-0.2 6,-0.2 0.909 104.8 51.0 -61.7 -44.7 16.0 -13.3 -21.9 153 162 A V H 3< S+ 0 0 6 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.630 111.9 48.8 -72.6 -13.4 12.7 -12.3 -23.6 154 163 A H T << S+ 0 0 102 -3,-0.6 -1,-0.3 -4,-0.6 -2,-0.2 0.403 90.1 111.1-100.8 -1.0 11.6 -15.9 -23.8 155 164 A S X - 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