==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 02-MAR-99 2CDS . COMPND 2 MOLECULE: PROTEIN (LYSOZYME (E.C.3.2.1.17)); . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR G.J.KLEYWEGT,C.DIVNE . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6739.0 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 . 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,-2.7 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 134.2 -2.4 68.6 -9.8 2 2 A V B -A 39 0A 99 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.890 360.0-147.5-102.2 108.7 -2.4 65.3 -11.6 3 3 A F - 0 0 14 35,-2.5 2,-0.2 -2,-0.7 3,-0.0 -0.322 8.9-124.2 -74.1 155.8 1.2 64.0 -11.7 4 4 A G > - 0 0 34 1,-0.1 4,-2.5 -2,-0.1 5,-0.3 -0.623 32.3-108.8 -91.3 158.7 2.7 61.9 -14.5 5 5 A R H > S+ 0 0 86 -2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.954 117.7 35.6 -54.6 -55.9 4.2 58.6 -13.5 6 6 A a H > S+ 0 0 43 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.836 114.2 57.9 -68.3 -34.5 7.8 59.6 -13.9 7 7 A E H > S+ 0 0 90 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.925 109.8 44.4 -61.4 -44.9 7.3 63.1 -12.8 8 8 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.912 109.7 55.9 -65.7 -43.5 5.9 61.8 -9.4 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 -5,-0.3 -2,-0.2 0.918 109.3 47.1 -54.4 -46.0 8.7 59.3 -9.1 10 10 A A H X S+ 0 0 45 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.896 112.4 48.9 -64.3 -42.3 11.3 62.1 -9.4 11 11 A A H X S+ 0 0 19 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.905 112.7 47.6 -65.2 -41.7 9.5 64.3 -6.9 12 12 A M H <>S+ 0 0 1 -4,-2.9 5,-2.3 2,-0.2 6,-0.3 0.882 111.4 50.9 -66.7 -39.3 9.3 61.4 -4.4 13 13 A K H ><5S+ 0 0 82 -4,-2.3 3,-1.8 -5,-0.3 5,-0.2 0.921 108.5 51.4 -64.0 -44.2 12.9 60.5 -4.8 14 14 A R H 3<5S+ 0 0 192 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.821 107.2 54.7 -62.3 -31.3 14.0 64.1 -4.3 15 15 A H T 3<5S- 0 0 32 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.294 123.1-105.1 -87.0 10.7 12.0 64.1 -1.1 16 16 A G T < 5S+ 0 0 35 -3,-1.8 -3,-0.2 -5,-0.1 -2,-0.1 0.684 81.8 125.6 79.1 22.2 13.8 61.1 0.2 17 17 A L > < + 0 0 0 -5,-2.3 3,-2.2 2,-0.1 2,-0.4 0.725 37.8 108.4 -84.8 -20.3 11.2 58.3 -0.2 18 18 A D T 3 S- 0 0 60 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.428 104.3 -10.1 -63.2 114.4 13.4 56.0 -2.3 19 19 A N T > S+ 0 0 98 4,-1.6 3,-2.2 -2,-0.4 2,-0.3 0.608 90.1 165.4 71.3 14.8 14.2 53.0 0.1 20 20 A Y B X S-B 23 0B 52 -3,-2.2 3,-1.7 3,-0.7 -1,-0.3 -0.492 78.5 -8.2 -64.7 122.2 12.8 54.9 3.0 21 21 A R T 3 S- 0 0 143 -2,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.758 134.7 -57.2 59.1 25.8 12.4 52.3 5.7 22 22 A G T < S+ 0 0 67 -3,-2.2 2,-0.7 1,-0.2 -1,-0.3 0.504 104.7 127.9 87.4 4.7 13.3 49.7 3.1 23 23 A Y B < -B 20 0B 49 -3,-1.7 -4,-1.6 -6,-0.2 -3,-0.7 -0.850 54.3-134.4-100.8 114.4 10.6 50.4 0.6 24 24 A S >> - 0 0 38 -2,-0.7 3,-1.8 -5,-0.2 4,-0.9 -0.174 27.2-104.2 -61.8 156.7 11.8 51.0 -2.9 25 25 A L H 3> S+ 0 0 3 1,-0.3 4,-2.0 2,-0.2 3,-0.4 0.834 117.8 67.0 -50.6 -38.1 10.5 54.0 -4.9 26 26 A G H 3> S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.819 96.1 55.7 -55.0 -33.3 8.4 51.6 -7.0 27 27 A N H <> S+ 0 0 20 -3,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.905 108.2 46.8 -65.9 -42.9 6.3 50.9 -3.9 28 28 A W H X S+ 0 0 0 -4,-0.9 4,-2.0 -3,-0.4 -2,-0.2 0.856 113.4 46.9 -67.9 -39.5 5.5 54.6 -3.3 29 29 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.895 112.6 51.0 -70.6 -39.6 4.5 55.3 -6.9 30 30 A b H X S+ 0 0 0 -4,-2.0 4,-2.1 -5,-0.3 -2,-0.2 0.915 110.6 48.9 -62.9 -43.2 2.4 52.2 -7.0 31 31 A A H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 5,-0.2 0.915 111.8 47.9 -62.6 -45.8 0.6 53.2 -3.8 32 32 A A H X>S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 6,-1.2 0.916 109.0 55.8 -61.6 -44.0 -0.1 56.8 -5.1 33 33 A K H X5S+ 0 0 56 -4,-2.5 4,-1.1 4,-0.2 -2,-0.2 0.936 117.3 32.9 -53.8 -51.4 -1.3 55.4 -8.4 34 34 A F H <5S+ 0 0 59 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.617 119.5 51.9 -86.0 -11.5 -4.0 53.2 -6.7 35 35 A E H <5S- 0 0 28 -4,-1.8 -2,-0.2 20,-0.2 -3,-0.2 0.880 138.2 -7.0 -87.8 -43.0 -4.7 55.5 -3.8 36 36 A S H ><5S- 0 0 12 -4,-2.7 3,-1.2 19,-0.4 -3,-0.2 0.387 86.5-114.8-134.0 -1.3 -5.4 58.7 -5.8 37 37 A N T 3< - 0 0 53 4,-3.1 3,-2.3 -2,-0.3 -1,-0.0 -0.704 25.5-109.7-106.3 158.4 -15.1 56.9 5.1 47 47 A T T 3 S+ 0 0 159 1,-0.3 -1,-0.1 -2,-0.3 4,-0.0 0.783 115.6 61.7 -56.5 -30.1 -18.1 55.3 6.9 48 48 A D T 3 S- 0 0 79 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.487 121.6-105.1 -77.6 0.6 -16.6 56.2 10.3 49 49 A G S < S+ 0 0 23 -3,-2.3 -2,-0.1 1,-0.4 -1,-0.1 0.258 84.1 118.8 98.0 -14.6 -16.8 59.9 9.3 50 50 A S - 0 0 1 -5,-0.1 -4,-3.1 19,-0.1 -1,-0.4 -0.289 52.1-141.6 -78.5 170.8 -13.1 60.4 8.7 51 51 A T E -C 45 0C 3 -6,-0.3 9,-2.1 -3,-0.1 2,-0.4 -0.980 4.6-133.1-136.5 146.9 -11.8 61.5 5.2 52 52 A D E -CD 44 59C 28 -8,-3.1 -8,-1.6 -2,-0.3 2,-0.4 -0.854 27.5-159.8-101.2 137.0 -8.7 60.5 3.2 53 53 A Y E > -CD 43 58C 25 5,-2.5 5,-2.4 -2,-0.4 3,-0.4 -0.935 31.4 -11.9-127.3 142.0 -6.7 63.3 1.6 54 54 A G T > 5S- 0 0 0 -12,-1.8 3,-1.5 -2,-0.4 30,-0.2 -0.116 97.1 -34.8 82.5-174.3 -4.2 63.7 -1.2 55 55 A I T 3 5S+ 0 0 2 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.763 142.0 35.7 -59.2 -29.1 -2.0 61.7 -3.4 56 56 A L T 3 5S- 0 0 2 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.241 107.1-124.9-110.6 12.0 -1.4 59.1 -0.6 57 57 A Q T < 5 - 0 0 12 -3,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.901 32.8-164.6 46.0 58.4 -4.9 59.4 0.8 58 58 A I E < -D 53 0C 2 -5,-2.4 -5,-2.5 -6,-0.1 2,-0.3 -0.569 17.0-120.2 -77.2 133.5 -3.9 60.2 4.4 59 59 A N E >>> -D 52 0C 32 -2,-0.3 4,-2.0 -7,-0.2 3,-0.8 -0.540 6.3-146.4 -82.4 136.3 -6.7 59.7 7.0 60 60 A S T 345S+ 0 0 0 -9,-2.1 6,-0.2 -2,-0.3 9,-0.1 0.531 88.7 76.5 -75.6 -9.7 -8.1 62.5 9.2 61 61 A R T 345S+ 0 0 120 -10,-0.2 12,-2.8 11,-0.1 -1,-0.2 0.842 120.6 1.6 -72.0 -28.2 -8.8 60.2 12.2 62 62 A W T <45S+ 0 0 101 -3,-0.8 13,-2.8 10,-0.2 -2,-0.2 0.690 131.5 42.0-126.0 -35.1 -5.1 60.1 13.1 63 63 A W T <5S+ 0 0 38 -4,-2.0 13,-1.8 11,-0.3 15,-0.3 0.763 107.7 16.2 -97.5 -28.6 -2.9 62.2 10.9 64 64 A c < - 0 0 0 -5,-0.6 2,-0.5 9,-0.3 11,-0.1 -0.941 67.9-113.0-143.2 165.6 -4.3 65.5 10.0 65 65 A N B +e 79 0D 82 13,-2.3 15,-2.3 -2,-0.3 16,-0.4 -0.891 32.2 161.6-106.5 124.7 -7.0 67.9 11.2 66 66 A D - 0 0 37 -2,-0.5 -1,-0.1 -6,-0.2 -6,-0.0 0.249 53.5-119.5-119.1 8.2 -10.1 68.7 9.0 67 67 A G S S+ 0 0 65 2,-0.1 -2,-0.1 1,-0.1 0, 0.0 0.552 98.5 72.3 67.4 9.4 -12.3 70.1 11.8 68 68 A R + 0 0 119 1,-0.1 -1,-0.1 -8,-0.1 -3,-0.0 0.096 64.9 91.7-143.0 26.8 -15.0 67.4 11.3 69 69 A T S > S- 0 0 16 -9,-0.1 3,-1.2 3,-0.1 -2,-0.1 -0.847 73.9-136.2-124.8 90.6 -13.6 64.1 12.7 70 70 A P T 3 S- 0 0 126 0, 0.0 -2,-0.0 0, 0.0 -20,-0.0 -0.156 79.1 -0.8 -49.3 130.7 -14.7 64.0 16.4 71 71 A G T 3 S+ 0 0 91 1,-0.2 2,-0.2 0, 0.0 -10,-0.0 0.837 96.6 143.4 55.7 37.8 -12.0 62.9 18.8 72 72 A S < - 0 0 32 -3,-1.2 -10,-0.2 -12,-0.0 2,-0.2 -0.611 45.1-122.0-102.1 165.7 -9.4 62.3 16.2 73 73 A R - 0 0 149 -12,-2.8 -9,-0.3 -2,-0.2 3,-0.1 -0.640 2.9-149.0-105.0 165.2 -5.7 63.0 16.4 74 74 A N > + 0 0 51 -2,-0.2 3,-1.8 -11,-0.1 -11,-0.3 -0.531 30.0 161.3-130.9 63.4 -3.4 65.2 14.3 75 75 A L T 3 S+ 0 0 70 -13,-2.8 -12,-0.2 1,-0.3 -11,-0.1 0.749 76.4 49.3 -57.9 -30.3 -0.2 63.3 14.5 76 76 A d T 3 S- 0 0 10 -13,-1.8 -1,-0.3 2,-0.2 -12,-0.1 0.504 104.9-133.5 -88.7 -2.5 1.3 65.0 11.5 77 77 A N < + 0 0 123 -3,-1.8 -13,-0.1 1,-0.2 -2,-0.1 0.926 63.9 108.5 50.7 58.5 0.4 68.4 13.0 78 78 A I S S- 0 0 37 -15,-0.3 -13,-2.3 16,-0.0 2,-0.2 -0.993 75.8-100.0-156.6 154.2 -1.2 69.9 9.8 79 79 A P B > -e 65 0D 70 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.595 37.1-123.8 -76.0 141.1 -4.5 70.8 8.4 80 80 A c G > S+ 0 0 1 -15,-2.3 3,-1.7 1,-0.3 -14,-0.1 0.798 108.0 68.8 -55.4 -29.3 -5.7 68.1 6.0 81 81 A S G > S+ 0 0 82 -16,-0.4 3,-1.7 1,-0.3 -1,-0.3 0.763 85.8 67.5 -61.8 -26.1 -6.0 70.7 3.2 82 82 A A G X S+ 0 0 33 -3,-1.9 3,-0.9 1,-0.3 -1,-0.3 0.760 92.1 63.4 -65.4 -22.1 -2.2 71.0 3.2 83 83 A L G < S+ 0 0 2 -3,-1.7 -28,-0.5 -4,-0.4 -1,-0.3 0.474 94.1 60.3 -80.4 -3.5 -2.2 67.5 1.8 84 84 A L G < S+ 0 0 43 -3,-1.7 -1,-0.2 -30,-0.2 -2,-0.2 0.409 79.2 119.1-103.0 -1.2 -4.0 68.5 -1.3 85 85 A S S < S- 0 0 54 -3,-0.9 6,-0.1 -4,-0.2 -3,-0.0 -0.163 74.8-123.1 -62.8 157.4 -1.4 71.0 -2.5 86 86 A S S S+ 0 0 72 2,-0.0 2,-0.7 -45,-0.0 -1,-0.1 0.669 101.3 80.1 -74.9 -15.8 0.4 70.5 -5.8 87 87 A D S > S- 0 0 89 1,-0.1 3,-0.5 -5,-0.1 4,-0.3 -0.840 72.1-160.6 -90.8 114.3 3.6 70.6 -3.6 88 88 A I T 3> + 0 0 6 -2,-0.7 4,-2.9 1,-0.2 5,-0.2 0.482 61.6 104.8 -78.5 -0.4 3.8 67.0 -2.2 89 89 A T H 3> S+ 0 0 46 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.885 80.9 45.8 -46.6 -51.7 6.2 68.0 0.7 90 90 A A H <> S+ 0 0 27 -3,-0.5 4,-2.2 -8,-0.3 -1,-0.2 0.918 113.7 49.6 -61.1 -43.8 3.5 67.8 3.4 91 91 A S H > S+ 0 0 5 -4,-0.3 4,-2.5 -9,-0.3 -1,-0.2 0.934 113.3 47.3 -60.9 -44.8 2.1 64.5 2.1 92 92 A V H X S+ 0 0 2 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.935 110.9 49.7 -63.0 -47.9 5.6 63.0 2.0 93 93 A N H X S+ 0 0 82 -4,-2.9 4,-1.0 -5,-0.2 -1,-0.2 0.891 114.8 44.9 -59.3 -40.0 6.6 64.2 5.4 94 94 A d H X S+ 0 0 3 -4,-2.2 4,-2.3 -5,-0.2 3,-0.4 0.893 109.1 55.6 -71.3 -39.9 3.5 62.8 6.9 95 95 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.880 103.1 57.4 -59.1 -38.5 3.8 59.5 4.9 96 96 A K H X S+ 0 0 45 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.855 107.7 46.5 -61.7 -36.1 7.3 59.1 6.5 97 97 A K H < S+ 0 0 104 -4,-1.0 4,-0.4 -3,-0.4 -1,-0.2 0.902 113.0 50.3 -72.8 -40.2 5.7 59.2 10.0 98 98 A I H >< S+ 0 0 7 -4,-2.3 3,-1.6 1,-0.2 6,-0.2 0.952 111.1 46.0 -62.2 -51.1 3.0 56.8 9.0 99 99 A V H 3< S+ 0 0 5 -4,-3.0 5,-0.3 1,-0.3 -1,-0.2 0.691 103.2 65.0 -68.1 -17.7 5.3 54.2 7.5 100 100 A S T 3< S+ 0 0 49 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.589 84.3 98.1 -78.8 -10.7 7.7 54.4 10.5 101 101 A D S X S- 0 0 92 -3,-1.6 3,-2.7 -4,-0.4 6,-0.1 -0.487 100.3 -92.8 -76.3 149.3 4.8 53.0 12.6 102 102 A G T 3 S+ 0 0 78 1,-0.3 -1,-0.1 -2,-0.1 -3,-0.1 0.606 120.9 54.8 -34.8 -28.9 4.9 49.3 13.3 103 103 A N T > S- 0 0 114 -5,-0.2 3,-1.7 1,-0.2 -1,-0.3 0.466 84.0-165.0 -93.7 -0.4 2.8 48.3 10.3 104 104 A G G X - 0 0 8 -3,-2.7 3,-1.4 -5,-0.3 -1,-0.2 -0.153 65.1 -14.7 55.1-144.5 4.8 50.0 7.5 105 105 A M G > S+ 0 0 0 1,-0.3 3,-1.9 2,-0.2 7,-0.3 0.508 115.7 87.9 -71.4 -4.1 3.1 50.4 4.1 106 106 A N G < S+ 0 0 45 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.630 70.9 80.9 -67.9 -9.7 0.4 47.9 5.1 107 107 A A G < S+ 0 0 56 -3,-1.4 2,-0.7 -4,-0.1 -1,-0.3 0.743 81.4 70.8 -65.3 -23.9 -1.2 51.1 6.4 108 108 A W S <> S- 0 0 10 -3,-1.9 4,-2.3 1,-0.2 3,-0.3 -0.862 71.2-159.3 -99.9 111.4 -2.3 51.8 2.8 109 109 A V H > S+ 0 0 80 -2,-0.7 4,-2.5 1,-0.2 5,-0.2 0.855 92.2 54.3 -56.6 -38.6 -5.1 49.4 1.7 110 110 A A H > S+ 0 0 11 2,-0.2 4,-2.2 1,-0.2 5,-0.4 0.889 109.2 48.3 -64.9 -38.3 -4.3 50.1 -2.0 111 111 A W H >>S+ 0 0 12 -3,-0.3 5,-3.5 3,-0.2 4,-2.1 0.936 112.8 47.6 -66.1 -46.8 -0.7 49.2 -1.5 112 112 A R H <5S+ 0 0 98 -4,-2.3 -2,-0.2 -7,-0.3 -1,-0.2 0.911 122.3 34.1 -61.6 -43.3 -1.5 46.0 0.4 113 113 A N H <5S+ 0 0 121 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.690 133.6 22.2 -89.4 -18.4 -4.1 44.8 -2.1 114 114 A R H <5S+ 0 0 142 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 0.546 130.5 27.5-127.1 -8.7 -2.6 46.1 -5.4 115 115 A b T ><5S+ 0 0 0 -4,-2.1 3,-2.2 -5,-0.4 5,-0.2 0.727 86.6 98.5-118.8 -47.1 1.1 46.6 -4.9 116 116 A K T 3 + 0 0 82 -2,-0.2 3,-1.7 1,-0.2 4,-0.2 -0.528 53.6 171.6 -81.3 76.1 6.7 43.8 -9.7 120 120 A V G > + 0 0 16 -2,-2.1 3,-1.9 1,-0.3 -1,-0.2 0.724 65.7 73.0 -59.6 -24.4 6.6 47.3 -8.2 121 121 A Q G >> S+ 0 0 122 1,-0.3 3,-2.3 2,-0.2 4,-0.9 0.794 79.1 75.7 -61.9 -27.1 9.7 48.3 -10.1 122 122 A A G <4 S+ 0 0 42 -3,-1.7 3,-0.3 1,-0.3 -1,-0.3 0.786 84.7 68.1 -55.0 -24.2 7.6 48.4 -13.3 123 123 A W G <4 S+ 0 0 59 -3,-1.9 -1,-0.3 -4,-0.2 -2,-0.2 0.667 108.1 32.3 -72.1 -16.7 6.3 51.6 -11.9 124 124 A I T X4 S+ 0 0 41 -3,-2.3 3,-1.6 -4,-0.2 -1,-0.2 0.390 87.2 121.2-119.7 1.7 9.5 53.5 -12.3 125 125 A R T 3< S+ 0 0 136 -4,-0.9 3,-0.1 -3,-0.3 -119,-0.0 -0.399 75.8 25.5 -66.7 142.4 11.0 51.8 -15.4 126 126 A G T 3 S+ 0 0 83 1,-0.3 -1,-0.2 -2,-0.1 2,-0.2 0.295 96.9 123.5 87.7 -9.1 11.6 54.2 -18.3 127 127 A a < - 0 0 24 -3,-1.6 2,-0.9 -122,-0.0 -1,-0.3 -0.596 65.3-126.3 -89.9 148.1 12.0 57.1 -16.0 128 128 A R 0 0 242 -2,-0.2 -3,-0.0 -3,-0.1 -1,-0.0 -0.807 360.0 360.0 -93.4 103.5 15.0 59.4 -15.8 129 129 A L 0 0 97 -2,-0.9 -119,-0.1 -5,-0.1 -123,-0.0 -0.833 360.0 360.0-129.9 360.0 16.0 59.3 -12.1