==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-SEP-10 3P09 . COMPND 2 MOLECULE: BETA-LACTAMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: FRANCISELLA TULARENSIS SUBSP. TULARENS . AUTHOR Y.KIM,M.MAKOWSKA-GRZYSKA,J.HASSEMAN,W.F.ANDERSON,A.JOACHIMIA . 528 4 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22986.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 374 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 77 14.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 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 . 12 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 182 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.7 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 0 0 0 2 2 2 2 4 0 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 3 4 2 0 0 0 3 3 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 2 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 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 20 A Q > 0 0 186 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -34.9 23.0 101.2 2.0 2 21 A L H > + 0 0 48 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.937 360.0 51.9 -61.0 -45.6 24.0 98.4 4.4 3 22 A D H > S+ 0 0 94 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.899 107.7 50.2 -51.9 -47.0 20.3 97.6 3.9 4 23 A D H > S+ 0 0 90 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.868 110.1 51.2 -61.4 -38.3 20.8 97.7 0.1 5 24 A S H X S+ 0 0 40 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.881 109.5 47.8 -70.4 -38.9 23.8 95.3 0.4 6 25 A F H X S+ 0 0 1 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.913 110.3 53.5 -67.5 -40.6 21.9 92.7 2.5 7 26 A K H X S+ 0 0 91 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.860 104.2 56.1 -59.4 -37.4 19.0 92.9 0.1 8 27 A N H X S+ 0 0 98 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.886 103.9 53.7 -62.4 -37.5 21.5 92.2 -2.8 9 28 A L H X S+ 0 0 12 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.900 108.6 49.4 -62.9 -40.4 22.6 89.0 -0.9 10 29 A E H X S+ 0 0 8 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.909 111.3 48.4 -63.8 -44.0 19.0 87.8 -0.8 11 30 A N H < S+ 0 0 103 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.876 113.9 48.5 -60.7 -39.6 18.5 88.5 -4.5 12 31 A K H < S+ 0 0 126 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.891 128.5 19.4 -69.4 -41.6 21.7 86.7 -5.2 13 32 A Y H < S- 0 0 58 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.438 99.8-126.6-113.6 -0.9 21.0 83.5 -3.1 14 33 A D < + 0 0 106 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.1 0.085 68.2 60.3 64.8 170.9 17.2 83.5 -2.6 15 34 A G S S- 0 0 15 219,-0.1 2,-0.4 -4,-0.1 221,-0.3 -0.296 88.9 -59.0 77.0-160.8 15.7 83.3 0.9 16 35 A K E -A 235 0A 59 219,-3.4 219,-2.1 -3,-0.1 2,-0.4 -0.966 33.6-158.0-130.1 137.6 16.1 85.6 3.9 17 36 A I E -A 234 0A 0 -2,-0.4 2,-0.4 217,-0.2 217,-0.2 -0.939 9.8-161.4-114.3 140.3 19.2 86.8 5.8 18 37 A G E -A 233 0A 0 215,-3.1 215,-2.6 -2,-0.4 2,-0.4 -0.982 10.2-178.5-126.2 134.7 18.8 88.2 9.4 19 38 A I E +AB 232 29A 0 10,-2.7 10,-2.1 -2,-0.4 2,-0.3 -0.987 8.8 167.4-136.4 134.3 21.5 90.3 11.1 20 39 A Y E -AB 231 28A 24 211,-2.0 211,-2.6 -2,-0.4 2,-0.4 -0.964 9.1-170.4-146.6 137.2 21.8 91.9 14.5 21 40 A T E -A 230 0A 1 6,-1.4 2,-0.4 -2,-0.3 209,-0.2 -0.943 6.6-159.4-120.5 150.2 24.8 93.5 16.2 22 41 A L E -A 229 0A 32 207,-2.1 207,-2.0 -2,-0.4 2,-0.2 -0.984 5.6-162.8-133.8 122.9 25.0 94.6 19.8 23 42 A N 0 0 72 -2,-0.4 205,-0.1 205,-0.2 138,-0.0 -0.530 360.0 360.0 -98.2 168.3 27.4 97.1 21.3 24 43 A T 0 0 81 203,-0.3 -1,-0.1 -2,-0.2 202,-0.1 -0.511 360.0 360.0 -75.2 360.0 28.4 97.7 24.9 25 ! 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 26 48 A N 0 0 109 0, 0.0 2,-0.4 0, 0.0 -4,-0.1 0.000 360.0 360.0 360.0 102.8 23.7 99.3 15.5 27 49 A I + 0 0 14 2,-0.0 -6,-1.4 229,-0.0 2,-0.3 -0.708 360.0 157.7 -88.4 127.4 23.6 97.2 12.3 28 50 A K E +B 20 0A 108 -2,-0.4 2,-0.3 -8,-0.2 -8,-0.2 -0.998 17.3 173.2-151.3 146.8 20.3 95.2 11.9 29 51 A Y E S-B 19 0A 21 -10,-2.1 -10,-2.7 -2,-0.3 4,-0.1 -0.893 79.7 -10.2-159.6 126.4 18.4 93.7 9.0 30 52 A N S > S+ 0 0 45 -2,-0.3 3,-1.7 -12,-0.2 124,-0.1 0.863 82.1 160.3 50.1 38.1 15.3 91.5 9.2 31 53 A E T 3 + 0 0 43 1,-0.3 123,-2.3 122,-0.1 124,-0.4 0.633 68.0 43.8 -72.4 -11.1 16.1 91.5 12.9 32 54 A S T 3 S+ 0 0 46 121,-0.1 -1,-0.3 120,-0.1 2,-0.3 0.220 86.1 112.0-114.3 9.8 12.6 90.4 14.0 33 55 A Y S < S- 0 0 61 -3,-1.7 2,-0.5 -4,-0.1 121,-0.1 -0.625 70.7-119.8 -78.0 144.5 12.1 87.7 11.3 34 56 A H + 0 0 33 -2,-0.3 118,-0.2 118,-0.2 -2,-0.1 -0.780 34.2 179.6 -95.6 130.8 12.0 84.2 12.7 35 57 A F E -E 151 0B 0 116,-2.9 116,-2.3 -2,-0.5 200,-0.1 -0.924 41.1 -88.8-124.6 146.7 14.6 81.7 11.5 36 58 A P E -E 150 0B 3 0, 0.0 114,-0.3 0, 0.0 198,-0.2 -0.335 34.2-153.3 -49.4 131.1 15.2 78.0 12.4 37 59 A I > + 0 0 0 112,-2.0 3,-1.7 102,-0.2 113,-0.1 0.841 28.8 168.5 -81.9 -33.0 17.5 78.1 15.4 38 60 A a G > - 0 0 0 111,-0.5 3,-1.6 101,-0.5 4,-0.1 -0.208 68.4 -13.1 55.0-145.8 19.1 74.7 14.7 39 61 A S G > S+ 0 0 12 1,-0.3 3,-2.0 2,-0.2 -1,-0.3 0.565 116.3 88.8 -66.8 -8.6 22.2 73.9 16.8 40 62 A V G X> S+ 0 0 1 -3,-1.7 3,-2.0 1,-0.3 4,-0.6 0.836 71.7 74.3 -58.6 -28.9 22.5 77.5 18.0 41 63 A F H X> S+ 0 0 0 -3,-1.6 4,-2.0 1,-0.3 3,-0.7 0.780 77.3 80.2 -54.2 -23.1 20.2 76.6 20.9 42 64 A K H <> S+ 0 0 0 -3,-2.0 4,-1.9 1,-0.2 -1,-0.3 0.790 86.7 54.0 -61.9 -25.7 23.2 74.8 22.4 43 65 A F H <> S+ 0 0 0 -3,-2.0 4,-2.2 -4,-0.2 -1,-0.2 0.845 107.2 50.9 -77.0 -29.5 24.7 78.0 23.7 44 66 A L H < S- 0 0 68 -4,-1.3 3,-1.7 -3,-0.3 -1,-0.2 -0.658 89.7-143.1-141.2 76.4 23.9 74.4 42.7 57 79 A Q T 3 S+ 0 0 160 -3,-0.3 -3,-0.1 1,-0.2 -4,-0.1 -0.082 81.4 22.9 -51.6 134.5 27.5 74.6 43.7 58 80 A G T > S+ 0 0 35 -5,-0.2 3,-1.2 4,-0.0 4,-0.4 0.296 81.1 122.0 96.0 -8.3 29.7 71.8 42.3 59 81 A F G X + 0 0 11 -3,-1.7 3,-1.4 -6,-0.3 31,-0.4 0.843 67.6 60.0 -57.7 -37.7 27.5 70.9 39.4 60 82 A L G 3 S+ 0 0 10 1,-0.3 31,-2.3 30,-0.2 32,-0.3 0.784 106.3 48.2 -62.4 -27.9 30.2 71.6 36.8 61 83 A D G < S+ 0 0 123 -3,-1.2 -1,-0.3 29,-0.2 -2,-0.2 0.443 83.9 124.7 -90.7 -0.9 32.4 68.9 38.3 62 84 A K < - 0 0 108 -3,-1.4 28,-1.3 -4,-0.4 2,-0.4 -0.405 61.6-126.6 -68.3 130.9 29.6 66.4 38.5 63 85 A K E -G 89 0C 160 26,-0.2 26,-0.2 -2,-0.2 -1,-0.1 -0.645 24.0-167.0 -85.9 126.3 30.4 63.1 36.7 64 86 A I E -G 88 0C 5 24,-3.0 24,-2.4 -2,-0.4 2,-0.1 -0.954 19.3-128.0-116.9 121.9 28.0 61.9 34.1 65 87 A P E -G 87 0C 70 0, 0.0 2,-0.6 0, 0.0 22,-0.3 -0.424 18.0-142.4 -60.5 134.9 28.0 58.3 32.7 66 88 A I - 0 0 0 20,-2.9 19,-2.9 17,-0.4 20,-0.4 -0.928 23.9-170.9-102.7 115.0 28.1 58.3 28.9 67 89 A N >> - 0 0 74 -2,-0.6 3,-1.6 17,-0.2 4,-0.9 -0.731 34.4-117.1-107.5 156.5 25.9 55.4 27.6 68 90 A Q H >> S+ 0 0 123 1,-0.3 4,-2.3 -2,-0.3 3,-1.0 0.886 115.8 58.4 -57.6 -40.3 25.5 54.0 24.1 69 91 A D H 34 S+ 0 0 126 1,-0.3 -1,-0.3 2,-0.2 4,-0.1 0.683 95.9 64.5 -65.9 -16.7 21.8 54.9 24.1 70 92 A D H <4 S+ 0 0 18 -3,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.860 107.0 42.2 -69.3 -35.8 22.9 58.5 24.7 71 93 A I H X< S+ 0 0 16 -3,-1.0 3,-2.1 -4,-0.9 -2,-0.2 0.941 84.9 153.2 -74.7 -51.0 24.6 58.4 21.3 72 94 A G T 3< S- 0 0 51 -4,-2.3 -1,-0.1 1,-0.3 -2,-0.1 -0.332 76.9 -28.8 61.2-131.3 21.7 56.6 19.6 73 95 A K T 3 S+ 0 0 219 -4,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.129 99.3 129.2-103.8 18.8 21.5 57.3 15.9 74 96 A L < - 0 0 26 -3,-2.1 3,-0.1 1,-0.1 62,-0.0 -0.650 41.7-164.9 -76.6 121.4 23.0 60.8 16.3 75 97 A G + 0 0 84 -2,-0.5 2,-1.0 1,-0.2 -1,-0.1 0.771 69.4 67.5 -83.7 -28.8 25.9 61.0 13.8 76 98 A Y + 0 0 123 1,-0.1 26,-2.3 24,-0.1 -1,-0.2 -0.764 55.2 131.1-100.5 96.5 27.8 64.0 15.0 77 99 A A > + 0 0 10 -2,-1.0 4,-1.8 24,-0.2 5,-0.2 -0.469 16.1 162.6-141.5 60.7 29.3 63.1 18.4 78 100 A P T 4 S+ 0 0 44 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.842 81.8 20.9 -61.0 -36.8 33.0 64.0 18.3 79 101 A I T >4 S+ 0 0 34 2,-0.1 3,-1.6 17,-0.1 4,-0.2 0.884 123.6 50.2 -94.6 -51.0 33.6 63.9 22.0 80 102 A T G >4 S+ 0 0 0 1,-0.3 3,-2.0 2,-0.2 4,-0.1 0.864 103.5 60.8 -61.3 -35.2 30.8 61.7 23.4 81 103 A A G 3< S+ 0 0 58 -4,-1.8 3,-0.4 1,-0.3 -1,-0.3 0.724 101.6 54.6 -64.8 -20.9 31.4 58.9 21.0 82 104 A K G < S+ 0 0 171 -3,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.408 108.4 50.5 -89.7 4.3 35.0 58.6 22.3 83 105 A N X + 0 0 31 -3,-2.0 3,-2.1 -4,-0.2 -17,-0.4 0.154 66.2 143.9-132.4 20.6 33.7 58.1 25.9 84 106 A V T 3 S+ 0 0 52 -3,-0.4 -17,-0.2 1,-0.3 3,-0.1 -0.445 78.8 19.2 -65.3 130.2 31.0 55.4 25.9 85 107 A G T 3 S+ 0 0 71 -19,-2.9 -1,-0.3 1,-0.4 2,-0.2 0.422 118.1 80.0 86.6 -1.2 31.2 53.4 29.0 86 108 A K S < S- 0 0 136 -3,-2.1 -20,-2.9 -20,-0.4 -1,-0.4 -0.509 79.6-107.9-116.1-168.2 33.2 56.1 30.8 87 109 A T E -G 65 0C 73 -22,-0.3 2,-0.3 -2,-0.2 -24,-0.1 -0.915 19.3-164.1-125.5 155.4 32.1 59.4 32.4 88 110 A L E -G 64 0C 7 -24,-2.4 -24,-3.0 -2,-0.3 2,-0.1 -0.975 25.9-116.4-130.7 145.2 32.4 63.1 31.5 89 111 A T E > -G 63 0C 33 -2,-0.3 4,-1.8 -26,-0.2 -26,-0.2 -0.382 30.7-109.7 -72.5 160.8 32.0 66.1 33.8 90 112 A I H > S+ 0 0 0 -28,-1.3 4,-2.3 -31,-0.4 -29,-0.2 0.913 122.1 54.1 -53.8 -42.2 29.2 68.5 33.2 91 113 A S H > S+ 0 0 37 -31,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.900 106.1 51.0 -63.0 -39.5 31.8 71.1 32.1 92 114 A Q H > S+ 0 0 93 -32,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.845 110.1 50.5 -63.7 -34.1 33.3 68.6 29.6 93 115 A L H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.848 106.5 55.0 -72.2 -35.4 29.8 68.1 28.2 94 116 A N H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.935 108.1 48.9 -58.3 -48.6 29.3 71.9 28.0 95 117 A Y H X S+ 0 0 90 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.932 112.5 48.5 -56.6 -47.8 32.5 72.0 25.9 96 118 A A H <>S+ 0 0 0 -4,-2.0 5,-2.9 1,-0.2 -1,-0.2 0.900 110.2 51.2 -58.5 -45.6 31.2 69.2 23.7 97 119 A A H ><5S+ 0 0 0 -4,-2.7 3,-1.8 3,-0.2 -1,-0.2 0.885 107.9 51.4 -62.2 -41.3 27.8 70.9 23.2 98 120 A I H 3<5S+ 0 0 0 -4,-2.4 107,-0.3 1,-0.3 -1,-0.2 0.825 106.4 54.5 -67.2 -29.8 29.4 74.2 22.2 99 121 A L T 3<5S- 0 0 7 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.294 128.4-107.3 -81.1 9.1 31.4 72.2 19.7 100 122 A S T < 5 + 0 0 14 -3,-1.8 2,-0.4 1,-0.2 -3,-0.2 0.588 58.5 166.1 76.6 16.8 27.9 71.0 18.5 101 123 A D >< - 0 0 0 -5,-2.9 4,-1.6 1,-0.2 -1,-0.2 -0.483 23.5-156.6 -61.9 116.6 28.1 67.4 19.9 102 124 A S H > S+ 0 0 11 -26,-2.3 4,-2.3 -2,-0.4 34,-0.2 0.938 87.3 47.3 -71.6 -48.7 24.5 66.2 19.8 103 125 A P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.900 110.3 55.7 -58.9 -37.9 24.5 63.5 22.4 104 126 A A H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.914 107.8 49.5 -56.9 -44.2 26.3 65.9 24.7 105 127 A S H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.899 109.5 49.3 -62.5 -45.7 23.4 68.4 24.2 106 128 A N H X S+ 0 0 34 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.892 110.3 52.1 -64.8 -37.4 20.7 65.9 24.9 107 129 A I H X S+ 0 0 0 -4,-2.2 4,-3.0 -5,-0.2 5,-0.2 0.921 109.0 50.2 -61.4 -43.2 22.5 64.8 28.1 108 130 A L H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 6,-0.2 0.905 107.5 52.8 -64.7 -41.7 22.7 68.4 29.3 109 131 A V H X>S+ 0 0 6 -4,-2.2 5,-3.0 2,-0.2 4,-0.7 0.928 113.0 45.7 -57.7 -45.5 19.0 68.9 28.7 110 132 A R H ><5S+ 0 0 115 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.943 112.9 48.2 -62.5 -48.7 18.3 65.9 30.8 111 133 A E H 3<5S+ 0 0 52 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.746 107.3 57.7 -68.6 -20.7 20.7 66.8 33.6 112 134 A L H 3<5S- 0 0 10 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.695 128.0 -99.6 -76.0 -21.5 19.2 70.3 33.6 113 135 A G T <<5 - 0 0 51 -3,-1.2 3,-0.2 -4,-0.7 -3,-0.2 0.503 69.2 -67.9 110.3 9.9 15.8 68.8 34.3 114 136 A G >< - 0 0 21 -5,-3.0 4,-1.3 -6,-0.2 3,-0.4 -0.351 68.8 -53.1 104.9 178.3 14.4 68.8 30.8 115 137 A L H > S+ 0 0 42 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.780 123.6 63.9 -67.1 -30.7 13.2 71.3 28.2 116 138 A Q H > S+ 0 0 166 1,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.923 104.3 48.1 -60.6 -42.1 10.7 73.1 30.5 117 139 A N H > S+ 0 0 54 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.874 109.9 52.4 -64.8 -39.4 13.7 74.2 32.6 118 140 A L H X S+ 0 0 0 -4,-1.3 4,-2.6 2,-0.2 -2,-0.2 0.939 109.8 48.1 -60.5 -49.0 15.6 75.4 29.6 119 141 A N H X S+ 0 0 29 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.867 108.5 55.1 -62.7 -36.7 12.7 77.5 28.4 120 142 A K H X S+ 0 0 132 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.931 109.5 47.6 -57.3 -45.4 12.3 79.0 31.9 121 143 A F H X S+ 0 0 11 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.935 108.0 54.3 -63.6 -44.0 15.9 80.0 31.7 122 144 A I H <>S+ 0 0 2 -4,-2.6 5,-1.8 1,-0.2 4,-0.4 0.920 109.2 48.9 -55.3 -43.6 15.5 81.5 28.2 123 145 A K H ><5S+ 0 0 130 -4,-2.2 3,-1.8 1,-0.2 -1,-0.2 0.897 105.3 57.8 -63.0 -38.7 12.6 83.6 29.6 124 146 A K H 3<5S+ 0 0 108 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.825 99.5 60.0 -59.8 -32.5 14.8 84.7 32.5 125 147 A L T 3<5S- 0 0 8 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.620 123.5-107.1 -67.0 -15.2 17.3 86.0 29.9 126 148 A G T < 5S+ 0 0 47 -3,-1.8 2,-0.8 -4,-0.4 -3,-0.2 0.530 75.6 140.1 95.5 10.0 14.5 88.3 28.7 127 149 A D < + 0 0 5 -5,-1.8 -1,-0.2 1,-0.1 -2,-0.1 -0.778 14.0 157.7 -94.9 105.8 14.0 86.3 25.5 128 150 A N + 0 0 114 -2,-0.8 -1,-0.1 -3,-0.1 -5,-0.1 0.194 68.9 62.4-107.6 14.1 10.4 86.0 24.6 129 151 A D S S+ 0 0 49 23,-0.1 2,-0.4 1,-0.0 21,-0.2 0.719 79.0 87.9-106.8 -31.0 10.9 85.2 20.9 130 152 A T - 0 0 6 21,-0.1 2,-0.6 -8,-0.1 21,-0.2 -0.588 55.6-171.4 -78.1 122.8 12.9 81.9 21.0 131 153 A I B +F 150 0B 29 19,-2.1 18,-2.2 -2,-0.4 19,-0.5 -0.911 5.5 178.8-120.9 106.6 10.6 78.9 21.1 132 154 A I + 0 0 2 -2,-0.6 -13,-0.1 17,-0.2 3,-0.1 -0.907 12.9 161.1-110.1 127.4 12.3 75.5 21.7 133 155 A T + 0 0 75 -2,-0.5 2,-0.3 1,-0.1 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