==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 15-OCT-09 3A92 . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR S.ABE,T.KOSHIYAMA,T.OHKI,T.HIKAGE,Y.WATANABE,T.UENO . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6539.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 89 69.0 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 . 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 86 0, 0.0 39,-3.2 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 134.0 -1.8 10.1 18.9 2 2 A V B -A 39 0A 101 37,-0.3 37,-0.2 38,-0.1 2,-0.1 -0.927 360.0-148.2-101.3 110.3 -1.8 13.5 20.7 3 3 A F - 0 0 12 35,-2.7 2,-0.2 -2,-0.7 3,-0.0 -0.457 11.0-119.9 -75.8 149.4 1.7 14.7 20.8 4 4 A G > - 0 0 36 -2,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.547 33.2-110.0 -74.5 155.5 3.2 16.8 23.6 5 5 A R H > S+ 0 0 88 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.951 118.2 36.9 -52.9 -58.3 4.5 20.2 22.4 6 6 A a H > S+ 0 0 43 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.837 114.1 58.2 -67.9 -31.4 8.2 19.4 22.8 7 7 A E H > S+ 0 0 89 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.921 109.6 43.9 -61.7 -45.3 7.7 15.8 21.7 8 8 A L H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.901 110.2 55.3 -67.4 -41.0 6.3 17.0 18.4 9 9 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.925 109.9 47.3 -55.7 -45.2 9.0 19.6 18.0 10 10 A A H X S+ 0 0 44 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.889 112.7 47.8 -64.6 -42.5 11.6 16.8 18.3 11 11 A A H X S+ 0 0 12 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.903 112.0 49.7 -65.3 -40.8 9.9 14.6 15.8 12 12 A M H <>S+ 0 0 0 -4,-2.9 5,-2.4 2,-0.2 6,-0.3 0.905 111.5 49.7 -63.7 -40.8 9.5 17.4 13.3 13 13 A K H ><5S+ 0 0 78 -4,-2.3 3,-1.9 -5,-0.2 -2,-0.2 0.933 108.7 50.8 -63.9 -46.6 13.2 18.3 13.7 14 14 A R H 3<5S+ 0 0 191 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.853 108.8 53.6 -60.2 -32.7 14.3 14.7 13.2 15 15 A H T 3<5S- 0 0 30 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.301 123.0-105.3 -88.3 6.7 12.2 14.6 10.0 16 16 A G T < 5S+ 0 0 35 -3,-1.9 -3,-0.2 -5,-0.1 -2,-0.1 0.679 81.7 124.8 87.2 21.4 13.9 17.7 8.7 17 17 A L > < + 0 0 0 -5,-2.4 3,-2.1 2,-0.1 2,-0.4 0.690 37.2 108.2 -84.1 -20.9 11.3 20.5 9.1 18 18 A D T 3 S- 0 0 62 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.463 105.8 -9.0 -62.9 114.3 13.5 22.9 11.2 19 19 A N T > S+ 0 0 96 4,-1.6 3,-2.3 -2,-0.4 -1,-0.3 0.580 90.1 162.7 67.5 17.5 14.2 25.7 8.7 20 20 A Y B X S-B 23 0B 72 -3,-2.1 3,-1.9 3,-0.6 -1,-0.2 -0.496 80.5 -3.0 -66.2 128.9 12.7 23.8 5.8 21 21 A R T 3 S- 0 0 160 1,-0.3 -1,-0.3 -2,-0.2 3,-0.1 0.743 135.9 -61.5 51.1 26.8 12.0 26.4 3.0 22 22 A G T < S+ 0 0 57 -3,-2.3 2,-0.7 1,-0.2 -1,-0.3 0.496 103.0 132.9 85.7 6.3 13.2 28.9 5.6 23 23 A Y B < -B 20 0B 47 -3,-1.9 -4,-1.6 -6,-0.1 -3,-0.6 -0.811 52.1-134.0 -97.8 111.7 10.6 28.2 8.2 24 24 A S >> - 0 0 41 -2,-0.7 3,-1.6 -5,-0.2 4,-1.0 -0.134 27.6-102.3 -58.7 157.6 11.9 27.8 11.7 25 25 A L H 3> S+ 0 0 1 1,-0.3 4,-2.3 2,-0.2 3,-0.4 0.828 118.9 62.2 -51.8 -40.7 10.7 24.9 13.9 26 26 A G H 3> S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.811 98.2 57.3 -56.3 -34.5 8.4 27.1 16.0 27 27 A N H <> S+ 0 0 20 -3,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.911 109.1 45.5 -61.5 -43.4 6.4 28.0 12.8 28 28 A W H X S+ 0 0 0 -4,-1.0 4,-2.2 -3,-0.4 -2,-0.2 0.887 114.1 47.5 -67.9 -42.9 5.7 24.3 12.2 29 29 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.916 112.4 49.5 -64.2 -44.8 4.8 23.6 15.9 30 30 A b H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 5,-0.2 0.915 110.5 51.1 -60.3 -43.7 2.5 26.7 16.0 31 31 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.936 111.1 47.3 -61.4 -44.0 0.8 25.5 12.7 32 32 A A H X>S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 6,-1.3 0.872 107.6 57.9 -66.3 -36.8 0.2 22.1 14.2 33 33 A K H X5S+ 0 0 63 -4,-2.4 4,-1.5 4,-0.2 -1,-0.2 0.949 115.5 33.5 -56.7 -49.9 -1.2 23.5 17.4 34 34 A F H <5S+ 0 0 60 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.740 120.1 50.3 -85.7 -21.3 -3.9 25.5 15.7 35 35 A E H <5S- 0 0 35 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.917 138.1 -6.6 -74.9 -44.9 -4.6 23.0 12.9 36 36 A S H ><5S- 0 0 11 -4,-2.5 3,-1.4 19,-0.4 -3,-0.2 0.406 83.0-115.9-134.3 -3.4 -4.9 19.9 15.0 37 37 A N T 3< - 0 0 50 4,-3.2 3,-1.8 -2,-0.3 -1,-0.0 -0.560 24.6-110.3 -91.7 160.8 -14.5 21.5 4.2 47 47 A T T 3 S+ 0 0 160 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.836 116.8 58.4 -58.6 -34.3 -17.4 23.3 2.5 48 48 A D T 3 S- 0 0 86 1,-0.1 -1,-0.3 21,-0.0 3,-0.1 0.438 122.8-102.5 -78.7 -0.2 -16.3 22.1 -0.9 49 49 A G S < S+ 0 0 22 -3,-1.8 -2,-0.1 1,-0.4 -1,-0.1 0.270 85.5 121.5 96.7 -10.5 -16.6 18.4 0.2 50 50 A S - 0 0 0 19,-0.1 -4,-3.2 -5,-0.1 -1,-0.4 -0.311 53.0-138.5 -74.6 169.1 -12.9 17.9 0.6 51 51 A T E -C 45 0C 3 -6,-0.2 9,-2.3 -3,-0.1 2,-0.4 -0.982 1.3-136.8-133.8 145.4 -11.5 16.9 4.0 52 52 A D E -CD 44 59C 28 -8,-2.9 -8,-1.8 -2,-0.3 2,-0.4 -0.855 26.4-160.3-101.9 138.2 -8.4 18.0 6.0 53 53 A Y E > -CD 43 58C 25 5,-2.2 5,-2.2 -2,-0.4 3,-0.4 -0.963 31.5 -16.2-129.3 133.2 -6.3 15.2 7.7 54 54 A G T > 5S- 0 0 0 -12,-2.7 3,-1.5 -2,-0.4 30,-0.2 -0.183 98.7 -28.2 89.4-169.2 -3.8 14.9 10.5 55 55 A I T 3 5S+ 0 0 1 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.774 141.6 34.1 -60.4 -29.8 -1.5 17.1 12.5 56 56 A L T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.211 106.3-123.3-112.1 14.9 -1.2 19.6 9.7 57 57 A Q T < 5 - 0 0 11 -3,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.899 34.7-165.1 49.3 54.0 -4.7 19.3 8.3 58 58 A I E < -D 53 0C 2 -5,-2.2 -5,-2.2 -6,-0.1 2,-0.3 -0.541 16.1-122.5 -76.7 133.4 -3.6 18.4 4.8 59 59 A N E >>> -D 52 0C 28 -2,-0.3 4,-2.2 -7,-0.2 3,-0.9 -0.574 7.5-145.4 -92.6 138.2 -6.5 18.6 2.3 60 60 A S T 345S+ 0 0 0 -9,-2.3 6,-0.2 -2,-0.3 13,-0.2 0.604 89.9 80.8 -70.6 -12.9 -7.8 15.9 -0.0 61 61 A R T 345S- 0 0 58 -10,-0.2 12,-1.9 11,-0.2 -1,-0.2 0.853 120.2 -5.1 -62.0 -36.2 -8.5 18.5 -2.8 62 62 A W T <45S+ 0 0 131 -3,-0.9 13,-2.9 10,-0.2 -2,-0.2 0.650 131.6 45.5-124.6 -31.8 -4.9 18.4 -3.9 63 63 A W T <5S+ 0 0 25 -4,-2.2 13,-1.9 11,-0.3 15,-0.4 0.738 103.3 20.4-108.0 -26.5 -2.7 16.3 -1.7 64 64 A c < - 0 0 0 -5,-0.5 2,-0.6 9,-0.4 -1,-0.1 -0.954 68.0-110.8-143.3 161.0 -4.0 12.9 -0.7 65 65 A N B +e 79 0D 81 13,-2.7 15,-2.7 -2,-0.3 16,-0.4 -0.854 36.3 156.1 -97.8 123.1 -6.6 10.4 -1.9 66 66 A D - 0 0 36 -2,-0.6 -1,-0.1 13,-0.2 8,-0.0 0.350 53.1-123.5-119.3 3.6 -9.7 9.7 0.2 67 67 A G S S+ 0 0 69 2,-0.1 -2,-0.1 -7,-0.1 0, 0.0 0.419 96.4 73.1 74.1 -0.2 -11.9 8.4 -2.6 68 68 A R + 0 0 120 1,-0.1 -1,-0.1 2,-0.0 -3,-0.0 0.066 65.0 90.8-136.4 28.2 -14.6 11.0 -1.9 69 69 A T S > S- 0 0 7 -9,-0.1 3,-1.8 -19,-0.0 -2,-0.1 -0.808 70.3-142.0-125.8 87.7 -13.3 14.3 -3.2 70 70 A P T 3 S+ 0 0 108 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.194 79.0 8.0 -57.1 136.2 -14.4 14.6 -6.9 71 71 A G T 3 S+ 0 0 85 1,-0.2 -10,-0.0 0, 0.0 0, 0.0 0.431 99.9 135.3 79.9 0.2 -12.0 16.2 -9.4 72 72 A S < - 0 0 30 -3,-1.8 -1,-0.2 1,-0.1 -10,-0.2 -0.170 46.0-133.8 -78.9 169.8 -9.3 16.3 -6.8 73 73 A R - 0 0 142 -12,-1.9 -9,-0.4 -13,-0.2 -1,-0.1 -0.633 6.3-144.3-113.1 177.0 -5.6 15.3 -7.0 74 74 A N > + 0 0 49 -2,-0.2 3,-1.7 -11,-0.2 -11,-0.3 -0.551 30.6 161.8-139.9 64.9 -3.3 13.2 -4.9 75 75 A L T 3 S+ 0 0 42 -13,-2.9 -12,-0.2 1,-0.3 -11,-0.1 0.742 75.5 52.7 -67.9 -23.8 0.0 15.1 -5.3 76 76 A d T 3 S- 0 0 23 -13,-1.9 -1,-0.3 2,-0.2 -12,-0.1 0.464 104.7-132.0 -87.3 -2.4 1.6 13.5 -2.2 77 77 A N < + 0 0 130 -3,-1.7 -13,-0.1 1,-0.2 -2,-0.1 0.896 64.9 114.2 53.7 50.7 0.7 10.0 -3.7 78 78 A I S S- 0 0 30 -15,-0.4 -13,-2.7 12,-0.0 2,-0.2 -0.991 73.4-104.9-145.1 150.0 -0.8 8.7 -0.4 79 79 A P B > -e 65 0D 73 0, 0.0 3,-1.8 0, 0.0 4,-0.4 -0.568 36.7-123.3 -68.7 142.1 -4.1 7.7 1.0 80 80 A c G > S+ 0 0 1 -15,-2.7 3,-1.8 1,-0.3 -14,-0.1 0.825 109.3 68.7 -57.3 -30.3 -5.4 10.4 3.3 81 81 A S G > S+ 0 0 83 -16,-0.4 3,-2.0 1,-0.3 -1,-0.3 0.782 85.3 68.8 -59.6 -26.0 -5.5 7.9 6.1 82 82 A A G X S+ 0 0 30 -3,-1.8 3,-0.9 1,-0.3 9,-0.3 0.768 90.8 63.0 -63.5 -24.1 -1.7 7.8 6.1 83 83 A L G < S+ 0 0 1 -3,-1.8 -28,-0.5 -4,-0.4 -1,-0.3 0.436 95.4 59.8 -78.4 -2.9 -1.9 11.3 7.5 84 84 A L G < S+ 0 0 42 -3,-2.0 -1,-0.2 -30,-0.2 -2,-0.2 0.424 79.8 121.7-103.4 -1.6 -3.6 10.1 10.6 85 85 A S S < S- 0 0 54 -3,-0.9 6,-0.1 -4,-0.2 -3,-0.0 -0.158 72.9-125.3 -61.7 151.4 -0.8 7.7 11.7 86 86 A S S S+ 0 0 76 2,-0.0 2,-0.6 -45,-0.0 -1,-0.1 0.775 102.5 76.6 -65.0 -25.6 1.0 8.0 15.1 87 87 A D S S- 0 0 89 1,-0.1 3,-0.5 -5,-0.1 4,-0.3 -0.796 74.1-158.5 -86.2 119.8 4.1 8.1 12.8 88 88 A I > + 0 0 5 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.420 62.2 105.7 -85.4 2.9 4.3 11.7 11.3 89 89 A T H > S+ 0 0 47 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.903 80.8 46.2 -48.0 -53.3 6.5 10.7 8.4 90 90 A A H > S+ 0 0 25 -3,-0.5 4,-2.2 -8,-0.3 -1,-0.2 0.918 114.2 48.3 -62.6 -41.2 3.7 10.9 5.7 91 91 A S H > S+ 0 0 4 -9,-0.3 4,-2.6 -4,-0.3 -1,-0.2 0.909 114.0 46.9 -63.8 -42.6 2.5 14.2 7.1 92 92 A V H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.949 112.2 48.8 -64.7 -48.0 6.0 15.7 7.2 93 93 A N H X S+ 0 0 90 -4,-2.9 4,-1.1 -5,-0.2 -1,-0.2 0.883 115.3 44.6 -60.7 -39.8 6.9 14.5 3.7 94 94 A d H X S+ 0 0 4 -4,-2.2 4,-2.5 -5,-0.3 3,-0.3 0.908 109.1 56.3 -71.0 -42.0 3.6 15.9 2.2 95 95 A A H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.859 102.2 57.4 -54.7 -37.8 4.0 19.2 4.2 96 96 A K H X S+ 0 0 42 -4,-2.1 4,-0.8 1,-0.2 -1,-0.2 0.902 108.3 46.1 -61.0 -40.3 7.4 19.6 2.5 97 97 A K H >< S+ 0 0 98 -4,-1.1 3,-0.6 -3,-0.3 4,-0.3 0.931 113.4 49.4 -66.7 -44.2 5.7 19.4 -0.9 98 98 A I H >< S+ 0 0 8 -4,-2.5 3,-1.8 1,-0.2 5,-0.3 0.937 109.7 49.3 -60.3 -50.1 2.9 21.9 0.2 99 99 A V H 3< S+ 0 0 3 -4,-2.8 5,-0.4 1,-0.3 3,-0.3 0.664 109.8 53.6 -68.0 -14.5 5.3 24.5 1.6 100 100 A S T << S+ 0 0 33 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.423 82.1 94.8 -92.9 -1.5 7.3 24.3 -1.6 101 101 A D S < S- 0 0 116 -3,-1.8 -1,-0.2 -4,-0.3 -2,-0.1 0.604 107.9 -89.7 -74.4 -15.6 4.3 25.0 -3.9 102 102 A G S S+ 0 0 74 -3,-0.3 -3,-0.1 -4,-0.2 -1,-0.1 0.003 114.9 67.2 137.4 -31.1 4.8 28.7 -4.1 103 103 A N S > S- 0 0 102 -5,-0.3 3,-1.8 1,-0.3 4,-0.1 0.254 82.8-148.4-104.9 10.5 3.0 30.4 -1.2 104 104 A G G > - 0 0 11 -5,-0.4 3,-1.4 1,-0.3 -1,-0.3 -0.232 68.9 -17.2 56.2-142.5 5.2 29.0 1.6 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.2 2,-0.2 7,-0.3 0.540 116.1 90.5 -76.3 -3.8 3.3 28.4 4.9 106 106 A N G < + 0 0 33 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.682 68.0 81.2 -64.0 -14.7 0.4 30.7 3.8 107 107 A A G < S+ 0 0 56 -3,-1.4 2,-0.9 1,-0.2 -1,-0.3 0.797 83.8 66.1 -54.9 -31.2 -1.0 27.4 2.4 108 108 A W S X> S- 0 0 10 -3,-2.2 4,-2.1 1,-0.2 3,-0.6 -0.853 74.5-163.7 -95.4 105.6 -2.1 26.8 6.0 109 109 A V H 3> S+ 0 0 78 -2,-0.9 4,-2.7 1,-0.3 5,-0.2 0.871 89.5 55.1 -58.7 -38.4 -4.7 29.5 6.6 110 110 A A H 3> S+ 0 0 12 2,-0.2 4,-1.9 1,-0.2 5,-0.4 0.824 106.0 52.1 -64.3 -33.8 -4.4 29.0 10.4 111 111 A W H <>>S+ 0 0 11 -3,-0.6 5,-3.2 -6,-0.2 4,-2.3 0.948 111.7 46.0 -64.9 -47.1 -0.6 29.6 10.2 112 112 A R H <5S+ 0 0 116 -4,-2.1 -2,-0.2 -7,-0.3 -1,-0.2 0.924 120.4 39.2 -59.5 -44.4 -1.2 32.9 8.4 113 113 A N H <5S+ 0 0 105 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.735 132.9 18.2 -80.6 -23.0 -3.9 34.0 10.8 114 114 A R H <5S+ 0 0 141 -4,-1.9 -3,-0.2 -5,-0.2 -2,-0.2 0.595 131.7 28.1-127.1 -16.6 -2.5 32.8 14.1 115 115 A b T ><5S+ 0 0 0 -4,-2.3 3,-2.4 -5,-0.4 -3,-0.2 0.745 84.7 103.3-115.9 -44.8 1.3 32.2 13.7 116 116 A K T 3 + 0 0 116 1,-0.2 3,-1.5 -3,-0.1 4,-0.2 -0.507 56.8 168.5 -78.3 76.0 6.9 35.1 18.5 120 120 A V G > + 0 0 17 -2,-2.2 3,-1.7 1,-0.3 4,-0.3 0.703 62.4 76.3 -67.8 -20.6 6.8 31.5 17.1 121 121 A Q G >> S+ 0 0 104 1,-0.3 3,-2.0 2,-0.2 4,-0.6 0.803 79.5 74.8 -61.1 -24.6 10.0 30.6 19.0 122 122 A A G X4 S+ 0 0 49 -3,-1.5 3,-0.9 1,-0.3 -1,-0.3 0.820 84.1 66.7 -54.5 -31.4 7.8 30.4 22.1 123 123 A W G <4 S+ 0 0 55 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.698 109.2 34.3 -67.4 -18.2 6.5 27.1 20.8 124 124 A I G X4 S+ 0 0 36 -3,-2.0 3,-1.6 -4,-0.3 -1,-0.2 0.326 86.2 131.5-117.4 6.3 9.9 25.4 21.2 125 125 A R T << S+ 0 0 38 -3,-0.9 3,-0.1 -4,-0.6 -119,-0.1 -0.346 77.1 12.8 -62.0 133.2 11.0 27.2 24.3 126 126 A G T 3 S+ 0 0 85 1,-0.3 -1,-0.2 -2,-0.1 2,-0.2 0.215 95.1 131.7 87.0 -15.7 12.2 24.8 27.0 127 127 A a < - 0 0 18 -3,-1.6 2,-0.8 1,-0.1 -1,-0.3 -0.495 63.9-123.3 -77.1 136.1 12.4 21.8 24.6 128 128 A R 0 0 243 -2,-0.2 -1,-0.1 -3,-0.1 -118,-0.0 -0.710 360.0 360.0 -71.4 111.2 15.5 19.6 24.5 129 129 A L 0 0 93 -2,-0.8 -119,-0.1 -116,-0.0 -3,-0.0 -0.950 360.0 360.0-130.9 360.0 16.3 20.0 20.8