==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-JUL-05 2A7F . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR C.MUELLER-DIECKMANN,S.PANJIKAR,P.A.TUCKER,M.S.WEISS . 128 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6639.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 86 67.2 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 8.6 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 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 20.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 25.0 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 82 0, 0.0 39,-2.9 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 140.1 2.1 10.7 8.7 2 2 A V B -A 39 0A 98 37,-0.2 37,-0.2 38,-0.1 2,-0.2 -0.944 360.0-148.1-104.5 111.4 2.2 14.1 7.0 3 3 A F - 0 0 14 35,-2.6 2,-0.2 -2,-0.7 3,-0.0 -0.457 8.6-123.1 -72.5 149.6 -1.3 15.4 7.0 4 4 A G > - 0 0 34 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.488 32.7-108.6 -77.8 158.6 -2.9 17.6 4.4 5 5 A R H > S+ 0 0 92 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.962 119.1 36.0 -58.4 -55.7 -4.3 20.9 5.7 6 6 A a H > S+ 0 0 44 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.891 114.2 58.5 -66.6 -38.6 -8.0 19.9 5.2 7 7 A E H > S+ 0 0 89 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.912 110.0 43.7 -55.1 -44.5 -7.3 16.2 6.2 8 8 A L H X S+ 0 0 0 -4,-2.7 4,-3.1 2,-0.2 5,-0.2 0.921 110.1 54.7 -69.4 -43.3 -6.0 17.5 9.6 9 9 A A H X S+ 0 0 4 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.945 110.5 47.8 -51.7 -50.7 -8.8 19.9 10.1 10 10 A A H X S+ 0 0 55 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.909 112.4 47.7 -55.8 -45.4 -11.2 17.0 9.6 11 11 A A H X S+ 0 0 18 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.897 111.8 51.2 -66.2 -39.3 -9.3 14.8 12.0 12 12 A M H <>S+ 0 0 1 -4,-3.1 5,-2.5 2,-0.2 6,-0.4 0.917 112.0 46.1 -64.0 -40.2 -9.2 17.6 14.6 13 13 A K H ><5S+ 0 0 132 -4,-2.3 3,-2.0 1,-0.2 -2,-0.2 0.911 108.7 55.7 -70.2 -41.2 -12.9 18.2 14.3 14 14 A R H 3<5S+ 0 0 189 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.828 108.9 48.5 -61.1 -32.9 -13.6 14.4 14.6 15 15 A H T 3<5S- 0 0 29 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.204 122.1-106.5 -95.0 17.1 -11.6 14.4 17.9 16 16 A G T < 5S+ 0 0 38 -3,-2.0 -3,-0.2 -5,-0.1 -2,-0.1 0.707 83.1 122.9 71.2 27.6 -13.6 17.4 19.3 17 17 A L > < + 0 0 0 -5,-2.5 3,-2.3 -6,-0.1 2,-0.3 0.700 37.8 111.0 -88.6 -21.3 -10.9 20.1 19.0 18 18 A D T 3 S- 0 0 64 -6,-0.4 6,-0.2 1,-0.3 4,-0.1 -0.410 101.7 -8.6 -60.1 116.9 -13.0 22.4 16.9 19 19 A N T > S+ 0 0 97 4,-1.4 3,-2.1 -2,-0.3 -1,-0.3 0.596 90.3 163.8 60.4 21.6 -13.9 25.3 19.2 20 20 A Y B X S-B 23 0B 74 -3,-2.3 3,-1.8 3,-0.6 -1,-0.2 -0.480 76.4 -3.0 -70.2 130.6 -12.4 23.6 22.2 21 21 A R T 3 S- 0 0 153 -2,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.761 135.0 -61.5 52.5 28.0 -11.9 26.2 25.0 22 22 A G T < S+ 0 0 57 -3,-2.1 2,-0.7 1,-0.2 -1,-0.3 0.467 102.8 132.3 86.4 2.6 -13.1 28.8 22.4 23 23 A Y B < -B 20 0B 49 -3,-1.8 -4,-1.4 -6,-0.2 -3,-0.6 -0.817 52.7-133.6 -96.4 112.7 -10.3 28.2 19.8 24 24 A S >> - 0 0 42 -2,-0.7 3,-1.4 -5,-0.2 4,-1.2 -0.190 26.5-102.5 -58.6 156.4 -11.7 27.8 16.3 25 25 A L H 3> S+ 0 0 15 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.797 120.1 61.3 -50.7 -38.3 -10.4 24.9 14.1 26 26 A G H 3> S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.859 99.3 56.7 -63.0 -31.2 -8.2 27.3 12.1 27 27 A N H <> S+ 0 0 22 -3,-1.4 4,-2.6 2,-0.2 -1,-0.2 0.937 110.0 44.0 -59.9 -47.8 -6.3 28.1 15.3 28 28 A W H X S+ 0 0 0 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.879 114.6 48.5 -64.5 -44.7 -5.4 24.4 15.9 29 29 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.928 112.1 49.3 -60.7 -45.4 -4.5 23.9 12.2 30 30 A b H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 5,-0.2 0.931 110.9 50.5 -61.2 -45.1 -2.3 27.0 12.2 31 31 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-0.3 0.925 112.0 46.9 -55.1 -48.3 -0.6 25.8 15.4 32 32 A A H X>S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 6,-1.3 0.886 109.1 56.6 -64.7 -39.1 0.0 22.3 13.9 33 33 A K H X5S+ 0 0 62 -4,-2.5 4,-1.6 4,-0.2 -1,-0.2 0.953 116.4 33.1 -55.8 -51.0 1.3 24.0 10.7 34 34 A F H <5S+ 0 0 57 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.715 120.9 49.5 -87.8 -20.2 4.0 26.0 12.5 35 35 A E H <5S- 0 0 37 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 0.900 138.3 -5.6 -75.8 -46.6 4.8 23.4 15.2 36 36 A S H ><5S- 0 0 11 -4,-2.4 3,-1.4 19,-0.4 -3,-0.2 0.446 83.6-117.7-133.0 -1.2 5.2 20.3 13.1 37 37 A N T 3< - 0 0 44 4,-2.9 3,-2.0 -2,-0.4 -1,-0.0 -0.592 25.4-111.3 -86.8 153.3 14.9 21.9 23.7 47 47 A T T 3 S+ 0 0 160 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.789 115.5 59.1 -48.3 -35.7 18.0 23.6 25.1 48 48 A D T 3 S- 0 0 83 1,-0.1 -1,-0.3 21,-0.0 3,-0.1 0.332 122.7 -98.8 -82.4 2.8 17.1 22.4 28.7 49 49 A G S < S+ 0 0 23 -3,-2.0 -2,-0.1 1,-0.4 2,-0.1 0.232 87.8 118.7 98.9 -11.0 17.1 18.7 27.8 50 50 A S - 0 0 0 19,-0.1 -4,-2.9 -5,-0.1 -1,-0.4 -0.348 53.0-141.9 -74.4 170.4 13.3 18.3 27.3 51 51 A T E -C 45 0C 3 -6,-0.3 9,-2.5 -3,-0.1 2,-0.4 -0.989 3.3-136.7-135.9 143.5 11.8 17.3 23.9 52 52 A D E -CD 44 59C 27 -8,-2.8 -8,-1.8 -2,-0.4 2,-0.4 -0.843 26.5-157.0-100.1 134.3 8.7 18.4 22.0 53 53 A Y E > -CD 43 58C 21 5,-1.8 5,-2.0 -2,-0.4 3,-0.4 -0.960 30.5 -24.7-125.8 128.3 6.7 15.6 20.3 54 54 A G T > 5S- 0 0 0 -12,-2.8 3,-1.3 -2,-0.4 30,-0.2 -0.148 97.7 -22.2 87.8-170.5 4.3 15.3 17.5 55 55 A I T 3 5S+ 0 0 3 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.777 142.1 30.4 -52.9 -34.5 1.8 17.3 15.4 56 56 A L T 3 5S- 0 0 1 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.233 105.8-123.1-115.7 16.3 1.5 19.9 18.3 57 57 A Q T < 5 - 0 0 12 -3,-1.3 2,-0.2 1,-0.2 -3,-0.2 0.885 33.2-164.4 50.3 51.3 5.0 19.6 19.7 58 58 A I E < -D 53 0C 2 -5,-2.0 -5,-1.8 -6,-0.1 2,-0.3 -0.497 17.4-122.3 -73.3 129.7 4.0 18.7 23.3 59 59 A N E >>> -D 52 0C 31 -2,-0.2 4,-2.2 -7,-0.2 3,-1.1 -0.618 6.7-146.7 -88.9 136.7 6.8 19.1 25.7 60 60 A S T 345S+ 0 0 0 -9,-2.5 6,-0.2 -2,-0.3 13,-0.2 0.618 90.2 81.1 -71.6 -15.0 8.2 16.3 27.9 61 61 A R T 345S- 0 0 58 -10,-0.2 12,-1.8 11,-0.2 -1,-0.2 0.856 120.3 -4.3 -59.8 -34.0 9.0 18.9 30.7 62 62 A W T <45S+ 0 0 126 -3,-1.1 13,-2.7 10,-0.2 -2,-0.2 0.686 131.3 44.0-120.8 -37.1 5.3 18.7 31.8 63 63 A W T <5S+ 0 0 28 -4,-2.2 13,-2.1 11,-0.3 2,-0.3 0.734 103.8 22.5-109.2 -28.6 3.0 16.6 29.6 64 64 A c < - 0 0 0 -5,-0.5 2,-0.6 9,-0.4 11,-0.1 -0.940 69.3-110.6-141.3 161.1 4.4 13.3 28.7 65 65 A N B +e 79 0D 79 13,-2.9 15,-2.4 -2,-0.3 16,-0.4 -0.867 37.2 155.2 -98.4 120.5 7.1 10.7 29.8 66 66 A D - 0 0 34 -2,-0.6 -1,-0.1 13,-0.2 8,-0.0 0.301 52.2-126.6-114.7 2.0 10.2 10.2 27.7 67 67 A G S S+ 0 0 64 2,-0.1 -2,-0.1 -7,-0.1 0, 0.0 0.494 94.5 74.8 64.6 4.8 12.4 8.9 30.6 68 68 A R + 0 0 117 1,-0.1 -1,-0.1 -19,-0.1 -3,-0.0 0.051 64.9 92.0-134.0 26.8 15.1 11.4 29.9 69 69 A T S > S- 0 0 6 -9,-0.1 3,-2.3 3,-0.0 -2,-0.1 -0.738 71.3-143.4-120.7 81.0 13.8 14.7 31.2 70 70 A P T 3 S+ 0 0 112 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.192 80.8 8.3 -49.3 128.3 15.0 14.9 34.8 71 71 A G T 3 S+ 0 0 79 1,-0.3 -10,-0.0 0, 0.0 2,-0.0 0.433 97.5 136.7 87.8 2.5 12.5 16.5 37.1 72 72 A S < - 0 0 29 -3,-2.3 -1,-0.3 1,-0.1 -10,-0.2 -0.252 44.8-136.2 -81.4 167.7 9.7 16.6 34.6 73 73 A R - 0 0 145 -12,-1.8 -9,-0.4 -13,-0.2 -1,-0.1 -0.597 4.2-144.5-110.9 179.9 6.1 15.7 35.0 74 74 A N > + 0 0 43 -2,-0.2 3,-1.7 -11,-0.2 -11,-0.3 -0.595 28.9 164.3-146.4 63.2 3.8 13.6 32.8 75 75 A L T 3 S+ 0 0 65 -13,-2.7 -12,-0.2 1,-0.3 -11,-0.1 0.676 75.4 54.4 -70.0 -19.3 0.4 15.4 33.3 76 76 A d T 3 S- 0 0 14 -13,-2.1 -1,-0.3 2,-0.2 -12,-0.1 0.479 103.9-132.9 -87.0 -3.7 -1.1 13.7 30.2 77 77 A N < + 0 0 140 -3,-1.7 -13,-0.1 1,-0.2 -2,-0.1 0.927 65.3 114.7 51.0 57.5 -0.2 10.3 31.7 78 78 A I S S- 0 0 46 -15,-0.3 -13,-2.9 16,-0.0 2,-0.2 -0.996 73.3-105.8-151.9 140.8 1.2 9.1 28.4 79 79 A P B > -e 65 0D 71 0, 0.0 3,-1.5 0, 0.0 4,-0.4 -0.598 35.0-124.2 -67.3 144.4 4.6 8.0 26.9 80 80 A c G > S+ 0 0 1 -15,-2.4 3,-1.6 1,-0.3 -14,-0.1 0.812 109.2 69.3 -61.8 -30.4 5.8 10.8 24.7 81 81 A S G > S+ 0 0 82 -16,-0.4 3,-1.9 1,-0.3 -1,-0.3 0.822 87.9 64.9 -54.7 -30.9 6.1 8.2 21.9 82 82 A A G X S+ 0 0 29 -3,-1.5 3,-0.9 1,-0.3 9,-0.3 0.729 91.7 65.3 -64.8 -22.8 2.2 8.0 21.9 83 83 A L G < S+ 0 0 1 -3,-1.6 -28,-0.5 -4,-0.4 -1,-0.3 0.438 93.6 60.9 -77.8 2.0 2.3 11.6 20.7 84 84 A L G < S+ 0 0 45 -3,-1.9 -1,-0.2 -30,-0.2 -2,-0.2 0.359 77.2 124.9-109.1 4.6 4.0 10.5 17.4 85 85 A S < - 0 0 55 -3,-0.9 6,-0.1 2,-0.2 -3,-0.0 -0.130 69.4-127.0 -68.2 153.4 1.2 8.2 16.2 86 86 A S S S+ 0 0 73 -45,-0.0 2,-0.5 2,-0.0 -1,-0.1 0.850 101.6 72.9 -68.9 -29.7 -0.5 8.6 12.8 87 87 A D S S- 0 0 77 1,-0.1 3,-0.5 -47,-0.0 4,-0.3 -0.774 78.0-152.8 -83.5 125.1 -3.8 8.7 14.7 88 88 A I > + 0 0 6 -2,-0.5 4,-2.5 1,-0.2 3,-0.2 0.430 63.4 107.8 -84.5 1.5 -4.0 12.0 16.5 89 89 A T H > S+ 0 0 51 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.857 82.8 44.2 -47.2 -52.1 -6.2 10.9 19.5 90 90 A A H > S+ 0 0 23 -3,-0.5 4,-2.2 -8,-0.3 -1,-0.2 0.893 114.6 48.7 -64.5 -44.9 -3.4 11.1 22.1 91 91 A S H > S+ 0 0 5 -9,-0.3 4,-2.7 -4,-0.3 -1,-0.2 0.912 114.3 47.4 -59.7 -41.1 -2.1 14.4 20.9 92 92 A V H X S+ 0 0 1 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.926 110.7 49.7 -65.8 -50.1 -5.6 15.8 20.9 93 93 A N H X S+ 0 0 83 -4,-2.7 4,-1.2 -5,-0.2 -1,-0.2 0.895 115.5 44.9 -57.1 -44.5 -6.5 14.5 24.4 94 94 A d H X S+ 0 0 3 -4,-2.2 4,-2.6 -5,-0.2 3,-0.4 0.937 109.4 53.6 -66.8 -46.0 -3.3 16.0 25.7 95 95 A A H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.879 103.3 59.8 -53.5 -37.1 -3.6 19.3 23.9 96 96 A K H X S+ 0 0 45 -4,-2.3 4,-0.9 2,-0.2 -1,-0.2 0.915 108.1 43.6 -59.0 -43.3 -7.1 19.6 25.5 97 97 A K H < S+ 0 0 101 -4,-1.2 3,-0.4 -3,-0.4 4,-0.4 0.931 113.6 51.2 -68.6 -41.0 -5.4 19.5 29.0 98 98 A I H >< S+ 0 0 7 -4,-2.6 3,-1.4 1,-0.2 5,-0.3 0.924 109.8 48.2 -60.9 -47.8 -2.6 21.9 27.9 99 99 A V H 3< S+ 0 0 2 -4,-2.8 5,-0.4 1,-0.3 3,-0.4 0.689 110.6 53.3 -71.7 -19.4 -5.1 24.6 26.5 100 100 A S T 3< S+ 0 0 34 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.494 85.2 92.4 -83.6 -3.9 -7.2 24.3 29.8 101 101 A D S < S- 0 0 110 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.1 0.538 107.8 -86.1 -80.9 -10.4 -4.1 24.9 32.0 102 102 A G S S+ 0 0 58 -3,-0.4 -3,-0.1 -4,-0.2 -1,-0.1 -0.207 114.8 59.7 140.2 -43.4 -4.5 28.7 32.3 103 103 A N S > S- 0 0 125 1,-0.3 3,-1.5 -5,-0.3 -4,-0.1 0.235 84.4-146.2-104.3 17.0 -2.9 30.5 29.4 104 104 A G G > - 0 0 10 -5,-0.4 3,-1.3 1,-0.2 -1,-0.3 -0.280 68.1 -14.9 61.3-144.2 -4.9 29.0 26.6 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.0 2,-0.1 7,-0.4 0.563 114.8 90.4 -75.4 -7.0 -3.1 28.5 23.2 106 106 A N G < + 0 0 48 -3,-1.5 -1,-0.3 1,-0.3 6,-0.2 0.724 69.2 78.7 -58.1 -19.3 -0.2 30.8 24.3 107 107 A A G < S+ 0 0 57 -3,-1.3 2,-0.9 1,-0.1 -1,-0.3 0.804 83.9 68.6 -56.7 -33.7 1.4 27.5 25.7 108 108 A W S <> S- 0 0 7 -3,-2.0 4,-2.6 1,-0.2 3,-0.2 -0.801 74.3-164.8 -88.8 103.4 2.3 27.0 22.0 109 109 A V H > S+ 0 0 81 -2,-0.9 4,-2.6 1,-0.2 5,-0.2 0.885 88.0 54.1 -63.7 -37.7 4.9 29.6 21.3 110 110 A A H >>S+ 0 0 16 2,-0.2 4,-2.4 1,-0.2 5,-0.5 0.873 108.4 50.8 -63.1 -34.8 4.6 29.2 17.5 111 111 A W H >>S+ 0 0 11 -6,-0.2 5,-3.1 3,-0.2 4,-2.2 0.963 112.3 47.0 -65.0 -47.5 0.8 29.8 17.8 112 112 A R H <5S+ 0 0 116 -4,-2.6 -2,-0.2 -7,-0.4 -1,-0.2 0.932 121.8 35.0 -57.9 -45.7 1.5 32.9 19.9 113 113 A N H <5S+ 0 0 101 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.716 134.4 20.8 -85.4 -21.7 4.1 34.3 17.4 114 114 A R H <5S+ 0 0 137 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.588 131.1 27.3-124.6 -16.9 2.7 33.1 14.1 115 115 A b T >< + 0 0 104 1,-0.2 3,-1.3 -3,-0.1 4,-0.3 -0.494 57.4 167.8 -76.1 77.4 -6.6 35.4 9.7 120 120 A V G > + 0 0 18 -2,-2.3 3,-1.4 1,-0.3 4,-0.3 0.698 63.0 75.0 -71.1 -16.5 -6.7 31.7 11.1 121 121 A Q G > S+ 0 0 82 1,-0.3 3,-1.7 2,-0.2 4,-0.5 0.801 79.3 73.8 -69.6 -24.5 -9.8 30.9 9.1 122 122 A A G X S+ 0 0 38 -3,-1.3 3,-1.0 1,-0.3 -1,-0.3 0.814 86.2 66.0 -50.6 -33.1 -7.6 30.8 6.0 123 123 A W G < S+ 0 0 53 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.735 110.2 33.1 -65.3 -26.0 -6.3 27.5 7.4 124 124 A I G X S+ 0 0 47 -3,-1.7 3,-2.1 -4,-0.3 -1,-0.3 0.284 86.8 137.0-110.0 10.6 -9.7 25.8 6.9 125 125 A R T < S+ 0 0 119 -3,-1.0 3,-0.1 -4,-0.5 -119,-0.1 -0.284 77.5 5.4 -65.4 129.8 -10.7 27.7 3.8 126 126 A G T 3 S+ 0 0 80 1,-0.2 2,-0.3 -120,-0.0 -1,-0.3 0.387 92.6 139.9 81.8 -6.2 -12.3 25.4 1.3 127 127 A a < 0 0 36 -3,-2.1 -1,-0.2 1,-0.1 -3,-0.0 -0.576 360.0 360.0 -78.0 135.0 -12.3 22.4 3.5 128 128 A R 0 0 267 -2,-0.3 -1,-0.1 -3,-0.1 -118,-0.1 -0.733 360.0 360.0 -79.6 360.0 -15.4 20.1 3.3