==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (O-GLYCOSYL) 10-FEB-95 1LZG . COMPND 2 MOLECULE: HEN EGG WHITE LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR K.MAENAKA,M.MATSUSHIMA,H.SONG,K.WATANABE,I.KUMAGAI . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6714.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 88 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 11 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 8 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 21.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 24.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.3 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 0 1 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 K 0 0 91 0, 0.0 39,-2.3 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 129.3 2.5 10.4 9.1 2 2 A V B -A 39 0A 102 37,-0.2 37,-0.3 38,-0.1 36,-0.1 -0.898 360.0-142.2 -95.1 109.6 2.5 13.8 7.4 3 3 A F - 0 0 15 35,-3.1 2,-0.3 -2,-0.7 3,-0.0 -0.435 7.2-124.7 -74.4 153.3 -1.1 15.0 7.4 4 4 A G > - 0 0 35 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.651 32.1-110.3 -86.6 150.4 -2.6 16.9 4.5 5 5 A R H > S+ 0 0 61 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.909 116.8 35.9 -48.5 -62.1 -4.1 20.3 5.5 6 6 A a H > S+ 0 0 43 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.815 113.3 60.7 -65.9 -34.8 -7.8 19.5 5.1 7 7 A E H > S+ 0 0 91 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.927 109.1 42.0 -57.1 -49.0 -7.2 15.8 6.3 8 8 A L H X S+ 0 0 0 -4,-2.3 4,-3.4 2,-0.2 5,-0.3 0.908 109.5 58.4 -62.3 -46.9 -6.0 17.1 9.7 9 9 A A H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 5,-0.2 0.957 109.2 45.8 -51.3 -49.4 -8.8 19.7 9.9 10 10 A A H X S+ 0 0 46 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.929 112.9 48.9 -62.4 -47.5 -11.3 16.9 9.6 11 11 A A H X S+ 0 0 17 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.915 112.3 48.8 -59.6 -42.9 -9.5 14.8 12.2 12 12 A M H <>S+ 0 0 1 -4,-3.4 5,-2.0 1,-0.2 6,-0.2 0.910 111.4 48.5 -63.6 -45.5 -9.3 17.7 14.6 13 13 A K H ><5S+ 0 0 84 -4,-2.5 3,-1.9 -5,-0.3 5,-0.2 0.909 109.3 54.2 -59.3 -42.7 -12.9 18.5 14.2 14 14 A R H 3<5S+ 0 0 191 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.822 106.5 52.0 -60.1 -34.1 -13.8 14.9 14.8 15 15 A H T 3<5S- 0 0 30 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.235 124.0-104.1 -89.2 11.9 -11.9 14.9 18.0 16 16 A G T < 5S+ 0 0 37 -3,-1.9 -3,-0.2 -5,-0.1 -2,-0.1 0.700 81.0 126.1 69.7 33.1 -13.8 17.9 19.3 17 17 A L > < + 0 0 0 -5,-2.0 3,-2.2 2,-0.1 2,-0.4 0.647 36.1 107.8 -92.3 -17.3 -11.3 20.8 18.9 18 18 A D T 3 S- 0 0 60 1,-0.3 6,-0.2 -6,-0.2 3,-0.1 -0.511 105.7 -7.0 -66.2 117.3 -13.5 23.2 16.8 19 19 A N T > S+ 0 0 98 4,-1.4 3,-2.0 -2,-0.4 2,-0.4 0.613 92.0 162.4 69.0 16.7 -14.3 26.0 19.2 20 20 A Y B X S-B 23 0B 57 -3,-2.2 3,-2.0 3,-0.8 -1,-0.3 -0.499 79.4 -5.7 -70.0 125.9 -12.8 24.1 22.0 21 21 A R T 3 S- 0 0 144 -2,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.801 135.1 -59.3 59.3 28.8 -12.2 26.6 24.8 22 22 A G T < S+ 0 0 65 -3,-2.0 2,-0.7 1,-0.2 -1,-0.3 0.510 105.6 129.4 80.6 9.8 -13.3 29.2 22.3 23 23 A Y B < -B 20 0B 47 -3,-2.0 -4,-1.4 -6,-0.2 -3,-0.8 -0.854 52.5-136.6-103.2 116.3 -10.6 28.5 19.7 24 24 A S >> - 0 0 40 -2,-0.7 3,-1.6 -6,-0.2 4,-1.0 -0.125 28.4-103.4 -65.4 155.9 -11.9 27.9 16.1 25 25 A L H 3> S+ 0 0 1 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.806 116.9 67.5 -50.2 -39.1 -10.4 25.0 14.0 26 26 A G H 3> S+ 0 0 2 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.827 97.7 54.6 -53.8 -34.4 -8.3 27.4 12.0 27 27 A N H <> S+ 0 0 22 -3,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.920 108.7 46.8 -65.5 -45.0 -6.2 28.1 15.1 28 28 A W H X S+ 0 0 0 -4,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.845 114.5 46.4 -65.3 -42.3 -5.5 24.4 15.7 29 29 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.889 113.1 49.2 -69.6 -40.6 -4.5 23.8 12.1 30 30 A b H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 5,-0.2 0.932 110.7 51.8 -63.3 -43.8 -2.3 26.9 11.9 31 31 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.931 111.0 46.9 -61.5 -47.2 -0.7 25.8 15.2 32 32 A A H X>S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 6,-1.1 0.897 109.5 54.7 -59.2 -46.9 0.1 22.3 13.8 33 33 A K H X5S+ 0 0 65 -4,-2.4 4,-1.1 4,-0.2 -2,-0.2 0.955 116.7 35.4 -52.1 -49.0 1.5 23.8 10.5 34 34 A F H <5S+ 0 0 58 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.752 118.9 49.5 -80.9 -27.8 4.0 26.0 12.3 35 35 A E H <5S- 0 0 32 -4,-2.2 -2,-0.2 20,-0.2 -3,-0.2 0.888 139.2 -7.7 -78.3 -45.0 4.9 23.6 15.2 36 36 A S H ><5S- 0 0 14 -4,-2.6 3,-1.2 19,-0.4 -3,-0.2 0.384 85.2-114.5-134.6 2.1 5.5 20.4 13.1 37 37 A N T 3< - 0 0 53 4,-3.4 3,-2.2 -2,-0.4 -2,-0.0 -0.605 26.5-110.1-102.2 165.2 15.2 22.4 24.2 47 47 A T T 3 S+ 0 0 160 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.810 116.4 62.7 -62.6 -31.3 18.1 23.9 26.2 48 48 A D T 3 S- 0 0 79 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.419 121.3-107.6 -71.8 -2.3 16.6 22.9 29.5 49 49 A G S < S+ 0 0 24 -3,-2.2 -2,-0.1 1,-0.4 2,-0.1 0.360 82.3 121.9 91.2 -1.9 16.9 19.2 28.3 50 50 A S - 0 0 0 19,-0.1 -4,-3.4 -5,-0.0 -1,-0.4 -0.478 51.3-140.9 -89.5 166.1 13.2 18.7 27.7 51 51 A T E -C 45 0C 4 -6,-0.3 9,-2.2 -2,-0.1 2,-0.4 -0.967 3.8-134.7-128.8 149.6 11.9 17.6 24.3 52 52 A D E -CD 44 59C 24 -8,-3.7 -8,-1.7 -2,-0.3 2,-0.4 -0.869 27.1-155.9-105.0 141.5 8.8 18.6 22.2 53 53 A Y E > -CD 43 58C 24 5,-2.2 5,-2.0 -2,-0.4 3,-0.4 -0.954 30.8 -27.0-128.7 139.1 6.8 15.8 20.6 54 54 A G T > 5S- 0 0 0 -12,-2.1 3,-1.4 -2,-0.4 30,-0.2 -0.062 97.7 -22.8 73.1-164.8 4.5 15.4 17.7 55 55 A I T 3 5S+ 0 0 3 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.764 140.7 34.0 -50.4 -37.2 2.1 17.3 15.6 56 56 A L T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.310 104.0-125.6-110.2 7.8 1.5 19.8 18.5 57 57 A Q T < 5 - 0 0 12 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.865 35.0-167.7 48.1 54.0 5.0 19.8 19.9 58 58 A I E < -D 53 0C 3 -5,-2.0 -5,-2.2 -6,-0.1 2,-0.3 -0.483 18.1-119.2 -77.2 132.9 3.9 19.0 23.4 59 59 A N E >> -D 52 0C 30 -2,-0.3 4,-2.8 -7,-0.2 3,-0.8 -0.560 8.9-148.8 -84.9 131.6 6.7 19.4 26.0 60 60 A S T 34 S+ 0 0 0 -9,-2.2 6,-0.2 -2,-0.3 4,-0.1 0.689 90.4 74.8 -69.4 -23.7 8.2 16.7 28.2 61 61 A R T 34 S+ 0 0 55 1,-0.2 12,-2.9 -10,-0.1 -1,-0.2 0.866 122.5 2.0 -58.5 -36.4 9.0 19.2 31.1 62 62 A F T <4 S+ 0 0 109 -3,-0.8 13,-2.3 10,-0.2 -2,-0.2 0.720 131.6 41.8-119.4 -31.0 5.3 19.3 32.0 63 63 A W S < S+ 0 0 30 -4,-2.8 13,-2.3 11,-0.3 15,-0.3 0.716 104.0 18.9-104.1 -21.8 3.1 17.1 29.9 64 64 A c - 0 0 0 -5,-0.5 2,-0.6 9,-0.4 11,-0.1 -0.913 67.3-109.9-146.7 166.5 4.5 13.6 29.2 65 65 A N B +e 79 0D 81 13,-2.4 15,-2.7 -2,-0.3 16,-0.4 -0.924 35.0 158.8-106.1 122.8 7.0 11.2 30.4 66 66 A D - 0 0 34 -2,-0.6 -1,-0.1 13,-0.2 -6,-0.0 0.122 52.9-123.3-119.4 3.3 10.1 10.5 28.2 67 67 A G S S+ 0 0 65 1,-0.1 -2,-0.1 2,-0.1 0, 0.0 0.575 96.0 72.5 64.9 13.2 12.3 9.2 31.0 68 68 A R + 0 0 118 1,-0.1 -1,-0.1 2,-0.0 -8,-0.0 0.013 65.8 88.9-145.7 30.0 15.0 11.7 30.4 69 69 A T S > S- 0 0 8 -9,-0.1 3,-1.3 3,-0.1 -2,-0.1 -0.651 72.4-144.1-128.6 72.8 13.8 15.0 31.7 70 70 A P T 3 S+ 0 0 118 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 0.039 77.1 7.9 -46.6 133.9 14.7 15.1 35.4 71 71 A G T 3 S+ 0 0 84 1,-0.2 2,-0.2 0, 0.0 -10,-0.0 0.730 96.9 136.1 66.9 26.6 12.3 16.7 37.8 72 72 A S < - 0 0 36 -3,-1.3 -10,-0.2 1,-0.1 -1,-0.2 -0.536 49.3-122.4 -98.7 166.7 9.6 17.2 35.1 73 73 A R - 0 0 164 -12,-2.9 -9,-0.4 -2,-0.2 3,-0.1 -0.591 2.8-148.3-104.6 166.9 5.9 16.5 35.4 74 74 A N > + 0 0 47 -11,-0.2 3,-1.6 -2,-0.2 -11,-0.3 -0.600 28.6 162.6-134.7 62.1 3.6 14.2 33.4 75 75 A L T 3 S+ 0 0 53 -13,-2.3 -12,-0.2 1,-0.3 -11,-0.2 0.678 75.5 49.4 -59.1 -25.5 0.3 16.0 33.5 76 76 A d T 3 S- 0 0 12 -13,-2.3 -1,-0.3 2,-0.2 -12,-0.1 0.479 103.0-133.6 -93.4 -6.4 -1.2 14.1 30.5 77 77 A N < + 0 0 126 -3,-1.6 -13,-0.1 -14,-0.2 -2,-0.1 0.905 64.0 109.2 52.6 55.4 -0.2 10.9 32.1 78 78 A I S S- 0 0 33 -15,-0.3 -13,-2.4 16,-0.0 -1,-0.2 -0.983 75.7-100.9-152.9 151.4 1.3 9.3 29.0 79 79 A P B > -e 65 0D 68 0, 0.0 3,-1.5 0, 0.0 4,-0.4 -0.464 38.1-122.6 -69.5 140.3 4.7 8.3 27.6 80 80 A c G > S+ 0 0 1 -15,-2.7 3,-2.1 1,-0.3 -14,-0.1 0.843 108.4 70.2 -57.8 -31.7 5.8 11.1 25.1 81 81 A S G > S+ 0 0 86 -16,-0.4 3,-2.1 1,-0.3 4,-0.3 0.810 85.0 68.8 -57.7 -29.1 6.2 8.4 22.4 82 82 A A G X S+ 0 0 32 -3,-1.5 3,-0.6 1,-0.3 -1,-0.3 0.738 91.3 62.3 -59.0 -25.3 2.3 8.1 22.4 83 83 A L G < S+ 0 0 3 -3,-2.1 -28,-0.5 -4,-0.4 -1,-0.3 0.519 94.8 61.3 -80.8 -2.8 2.4 11.7 20.9 84 84 A L G < S+ 0 0 44 -3,-2.1 -1,-0.2 -30,-0.2 -2,-0.2 0.407 78.3 117.7-100.4 -9.1 4.2 10.5 17.7 85 85 A S S < S- 0 0 52 -3,-0.6 6,-0.1 -4,-0.3 -3,-0.0 -0.115 75.2-120.4 -59.9 155.4 1.6 8.0 16.5 86 86 A S S S+ 0 0 76 2,-0.1 2,-0.6 -45,-0.0 -1,-0.1 0.667 101.6 76.1 -69.4 -19.6 -0.3 8.3 13.2 87 87 A D S S- 0 0 89 1,-0.1 3,-0.4 -47,-0.0 4,-0.3 -0.904 72.6-157.5 -94.9 119.1 -3.5 8.5 15.3 88 88 A I > + 0 0 7 -2,-0.6 4,-2.5 1,-0.2 5,-0.2 0.290 62.1 105.8 -85.6 8.1 -3.8 11.9 16.9 89 89 A T H > S+ 0 0 45 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.906 82.4 44.7 -53.6 -48.4 -6.1 11.0 19.8 90 90 A A H > S+ 0 0 27 -3,-0.4 4,-2.4 -8,-0.3 -1,-0.2 0.919 113.3 50.6 -64.0 -41.9 -3.4 11.2 22.5 91 91 A S H > S+ 0 0 5 -4,-0.3 4,-2.2 -9,-0.3 -1,-0.2 0.881 114.2 46.0 -62.1 -40.4 -2.1 14.5 21.1 92 92 A V H X S+ 0 0 2 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.914 110.6 50.6 -68.9 -44.8 -5.6 15.9 21.1 93 93 A N H X S+ 0 0 81 -4,-2.9 4,-0.9 1,-0.2 -2,-0.2 0.896 114.7 45.7 -58.5 -42.7 -6.5 14.7 24.6 94 94 A d H >X S+ 0 0 3 -4,-2.4 4,-2.1 -5,-0.2 3,-0.6 0.899 109.0 54.4 -68.2 -41.9 -3.4 16.2 25.9 95 95 A A H 3X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.891 102.3 58.7 -58.6 -40.8 -3.9 19.5 24.0 96 96 A K H 3X S+ 0 0 46 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.868 108.3 46.3 -56.5 -36.3 -7.3 19.9 25.5 97 97 A K H X< S+ 0 0 102 -4,-0.9 3,-0.6 -3,-0.6 4,-0.2 0.910 112.1 49.6 -73.7 -44.5 -5.7 19.9 29.0 98 98 A I H >< S+ 0 0 8 -4,-2.1 3,-1.7 1,-0.2 5,-0.4 0.928 108.6 51.3 -58.4 -50.9 -2.9 22.3 28.1 99 99 A V H 3< S+ 0 0 6 -4,-2.7 3,-0.4 1,-0.3 5,-0.3 0.649 109.2 52.6 -62.8 -21.3 -5.3 24.9 26.5 100 100 A S T << S+ 0 0 43 -4,-0.6 -1,-0.3 -3,-0.6 -2,-0.2 0.325 84.4 93.9 -94.1 -0.4 -7.4 24.8 29.7 101 101 A D S < S- 0 0 111 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.1 0.542 107.6 -92.4 -74.6 -10.7 -4.4 25.5 31.9 102 102 A G S S+ 0 0 67 -3,-0.4 -3,-0.1 -4,-0.1 -1,-0.1 -0.037 114.7 70.8 125.4 -34.3 -4.7 29.3 32.1 103 103 A N S > S- 0 0 125 -5,-0.4 3,-1.5 1,-0.3 -4,-0.1 0.411 80.4-154.3 -95.3 -0.6 -2.6 30.6 29.2 104 104 A G G > - 0 0 12 -5,-0.3 3,-1.2 1,-0.2 -1,-0.3 -0.343 67.1 -21.5 63.7-145.9 -4.9 29.4 26.4 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.6 2,-0.1 7,-0.3 0.518 117.1 91.8 -74.2 -6.4 -3.1 28.8 23.1 106 106 A N G < + 0 0 47 -3,-1.5 -1,-0.3 1,-0.3 6,-0.2 0.748 69.1 79.0 -61.0 -18.3 -0.2 31.0 24.2 107 107 A A G < S+ 0 0 55 -3,-1.2 2,-0.8 1,-0.1 -1,-0.3 0.686 83.4 69.9 -61.4 -23.2 1.3 27.8 25.5 108 108 A W S <> S- 0 0 9 -3,-2.6 4,-2.3 1,-0.2 3,-0.4 -0.889 72.3-162.6-101.0 108.5 2.2 27.1 21.8 109 109 A V H > S+ 0 0 73 -2,-0.8 4,-2.1 1,-0.2 -1,-0.2 0.840 90.8 52.1 -58.3 -38.3 5.0 29.6 20.9 110 110 A A H > S+ 0 0 13 1,-0.2 4,-2.2 2,-0.2 5,-0.4 0.850 109.4 52.1 -67.3 -33.9 4.4 29.1 17.1 111 111 A W H >>S+ 0 0 11 -3,-0.4 5,-3.3 -6,-0.2 4,-2.0 0.935 110.4 46.4 -64.3 -51.0 0.7 29.9 17.6 112 112 A R H <5S+ 0 0 103 -4,-2.3 -2,-0.2 -7,-0.3 -1,-0.2 0.879 121.3 37.8 -61.5 -39.0 1.4 33.1 19.5 113 113 A N H <5S+ 0 0 117 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.671 132.4 18.1 -87.6 -23.1 4.0 34.3 16.9 114 114 A R H <5S+ 0 0 141 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 0.560 131.6 30.2-126.3 -11.3 2.5 33.2 13.6 115 115 A b T ><5S+ 0 0 0 -4,-2.0 3,-2.4 -5,-0.4 -3,-0.2 0.734 85.5 101.2-114.9 -42.7 -1.2 32.5 14.1 116 116 A K T 3 + 0 0 114 1,-0.2 3,-1.7 -2,-0.2 4,-0.2 -0.586 51.3 174.7 -85.1 82.2 -7.0 35.4 9.6 120 120 A V G > + 0 0 16 -2,-1.9 3,-1.5 1,-0.3 4,-0.2 0.639 64.2 81.6 -64.9 -15.4 -6.9 31.8 10.8 121 121 A Q G > S+ 0 0 137 1,-0.3 3,-2.0 2,-0.2 4,-0.4 0.810 77.3 72.2 -57.2 -32.5 -10.0 31.0 8.7 122 122 A A G X S+ 0 0 36 -3,-1.7 3,-0.8 1,-0.3 -1,-0.3 0.757 84.8 66.7 -56.3 -29.7 -7.7 30.6 5.7 123 123 A W G < S+ 0 0 50 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.607 105.2 40.9 -71.0 -13.9 -6.3 27.4 7.1 124 124 A I G X S+ 0 0 47 -3,-2.0 3,-2.0 -4,-0.2 -1,-0.2 0.367 84.0 134.6-112.2 3.1 -9.7 25.6 6.6 125 125 A R T < S+ 0 0 151 -3,-0.8 3,-0.1 -4,-0.4 -119,-0.1 -0.199 75.9 8.2 -56.0 138.4 -10.5 27.1 3.2 126 126 A G T 3 S+ 0 0 84 1,-0.2 2,-0.3 -120,-0.0 -1,-0.3 0.420 94.7 137.1 70.3 1.2 -11.8 24.6 0.7 127 127 A a < - 0 0 22 -3,-2.0 2,-1.1 1,-0.1 -1,-0.2 -0.593 57.3-129.7 -83.0 141.9 -12.1 21.8 3.2 128 128 A R 0 0 242 -2,-0.3 -1,-0.1 -3,-0.1 -3,-0.0 -0.809 360.0 360.0 -88.0 99.6 -15.1 19.5 3.2 129 129 A L 0 0 100 -2,-1.1 -119,-0.0 -5,-0.1 -123,-0.0 -0.926 360.0 360.0-121.1 360.0 -16.1 19.7 6.9