==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-NOV-96 1KXY . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR H.MOTOSHIMA,T.OHMURA,T.UEDA,T.IMOTO . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6559.0 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 . 29 22.5 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 85 0, 0.0 39,-2.7 0, 0.0 2,-0.8 0.000 360.0 360.0 360.0 141.3 2.5 10.6 9.3 2 2 A V B -A 39 0A 101 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.892 360.0-147.2-102.2 106.0 2.5 13.9 7.5 3 3 A F - 0 0 14 35,-2.9 2,-0.3 -2,-0.8 3,-0.0 -0.359 8.1-126.1 -73.3 152.1 -1.1 15.1 7.4 4 4 A G > - 0 0 35 1,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.658 33.0-106.8 -90.8 156.2 -2.6 17.2 4.6 5 5 A R H > S+ 0 0 86 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.910 116.8 36.9 -49.8 -55.1 -4.2 20.5 5.7 6 6 A a H > S+ 0 0 46 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.818 113.3 58.7 -73.1 -29.4 -7.9 19.5 5.3 7 7 A E H > S+ 0 0 93 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.940 110.1 42.8 -63.6 -45.8 -7.3 16.0 6.5 8 8 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.880 110.6 56.0 -66.9 -42.7 -6.0 17.3 9.8 9 9 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.949 110.7 45.4 -54.4 -47.5 -8.7 19.8 10.0 10 10 A A H X S+ 0 0 43 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.896 113.2 49.1 -65.7 -41.3 -11.3 17.1 9.7 11 11 A A H X S+ 0 0 13 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.864 112.0 48.5 -67.0 -37.2 -9.5 14.8 12.2 12 12 A M H <>S+ 0 0 0 -4,-2.7 5,-2.3 2,-0.2 6,-0.3 0.907 110.7 51.0 -69.3 -39.7 -9.2 17.6 14.8 13 13 A K H ><5S+ 0 0 79 -4,-2.4 3,-2.1 -5,-0.2 -2,-0.2 0.937 108.3 51.6 -61.4 -47.0 -12.9 18.5 14.4 14 14 A R H 3<5S+ 0 0 183 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.805 107.5 54.9 -59.5 -31.6 -14.0 14.9 14.9 15 15 A H T 3<5S- 0 0 29 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.259 123.2-105.2 -88.6 13.5 -11.9 14.9 18.0 16 16 A G T < 5S+ 0 0 32 -3,-2.1 -3,-0.2 1,-0.0 -2,-0.1 0.693 82.8 124.4 74.8 23.2 -13.7 18.0 19.4 17 17 A L > < + 0 0 0 -5,-2.3 3,-2.1 2,-0.1 2,-0.2 0.767 36.7 105.3 -86.0 -24.8 -11.1 20.7 18.9 18 18 A N T 3 S- 0 0 68 -6,-0.3 6,-0.2 1,-0.3 4,-0.1 -0.419 106.9 -10.3 -60.5 115.5 -13.2 23.1 16.8 19 19 A N T > S+ 0 0 99 4,-1.4 3,-1.9 -2,-0.2 -1,-0.3 0.565 88.4 163.0 65.5 20.3 -14.0 25.9 19.3 20 20 A Y B X S-B 23 0B 66 -3,-2.1 3,-2.0 3,-0.6 -1,-0.2 -0.462 78.8 -3.6 -69.0 127.3 -12.7 24.0 22.3 21 21 A R T 3 S- 0 0 153 1,-0.3 -1,-0.3 -2,-0.2 3,-0.1 0.793 136.7 -57.0 57.0 30.4 -12.1 26.6 25.0 22 22 A G T < S+ 0 0 57 -3,-1.9 2,-0.6 1,-0.2 -1,-0.3 0.501 104.9 128.2 84.5 3.6 -13.2 29.3 22.5 23 23 A Y B < -B 20 0B 47 -3,-2.0 -4,-1.4 -6,-0.1 -3,-0.6 -0.847 52.7-135.9-101.4 119.0 -10.6 28.5 19.8 24 24 A S >> - 0 0 37 -2,-0.6 3,-1.4 -5,-0.2 4,-1.0 -0.172 28.4-103.8 -63.5 162.2 -11.8 28.0 16.3 25 25 A L H 3> S+ 0 0 9 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.817 117.3 66.1 -56.6 -38.2 -10.5 25.1 14.2 26 26 A G H 3> S+ 0 0 1 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.818 97.3 55.8 -55.2 -33.2 -8.3 27.4 12.1 27 27 A N H <> S+ 0 0 20 -3,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.930 109.0 45.2 -65.3 -45.4 -6.2 28.2 15.3 28 28 A W H X S+ 0 0 0 -4,-1.0 4,-2.1 2,-0.2 -2,-0.2 0.868 114.6 47.8 -67.2 -38.6 -5.4 24.5 15.9 29 29 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.912 112.4 49.6 -71.6 -39.1 -4.6 23.8 12.3 30 30 A b H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.904 110.7 50.9 -65.1 -41.9 -2.4 26.9 12.1 31 31 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 5,-0.2 0.909 110.0 47.9 -62.9 -44.2 -0.6 25.8 15.3 32 32 A A H X>S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 5,-1.3 0.916 109.2 56.0 -63.2 -42.6 0.1 22.3 14.0 33 33 A K H X5S+ 0 0 62 -4,-2.2 4,-1.0 4,-0.2 -2,-0.2 0.952 116.7 33.5 -53.6 -53.3 1.4 23.8 10.7 34 34 A F H <5S+ 0 0 57 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.706 120.6 49.3 -80.7 -19.1 4.0 26.0 12.5 35 35 A E H <5S- 0 0 31 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.2 0.891 138.5 -6.0 -85.1 -42.6 4.8 23.6 15.3 36 36 A S H ><5S- 0 0 11 -4,-2.7 3,-1.0 19,-0.4 -3,-0.2 0.419 85.5-116.2-132.3 -7.1 5.4 20.4 13.4 37 37 A N T 3< - 0 0 55 4,-3.0 3,-1.5 -2,-0.3 -1,-0.0 -0.625 26.3-108.9-104.8 167.5 15.2 22.3 24.2 47 47 A T T 3 S+ 0 0 159 1,-0.3 -1,-0.1 -2,-0.2 4,-0.0 0.797 115.3 64.5 -67.7 -27.5 18.1 23.7 26.1 48 48 A D T 3 S- 0 0 81 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.386 120.6-107.7 -75.4 6.5 16.6 22.8 29.4 49 49 A G S < S+ 0 0 22 -3,-1.5 -2,-0.1 1,-0.3 -1,-0.1 0.291 83.8 120.6 87.8 -13.9 17.0 19.2 28.3 50 50 A S - 0 0 0 -5,-0.1 -4,-3.0 19,-0.1 2,-0.3 -0.257 52.6-140.5 -75.7 171.6 13.3 18.6 27.8 51 51 A T E -C 45 0C 4 -6,-0.3 9,-2.6 -3,-0.1 2,-0.4 -0.976 3.6-135.5-138.2 145.2 11.9 17.6 24.4 52 52 A D E -CD 44 59C 29 -8,-3.2 -8,-1.7 -2,-0.3 2,-0.4 -0.893 27.6-156.0-100.1 137.4 8.8 18.6 22.4 53 53 A Y E > -CD 43 58C 24 5,-2.4 5,-2.0 -2,-0.4 3,-0.4 -0.924 30.3 -25.1-125.7 136.7 6.8 15.8 20.8 54 54 A G T > 5S- 0 0 0 -12,-2.5 3,-1.6 -2,-0.4 30,-0.2 -0.079 97.0 -23.2 79.3-170.4 4.5 15.4 17.9 55 55 A I T 3 5S+ 0 0 3 28,-0.6 -19,-0.4 1,-0.3 -17,-0.3 0.759 141.9 31.8 -51.2 -37.6 2.0 17.3 15.8 56 56 A L T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.297 106.0-124.4-108.8 8.5 1.5 19.9 18.5 57 57 A Q T < 5 - 0 0 12 -3,-1.6 2,-0.2 1,-0.2 -3,-0.2 0.884 34.2-165.6 49.8 54.5 5.0 19.7 20.0 58 58 A I E < -D 53 0C 2 -5,-2.0 -5,-2.4 -6,-0.1 2,-0.3 -0.503 18.3-117.2 -74.4 131.0 4.0 18.9 23.6 59 59 A N E >>> -D 52 0C 29 -2,-0.2 4,-2.0 -7,-0.2 3,-0.8 -0.518 7.1-146.3 -77.5 137.0 6.8 19.3 26.2 60 60 A S T 345S+ 0 0 0 -9,-2.6 14,-0.4 -2,-0.3 6,-0.2 0.614 89.9 72.5 -74.8 -16.2 8.2 16.6 28.3 61 61 A R T 345S+ 0 0 51 11,-0.2 12,-2.0 -10,-0.2 -1,-0.2 0.847 120.9 4.9 -69.8 -27.1 8.9 18.7 31.4 62 62 A W T <45S+ 0 0 122 -3,-0.8 13,-3.2 10,-0.3 -2,-0.2 0.708 131.5 39.2-123.8 -35.5 5.2 19.0 32.3 63 63 A W T <5S+ 0 0 28 -4,-2.0 13,-2.1 11,-0.3 2,-0.3 0.775 108.8 18.6 -99.5 -29.9 3.0 16.8 30.0 64 64 A c < - 0 0 0 -5,-0.6 2,-0.5 11,-0.1 10,-0.5 -0.920 66.5-116.3-142.3 162.9 4.5 13.5 29.1 65 65 A N B +e 79 0D 76 13,-2.4 15,-2.4 -2,-0.3 16,-0.4 -0.913 30.8 162.9-105.9 124.0 7.2 11.1 30.3 66 66 A D - 0 0 36 -2,-0.5 -1,-0.1 13,-0.2 -6,-0.0 0.190 53.5-120.8-117.2 9.2 10.1 10.4 28.1 67 67 A G S S+ 0 0 62 2,-0.1 -2,-0.1 1,-0.1 -7,-0.0 0.538 98.3 73.2 64.0 11.3 12.2 9.0 30.9 68 68 A R + 0 0 122 1,-0.1 -1,-0.1 -8,-0.1 -3,-0.0 0.136 66.9 89.7-141.4 23.3 15.0 11.5 30.4 69 69 A T > - 0 0 10 -9,-0.1 3,-1.8 -19,-0.0 -2,-0.1 -0.878 69.9-140.1-124.8 95.3 13.7 14.9 31.7 70 70 A P T 3 S+ 0 0 114 0, 0.0 -2,-0.0 0, 0.0 -20,-0.0 -0.327 87.4 18.0 -58.0 128.3 14.5 15.3 35.4 71 71 A G T 3 S+ 0 0 68 1,-0.3 2,-0.1 -2,-0.0 -10,-0.0 0.544 86.0 160.4 87.1 6.0 11.6 16.8 37.3 72 72 A S < - 0 0 32 -3,-1.8 -10,-0.3 1,-0.1 -1,-0.3 -0.361 30.3-155.9 -59.6 141.3 9.1 16.1 34.6 73 73 A R - 0 0 150 -12,-2.0 -11,-0.2 -9,-0.1 -1,-0.1 0.640 10.4-150.2 -97.3 -15.9 5.5 16.1 35.8 74 74 A N > + 0 0 36 -10,-0.5 3,-1.9 -14,-0.4 -11,-0.3 0.837 26.7 169.4 45.8 50.0 3.7 13.9 33.3 75 75 A L T 3 S+ 0 0 51 -13,-3.2 -12,-0.2 1,-0.3 -11,-0.1 0.700 75.6 48.7 -64.5 -23.1 0.3 15.7 33.6 76 76 A d T 3 S- 0 0 13 -13,-2.1 -1,-0.3 2,-0.2 -12,-0.1 0.475 104.5-135.2 -93.9 -1.5 -1.2 13.9 30.6 77 77 A N < + 0 0 130 -3,-1.9 -13,-0.1 1,-0.2 -2,-0.1 0.928 62.7 110.5 45.8 64.7 -0.0 10.6 32.0 78 78 A I S S- 0 0 35 -15,-0.3 -13,-2.4 16,-0.0 2,-0.2 -0.982 74.8-101.9-158.2 149.8 1.4 9.1 28.9 79 79 A P B > -e 65 0D 70 0, 0.0 3,-1.5 0, 0.0 4,-0.4 -0.577 37.4-119.8 -74.0 148.4 4.8 8.3 27.5 80 80 A c G > S+ 0 0 1 -15,-2.4 3,-1.5 1,-0.3 4,-0.2 0.807 108.9 69.6 -59.8 -26.8 5.9 10.9 25.0 81 81 A S G > S+ 0 0 83 -16,-0.4 3,-1.6 1,-0.3 -1,-0.3 0.781 86.9 66.4 -62.1 -29.1 6.2 8.3 22.2 82 82 A A G X S+ 0 0 34 -3,-1.5 3,-1.1 1,-0.3 -1,-0.3 0.784 91.8 63.8 -60.9 -29.0 2.4 8.0 22.3 83 83 A L G < S+ 0 0 2 -3,-1.5 -28,-0.6 -4,-0.4 -1,-0.3 0.513 95.8 59.0 -74.2 -3.7 2.3 11.6 21.0 84 84 A L G < S+ 0 0 44 -3,-1.6 -1,-0.2 -4,-0.2 -2,-0.2 0.317 78.4 118.8-107.8 4.0 4.1 10.6 17.8 85 85 A S S < S- 0 0 58 -3,-1.1 6,-0.1 2,-0.2 -3,-0.0 -0.230 75.1-120.2 -66.3 158.2 1.5 8.1 16.6 86 86 A S S S+ 0 0 73 1,-0.1 2,-0.8 2,-0.1 -1,-0.1 0.730 102.5 77.9 -71.1 -23.6 -0.4 8.5 13.3 87 87 A D S > S- 0 0 87 1,-0.1 3,-0.6 -47,-0.0 4,-0.3 -0.817 73.4-158.6 -85.6 112.2 -3.6 8.6 15.4 88 88 A I T 3> + 0 0 4 -2,-0.8 4,-2.9 1,-0.2 5,-0.2 0.463 61.8 107.0 -74.8 2.1 -3.7 12.1 16.9 89 89 A T H 3> S+ 0 0 37 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.886 79.7 44.8 -48.5 -51.1 -6.0 11.1 19.8 90 90 A A H <> S+ 0 0 27 -3,-0.6 4,-2.1 -8,-0.2 -1,-0.2 0.916 114.6 50.1 -60.9 -43.6 -3.4 11.2 22.6 91 91 A S H > S+ 0 0 3 -4,-0.3 4,-2.6 -9,-0.3 -1,-0.2 0.927 112.3 47.2 -60.3 -46.3 -2.0 14.5 21.2 92 92 A V H X S+ 0 0 2 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.928 111.5 49.6 -62.9 -45.6 -5.5 16.0 21.1 93 93 A N H X S+ 0 0 79 -4,-2.8 4,-1.0 -5,-0.2 -1,-0.2 0.854 114.3 45.1 -62.6 -38.2 -6.5 14.8 24.6 94 94 A d H >X S+ 0 0 1 -4,-2.1 4,-2.2 -5,-0.2 3,-0.6 0.912 109.3 55.0 -72.1 -42.0 -3.3 16.2 26.1 95 95 A A H 3X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.3 5,-0.2 0.873 102.2 59.9 -58.7 -36.1 -3.6 19.5 24.1 96 96 A K H 3X S+ 0 0 46 -4,-2.1 4,-0.7 1,-0.2 -1,-0.3 0.876 107.4 44.2 -58.6 -40.3 -7.1 19.8 25.7 97 97 A K H << S+ 0 0 105 -4,-1.0 4,-0.3 -3,-0.6 -2,-0.2 0.872 113.6 51.1 -71.1 -40.8 -5.6 19.8 29.2 98 98 A I H >< S+ 0 0 9 -4,-2.2 3,-2.1 1,-0.2 5,-0.4 0.972 109.8 47.9 -60.3 -53.4 -2.8 22.3 28.1 99 99 A V H 3< S+ 0 0 5 -4,-3.0 5,-0.5 1,-0.3 3,-0.4 0.704 110.7 53.4 -63.4 -20.1 -5.2 24.8 26.6 100 100 A S T 3< S+ 0 0 31 -4,-0.7 -1,-0.3 -5,-0.2 -2,-0.2 0.494 81.0 97.6 -91.0 -3.9 -7.3 24.6 29.8 101 101 A D S < S- 0 0 99 -3,-2.1 -1,-0.2 -4,-0.3 -2,-0.1 0.439 106.4 -99.4 -66.1 -2.1 -4.3 25.3 31.9 102 102 A G S S+ 0 0 69 -3,-0.4 -1,-0.1 -4,-0.1 -3,-0.1 0.252 112.5 74.7 104.1 -15.1 -5.2 29.0 32.2 103 103 A N S > S- 0 0 108 -5,-0.4 3,-1.4 1,-0.3 -4,-0.1 0.390 81.3-154.1-110.9 2.8 -2.9 30.5 29.5 104 104 A G G > - 0 0 10 -5,-0.5 3,-1.2 1,-0.2 -1,-0.3 -0.218 61.3 -21.9 61.6-148.2 -4.8 29.2 26.5 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.1 2,-0.1 7,-0.3 0.502 115.2 91.1 -76.2 -1.4 -3.1 28.7 23.2 106 106 A N G < + 0 0 48 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.622 68.6 79.8 -67.7 -13.4 -0.2 31.0 24.3 107 107 A A G < S+ 0 0 59 -3,-1.2 2,-0.8 1,-0.1 -1,-0.3 0.711 83.2 69.9 -62.7 -25.4 1.3 27.8 25.6 108 108 A W S X> S- 0 0 7 -3,-2.1 4,-2.2 1,-0.2 3,-0.6 -0.880 72.6-161.8-100.3 106.0 2.3 27.2 22.0 109 109 A V H 3> S+ 0 0 73 -2,-0.8 4,-2.7 1,-0.2 5,-0.2 0.805 90.1 53.4 -55.9 -37.3 5.0 29.7 21.0 110 110 A A H 3> S+ 0 0 11 2,-0.2 4,-2.4 1,-0.2 5,-0.4 0.857 109.4 50.2 -69.2 -31.9 4.5 29.2 17.3 111 111 A W H <>>S+ 0 0 12 -3,-0.6 5,-3.3 -6,-0.2 4,-2.3 0.949 112.5 45.8 -66.7 -50.8 0.8 30.0 17.7 112 112 A R H <5S+ 0 0 112 -4,-2.2 -2,-0.2 -7,-0.3 -1,-0.2 0.947 121.7 38.0 -57.6 -46.6 1.5 33.1 19.7 113 113 A N H <5S+ 0 0 113 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.762 133.3 17.0 -81.8 -24.3 4.1 34.3 17.2 114 114 A R H <5S+ 0 0 143 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.569 130.2 31.4-127.9 -8.7 2.6 33.2 13.9 115 115 A b T ><5S+ 0 0 0 -4,-2.3 3,-2.2 -5,-0.4 -3,-0.2 0.755 84.8 99.5-115.3 -47.9 -1.1 32.5 14.3 116 116 A K T 3 + 0 0 80 1,-0.2 3,-1.7 -2,-0.2 4,-0.3 -0.544 52.8 173.2 -78.1 80.6 -6.9 35.4 9.6 120 120 A V G > + 0 0 8 -2,-2.2 3,-1.8 1,-0.3 4,-0.3 0.764 65.3 78.6 -63.2 -20.7 -6.7 31.8 11.0 121 121 A Q G >> S+ 0 0 110 1,-0.3 3,-1.6 -3,-0.2 4,-0.7 0.792 78.1 71.0 -57.6 -29.4 -9.8 31.0 9.0 122 122 A A G X4 S+ 0 0 40 -3,-1.7 3,-0.6 1,-0.3 -1,-0.3 0.820 85.7 69.0 -58.6 -29.6 -7.7 30.7 5.9 123 123 A W G <4 S+ 0 0 58 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.682 108.1 32.9 -65.2 -20.1 -6.3 27.5 7.3 124 124 A I G X4 S+ 0 0 49 -3,-1.6 3,-1.7 -4,-0.3 -1,-0.2 0.410 88.3 127.4-115.9 2.6 -9.5 25.6 6.9 125 125 A R T << S+ 0 0 138 -4,-0.7 3,-0.1 -3,-0.6 -119,-0.0 -0.276 74.5 18.8 -62.0 137.6 -10.7 27.3 3.7 126 126 A G T 3 S+ 0 0 80 1,-0.3 -1,-0.3 -120,-0.0 2,-0.2 0.262 94.0 129.5 86.8 -13.1 -11.7 25.0 0.9 127 127 A a < - 0 0 21 -3,-1.7 2,-1.0 1,-0.1 -1,-0.3 -0.516 63.3-126.7 -80.1 142.3 -12.0 22.0 3.2 128 128 A R 0 0 241 -2,-0.2 -1,-0.1 1,-0.2 -118,-0.1 -0.786 360.0 360.0 -86.0 103.3 -15.1 19.8 3.1 129 129 A L 0 0 100 -2,-1.0 -1,-0.2 -116,-0.0 -2,-0.0 0.488 360.0 360.0-123.8 360.0 -16.0 19.8 6.8