==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 31-AUG-11 3TMX . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR J.KMETKO,M.A.WARKENTIN,U.ENGLICH,R.E.THORNE . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6784.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 85 65.9 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 . 9 7.0 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 . 0 0.0 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 . 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 . 1 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,-2.9 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 134.5 -2.1 -10.5 -9.8 2 2 A V B -A 39 0A 102 37,-0.2 37,-0.2 38,-0.1 2,-0.2 -0.918 360.0-148.4-104.2 113.9 -2.1 -13.9 -11.6 3 3 A F - 0 0 13 35,-2.8 2,-0.2 -2,-0.7 3,-0.0 -0.478 8.9-123.9 -81.5 150.2 1.5 -15.3 -11.7 4 4 A G > - 0 0 35 -2,-0.2 4,-2.5 1,-0.1 5,-0.3 -0.529 33.0-107.7 -78.1 159.1 3.0 -17.4 -14.4 5 5 A R H > S+ 0 0 92 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.956 117.7 36.7 -54.6 -61.4 4.5 -20.7 -13.2 6 6 A a H > S+ 0 0 43 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.854 114.6 58.3 -62.6 -33.8 8.3 -19.8 -13.6 7 7 A E H > S+ 0 0 92 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.923 109.2 43.5 -60.7 -44.6 7.6 -16.2 -12.5 8 8 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.915 110.0 56.2 -68.3 -38.3 6.2 -17.4 -9.1 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.3 -2,-0.2 0.946 109.4 47.4 -56.8 -45.5 9.0 -20.0 -8.7 10 10 A A H X S+ 0 0 50 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.873 112.3 48.0 -62.4 -42.6 11.5 -17.1 -9.1 11 11 A A H X S+ 0 0 19 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.932 111.2 50.8 -69.0 -42.6 9.7 -14.9 -6.5 12 12 A M H <>S+ 0 0 0 -4,-2.9 5,-2.5 1,-0.2 6,-0.4 0.908 111.8 48.2 -59.5 -40.2 9.4 -17.7 -4.0 13 13 A K H ><5S+ 0 0 84 -4,-2.1 3,-1.9 -5,-0.2 -2,-0.2 0.929 108.7 53.7 -66.6 -44.9 13.2 -18.4 -4.3 14 14 A R H 3<5S+ 0 0 201 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.849 108.2 50.4 -56.3 -37.4 14.1 -14.7 -3.9 15 15 A H T 3<5S- 0 0 31 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.245 121.8-105.7 -92.0 14.7 12.1 -14.6 -0.7 16 16 A G T < 5S+ 0 0 37 -3,-1.9 -3,-0.2 -5,-0.1 -2,-0.1 0.677 82.2 123.5 80.8 24.2 13.9 -17.7 0.7 17 17 A L > < + 0 0 0 -5,-2.5 3,-2.1 2,-0.1 2,-0.3 0.716 39.1 108.0 -91.4 -16.9 11.2 -20.5 0.4 18 18 A D T 3 S- 0 0 70 -6,-0.4 6,-0.2 1,-0.3 4,-0.1 -0.414 102.6 -6.7 -70.2 119.9 13.3 -22.9 -1.7 19 19 A N T > S+ 0 0 94 4,-1.1 3,-2.3 -2,-0.3 -1,-0.3 0.510 90.5 161.8 60.1 15.8 14.2 -25.8 0.6 20 20 A Y G X S- 0 0 74 -3,-2.1 3,-1.9 3,-0.5 -1,-0.2 -0.405 77.6 -3.9 -64.7 130.5 12.7 -24.0 3.7 21 21 A R G 3 S- 0 0 160 1,-0.3 -1,-0.3 -2,-0.1 3,-0.1 0.758 134.8 -61.5 49.9 30.1 12.1 -26.7 6.4 22 22 A G G < S+ 0 0 57 -3,-2.3 2,-0.6 1,-0.2 -1,-0.3 0.494 102.6 131.8 84.7 5.6 13.3 -29.2 3.8 23 23 A Y < - 0 0 49 -3,-1.9 -4,-1.1 -6,-0.2 -3,-0.5 -0.847 52.8-133.2 -98.2 113.4 10.6 -28.6 1.1 24 24 A S >> - 0 0 43 -2,-0.6 3,-1.4 -5,-0.2 4,-1.0 -0.183 27.5-102.6 -58.4 154.3 12.0 -28.1 -2.4 25 25 A L H 3> S+ 0 0 5 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.791 119.1 63.4 -44.5 -41.4 10.7 -25.2 -4.6 26 26 A G H 3> S+ 0 0 1 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.843 98.1 55.4 -58.3 -34.4 8.5 -27.6 -6.6 27 27 A N H <> S+ 0 0 20 -3,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.897 109.7 45.9 -63.0 -40.4 6.4 -28.5 -3.5 28 28 A W H X S+ 0 0 0 -4,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.870 113.9 48.4 -71.0 -43.1 5.6 -24.7 -2.8 29 29 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.912 112.2 49.2 -61.9 -43.8 4.7 -24.1 -6.6 30 30 A b H X S+ 0 0 1 -4,-2.4 4,-1.9 2,-0.2 5,-0.2 0.900 110.9 50.5 -60.0 -45.6 2.5 -27.2 -6.7 31 31 A A H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 5,-0.2 0.932 111.5 47.9 -59.9 -47.2 0.7 -26.1 -3.4 32 32 A A H X>S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 6,-1.2 0.884 108.2 56.7 -61.5 -40.1 0.1 -22.5 -4.9 33 33 A K H X5S+ 0 0 61 -4,-2.2 4,-1.4 4,-0.2 -1,-0.2 0.956 115.2 34.0 -56.8 -50.9 -1.2 -24.1 -8.1 34 34 A F H <5S+ 0 0 64 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.721 120.0 50.9 -83.3 -21.5 -4.0 -26.1 -6.4 35 35 A E H <5S- 0 0 39 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.936 137.6 -6.7 -74.6 -46.5 -4.7 -23.6 -3.6 36 36 A S H ><5S- 0 0 12 -4,-2.4 3,-1.4 19,-0.4 -3,-0.2 0.370 83.6-115.9-134.3 -3.1 -5.2 -20.4 -5.7 37 37 A N T 3< - 0 0 47 4,-2.8 3,-2.1 -2,-0.4 -1,-0.0 -0.540 23.0-111.7 -88.4 157.3 -15.0 -22.0 5.2 47 47 A T T 3 S+ 0 0 161 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.823 116.6 59.4 -53.9 -34.3 -18.0 -23.8 6.7 48 48 A D T 3 S- 0 0 107 1,-0.1 -1,-0.3 21,-0.0 3,-0.1 0.421 122.0-103.3 -77.6 0.2 -16.9 -22.6 10.2 49 49 A G S < S+ 0 0 25 -3,-2.1 -2,-0.1 1,-0.4 -1,-0.1 0.258 85.7 120.6 94.0 -7.7 -17.1 -18.9 9.2 50 50 A S - 0 0 2 19,-0.1 -4,-2.8 -5,-0.1 -1,-0.4 -0.324 53.4-139.0 -76.2 172.8 -13.3 -18.4 8.8 51 51 A T E -B 45 0B 4 -6,-0.2 9,-2.2 -3,-0.1 2,-0.4 -0.987 1.6-139.4-136.8 145.1 -11.8 -17.3 5.3 52 52 A D E -BC 44 59B 29 -8,-2.6 -8,-1.5 -2,-0.3 2,-0.4 -0.837 25.7-161.4-104.4 134.7 -8.7 -18.4 3.3 53 53 A Y E > -BC 43 58B 26 5,-2.1 5,-1.9 -2,-0.4 3,-0.3 -0.971 30.4 -16.5-128.9 132.8 -6.7 -15.7 1.6 54 54 A G T > 5S- 0 0 0 -12,-2.8 3,-1.9 -2,-0.4 30,-0.2 -0.169 97.4 -26.4 89.2-172.8 -4.1 -15.4 -1.2 55 55 A I T 3 5S+ 0 0 1 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.766 141.9 32.0 -57.0 -33.1 -1.7 -17.5 -3.2 56 56 A L T 3 5S- 0 0 0 -3,-0.3 -1,-0.3 27,-0.2 -2,-0.2 0.205 106.2-123.1-106.5 15.6 -1.4 -20.0 -0.4 57 57 A Q T < 5 - 0 0 12 -3,-1.9 2,-0.3 1,-0.2 -3,-0.2 0.896 34.4-166.4 49.5 51.2 -5.0 -19.7 1.0 58 58 A I E < -C 53 0B 2 -5,-1.9 -5,-2.1 -6,-0.1 2,-0.2 -0.552 16.9-123.5 -73.7 131.9 -3.9 -18.8 4.6 59 59 A N E >> -C 52 0B 28 -2,-0.3 4,-2.0 -7,-0.2 3,-0.7 -0.571 5.7-143.8 -91.4 139.2 -6.8 -19.1 7.1 60 60 A S T 34 S+ 0 0 0 -9,-2.2 6,-0.2 -2,-0.2 13,-0.1 0.519 89.9 82.4 -73.3 -9.9 -8.1 -16.3 9.4 61 61 A R T 34 S- 0 0 93 -10,-0.2 12,-2.2 11,-0.1 -1,-0.2 0.916 119.1 -5.0 -63.9 -38.3 -8.9 -18.9 12.2 62 62 A W T <4 S+ 0 0 103 -3,-0.7 13,-2.5 10,-0.2 -2,-0.2 0.678 132.2 45.7-119.1 -32.0 -5.2 -18.8 13.3 63 63 A W S < S+ 0 0 27 -4,-2.0 13,-1.8 11,-0.3 15,-0.3 0.743 102.9 20.1-108.9 -24.4 -3.0 -16.7 11.1 64 64 A c - 0 0 0 -5,-0.5 2,-0.6 9,-0.4 -1,-0.1 -0.935 68.4-111.2-144.2 162.9 -4.4 -13.3 10.2 65 65 A N B +d 79 0C 79 13,-2.7 15,-2.4 -2,-0.3 16,-0.4 -0.887 35.5 158.5-102.2 122.4 -7.0 -10.8 11.3 66 66 A D - 0 0 36 -2,-0.6 -1,-0.1 13,-0.2 -6,-0.0 0.389 52.0-123.1-113.7 0.5 -10.1 -10.1 9.2 67 67 A G S S+ 0 0 67 2,-0.1 -2,-0.1 1,-0.1 0, 0.0 0.510 97.3 71.7 75.0 0.6 -12.4 -8.7 11.9 68 68 A R + 0 0 119 1,-0.1 -1,-0.1 2,-0.0 -3,-0.0 0.054 64.8 93.3-136.2 22.4 -15.1 -11.3 11.3 69 69 A T S > S- 0 0 16 -9,-0.1 3,-1.5 -19,-0.0 -2,-0.1 -0.734 70.8-139.1-117.2 85.5 -13.8 -14.7 12.7 70 70 A P T 3 S+ 0 0 128 0, 0.0 -2,-0.0 0, 0.0 -20,-0.0 -0.083 79.1 4.4 -49.9 132.1 -15.0 -15.0 16.3 71 71 A G T 3 S+ 0 0 69 1,-0.2 2,-0.1 0, 0.0 -10,-0.0 0.655 98.3 139.5 76.2 18.0 -12.5 -16.4 18.8 72 72 A S < - 0 0 32 -3,-1.5 -10,-0.2 1,-0.1 -1,-0.2 -0.371 45.0-131.1 -91.9 170.6 -9.7 -16.6 16.3 73 73 A R - 0 0 146 -12,-2.2 -9,-0.4 -13,-0.1 3,-0.1 -0.618 2.7-148.3-112.0 171.3 -5.9 -15.7 16.6 74 74 A N > + 0 0 50 -2,-0.2 3,-1.6 -11,-0.2 -11,-0.3 -0.605 28.5 163.7-139.4 68.4 -3.6 -13.6 14.4 75 75 A L T 3 S+ 0 0 56 -13,-2.5 -12,-0.2 1,-0.3 -11,-0.1 0.786 74.6 54.1 -69.6 -24.4 -0.3 -15.4 14.8 76 76 A d T 3 S- 0 0 16 -13,-1.8 -1,-0.3 2,-0.1 -12,-0.1 0.508 104.5-131.4 -82.4 -6.5 1.3 -13.8 11.7 77 77 A N < + 0 0 134 -3,-1.6 -13,-0.1 1,-0.2 -2,-0.1 0.896 65.9 110.9 53.9 52.5 0.4 -10.3 13.2 78 78 A I S S- 0 0 32 -15,-0.3 -13,-2.7 16,-0.0 2,-0.2 -0.993 74.2-104.2-146.5 154.4 -1.1 -9.0 9.9 79 79 A P B > -d 65 0C 71 0, 0.0 3,-1.6 0, 0.0 4,-0.4 -0.579 36.1-123.4 -75.7 142.1 -4.5 -8.0 8.4 80 80 A c G > S+ 0 0 2 -15,-2.4 3,-1.8 1,-0.3 4,-0.2 0.817 108.7 71.0 -55.6 -32.5 -5.7 -10.8 6.1 81 81 A S G > S+ 0 0 84 -16,-0.4 3,-1.8 1,-0.3 -1,-0.3 0.811 85.2 65.7 -52.4 -32.9 -5.9 -8.1 3.3 82 82 A A G X S+ 0 0 32 -3,-1.6 3,-0.7 1,-0.3 9,-0.3 0.705 92.1 65.5 -60.1 -22.4 -2.0 -8.0 3.2 83 83 A L G < S+ 0 0 2 -3,-1.8 -28,-0.5 -4,-0.4 -1,-0.3 0.467 94.3 58.1 -78.0 -4.7 -2.2 -11.6 1.9 84 84 A L G < S+ 0 0 43 -3,-1.8 -1,-0.2 -4,-0.2 -2,-0.2 0.377 80.1 122.2-106.5 -0.4 -3.9 -10.4 -1.3 85 85 A S S < S- 0 0 55 -3,-0.7 6,-0.1 -4,-0.2 -3,-0.0 -0.190 71.9-124.8 -59.6 150.5 -1.1 -8.0 -2.5 86 86 A S S S+ 0 0 75 2,-0.0 2,-0.6 -45,-0.0 -1,-0.1 0.812 102.1 75.5 -63.5 -24.3 0.7 -8.4 -5.8 87 87 A D S S- 0 0 89 1,-0.1 3,-0.4 -47,-0.0 4,-0.3 -0.799 74.9-157.2 -86.8 122.8 3.9 -8.5 -3.7 88 88 A I > + 0 0 6 -2,-0.6 4,-2.3 1,-0.2 5,-0.2 0.392 62.2 106.4 -85.3 -0.3 4.1 -12.0 -2.1 89 89 A T H > S+ 0 0 49 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.898 81.1 47.2 -46.3 -50.3 6.4 -11.0 0.9 90 90 A A H > S+ 0 0 25 -3,-0.4 4,-2.0 -8,-0.3 -1,-0.2 0.898 112.8 49.1 -63.1 -42.5 3.5 -11.2 3.5 91 91 A S H > S+ 0 0 5 -9,-0.3 4,-2.5 -4,-0.3 -1,-0.2 0.900 113.4 47.0 -60.5 -42.3 2.3 -14.6 2.2 92 92 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.929 111.5 49.4 -70.0 -45.3 5.8 -16.1 2.3 93 93 A N H X S+ 0 0 86 -4,-2.6 4,-1.1 -5,-0.2 -1,-0.2 0.871 114.6 45.7 -60.3 -40.3 6.7 -14.9 5.8 94 94 A d H X S+ 0 0 2 -4,-2.0 4,-2.5 -5,-0.2 3,-0.2 0.898 109.6 54.5 -68.4 -42.2 3.4 -16.3 7.1 95 95 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.880 103.4 57.6 -57.2 -37.4 3.8 -19.6 5.2 96 96 A K H X S+ 0 0 43 -4,-2.2 4,-0.9 1,-0.2 -1,-0.2 0.901 108.6 44.7 -59.9 -42.9 7.3 -20.0 6.9 97 97 A K H < S+ 0 0 95 -4,-1.1 3,-0.4 -3,-0.2 4,-0.3 0.925 114.1 50.5 -67.1 -42.3 5.6 -19.8 10.4 98 98 A I H >< S+ 0 0 8 -4,-2.5 3,-1.6 1,-0.2 5,-0.3 0.935 109.3 49.2 -60.1 -49.0 2.8 -22.2 9.3 99 99 A V H 3< S+ 0 0 3 -4,-2.8 5,-0.5 1,-0.3 3,-0.4 0.704 109.2 54.8 -68.2 -18.1 5.2 -24.9 7.9 100 100 A S T 3< S+ 0 0 33 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.445 81.1 95.8 -84.5 -3.1 7.2 -24.7 11.2 101 101 A D S < S- 0 0 113 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.1 0.595 107.5 -89.5 -76.8 -10.9 4.1 -25.4 13.3 102 102 A G S S+ 0 0 63 -3,-0.4 -1,-0.1 -4,-0.2 -3,-0.1 -0.023 113.8 67.4 133.9 -32.8 4.8 -29.2 13.7 103 103 A N S > S- 0 0 122 1,-0.3 3,-1.4 -5,-0.3 -3,-0.1 0.291 82.8-145.0-107.5 11.7 3.0 -30.9 10.7 104 104 A G G > - 0 0 13 -5,-0.5 3,-1.3 1,-0.2 -1,-0.3 -0.319 68.4 -21.1 62.9-145.1 5.1 -29.6 7.9 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.1 2,-0.1 7,-0.3 0.548 116.8 91.3 -82.2 -2.9 3.2 -28.9 4.6 106 106 A N G < + 0 0 52 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.704 67.9 80.5 -60.0 -15.1 0.4 -31.3 5.7 107 107 A A G < S+ 0 0 54 -3,-1.3 2,-0.9 1,-0.1 -1,-0.3 0.801 84.1 67.2 -58.4 -27.1 -1.1 -27.9 7.1 108 108 A W S X> S- 0 0 10 -3,-2.1 4,-2.0 1,-0.2 3,-0.5 -0.835 75.7-162.1 -98.6 105.0 -2.2 -27.4 3.5 109 109 A V H 3> S+ 0 0 82 -2,-0.9 4,-2.4 1,-0.2 5,-0.2 0.894 89.3 54.1 -58.4 -38.8 -4.8 -30.1 2.9 110 110 A A H 3> S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 5,-0.4 0.847 105.5 53.2 -63.6 -33.8 -4.5 -29.6 -1.0 111 111 A W H <>>S+ 0 0 13 -3,-0.5 5,-3.3 -6,-0.2 4,-2.1 0.935 111.5 46.5 -63.6 -45.7 -0.7 -30.2 -0.8 112 112 A R H <5S+ 0 0 118 -4,-2.0 -2,-0.2 -7,-0.3 -1,-0.2 0.932 120.8 38.2 -59.1 -45.4 -1.3 -33.5 1.1 113 113 A N H <5S+ 0 0 100 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.752 133.4 18.7 -82.9 -22.7 -4.0 -34.6 -1.4 114 114 A R H <5S+ 0 0 141 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.577 131.7 27.7-125.2 -11.7 -2.6 -33.4 -4.7 115 115 A b T ><5S+ 0 0 0 -4,-2.1 3,-2.1 -5,-0.4 -3,-0.2 0.726 84.9 103.6-124.1 -43.0 1.2 -32.8 -4.4 116 116 A K T 3 + 0 0 97 1,-0.2 3,-1.5 -3,-0.1 4,-0.2 -0.484 56.4 166.2 -77.9 74.5 6.8 -35.6 -9.2 120 120 A V G > + 0 0 17 -2,-2.1 3,-1.8 1,-0.3 4,-0.3 0.761 63.4 75.5 -67.7 -21.4 6.9 -32.0 -7.8 121 121 A Q G > S+ 0 0 89 1,-0.3 3,-1.8 -3,-0.2 4,-0.4 0.777 80.8 72.9 -59.3 -28.0 10.1 -31.2 -9.7 122 122 A A G X S+ 0 0 38 -3,-1.5 3,-1.0 1,-0.3 -1,-0.3 0.819 85.3 66.3 -53.3 -33.0 7.9 -31.0 -12.9 123 123 A W G < S+ 0 0 58 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.685 109.4 34.8 -65.4 -21.5 6.5 -27.7 -11.5 124 124 A I G X S+ 0 0 36 -3,-1.8 3,-1.9 -4,-0.3 -1,-0.2 0.321 86.5 134.6-113.6 10.0 9.9 -25.9 -11.9 125 125 A R T < S+ 0 0 124 -3,-1.0 3,-0.1 -4,-0.4 -3,-0.1 -0.245 76.6 8.6 -66.7 133.5 11.0 -27.8 -15.1 126 126 A G T 3 S+ 0 0 82 1,-0.2 2,-0.3 3,-0.0 -1,-0.3 0.451 93.1 138.2 74.8 -0.7 12.5 -25.5 -17.7 127 127 A a < - 0 0 20 -3,-1.9 2,-1.1 1,-0.1 -1,-0.2 -0.624 58.5-128.3 -82.2 137.1 12.6 -22.4 -15.4 128 128 A R 0 0 250 -2,-0.3 -1,-0.1 -3,-0.1 -118,-0.0 -0.695 360.0 360.0 -79.8 99.9 15.6 -20.2 -15.5 129 129 A L 0 0 96 -2,-1.1 -119,-0.0 -5,-0.1 -3,-0.0 -0.949 360.0 360.0-125.3 360.0 16.3 -20.2 -11.8