==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 12-NOV-09 3KNR . COMPND 2 MOLECULE: BETA-LACTAMASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR F.J.MEDRANO MARTIN,J.M.GONZALEZ,A.J.VILA . 837 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32826.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 594 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 72 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 172 20.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 14 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 57 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 186 22.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 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 4 2 2 0 0 4 4 0 0 0 4 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 4 8 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 . 10 0 8 0 4 10 0 0 0 2 0 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 6 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 14 A G 0 0 39 0, 0.0 641,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 80.8 30.8 -25.3 18.1 2 15 A T + 0 0 66 1,-0.2 16,-2.8 15,-0.1 2,-0.5 0.853 360.0 31.5 -63.3 -39.6 30.6 -22.8 15.3 3 16 A I E S+A 17 0A 22 14,-0.2 2,-0.3 50,-0.1 14,-0.2 -0.986 76.5 168.8-121.1 128.2 27.0 -23.7 14.6 4 17 A S E -A 16 0A 20 12,-2.8 12,-2.6 -2,-0.5 2,-0.4 -0.930 20.3-156.6-132.6 154.0 24.8 -24.9 17.3 5 18 A I E -A 15 0A 15 -2,-0.3 2,-0.4 10,-0.2 10,-0.2 -0.973 11.6-168.3-128.4 140.0 21.1 -25.5 17.7 6 19 A S E -A 14 0A 44 8,-2.5 8,-3.1 -2,-0.4 2,-0.4 -0.997 20.6-119.9-134.9 137.8 19.4 -25.5 21.0 7 20 A Q E +A 13 0A 108 -2,-0.4 6,-0.3 6,-0.2 3,-0.1 -0.631 30.1 170.0 -86.6 136.2 15.9 -26.7 21.7 8 21 A L E S- 0 0 59 4,-3.0 2,-0.2 1,-0.5 5,-0.2 0.792 77.8 -30.0 -98.6 -48.5 13.1 -24.6 23.1 9 22 A N E > S-A 12 0A 49 3,-2.2 3,-0.6 1,-0.0 -1,-0.5 -0.829 87.2 -63.6-151.8-168.1 10.4 -27.3 22.4 10 23 A K T 3 S+ 0 0 161 1,-0.2 -1,-0.0 -2,-0.2 -2,-0.0 0.918 131.3 20.2 -54.1 -48.5 9.7 -30.1 20.0 11 24 A N T 3 S+ 0 0 38 1,-0.1 23,-3.1 22,-0.1 2,-0.5 0.300 112.8 73.8-107.5 10.3 9.4 -27.9 16.9 12 25 A V E < +AB 9 33A 0 -3,-0.6 -4,-3.0 21,-0.2 -3,-2.2 -0.976 53.0 164.0-129.2 119.0 11.2 -24.7 17.9 13 26 A W E -AB 7 32A 31 19,-2.8 19,-3.2 -2,-0.5 2,-0.5 -0.891 32.5-125.7-126.0 158.9 15.0 -24.5 18.2 14 27 A V E -AB 6 31A 1 -8,-3.1 -8,-2.5 -2,-0.3 2,-0.4 -0.902 19.7-153.5 -99.4 132.7 17.4 -21.6 18.4 15 28 A H E -AB 5 30A 0 15,-1.8 15,-2.5 -2,-0.5 2,-0.4 -0.887 14.2-175.2-103.0 142.9 20.2 -21.6 15.8 16 29 A T E -AB 4 29A 20 -12,-2.6 -12,-2.8 -2,-0.4 2,-0.4 -0.997 4.6-171.2-142.6 124.8 23.4 -19.9 16.8 17 30 A E E -AB 3 28A 0 11,-2.2 11,-1.1 -2,-0.4 2,-0.7 -0.959 19.7-137.8-120.7 140.2 26.4 -19.3 14.8 18 31 A L E - B 0 27A 28 -16,-2.8 2,-0.1 -2,-0.4 7,-0.1 -0.875 22.0-160.3 -92.0 112.9 29.8 -17.9 15.7 19 32 A G E - B 0 26A 2 7,-3.0 7,-2.1 -2,-0.7 2,-0.6 -0.435 19.3-122.1 -79.0 166.2 30.9 -15.5 13.1 20 33 A S E + B 0 25A 75 5,-0.2 2,-0.5 -2,-0.1 5,-0.2 -0.965 37.0 169.1-119.7 109.4 34.6 -14.8 13.0 21 34 A F E > S- B 0 24A 90 3,-3.3 3,-2.1 -2,-0.6 -2,-0.0 -0.978 72.2 -27.0-128.4 114.3 35.4 -11.1 13.5 22 35 A N T 3 S- 0 0 161 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.869 125.6 -50.1 50.9 44.9 39.0 -10.0 14.1 23 36 A G T 3 S+ 0 0 14 1,-0.3 804,-0.5 803,-0.1 2,-0.4 0.632 117.4 115.9 70.7 13.9 39.8 -13.4 15.6 24 37 A E E < -B 21 0A 76 -3,-2.1 -3,-3.3 802,-0.2 2,-0.4 -0.932 64.4-133.2-113.0 138.2 36.7 -13.1 17.9 25 38 A A E -B 20 0A 31 -2,-0.4 -5,-0.2 -5,-0.2 801,-0.1 -0.728 24.7-168.8 -84.0 135.8 33.8 -15.5 17.7 26 39 A V E -B 19 0A 38 -7,-2.1 -7,-3.0 -2,-0.4 -9,-0.1 -0.957 11.6-140.3-131.6 117.1 30.5 -13.6 17.7 27 40 A P E -B 18 0A 20 0, 0.0 2,-0.4 0, 0.0 -9,-0.2 -0.342 16.8-174.9 -77.9 149.6 27.3 -15.5 18.2 28 41 A S E -B 17 0A 0 -11,-1.1 -11,-2.2 169,-0.1 2,-0.3 -0.965 12.4-149.0-135.7 141.6 24.2 -14.6 16.3 29 42 A N E +B 16 0A 7 167,-2.8 2,-0.2 -2,-0.4 -13,-0.2 -0.790 23.6 153.6-110.9 152.8 20.9 -16.3 17.0 30 43 A G E -B 15 0A 0 -15,-2.5 -15,-1.8 -2,-0.3 2,-0.3 -0.792 37.3 -98.8-150.7-168.9 17.9 -17.2 14.9 31 44 A L E -BC 14 42A 0 11,-1.9 11,-2.4 -17,-0.3 2,-0.4 -0.885 14.1-154.1-121.1 153.9 15.1 -19.7 15.1 32 45 A V E -BC 13 41A 0 -19,-3.2 -19,-2.8 -2,-0.3 2,-0.5 -0.999 11.9-163.5-124.0 125.2 14.5 -23.0 13.4 33 46 A L E -BC 12 40A 0 7,-2.9 7,-2.2 -2,-0.4 2,-0.9 -0.948 7.6-152.9-110.6 121.5 10.9 -24.1 13.1 34 47 A N E + C 0 39A 17 -23,-3.1 2,-0.3 -2,-0.5 5,-0.2 -0.843 28.9 173.3 -96.6 110.0 10.3 -27.7 12.4 35 48 A T E > - C 0 38A 4 3,-1.9 3,-1.8 -2,-0.9 88,-0.2 -0.726 49.5-109.2-118.9 164.1 7.0 -27.8 10.6 36 49 A S T 3 S+ 0 0 80 86,-0.3 87,-0.2 1,-0.3 3,-0.1 0.640 122.0 45.8 -63.5 -12.3 5.0 -30.5 8.9 37 50 A K T 3 S- 0 0 156 1,-0.5 -1,-0.3 85,-0.1 2,-0.2 0.198 126.9 -70.5-116.2 11.4 5.9 -28.7 5.6 38 51 A G E < -C 35 0A 8 -3,-1.8 -3,-1.9 84,-0.1 -1,-0.5 -0.657 65.6 -49.3 127.6-178.3 9.6 -28.1 6.2 39 52 A L E -Cd 34 66A 0 26,-2.7 28,-2.8 -5,-0.2 29,-1.2 -0.727 44.6-164.4 -91.6 136.2 12.0 -26.1 8.3 40 53 A V E -Cd 33 68A 0 -7,-2.2 -7,-2.9 -2,-0.4 2,-0.4 -0.979 8.5-156.1-120.5 128.6 11.4 -22.4 8.5 41 54 A L E -Cd 32 69A 0 27,-2.7 29,-2.4 -2,-0.5 2,-0.7 -0.844 15.1-144.3-103.5 145.1 14.2 -20.3 9.8 42 55 A V E S-Cd 31 70A 0 -11,-2.4 -11,-1.9 -2,-0.4 -27,-0.2 -0.965 82.1 -8.0-100.6 115.8 14.1 -16.9 11.4 43 56 A D - 0 0 0 27,-3.1 -1,-0.2 -2,-0.7 36,-0.1 0.478 67.2-131.3 70.0 150.3 17.2 -15.4 10.1 44 57 A S - 0 0 0 34,-2.2 2,-0.2 1,-0.2 35,-0.1 0.296 42.2 -86.8 -92.8-133.6 20.0 -16.9 8.1 45 58 A S - 0 0 0 2,-0.2 36,-0.8 -29,-0.1 35,-0.5 -0.764 42.2 -76.1-138.8-175.1 23.6 -16.3 9.2 46 59 A W S S- 0 0 33 -2,-0.2 2,-0.3 34,-0.2 32,-0.1 0.710 104.9 -10.8 -55.3 -34.9 26.5 -13.9 8.9 47 60 A D S > S- 0 0 69 30,-0.1 4,-1.9 1,-0.1 34,-0.3 -0.895 79.5 -85.4-154.7-179.4 27.5 -14.9 5.4 48 61 A D H > S+ 0 0 47 32,-0.4 4,-3.1 -2,-0.3 5,-0.2 0.910 120.0 55.8 -65.3 -43.0 26.9 -17.6 2.8 49 62 A K H > S+ 0 0 144 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.949 114.2 39.2 -53.0 -52.2 29.4 -20.0 4.1 50 63 A L H > S+ 0 0 13 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.831 113.9 55.5 -68.5 -35.7 27.8 -20.1 7.6 51 64 A T H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.915 108.4 47.7 -64.4 -43.5 24.3 -20.0 6.0 52 65 A K H X S+ 0 0 96 -4,-3.1 4,-2.9 2,-0.2 -2,-0.2 0.916 113.2 48.3 -61.8 -41.7 25.1 -23.1 4.0 53 66 A E H X S+ 0 0 68 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.893 111.5 50.3 -67.0 -37.3 26.5 -24.8 7.1 54 67 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.948 112.2 46.5 -63.0 -49.5 23.5 -23.9 9.1 55 68 A I H X S+ 0 0 5 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.938 112.9 50.2 -60.8 -47.2 21.1 -25.2 6.4 56 69 A E H X S+ 0 0 140 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.921 111.8 48.4 -55.6 -46.1 23.2 -28.4 6.1 57 70 A M H X S+ 0 0 68 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.931 115.1 41.9 -62.5 -49.3 23.1 -28.9 9.8 58 71 A V H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.881 113.1 52.4 -70.8 -39.1 19.3 -28.4 10.3 59 72 A E H X>S+ 0 0 36 -4,-2.9 4,-1.4 -5,-0.2 5,-0.9 0.905 113.9 44.1 -61.6 -42.6 18.3 -30.3 7.3 60 73 A K H <5S+ 0 0 170 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.925 113.8 50.8 -68.7 -41.7 20.4 -33.3 8.5 61 74 A K H <5S+ 0 0 104 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.909 125.6 24.5 -59.6 -50.8 19.2 -33.0 12.1 62 75 A F H <5S- 0 0 33 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.489 95.2-131.8 -94.2 -7.0 15.5 -32.9 11.2 63 76 A Q T <5S+ 0 0 176 -4,-1.4 2,-0.3 -5,-0.3 -3,-0.2 0.959 71.6 113.8 46.4 53.4 15.6 -34.7 7.9 64 77 A K < - 0 0 66 -5,-0.9 2,-0.3 -6,-0.2 -1,-0.2 -0.976 69.6-106.7-146.4 155.4 13.5 -31.9 6.5 65 78 A R - 0 0 165 -2,-0.3 -26,-2.7 -3,-0.1 2,-0.5 -0.684 25.2-121.8 -86.5 140.4 14.1 -29.2 3.9 66 79 A V E +d 39 0A 7 -2,-0.3 -26,-0.2 -28,-0.2 3,-0.1 -0.686 39.9 167.6 -72.9 122.5 14.6 -25.6 4.8 67 80 A T E + 0 0 35 -28,-2.8 24,-2.2 -2,-0.5 2,-0.3 0.665 54.1 18.1-109.6 -27.9 11.8 -23.9 2.8 68 81 A D E -de 40 91A 14 -29,-1.2 -27,-2.7 22,-0.2 2,-0.4 -0.996 51.9-164.5-150.2 148.7 11.6 -20.4 4.1 69 82 A V E -de 41 92A 0 22,-2.9 24,-3.3 -2,-0.3 2,-0.6 -0.995 13.8-146.5-135.1 139.7 13.6 -17.8 6.1 70 83 A I E -de 42 93A 0 -29,-2.4 -27,-3.1 -2,-0.4 2,-0.5 -0.948 16.3-149.8-104.6 124.3 12.3 -14.7 7.7 71 84 A I - 0 0 0 22,-2.8 24,-0.4 -2,-0.6 3,-0.1 -0.841 6.1-163.5 -98.7 121.0 14.9 -11.9 7.5 72 85 A T - 0 0 1 -2,-0.5 69,-2.2 1,-0.2 2,-0.3 0.690 67.2 -9.2 -87.8 -20.2 14.7 -9.6 10.4 73 86 A H S S- 0 0 1 67,-0.2 -1,-0.2 2,-0.2 2,-0.2 -0.945 73.3 -97.1-166.4 166.9 16.7 -6.7 9.0 74 87 A A S S+ 0 0 1 -2,-0.3 2,-0.2 4,-0.1 33,-0.1 0.041 82.5 105.5 -87.7 39.2 19.0 -5.9 6.2 75 88 A H S >> S- 0 0 53 -2,-0.2 3,-2.5 1,-0.0 4,-2.3 -0.729 81.6 -98.3-109.6 170.7 22.4 -6.5 8.0 76 89 A A H 3> S+ 0 0 35 1,-0.3 4,-1.9 -2,-0.2 5,-0.2 0.766 115.9 56.4 -62.1 -42.0 25.0 -9.4 7.7 77 90 A D H 34 S+ 0 0 12 1,-0.2 -1,-0.3 2,-0.2 -30,-0.1 0.788 122.4 29.5 -58.3 -23.4 24.0 -11.5 10.7 78 91 A R H <4 S+ 0 0 0 -3,-2.5 -34,-2.2 -32,-0.1 -2,-0.2 0.870 136.5 18.9-100.8 -48.7 20.5 -11.7 9.3 79 92 A I H >< S+ 0 0 0 -4,-2.3 3,-2.1 -36,-0.1 4,-0.2 0.181 85.5 112.2-114.1 6.9 20.6 -11.5 5.5 80 93 A G T 3< S+ 0 0 7 -4,-1.9 -32,-0.4 -35,-0.5 3,-0.4 0.783 82.9 46.4 -51.5 -33.5 24.3 -12.5 5.0 81 94 A G T 3> S+ 0 0 0 -36,-0.8 4,-2.1 -34,-0.3 3,-0.4 0.166 72.1 118.0 -99.2 18.3 23.2 -15.7 3.4 82 95 A I H <> S+ 0 0 3 -3,-2.1 4,-2.9 1,-0.3 -1,-0.2 0.864 74.8 55.2 -59.0 -35.3 20.5 -14.4 1.1 83 96 A K H > S+ 0 0 98 -3,-0.4 4,-2.5 -4,-0.2 -1,-0.3 0.922 106.9 51.6 -61.1 -43.5 22.4 -15.6 -2.0 84 97 A T H 4 S+ 0 0 1 -3,-0.4 4,-0.5 1,-0.2 -2,-0.2 0.926 111.7 47.7 -56.4 -46.2 22.5 -19.1 -0.5 85 98 A L H >X>S+ 0 0 0 -4,-2.1 5,-2.5 1,-0.2 3,-1.4 0.946 111.4 47.8 -60.9 -50.8 18.8 -18.9 -0.0 86 99 A K H ><5S+ 0 0 98 -4,-2.9 3,-1.4 1,-0.3 -2,-0.2 0.913 109.9 53.1 -58.5 -40.8 18.0 -17.6 -3.5 87 100 A E T 3<5S+ 0 0 125 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.504 112.7 46.7 -78.7 -3.0 20.2 -20.3 -5.1 88 101 A R T <45S- 0 0 111 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.397 112.7-114.3-111.3 -0.6 18.3 -22.9 -3.2 89 102 A G T <<5 + 0 0 56 -3,-1.4 2,-0.6 -4,-0.6 -3,-0.2 0.773 63.9 151.9 65.5 28.2 14.8 -21.8 -3.8 90 103 A I < - 0 0 9 -5,-2.5 -1,-0.3 -6,-0.2 -22,-0.2 -0.824 49.0-123.3 -88.6 120.2 14.4 -21.0 -0.1 91 104 A K E -e 68 0A 116 -24,-2.2 -22,-2.9 -2,-0.6 2,-0.7 -0.490 19.3-153.1 -74.1 132.8 12.0 -18.2 0.1 92 105 A A E -e 69 0A 6 -24,-0.2 19,-3.4 -2,-0.2 2,-0.2 -0.911 12.7-160.7-113.3 100.1 13.4 -15.2 1.9 93 106 A H E +e 70 0A 14 -24,-3.3 -22,-2.8 -2,-0.7 2,-0.3 -0.603 24.5 142.6 -83.1 143.6 10.6 -13.2 3.6 94 107 A S - 0 0 0 -2,-0.2 20,-2.6 -24,-0.2 19,-0.5 -0.969 51.1 -88.5-164.2 165.0 11.0 -9.6 4.6 95 108 A T B > -f 114 0B 11 -24,-0.4 4,-2.0 -2,-0.3 17,-0.3 -0.363 44.7-108.8 -71.2 165.4 9.3 -6.3 4.8 96 109 A A H > S+ 0 0 63 18,-0.8 4,-2.7 16,-0.3 5,-0.1 0.889 120.7 54.4 -61.0 -39.2 9.5 -4.1 1.7 97 110 A L H > S+ 0 0 38 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.930 106.5 49.6 -64.3 -43.8 11.7 -1.8 3.6 98 111 A T H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.927 111.2 50.4 -61.0 -38.0 14.1 -4.6 4.5 99 112 A A H X S+ 0 0 2 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.938 110.5 50.3 -64.9 -44.5 14.2 -5.6 0.8 100 113 A E H X S+ 0 0 96 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.944 113.4 43.8 -58.9 -46.0 14.9 -2.0 -0.2 101 114 A L H X S+ 0 0 33 -4,-2.7 4,-3.0 1,-0.2 6,-0.2 0.907 110.1 56.4 -71.2 -37.2 17.7 -1.7 2.2 102 115 A A H <>S+ 0 0 0 -4,-3.0 5,-2.5 -5,-0.3 4,-0.3 0.954 104.4 52.3 -53.5 -51.7 19.1 -5.1 1.2 103 116 A K H <5S+ 0 0 131 -4,-2.5 3,-0.5 1,-0.2 -1,-0.2 0.858 116.5 43.3 -54.8 -34.2 19.2 -3.9 -2.4 104 117 A K H <5S+ 0 0 120 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.832 105.5 57.7 -78.3 -39.4 21.2 -0.9 -1.0 105 118 A N T <5S- 0 0 76 -4,-3.0 -1,-0.2 -5,-0.1 -2,-0.2 0.262 125.4 -93.8 -80.8 15.1 23.6 -2.7 1.4 106 119 A G T 5S+ 0 0 71 -3,-0.5 2,-0.2 -4,-0.3 -3,-0.2 0.580 84.6 127.5 86.2 14.7 24.9 -4.9 -1.5 107 120 A Y < - 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