==== 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 26-JUL-06 2HU3 . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR F.FROLOW,S.LAGZIEL-SIMIS,N.COHEN-HADAR,Y.WINE,A.FREEMAN . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6625.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 87 67.4 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 . 27 20.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 25.6 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 87 0, 0.0 39,-3.0 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 137.1 2.2 10.5 8.7 2 2 A V B -A 39 0A 97 37,-0.2 37,-0.2 38,-0.1 2,-0.1 -0.924 360.0-149.1-103.9 109.2 2.2 13.9 6.9 3 3 A F - 0 0 13 35,-2.6 2,-0.2 -2,-0.7 3,-0.0 -0.447 10.7-120.7 -73.4 148.0 -1.4 15.1 6.8 4 4 A G > - 0 0 35 -2,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.478 33.4-108.6 -71.2 160.4 -2.9 17.2 4.2 5 5 A R H > S+ 0 0 90 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.957 117.9 36.4 -59.6 -57.7 -4.3 20.5 5.4 6 6 A a H > S+ 0 0 46 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.875 114.9 58.4 -67.0 -33.0 -8.0 19.7 5.0 7 7 A E H > S+ 0 0 89 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.910 108.6 44.0 -59.5 -43.7 -7.3 16.1 6.1 8 8 A L H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.911 110.8 54.9 -69.1 -42.4 -5.9 17.3 9.4 9 9 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.930 109.9 47.3 -52.8 -50.2 -8.7 19.8 9.8 10 10 A A H X S+ 0 0 43 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.900 112.2 48.8 -59.4 -44.4 -11.2 17.0 9.4 11 11 A A H X S+ 0 0 20 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.907 111.0 50.7 -64.1 -41.9 -9.4 14.7 11.9 12 12 A M H <>S+ 0 0 1 -4,-3.0 5,-2.5 2,-0.2 6,-0.4 0.917 112.5 46.7 -62.5 -41.6 -9.1 17.6 14.4 13 13 A K H ><5S+ 0 0 82 -4,-2.3 3,-2.1 -5,-0.2 -2,-0.2 0.921 107.5 56.6 -66.7 -42.5 -12.9 18.2 14.1 14 14 A R H 3<5S+ 0 0 196 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.851 109.6 47.8 -52.1 -40.0 -13.6 14.4 14.4 15 15 A H T 3<5S- 0 0 51 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.241 121.0-107.0 -94.4 14.0 -11.8 14.5 17.7 16 16 A G T < 5S+ 0 0 31 -3,-2.1 -3,-0.2 -5,-0.1 -2,-0.1 0.675 81.7 124.5 79.8 19.2 -13.6 17.6 19.0 17 17 A L > < + 0 0 0 -5,-2.5 3,-2.1 -6,-0.1 2,-0.4 0.700 39.4 107.3 -84.0 -19.2 -10.9 20.2 18.7 18 18 A D T 3 S- 0 0 61 -6,-0.4 6,-0.2 1,-0.3 3,-0.1 -0.435 102.0 -6.8 -70.3 121.8 -12.9 22.5 16.6 19 19 A N T > S+ 0 0 104 4,-1.5 3,-2.3 -2,-0.4 -1,-0.3 0.595 91.0 163.0 66.3 15.6 -13.8 25.5 18.9 20 20 A Y B X S-B 23 0B 70 -3,-2.1 3,-1.9 3,-0.6 -1,-0.2 -0.449 76.7 -2.7 -67.4 128.2 -12.4 23.7 21.9 21 21 A R T 3 S- 0 0 159 1,-0.3 -1,-0.3 -2,-0.2 3,-0.1 0.745 135.3 -61.3 56.1 26.9 -11.8 26.4 24.6 22 22 A G T < S+ 0 0 56 -3,-2.3 2,-0.7 1,-0.2 -1,-0.3 0.500 103.5 133.0 82.6 7.3 -13.1 28.8 22.0 23 23 A Y B < -B 20 0B 48 -3,-1.9 -4,-1.5 -6,-0.1 -3,-0.6 -0.818 51.9-133.9 -98.1 112.9 -10.3 28.2 19.5 24 24 A S >> - 0 0 48 -2,-0.7 3,-1.3 -5,-0.2 4,-1.2 -0.146 25.3-103.4 -60.9 160.9 -11.6 27.7 16.0 25 25 A L H 3> S+ 0 0 12 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.837 118.8 60.0 -54.7 -40.5 -10.4 24.9 13.8 26 26 A G H 3> S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.838 99.7 57.6 -60.7 -32.4 -8.1 27.2 11.8 27 27 A N H <> S+ 0 0 22 -3,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.913 109.3 44.6 -59.4 -45.4 -6.2 28.1 14.9 28 28 A W H X S+ 0 0 0 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.872 114.0 48.4 -67.3 -41.2 -5.4 24.5 15.5 29 29 A V H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.929 111.8 50.3 -66.3 -43.2 -4.5 23.8 11.9 30 30 A b H X S+ 0 0 1 -4,-2.6 4,-2.1 2,-0.2 5,-0.2 0.927 110.3 50.0 -58.5 -46.5 -2.3 26.9 11.8 31 31 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.937 111.8 47.9 -58.9 -46.7 -0.5 25.8 15.0 32 32 A A H X>S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 6,-1.2 0.893 107.9 56.9 -62.3 -38.7 0.1 22.3 13.6 33 33 A K H X5S+ 0 0 62 -4,-2.5 4,-1.7 4,-0.2 -1,-0.2 0.952 115.3 34.8 -57.3 -49.8 1.4 23.9 10.4 34 34 A F H <5S+ 0 0 60 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.761 119.7 49.3 -84.6 -19.8 4.1 25.8 12.1 35 35 A E H <5S- 0 0 38 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.904 138.1 -6.6 -77.6 -43.4 4.9 23.3 14.8 36 36 A S H ><5S- 0 0 12 -4,-2.5 3,-1.5 19,-0.4 -3,-0.2 0.395 82.3-115.8-135.2 -2.9 5.3 20.2 12.6 37 37 A N T 3< - 0 0 46 4,-3.1 3,-2.0 -2,-0.3 -1,-0.0 -0.571 24.2-111.8 -95.5 157.4 14.8 21.9 23.4 47 47 A T T 3 S+ 0 0 163 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.840 117.0 59.5 -53.3 -36.6 17.7 23.7 25.0 48 48 A D T 3 S- 0 0 83 1,-0.1 -1,-0.3 21,-0.0 3,-0.1 0.453 122.1-104.4 -74.8 -7.0 16.5 22.6 28.5 49 49 A G S < S+ 0 0 29 -3,-2.0 -2,-0.1 1,-0.4 -1,-0.1 0.258 84.9 120.6 99.4 -10.3 16.9 18.9 27.5 50 50 A S - 0 0 0 19,-0.1 -4,-3.1 -5,-0.1 -1,-0.4 -0.306 53.6-138.6 -72.7 169.9 13.1 18.3 27.0 51 51 A T E -C 45 0C 2 -6,-0.3 9,-2.4 -3,-0.1 2,-0.4 -0.981 1.2-137.4-134.0 145.9 11.8 17.3 23.6 52 52 A D E -CD 44 59C 27 -8,-2.8 -8,-1.9 -2,-0.3 2,-0.4 -0.867 25.8-161.1-102.9 138.3 8.7 18.3 21.7 53 53 A Y E > -CD 43 58C 23 5,-2.0 5,-2.2 -2,-0.4 3,-0.4 -0.964 32.0 -13.3-129.9 134.5 6.7 15.5 20.0 54 54 A G T > 5S- 0 0 0 -12,-2.6 3,-1.6 -2,-0.4 30,-0.2 -0.150 98.7 -30.1 87.7-169.2 4.1 15.2 17.2 55 55 A I T 3 5S+ 0 0 3 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.743 140.9 35.0 -63.3 -27.9 1.9 17.4 15.1 56 56 A L T 3 5S- 0 0 1 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.176 106.3-122.9-111.1 11.5 1.5 19.9 18.0 57 57 A Q T < 5 - 0 0 10 -3,-1.6 2,-0.2 1,-0.2 -3,-0.2 0.895 34.7-164.0 49.9 57.1 5.0 19.6 19.3 58 58 A I E < -D 53 0C 2 -5,-2.2 -5,-2.0 -6,-0.1 2,-0.3 -0.486 15.5-123.4 -81.0 129.8 3.9 18.7 22.9 59 59 A N E >> -D 52 0C 30 -2,-0.2 4,-2.2 -7,-0.2 3,-0.8 -0.609 7.2-145.8 -88.8 136.8 6.7 19.0 25.4 60 60 A S T 34 S+ 0 0 0 -9,-2.4 13,-0.2 -2,-0.3 6,-0.2 0.516 89.2 80.8 -73.7 -9.0 8.1 16.4 27.7 61 61 A R T 34 S- 0 0 59 11,-0.2 12,-2.2 -10,-0.2 -1,-0.2 0.902 120.4 -3.5 -63.3 -38.3 8.8 18.9 30.5 62 62 A W T <4 S+ 0 0 127 -3,-0.8 13,-2.8 10,-0.2 -2,-0.2 0.696 131.8 44.8-120.4 -34.3 5.1 18.8 31.5 63 63 A W S < S+ 0 0 32 -4,-2.2 13,-1.9 11,-0.3 15,-0.3 0.715 103.2 19.8-109.0 -25.3 3.0 16.6 29.3 64 64 A c - 0 0 0 -5,-0.4 2,-0.6 9,-0.4 11,-0.1 -0.955 68.0-111.0-143.3 160.8 4.4 13.3 28.4 65 65 A N B +e 79 0D 78 13,-2.5 15,-2.5 -2,-0.3 16,-0.4 -0.866 36.3 156.2 -99.1 125.8 7.0 10.8 29.5 66 66 A D - 0 0 35 -2,-0.6 -1,-0.1 13,-0.2 8,-0.0 0.312 52.3-124.1-119.8 1.9 10.1 10.1 27.5 67 67 A G S S+ 0 0 66 2,-0.1 -2,-0.1 1,-0.1 0, 0.0 0.488 96.1 72.6 72.3 0.4 12.4 8.8 30.3 68 68 A R + 0 0 119 1,-0.1 -1,-0.1 2,-0.0 -3,-0.0 0.082 65.2 92.8-138.8 29.2 15.1 11.4 29.6 69 69 A T S > S- 0 0 7 -9,-0.1 3,-1.6 -19,-0.0 -2,-0.1 -0.791 70.9-140.7-121.0 88.8 13.7 14.8 30.8 70 70 A P T 3 S+ 0 0 108 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.190 79.7 8.0 -54.9 134.6 14.9 15.2 34.4 71 71 A G T 3 S+ 0 0 82 1,-0.2 2,-0.0 0, 0.0 -10,-0.0 0.593 99.4 137.9 78.6 10.7 12.5 16.7 36.9 72 72 A S < - 0 0 32 -3,-1.6 2,-0.2 1,-0.1 -10,-0.2 -0.258 44.4-135.1 -88.8 169.7 9.6 16.6 34.4 73 73 A R - 0 0 141 -12,-2.2 -9,-0.4 -13,-0.2 3,-0.1 -0.704 6.0-146.8-115.5 174.3 6.0 15.6 34.7 74 74 A N > + 0 0 49 -2,-0.2 3,-1.5 -11,-0.2 -11,-0.3 -0.582 30.1 161.9-138.4 67.8 3.7 13.5 32.5 75 75 A L T 3 S+ 0 0 61 -13,-2.8 -12,-0.2 1,-0.3 -11,-0.1 0.737 74.6 54.2 -75.8 -18.7 0.4 15.3 33.0 76 76 A d T 3 S- 0 0 8 -13,-1.9 -1,-0.3 2,-0.2 -12,-0.1 0.509 105.0-132.1 -84.6 -6.6 -1.2 13.7 29.9 77 77 A N < + 0 0 125 -3,-1.5 -13,-0.1 1,-0.2 -2,-0.1 0.907 65.0 112.9 57.3 52.0 -0.4 10.3 31.3 78 78 A I S S- 0 0 30 -15,-0.3 -13,-2.5 12,-0.0 2,-0.2 -0.991 73.9-103.9-147.4 150.3 1.1 9.0 28.1 79 79 A P B > -e 65 0D 70 0, 0.0 3,-1.8 0, 0.0 4,-0.4 -0.544 36.1-123.2 -69.3 140.7 4.5 8.0 26.6 80 80 A c G > S+ 0 0 2 -15,-2.5 3,-1.9 1,-0.3 -14,-0.1 0.833 109.6 68.5 -54.9 -32.8 5.7 10.8 24.4 81 81 A S G > S+ 0 0 81 -16,-0.4 3,-2.1 1,-0.3 -1,-0.3 0.777 85.4 68.3 -57.1 -29.7 5.9 8.2 21.5 82 82 A A G X S+ 0 0 30 -3,-1.8 3,-0.8 1,-0.3 9,-0.3 0.745 90.9 64.2 -59.9 -23.6 2.1 8.0 21.5 83 83 A L G < S+ 0 0 1 -3,-1.9 -28,-0.5 -4,-0.4 -1,-0.3 0.430 94.7 59.5 -79.3 -2.7 2.2 11.6 20.2 84 84 A L G < S+ 0 0 42 -3,-2.1 -1,-0.2 -30,-0.2 -2,-0.2 0.412 79.2 120.4-103.4 -2.3 4.0 10.4 17.0 85 85 A S S < S- 0 0 52 -3,-0.8 6,-0.1 -4,-0.2 -3,-0.0 -0.177 72.9-124.2 -62.4 153.6 1.2 8.0 15.8 86 86 A S S S+ 0 0 73 2,-0.0 2,-0.6 -45,-0.0 -1,-0.1 0.766 101.8 76.0 -64.6 -26.5 -0.6 8.4 12.5 87 87 A D S S- 0 0 88 1,-0.1 3,-0.5 -47,-0.0 4,-0.3 -0.829 74.7-156.7 -86.5 120.4 -3.8 8.5 14.7 88 88 A I > + 0 0 7 -2,-0.6 4,-2.6 1,-0.2 5,-0.2 0.421 62.1 107.0 -84.7 5.8 -4.0 11.9 16.3 89 89 A T H > S+ 0 0 48 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.876 80.7 45.4 -50.7 -51.4 -6.1 10.9 19.2 90 90 A A H > S+ 0 0 24 -3,-0.5 4,-2.3 -8,-0.3 5,-0.2 0.923 114.1 48.9 -65.9 -41.6 -3.4 11.1 21.9 91 91 A S H > S+ 0 0 6 -9,-0.3 4,-2.5 -4,-0.3 -1,-0.2 0.911 113.5 47.4 -59.2 -44.4 -2.1 14.5 20.6 92 92 A V H X S+ 0 0 2 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.937 112.2 48.9 -64.1 -46.7 -5.6 15.9 20.5 93 93 A N H X S+ 0 0 83 -4,-2.8 4,-1.1 -5,-0.2 -1,-0.2 0.888 115.0 44.8 -62.9 -39.5 -6.5 14.7 24.0 94 94 A d H X S+ 0 0 2 -4,-2.3 4,-2.5 -5,-0.2 3,-0.3 0.913 109.0 55.7 -71.1 -41.0 -3.3 16.1 25.4 95 95 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 -5,-0.2 5,-0.2 0.863 102.2 58.2 -57.1 -37.5 -3.7 19.4 23.5 96 96 A K H X S+ 0 0 43 -4,-2.1 4,-0.7 2,-0.2 -1,-0.2 0.902 108.4 45.8 -61.4 -38.3 -7.1 19.8 25.2 97 97 A K H >< S+ 0 0 94 -4,-1.1 3,-0.6 -3,-0.3 4,-0.3 0.934 113.3 49.6 -64.9 -47.1 -5.4 19.6 28.6 98 98 A I H >< S+ 0 0 6 -4,-2.5 3,-1.7 1,-0.2 5,-0.3 0.935 109.7 49.0 -61.2 -47.9 -2.6 22.0 27.5 99 99 A V H 3< S+ 0 0 3 -4,-2.9 5,-0.4 1,-0.3 3,-0.3 0.671 109.8 54.5 -70.4 -14.8 -5.0 24.7 26.2 100 100 A S T << S+ 0 0 33 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.403 81.3 94.3 -91.9 0.5 -7.0 24.4 29.4 101 101 A D S < S- 0 0 114 -3,-1.7 -1,-0.2 -4,-0.3 -2,-0.1 0.599 108.5 -87.8 -77.5 -12.8 -4.0 25.1 31.6 102 102 A G S S+ 0 0 64 -3,-0.3 -3,-0.1 -4,-0.2 -1,-0.1 -0.052 115.0 66.0 139.4 -34.2 -4.6 28.9 31.9 103 103 A N S > S- 0 0 122 1,-0.3 3,-1.8 -5,-0.3 4,-0.1 0.230 82.6-147.8-101.4 10.7 -2.8 30.6 28.9 104 104 A G G > - 0 0 11 -5,-0.4 3,-1.5 1,-0.3 -1,-0.3 -0.216 68.7 -16.7 59.1-143.5 -4.9 29.2 26.2 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.0 2,-0.2 7,-0.3 0.603 116.9 89.3 -76.6 -3.8 -3.1 28.6 22.9 106 106 A N G < + 0 0 50 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.714 67.8 81.4 -61.8 -17.1 -0.3 30.9 24.0 107 107 A A G < S+ 0 0 55 -3,-1.5 2,-1.0 1,-0.2 -1,-0.3 0.817 84.3 66.2 -52.7 -35.7 1.2 27.7 25.4 108 108 A W S X> S- 0 0 11 -3,-2.0 4,-2.1 1,-0.2 3,-0.8 -0.822 75.3-164.1 -88.6 101.7 2.3 27.2 21.9 109 109 A V H 3> S+ 0 0 81 -2,-1.0 4,-2.6 1,-0.3 5,-0.2 0.898 89.2 55.7 -55.8 -40.3 4.8 29.9 21.3 110 110 A A H 3> S+ 0 0 21 1,-0.2 4,-2.0 2,-0.2 5,-0.4 0.827 104.8 53.1 -62.6 -35.1 4.6 29.4 17.5 111 111 A W H <>>S+ 0 0 12 -3,-0.8 5,-2.9 -6,-0.3 4,-2.4 0.948 111.2 45.9 -61.2 -50.2 0.8 30.0 17.7 112 112 A R H <5S+ 0 0 114 -4,-2.1 -2,-0.2 -7,-0.3 -1,-0.2 0.925 120.1 40.1 -56.8 -44.7 1.4 33.2 19.5 113 113 A N H <5S+ 0 0 103 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.740 132.6 17.8 -80.0 -24.0 4.1 34.3 17.1 114 114 A R H <5S+ 0 0 137 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.2 0.602 131.6 28.1-127.0 -15.4 2.6 33.1 13.8 115 115 A b T ><5S+ 0 0 0 -4,-2.4 3,-2.4 -5,-0.4 -3,-0.2 0.716 85.2 101.4-116.5 -45.7 -1.1 32.4 14.1 116 116 A K T 3 + 0 0 100 1,-0.2 3,-1.6 -2,-0.1 4,-0.2 -0.479 55.1 168.8 -77.7 75.4 -6.7 35.2 9.3 120 120 A V G > + 0 0 17 -2,-2.3 3,-1.8 1,-0.3 4,-0.3 0.739 62.9 75.8 -68.9 -19.1 -6.6 31.7 10.6 121 121 A Q G >> S+ 0 0 89 1,-0.3 3,-1.7 -3,-0.2 4,-0.9 0.807 79.5 74.7 -62.6 -21.8 -9.8 30.7 8.7 122 122 A A G <4 S+ 0 0 38 -3,-1.6 3,-0.4 1,-0.3 -1,-0.3 0.826 85.8 64.2 -55.8 -31.6 -7.5 30.6 5.6 123 123 A W G <4 S+ 0 0 54 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.732 113.0 31.3 -70.5 -18.2 -6.2 27.3 7.0 124 124 A I T X4 S+ 0 0 34 -3,-1.7 3,-1.9 -4,-0.3 -1,-0.2 0.361 88.2 129.6-115.7 4.6 -9.6 25.6 6.7 125 125 A R T 3< S+ 0 0 116 -4,-0.9 3,-0.1 -3,-0.4 -119,-0.0 -0.310 77.6 12.4 -66.4 136.4 -10.8 27.5 3.6 126 126 A G T 3 S+ 0 0 80 1,-0.3 -1,-0.3 -120,-0.0 2,-0.2 0.199 94.8 132.6 87.7 -17.4 -12.1 25.3 0.9 127 127 A a < - 0 0 20 -3,-1.9 2,-0.8 1,-0.1 -1,-0.3 -0.474 60.6-128.3 -77.3 141.6 -12.2 22.2 3.1 128 128 A R 0 0 244 -2,-0.2 -1,-0.1 -3,-0.1 -118,-0.1 -0.772 360.0 360.0 -85.0 107.5 -15.2 19.9 3.2 129 129 A L 0 0 84 -2,-0.8 -119,-0.1 -5,-0.0 -3,-0.0 -0.890 360.0 360.0-132.2 360.0 -15.8 19.8 7.0