==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-NOV-96 1UIH . 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) . 6597.0 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 . 28 21.7 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 . 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 90 0, 0.0 39,-2.7 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 136.7 2.4 10.4 9.2 2 2 A V B -A 39 0A 98 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.919 360.0-146.6-104.8 107.4 2.4 13.7 7.5 3 3 A F - 0 0 14 35,-2.6 2,-0.3 -2,-0.7 3,-0.0 -0.311 8.0-124.8 -71.4 155.6 -1.1 15.0 7.4 4 4 A G > - 0 0 34 1,-0.1 4,-2.6 -2,-0.0 5,-0.3 -0.683 32.5-107.7 -92.8 156.6 -2.6 17.1 4.6 5 5 A R H > S+ 0 0 59 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.935 117.3 35.9 -50.6 -58.3 -4.2 20.4 5.7 6 6 A a H > S+ 0 0 43 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.835 114.0 58.7 -69.0 -30.2 -7.9 19.4 5.2 7 7 A E H > S+ 0 0 90 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.941 110.0 43.0 -62.6 -46.4 -7.3 15.9 6.4 8 8 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.919 110.5 55.7 -64.8 -46.6 -6.0 17.2 9.7 9 9 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.3 5,-0.2 0.947 109.2 47.8 -50.6 -51.1 -8.8 19.7 10.0 10 10 A A H X S+ 0 0 46 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.896 112.3 48.5 -58.6 -45.0 -11.3 16.9 9.6 11 11 A A H X S+ 0 0 18 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.863 112.6 47.6 -65.3 -39.2 -9.6 14.7 12.2 12 12 A M H <>S+ 0 0 1 -4,-2.8 5,-2.4 2,-0.2 6,-0.3 0.884 112.0 49.9 -70.3 -39.0 -9.3 17.6 14.8 13 13 A K H ><5S+ 0 0 79 -4,-2.5 3,-2.3 -5,-0.3 5,-0.2 0.956 108.7 52.7 -63.1 -47.3 -12.9 18.5 14.3 14 14 A R H 3<5S+ 0 0 185 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.841 106.8 54.7 -56.4 -34.5 -13.9 14.9 14.7 15 15 A H T 3<5S- 0 0 29 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.212 123.2-104.3 -87.4 17.0 -12.0 14.9 18.0 16 16 A G T < 5S+ 0 0 37 -3,-2.3 -3,-0.2 1,-0.1 -2,-0.1 0.706 82.5 125.4 72.3 23.8 -13.9 18.0 19.3 17 17 A L > < + 0 0 0 -5,-2.4 3,-2.1 2,-0.1 2,-0.3 0.696 35.0 107.9 -87.4 -19.3 -11.3 20.7 18.8 18 18 A D T 3 S- 0 0 64 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.457 106.1 -10.9 -63.7 117.4 -13.4 23.1 16.7 19 19 A N T > S+ 0 0 94 4,-1.3 3,-1.9 -2,-0.3 2,-0.3 0.620 89.4 163.8 65.3 21.1 -14.1 26.0 19.1 20 20 A Y B X S-B 23 0B 60 -3,-2.1 3,-1.7 3,-0.7 -1,-0.2 -0.520 79.0 -2.9 -69.9 124.6 -12.8 24.0 22.1 21 21 A R T 3 S- 0 0 145 -2,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.789 136.2 -58.4 61.5 27.2 -12.2 26.7 24.8 22 22 A G T < S+ 0 0 63 -3,-1.9 2,-0.7 1,-0.2 -1,-0.3 0.501 105.5 129.9 83.5 6.5 -13.3 29.3 22.3 23 23 A Y B < -B 20 0B 47 -3,-1.7 -4,-1.3 -6,-0.1 -3,-0.7 -0.837 52.0-137.2-101.5 111.6 -10.6 28.4 19.8 24 24 A S >> - 0 0 39 -2,-0.7 3,-1.7 -5,-0.2 4,-0.9 -0.176 26.9-104.8 -62.5 156.7 -11.8 27.9 16.2 25 25 A L H 3> S+ 0 0 1 1,-0.3 4,-2.2 2,-0.2 3,-0.3 0.802 117.2 65.9 -51.2 -39.5 -10.5 25.1 14.1 26 26 A G H 3> S+ 0 0 1 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.840 97.5 56.3 -54.7 -34.8 -8.3 27.4 12.1 27 27 A N H <> S+ 0 0 21 -3,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.922 108.2 46.1 -63.1 -44.0 -6.2 28.1 15.2 28 28 A W H X S+ 0 0 0 -4,-0.9 4,-2.2 -3,-0.3 -2,-0.2 0.873 113.8 47.4 -67.2 -43.0 -5.4 24.4 15.8 29 29 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.896 112.8 49.5 -66.9 -39.9 -4.5 23.7 12.1 30 30 A b H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 5,-0.2 0.925 111.1 50.6 -64.1 -41.4 -2.3 26.9 12.0 31 31 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.929 111.2 46.9 -62.2 -48.2 -0.6 25.7 15.3 32 32 A A H X>S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 6,-1.1 0.916 109.6 55.8 -61.2 -43.3 0.1 22.2 14.0 33 33 A K H X5S+ 0 0 61 -4,-2.3 4,-1.4 4,-0.2 -2,-0.2 0.934 116.7 33.5 -54.4 -52.3 1.5 23.6 10.7 34 34 A F H <5S+ 0 0 58 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.756 119.6 50.8 -81.0 -22.5 4.0 25.8 12.4 35 35 A E H <5S- 0 0 28 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.923 138.6 -6.0 -79.2 -43.2 4.8 23.5 15.3 36 36 A S H ><5S- 0 0 11 -4,-2.7 3,-1.2 19,-0.4 -3,-0.2 0.376 85.5-115.0-133.3 -1.1 5.4 20.3 13.3 37 37 A N T 3< - 0 0 52 4,-3.2 3,-1.7 -2,-0.3 -1,-0.0 -0.686 25.9-109.2-110.1 164.6 15.1 22.2 24.2 47 47 A T T 3 S+ 0 0 158 1,-0.3 -1,-0.1 -2,-0.2 4,-0.0 0.845 115.7 61.7 -59.9 -37.9 17.9 23.9 26.2 48 48 A D T 3 S- 0 0 77 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.396 121.7-106.2 -71.5 4.7 16.4 22.9 29.5 49 49 A G S < S+ 0 0 28 -3,-1.7 -2,-0.1 1,-0.3 2,-0.1 0.365 83.4 121.0 89.5 -7.8 16.8 19.3 28.5 50 50 A S - 0 0 0 19,-0.1 -4,-3.2 -5,-0.1 2,-0.3 -0.392 52.0-140.7 -82.4 168.6 13.1 18.7 27.8 51 51 A T E -C 45 0C 3 -6,-0.2 9,-2.5 -2,-0.1 2,-0.4 -0.963 5.4-133.4-133.4 145.6 11.8 17.6 24.3 52 52 A D E -CD 44 59C 28 -8,-3.0 -8,-1.4 -2,-0.3 2,-0.4 -0.863 27.6-149.9 -99.2 138.5 8.7 18.6 22.4 53 53 A Y E > -CD 43 58C 21 5,-2.2 5,-2.1 -2,-0.4 3,-0.4 -0.921 30.4 -36.7-124.0 133.7 6.7 15.7 20.8 54 54 A G T > 5S- 0 0 0 -12,-2.6 3,-1.6 -2,-0.4 -13,-0.2 -0.097 97.5 -17.7 74.3-164.1 4.5 15.2 17.8 55 55 A I T 3 5S+ 0 0 3 28,-0.6 -19,-0.4 1,-0.3 -17,-0.3 0.771 141.5 32.7 -52.7 -36.4 2.0 17.1 15.7 56 56 A L T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.247 104.8-124.4-110.2 12.7 1.4 19.7 18.5 57 57 A Q T < 5 - 0 0 13 -3,-1.6 2,-0.4 1,-0.2 -3,-0.2 0.895 34.7-166.6 45.1 55.9 4.9 19.7 19.9 58 58 A I E < -D 53 0C 2 -5,-2.1 -5,-2.2 -6,-0.1 2,-0.3 -0.587 18.3-120.2 -76.4 128.0 3.9 18.8 23.5 59 59 A N E >>> -D 52 0C 30 -2,-0.4 4,-2.3 -7,-0.2 3,-0.7 -0.510 7.2-146.9 -79.1 135.6 6.7 19.3 26.0 60 60 A S T 345S+ 0 0 0 -9,-2.5 14,-0.4 -2,-0.3 6,-0.2 0.615 91.9 71.2 -72.9 -17.2 8.1 16.6 28.3 61 61 A R T 345S+ 0 0 56 11,-0.2 12,-1.6 -10,-0.2 -1,-0.2 0.885 122.1 6.4 -68.4 -29.3 8.9 18.9 31.2 62 62 A W T <45S+ 0 0 127 -3,-0.7 13,-3.0 10,-0.2 -2,-0.2 0.796 131.1 36.4-119.0 -42.1 5.1 19.2 31.9 63 63 A W T <5S+ 0 0 28 -4,-2.3 13,-2.2 11,-0.3 15,-0.3 0.766 108.2 18.7 -97.7 -27.5 2.9 17.0 29.9 64 64 A c < - 0 0 0 -5,-0.6 2,-0.5 11,-0.1 10,-0.4 -0.910 66.9-113.6-143.3 166.2 4.4 13.6 29.2 65 65 A N B +e 79 0D 78 13,-2.4 15,-2.4 -2,-0.3 16,-0.4 -0.901 31.0 162.8-108.8 123.9 7.0 11.2 30.4 66 66 A D - 0 0 36 -2,-0.5 -1,-0.1 13,-0.2 -6,-0.0 0.235 53.1-119.4-117.2 6.5 10.0 10.4 28.2 67 67 A G S S+ 0 0 63 2,-0.1 -2,-0.1 1,-0.1 -7,-0.0 0.562 99.5 70.7 68.8 9.3 12.2 9.0 30.9 68 68 A R + 0 0 119 1,-0.1 -1,-0.1 -8,-0.0 -3,-0.0 0.163 68.0 90.2-142.5 21.5 14.9 11.6 30.4 69 69 A T > - 0 0 9 -9,-0.1 3,-2.2 -19,-0.0 -2,-0.1 -0.811 67.2-147.3-121.2 83.9 13.5 14.9 31.7 70 70 A P T 3 S+ 0 0 116 0, 0.0 -2,-0.0 0, 0.0 -20,-0.0 -0.355 87.3 24.6 -53.5 125.7 14.4 15.2 35.4 71 71 A G T 3 S+ 0 0 64 1,-0.3 -10,-0.0 2,-0.0 0, 0.0 0.508 83.4 158.7 96.3 4.6 11.5 17.1 37.0 72 72 A S < - 0 0 32 -3,-2.2 -1,-0.3 1,-0.1 -10,-0.2 -0.321 30.3-157.5 -58.6 144.4 8.9 16.2 34.4 73 73 A R - 0 0 159 -12,-1.6 -11,-0.2 -13,-0.2 -1,-0.1 0.674 11.7-151.9 -98.2 -20.7 5.4 16.5 35.8 74 74 A N > + 0 0 37 -10,-0.4 3,-1.6 -14,-0.4 -11,-0.3 0.856 25.8 169.3 47.3 52.0 3.6 14.2 33.3 75 75 A L T 3 S+ 0 0 49 -13,-3.0 -12,-0.2 1,-0.3 -11,-0.1 0.744 74.4 49.2 -65.3 -24.7 0.3 16.0 33.5 76 76 A d T 3 S- 0 0 13 -13,-2.2 -1,-0.3 2,-0.2 -12,-0.1 0.508 103.6-134.2 -92.0 -2.8 -1.3 14.1 30.6 77 77 A N < + 0 0 130 -3,-1.6 -13,-0.1 -14,-0.2 -2,-0.1 0.928 63.1 110.7 49.3 60.3 -0.2 10.7 32.2 78 78 A I S S- 0 0 38 -15,-0.3 -13,-2.4 16,-0.0 2,-0.3 -0.981 75.1-100.3-154.7 154.8 1.2 9.2 29.0 79 79 A P B > -e 65 0D 72 0, 0.0 3,-1.7 0, 0.0 4,-0.4 -0.609 37.2-122.9 -76.5 140.2 4.7 8.2 27.6 80 80 A c G > S+ 0 0 1 -15,-2.4 3,-1.6 1,-0.3 -14,-0.1 0.792 108.1 69.0 -55.3 -29.0 5.8 11.0 25.1 81 81 A S G > S+ 0 0 86 -16,-0.4 3,-1.9 1,-0.3 4,-0.3 0.804 85.8 67.8 -62.2 -26.9 6.1 8.3 22.4 82 82 A A G X S+ 0 0 36 -3,-1.7 3,-0.8 1,-0.3 -1,-0.3 0.759 92.4 62.6 -62.6 -23.4 2.3 7.9 22.4 83 83 A L G < S+ 0 0 2 -3,-1.6 -28,-0.6 -4,-0.4 -1,-0.3 0.430 93.9 61.6 -80.8 -3.2 2.2 11.5 21.0 84 84 A L G < S+ 0 0 43 -3,-1.9 -1,-0.2 -30,-0.2 -2,-0.2 0.442 78.2 121.0-101.7 -4.0 4.1 10.5 17.8 85 85 A S S < S- 0 0 53 -3,-0.8 6,-0.1 -4,-0.3 -3,-0.0 -0.106 73.2-122.4 -57.6 157.2 1.4 8.0 16.6 86 86 A S S S+ 0 0 74 2,-0.0 2,-0.7 -45,-0.0 -1,-0.1 0.630 101.7 75.6 -73.6 -18.9 -0.3 8.3 13.3 87 87 A D S > S- 0 0 82 1,-0.1 3,-0.5 -47,-0.0 4,-0.3 -0.899 74.9-156.3 -94.8 119.6 -3.6 8.5 15.2 88 88 A I T 3> + 0 0 5 -2,-0.7 4,-2.7 1,-0.2 5,-0.2 0.418 62.6 106.0 -81.7 5.3 -3.8 11.9 16.8 89 89 A T H 3> S+ 0 0 40 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.903 80.6 46.4 -50.7 -51.8 -6.2 11.0 19.7 90 90 A A H <> S+ 0 0 29 -3,-0.5 4,-2.0 -8,-0.3 -1,-0.2 0.910 113.6 49.6 -59.2 -43.5 -3.5 11.1 22.5 91 91 A S H > S+ 0 0 3 -4,-0.3 4,-2.4 -9,-0.2 -1,-0.2 0.903 112.7 47.4 -62.9 -41.9 -2.2 14.4 21.2 92 92 A V H X S+ 0 0 2 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.938 111.1 49.7 -66.2 -44.6 -5.7 15.9 21.0 93 93 A N H X S+ 0 0 75 -4,-2.8 4,-0.9 -5,-0.2 -1,-0.2 0.868 114.8 44.7 -63.1 -38.2 -6.7 14.7 24.5 94 94 A d H >X S+ 0 0 2 -4,-2.0 4,-2.2 -5,-0.2 3,-0.6 0.911 109.3 56.1 -71.9 -40.5 -3.5 16.1 26.0 95 95 A A H 3X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.3 5,-0.2 0.860 102.2 57.6 -58.8 -36.8 -3.9 19.4 24.1 96 96 A K H 3X S+ 0 0 45 -4,-2.1 4,-0.8 1,-0.2 -1,-0.3 0.869 108.1 46.4 -62.6 -36.0 -7.3 19.9 25.6 97 97 A K H << S+ 0 0 110 -4,-0.9 4,-0.4 -3,-0.6 3,-0.3 0.931 112.7 50.3 -71.4 -42.6 -5.8 19.7 29.0 98 98 A I H >< S+ 0 0 8 -4,-2.2 3,-1.9 1,-0.2 5,-0.4 0.942 109.4 48.6 -60.0 -52.6 -3.0 22.2 28.1 99 99 A V H 3< S+ 0 0 6 -4,-2.8 5,-0.5 1,-0.3 3,-0.4 0.730 110.7 53.9 -63.8 -20.7 -5.2 24.8 26.5 100 100 A S T 3< S+ 0 0 39 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.2 0.515 83.5 92.1 -89.8 -5.3 -7.4 24.6 29.7 101 101 A D S < S- 0 0 112 -3,-1.9 -1,-0.2 -4,-0.4 -2,-0.1 0.357 109.3 -89.3 -75.3 5.5 -4.4 25.2 32.0 102 102 A G S S+ 0 0 65 -3,-0.4 -1,-0.1 -4,-0.1 -3,-0.1 0.038 115.2 69.4 116.7 -30.7 -4.8 29.0 32.2 103 103 A N S > S- 0 0 122 -5,-0.4 3,-1.7 1,-0.3 4,-0.1 0.335 80.5-152.5-105.5 10.0 -2.8 30.4 29.3 104 104 A G G > - 0 0 10 -5,-0.5 3,-1.2 1,-0.3 -1,-0.3 -0.231 66.9 -19.7 56.0-143.4 -5.0 29.2 26.5 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.2 2,-0.1 7,-0.3 0.503 115.1 92.6 -76.8 -1.7 -3.2 28.6 23.2 106 106 A N G < + 0 0 49 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.665 68.0 80.2 -64.6 -13.5 -0.2 30.9 24.3 107 107 A A G < S+ 0 0 56 -3,-1.2 2,-0.7 1,-0.1 -1,-0.3 0.682 82.7 70.1 -63.5 -21.4 1.2 27.5 25.5 108 108 A W S <> S- 0 0 7 -3,-2.2 4,-2.3 1,-0.2 3,-0.4 -0.897 72.3-161.8-102.8 106.3 2.2 27.0 21.9 109 109 A V H > S+ 0 0 71 -2,-0.7 4,-2.4 1,-0.2 5,-0.2 0.855 90.2 51.9 -56.2 -39.8 5.0 29.5 21.0 110 110 A A H > S+ 0 0 12 2,-0.2 4,-2.3 1,-0.2 5,-0.4 0.856 109.5 50.7 -67.4 -33.5 4.4 29.1 17.2 111 111 A W H >>S+ 0 0 12 -3,-0.4 5,-3.3 -6,-0.2 4,-2.3 0.948 111.7 47.0 -66.7 -50.3 0.7 29.9 17.6 112 112 A R H <5S+ 0 0 102 -4,-2.3 -2,-0.2 -7,-0.3 -1,-0.2 0.919 121.6 37.2 -56.5 -43.4 1.4 33.0 19.7 113 113 A N H <5S+ 0 0 116 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.721 133.6 17.8 -86.8 -21.3 4.0 34.2 17.2 114 114 A R H <5S+ 0 0 144 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.549 130.4 31.0-128.0 -12.0 2.5 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 0.742 85.0 100.0-113.7 -44.0 -1.2 32.5 14.3 116 116 A K T 3 + 0 0 106 -2,-0.2 3,-1.8 1,-0.2 4,-0.2 -0.529 50.9 174.0 -82.3 81.0 -6.9 35.3 9.7 120 120 A V G > + 0 0 16 -2,-2.0 3,-1.8 1,-0.3 4,-0.2 0.706 63.9 79.7 -63.5 -16.8 -6.9 31.7 10.9 121 121 A Q G > S+ 0 0 106 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.804 78.8 71.5 -62.6 -25.5 -10.0 30.9 8.9 122 122 A A G X S+ 0 0 32 -3,-1.8 3,-1.1 1,-0.3 -1,-0.3 0.776 84.4 69.5 -59.7 -27.0 -7.8 30.6 5.8 123 123 A W G < S+ 0 0 49 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.609 105.3 38.3 -67.7 -15.0 -6.3 27.4 7.2 124 124 A I G X S+ 0 0 44 -3,-1.8 3,-1.7 -4,-0.2 -1,-0.2 0.277 84.4 136.3-119.3 12.4 -9.5 25.5 6.6 125 125 A R T < S+ 0 0 141 -3,-1.1 3,-0.1 1,-0.3 -119,-0.1 -0.274 74.5 10.8 -60.6 140.2 -10.5 27.1 3.3 126 126 A G T 3 S+ 0 0 88 1,-0.2 -1,-0.3 -120,-0.0 2,-0.2 0.371 94.6 133.9 73.9 -5.7 -11.8 24.7 0.7 127 127 A a < - 0 0 21 -3,-1.7 2,-0.9 1,-0.1 -1,-0.2 -0.559 59.0-128.3 -81.7 142.5 -12.1 21.8 3.2 128 128 A R 0 0 238 -2,-0.2 -1,-0.1 1,-0.2 -118,-0.1 -0.798 360.0 360.0 -89.0 105.5 -15.2 19.6 3.3 129 129 A L 0 0 102 -2,-0.9 -1,-0.2 -5,-0.1 -2,-0.0 0.608 360.0 360.0-120.7 360.0 -16.1 19.7 7.0