==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-MAR-98 2LYO . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR Q.HUANG,Z.WANG,G.ZHU,M.QIAN,M.SHAO,Y.JIA,Y.TANG . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6492.0 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 . 26 20.2 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 . 7 5.4 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 89 0, 0.0 39,-2.9 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 139.1 2.3 10.5 8.9 2 2 A V B -A 39 0A 96 37,-0.2 37,-0.2 38,-0.1 2,-0.1 -0.929 360.0-149.6-103.4 115.9 2.3 13.8 7.1 3 3 A F - 0 0 18 35,-2.6 2,-0.3 -2,-0.6 3,-0.0 -0.405 8.7-123.9 -81.4 164.4 -1.2 15.3 6.9 4 4 A G > - 0 0 31 -2,-0.1 4,-2.9 1,-0.1 5,-0.3 -0.686 33.1-108.2-100.7 159.1 -2.8 17.5 4.3 5 5 A R H > S+ 0 0 83 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.953 118.9 35.8 -52.4 -59.5 -4.3 20.7 5.5 6 6 A a H > S+ 0 0 39 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.849 114.5 58.8 -66.2 -34.2 -7.9 19.7 5.0 7 7 A E H > S+ 0 0 93 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.929 110.3 42.0 -61.7 -45.4 -7.2 16.2 6.0 8 8 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.899 111.2 55.7 -70.4 -40.0 -5.9 17.4 9.4 9 9 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.3 -2,-0.2 0.910 108.9 47.1 -58.7 -43.6 -8.7 19.9 9.9 10 10 A A H X S+ 0 0 32 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.909 111.9 51.5 -66.5 -38.4 -11.4 17.3 9.4 11 11 A A H X S+ 0 0 15 -4,-1.7 4,-0.9 -5,-0.2 -2,-0.2 0.906 112.7 44.8 -65.6 -40.2 -9.5 15.0 11.8 12 12 A M H <>S+ 0 0 0 -4,-2.6 5,-2.3 2,-0.2 6,-0.3 0.878 111.0 53.7 -71.7 -35.5 -9.3 17.7 14.5 13 13 A K H ><5S+ 0 0 98 -4,-2.6 3,-2.5 1,-0.2 -2,-0.2 0.982 109.3 48.6 -61.7 -48.7 -13.0 18.7 14.0 14 14 A R H 3<5S+ 0 0 181 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.697 108.6 54.0 -63.4 -23.7 -14.0 15.1 14.6 15 15 A H T 3<5S- 0 0 25 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.2 0.365 124.2-105.9 -91.8 4.0 -11.9 15.0 17.7 16 16 A G T < 5S+ 0 0 35 -3,-2.5 -3,-0.2 -4,-0.2 -2,-0.2 0.836 80.6 126.5 79.4 37.2 -13.7 18.1 18.9 17 17 A L > < + 0 0 0 -5,-2.3 3,-2.6 2,-0.1 2,-0.3 0.717 34.8 109.1 -95.4 -26.0 -11.2 20.9 18.5 18 18 A D T 3 S- 0 0 69 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.387 106.9 -12.7 -58.3 112.5 -13.3 23.3 16.5 19 19 A N T > S+ 0 0 90 4,-1.7 3,-2.4 -2,-0.3 2,-0.3 0.622 87.8 165.0 64.6 21.6 -13.9 26.1 19.0 20 20 A Y B X S-B 23 0B 54 -3,-2.6 3,-1.7 3,-0.7 -1,-0.3 -0.546 82.0 -3.6 -68.9 121.1 -12.7 24.0 21.9 21 21 A R T 3 S- 0 0 145 -2,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.674 135.8 -58.1 65.9 22.6 -12.3 26.7 24.5 22 22 A G T < S+ 0 0 58 -3,-2.4 2,-0.7 1,-0.2 -1,-0.3 0.446 104.7 126.2 91.3 -1.8 -13.2 29.4 22.0 23 23 A Y B < -B 20 0B 47 -3,-1.7 -4,-1.7 -6,-0.2 -3,-0.7 -0.830 54.5-137.3 -97.4 111.3 -10.4 28.6 19.5 24 24 A S >> - 0 0 39 -2,-0.7 3,-1.7 -5,-0.2 4,-0.8 -0.163 29.3 -98.6 -60.8 162.3 -11.8 28.1 16.0 25 25 A L H 3> S+ 0 0 3 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.780 118.1 66.0 -52.4 -39.4 -10.5 25.2 13.9 26 26 A G H 3> S+ 0 0 1 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.787 95.4 58.1 -57.0 -31.4 -8.1 27.5 11.9 27 27 A N H <> S+ 0 0 18 -3,-1.7 4,-2.8 2,-0.2 -1,-0.2 0.962 107.6 46.2 -62.9 -48.4 -6.0 28.2 15.0 28 28 A W H X S+ 0 0 1 -4,-0.8 4,-2.2 1,-0.2 -2,-0.2 0.850 114.6 45.8 -62.7 -41.3 -5.3 24.5 15.6 29 29 A V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.887 112.9 50.9 -73.0 -36.8 -4.4 23.8 11.9 30 30 A b H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.947 111.7 48.2 -64.1 -45.5 -2.2 27.0 11.8 31 31 A A H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 5,-0.3 0.927 110.9 49.8 -57.0 -50.9 -0.4 25.8 15.0 32 32 A A H X>S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 5,-1.2 0.914 108.4 55.6 -55.7 -45.1 0.2 22.3 13.7 33 33 A K H X5S+ 0 0 62 -4,-2.2 4,-1.1 4,-0.2 -2,-0.2 0.953 116.1 33.8 -54.4 -54.2 1.5 23.8 10.5 34 34 A F H <5S+ 0 0 63 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.647 121.0 48.9 -83.2 -10.8 4.2 25.9 12.2 35 35 A E H <5S- 0 0 36 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.2 0.876 136.6 -3.6 -92.4 -41.4 4.9 23.5 15.0 36 36 A S H ><5S- 0 0 8 -4,-2.7 3,-1.2 19,-0.4 -3,-0.2 0.416 86.1-116.7-130.4 -8.0 5.4 20.2 13.2 37 37 A N T 3< - 0 0 55 4,-3.2 3,-1.6 -2,-0.4 -1,-0.0 -0.482 23.5-112.7 -93.3 163.8 15.1 22.1 23.6 47 47 A T T 3 S+ 0 0 159 1,-0.3 -1,-0.1 -2,-0.2 4,-0.0 0.824 117.2 59.6 -63.9 -34.9 18.0 23.8 25.4 48 48 A D T 3 S- 0 0 89 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.552 121.7-109.9 -70.6 -6.0 16.6 22.9 28.8 49 49 A G S < S+ 0 0 22 -3,-1.6 -2,-0.1 1,-0.4 2,-0.1 0.335 81.3 119.6 98.7 -14.0 16.9 19.3 27.7 50 50 A S - 0 0 0 19,-0.1 -4,-3.2 -5,-0.1 -1,-0.4 -0.387 53.7-139.2 -76.4 169.1 13.2 18.6 27.3 51 51 A T E -C 45 0C 2 -6,-0.3 9,-2.3 -2,-0.1 2,-0.5 -0.962 3.0-132.7-132.8 148.5 11.9 17.5 23.9 52 52 A D E -CD 44 59C 26 -8,-3.4 -8,-1.9 -2,-0.3 2,-0.4 -0.893 25.8-157.2-102.3 133.4 8.7 18.4 22.0 53 53 A Y E > -CD 43 58C 24 5,-2.8 5,-2.3 -2,-0.5 3,-0.3 -0.910 32.7 -19.6-121.0 137.3 6.7 15.6 20.4 54 54 A G T > 5S- 0 0 0 -12,-2.4 3,-1.6 -2,-0.4 30,-0.2 -0.123 95.1 -29.7 83.6-173.0 4.3 15.3 17.6 55 55 A I T 3 5S+ 0 0 2 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.832 141.1 33.0 -54.5 -38.3 1.9 17.2 15.4 56 56 A L T 3 5S- 0 0 1 -3,-0.3 -1,-0.3 27,-0.2 -2,-0.2 0.168 107.1-123.8-109.7 15.3 1.3 19.7 18.2 57 57 A Q T < 5 - 0 0 12 -3,-1.6 2,-0.2 1,-0.2 -3,-0.2 0.873 33.2-164.7 43.2 58.5 4.8 19.6 19.7 58 58 A I E < -D 53 0C 2 -5,-2.3 -5,-2.8 -6,-0.1 2,-0.3 -0.534 18.8-117.0 -77.2 133.9 3.8 18.6 23.3 59 59 A N E >>> -D 52 0C 30 -2,-0.2 4,-2.4 -7,-0.2 5,-0.8 -0.556 9.0-148.2 -82.6 136.1 6.5 19.1 25.8 60 60 A S T 345S+ 0 0 0 -9,-2.3 14,-0.3 -2,-0.3 6,-0.2 0.643 90.8 67.1 -73.5 -21.2 8.2 16.4 27.9 61 61 A R T 345S+ 0 0 52 11,-0.2 12,-2.5 -10,-0.2 -1,-0.2 0.886 122.8 10.1 -70.2 -28.5 8.9 18.4 31.0 62 62 A W T <45S+ 0 0 111 -3,-0.5 13,-3.6 10,-0.3 -2,-0.2 0.768 131.4 31.8-116.3 -40.2 5.2 18.8 31.8 63 63 A W T <5S+ 0 0 27 -4,-2.4 13,-1.7 11,-0.3 2,-0.3 0.735 110.2 23.3-106.2 -23.8 2.9 16.7 29.7 64 64 A c < - 0 0 0 -5,-0.8 2,-0.6 11,-0.1 10,-0.4 -0.921 67.5-119.5-140.5 162.4 4.4 13.4 28.7 65 65 A N B +e 79 0D 74 13,-2.6 15,-1.8 -2,-0.3 16,-0.3 -0.935 27.2 168.8-107.8 119.9 7.1 11.1 29.9 66 66 A D - 0 0 33 -2,-0.6 -1,-0.1 -6,-0.2 -5,-0.0 0.194 51.4-118.1-109.3 12.7 10.0 10.3 27.6 67 67 A G S S+ 0 0 67 2,-0.2 -2,-0.1 1,-0.1 0, 0.0 0.590 102.8 66.3 65.7 9.8 12.1 8.6 30.2 68 68 A R S S+ 0 0 122 1,-0.1 -1,-0.1 -8,-0.1 -3,-0.0 0.362 70.9 91.2-140.0 2.3 14.9 11.2 29.8 69 69 A T > - 0 0 8 -9,-0.1 3,-1.1 -18,-0.0 2,-0.2 -0.897 69.1-141.8-107.4 105.8 13.5 14.5 31.1 70 70 A P T 3 S+ 0 0 100 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.464 85.0 19.9 -66.7 131.0 14.2 14.9 34.8 71 71 A G T 3 S+ 0 0 46 1,-0.3 2,-0.4 -2,-0.2 3,-0.0 0.748 83.5 165.7 80.7 20.5 11.4 16.4 36.9 72 72 A S < - 0 0 28 -3,-1.1 -1,-0.3 1,-0.2 -10,-0.3 -0.590 26.9-160.9 -70.4 126.5 8.9 15.6 34.2 73 73 A R - 0 0 131 -12,-2.5 -11,-0.2 -2,-0.4 -1,-0.2 0.763 13.4-154.8 -80.1 -25.0 5.4 16.1 35.6 74 74 A N > + 0 0 28 -10,-0.4 3,-2.0 -14,-0.3 -11,-0.3 0.907 20.5 176.1 49.0 51.2 3.8 13.9 32.9 75 75 A L T 3 S+ 0 0 85 -13,-3.6 -12,-0.2 1,-0.3 -11,-0.1 0.761 76.4 49.1 -56.9 -31.0 0.4 15.7 33.3 76 76 A d T 3 S- 0 0 21 -13,-1.7 -1,-0.3 2,-0.1 -12,-0.1 0.420 105.4-135.2 -89.7 1.8 -1.2 13.8 30.4 77 77 A N < + 0 0 133 -3,-2.0 -13,-0.1 1,-0.2 -2,-0.1 0.928 61.8 111.3 42.8 73.6 0.1 10.6 31.9 78 78 A I S S- 0 0 39 -15,-0.2 -13,-2.6 5,-0.0 2,-0.4 -0.977 73.7 -98.7-166.7 149.6 1.4 9.1 28.7 79 79 A P B > -e 65 0D 69 0, 0.0 3,-2.2 0, 0.0 4,-0.5 -0.705 35.4-124.4 -77.3 136.4 4.7 8.2 27.1 80 80 A c G > S+ 0 0 1 -15,-1.8 3,-1.2 -2,-0.4 -14,-0.1 0.736 106.8 66.5 -54.3 -26.6 5.8 10.8 24.6 81 81 A S G > S+ 0 0 87 -16,-0.3 3,-1.7 1,-0.3 -1,-0.3 0.768 86.8 69.4 -68.3 -23.8 6.2 8.3 21.9 82 82 A A G X S+ 0 0 32 -3,-2.2 3,-1.0 1,-0.3 -1,-0.3 0.830 92.7 61.1 -62.0 -27.7 2.4 7.7 22.0 83 83 A L G < S+ 0 0 2 -3,-1.2 -28,-0.5 -4,-0.5 -1,-0.3 0.494 90.9 65.5 -77.6 -4.3 2.2 11.3 20.5 84 84 A L G < S+ 0 0 43 -3,-1.7 -1,-0.2 -30,-0.2 -2,-0.1 0.252 78.4 122.2-102.4 11.9 4.1 10.4 17.3 85 85 A S S < S- 0 0 57 -3,-1.0 6,-0.1 2,-0.2 -3,-0.0 -0.372 74.0-123.4 -74.0 153.4 1.3 8.1 16.2 86 86 A S S S+ 0 0 76 -2,-0.1 2,-0.7 2,-0.1 -1,-0.1 0.716 101.9 75.2 -66.9 -24.9 -0.6 8.4 12.9 87 87 A D S > S- 0 0 87 1,-0.1 3,-0.5 -47,-0.0 4,-0.3 -0.863 72.7-160.3 -92.2 116.7 -3.7 8.5 15.0 88 88 A I T 3> + 0 0 5 -2,-0.7 4,-3.0 1,-0.2 5,-0.3 0.318 60.3 106.9 -81.7 7.0 -3.9 12.0 16.7 89 89 A T H 3> S+ 0 0 41 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.911 81.6 46.2 -53.5 -48.0 -6.2 11.1 19.5 90 90 A A H <> S+ 0 0 25 -3,-0.5 4,-2.0 -8,-0.2 5,-0.2 0.917 115.1 47.1 -62.6 -43.7 -3.5 11.2 22.2 91 91 A S H > S+ 0 0 3 -4,-0.3 4,-3.0 -9,-0.2 5,-0.2 0.968 114.8 45.9 -60.9 -54.7 -2.1 14.5 20.9 92 92 A V H X S+ 0 0 1 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.923 113.6 49.6 -55.4 -44.3 -5.5 16.1 20.6 93 93 A N H X S+ 0 0 84 -4,-2.8 4,-0.9 -5,-0.3 -1,-0.2 0.818 114.6 43.3 -65.1 -38.1 -6.6 14.8 24.1 94 94 A d H X S+ 0 0 5 -4,-2.0 4,-2.3 -5,-0.2 3,-0.3 0.876 110.5 56.7 -75.5 -36.9 -3.5 16.1 25.8 95 95 A A H X S+ 0 0 0 -4,-3.0 4,-3.4 -5,-0.2 5,-0.2 0.876 101.8 56.8 -60.9 -35.7 -3.7 19.4 23.9 96 96 A K H X S+ 0 0 51 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.908 108.0 47.6 -61.9 -38.6 -7.2 19.9 25.3 97 97 A K H < S+ 0 0 111 -4,-0.9 4,-0.3 -3,-0.3 -2,-0.2 0.880 113.3 48.2 -68.6 -39.7 -5.7 19.6 28.8 98 98 A I H >< S+ 0 0 8 -4,-2.3 3,-1.5 1,-0.2 5,-0.4 0.953 111.5 48.5 -67.9 -46.3 -2.9 22.1 27.8 99 99 A V H ><>S+ 0 0 4 -4,-3.4 3,-0.6 1,-0.3 5,-0.5 0.802 107.1 55.2 -66.8 -27.3 -5.3 24.6 26.3 100 100 A S T 3<5S+ 0 0 44 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.538 82.6 102.6 -80.0 -4.0 -7.6 24.5 29.3 101 101 A D T < 5S- 0 0 99 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.1 0.444 100.4-104.2 -58.6 -11.4 -4.5 25.4 31.4 102 102 A G T < 5S+ 0 0 78 -3,-0.6 -1,-0.1 -4,-0.1 -2,-0.1 0.225 113.3 72.0 104.1 -18.7 -5.3 29.1 31.9 103 103 A N T > 5S- 0 0 89 -5,-0.4 3,-1.3 1,-0.2 -4,-0.1 0.445 84.5-157.4-105.1 -6.6 -2.8 30.3 29.4 104 104 A G G > < - 0 0 9 -5,-0.5 3,-1.4 -6,-0.2 -1,-0.2 -0.212 59.0 -25.3 64.6-152.4 -4.7 29.2 26.3 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.0 2,-0.1 7,-0.3 0.476 116.8 91.4 -74.9 0.1 -3.0 28.5 23.0 106 106 A N G < + 0 0 37 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.714 68.3 78.8 -67.0 -16.4 -0.3 31.0 24.1 107 107 A A G < S+ 0 0 53 -3,-1.4 2,-0.8 1,-0.1 -1,-0.3 0.702 81.9 73.7 -62.5 -21.6 1.4 27.9 25.4 108 108 A W S <> S- 0 0 11 -3,-2.0 4,-2.6 1,-0.2 3,-0.3 -0.868 71.4-159.5-100.4 111.4 2.4 27.2 21.8 109 109 A V H > S+ 0 0 80 -2,-0.8 4,-2.8 1,-0.2 5,-0.2 0.865 91.9 52.5 -55.6 -41.1 5.1 29.6 20.8 110 110 A A H >>S+ 0 0 12 2,-0.2 4,-2.0 1,-0.2 5,-0.5 0.894 109.8 48.5 -68.1 -34.4 4.4 29.1 17.1 111 111 A W H >>S+ 0 0 15 -3,-0.3 5,-3.2 -6,-0.2 4,-2.3 0.966 113.7 47.3 -67.1 -47.6 0.7 29.9 17.6 112 112 A R H <5S+ 0 0 99 -4,-2.6 -2,-0.2 -7,-0.3 -3,-0.2 0.955 120.9 35.4 -57.9 -48.1 1.5 33.0 19.6 113 113 A N H <5S+ 0 0 112 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.678 134.0 19.2 -84.5 -18.1 4.1 34.3 17.1 114 114 A R H <5S+ 0 0 144 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.2 0.572 129.2 32.0-128.1 -14.1 2.6 33.3 13.8 115 115 A b T >< + 0 0 87 -2,-0.2 3,-1.8 1,-0.2 4,-0.2 -0.563 53.3 170.6 -79.5 77.3 -6.8 35.4 9.4 120 120 A V G > + 0 0 9 -2,-2.2 3,-2.3 1,-0.3 4,-0.2 0.770 66.0 75.0 -62.7 -22.3 -6.6 31.8 10.8 121 121 A Q G >> S+ 0 0 86 1,-0.3 3,-1.5 -3,-0.2 4,-0.7 0.743 78.5 73.8 -62.9 -20.9 -9.8 30.9 8.8 122 122 A A G <4 S+ 0 0 47 -3,-1.8 3,-0.4 1,-0.3 -1,-0.3 0.786 84.5 69.7 -64.0 -21.6 -7.6 30.9 5.7 123 123 A W G <4 S+ 0 0 52 -3,-2.3 -1,-0.3 -4,-0.2 -2,-0.2 0.691 108.0 31.1 -70.0 -20.5 -6.2 27.6 7.1 124 124 A I T X4 S+ 0 0 42 -3,-1.5 3,-1.5 -4,-0.2 -1,-0.2 0.388 86.9 124.3-119.3 5.3 -9.5 25.6 6.5 125 125 A R T 3< S+ 0 0 130 -4,-0.7 3,-0.1 -3,-0.4 -119,-0.1 -0.463 75.2 23.8 -71.0 133.7 -10.9 27.4 3.5 126 126 A G T 3 S+ 0 0 82 1,-0.3 2,-0.4 -2,-0.2 -1,-0.3 0.469 94.7 129.7 92.8 4.4 -11.7 25.1 0.6 127 127 A a < - 0 0 23 -3,-1.5 2,-1.0 -122,-0.0 -1,-0.3 -0.761 57.4-143.2 -98.7 136.7 -11.9 22.1 2.8 128 128 A R 0 0 238 -2,-0.4 -118,-0.1 1,-0.2 -3,-0.0 -0.886 360.0 360.0 -92.3 99.6 -14.9 19.7 2.8 129 129 A L 0 0 95 -2,-1.0 -1,-0.2 -120,-0.1 -115,-0.1 0.878 360.0 360.0 -93.6 360.0 -14.9 19.2 6.6