==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-APR-12 4ETB . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR S.BOUTET,L.LOMB,G.WILLIAMS,T.BARENDS,A.AQUILA,R.B.DOAK,U.WEI . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6684.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 87 67.4 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 . 32 24.8 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 89 0, 0.0 39,-2.5 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 132.4 10.5 2.4 9.9 2 2 A V B -A 39 0A 98 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.907 360.0-146.7-101.5 109.0 13.9 2.5 11.7 3 3 A F - 0 0 16 35,-2.5 2,-0.2 -2,-0.7 3,-0.0 -0.379 8.6-123.1 -73.3 150.2 15.1 -1.1 11.8 4 4 A G > - 0 0 35 1,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.548 32.7-109.2 -77.5 160.3 17.2 -2.6 14.6 5 5 A R H > S+ 0 0 91 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.950 117.8 37.5 -59.0 -53.3 20.5 -4.1 13.4 6 6 A a H > S+ 0 0 43 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.836 113.2 57.9 -71.1 -32.0 19.6 -7.8 14.0 7 7 A E H > S+ 0 0 93 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.916 110.1 44.0 -61.0 -43.8 16.0 -7.2 12.7 8 8 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.901 109.3 56.2 -68.8 -41.8 17.3 -5.9 9.4 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.932 110.0 46.2 -54.3 -47.1 19.9 -8.7 9.1 10 10 A A H X S+ 0 0 43 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.884 111.8 50.3 -66.0 -40.4 17.1 -11.2 9.4 11 11 A A H X S+ 0 0 19 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.911 112.2 48.0 -62.2 -42.0 14.8 -9.4 6.9 12 12 A M H <>S+ 0 0 1 -4,-2.8 5,-2.3 2,-0.2 6,-0.3 0.897 110.7 50.9 -66.4 -39.9 17.7 -9.2 4.4 13 13 A K H ><5S+ 0 0 82 -4,-2.2 3,-1.6 -5,-0.2 5,-0.2 0.914 108.5 51.9 -63.2 -43.3 18.5 -12.9 4.9 14 14 A R H 3<5S+ 0 0 198 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.832 107.2 54.3 -62.1 -32.0 14.9 -13.8 4.3 15 15 A H T 3<5S- 0 0 30 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.305 122.2-104.4 -89.2 9.0 14.9 -11.8 1.1 16 16 A G T < 5S+ 0 0 36 -3,-1.6 -3,-0.2 -5,-0.1 -2,-0.1 0.648 82.4 124.7 85.8 18.4 18.0 -13.7 -0.3 17 17 A L > < + 0 0 0 -5,-2.3 3,-2.1 2,-0.1 2,-0.4 0.684 36.4 109.5 -83.3 -17.2 20.8 -11.2 0.2 18 18 A D T 3 S- 0 0 52 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.477 104.2 -10.4 -68.8 117.1 23.1 -13.4 2.2 19 19 A N T > S+ 0 0 102 4,-1.3 3,-2.2 -2,-0.4 -1,-0.3 0.614 90.3 166.5 65.5 17.9 26.0 -14.2 -0.1 20 20 A Y B X S-B 23 0B 74 -3,-2.1 3,-1.8 3,-0.7 -1,-0.2 -0.490 78.4 -7.6 -64.4 124.2 24.2 -12.7 -3.0 21 21 A R T 3 S- 0 0 163 -2,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.787 135.1 -57.3 51.2 31.5 26.8 -12.3 -5.8 22 22 A G T < S+ 0 0 67 -3,-2.2 2,-0.7 1,-0.2 -1,-0.3 0.510 104.4 130.7 85.2 5.7 29.4 -13.2 -3.2 23 23 A Y B < -B 20 0B 44 -3,-1.8 -4,-1.3 -6,-0.1 -3,-0.7 -0.838 52.2-136.9 -98.4 110.2 28.6 -10.5 -0.6 24 24 A S >> - 0 0 35 -2,-0.7 3,-1.6 -5,-0.2 4,-0.9 -0.137 27.5-102.8 -62.1 159.0 28.1 -11.8 2.9 25 25 A L H 3> S+ 0 0 1 1,-0.3 4,-1.9 2,-0.2 3,-0.4 0.818 117.5 64.8 -54.0 -39.6 25.2 -10.5 5.0 26 26 A G H 3> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.797 96.5 57.9 -55.7 -32.0 27.4 -8.3 7.0 27 27 A N H <> S+ 0 0 21 -3,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.913 107.3 46.6 -64.4 -43.0 28.2 -6.2 3.9 28 28 A W H X S+ 0 0 0 -4,-0.9 4,-2.1 -3,-0.4 -2,-0.2 0.876 113.2 47.9 -68.5 -40.0 24.6 -5.4 3.3 29 29 A V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.911 112.2 49.9 -68.2 -42.5 23.9 -4.5 6.9 30 30 A b H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 5,-0.2 0.916 110.6 50.4 -59.8 -45.0 27.0 -2.2 7.1 31 31 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.922 111.0 48.1 -60.4 -45.1 25.9 -0.5 3.8 32 32 A A H X>S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 6,-1.4 0.872 108.4 55.4 -65.5 -38.6 22.4 0.2 5.2 33 33 A K H X5S+ 0 0 64 -4,-2.2 4,-1.6 4,-0.2 -1,-0.2 0.949 116.7 34.6 -58.1 -49.9 23.8 1.5 8.5 34 34 A F H <5S+ 0 0 58 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.733 119.3 50.4 -85.2 -18.0 26.0 4.1 6.8 35 35 A E H <5S- 0 0 28 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.905 137.9 -5.4 -79.3 -41.4 23.6 4.9 3.9 36 36 A S H ><5S- 0 0 12 -4,-2.3 3,-1.3 19,-0.3 -3,-0.2 0.379 85.3-114.5-137.1 -0.7 20.4 5.5 5.9 37 37 A N T 3< - 0 0 48 4,-3.0 3,-1.6 -2,-0.3 -1,-0.0 -0.550 26.0-108.5 -95.4 165.0 22.4 15.0 -5.1 47 47 A T T 3 S+ 0 0 157 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.850 115.9 58.5 -60.4 -36.5 24.1 17.9 -6.9 48 48 A D T 3 S- 0 0 82 1,-0.1 -1,-0.3 21,-0.0 3,-0.1 0.485 122.9-101.5 -75.7 -1.0 22.9 16.8 -10.3 49 49 A G S < S+ 0 0 20 -3,-1.6 -2,-0.1 1,-0.4 -1,-0.1 0.267 84.7 123.4 98.8 -11.6 19.3 17.0 -9.2 50 50 A S - 0 0 0 -5,-0.1 -4,-3.0 19,-0.1 -1,-0.4 -0.272 50.9-140.0 -73.8 169.1 18.8 13.3 -8.7 51 51 A T E -C 45 0C 4 -6,-0.2 9,-2.5 -3,-0.1 2,-0.4 -0.987 2.3-136.9-135.0 142.2 17.6 12.0 -5.3 52 52 A D E -CD 44 59C 26 -8,-3.1 -8,-1.7 -2,-0.4 2,-0.4 -0.847 27.1-157.8 -96.9 137.8 18.6 8.9 -3.2 53 53 A Y E > -CD 43 58C 24 5,-2.1 5,-1.9 -2,-0.4 3,-0.4 -0.944 30.4 -21.4-128.9 131.4 15.8 6.9 -1.6 54 54 A G T > 5S- 0 0 0 -12,-2.7 3,-1.5 -2,-0.4 30,-0.2 -0.156 98.1 -26.4 86.8-167.7 15.3 4.5 1.3 55 55 A I T 3 5S+ 0 0 2 28,-0.6 -19,-0.3 1,-0.3 -17,-0.3 0.777 140.6 33.9 -64.3 -28.2 17.4 2.1 3.3 56 56 A L T 3 5S- 0 0 1 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.275 105.9-123.0-110.3 11.0 20.0 1.6 0.6 57 57 A Q T < 5 - 0 0 12 -3,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.902 34.0-164.2 53.9 51.2 19.8 5.1 -0.9 58 58 A I E < -D 53 0C 2 -5,-1.9 -5,-2.1 -6,-0.1 2,-0.3 -0.531 17.2-121.1 -75.7 132.3 19.0 4.0 -4.4 59 59 A N E >>> -D 52 0C 38 -2,-0.3 4,-2.3 -7,-0.2 3,-1.0 -0.547 7.5-149.0 -88.4 132.4 19.5 6.9 -7.0 60 60 A S T 345S+ 0 0 0 -9,-2.5 6,-0.2 -2,-0.3 -1,-0.1 0.581 90.1 78.4 -74.0 -12.8 16.7 8.3 -9.2 61 61 A R T 345S- 0 0 48 -10,-0.2 12,-2.1 11,-0.1 -1,-0.2 0.879 120.2 -1.1 -61.1 -36.7 19.3 9.1 -11.9 62 62 A W T <45S+ 0 0 123 -3,-1.0 13,-2.8 10,-0.2 -2,-0.2 0.693 131.6 42.3-121.7 -30.7 19.3 5.4 -12.9 63 63 A W T <5S+ 0 0 31 -4,-2.3 13,-1.9 11,-0.3 15,-0.4 0.730 104.8 20.5-110.8 -26.3 17.1 3.1 -10.9 64 64 A c < - 0 0 0 -5,-0.5 2,-0.6 9,-0.3 -1,-0.1 -0.957 67.0-112.9-143.8 161.9 13.7 4.6 -10.1 65 65 A N B +e 79 0D 80 13,-2.4 15,-2.2 -2,-0.3 16,-0.4 -0.867 32.7 160.7-101.8 122.7 11.2 7.2 -11.2 66 66 A D - 0 0 36 -2,-0.6 -1,-0.1 13,-0.2 -6,-0.0 0.280 53.6-120.9-116.8 5.3 10.5 10.2 -9.0 67 67 A G S S+ 0 0 64 2,-0.1 -2,-0.1 1,-0.1 0, 0.0 0.520 98.2 73.9 73.8 5.5 9.0 12.4 -11.8 68 68 A R + 0 0 121 1,-0.1 -1,-0.1 -8,-0.0 -3,-0.0 0.192 66.5 85.8-138.4 19.8 11.6 15.1 -11.2 69 69 A T S > S- 0 0 7 -9,-0.1 3,-1.3 3,-0.0 -2,-0.1 -0.751 70.6-149.4-120.9 81.3 14.9 13.8 -12.6 70 70 A P T 3 S+ 0 0 115 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.222 76.5 14.5 -60.4 136.7 14.8 14.7 -16.3 71 71 A G T 3 S+ 0 0 85 1,-0.3 2,-0.2 0, 0.0 -10,-0.0 0.695 96.9 134.5 75.8 19.9 16.6 12.4 -18.7 72 72 A S < - 0 0 32 -3,-1.3 -1,-0.3 1,-0.0 2,-0.2 -0.551 49.8-127.0 -95.6 164.3 17.0 9.7 -16.1 73 73 A R - 0 0 154 -12,-2.1 -9,-0.3 -2,-0.2 2,-0.1 -0.610 0.1-147.2-102.4 170.9 16.3 6.0 -16.5 74 74 A N > + 0 0 51 -2,-0.2 3,-1.5 -11,-0.2 -11,-0.3 -0.589 29.0 163.9-133.4 65.6 14.1 3.7 -14.4 75 75 A L T 3 S+ 0 0 68 -13,-2.8 -12,-0.2 1,-0.3 -11,-0.1 0.765 76.2 49.2 -65.6 -26.1 16.1 0.5 -14.5 76 76 A d T 3 S- 0 0 12 -13,-1.9 -1,-0.3 2,-0.2 -12,-0.1 0.546 103.7-132.9 -88.3 -5.8 14.2 -1.1 -11.6 77 77 A N < + 0 0 130 -3,-1.5 -13,-0.1 1,-0.2 -2,-0.1 0.915 64.9 111.3 58.4 49.6 10.8 -0.1 -13.1 78 78 A I S S- 0 0 35 -15,-0.4 -13,-2.4 16,-0.0 2,-0.2 -0.990 74.5-103.4-146.9 151.2 9.4 1.3 -9.9 79 79 A P B > -e 65 0D 75 0, 0.0 3,-1.7 0, 0.0 4,-0.4 -0.607 36.2-123.5 -72.4 142.1 8.4 4.7 -8.5 80 80 A c G > S+ 0 0 1 -15,-2.2 3,-1.7 1,-0.3 -14,-0.1 0.796 107.9 68.1 -57.2 -31.5 11.1 5.9 -6.1 81 81 A S G > S+ 0 0 86 -16,-0.4 3,-1.8 1,-0.3 -1,-0.3 0.780 86.4 68.2 -60.7 -26.3 8.5 6.2 -3.3 82 82 A A G X S+ 0 0 36 -3,-1.7 3,-0.9 1,-0.3 -1,-0.3 0.764 91.4 63.2 -62.7 -23.9 8.1 2.4 -3.3 83 83 A L G < S+ 0 0 2 -3,-1.7 -28,-0.6 -4,-0.4 -1,-0.3 0.484 93.0 62.6 -78.4 -4.8 11.7 2.3 -1.9 84 84 A L G < S+ 0 0 43 -3,-1.8 -1,-0.2 -30,-0.2 -2,-0.2 0.468 78.0 121.2 -99.6 -1.9 10.6 4.2 1.3 85 85 A S S < S- 0 0 53 -3,-0.9 6,-0.1 -4,-0.2 -3,-0.0 -0.118 72.7-125.3 -60.6 153.6 8.2 1.4 2.5 86 86 A S S S+ 0 0 76 2,-0.1 2,-0.7 -45,-0.0 -1,-0.1 0.754 102.0 78.2 -67.0 -22.9 8.5 -0.3 5.8 87 87 A D S > S- 0 0 89 1,-0.1 3,-0.5 -47,-0.0 4,-0.3 -0.801 73.4-160.2 -85.9 116.9 8.5 -3.5 3.7 88 88 A I T 3> + 0 0 7 -2,-0.7 4,-2.5 1,-0.2 5,-0.2 0.421 61.6 105.4 -84.0 4.5 12.0 -3.7 2.2 89 89 A T H 3> S+ 0 0 45 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.891 80.5 46.1 -51.1 -49.8 11.1 -6.0 -0.7 90 90 A A H <> S+ 0 0 30 -3,-0.5 4,-1.9 -8,-0.3 -1,-0.2 0.893 113.2 49.6 -64.2 -40.9 11.3 -3.4 -3.4 91 91 A S H > S+ 0 0 5 -4,-0.3 4,-2.5 -9,-0.2 -1,-0.2 0.909 113.2 47.1 -62.6 -43.2 14.6 -2.0 -2.1 92 92 A V H X S+ 0 0 2 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.932 110.7 50.1 -65.9 -48.9 16.1 -5.5 -2.0 93 93 A N H X S+ 0 0 84 -4,-2.7 4,-1.0 -5,-0.2 -1,-0.2 0.882 114.3 45.5 -58.6 -39.1 14.9 -6.5 -5.4 94 94 A d H X S+ 0 0 4 -4,-1.9 4,-2.1 -5,-0.2 3,-0.5 0.909 108.8 55.8 -71.2 -41.2 16.3 -3.3 -6.9 95 95 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.847 102.4 57.8 -56.6 -37.4 19.6 -3.7 -5.0 96 96 A K H X S+ 0 0 46 -4,-2.1 4,-0.8 1,-0.2 -1,-0.2 0.867 107.2 47.2 -61.5 -37.3 20.0 -7.2 -6.6 97 97 A K H < S+ 0 0 107 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.895 113.6 48.3 -69.2 -41.5 19.9 -5.6 -10.0 98 98 A I H >< S+ 0 0 5 -4,-2.1 3,-1.7 1,-0.2 5,-0.4 0.944 110.8 48.5 -63.6 -49.4 22.4 -2.9 -9.1 99 99 A V H 3<>S+ 0 0 4 -4,-2.8 5,-0.5 1,-0.3 3,-0.4 0.711 109.8 55.0 -70.0 -17.7 24.9 -5.2 -7.5 100 100 A S T 3<5S+ 0 0 42 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.421 82.4 91.1 -88.8 -0.3 24.7 -7.5 -10.6 101 101 A D T < 5S- 0 0 83 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.1 0.484 110.1 -89.1 -85.2 -0.3 25.5 -4.7 -13.1 102 102 A G T 5S+ 0 0 66 -3,-0.4 -3,-0.1 -4,-0.1 -1,-0.1 -0.013 114.7 72.0 124.1 -30.3 29.3 -5.2 -13.1 103 103 A N T > 5S- 0 0 113 -5,-0.4 3,-1.5 1,-0.3 4,-0.1 0.382 77.9-155.1-103.8 4.3 30.6 -3.0 -10.3 104 104 A G G > < - 0 0 9 -5,-0.5 3,-1.0 1,-0.2 -1,-0.3 -0.230 65.2 -22.2 60.5-143.4 29.4 -5.0 -7.3 105 105 A M G > S+ 0 0 0 1,-0.2 3,-2.2 2,-0.1 7,-0.3 0.516 114.2 94.0 -82.0 -2.8 28.8 -3.1 -4.1 106 106 A N G < + 0 0 49 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.678 68.2 78.9 -61.3 -14.7 31.2 -0.3 -5.2 107 107 A A G < S+ 0 0 54 -3,-1.0 2,-0.8 -4,-0.1 -1,-0.3 0.783 82.3 72.6 -58.0 -29.3 27.9 1.4 -6.4 108 108 A W S <> S- 0 0 10 -3,-2.2 4,-2.3 1,-0.2 3,-0.3 -0.817 71.5-161.1 -95.2 108.1 27.3 2.3 -2.8 109 109 A V H > S+ 0 0 78 -2,-0.8 4,-2.4 1,-0.2 5,-0.2 0.882 90.9 51.1 -56.1 -40.9 29.8 5.1 -1.8 110 110 A A H > S+ 0 0 11 1,-0.2 4,-2.1 2,-0.2 5,-0.4 0.844 109.1 51.8 -69.4 -32.6 29.4 4.5 1.9 111 111 A W H >>S+ 0 0 12 -3,-0.3 5,-3.2 -6,-0.2 4,-2.0 0.943 111.3 46.9 -65.6 -46.4 30.1 0.8 1.4 112 112 A R H <5S+ 0 0 109 -4,-2.3 -2,-0.2 -7,-0.3 -1,-0.2 0.909 121.7 36.8 -61.5 -39.8 33.2 1.5 -0.5 113 113 A N H <5S+ 0 0 115 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.736 132.5 19.3 -88.1 -21.4 34.4 4.1 2.1 114 114 A R H <5S+ 0 0 140 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.518 130.2 28.9-130.0 -10.6 33.3 2.5 5.4 115 115 A b T ><5S+ 0 0 0 -4,-2.0 3,-2.2 -5,-0.4 -3,-0.2 0.690 86.7 98.8-120.7 -44.8 32.6 -1.2 5.0 116 116 A K T 3 + 0 0 74 -2,-0.2 3,-1.3 1,-0.2 4,-0.2 -0.615 51.6 172.2 -80.9 85.4 35.4 -6.9 9.5 120 120 A V G > + 0 0 7 -2,-1.7 3,-2.0 1,-0.3 4,-0.3 0.719 64.6 76.8 -72.9 -18.7 31.8 -6.8 8.3 121 121 A Q G > S+ 0 0 108 1,-0.3 3,-1.4 2,-0.2 4,-0.5 0.759 80.3 73.3 -60.8 -22.8 30.8 -10.0 10.2 122 122 A A G < S+ 0 0 39 -3,-1.3 3,-0.4 1,-0.3 -1,-0.3 0.751 85.2 66.4 -61.3 -24.0 30.8 -7.8 13.3 123 123 A W G < S+ 0 0 59 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.679 108.2 35.7 -73.6 -20.2 27.5 -6.3 11.9 124 124 A I S X S+ 0 0 40 -3,-1.4 3,-1.8 -4,-0.3 -1,-0.2 0.346 86.7 133.3-111.5 5.4 25.6 -9.5 12.3 125 125 A R T 3 S+ 0 0 146 -4,-0.5 3,-0.1 -3,-0.4 -119,-0.1 -0.303 75.7 11.1 -59.3 131.0 27.4 -10.7 15.5 126 126 A G T 3 S+ 0 0 82 1,-0.3 -1,-0.3 -120,-0.0 2,-0.2 0.323 95.4 134.4 86.1 -8.0 24.9 -11.9 18.2 127 127 A a < - 0 0 20 -3,-1.8 2,-1.0 1,-0.1 -1,-0.3 -0.485 60.3-125.1 -80.4 145.1 22.0 -12.0 15.8 128 128 A R 0 0 236 -2,-0.2 -1,-0.1 1,-0.2 -118,-0.0 -0.777 360.0 360.0 -86.7 103.4 19.5 -14.9 15.7 129 129 A L 0 0 106 -2,-1.0 -1,-0.2 -5,-0.1 -2,-0.0 0.484 360.0 360.0-122.2 360.0 19.7 -15.8 12.0