==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-MAY-11 3RU5 . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR T.C.LEEPER,M.J.PANZNER,S.M.BILINOVICH . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6566.0 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 . 13 10.1 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 . 7 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 19.4 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 . 3 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 84 0, 0.0 39,-2.9 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 133.4 2.0 -9.9 19.2 2 2 A V B -A 39 0A 100 37,-0.2 37,-0.2 38,-0.1 2,-0.1 -0.923 360.0-148.2-100.8 109.8 2.1 -13.3 21.0 3 3 A F - 0 0 13 35,-2.6 2,-0.2 -2,-0.7 3,-0.0 -0.431 9.7-122.6 -72.5 147.2 -1.5 -14.6 21.2 4 4 A G > - 0 0 35 -2,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.548 33.5-108.3 -73.1 158.6 -2.9 -16.7 24.0 5 5 A R H > S+ 0 0 88 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.940 118.3 37.9 -56.1 -54.0 -4.3 -20.0 22.8 6 6 A a H > S+ 0 0 38 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.839 113.6 57.7 -71.7 -28.7 -8.0 -19.2 23.3 7 7 A E H > S+ 0 0 91 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.932 110.2 43.5 -64.6 -45.4 -7.4 -15.6 22.1 8 8 A L H X S+ 0 0 0 -4,-2.6 4,-3.1 2,-0.2 5,-0.2 0.904 109.8 56.1 -67.7 -40.0 -6.1 -16.9 18.8 9 9 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.933 109.8 47.0 -56.0 -44.6 -8.9 -19.5 18.5 10 10 A A H X S+ 0 0 41 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.909 112.1 48.7 -64.9 -43.9 -11.4 -16.7 18.8 11 11 A A H X S+ 0 0 13 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.917 113.5 47.6 -62.0 -43.4 -9.6 -14.5 16.3 12 12 A M H <>S+ 0 0 1 -4,-3.1 5,-2.3 2,-0.2 6,-0.3 0.899 112.0 50.5 -64.8 -40.3 -9.4 -17.4 13.8 13 13 A K H ><5S+ 0 0 84 -4,-2.6 3,-1.8 -5,-0.2 5,-0.2 0.931 108.6 49.9 -63.5 -45.9 -13.1 -18.3 14.4 14 14 A R H 3<5S+ 0 0 172 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.837 108.5 55.9 -64.3 -27.4 -14.3 -14.7 13.8 15 15 A H T 3<5S- 0 0 28 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.339 122.3-104.8 -87.6 4.6 -12.2 -14.8 10.6 16 16 A G T < 5S+ 0 0 35 -3,-1.8 -3,-0.2 -4,-0.1 -2,-0.1 0.656 82.0 124.5 88.7 20.8 -14.0 -17.9 9.2 17 17 A L > < + 0 0 0 -5,-2.3 3,-2.1 2,-0.1 2,-0.4 0.725 37.1 106.5 -85.4 -20.1 -11.4 -20.6 9.8 18 18 A D T 3 S- 0 0 75 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.461 106.4 -8.5 -65.5 117.2 -13.4 -23.0 11.9 19 19 A N T > S+ 0 0 105 4,-1.4 3,-2.5 -2,-0.4 -1,-0.3 0.591 90.1 165.1 68.4 15.2 -14.2 -25.9 9.5 20 20 A Y B X S-B 23 0B 58 -3,-2.1 3,-2.0 3,-0.7 -1,-0.2 -0.500 81.2 -6.6 -64.4 124.1 -12.8 -23.9 6.5 21 21 A R T 3 S- 0 0 148 -2,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.795 135.2 -60.0 47.7 34.4 -12.4 -26.6 3.8 22 22 A G T < S+ 0 0 54 -3,-2.5 2,-0.7 1,-0.2 -1,-0.3 0.468 103.8 132.4 81.7 5.0 -13.4 -29.1 6.5 23 23 A Y B < -B 20 0B 48 -3,-2.0 -4,-1.4 -6,-0.1 -3,-0.7 -0.808 53.4-133.7 -94.5 111.9 -10.5 -28.2 8.9 24 24 A S >> - 0 0 42 -2,-0.7 3,-1.5 -5,-0.2 4,-1.0 -0.161 25.7-103.8 -61.1 156.7 -11.8 -27.7 12.4 25 25 A L H 3> S+ 0 0 0 1,-0.3 4,-2.2 2,-0.2 3,-0.5 0.842 119.1 63.4 -50.0 -40.9 -10.6 -24.7 14.4 26 26 A G H 3> S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.824 97.8 56.9 -57.5 -34.9 -8.3 -26.9 16.5 27 27 A N H <> S+ 0 0 20 -3,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.910 108.9 45.5 -59.3 -44.8 -6.3 -27.8 13.4 28 28 A W H X S+ 0 0 0 -4,-1.0 4,-2.3 -3,-0.5 -2,-0.2 0.874 114.0 47.8 -68.7 -38.8 -5.6 -24.1 12.7 29 29 A V H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.932 112.8 49.0 -68.7 -44.6 -4.7 -23.4 16.4 30 30 A b H X S+ 0 0 0 -4,-2.6 4,-2.2 -5,-0.2 5,-0.2 0.920 110.8 50.9 -57.7 -45.2 -2.4 -26.4 16.4 31 31 A A H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 5,-0.2 0.946 111.2 47.5 -60.8 -46.0 -0.8 -25.4 13.2 32 32 A A H X>S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 6,-1.3 0.887 109.0 55.3 -63.7 -38.7 -0.1 -21.8 14.5 33 33 A K H X5S+ 0 0 63 -4,-2.4 4,-1.6 4,-0.2 -1,-0.2 0.948 116.2 35.1 -57.3 -51.1 1.3 -23.2 17.8 34 34 A F H <5S+ 0 0 58 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.624 120.4 48.5 -86.6 -11.6 3.9 -25.3 16.0 35 35 A E H <5S- 0 0 31 -4,-1.8 -2,-0.2 20,-0.2 -3,-0.2 0.869 137.8 -3.7 -86.3 -44.6 4.6 -22.9 13.1 36 36 A S H ><5S- 0 0 10 -4,-2.5 3,-1.5 19,-0.4 -3,-0.2 0.360 85.4-115.7-132.9 -0.1 5.1 -19.7 15.1 37 37 A N T 3< - 0 0 44 4,-3.1 3,-1.9 -2,-0.3 -1,-0.0 -0.625 24.4-112.3 -95.4 159.1 14.3 -21.7 4.3 47 47 A T T 3 S+ 0 0 162 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.784 116.4 58.8 -63.0 -27.1 17.2 -23.6 2.7 48 48 A D T 3 S- 0 0 78 1,-0.0 -1,-0.3 2,-0.0 3,-0.1 0.486 123.4-102.9 -78.8 -6.0 16.1 -22.5 -0.8 49 49 A G S < S+ 0 0 21 -3,-1.9 -2,-0.1 1,-0.4 2,-0.0 0.295 85.7 118.8 99.2 -11.6 16.4 -18.9 0.2 50 50 A S - 0 0 0 19,-0.1 -4,-3.1 -5,-0.1 -1,-0.4 -0.271 54.4-137.0 -71.5 171.6 12.7 -18.2 0.7 51 51 A T E -C 45 0C 2 -6,-0.3 9,-1.8 -3,-0.1 2,-0.4 -0.989 2.7-133.6-134.9 146.2 11.4 -17.1 4.1 52 52 A D E -CD 44 59C 26 -8,-3.1 -8,-2.0 -2,-0.3 2,-0.4 -0.847 28.7-156.2 -98.5 138.0 8.3 -18.1 6.1 53 53 A Y E > -CD 43 58C 21 5,-2.1 5,-2.3 -2,-0.4 3,-0.4 -0.939 30.5 -25.1-126.7 131.2 6.3 -15.2 7.7 54 54 A G T > 5S- 0 0 0 -12,-2.7 3,-1.8 -2,-0.4 30,-0.2 -0.100 99.2 -21.7 84.6-167.1 4.0 -14.7 10.6 55 55 A I T 3 5S+ 0 0 2 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.753 141.7 31.5 -57.3 -31.1 1.5 -16.7 12.7 56 56 A L T 3 5S- 0 0 1 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.162 106.5-120.9-117.2 17.1 1.1 -19.4 10.0 57 57 A Q T < 5 - 0 0 10 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.895 35.9-163.6 50.6 54.8 4.6 -19.2 8.5 58 58 A I E < -D 53 0C 1 -5,-2.3 -5,-2.1 -6,-0.1 -1,-0.2 -0.572 16.0-120.7 -77.8 131.7 3.5 -18.3 5.0 59 59 A N E > -D 52 0C 38 -2,-0.3 4,-1.8 -7,-0.2 5,-0.5 -0.405 10.9-152.0 -78.7 140.9 6.2 -18.9 2.4 60 60 A S T 4 S+ 0 0 0 -9,-1.8 13,-0.2 3,-0.2 6,-0.2 0.584 90.0 79.3 -80.3 -12.9 7.7 -16.2 0.1 61 61 A R T 4 S- 0 0 49 -10,-0.2 12,-2.0 11,-0.2 -1,-0.2 0.842 121.8 -3.9 -60.3 -33.2 8.5 -19.0 -2.5 62 62 A W T 4 S+ 0 0 136 -3,-0.3 13,-2.7 10,-0.2 -2,-0.2 0.641 133.0 44.3-127.8 -29.4 4.8 -19.0 -3.5 63 63 A W B < S+E 74 0D 24 -4,-1.8 13,-1.8 11,-0.3 15,-0.3 0.668 104.4 16.9-112.7 -22.3 2.6 -16.6 -1.5 64 64 A c - 0 0 0 9,-0.5 2,-0.5 -5,-0.5 -1,-0.1 -0.960 65.6-113.7-150.6 162.1 4.1 -13.2 -0.9 65 65 A N B +f 79 0E 91 13,-2.2 15,-2.3 -2,-0.3 16,-0.4 -0.916 29.3 167.6-104.4 121.0 6.8 -10.8 -2.1 66 66 A D - 0 0 34 -2,-0.5 -1,-0.1 13,-0.2 -6,-0.0 0.263 52.9-115.8-112.5 8.7 9.7 -10.1 0.4 67 67 A G S S+ 0 0 69 2,-0.1 -2,-0.1 1,-0.1 0, 0.0 0.462 103.5 66.6 73.7 2.8 12.0 -8.5 -2.1 68 68 A R + 0 0 123 1,-0.1 -1,-0.1 -17,-0.0 -3,-0.0 0.147 69.4 88.9-142.8 23.5 14.6 -11.2 -1.7 69 69 A T > - 0 0 9 -9,-0.1 3,-1.2 -19,-0.0 -2,-0.1 -0.732 65.6-156.8-120.4 81.2 13.2 -14.5 -3.1 70 70 A P T 3 S+ 0 0 112 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.258 71.2 15.5 -64.2 144.1 14.1 -14.4 -6.8 71 71 A G T 3 S+ 0 0 86 1,-0.2 2,-0.1 0, 0.0 -10,-0.0 0.665 99.7 124.1 72.4 19.1 12.0 -16.5 -9.2 72 72 A S < - 0 0 32 -3,-1.2 2,-0.2 1,-0.1 -1,-0.2 -0.401 56.5-115.2-100.9 179.0 9.2 -16.9 -6.8 73 73 A R - 0 0 150 -12,-2.0 -9,-0.5 -13,-0.2 3,-0.1 -0.719 2.8-151.2-113.0 166.5 5.5 -16.2 -6.9 74 74 A N B > +E 63 0D 45 -2,-0.2 3,-1.9 -11,-0.2 -11,-0.3 -0.546 30.0 160.8-131.8 62.0 3.2 -13.8 -5.0 75 75 A L T 3 S+ 0 0 52 -13,-2.7 -12,-0.2 1,-0.3 -11,-0.1 0.708 74.9 50.8 -67.4 -22.6 -0.0 -15.7 -5.1 76 76 A d T 3 S- 0 0 22 -13,-1.8 -1,-0.3 2,-0.2 -12,-0.1 0.472 104.7-132.1 -89.5 -1.6 -1.6 -13.8 -2.2 77 77 A N < + 0 0 129 -3,-1.9 -13,-0.1 1,-0.2 -2,-0.1 0.909 65.1 114.2 53.4 52.0 -0.6 -10.5 -3.8 78 78 A I S S- 0 0 33 -15,-0.3 -13,-2.2 16,-0.0 2,-0.2 -0.993 73.6-105.3-146.1 148.7 0.9 -9.0 -0.7 79 79 A P B > -f 65 0E 74 0, 0.0 3,-1.7 0, 0.0 4,-0.3 -0.596 36.3-124.3 -70.0 143.3 4.2 -7.9 0.7 80 80 A c G > S+ 0 0 0 -15,-2.3 3,-2.2 1,-0.3 -14,-0.1 0.836 108.5 68.9 -57.3 -32.2 5.4 -10.6 3.2 81 81 A S G > S+ 0 0 83 -16,-0.4 3,-1.7 1,-0.3 -1,-0.3 0.782 87.0 68.4 -58.7 -27.9 5.7 -7.9 5.9 82 82 A A G X S+ 0 0 33 -3,-1.7 3,-0.8 1,-0.3 -1,-0.3 0.720 90.6 62.5 -59.0 -24.6 1.9 -7.7 5.8 83 83 A L G < S+ 0 0 2 -3,-2.2 -28,-0.5 -4,-0.3 -1,-0.3 0.405 93.7 64.4 -83.5 2.5 1.8 -11.2 7.3 84 84 A L G < S+ 0 0 46 -3,-1.7 -1,-0.2 -30,-0.2 -2,-0.2 0.414 73.7 122.2-107.9 -1.6 3.6 -9.9 10.4 85 85 A S S < S- 0 0 58 -3,-0.8 6,-0.1 2,-0.2 -3,-0.0 -0.144 73.4-119.0 -60.7 155.0 0.9 -7.5 11.7 86 86 A S S S+ 0 0 73 2,-0.0 2,-0.5 -45,-0.0 -1,-0.1 0.742 103.5 71.8 -67.1 -22.0 -0.6 -7.9 15.2 87 87 A D S S- 0 0 67 1,-0.1 3,-0.4 -47,-0.0 4,-0.3 -0.854 76.8-150.1 -97.4 134.6 -3.9 -8.4 13.4 88 88 A I > + 0 0 3 -2,-0.5 4,-3.0 1,-0.2 5,-0.2 0.386 64.3 108.3 -87.5 2.8 -4.2 -11.7 11.6 89 89 A T H > S+ 0 0 50 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.885 82.1 44.7 -47.4 -53.5 -6.5 -10.7 8.7 90 90 A A H > S+ 0 0 28 -3,-0.4 4,-2.2 -8,-0.3 -1,-0.2 0.911 114.8 48.8 -62.7 -42.9 -3.8 -10.9 6.0 91 91 A S H > S+ 0 0 4 -4,-0.3 4,-2.7 -9,-0.3 -1,-0.2 0.915 113.0 47.9 -62.4 -43.2 -2.5 -14.2 7.2 92 92 A V H X S+ 0 0 2 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.931 111.8 48.2 -63.5 -47.0 -6.0 -15.7 7.4 93 93 A N H X S+ 0 0 90 -4,-2.6 4,-1.1 -5,-0.2 -1,-0.2 0.891 115.1 45.4 -63.6 -40.0 -7.0 -14.6 3.9 94 94 A d H X S+ 0 0 5 -4,-2.2 4,-2.4 -5,-0.2 3,-0.4 0.921 109.8 55.2 -68.0 -42.8 -3.8 -15.9 2.5 95 95 A A H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.869 102.6 57.3 -56.7 -38.4 -4.1 -19.2 4.4 96 96 A K H X S+ 0 0 43 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.883 108.7 46.0 -61.5 -38.5 -7.6 -19.7 2.9 97 97 A K H < S+ 0 0 100 -4,-1.1 3,-0.3 -3,-0.4 4,-0.2 0.918 113.7 49.3 -68.6 -42.6 -6.0 -19.5 -0.6 98 98 A I H >< S+ 0 0 4 -4,-2.4 3,-1.8 1,-0.2 5,-0.4 0.949 110.3 48.0 -61.1 -51.2 -3.2 -21.9 0.4 99 99 A V H 3< S+ 0 0 6 -4,-2.9 5,-0.5 1,-0.3 3,-0.4 0.721 111.4 54.2 -66.4 -18.4 -5.4 -24.5 2.0 100 100 A S T 3< S+ 0 0 41 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.2 0.376 83.1 89.1 -93.1 0.3 -7.7 -24.4 -1.1 101 101 A D S < S- 0 0 69 -3,-1.8 -1,-0.2 -4,-0.2 -2,-0.1 0.445 111.2 -86.1 -86.5 -1.3 -4.9 -25.0 -3.7 102 102 A G S S+ 0 0 69 -3,-0.4 -3,-0.1 -4,-0.1 -2,-0.1 -0.004 116.2 70.4 129.2 -30.2 -5.1 -28.8 -3.7 103 103 A N S > S- 0 0 100 -5,-0.4 3,-1.5 1,-0.3 4,-0.1 0.412 78.0-156.7-101.1 -3.0 -2.9 -30.0 -0.9 104 104 A G G > - 0 0 10 -5,-0.5 3,-1.3 1,-0.3 -1,-0.3 -0.230 65.9 -20.9 59.7-146.4 -5.0 -28.9 2.1 105 105 A M G > S+ 0 0 0 1,-0.3 3,-1.9 2,-0.1 7,-0.3 0.549 116.5 92.1 -76.7 -1.9 -3.3 -28.3 5.4 106 106 A N G < + 0 0 48 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.703 68.5 77.8 -62.9 -17.1 -0.4 -30.5 4.2 107 107 A A G < S+ 0 0 47 -3,-1.3 2,-0.9 1,-0.1 -1,-0.3 0.816 83.0 73.1 -57.2 -32.5 1.2 -27.2 3.0 108 108 A W S <> S- 0 0 8 -3,-1.9 4,-2.3 1,-0.2 3,-0.3 -0.792 71.2-161.8 -90.3 107.0 2.1 -26.6 6.6 109 109 A V H > S+ 0 0 82 -2,-0.9 4,-2.3 1,-0.2 5,-0.2 0.885 91.2 52.1 -53.5 -44.7 4.9 -28.9 7.6 110 110 A A H > S+ 0 0 13 1,-0.2 4,-2.0 2,-0.2 5,-0.5 0.881 108.6 51.4 -64.3 -36.4 4.3 -28.5 11.3 111 111 A W H >>S+ 0 0 12 -3,-0.3 5,-3.1 -6,-0.2 4,-2.3 0.964 111.1 46.6 -63.6 -48.7 0.6 -29.4 10.8 112 112 A R H <5S+ 0 0 103 -4,-2.3 -2,-0.2 -7,-0.3 -1,-0.2 0.888 121.6 37.3 -60.7 -38.7 1.4 -32.6 8.9 113 113 A N H <5S+ 0 0 111 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.692 132.7 19.4 -90.3 -18.0 4.0 -33.7 11.4 114 114 A R H <5S+ 0 0 140 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.2 0.553 130.9 27.7-131.0 -14.4 2.5 -32.6 14.7 115 115 A b T ><5S+ 0 0 0 -4,-2.3 3,-2.4 -5,-0.5 5,-0.2 0.722 85.6 99.8-120.0 -42.6 -1.3 -32.0 14.3 116 116 A K T 3 + 0 0 87 1,-0.2 3,-1.7 -2,-0.2 4,-0.2 -0.515 53.0 170.1 -80.3 76.0 -6.8 -34.9 19.0 120 120 A V G > + 0 0 13 -2,-2.1 3,-1.7 1,-0.3 4,-0.3 0.680 62.9 78.0 -69.4 -16.8 -6.8 -31.3 17.8 121 121 A Q G > S+ 0 0 131 1,-0.3 3,-1.9 2,-0.2 4,-0.4 0.804 79.9 72.9 -58.5 -28.9 -9.9 -30.4 19.8 122 122 A A G X S+ 0 0 35 -3,-1.7 3,-1.1 1,-0.3 -1,-0.3 0.807 84.4 67.4 -55.5 -29.2 -7.6 -30.2 22.8 123 123 A W G < S+ 0 0 54 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.710 106.6 38.3 -68.6 -19.1 -6.3 -27.0 21.3 124 124 A I G X S+ 0 0 48 -3,-1.9 3,-2.0 -4,-0.3 -1,-0.3 0.304 84.2 139.5-111.9 10.6 -9.6 -25.2 21.9 125 125 A R T < S+ 0 0 143 -3,-1.1 3,-0.1 -4,-0.4 -119,-0.1 -0.281 77.2 5.0 -56.8 129.5 -10.3 -26.9 25.3 126 126 A G T 3 S+ 0 0 83 1,-0.2 2,-0.3 -120,-0.0 -1,-0.3 0.346 94.9 139.6 79.5 -3.9 -11.8 -24.4 27.7 127 127 A a < - 0 0 19 -3,-2.0 2,-0.8 1,-0.1 -1,-0.2 -0.538 55.3-130.9 -79.8 133.2 -12.0 -21.6 25.2 128 128 A R 0 0 235 -2,-0.3 -118,-0.1 1,-0.2 -1,-0.1 -0.761 360.0 360.0 -78.7 112.9 -15.1 -19.4 25.2 129 129 A L 0 0 90 -2,-0.8 -1,-0.2 -116,-0.0 -2,-0.0 0.517 360.0 360.0-137.1 360.0 -15.9 -19.4 21.5