==== 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 TRANSFERASE 30-DEC-09 3L86 . COMPND 2 MOLECULE: ACETYLGLUTAMATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS MUTANS; . AUTHOR X.-D.SU,X.LIU,C.W.WU . 245 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11178.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 78.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 15.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 8.6 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 . 19 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 29.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 4.9 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 1 1 0 0 0 1 2 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 3 0 2 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 PARALLEL BRIDGES PER LADDER . 0 2 2 0 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 . 2 0 0 1 0 0 1 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 0 132 0, 0.0 171,-0.1 0, 0.0 172,-0.0 0.000 360.0 360.0 360.0 98.1 49.1 18.9 49.8 2 2 A K - 0 0 106 169,-0.2 32,-0.1 2,-0.2 3,-0.1 0.499 360.0-123.3 -67.7 -11.4 47.7 21.8 48.0 3 3 A D + 0 0 56 1,-0.2 31,-1.9 30,-0.1 2,-0.3 0.967 68.5 132.5 57.8 53.0 44.2 20.6 49.2 4 4 A I E -a 34 0A 5 29,-0.2 169,-2.4 167,-0.1 170,-0.9 -0.989 32.6-179.1-137.2 124.2 42.9 20.4 45.6 5 5 A I E -ab 35 174A 12 29,-2.0 31,-1.7 -2,-0.3 2,-0.5 -0.998 14.4-152.8-126.0 129.2 41.0 17.4 44.1 6 6 A V E -ab 36 175A 0 168,-2.1 170,-2.2 -2,-0.4 2,-0.5 -0.892 11.8-163.7 -94.7 125.6 39.8 17.2 40.4 7 7 A I E -ab 37 176A 0 29,-2.4 31,-2.1 -2,-0.5 2,-0.5 -0.960 2.0-165.6-111.0 116.0 36.7 14.9 40.0 8 8 A K E -ab 38 177A 7 168,-2.9 170,-2.5 -2,-0.5 2,-0.5 -0.856 8.4-159.2 -99.8 129.5 35.9 13.7 36.4 9 9 A I E -ab 39 178A 0 29,-2.5 31,-1.8 -2,-0.5 170,-0.2 -0.945 7.9-141.3-117.1 121.1 32.4 12.2 36.1 10 10 A G > - 0 0 7 168,-2.0 4,-1.6 -2,-0.5 169,-0.1 -0.025 29.5 -95.4 -71.7 176.1 31.4 9.8 33.1 11 11 A G T 4 S+ 0 0 14 2,-0.2 3,-0.4 1,-0.2 4,-0.3 0.985 121.1 30.8 -59.1 -65.5 28.1 9.6 31.1 12 12 A V T >4 S+ 0 0 41 1,-0.2 3,-2.4 2,-0.2 4,-0.4 0.927 116.6 60.3 -56.9 -47.1 26.3 6.8 33.0 13 13 A A G >4 S+ 0 0 3 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.829 98.7 57.4 -56.4 -35.7 28.0 7.7 36.3 14 14 A S G 3< S+ 0 0 1 -4,-1.6 3,-0.3 -3,-0.4 -1,-0.3 0.613 101.8 56.1 -72.8 -8.9 26.5 11.2 36.3 15 15 A Q G < S+ 0 0 99 -3,-2.4 -1,-0.2 -4,-0.3 -2,-0.2 0.359 109.8 44.4-102.0 0.2 22.9 9.8 36.0 16 16 A Q S < S+ 0 0 118 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.1 -0.062 71.9 165.8-133.0 33.4 23.2 7.7 39.2 17 17 A L - 0 0 31 -3,-0.3 -3,-0.1 1,-0.1 218,-0.0 -0.315 28.1-139.6 -63.4 125.9 24.9 9.9 41.8 18 18 A S > - 0 0 59 1,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.243 20.3-111.3 -83.1 169.2 24.5 8.4 45.3 19 19 A G H > S+ 0 0 51 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.905 121.5 54.3 -58.3 -42.0 23.8 9.9 48.8 20 20 A D H > S+ 0 0 140 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.922 109.2 48.3 -57.7 -44.6 27.3 8.9 49.7 21 21 A F H > S+ 0 0 9 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.969 111.9 47.0 -60.8 -57.9 28.7 10.9 46.7 22 22 A L H X S+ 0 0 33 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.885 115.1 45.9 -54.8 -47.1 26.6 14.0 47.4 23 23 A S H X S+ 0 0 66 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.893 110.4 54.1 -60.8 -40.5 27.5 14.1 51.2 24 24 A Q H X S+ 0 0 51 -4,-2.2 4,-2.5 -5,-0.3 5,-0.2 0.940 110.0 46.8 -63.3 -46.2 31.2 13.5 50.5 25 25 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.958 114.1 46.5 -56.0 -55.0 31.4 16.4 48.1 26 26 A K H X S+ 0 0 74 -4,-2.1 4,-3.1 2,-0.2 -2,-0.2 0.910 113.5 49.9 -56.0 -44.7 29.5 18.8 50.5 27 27 A N H X S+ 0 0 93 -4,-2.9 4,-1.3 1,-0.2 -1,-0.2 0.908 110.6 48.8 -65.4 -42.6 31.8 17.7 53.5 28 28 A W H <>S+ 0 0 43 -4,-2.5 5,-2.5 -5,-0.2 3,-0.3 0.917 113.1 47.9 -57.6 -45.0 35.0 18.2 51.5 29 29 A Q H ><5S+ 0 0 33 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.956 111.7 49.4 -65.2 -45.8 33.7 21.7 50.5 30 30 A D H 3<5S+ 0 0 98 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.707 107.1 56.8 -62.2 -23.0 32.8 22.5 54.1 31 31 A A T 3<5S- 0 0 81 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.301 124.3-102.7 -90.6 4.9 36.3 21.4 55.3 32 32 A G T < 5 + 0 0 50 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.569 68.6 150.6 93.8 1.9 37.9 23.8 53.0 33 33 A K < - 0 0 49 -5,-2.5 2,-0.6 -6,-0.2 -1,-0.2 -0.432 44.8-128.2 -66.9 144.1 39.0 21.5 50.1 34 34 A Q E -a 4 0A 74 -31,-1.9 -29,-2.0 -32,-0.1 2,-0.4 -0.887 31.5-170.8 -97.6 126.2 39.1 23.1 46.6 35 35 A L E -a 5 0A 5 -2,-0.6 2,-0.4 -31,-0.2 -29,-0.2 -0.907 16.0-173.8-123.2 137.1 37.2 21.0 44.1 36 36 A V E -a 6 0A 0 -31,-1.7 -29,-2.4 -2,-0.4 2,-0.4 -0.999 13.4-153.7-127.8 132.3 36.9 21.2 40.3 37 37 A I E -ac 7 142A 0 104,-2.1 106,-3.1 -2,-0.4 2,-0.3 -0.926 12.0-178.8-110.9 127.6 34.5 18.9 38.4 38 38 A V E -ac 8 143A 0 -31,-2.1 -29,-2.5 -2,-0.4 2,-0.3 -0.895 12.0-176.9-116.0 144.7 34.9 17.8 34.7 39 39 A H E -ac 9 144A 1 104,-1.7 106,-1.1 -2,-0.3 -29,-0.2 -0.991 14.4-167.7-143.8 151.2 32.3 15.6 33.0 40 40 A G - 0 0 4 -31,-1.8 118,-0.1 -2,-0.3 -30,-0.0 -0.091 8.3-157.0-109.4-143.7 31.7 13.8 29.6 41 41 A G > + 0 0 5 -2,-0.1 4,-2.3 40,-0.1 5,-0.3 0.339 30.1 149.0 167.3 29.9 28.5 12.2 28.1 42 42 A G H > S+ 0 0 26 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.898 79.5 53.4 -47.7 -50.1 29.2 9.5 25.5 43 43 A F H > S+ 0 0 122 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.938 112.4 45.8 -54.7 -46.8 26.1 7.5 26.3 44 44 A A H > S+ 0 0 20 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.892 111.2 50.0 -61.4 -45.9 23.9 10.6 25.9 45 45 A I H X S+ 0 0 8 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.873 110.1 53.0 -59.2 -41.5 25.5 11.8 22.6 46 46 A N H X S+ 0 0 55 -4,-2.6 4,-1.7 -5,-0.3 -2,-0.2 0.949 109.5 48.1 -58.3 -50.8 25.0 8.2 21.3 47 47 A K H >X S+ 0 0 82 -4,-2.0 4,-2.4 1,-0.2 3,-0.8 0.973 112.5 48.7 -54.2 -60.5 21.3 8.3 22.1 48 48 A L H 3X S+ 0 0 25 -4,-2.5 4,-1.1 1,-0.3 -1,-0.2 0.851 106.6 55.7 -50.3 -40.0 20.8 11.7 20.6 49 49 A M H 3<>S+ 0 0 2 -4,-2.4 5,-2.9 2,-0.2 -1,-0.3 0.887 110.7 45.6 -62.0 -36.4 22.6 10.6 17.4 50 50 A E H X<5S+ 0 0 72 -4,-1.7 3,-3.4 -3,-0.8 -2,-0.2 0.990 110.3 51.9 -68.5 -60.3 20.1 7.7 17.0 51 51 A E H 3<5S+ 0 0 89 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.602 117.8 41.2 -46.4 -21.8 17.0 9.9 17.8 52 52 A N T 3<5S- 0 0 88 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.002 117.1-115.0-114.3 16.8 18.4 12.2 15.1 53 53 A Q T < 5 + 0 0 93 -3,-3.4 -3,-0.2 1,-0.1 -4,-0.1 0.623 65.7 135.1 49.9 33.8 19.4 9.5 12.6 54 54 A V < - 0 0 43 -5,-2.9 2,-0.4 -6,-0.2 -1,-0.1 -0.836 53.9-113.2-102.4 145.3 23.3 9.9 12.5 55 55 A P - 0 0 99 0, 0.0 2,-0.6 0, 0.0 -5,-0.0 -0.659 20.0-133.3 -85.0 123.4 25.8 6.9 12.6 56 56 A V + 0 0 70 -2,-0.4 2,-0.4 -10,-0.1 7,-0.0 -0.706 30.7 173.2 -77.2 115.4 28.1 6.5 15.5 57 57 A K - 0 0 63 -2,-0.6 7,-2.3 7,-0.3 2,-0.3 -1.000 5.0-178.6-126.2 127.7 31.7 5.9 14.4 58 58 A K E -H 63 0B 106 -2,-0.4 2,-0.4 5,-0.3 5,-0.2 -0.901 9.8-164.1-122.4 152.7 34.6 5.7 16.8 59 59 A I E > S-H 62 0B 63 3,-2.4 3,-1.8 -2,-0.3 -2,-0.0 -0.971 79.5 -10.5-140.4 115.6 38.3 5.1 16.1 60 60 A N T 3 S- 0 0 123 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.898 130.7 -55.5 63.6 38.0 40.7 4.2 18.9 61 61 A G T 3 S+ 0 0 24 1,-0.2 2,-0.4 152,-0.1 -1,-0.3 0.462 116.6 114.8 69.3 5.5 37.9 5.0 21.4 62 62 A L E < -H 59 0B 10 -3,-1.8 -3,-2.4 96,-0.1 2,-0.3 -0.897 67.7-120.7-110.7 134.1 37.5 8.6 19.9 63 63 A R E -H 58 0B 16 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.3 -0.566 19.1-128.6 -76.2 127.5 34.2 9.8 18.2 64 64 A V - 0 0 45 -7,-2.3 2,-0.5 -2,-0.3 -7,-0.3 -0.647 36.0-167.0 -70.6 122.5 34.6 11.0 14.6 65 65 A T B -i 118 0C 0 52,-2.8 54,-3.4 -2,-0.4 91,-0.1 -0.940 12.7-161.2-129.8 110.2 32.8 14.4 14.7 66 66 A S > - 0 0 53 -2,-0.5 4,-1.1 52,-0.2 3,-0.0 -0.426 38.6-104.5 -79.7 167.5 31.7 16.5 11.8 67 67 A K H > S+ 0 0 121 1,-0.2 4,-0.6 2,-0.2 3,-0.5 0.886 125.9 50.2 -57.5 -40.4 30.9 20.2 12.1 68 68 A D H >> S+ 0 0 134 1,-0.2 3,-0.9 2,-0.2 4,-0.7 0.874 104.7 60.3 -61.9 -37.9 27.2 19.4 11.9 69 69 A D H >> S+ 0 0 25 1,-0.2 4,-2.2 2,-0.2 3,-0.5 0.784 89.8 70.2 -55.7 -32.9 27.8 16.8 14.6 70 70 A M H 3X S+ 0 0 14 -4,-1.1 4,-2.5 -3,-0.5 5,-0.3 0.794 89.1 61.5 -62.7 -32.2 29.0 19.5 17.1 71 71 A V H S+ 0 0 71 -4,-1.6 4,-1.8 -5,-0.3 5,-1.3 0.941 112.2 43.9 -61.0 -48.1 23.5 20.0 23.3 76 76 A A H X>S+ 0 0 0 -4,-2.5 5,-0.7 3,-0.2 4,-0.5 0.944 118.1 44.7 -63.6 -44.6 23.9 16.6 25.0 77 77 A L H <>S+ 0 0 0 -4,-2.3 5,-2.7 -5,-0.2 4,-0.4 0.956 124.6 30.1 -65.7 -50.1 26.8 17.7 27.1 78 78 A L H <>S+ 0 0 23 -4,-2.7 5,-1.1 -5,-0.2 -3,-0.2 0.918 133.6 25.0 -75.8 -47.0 25.5 21.2 28.3 79 79 A D H <5S+ 0 0 84 -4,-1.8 -3,-0.2 -5,-0.5 -2,-0.1 0.822 128.8 37.7 -95.6 -33.2 21.7 20.6 28.4 80 80 A L T < S+ 0 0 37 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.892 108.3 52.8 -58.8 -44.1 21.3 17.8 35.8 85 85 A L H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 5,-0.2 0.947 111.0 46.5 -54.5 -54.6 24.8 17.7 37.6 86 86 A Q H X S+ 0 0 17 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.897 113.2 49.1 -57.9 -41.7 24.4 21.3 38.7 87 87 A E H X S+ 0 0 77 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.932 111.1 48.0 -67.1 -47.0 20.8 20.7 39.9 88 88 A K H X S+ 0 0 92 -4,-2.8 4,-0.9 2,-0.2 -1,-0.2 0.911 115.6 46.0 -58.9 -42.9 21.5 17.5 42.0 89 89 A L H <>S+ 0 0 1 -4,-2.1 5,-2.3 -5,-0.2 3,-0.4 0.934 113.9 46.8 -65.2 -50.3 24.5 19.2 43.7 90 90 A R H ><5S+ 0 0 105 -4,-2.6 3,-2.2 1,-0.2 -2,-0.2 0.925 108.7 55.4 -58.6 -43.5 22.6 22.5 44.4 91 91 A Q H 3<5S+ 0 0 152 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.801 106.2 53.5 -59.6 -25.8 19.7 20.5 45.8 92 92 A A T 3<5S- 0 0 39 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.392 125.6-101.1 -90.3 6.3 22.1 18.8 48.1 93 93 A G T < 5S+ 0 0 47 -3,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.448 75.4 140.0 88.7 2.4 23.5 22.2 49.5 94 94 A V < - 0 0 4 -5,-2.3 2,-0.6 -6,-0.2 -1,-0.3 -0.632 50.5-133.2 -77.7 131.9 26.7 22.3 47.4 95 95 A S + 0 0 51 -2,-0.3 45,-2.0 43,-0.1 2,-0.3 -0.799 49.9 133.5 -86.8 119.8 27.7 25.7 46.0 96 96 A C E -d 140 0A 1 -2,-0.6 2,-0.3 43,-0.3 43,-0.0 -0.951 37.4-149.3-160.4 167.7 28.7 25.2 42.3 97 97 A Q E -d 141 0A 67 43,-2.1 45,-2.3 -2,-0.3 2,-0.4 -0.956 17.9-128.6-154.5 126.3 28.2 26.7 38.8 98 98 A Q E -d 142 0A 10 -2,-0.3 2,-0.4 43,-0.2 45,-0.2 -0.647 27.6-134.0 -69.3 125.2 28.1 25.3 35.2 99 99 A L + 0 0 4 43,-2.4 45,-0.3 -2,-0.4 -1,-0.0 -0.697 41.3 150.1 -73.8 134.0 30.4 27.2 32.8 100 100 A K S > S+ 0 0 101 -2,-0.4 3,-1.4 43,-0.1 4,-0.4 0.411 78.6 15.5-124.2 -78.4 28.8 28.1 29.4 101 101 A S G > S+ 0 0 81 1,-0.3 3,-0.8 2,-0.2 4,-0.3 0.838 121.6 65.9 -68.3 -31.4 30.2 31.3 27.8 102 102 A D G > S+ 0 0 63 1,-0.2 3,-1.0 2,-0.2 4,-0.4 0.666 80.7 83.8 -59.2 -17.3 33.2 31.1 30.3 103 103 A I G X> S+ 0 0 4 -3,-1.4 4,-2.4 1,-0.2 3,-2.1 0.932 84.8 54.0 -54.6 -46.0 34.3 27.9 28.5 104 104 A K G <4 S+ 0 0 97 -3,-0.8 -1,-0.2 -4,-0.4 -2,-0.2 0.713 106.3 53.6 -63.9 -19.5 36.1 29.8 25.7 105 105 A H G <4 S+ 0 0 109 -3,-1.0 -1,-0.3 -4,-0.3 25,-0.2 0.438 117.3 35.4 -92.5 1.8 38.1 31.7 28.3 106 106 A V T <4 S+ 0 0 3 -3,-2.1 21,-2.3 -4,-0.4 2,-0.7 0.745 109.8 50.6-115.4 -47.4 39.3 28.6 30.1 107 107 A V E < -J 126 0D 3 -4,-2.4 41,-1.9 19,-0.2 2,-0.4 -0.855 57.1-175.2-107.9 111.1 40.0 25.7 27.6 108 108 A A E +Jk 125 148D 34 17,-2.7 16,-2.9 -2,-0.7 17,-1.8 -0.843 15.8 166.3 -95.3 142.7 42.1 26.2 24.5 109 109 A A E -J 123 0D 4 39,-1.6 41,-0.4 -2,-0.4 2,-0.3 -0.887 23.7-150.8-143.8 168.3 42.5 23.4 22.0 110 110 A D E -J 122 0D 69 12,-1.7 12,-2.3 -2,-0.3 2,-0.2 -0.913 43.0 -78.6-136.7 167.5 43.6 22.4 18.4 111 111 A Y E -J 121 0D 39 -2,-0.3 10,-0.2 10,-0.2 3,-0.2 -0.499 29.2-151.1 -69.1 129.0 42.4 19.7 15.9 112 112 A L S S- 0 0 58 8,-2.6 -1,-0.1 -2,-0.2 9,-0.1 0.906 81.2 -29.2 -62.4 -43.6 43.8 16.3 16.7 113 113 A D >>> - 0 0 73 7,-0.4 4,-2.8 5,-0.3 5,-0.7 -0.453 61.0-161.4 177.8 85.3 43.7 15.2 13.0 114 114 A K H 3>5S+ 0 0 120 1,-0.2 4,-1.7 3,-0.2 -2,-0.1 0.848 88.4 52.4 -48.8 -49.9 41.1 16.8 10.9 115 115 A D H 345S+ 0 0 166 1,-0.2 -1,-0.2 2,-0.2 -2,-0.0 0.840 120.9 33.3 -63.1 -35.1 41.1 14.3 8.0 116 116 A T H <45S+ 0 0 59 -3,-0.6 -2,-0.2 2,-0.1 -1,-0.2 0.912 137.0 13.7 -82.7 -44.9 40.7 11.3 10.4 117 117 A Y H <5S- 0 0 30 -4,-2.8 -52,-2.8 1,-0.3 2,-0.4 0.551 81.5-152.6-114.0 -14.3 38.5 12.7 13.3 118 118 A G B < - 0 0 70 -21,-2.3 4,-0.6 -2,-0.5 3,-0.5 -0.746 18.1-172.7 -79.5 98.9 43.7 29.5 31.8 128 128 A K H >> + 0 0 93 -2,-1.0 4,-3.0 1,-0.2 3,-0.8 0.841 69.4 75.4 -61.9 -37.1 44.0 29.0 35.6 129 129 A R H 3> S+ 0 0 60 1,-0.3 4,-1.1 2,-0.2 -1,-0.2 0.835 97.5 44.3 -52.9 -40.6 43.0 32.6 36.6 130 130 A V H 3> S+ 0 0 27 -3,-0.5 4,-0.8 -25,-0.2 -1,-0.3 0.779 113.0 49.2 -81.8 -23.0 39.3 32.1 35.8 131 131 A I H <>S+ 0 0 24 -4,-0.8 5,-1.6 -3,-0.3 3,-0.7 0.934 115.2 46.5 -63.7 -49.4 35.5 30.4 41.4 135 135 A L H ><5S+ 0 0 19 -4,-2.2 3,-2.6 1,-0.3 -2,-0.2 0.920 108.4 54.4 -64.5 -38.9 37.6 28.7 43.9 136 136 A E H 3<5S+ 0 0 90 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.778 108.9 52.8 -63.9 -18.8 38.5 31.9 45.7 137 137 A N T <<5S- 0 0 120 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.292 116.1-117.9 -98.2 9.5 34.8 32.3 45.9 138 138 A R T < 5S+ 0 0 217 -3,-2.6 2,-0.4 1,-0.2 -3,-0.2 0.906 73.9 126.0 51.2 51.5 34.2 28.8 47.5 139 139 A Q < - 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