==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 08-FEB-13 4J5F . COMPND 2 MOLECULE: N-ACYL HOMOSERINE LACTONASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS THURINGIENSIS; . AUTHOR C.F.LIU,D.LIU,J.MOMB,P.W.THOMAS,A.LAJOIE,G.A.PETSKO,W.FAST,D . 250 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10976.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 16.4 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 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 39 15.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 1 0 1 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 1 1 3 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 0 145 0, 0.0 2,-0.3 0, 0.0 178,-0.1 0.000 360.0 360.0 360.0 154.2 -11.1 -10.4 4.0 2 2 A T - 0 0 51 176,-0.0 2,-0.3 158,-0.0 41,-0.3 -0.883 360.0 -99.0-127.4 162.4 -8.4 -8.2 2.5 3 3 A V B -a 180 0A 0 176,-3.5 178,-2.8 -2,-0.3 179,-0.3 -0.662 27.8-144.3 -78.2 136.7 -7.3 -4.5 2.8 4 4 A K S S+ 0 0 82 37,-1.7 2,-0.4 -2,-0.3 178,-0.3 0.938 76.6 4.6 -72.0 -45.8 -8.8 -2.4 -0.2 5 5 A K E -F 41 0B 70 36,-1.6 36,-2.7 176,-0.1 2,-0.5 -0.992 53.7-162.7-140.7 147.5 -5.7 -0.1 -0.6 6 6 A L E -F 40 0B 0 244,-1.6 244,-2.5 -2,-0.4 2,-0.4 -0.985 17.9-164.0-124.8 113.2 -2.3 0.2 0.9 7 7 A Y E -F 39 0B 21 32,-2.9 32,-1.9 -2,-0.5 2,-0.7 -0.879 13.4-150.2-101.5 132.9 -0.6 3.6 0.3 8 8 A F E -F 38 0B 3 240,-0.5 238,-2.6 -2,-0.4 30,-0.2 -0.894 23.5-167.5 -94.7 117.0 3.1 4.3 0.7 9 9 A I E -F 37 0B 9 28,-2.7 28,-2.2 -2,-0.7 2,-0.1 -0.921 17.9-134.2-117.7 111.8 3.2 7.9 1.7 10 10 A P E -F 36 0B 60 0, 0.0 26,-0.2 0, 0.0 3,-0.1 -0.408 20.7-174.8 -59.3 132.7 6.5 9.9 1.6 11 11 A A E - 0 0 0 24,-2.7 42,-0.5 1,-0.6 2,-0.2 -0.163 51.7 -76.8-125.5 37.2 6.8 11.9 4.9 12 12 A G E - 0 0 12 23,-0.2 23,-2.1 40,-0.1 -1,-0.6 -0.522 56.5 -96.8 93.5-169.3 10.0 13.9 4.3 13 13 A R E -FG 34 76B 69 63,-2.4 63,-2.7 21,-0.2 2,-0.3 -0.858 20.5-145.6-143.8 175.4 13.5 12.6 4.6 14 14 A C E -FG 33 75B 2 19,-2.4 19,-2.9 -2,-0.3 2,-0.5 -0.964 12.8-135.1-154.5 135.9 16.5 12.4 6.9 15 15 A M E +FG 32 74B 38 59,-2.9 59,-2.4 -2,-0.3 2,-0.3 -0.788 33.5 167.7 -88.4 123.9 20.3 12.5 6.6 16 16 A L E -FG 31 73B 14 15,-1.8 15,-1.5 -2,-0.5 57,-0.2 -0.932 42.0 -97.2-128.3 156.4 22.1 9.8 8.7 17 17 A D E > -F 30 0B 20 55,-0.9 3,-2.3 -2,-0.3 4,-0.3 -0.477 37.8-117.8 -69.1 146.9 25.7 8.5 8.7 18 18 A H G >> S+ 0 0 39 11,-1.4 3,-1.1 1,-0.3 4,-0.8 0.648 108.9 75.4 -68.6 -12.5 26.0 5.4 6.5 19 19 A S G 34 S+ 0 0 30 1,-0.2 -1,-0.3 10,-0.2 6,-0.2 0.695 82.7 72.1 -68.4 -16.9 27.1 3.3 9.6 20 20 A S G <4 S+ 0 0 25 -3,-2.3 186,-2.6 1,-0.2 -1,-0.2 0.794 104.6 36.5 -62.9 -29.9 23.4 3.5 10.4 21 21 A V T <4 S+ 0 0 16 -3,-1.1 -1,-0.2 -4,-0.3 2,-0.2 0.559 132.1 29.0-101.1 -8.6 22.6 1.0 7.6 22 22 A N >< - 0 0 36 -4,-0.8 3,-2.9 1,-0.1 -1,-0.3 -0.701 67.1-163.4-152.2 91.9 25.8 -1.0 8.0 23 23 A S T 3 S+ 0 0 57 181,-1.5 182,-0.1 1,-0.3 -4,-0.1 0.754 89.4 63.0 -50.1 -32.0 27.2 -1.1 11.6 24 24 A A T 3 S+ 0 0 89 180,-0.3 -1,-0.3 2,-0.1 -5,-0.1 0.692 86.4 100.9 -66.0 -22.6 30.6 -2.4 10.4 25 25 A L S < S- 0 0 63 -3,-2.9 -6,-0.0 -7,-0.2 -3,-0.0 -0.203 73.4-122.2 -69.5 155.4 31.1 0.9 8.4 26 26 A T - 0 0 114 1,-0.1 3,-0.4 -8,-0.0 -8,-0.1 -0.862 35.9-111.4 -99.7 133.1 33.3 3.8 9.4 27 27 A P S S+ 0 0 91 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.127 74.5 87.9 -64.4 149.2 31.5 7.1 9.6 28 28 A G + 0 0 65 1,-0.6 2,-0.1 0, 0.0 -11,-0.0 -0.227 64.0 81.1 159.8 -58.4 31.9 10.2 7.3 29 29 A K - 0 0 161 -3,-0.4 -11,-1.4 1,-0.1 -1,-0.6 -0.434 68.2-133.4 -76.9 151.4 29.7 10.0 4.3 30 30 A L E -F 17 0B 82 -13,-0.2 2,-0.4 -2,-0.1 -13,-0.2 -0.705 11.5-156.5-106.5 159.1 26.0 11.1 4.6 31 31 A L E -F 16 0B 43 -15,-1.5 -15,-1.8 -2,-0.3 2,-0.9 -0.988 12.5-145.1-137.1 124.1 22.8 9.4 3.3 32 32 A N E -F 15 0B 63 -2,-0.4 -17,-0.2 -17,-0.2 -2,-0.0 -0.786 32.4-172.0 -90.8 103.2 19.5 11.1 2.5 33 33 A L E -F 14 0B 2 -19,-2.9 -19,-2.4 -2,-0.9 2,-0.2 -0.688 22.6-111.0-102.6 150.4 17.1 8.4 3.6 34 34 A P E -F 13 0B 3 0, 0.0 2,-0.4 0, 0.0 -21,-0.2 -0.504 19.5-152.0 -76.2 146.9 13.3 8.3 3.0 35 35 A V E - 0 0 1 -23,-2.1 -24,-2.7 -2,-0.2 2,-0.3 -0.964 24.3-166.5-113.1 135.4 10.9 8.6 6.0 36 36 A W E -F 10 0B 16 -2,-0.4 16,-0.3 198,-0.2 2,-0.3 -0.899 23.9-176.4-122.2 149.3 7.6 6.8 5.3 37 37 A C E -F 9 0B 0 -28,-2.2 -28,-2.7 -2,-0.3 2,-0.3 -0.901 19.9-148.3-124.3 169.0 4.1 6.5 6.7 38 38 A Y E -FH 8 49B 4 11,-2.2 11,-2.9 -2,-0.3 2,-0.4 -0.956 3.2-154.4-133.5 149.3 1.5 4.1 5.3 39 39 A L E -FH 7 48B 0 -32,-1.9 -32,-2.9 -2,-0.3 2,-0.5 -0.993 6.1-160.6-127.4 131.6 -2.3 4.4 5.0 40 40 A L E -FH 6 47B 0 7,-2.9 7,-2.3 -2,-0.4 2,-0.7 -0.928 6.3-154.9-110.9 121.7 -4.6 1.3 4.8 41 41 A E E +FH 5 46B 34 -36,-2.7 -37,-1.7 -2,-0.5 -36,-1.6 -0.890 30.5 170.0 -93.7 117.3 -8.1 1.7 3.5 42 42 A T E > - H 0 45B 6 3,-1.1 3,-1.3 -2,-0.7 -39,-0.1 -0.785 50.5-103.9-126.9 164.4 -10.0 -1.2 5.1 43 43 A E T 3 S+ 0 0 105 -41,-0.3 -1,-0.1 1,-0.3 -40,-0.1 0.897 124.1 47.3 -54.8 -39.9 -13.7 -2.2 5.4 44 44 A E T 3 S- 0 0 86 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.0 0.563 126.9 -82.2 -80.4 -11.8 -13.7 -1.0 9.0 45 45 A G E < -H 42 0B 17 -3,-1.3 -3,-1.1 2,-0.0 2,-0.3 -0.753 61.0 -38.8 136.1 176.8 -12.0 2.4 8.1 46 46 A P E -H 41 0B 17 0, 0.0 52,-3.0 0, 0.0 53,-0.8 -0.583 46.5-164.6 -82.0 139.6 -8.7 4.1 7.4 47 47 A I E -Hi 40 99B 0 -7,-2.3 -7,-2.9 -2,-0.3 2,-0.5 -0.975 6.5-151.0-124.7 129.4 -5.7 3.1 9.5 48 48 A L E -Hi 39 100B 1 51,-2.3 53,-2.6 -2,-0.4 2,-0.7 -0.864 3.4-154.8-103.3 132.9 -2.5 5.2 9.6 49 49 A V E -Hi 38 101B 0 -11,-2.9 -11,-2.2 -2,-0.5 53,-0.2 -0.938 66.0 -15.4-110.2 108.4 0.9 3.5 10.2 50 50 A D - 0 0 1 51,-2.3 -12,-0.2 -2,-0.7 60,-0.2 0.287 60.5-129.5 78.6 161.6 3.4 5.9 11.7 51 51 A T - 0 0 1 58,-2.4 32,-0.4 1,-0.3 59,-0.2 0.129 37.1-125.2-137.4 17.2 3.1 9.7 11.8 52 52 A G - 0 0 0 -16,-0.3 59,-1.8 56,-0.3 60,-0.6 -0.165 52.1 -22.0 75.7-161.6 6.4 11.1 10.6 53 53 A M S S- 0 0 4 -42,-0.5 30,-0.3 28,-0.3 55,-0.2 -0.473 72.5 -91.1 -90.9 158.2 8.8 13.6 12.2 54 54 A P > - 0 0 0 0, 0.0 3,-2.4 0, 0.0 4,-0.2 -0.278 33.2-113.8 -67.8 154.2 8.1 16.1 15.0 55 55 A E G > S+ 0 0 101 56,-0.5 3,-1.6 1,-0.3 57,-0.1 0.769 114.5 69.7 -57.7 -26.3 7.0 19.7 14.1 56 56 A S G 3 S+ 0 0 42 1,-0.3 -1,-0.3 55,-0.1 7,-0.0 0.672 90.7 61.2 -67.3 -15.1 10.3 20.9 15.6 57 57 A A G X S+ 0 0 0 -3,-2.4 3,-1.8 2,-0.1 20,-0.6 0.582 74.0 118.2 -85.2 -10.8 12.0 19.4 12.6 58 58 A V B < S-l 77 0C 19 -3,-1.6 20,-0.2 1,-0.3 21,-0.0 -0.403 98.0 -15.7 -66.4 127.6 10.3 21.6 10.1 59 59 A N T 3 S+ 0 0 93 18,-3.2 -1,-0.3 -2,-0.1 2,-0.2 0.802 114.2 113.6 48.1 33.9 12.9 23.7 8.2 60 60 A N X + 0 0 66 -3,-1.8 3,-1.5 17,-0.3 -1,-0.1 -0.592 29.8 162.8-139.0 74.8 15.3 22.8 11.0 61 61 A E T 3 S+ 0 0 72 1,-0.3 3,-0.5 -2,-0.2 -1,-0.1 0.757 79.9 62.2 -57.2 -23.6 18.2 20.6 9.9 62 62 A G T > + 0 0 25 1,-0.2 3,-2.2 12,-0.1 -1,-0.3 0.150 65.1 121.0 -93.6 18.6 20.0 21.6 13.1 63 63 A L T < S+ 0 0 34 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.1 0.855 76.9 45.1 -52.1 -39.8 17.3 20.1 15.4 64 64 A F T > S+ 0 0 22 -3,-0.5 3,-1.3 9,-0.4 5,-0.4 0.361 80.5 128.6 -94.1 7.4 19.8 17.8 17.0 65 65 A N T < S+ 0 0 102 -3,-2.2 3,-0.1 1,-0.2 -3,-0.0 -0.358 74.7 23.4 -56.4 138.2 22.6 20.4 17.6 66 66 A G T 3 S+ 0 0 72 1,-0.3 -1,-0.2 2,-0.0 -2,-0.1 -0.066 107.5 97.7 95.9 -33.1 23.8 20.4 21.2 67 67 A T S X S- 0 0 63 -3,-1.3 3,-1.3 -4,-0.1 -1,-0.3 -0.105 93.7 -91.1 -82.3-178.6 22.6 16.8 21.8 68 68 A F T 3 S+ 0 0 111 1,-0.3 -3,-0.1 -3,-0.1 -1,-0.1 0.472 123.9 48.1 -76.8 -0.8 24.4 13.5 21.8 69 69 A V T >> S+ 0 0 20 -5,-0.4 3,-1.7 4,-0.1 4,-0.8 0.076 75.4 153.7-122.6 25.0 23.6 13.0 18.1 70 70 A E T <4 S+ 0 0 105 -3,-1.3 -5,-0.1 1,-0.3 4,-0.1 -0.247 76.1 3.8 -51.7 134.5 24.7 16.4 16.7 71 71 A G T 34 S+ 0 0 49 2,-0.3 -1,-0.3 1,-0.1 3,-0.1 0.228 115.0 84.1 74.3 -17.9 25.7 16.1 13.1 72 72 A Q T <4 S+ 0 0 107 -3,-1.7 -55,-0.9 1,-0.3 2,-0.4 0.574 96.1 35.6 -91.7 -14.4 24.8 12.4 13.0 73 73 A I E < +G 16 0B 32 -4,-0.8 -9,-0.4 -57,-0.2 -2,-0.3 -0.927 62.0 174.9-143.8 117.4 21.1 13.1 12.2 74 74 A L E -G 15 0B 46 -59,-2.4 -59,-2.9 -2,-0.4 2,-0.2 -0.953 23.5-140.6-124.5 112.8 19.7 15.9 10.2 75 75 A P E -G 14 0B 0 0, 0.0 2,-0.5 0, 0.0 -61,-0.2 -0.494 6.5-160.0 -69.5 138.2 16.0 16.0 9.5 76 76 A K E +G 13 0B 75 -63,-2.7 -63,-2.4 -2,-0.2 2,-0.4 -0.802 38.8 140.7-117.1 85.3 14.9 17.1 6.0 77 77 A M B -l 58 0C 7 -20,-0.6 -18,-3.2 -2,-0.5 -17,-0.3 -0.986 28.0-173.3-134.7 129.7 11.3 18.2 6.6 78 78 A T > - 0 0 53 -2,-0.4 3,-1.9 -20,-0.2 4,-0.2 -0.639 48.2 -88.7-110.1-179.2 9.1 21.1 5.3 79 79 A E G > S+ 0 0 88 1,-0.3 3,-1.5 -2,-0.2 6,-0.2 0.795 123.4 63.5 -57.7 -35.8 5.7 22.2 6.2 80 80 A E G 3 S+ 0 0 128 1,-0.3 -1,-0.3 5,-0.1 -68,-0.0 0.712 95.4 62.0 -60.4 -21.5 4.1 19.9 3.6 81 81 A D G < S+ 0 0 25 -3,-1.9 -28,-0.3 4,-0.1 -1,-0.3 0.467 70.6 117.5 -91.6 -2.7 5.5 16.9 5.6 82 82 A R S X> S- 0 0 79 -3,-1.5 4,-2.3 -4,-0.2 3,-0.5 -0.472 74.0-125.4 -57.8 135.3 3.5 17.6 8.8 83 83 A I H 3> S+ 0 0 8 -32,-0.4 4,-2.8 -30,-0.3 5,-0.2 0.850 108.5 56.6 -57.9 -35.6 1.3 14.6 9.3 84 84 A V H 3> S+ 0 0 61 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.899 110.2 45.5 -63.4 -36.7 -1.9 16.7 9.4 85 85 A N H <> S+ 0 0 54 -3,-0.5 4,-2.4 2,-0.2 -2,-0.2 0.917 110.3 53.3 -71.6 -45.4 -1.0 18.2 6.0 86 86 A I H X S+ 0 0 3 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.953 112.8 45.0 -49.1 -53.8 -0.2 14.8 4.6 87 87 A L H X>S+ 0 0 0 -4,-2.8 5,-3.3 2,-0.2 4,-2.7 0.867 106.8 57.9 -58.7 -43.6 -3.6 13.5 5.8 88 88 A K H <5S+ 0 0 122 -4,-2.1 -1,-0.2 3,-0.3 -2,-0.2 0.935 109.3 46.8 -57.0 -41.0 -5.4 16.6 4.5 89 89 A R H <5S+ 0 0 136 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.922 110.1 49.5 -70.7 -41.4 -4.0 15.7 1.0 90 90 A V H <5S- 0 0 27 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.884 128.8-105.6 -60.1 -29.8 -4.9 12.0 1.2 91 91 A G T <5S+ 0 0 53 -4,-2.7 2,-0.3 1,-0.4 -3,-0.3 0.688 79.2 106.0 115.0 30.6 -8.3 13.5 2.2 92 92 A Y < - 0 0 44 -5,-3.3 -1,-0.4 -8,-0.1 -2,-0.1 -0.938 52.2-143.4-133.7 157.0 -8.7 12.9 6.0 93 93 A E > - 0 0 107 -2,-0.3 3,-2.4 -5,-0.1 4,-0.4 -0.807 41.4-102.4-106.4 160.9 -8.5 14.8 9.3 94 94 A P G > S+ 0 0 24 0, 0.0 3,-1.6 0, 0.0 25,-0.1 0.864 120.8 57.3 -52.4 -42.2 -7.0 13.1 12.4 95 95 A D G 3 S+ 0 0 101 1,-0.3 21,-0.0 23,-0.1 -3,-0.0 0.642 94.6 69.6 -70.2 -8.3 -10.4 12.3 14.0 96 96 A D G < S+ 0 0 77 -3,-2.4 -1,-0.3 23,-0.0 2,-0.1 0.674 78.6 102.4 -74.6 -19.7 -11.3 10.3 10.8 97 97 A L < - 0 0 11 -3,-1.6 -50,-0.2 -4,-0.4 3,-0.1 -0.381 59.8-154.9 -75.8 145.7 -8.9 7.6 11.5 98 98 A L S S- 0 0 52 -52,-3.0 2,-0.3 1,-0.3 -51,-0.2 0.921 78.3 -12.6 -78.8 -49.9 -9.9 4.2 12.9 99 99 A Y E -i 47 0B 38 -53,-0.8 -51,-2.3 20,-0.1 2,-0.4 -0.986 52.6-140.3-144.2 157.4 -6.5 3.5 14.4 100 100 A I E -ij 48 121B 0 20,-2.5 22,-3.0 -2,-0.3 2,-0.5 -0.961 20.8-155.5-108.0 139.1 -2.9 4.8 14.4 101 101 A I E -ij 49 122B 0 -53,-2.6 -51,-2.3 -2,-0.4 2,-0.8 -0.977 1.3-157.8-112.6 121.6 -0.3 2.0 14.5 102 102 A S - 0 0 1 20,-2.8 22,-0.4 -2,-0.5 3,-0.1 -0.872 7.3-166.0 -97.6 109.1 3.1 3.0 15.9 103 103 A S S S- 0 0 1 -2,-0.8 71,-1.6 1,-0.2 2,-0.3 0.928 78.2 -33.5 -55.3 -44.8 5.7 0.6 14.6 104 104 A H - 0 0 0 69,-0.2 -1,-0.2 2,-0.1 69,-0.1 -0.943 61.8-104.4-162.7 178.1 7.8 2.1 17.3 105 105 A L + 0 0 0 -2,-0.3 33,-0.3 -3,-0.1 5,-0.1 0.154 62.7 136.4-104.4 21.3 8.3 5.5 19.1 106 106 A H S >> S- 0 0 24 1,-0.1 3,-2.3 31,-0.1 4,-1.8 -0.303 71.4-102.3 -60.6 155.6 11.5 6.8 17.5 107 107 A W H 3> S+ 0 0 23 29,-0.4 4,-0.6 1,-0.3 -1,-0.1 0.719 120.4 52.4 -55.8 -26.8 11.5 10.4 16.5 108 108 A D H 34 S+ 0 0 8 -55,-0.2 -56,-0.3 1,-0.2 -1,-0.3 0.390 116.9 37.6 -95.0 4.4 11.0 9.7 12.7 109 109 A H H <4 S+ 0 0 6 -3,-2.3 -58,-2.4 -58,-0.1 -57,-0.3 0.571 127.2 26.7-125.5 -24.2 7.9 7.4 13.3 110 110 A A H >< S+ 0 0 0 -4,-1.8 3,-2.1 -60,-0.2 4,-0.3 0.244 80.2 110.9-128.1 11.1 6.0 9.0 16.2 111 111 A G T 3< S+ 0 0 9 -59,-1.8 -56,-0.5 -4,-0.6 3,-0.3 0.792 84.9 47.0 -61.4 -26.0 6.8 12.7 15.9 112 112 A G T > S+ 0 0 12 -60,-0.6 3,-1.7 1,-0.2 -1,-0.3 0.336 78.0 106.6 -94.5 8.8 3.3 13.5 14.8 113 113 A N G X + 0 0 0 -3,-2.1 3,-2.2 1,-0.3 -1,-0.2 0.823 67.4 68.2 -62.9 -32.5 1.5 11.4 17.4 114 114 A G G 3 S+ 0 0 28 26,-0.5 -1,-0.3 -3,-0.3 -2,-0.1 0.719 86.9 68.7 -59.9 -22.3 0.3 14.5 19.4 115 115 A A G < S+ 0 0 39 -3,-1.7 2,-0.8 1,-0.2 -1,-0.3 0.669 91.1 67.5 -69.1 -17.3 -2.0 15.5 16.5 116 116 A F < + 0 0 0 -3,-2.2 31,-0.4 -4,-0.3 -1,-0.2 -0.825 52.4 154.7-110.4 97.0 -4.2 12.4 17.3 117 117 A T S S+ 0 0 83 -2,-0.8 -1,-0.1 29,-0.1 -2,-0.1 0.569 76.7 31.6-102.6 -6.0 -5.9 12.9 20.7 118 118 A N S S+ 0 0 99 28,-0.1 -2,-0.1 2,-0.1 3,-0.1 0.738 94.7 90.6-113.7 -40.7 -9.0 10.7 20.1 119 119 A T S S- 0 0 6 1,-0.1 28,-0.4 -25,-0.1 2,-0.1 -0.285 84.7-109.9 -59.6 134.2 -7.8 7.9 17.8 120 120 A P - 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