==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-JUN-03 1PS5 . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR S.MAJEED,G.OFEK,A.BELACHEW,C.HUANG,T.ZHOU,P.D.KWONG . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6633.0 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 . 33 25.6 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 82 0, 0.0 39,-2.8 0, 0.0 2,-0.8 0.000 360.0 360.0 360.0 135.5 21.9 -4.5 14.4 2 2 A V B -A 39 0A 93 37,-0.2 37,-0.3 38,-0.1 36,-0.1 -0.874 360.0-147.3-103.5 103.2 21.9 -2.0 11.4 3 3 A F - 0 0 9 35,-3.0 2,-0.2 -2,-0.8 3,-0.0 -0.300 8.2-125.8 -70.8 150.0 19.9 -3.6 8.6 4 4 A G > - 0 0 36 1,-0.1 4,-2.2 -2,-0.0 5,-0.2 -0.549 35.5-106.2 -84.5 161.7 20.5 -3.2 4.9 5 5 A R H > S+ 0 0 91 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.948 117.5 33.1 -56.5 -57.0 17.4 -2.0 3.0 6 6 A a H > S+ 0 0 37 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.841 114.0 61.3 -71.3 -31.2 16.6 -5.2 1.2 7 7 A E H > S+ 0 0 93 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.918 108.7 42.5 -60.0 -43.8 17.8 -7.3 4.1 8 8 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.847 109.9 58.6 -71.5 -32.8 15.2 -5.7 6.4 9 9 A A H X S+ 0 0 0 -4,-1.6 4,-2.2 -5,-0.2 -2,-0.2 0.941 108.7 44.2 -60.8 -46.3 12.6 -6.0 3.7 10 10 A A H X S+ 0 0 11 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.893 114.1 49.4 -65.4 -41.7 13.0 -9.8 3.5 11 11 A A H X S+ 0 0 8 -4,-1.9 4,-1.2 -5,-0.2 -1,-0.2 0.899 111.6 48.7 -65.9 -40.9 13.1 -10.2 7.3 12 12 A M H <>S+ 0 0 2 -4,-2.7 5,-2.2 2,-0.2 6,-0.3 0.919 112.4 47.3 -65.4 -43.4 9.9 -8.1 7.7 13 13 A K H ><5S+ 0 0 86 -4,-2.2 3,-1.9 1,-0.3 5,-0.2 0.907 109.5 54.8 -62.4 -40.3 8.1 -10.1 5.0 14 14 A R H 3<5S+ 0 0 176 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.790 106.9 52.2 -61.6 -29.2 9.3 -13.2 6.7 15 15 A H T 3<5S- 0 0 56 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.161 124.3-103.7 -95.6 17.6 7.7 -11.8 9.9 16 16 A G T < 5S+ 0 0 36 -3,-1.9 -3,-0.2 -5,-0.1 -2,-0.1 0.743 84.1 123.9 70.8 27.9 4.4 -11.3 8.1 17 17 A L > < + 0 0 0 -5,-2.2 3,-1.6 2,-0.1 2,-0.9 0.615 37.8 107.0 -93.0 -13.7 4.4 -7.5 7.6 18 18 A D T 3 S- 0 0 56 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.545 105.9 -11.1 -71.4 106.2 3.9 -7.5 3.9 19 19 A N T > S+ 0 0 108 4,-2.0 3,-2.1 -2,-0.9 -1,-0.3 0.626 89.2 164.8 79.3 17.2 0.4 -6.3 3.4 20 20 A Y B X S-B 23 0B 70 -3,-1.6 3,-1.8 3,-0.7 -1,-0.3 -0.513 78.7 -4.1 -66.1 127.5 -0.4 -6.6 7.2 21 21 A R T 3 S- 0 0 156 1,-0.3 -1,-0.3 -2,-0.3 3,-0.1 0.741 136.0 -58.3 58.2 24.3 -3.6 -4.6 7.7 22 22 A G T < S+ 0 0 59 -3,-2.1 2,-0.7 1,-0.2 -1,-0.3 0.590 104.7 131.1 83.8 11.3 -3.5 -3.6 4.0 23 23 A Y B < -B 20 0B 51 -3,-1.8 -4,-2.0 -6,-0.1 -3,-0.7 -0.858 53.8-134.2-103.1 109.0 -0.0 -2.0 4.3 24 24 A S >> - 0 0 37 -2,-0.7 3,-1.8 -5,-0.2 4,-0.7 -0.160 28.4-103.8 -57.3 152.0 2.4 -3.2 1.5 25 25 A L H 3> S+ 0 0 1 1,-0.3 4,-1.8 2,-0.2 3,-0.3 0.763 115.1 71.4 -47.7 -33.6 5.9 -4.1 2.6 26 26 A G H 3> S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.859 91.9 57.1 -54.7 -39.5 7.3 -0.8 1.2 27 27 A N H <> S+ 0 0 16 -3,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.910 106.6 48.0 -58.5 -46.7 5.6 1.2 4.0 28 28 A W H X S+ 0 0 0 -4,-0.7 4,-2.2 -3,-0.3 -1,-0.2 0.869 112.6 47.2 -65.7 -39.0 7.4 -0.8 6.8 29 29 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.932 114.7 47.2 -68.1 -44.7 10.8 -0.5 5.2 30 30 A b H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.869 111.5 50.9 -63.5 -38.7 10.3 3.2 4.6 31 31 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.2 5,-0.3 0.927 111.4 48.2 -64.6 -43.8 9.1 3.7 8.1 32 32 A A H X>S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 6,-1.4 0.908 108.3 55.4 -62.6 -43.2 12.1 1.9 9.5 33 33 A K H X5S+ 0 0 65 -4,-2.5 4,-1.3 4,-0.3 -1,-0.2 0.950 117.9 32.0 -55.5 -53.4 14.5 4.0 7.4 34 34 A F H <5S+ 0 0 62 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.679 119.2 51.6 -83.1 -18.4 13.2 7.3 8.7 35 35 A E H <5S- 0 0 37 -4,-2.1 -3,-0.2 20,-0.2 -2,-0.2 0.900 139.3 -8.6 -82.6 -43.0 12.3 6.3 12.2 36 36 A S H ><5S- 0 0 11 -4,-2.3 3,-1.2 19,-0.5 -3,-0.2 0.343 87.4-112.5-137.9 4.8 15.7 4.6 13.1 37 37 A N T 3< - 0 0 53 4,-2.7 3,-1.9 -2,-0.2 -1,-0.0 -0.819 26.5-112.5-117.6 158.5 11.4 12.6 25.0 47 47 A T T 3 S+ 0 0 155 -2,-0.3 -1,-0.1 1,-0.3 4,-0.0 0.772 113.3 65.0 -60.1 -28.3 10.5 15.5 27.3 48 48 A D T 3 S- 0 0 62 1,-0.1 -1,-0.3 21,-0.0 3,-0.1 0.389 121.1-106.5 -77.8 8.4 7.6 13.6 28.8 49 49 A G S < S+ 0 0 16 -3,-1.9 -2,-0.1 1,-0.3 -1,-0.1 0.324 84.7 118.8 88.0 -9.8 10.2 11.1 30.2 50 50 A S - 0 0 0 19,-0.1 -4,-2.7 -5,-0.1 2,-0.3 -0.232 50.7-145.8 -80.8 175.7 9.3 8.4 27.7 51 51 A T E -C 45 0C 3 -6,-0.2 9,-2.4 -3,-0.1 2,-0.4 -0.992 9.2-129.8-146.1 144.0 11.7 6.9 25.2 52 52 A D E -CD 44 59C 32 -8,-2.5 -8,-1.4 -2,-0.3 2,-0.4 -0.836 31.4-157.8 -97.0 133.7 11.3 5.6 21.6 53 53 A Y E > -CD 43 58C 25 5,-2.8 5,-2.5 -2,-0.4 3,-0.3 -0.920 30.1 -16.4-124.4 140.6 12.8 2.2 21.0 54 54 A G T > 5S- 0 0 0 -12,-1.8 3,-1.6 -2,-0.4 30,-0.2 -0.096 97.4 -31.8 80.0-174.1 14.0 0.1 18.1 55 55 A I T 3 5S+ 0 0 5 28,-0.5 -19,-0.5 1,-0.3 -17,-0.3 0.785 142.6 33.4 -52.7 -36.2 13.8 -0.0 14.3 56 56 A L T 3 5S- 0 0 2 -3,-0.3 -1,-0.3 27,-0.2 -2,-0.2 0.224 107.4-124.3-107.8 10.7 10.3 1.5 14.4 57 57 A Q T < 5 - 0 0 12 -3,-1.6 2,-0.4 1,-0.2 -3,-0.2 0.922 32.1-165.5 45.1 65.5 10.8 3.7 17.5 58 58 A I E < -D 53 0C 3 -5,-2.5 -5,-2.8 25,-0.1 2,-0.3 -0.666 18.5-121.6 -82.5 133.4 8.0 2.4 19.6 59 59 A N E >> -D 52 0C 33 -2,-0.4 4,-1.9 -7,-0.3 3,-1.0 -0.595 5.8-145.7 -83.4 133.2 7.3 4.7 22.6 60 60 A S T 34 S+ 0 0 0 -9,-2.4 13,-0.4 -2,-0.3 4,-0.2 0.641 87.0 81.9 -69.7 -17.3 7.4 3.5 26.2 61 61 A R T 34 S+ 0 0 112 11,-0.2 12,-1.5 -10,-0.2 -1,-0.2 0.826 118.6 2.2 -59.1 -29.4 4.6 5.7 27.4 62 62 A W T <4 S+ 0 0 121 -3,-1.0 13,-2.8 10,-0.2 -2,-0.2 0.681 133.0 42.1-127.2 -33.0 2.1 3.1 26.1 63 63 A W S < S+ 0 0 54 -4,-1.9 13,-1.8 11,-0.3 15,-0.4 0.704 108.4 17.7-100.2 -21.3 3.7 0.0 24.6 64 64 A c - 0 0 0 9,-0.4 2,-0.5 -5,-0.4 9,-0.2 -0.942 65.7-115.2-146.5 168.8 6.7 -1.1 26.7 65 65 A N B +e 79 0D 78 13,-2.2 15,-2.7 -2,-0.3 16,-0.4 -0.922 30.8 160.4-110.2 128.3 8.2 -0.9 30.1 66 66 A D - 0 0 36 -2,-0.5 -1,-0.1 13,-0.2 -6,-0.0 0.237 55.0-119.1-123.4 7.6 11.6 0.7 30.7 67 67 A G S S+ 0 0 66 2,-0.1 -2,-0.1 1,-0.1 0, 0.0 0.574 99.9 64.4 67.9 12.4 11.1 1.4 34.4 68 68 A R + 0 0 126 -19,-0.1 -1,-0.1 2,-0.1 -3,-0.0 0.286 66.0 109.8-146.0 9.2 11.5 5.1 34.2 69 69 A T > - 0 0 12 -9,-0.1 3,-1.7 -18,-0.0 -20,-0.1 -0.826 68.1-123.6 -96.4 118.9 8.6 6.4 32.1 70 70 A P T 3 S+ 0 0 87 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.322 92.3 1.6 -60.3 136.5 5.9 8.3 34.1 71 71 A G T 3 S+ 0 0 76 1,-0.2 -2,-0.0 -2,-0.0 0, 0.0 0.704 96.5 178.4 58.2 20.6 2.4 7.0 33.9 72 72 A S < - 0 0 37 -3,-1.7 2,-0.3 2,-0.0 -10,-0.2 -0.225 17.5-164.6 -60.6 137.8 3.8 4.3 31.7 73 73 A R - 0 0 147 -12,-1.5 -9,-0.4 -13,-0.4 2,-0.2 -0.843 11.8-150.0-116.1 157.3 1.7 1.5 30.3 74 74 A N > + 0 0 52 -2,-0.3 3,-1.8 -11,-0.2 -11,-0.3 -0.533 29.0 159.7-129.5 65.3 3.0 -1.7 28.8 75 75 A L T 3 S+ 0 0 59 -13,-2.8 -12,-0.2 1,-0.3 -11,-0.1 0.722 77.5 51.6 -60.8 -25.5 0.5 -2.7 26.2 76 76 A d T 3 S- 0 0 21 -13,-1.8 -1,-0.3 2,-0.2 -12,-0.1 0.449 105.3-132.3 -91.2 1.0 2.9 -4.9 24.3 77 77 A N < + 0 0 134 -3,-1.8 -13,-0.1 1,-0.2 -2,-0.1 0.895 65.4 110.2 51.6 49.6 3.8 -6.7 27.6 78 78 A I S S- 0 0 35 -15,-0.4 -13,-2.2 16,-0.0 2,-0.3 -0.977 76.2-101.4-149.3 158.7 7.5 -6.4 27.1 79 79 A P B > -e 65 0D 72 0, 0.0 3,-2.1 0, 0.0 4,-0.4 -0.640 39.2-122.9 -77.4 141.9 10.6 -4.7 28.4 80 80 A c G > S+ 0 0 1 -15,-2.7 3,-2.3 1,-0.3 -14,-0.1 0.842 109.6 70.9 -55.1 -30.5 11.5 -1.9 26.0 81 81 A S G > S+ 0 0 81 -16,-0.4 3,-2.0 1,-0.3 4,-0.4 0.781 83.2 69.6 -57.5 -25.8 14.9 -3.5 25.6 82 82 A A G X S+ 0 0 30 -3,-2.1 3,-0.7 1,-0.3 9,-0.4 0.760 90.6 62.7 -63.9 -21.8 13.2 -6.4 23.7 83 83 A L G < S+ 0 0 1 -3,-2.3 -28,-0.5 -4,-0.4 -1,-0.3 0.415 97.5 58.8 -82.5 2.1 12.7 -3.8 21.0 84 84 A L G < S+ 0 0 39 -3,-2.0 -1,-0.2 -30,-0.2 -2,-0.2 0.500 77.9 110.7-109.3 -6.3 16.4 -3.4 20.5 85 85 A S S < S- 0 0 52 -3,-0.7 6,-0.1 -4,-0.4 -3,-0.0 -0.243 77.2-118.7 -71.4 158.9 17.6 -6.9 19.7 86 86 A S S S+ 0 0 77 2,-0.1 2,-0.8 1,-0.1 -1,-0.1 0.729 102.4 83.8 -65.3 -21.8 18.9 -8.0 16.3 87 87 A D S > S- 0 0 90 1,-0.1 3,-0.6 -5,-0.1 4,-0.3 -0.775 70.7-162.2 -84.1 109.2 15.9 -10.4 16.3 88 88 A I T 3> + 0 0 8 -2,-0.8 4,-2.9 1,-0.2 5,-0.3 0.486 61.3 104.4 -74.3 -1.8 13.1 -8.1 15.1 89 89 A T H 3> S+ 0 0 53 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.884 80.6 45.7 -45.4 -54.2 10.3 -10.4 16.4 90 90 A A H <> S+ 0 0 25 -3,-0.6 4,-2.5 -8,-0.3 5,-0.3 0.938 115.0 46.4 -58.6 -50.3 9.4 -8.2 19.4 91 91 A S H > S+ 0 0 5 -9,-0.4 4,-2.5 -4,-0.3 -1,-0.2 0.905 115.2 47.8 -59.9 -42.8 9.4 -5.0 17.4 92 92 A V H X S+ 0 0 3 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.949 113.5 45.0 -64.5 -51.0 7.3 -6.5 14.6 93 93 A N H X S+ 0 0 90 -4,-2.9 4,-1.4 -5,-0.3 -2,-0.2 0.869 115.8 47.6 -63.5 -34.9 4.7 -8.1 16.8 94 94 A d H X S+ 0 0 5 -4,-2.5 4,-1.9 -5,-0.3 -1,-0.2 0.917 111.3 50.8 -71.6 -40.3 4.4 -5.0 18.9 95 95 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 -5,-0.3 5,-0.3 0.872 105.3 57.7 -63.3 -35.7 4.1 -2.9 15.7 96 96 A K H X S+ 0 0 41 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.906 106.9 47.8 -61.6 -39.9 1.4 -5.3 14.5 97 97 A K H < S+ 0 0 95 -4,-1.4 4,-0.4 2,-0.2 -1,-0.2 0.887 113.2 49.0 -67.2 -37.5 -0.6 -4.5 17.6 98 98 A I H >< S+ 0 0 13 -4,-1.9 3,-0.7 1,-0.2 -2,-0.2 0.926 114.4 42.1 -68.3 -46.1 -0.1 -0.8 17.1 99 99 A V H 3< S+ 0 0 1 -4,-2.9 5,-0.2 1,-0.2 -1,-0.2 0.717 93.9 85.1 -74.9 -20.4 -1.1 -0.6 13.4 100 100 A S T 3< S- 0 0 37 -4,-1.5 -1,-0.2 -5,-0.3 2,-0.2 0.750 109.1 -13.3 -54.1 -30.8 -4.1 -3.0 13.9 101 101 A D S X S+ 0 0 104 -3,-0.7 3,-1.8 -4,-0.4 2,-0.1 -0.480 103.2 68.8-143.4-142.6 -6.3 -0.1 15.0 102 102 A G T 3 S- 0 0 76 1,-0.2 3,-0.1 -2,-0.2 -3,-0.1 -0.387 121.1 -29.3 58.5-123.8 -6.1 3.5 16.0 103 103 A N T > S- 0 0 87 1,-0.4 3,-1.9 -5,-0.2 -1,-0.2 -0.168 84.8-124.6-118.8 38.5 -5.0 5.4 12.9 104 104 A G G X S- 0 0 11 -3,-1.8 3,-1.3 1,-0.3 -1,-0.4 -0.226 79.3 -14.4 57.0-140.9 -3.0 2.7 11.1 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.1 2,-0.2 -1,-0.3 0.500 116.0 90.5 -74.4 -1.5 0.6 3.6 10.2 106 106 A N G < + 0 0 34 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.606 69.4 80.0 -67.0 -8.2 -0.2 7.2 10.9 107 107 A A G < S+ 0 0 46 -3,-1.3 2,-0.8 1,-0.1 -1,-0.3 0.730 80.4 72.9 -69.6 -22.7 1.0 6.2 14.3 108 108 A W <> - 0 0 10 -3,-2.1 4,-2.4 1,-0.2 3,-0.4 -0.839 69.9-160.6 -99.8 107.0 4.5 6.6 13.1 109 109 A V H > S+ 0 0 77 -2,-0.8 4,-1.6 1,-0.3 5,-0.2 0.874 92.0 50.3 -51.1 -45.4 5.4 10.3 12.6 110 110 A A H > S+ 0 0 15 1,-0.2 4,-2.0 2,-0.2 5,-0.4 0.863 109.9 50.6 -64.5 -35.6 8.3 9.5 10.3 111 111 A W H >>S+ 0 0 12 -3,-0.4 5,-3.1 1,-0.2 4,-1.9 0.916 110.8 50.5 -66.3 -41.0 6.1 7.3 8.1 112 112 A R H <5S+ 0 0 110 -4,-2.4 -2,-0.2 -7,-0.2 -1,-0.2 0.755 119.2 35.5 -67.7 -28.0 3.6 10.1 8.0 113 113 A N H <5S+ 0 0 110 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.612 131.8 23.6-103.7 -14.4 6.1 12.8 6.9 114 114 A R H <5S+ 0 0 145 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.2 0.513 131.4 26.2-127.5 -9.3 8.5 10.8 4.7 115 115 A b T ><5S+ 0 0 0 -4,-1.9 3,-2.0 -5,-0.4 5,-0.3 0.730 87.4 95.3-121.1 -48.1 6.5 7.8 3.4 116 116 A K T 3 + 0 0 94 -2,-0.3 3,-2.4 1,-0.2 4,-0.3 -0.354 56.9 166.0 -69.0 68.9 6.2 5.8 -4.0 120 120 A V G > + 0 0 8 -2,-3.5 3,-1.5 1,-0.3 -1,-0.2 0.784 66.5 75.1 -56.5 -25.5 6.7 3.7 -0.9 121 121 A Q G >> S+ 0 0 76 1,-0.3 3,-1.5 -3,-0.3 4,-0.6 0.754 79.1 73.1 -58.5 -25.8 6.9 0.8 -3.3 122 122 A A G X4 S+ 0 0 40 -3,-2.4 3,-0.8 1,-0.3 -1,-0.3 0.815 80.6 70.8 -61.1 -31.5 10.4 1.9 -4.3 123 123 A W G <4 S+ 0 0 57 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.616 104.3 40.6 -63.8 -11.7 11.9 0.7 -1.0 124 124 A I G X4 S+ 0 0 38 -3,-1.5 3,-2.2 -4,-0.2 -1,-0.3 0.517 86.7 122.5-110.0 -12.7 11.4 -2.9 -2.0 125 125 A R T << S+ 0 0 148 -3,-0.8 3,-0.1 -4,-0.6 -3,-0.0 -0.197 81.5 11.0 -53.4 138.2 12.5 -2.4 -5.6 126 126 A G T 3 S+ 0 0 81 1,-0.2 -1,-0.3 -120,-0.0 2,-0.2 0.509 98.1 141.7 70.6 4.9 15.4 -4.6 -6.7 127 127 A a < - 0 0 23 -3,-2.2 2,-1.3 1,-0.1 -1,-0.2 -0.511 57.5-128.3 -83.8 148.3 15.0 -6.6 -3.5 128 128 A R 0 0 224 1,-0.2 -1,-0.1 -2,-0.2 -3,-0.1 -0.624 360.0 360.0 -93.5 75.9 15.5 -10.4 -3.1 129 129 A L 0 0 118 -2,-1.3 -1,-0.2 -5,-0.1 -115,-0.0 0.994 360.0 360.0 -75.6 360.0 12.2 -11.3 -1.3