==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-AUG-10 3OJP . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR F.O'MEARA,J.BRADLEY,P.E.O'ROURKE,H.WEBB,B.M.TYNAN-CONNOLLY, . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6601.0 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 . 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 . 4 3.1 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,-2.9 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 137.3 2.1 -10.3 18.8 2 2 A V B -A 39 0A 96 37,-0.2 37,-0.2 38,-0.1 2,-0.1 -0.907 360.0-150.4-102.4 109.0 2.1 -13.6 20.7 3 3 A F - 0 0 12 35,-2.7 2,-0.2 -2,-0.7 3,-0.0 -0.466 11.3-120.7 -75.4 151.8 -1.4 -14.9 20.8 4 4 A G > - 0 0 36 -2,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.506 33.5-107.5 -74.8 156.9 -2.9 -17.0 23.6 5 5 A R H > S+ 0 0 86 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.955 118.7 36.9 -49.8 -58.2 -4.3 -20.4 22.4 6 6 A a H > S+ 0 0 40 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.817 113.3 59.8 -70.8 -31.4 -8.0 -19.5 22.8 7 7 A E H > S+ 0 0 89 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.916 108.7 43.4 -61.5 -44.8 -7.4 -15.9 21.6 8 8 A L H X S+ 0 0 0 -4,-2.4 4,-3.4 2,-0.2 5,-0.3 0.888 110.7 54.6 -66.6 -41.5 -6.1 -17.2 18.3 9 9 A A H X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.2 -2,-0.2 0.954 111.4 46.6 -57.8 -44.9 -8.8 -19.8 17.9 10 10 A A H X S+ 0 0 44 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.889 113.7 46.9 -63.3 -43.0 -11.3 -16.9 18.4 11 11 A A H X S+ 0 0 17 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.924 113.1 49.5 -64.9 -44.8 -9.5 -14.7 15.9 12 12 A M H <>S+ 0 0 0 -4,-3.4 5,-2.4 2,-0.2 6,-0.3 0.928 111.2 49.8 -63.0 -41.3 -9.3 -17.6 13.3 13 13 A K H ><5S+ 0 0 87 -4,-2.7 3,-1.8 -5,-0.3 -2,-0.2 0.938 109.1 51.7 -62.8 -44.4 -13.0 -18.4 13.7 14 14 A R H 3<5S+ 0 0 190 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.860 107.2 52.8 -61.6 -34.8 -13.9 -14.7 13.2 15 15 A H T 3<5S- 0 0 28 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.296 123.5-104.3 -87.1 10.6 -11.9 -14.6 10.0 16 16 A G T < 5S+ 0 0 36 -3,-1.8 -3,-0.2 -5,-0.1 -2,-0.1 0.649 83.0 124.9 81.0 22.8 -13.7 -17.7 8.7 17 17 A L > < + 0 0 0 -5,-2.4 3,-2.5 2,-0.1 2,-0.3 0.746 37.5 108.5 -82.1 -23.9 -11.1 -20.5 9.1 18 18 A D T 3 S- 0 0 58 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.432 105.2 -8.6 -60.2 116.5 -13.3 -22.9 11.2 19 19 A N T > S+ 0 0 98 4,-1.3 3,-2.5 -2,-0.3 -1,-0.3 0.536 90.5 163.8 64.1 16.1 -14.1 -25.7 8.8 20 20 A Y B X S-B 23 0B 71 -3,-2.5 3,-1.6 3,-0.6 -1,-0.2 -0.468 79.6 -4.9 -65.3 123.6 -12.5 -23.8 5.9 21 21 A R T 3 S- 0 0 160 -2,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.754 135.0 -59.6 52.7 31.4 -12.0 -26.5 3.1 22 22 A G T < S+ 0 0 65 -3,-2.5 2,-0.7 1,-0.2 -1,-0.3 0.530 104.2 132.4 84.8 7.8 -13.2 -29.0 5.7 23 23 A Y B < -B 20 0B 47 -3,-1.6 -4,-1.3 -6,-0.2 -3,-0.6 -0.808 51.5-136.7-100.9 108.7 -10.4 -28.3 8.3 24 24 A S >> - 0 0 41 -2,-0.7 3,-1.3 -5,-0.2 4,-1.1 -0.140 27.8-101.7 -58.0 155.2 -11.8 -27.8 11.8 25 25 A L H 3> S+ 0 0 1 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.825 118.6 62.6 -46.4 -41.8 -10.5 -24.9 14.0 26 26 A G H 3> S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.843 97.8 56.4 -58.3 -34.7 -8.2 -27.2 16.0 27 27 A N H <> S+ 0 0 21 -3,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.915 109.7 46.3 -59.2 -44.5 -6.2 -28.1 12.9 28 28 A W H X S+ 0 0 0 -4,-1.1 4,-2.3 2,-0.2 -2,-0.2 0.908 113.7 47.3 -68.4 -42.7 -5.5 -24.4 12.3 29 29 A V H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.909 113.4 48.3 -61.0 -45.3 -4.6 -23.8 15.9 30 30 A b H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 5,-0.2 0.918 110.7 51.6 -58.1 -47.9 -2.3 -26.8 16.0 31 31 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.942 111.9 47.0 -58.6 -44.2 -0.6 -25.7 12.7 32 32 A A H X>S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 6,-1.2 0.882 108.1 56.7 -68.3 -40.6 0.0 -22.3 14.1 33 33 A K H X5S+ 0 0 61 -4,-2.6 4,-1.6 4,-0.2 -1,-0.2 0.956 115.7 34.9 -51.5 -53.6 1.4 -23.7 17.4 34 34 A F H <5S+ 0 0 64 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.751 120.0 49.4 -82.3 -21.8 4.0 -25.7 15.7 35 35 A E H <5S- 0 0 36 -4,-2.4 -3,-0.2 20,-0.2 -2,-0.2 0.934 138.6 -7.1 -73.5 -45.0 4.8 -23.2 12.9 36 36 A S H ><5S- 0 0 11 -4,-2.6 3,-1.4 19,-0.5 -3,-0.2 0.403 82.7-115.5-135.6 -4.9 5.2 -20.1 15.0 37 37 A N T 3< - 0 0 45 4,-3.0 3,-2.1 -2,-0.3 -1,-0.0 -0.628 25.0-112.7 -97.7 155.3 14.7 -21.9 4.2 47 47 A T T 3 S+ 0 0 161 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.814 116.0 58.9 -58.1 -31.5 17.7 -23.6 2.6 48 48 A D T 3 S- 0 0 98 1,-0.1 -1,-0.3 21,-0.0 3,-0.1 0.377 122.5-103.0 -78.8 -1.1 16.6 -22.4 -0.9 49 49 A G S < S+ 0 0 21 -3,-2.1 -2,-0.1 1,-0.4 -1,-0.1 0.316 85.4 121.8 94.4 -11.8 16.8 -18.7 0.2 50 50 A S - 0 0 1 19,-0.1 -4,-3.0 -5,-0.1 2,-0.4 -0.297 52.7-138.7 -69.6 171.4 13.0 -18.3 0.6 51 51 A T E -C 45 0C 3 -6,-0.2 9,-2.4 -3,-0.1 2,-0.4 -0.989 1.9-135.4-138.1 146.3 11.7 -17.2 4.0 52 52 A N E -CD 44 59C 28 -8,-3.0 -8,-2.0 -2,-0.4 2,-0.4 -0.847 26.3-162.4-100.7 136.7 8.6 -18.3 6.1 53 53 A Y E > -CD 43 58C 22 5,-1.8 5,-2.2 -2,-0.4 3,-0.4 -0.971 31.8 -17.4-131.6 129.7 6.5 -15.5 7.7 54 54 A G T > 5S- 0 0 0 -12,-3.0 3,-1.8 -2,-0.4 30,-0.2 -0.147 98.2 -27.8 89.6-168.9 4.0 -15.2 10.5 55 55 A I T 3 5S+ 0 0 1 28,-0.5 -19,-0.5 1,-0.3 -17,-0.3 0.740 141.7 32.5 -62.2 -29.6 1.7 -17.4 12.5 56 56 A L T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.147 106.9-122.7-114.6 17.8 1.4 -20.0 9.8 57 57 A Q T < 5 - 0 0 13 -3,-1.8 2,-0.4 1,-0.2 -3,-0.2 0.899 35.2-165.4 47.6 55.2 5.0 -19.5 8.3 58 58 A I E < -D 53 0C 2 -5,-2.2 -5,-1.8 25,-0.1 2,-0.2 -0.629 15.5-123.3 -78.3 134.4 3.9 -18.7 4.8 59 59 A N E >> -D 52 0C 27 -2,-0.4 4,-2.0 -7,-0.2 5,-0.6 -0.500 7.8-144.3 -93.7 139.2 6.7 -18.9 2.3 60 60 A S T 45S+ 0 0 0 -9,-2.4 6,-0.2 -2,-0.2 9,-0.1 0.488 90.2 80.3 -73.4 -8.7 8.0 -16.2 -0.1 61 61 A R T 45S- 0 0 91 -10,-0.2 12,-3.2 11,-0.2 -1,-0.2 0.948 120.6 -4.3 -64.7 -44.3 8.8 -18.8 -2.9 62 62 A W T 45S+ 0 0 99 -3,-0.4 13,-2.6 10,-0.2 -2,-0.2 0.774 132.5 42.7-112.1 -35.1 5.1 -18.7 -3.9 63 63 A W T <5S+ 0 0 28 -4,-2.0 13,-1.9 11,-0.3 15,-0.3 0.707 104.4 22.7-111.3 -25.1 2.8 -16.6 -1.7 64 64 A c < - 0 0 0 -5,-0.6 2,-0.5 9,-0.4 11,-0.1 -0.958 67.5-114.7-141.4 156.1 4.3 -13.2 -0.7 65 65 A N B +e 79 0D 79 13,-2.5 15,-2.5 -2,-0.3 16,-0.4 -0.856 35.3 157.1 -92.8 128.0 6.9 -10.7 -1.9 66 66 A D - 0 0 37 -2,-0.5 -1,-0.1 -6,-0.2 8,-0.0 0.248 53.0-123.3-122.5 3.5 9.9 -10.0 0.2 67 67 A G S S+ 0 0 65 2,-0.1 -2,-0.1 1,-0.1 0, 0.0 0.514 96.1 75.5 72.0 4.0 12.2 -8.7 -2.6 68 68 A R + 0 0 116 1,-0.1 -1,-0.1 2,-0.0 -8,-0.0 0.040 63.9 92.5-137.9 28.2 14.9 -11.2 -1.9 69 69 A T S > S- 0 0 15 -9,-0.1 3,-2.3 3,-0.0 -2,-0.1 -0.775 70.7-138.5-124.5 86.1 13.6 -14.6 -3.3 70 70 A P T 3 S+ 0 0 129 0, 0.0 -2,-0.0 0, 0.0 -20,-0.0 -0.124 81.3 3.7 -50.5 127.2 14.8 -15.0 -6.8 71 71 A G T 3 S+ 0 0 75 1,-0.2 -10,-0.0 0, 0.0 0, 0.0 0.349 98.5 139.8 89.2 -3.2 12.4 -16.4 -9.3 72 72 A S < - 0 0 31 -3,-2.3 -1,-0.2 1,-0.1 -10,-0.2 -0.059 44.1-131.4 -75.4 167.9 9.6 -16.5 -6.7 73 73 A R - 0 0 137 -12,-3.2 -9,-0.4 -13,-0.1 -1,-0.1 -0.602 3.4-146.9-109.5 172.3 5.9 -15.7 -7.1 74 74 A N > + 0 0 50 -2,-0.2 3,-1.7 -11,-0.2 -11,-0.3 -0.521 30.9 161.2-138.6 64.2 3.5 -13.5 -4.9 75 75 A L T 3 S+ 0 0 64 -13,-2.6 -12,-0.2 1,-0.3 -11,-0.1 0.716 74.0 51.8 -73.8 -19.1 0.3 -15.3 -5.3 76 76 A d T 3 S- 0 0 11 -13,-1.9 -1,-0.3 2,-0.2 -12,-0.1 0.505 105.6-130.9 -90.0 -5.4 -1.4 -13.8 -2.3 77 77 A N < + 0 0 133 -3,-1.7 -2,-0.1 1,-0.2 -13,-0.1 0.925 65.2 112.5 62.6 49.7 -0.5 -10.3 -3.7 78 78 A I S S- 0 0 31 -15,-0.3 -13,-2.5 16,-0.0 2,-0.2 -0.990 73.8-102.2-147.1 151.6 1.0 -9.0 -0.5 79 79 A P B > -e 65 0D 71 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.592 35.4-124.8 -71.8 142.0 4.3 -8.0 1.1 80 80 A c G > S+ 0 0 2 -15,-2.5 3,-1.8 1,-0.3 -14,-0.1 0.837 109.1 69.4 -59.0 -30.0 5.6 -10.7 3.3 81 81 A S G > S+ 0 0 82 -16,-0.4 3,-1.9 1,-0.3 -1,-0.3 0.774 86.2 66.8 -57.9 -29.0 5.8 -8.1 6.1 82 82 A A G X S+ 0 0 31 -3,-1.9 3,-0.8 1,-0.3 9,-0.3 0.744 91.5 63.3 -61.7 -26.4 1.9 -8.0 6.1 83 83 A L G < S+ 0 0 1 -3,-1.8 -28,-0.5 -4,-0.4 -1,-0.3 0.411 96.3 59.4 -74.6 -2.1 2.1 -11.6 7.4 84 84 A L G < S+ 0 0 42 -3,-1.9 -1,-0.2 -30,-0.2 -2,-0.2 0.424 79.8 118.3-102.9 -3.9 3.9 -10.3 10.6 85 85 A S S < S- 0 0 53 -3,-0.8 6,-0.1 -4,-0.2 -3,-0.0 -0.251 74.0-124.4 -64.2 149.0 1.1 -7.9 11.8 86 86 A S S S+ 0 0 77 2,-0.1 2,-0.7 -45,-0.0 -1,-0.1 0.731 103.0 77.1 -57.2 -21.8 -0.8 -8.3 15.1 87 87 A D S > S- 0 0 85 1,-0.1 3,-0.5 -5,-0.1 4,-0.3 -0.848 74.0-159.8 -94.3 116.9 -3.9 -8.3 12.8 88 88 A I T 3> + 0 0 5 -2,-0.7 4,-3.0 1,-0.2 5,-0.2 0.369 60.5 106.8 -83.1 3.4 -4.0 -11.8 11.3 89 89 A T H 3> S+ 0 0 44 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.907 81.3 46.6 -49.3 -47.5 -6.3 -10.9 8.3 90 90 A A H <> S+ 0 0 22 -3,-0.5 4,-2.3 -8,-0.3 5,-0.2 0.936 113.9 47.4 -66.8 -47.4 -3.4 -11.1 5.7 91 91 A S H > S+ 0 0 4 -9,-0.3 4,-2.7 -4,-0.3 -1,-0.2 0.913 115.0 46.5 -54.4 -46.7 -2.2 -14.5 7.1 92 92 A V H X S+ 0 0 1 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.964 112.5 48.8 -63.4 -47.6 -5.7 -15.9 7.2 93 93 A N H X S+ 0 0 78 -4,-3.0 4,-1.2 -5,-0.2 -1,-0.2 0.867 115.8 43.9 -59.3 -40.4 -6.6 -14.7 3.7 94 94 A d H X S+ 0 0 2 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.2 0.909 109.3 56.6 -73.8 -38.9 -3.3 -16.1 2.2 95 95 A A H X S+ 0 0 0 -4,-2.7 4,-3.0 -5,-0.2 5,-0.2 0.870 103.7 56.5 -55.9 -37.5 -3.7 -19.4 4.2 96 96 A K H X S+ 0 0 42 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.918 108.0 45.7 -63.8 -44.9 -7.1 -19.8 2.5 97 97 A K H < S+ 0 0 102 -4,-1.2 -2,-0.2 2,-0.2 -1,-0.2 0.908 114.1 49.5 -60.7 -44.8 -5.5 -19.6 -0.9 98 98 A I H >< S+ 0 0 8 -4,-2.5 3,-1.7 1,-0.2 5,-0.3 0.921 109.6 49.2 -64.7 -45.4 -2.8 -22.1 0.1 99 99 A V H 3< S+ 0 0 4 -4,-3.0 5,-0.5 1,-0.3 3,-0.4 0.740 109.9 54.2 -69.7 -22.0 -5.2 -24.7 1.6 100 100 A S T 3< S+ 0 0 34 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.415 82.7 94.7 -78.7 -1.4 -7.2 -24.5 -1.6 101 101 A D S < S- 0 0 106 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.1 0.531 107.9 -89.0 -79.6 -9.0 -4.1 -25.2 -3.8 102 102 A G S S+ 0 0 67 -3,-0.4 -1,-0.1 -4,-0.1 -3,-0.1 -0.085 116.0 65.0 131.8 -35.0 -4.7 -29.0 -4.1 103 103 A N S > S- 0 0 114 -5,-0.3 3,-1.6 1,-0.3 -3,-0.1 0.343 82.4-151.1-106.4 11.5 -2.8 -30.6 -1.1 104 104 A G G > - 0 0 11 -5,-0.5 3,-1.6 1,-0.2 -1,-0.3 -0.270 68.7 -16.7 54.3-138.2 -5.0 -29.1 1.6 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.0 2,-0.2 7,-0.4 0.590 118.1 87.7 -80.6 -6.5 -3.2 -28.6 4.9 106 106 A N G < + 0 0 52 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.735 70.0 80.3 -59.8 -20.5 -0.4 -30.9 3.8 107 107 A A G < S+ 0 0 54 -3,-1.6 2,-0.9 1,-0.1 -1,-0.3 0.835 84.6 66.3 -50.2 -35.6 1.0 -27.7 2.3 108 108 A W S X> S- 0 0 10 -3,-2.0 4,-2.1 1,-0.2 3,-0.6 -0.795 76.3-161.2 -90.5 104.7 2.2 -27.1 6.0 109 109 A V H 3> S+ 0 0 80 -2,-0.9 4,-2.4 1,-0.2 5,-0.2 0.873 89.8 52.7 -55.3 -40.8 4.8 -29.7 6.6 110 110 A A H 3> S+ 0 0 14 2,-0.2 4,-2.6 1,-0.2 5,-0.4 0.836 105.4 54.1 -64.0 -32.0 4.5 -29.3 10.4 111 111 A W H <>>S+ 0 0 10 -3,-0.6 5,-3.1 -6,-0.2 4,-2.7 0.961 112.3 44.6 -65.0 -48.7 0.7 -29.8 10.3 112 112 A R H <5S+ 0 0 116 -4,-2.1 -2,-0.2 -7,-0.4 -1,-0.2 0.903 121.2 39.3 -59.4 -44.3 1.3 -33.1 8.4 113 113 A N H <5S+ 0 0 103 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.773 133.6 18.0 -79.9 -25.6 4.0 -34.2 10.8 114 114 A R H <5S+ 0 0 138 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.579 132.6 28.7-124.5 -14.0 2.6 -33.0 14.1 115 115 A b T ><5S+ 0 0 0 -4,-2.7 3,-2.4 -5,-0.4 -3,-0.2 0.717 84.8 102.3-118.4 -46.2 -1.2 -32.3 13.7 116 116 A K T 3 + 0 0 102 1,-0.2 3,-1.5 -2,-0.1 4,-0.2 -0.494 56.6 167.4 -78.8 78.5 -6.7 -35.2 18.6 120 120 A V G > + 0 0 16 -2,-2.3 3,-1.9 1,-0.3 4,-0.3 0.733 62.8 75.8 -70.3 -23.7 -6.7 -31.6 17.2 121 121 A Q G >> S+ 0 0 91 1,-0.3 3,-2.0 -3,-0.2 4,-0.7 0.797 81.0 75.1 -57.5 -26.3 -9.9 -30.7 19.0 122 122 A A G X4 S+ 0 0 36 -3,-1.5 3,-0.6 1,-0.3 -1,-0.3 0.822 83.7 65.0 -54.1 -32.0 -7.7 -30.5 22.1 123 123 A W G <4 S+ 0 0 57 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.664 110.8 34.6 -69.3 -16.0 -6.2 -27.2 20.8 124 124 A I G X4 S+ 0 0 38 -3,-2.0 3,-1.6 -4,-0.3 -1,-0.2 0.376 86.9 123.5-117.3 2.2 -9.7 -25.5 21.2 125 125 A R T << S+ 0 0 124 -4,-0.7 3,-0.1 -3,-0.6 -119,-0.0 -0.408 78.2 20.3 -67.4 132.8 -10.9 -27.3 24.4 126 126 A G T 3 S+ 0 0 80 1,-0.3 2,-0.4 -2,-0.1 -1,-0.3 0.380 96.0 129.8 90.0 -7.8 -11.9 -24.9 27.2 127 127 A a < - 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