==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 19-SEP-01 1IR9 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR T.OHMURA,T.UEDA,Y.HASHIMOTO,T.IMOTO . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6519.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 90 69.8 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 . 26 20.2 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 . 6 4.7 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,-2.6 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 132.4 2.4 10.6 9.2 2 2 A V B -A 39 0A 100 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.890 360.0-148.0 -99.5 111.8 2.4 13.9 7.4 3 3 A F - 0 0 14 35,-2.9 2,-0.3 -2,-0.7 3,-0.0 -0.375 8.6-124.3 -77.3 157.4 -1.1 15.2 7.3 4 4 A G > - 0 0 34 1,-0.1 4,-2.6 -2,-0.1 5,-0.3 -0.728 33.0-107.0 -95.2 154.1 -2.6 17.3 4.5 5 5 A R H > S+ 0 0 84 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.910 117.5 36.4 -45.2 -58.5 -4.2 20.6 5.6 6 6 A a H > S+ 0 0 42 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.801 113.4 57.6 -70.9 -30.2 -7.8 19.6 5.1 7 7 A E H > S+ 0 0 92 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.933 110.0 45.1 -64.7 -42.4 -7.3 16.0 6.3 8 8 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.911 109.5 55.0 -66.8 -43.0 -5.9 17.3 9.6 9 9 A A H X S+ 0 0 0 -4,-1.9 4,-1.8 -5,-0.3 -1,-0.2 0.895 110.4 46.3 -56.6 -43.0 -8.7 19.9 10.0 10 10 A A H X S+ 0 0 42 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.868 112.1 50.0 -69.9 -39.6 -11.3 17.1 9.7 11 11 A A H X S+ 0 0 19 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.895 112.2 47.8 -65.6 -40.8 -9.5 14.8 12.1 12 12 A M H <>S+ 0 0 1 -4,-2.6 5,-2.6 2,-0.2 6,-0.3 0.860 111.1 51.1 -67.0 -37.5 -9.2 17.6 14.7 13 13 A K H ><5S+ 0 0 79 -4,-1.8 3,-2.2 -5,-0.2 -2,-0.2 0.941 108.3 51.1 -65.1 -45.9 -12.9 18.5 14.3 14 14 A R H 3<5S+ 0 0 192 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.807 107.9 55.3 -60.7 -30.2 -14.0 14.9 14.8 15 15 A H T 3<5S- 0 0 29 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.254 122.8-106.1 -89.0 11.8 -11.9 14.9 17.9 16 16 A G T < 5S+ 0 0 36 -3,-2.2 -3,-0.2 -5,-0.0 -2,-0.1 0.648 82.5 123.6 76.1 21.4 -13.7 18.0 19.3 17 17 A L > < + 0 0 0 -5,-2.6 3,-2.3 2,-0.1 2,-0.2 0.756 36.9 107.3 -84.4 -25.2 -11.1 20.7 18.8 18 18 A D T 3 S- 0 0 63 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.405 106.0 -10.0 -57.9 114.9 -13.3 23.1 16.8 19 19 A N T > S+ 0 0 95 4,-1.5 3,-2.2 -2,-0.2 -1,-0.3 0.551 88.7 162.9 67.8 16.6 -14.0 25.9 19.2 20 20 A Y B X S-B 23 0B 57 -3,-2.3 3,-1.8 3,-0.5 -1,-0.2 -0.451 80.1 -3.3 -66.5 125.2 -12.6 24.0 22.2 21 21 A R T 3 S- 0 0 144 1,-0.3 -1,-0.3 -2,-0.2 3,-0.1 0.804 135.4 -60.4 58.7 29.4 -12.1 26.7 24.9 22 22 A G T < S+ 0 0 58 -3,-2.2 2,-0.7 1,-0.2 -1,-0.3 0.538 102.9 130.8 80.0 6.8 -13.2 29.2 22.3 23 23 A Y B < -B 20 0B 47 -3,-1.8 -4,-1.5 -6,-0.2 -3,-0.5 -0.840 53.2-133.9 -99.9 115.9 -10.5 28.6 19.7 24 24 A S >> - 0 0 38 -2,-0.7 3,-1.6 -5,-0.2 4,-0.9 -0.208 26.6-105.7 -60.8 157.9 -11.8 28.1 16.2 25 25 A L H 3> S+ 0 0 2 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.800 117.5 67.3 -55.0 -34.5 -10.5 25.1 14.2 26 26 A G H 3> S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.844 97.0 55.5 -58.5 -31.5 -8.4 27.5 12.0 27 27 A N H <> S+ 0 0 21 -3,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.918 108.1 46.4 -66.3 -45.4 -6.3 28.2 15.2 28 28 A W H X S+ 0 0 0 -4,-0.9 4,-1.8 2,-0.2 -1,-0.2 0.800 113.6 48.0 -66.6 -37.1 -5.4 24.5 15.8 29 29 A V H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.905 112.5 49.7 -71.8 -40.6 -4.5 23.8 12.1 30 30 A b H X S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.2 5,-0.2 0.935 110.8 50.2 -63.9 -45.5 -2.3 27.0 12.0 31 31 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.917 110.9 47.8 -59.2 -46.3 -0.6 25.9 15.2 32 32 A A H X>S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 5,-1.3 0.900 109.4 55.1 -62.6 -41.5 0.1 22.4 13.9 33 33 A K H X5S+ 0 0 63 -4,-2.4 4,-1.1 4,-0.2 -2,-0.2 0.967 116.6 35.4 -55.3 -55.5 1.4 23.8 10.6 34 34 A F H <5S+ 0 0 62 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.714 120.3 48.6 -76.8 -18.5 4.0 26.0 12.4 35 35 A E H <5S- 0 0 31 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.942 138.5 -6.3 -84.7 -51.8 4.8 23.6 15.2 36 36 A S H ><5S- 0 0 10 -4,-2.4 3,-1.0 19,-0.5 -3,-0.2 0.430 85.9-117.2-123.0 -7.5 5.4 20.4 13.2 37 37 A N T 3< - 0 0 53 4,-3.2 3,-1.6 -2,-0.4 -1,-0.0 -0.593 25.5-110.1-100.0 164.3 15.1 22.3 24.0 47 47 A T T 3 S+ 0 0 159 1,-0.3 -1,-0.1 -2,-0.2 4,-0.0 0.803 115.6 63.4 -64.3 -27.9 18.1 23.8 25.8 48 48 A D T 3 S- 0 0 82 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.373 121.6-105.8 -78.0 7.8 16.7 22.9 29.2 49 49 A G S < S+ 0 0 23 -3,-1.6 -2,-0.1 1,-0.3 -1,-0.1 0.302 84.0 120.6 88.7 -14.2 17.0 19.2 28.1 50 50 A S - 0 0 0 19,-0.1 -4,-3.2 -5,-0.1 2,-0.3 -0.292 52.9-138.3 -76.8 172.5 13.3 18.7 27.6 51 51 A T E -C 45 0C 3 -6,-0.3 9,-2.2 -3,-0.1 2,-0.4 -0.973 3.0-135.4-136.0 144.4 11.9 17.6 24.2 52 52 A D E -CD 44 59C 29 -8,-3.1 -8,-1.7 -2,-0.3 2,-0.4 -0.896 28.0-157.5 -99.7 134.2 8.8 18.6 22.2 53 53 A Y E > -CD 43 58C 23 5,-2.3 5,-2.0 -2,-0.4 3,-0.4 -0.913 30.5 -22.1-123.2 139.7 6.8 15.8 20.6 54 54 A G T > 5S- 0 0 0 -12,-2.1 3,-1.6 -2,-0.4 30,-0.2 -0.043 97.3 -26.9 76.3-171.3 4.4 15.3 17.8 55 55 A I T 3 5S+ 0 0 3 28,-0.6 -19,-0.5 1,-0.3 -17,-0.3 0.777 141.4 33.4 -52.7 -37.2 2.0 17.3 15.7 56 56 A L T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.302 106.2-124.0-107.6 9.5 1.5 19.9 18.4 57 57 A Q T < 5 - 0 0 12 -3,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.897 34.5-166.5 49.7 54.6 5.0 19.8 19.9 58 58 A I E < -D 53 0C 0 -5,-2.0 -5,-2.3 -6,-0.1 2,-0.2 -0.536 18.3-118.0 -75.8 131.4 4.0 18.9 23.4 59 59 A N E >>> -D 52 0C 28 -2,-0.3 4,-2.0 -7,-0.2 5,-0.6 -0.461 6.0-145.3 -77.9 137.8 6.8 19.3 26.0 60 60 A S T 345S+ 0 0 0 -9,-2.2 14,-0.4 1,-0.2 6,-0.2 0.655 91.3 73.0 -73.1 -19.2 8.3 16.5 28.2 61 61 A R T 345S+ 0 0 57 11,-0.2 12,-2.3 -10,-0.2 -1,-0.2 0.881 120.5 5.5 -65.5 -31.3 8.9 18.7 31.2 62 62 A W T <45S+ 0 0 115 -3,-0.6 13,-3.3 10,-0.2 -2,-0.2 0.744 130.9 37.8-121.2 -34.1 5.2 18.9 32.0 63 63 A W T <5S+ 0 0 23 -4,-2.0 13,-2.1 11,-0.3 15,-0.4 0.750 108.0 19.8-104.0 -24.6 3.0 16.8 29.9 64 64 A c < - 0 0 0 -5,-0.6 2,-0.6 11,-0.1 10,-0.4 -0.948 67.5-114.8-146.6 158.4 4.5 13.4 29.0 65 65 A N B +e 79 0D 77 13,-2.5 15,-2.8 -2,-0.3 16,-0.4 -0.877 30.2 165.4-100.5 127.3 7.1 11.1 30.2 66 66 A D - 0 0 35 -2,-0.6 -1,-0.1 13,-0.2 -6,-0.0 0.280 51.8-120.8-115.8 5.1 10.1 10.4 27.9 67 67 A G S S+ 0 0 62 2,-0.1 -2,-0.1 -7,-0.1 -7,-0.0 0.520 99.5 71.8 67.8 8.4 12.2 8.9 30.6 68 68 A R + 0 0 113 1,-0.1 -1,-0.1 -8,-0.0 -3,-0.0 0.107 66.8 90.0-141.5 24.1 14.9 11.5 30.2 69 69 A T > - 0 0 10 -9,-0.1 3,-2.3 -19,-0.0 -2,-0.1 -0.855 68.8-141.9-124.5 92.5 13.6 14.8 31.6 70 70 A P T 3 S+ 0 0 116 0, 0.0 -2,-0.0 0, 0.0 -20,-0.0 -0.315 87.8 16.2 -54.8 129.8 14.5 15.1 35.3 71 71 A G T 3 S+ 0 0 72 1,-0.2 -10,-0.0 2,-0.0 0, 0.0 0.403 87.5 158.8 87.6 -4.9 11.7 16.7 37.2 72 72 A S < - 0 0 30 -3,-2.3 -1,-0.2 1,-0.1 -10,-0.2 -0.207 31.8-153.9 -50.3 143.2 9.2 16.1 34.4 73 73 A R - 0 0 147 -12,-2.3 -11,-0.2 -13,-0.1 -1,-0.1 0.646 9.5-149.6 -98.0 -17.5 5.6 16.1 35.7 74 74 A N > + 0 0 36 -10,-0.4 3,-1.9 -14,-0.4 -11,-0.3 0.837 25.2 171.5 45.7 51.7 3.7 13.9 33.1 75 75 A L T 3 S+ 0 0 51 -13,-3.3 -12,-0.2 1,-0.3 -11,-0.1 0.687 75.1 49.8 -62.1 -22.9 0.4 15.7 33.4 76 76 A d T 3 S- 0 0 12 -13,-2.1 -1,-0.3 2,-0.2 -12,-0.1 0.459 103.6-132.8 -95.9 -1.9 -1.2 13.8 30.5 77 77 A N < + 0 0 136 -3,-1.9 -13,-0.1 1,-0.2 -2,-0.1 0.865 65.0 110.0 52.0 52.5 -0.1 10.5 31.9 78 78 A I S S- 0 0 33 -15,-0.4 -13,-2.5 12,-0.0 2,-0.3 -0.962 75.3-102.1-149.1 154.6 1.3 9.0 28.7 79 79 A P B > -e 65 0D 72 0, 0.0 3,-2.0 0, 0.0 4,-0.4 -0.640 37.6-120.8 -77.3 139.9 4.8 8.2 27.3 80 80 A c G > S+ 0 0 1 -15,-2.8 3,-1.8 -2,-0.3 4,-0.2 0.811 108.9 70.4 -53.5 -27.4 5.9 10.9 24.9 81 81 A S G > S+ 0 0 83 -16,-0.4 3,-1.8 1,-0.3 -1,-0.3 0.799 85.9 66.5 -62.0 -27.9 6.2 8.3 22.2 82 82 A A G X S+ 0 0 32 -3,-2.0 3,-0.9 1,-0.3 -1,-0.3 0.742 91.3 64.8 -63.2 -24.0 2.4 8.0 22.1 83 83 A L G < S+ 0 0 2 -3,-1.8 -28,-0.6 -4,-0.4 -1,-0.3 0.536 93.9 60.4 -77.2 -5.3 2.4 11.6 20.8 84 84 A L G < S+ 0 0 44 -3,-1.8 -1,-0.2 -4,-0.2 -2,-0.2 0.287 78.9 120.4-105.7 6.6 4.1 10.6 17.6 85 85 A S S < S- 0 0 53 -3,-0.9 6,-0.1 2,-0.2 -3,-0.0 -0.279 72.6-124.4 -69.7 155.9 1.5 8.2 16.4 86 86 A S S S+ 0 0 73 1,-0.1 2,-0.8 2,-0.1 -1,-0.1 0.837 101.9 76.9 -69.3 -30.2 -0.4 8.5 13.1 87 87 A D S > S- 0 0 91 1,-0.1 3,-0.6 -47,-0.0 4,-0.3 -0.721 74.0-160.0 -79.9 113.0 -3.6 8.5 15.2 88 88 A I T 3> + 0 0 7 -2,-0.8 4,-2.5 1,-0.2 5,-0.2 0.371 60.0 107.3 -80.5 9.0 -3.7 12.0 16.8 89 89 A T H 3> S+ 0 0 47 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.890 81.2 44.2 -53.5 -46.9 -6.1 11.1 19.6 90 90 A A H <> S+ 0 0 27 -3,-0.6 4,-2.4 -8,-0.3 5,-0.3 0.913 113.2 51.9 -65.7 -43.9 -3.4 11.3 22.4 91 91 A S H > S+ 0 0 3 -4,-0.3 4,-2.0 -9,-0.3 -1,-0.2 0.909 112.9 45.6 -59.6 -40.6 -2.0 14.5 21.0 92 92 A V H X S+ 0 0 2 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.922 112.0 49.8 -69.4 -43.9 -5.5 16.0 21.0 93 93 A N H X S+ 0 0 75 -4,-2.7 4,-0.9 1,-0.2 -2,-0.2 0.874 114.0 45.8 -64.4 -36.1 -6.4 14.8 24.5 94 94 A d H >X S+ 0 0 1 -4,-2.4 4,-2.2 -5,-0.2 3,-0.5 0.904 109.3 55.2 -72.9 -39.4 -3.2 16.2 25.9 95 95 A A H 3X S+ 0 0 0 -4,-2.0 4,-2.9 -5,-0.3 5,-0.2 0.836 101.7 58.7 -62.3 -33.0 -3.6 19.5 24.0 96 96 A K H 3X S+ 0 0 42 -4,-1.8 4,-0.7 1,-0.2 -1,-0.2 0.873 107.7 46.3 -64.8 -34.2 -7.0 19.9 25.6 97 97 A K H << S+ 0 0 101 -4,-0.9 3,-0.3 -3,-0.5 4,-0.3 0.917 113.5 48.6 -73.0 -44.8 -5.4 19.8 29.0 98 98 A M H >< S+ 0 0 10 -4,-2.2 3,-2.2 1,-0.2 5,-0.4 0.956 110.0 49.8 -59.2 -52.6 -2.6 22.2 28.0 99 99 A V H 3< S+ 0 0 6 -4,-2.9 5,-0.5 1,-0.3 3,-0.4 0.748 109.4 53.7 -61.5 -20.2 -5.0 24.8 26.5 100 100 A S T 3< S+ 0 0 40 -4,-0.7 -1,-0.3 -3,-0.3 -2,-0.2 0.469 80.4 100.5 -91.8 0.0 -7.1 24.6 29.7 101 101 A D S < S- 0 0 104 -3,-2.2 -1,-0.2 -4,-0.3 -2,-0.1 0.413 105.5 -97.0 -67.3 -1.3 -4.0 25.4 31.8 102 102 A G S S+ 0 0 71 -3,-0.4 -1,-0.1 -4,-0.1 -3,-0.1 0.074 114.5 75.7 108.0 -25.6 -4.8 29.1 32.2 103 103 A N S > S- 0 0 107 -5,-0.4 3,-1.4 1,-0.3 4,-0.1 0.404 80.6-153.9 -98.4 0.3 -2.7 30.5 29.4 104 104 A G G > - 0 0 11 -5,-0.5 3,-1.2 1,-0.2 -1,-0.3 -0.267 64.7 -23.1 61.0-148.2 -4.9 29.4 26.5 105 105 A M G > S+ 0 0 0 1,-0.2 3,-2.2 2,-0.1 7,-0.3 0.543 117.8 90.1 -75.5 -3.2 -3.1 28.8 23.2 106 106 A N G < + 0 0 34 -3,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.703 68.5 80.6 -64.9 -15.6 -0.2 31.1 24.2 107 107 A A G < S+ 0 0 49 -3,-1.2 2,-0.7 -4,-0.1 -1,-0.3 0.714 82.7 69.7 -60.2 -25.4 1.3 27.9 25.5 108 108 A W S <> S- 0 0 5 -3,-2.2 4,-2.2 1,-0.2 3,-0.4 -0.898 73.5-159.0-101.4 110.3 2.3 27.3 21.9 109 109 A V H > S+ 0 0 77 -2,-0.7 4,-2.2 1,-0.2 5,-0.2 0.842 91.2 51.1 -56.6 -40.1 5.1 29.7 21.0 110 110 A A H >>S+ 0 0 12 2,-0.2 4,-2.3 1,-0.2 5,-0.6 0.838 108.8 52.8 -70.2 -30.2 4.5 29.4 17.2 111 111 A W H >>S+ 0 0 12 -3,-0.4 5,-3.6 -6,-0.2 4,-1.9 0.944 111.3 45.6 -66.8 -47.5 0.8 30.0 17.7 112 112 A R H <5S+ 0 0 105 -4,-2.2 -2,-0.2 -7,-0.3 -1,-0.2 0.924 122.2 37.1 -61.6 -42.4 1.4 33.2 19.6 113 113 A N H <5S+ 0 0 117 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.746 133.4 18.5 -85.0 -23.4 4.0 34.4 17.1 114 114 A R H <5S+ 0 0 141 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.589 130.9 30.9-125.0 -17.3 2.6 33.3 13.8 115 115 A b T >< + 0 0 82 -2,-0.2 3,-1.2 1,-0.2 4,-0.2 -0.499 52.7 172.8 -73.0 85.5 -6.8 35.4 9.5 120 120 A V G > + 0 0 10 -2,-2.2 3,-1.8 1,-0.2 4,-0.4 0.715 63.5 80.1 -68.8 -17.2 -6.8 31.9 10.8 121 121 A Q G >> S+ 0 0 113 1,-0.3 3,-1.5 2,-0.2 4,-0.8 0.812 78.6 70.4 -58.6 -30.6 -10.0 31.1 8.7 122 122 A A G <4 S+ 0 0 42 -3,-1.2 3,-0.4 1,-0.3 -1,-0.3 0.792 85.9 68.8 -58.1 -27.0 -7.7 30.7 5.7 123 123 A W G <4 S+ 0 0 54 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.728 109.7 31.1 -67.0 -24.9 -6.4 27.5 7.2 124 124 A I T X4 S+ 0 0 49 -3,-1.5 3,-2.2 -4,-0.4 -1,-0.2 0.418 90.5 133.2-111.1 0.9 -9.6 25.6 6.8 125 125 A R T 3< S+ 0 0 132 -4,-0.8 -3,-0.1 -3,-0.4 -119,-0.1 -0.208 75.2 12.1 -53.0 129.3 -10.6 27.5 3.7 126 126 A G T 3 S+ 0 0 79 1,-0.2 -1,-0.3 -120,-0.0 2,-0.2 0.412 95.4 133.3 82.1 -2.3 -11.8 25.2 0.9 127 127 A a < - 0 0 23 -3,-2.2 2,-1.1 1,-0.1 -1,-0.2 -0.586 59.4-128.5 -87.5 147.1 -12.1 22.1 3.1 128 128 A R 0 0 245 -2,-0.2 -1,-0.1 1,-0.1 -118,-0.0 -0.777 360.0 360.0 -90.9 97.6 -15.1 19.7 3.2 129 129 A L 0 0 94 -2,-1.1 -1,-0.1 -5,-0.1 -119,-0.1 0.484 360.0 360.0 -99.0 360.0 -15.8 19.6 6.9