==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-SEP-95 1YAQ . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.YAMAGATA,H.KANEDA,S.FUJII,K.TAKANO,K.OGASAHARA,E.KANAYA, . 130 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6875.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 88 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 9 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 25.4 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 2 0 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 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 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 71 0, 0.0 39,-2.5 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 153.2 1.4 20.2 21.8 2 2 A V B -A 39 0A 100 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.912 360.0-141.8-106.1 108.0 4.1 19.5 19.3 3 3 A F - 0 0 14 35,-2.6 2,-0.3 -2,-0.7 3,-0.0 -0.361 10.9-123.3 -68.8 149.3 7.0 22.1 19.5 4 4 A E > - 0 0 142 1,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.632 34.3-111.3 -83.7 151.0 8.8 23.5 16.5 5 5 A R H > S+ 0 0 90 -2,-0.3 4,-2.2 1,-0.2 3,-0.1 0.952 113.9 36.0 -52.1 -63.5 12.5 22.8 16.8 6 6 A a H > S+ 0 0 24 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.847 113.0 60.6 -62.9 -29.8 13.8 26.4 17.3 7 7 A E H > S+ 0 0 63 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.949 108.8 43.2 -61.8 -47.2 10.7 27.3 19.3 8 8 A L H X S+ 0 0 1 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.917 109.9 56.8 -64.6 -44.0 11.6 24.6 21.9 9 9 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.920 109.0 45.6 -55.3 -46.2 15.3 25.5 21.9 10 10 A R H X S+ 0 0 117 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.898 112.7 52.3 -66.4 -34.6 14.5 29.1 22.8 11 11 A T H X S+ 0 0 19 -4,-1.8 4,-1.6 -5,-0.2 -2,-0.2 0.922 109.8 46.4 -67.1 -45.7 12.1 27.9 25.5 12 12 A L H <>S+ 0 0 1 -4,-2.9 5,-2.1 1,-0.2 6,-0.3 0.899 110.0 55.1 -65.3 -36.9 14.6 25.6 27.2 13 13 A K H ><5S+ 0 0 87 -4,-2.0 3,-1.6 -5,-0.3 5,-0.2 0.939 107.7 49.2 -58.9 -47.1 17.2 28.4 27.1 14 14 A R H 3<5S+ 0 0 187 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.814 106.3 56.6 -62.9 -32.6 14.8 30.7 28.9 15 15 A L T 3<5S- 0 0 55 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.312 120.2-108.7 -83.9 7.2 14.1 27.9 31.5 16 16 A G T < 5S+ 0 0 40 -3,-1.6 -3,-0.2 -5,-0.1 -2,-0.1 0.750 76.5 132.7 73.4 32.0 17.9 27.7 32.3 17 17 A M > < + 0 0 0 -5,-2.1 3,-1.6 2,-0.1 2,-0.7 0.646 35.5 106.1 -86.5 -19.5 18.7 24.3 30.7 18 18 A D T 3 S- 0 0 78 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.526 103.1 -6.4 -69.7 108.3 21.8 25.4 28.8 19 19 A G T > S+ 0 0 41 4,-2.0 3,-2.1 -2,-0.7 -1,-0.3 0.513 87.7 164.7 87.2 6.1 24.7 24.0 30.7 20 20 A Y B X S-B 23 0B 58 -3,-1.6 3,-2.1 3,-0.7 -1,-0.3 -0.406 79.7 -12.6 -60.5 121.7 22.6 22.7 33.6 21 21 A R T 3 S- 0 0 141 1,-0.3 -1,-0.3 -2,-0.2 3,-0.1 0.844 133.7 -54.3 51.4 37.3 24.8 20.3 35.6 22 22 A G T < S+ 0 0 75 -3,-2.1 2,-0.7 1,-0.2 -1,-0.3 0.492 106.3 131.0 78.8 7.0 27.2 20.3 32.6 23 23 A I B < -B 20 0B 12 -3,-2.1 -4,-2.0 -6,-0.1 -3,-0.7 -0.827 51.1-136.9 -99.9 116.9 24.6 19.4 30.0 24 24 A S >> - 0 0 45 -2,-0.7 4,-1.4 -5,-0.2 3,-1.1 -0.288 20.5-114.9 -67.7 155.5 24.5 21.6 26.9 25 25 A L H 3> S+ 0 0 4 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.854 114.9 59.7 -59.1 -38.2 21.3 22.8 25.3 26 26 A A H 3> S+ 0 0 11 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.822 102.9 53.5 -62.7 -28.4 21.9 20.8 22.1 27 27 A N H <> S+ 0 0 31 -3,-1.1 4,-2.5 2,-0.2 -1,-0.2 0.920 107.7 48.7 -70.9 -43.0 22.0 17.6 24.3 28 28 A W H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.877 112.6 49.9 -61.9 -38.7 18.6 18.4 25.8 29 29 A M H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.922 109.4 49.7 -65.7 -46.2 17.3 19.0 22.3 30 30 A b H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.915 112.6 49.5 -58.7 -41.0 18.7 15.7 21.0 31 31 A L H X S+ 0 0 2 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.941 111.6 46.2 -62.6 -53.0 17.0 14.0 24.0 32 32 A A H X>S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 6,-1.3 0.891 111.2 54.6 -58.0 -41.3 13.5 15.6 23.5 33 33 A K H X5S+ 0 0 70 -4,-2.4 4,-1.0 4,-0.2 -1,-0.2 0.950 115.6 36.0 -58.7 -53.0 13.7 14.8 19.8 34 34 A W H <5S+ 0 0 90 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.775 118.1 50.9 -75.1 -28.0 14.3 11.1 20.3 35 35 A E H <5S- 0 0 43 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.925 138.3 -11.6 -76.7 -43.0 12.2 10.6 23.3 36 36 A S H <5S- 0 0 23 -4,-2.3 -3,-0.2 20,-0.4 -2,-0.2 0.489 83.0-110.4-136.5 -8.6 9.0 12.3 22.0 37 37 A G S < -A 2 0A 44 -7,-0.3 3,-1.0 -37,-0.2 -37,-0.2 -0.877 36.8-166.5-107.0 114.3 5.5 16.2 21.8 40 40 A T T 3 S+ 0 0 2 -39,-2.5 16,-0.2 -2,-0.6 -1,-0.1 0.687 87.6 53.6 -72.5 -20.0 4.3 17.2 25.3 41 41 A R T 3 S+ 0 0 179 -40,-0.3 -1,-0.2 14,-0.2 44,-0.1 0.427 77.9 128.8 -96.6 4.4 1.4 14.8 25.3 42 42 A A < + 0 0 20 -3,-1.0 13,-2.4 12,-0.1 2,-0.4 -0.315 32.0 178.5 -62.1 133.0 3.4 11.7 24.5 43 43 A T E -C 54 0C 84 11,-0.2 2,-0.4 15,-0.1 11,-0.2 -0.995 9.7-170.3-136.7 140.5 2.9 8.6 26.8 44 44 A N E -C 53 0C 73 9,-1.9 9,-2.7 -2,-0.4 2,-0.4 -0.965 12.3-148.2-136.9 115.1 4.5 5.2 26.5 45 45 A Y E -C 52 0C 127 -2,-0.4 2,-0.8 7,-0.2 7,-0.2 -0.699 3.4-152.6 -86.0 131.9 3.4 2.3 28.6 46 46 A N E >>> -C 51 0C 43 5,-3.0 4,-1.2 -2,-0.4 5,-1.0 -0.877 10.8-174.9-104.9 96.0 6.0 -0.3 29.6 47 47 A A T 345S+ 0 0 73 -2,-0.8 -1,-0.2 1,-0.2 3,-0.0 0.793 75.7 70.3 -62.4 -28.5 4.0 -3.5 30.0 48 48 A G T 345S+ 0 0 86 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.798 119.8 11.8 -60.2 -34.6 7.2 -5.3 31.2 49 49 A D T <45S- 0 0 67 -3,-0.9 -1,-0.2 2,-0.2 -2,-0.2 0.262 101.6-113.7-128.2 7.2 7.4 -3.4 34.5 50 50 A R T <5S+ 0 0 155 -4,-1.2 2,-0.2 1,-0.2 -3,-0.2 0.698 73.7 125.6 66.9 25.9 4.0 -1.7 34.7 51 51 A S E < -C 46 0C 0 -5,-1.0 -5,-3.0 19,-0.1 2,-0.4 -0.692 47.5-143.2-111.2 164.5 5.4 1.8 34.5 52 52 A T E -C 45 0C 8 -2,-0.2 9,-2.1 -7,-0.2 2,-0.5 -0.982 7.2-138.5-132.0 140.2 4.6 4.7 32.1 53 53 A D E -CD 44 60C 25 -9,-2.7 -9,-1.9 -2,-0.4 2,-0.4 -0.859 27.5-156.2 -95.5 130.0 6.9 7.3 30.4 54 54 A Y E > -CD 43 59C 22 5,-2.5 5,-2.1 -2,-0.5 3,-0.4 -0.909 31.5 -25.7-119.4 134.0 5.3 10.8 30.4 55 55 A G T > 5S- 0 0 1 -13,-2.4 3,-1.1 -2,-0.4 -16,-0.2 -0.098 97.3 -26.0 80.7-169.0 5.8 13.9 28.2 56 56 A I T 3 5S+ 0 0 4 28,-0.3 -20,-0.4 1,-0.3 -18,-0.3 0.792 140.5 35.1 -58.6 -32.2 8.4 15.6 26.1 57 57 A F T 3 5S- 0 0 2 -3,-0.4 -1,-0.3 27,-0.1 -2,-0.2 0.384 106.2-125.6-102.6 -0.9 11.3 14.0 28.0 58 58 A Q T < 5 - 0 0 15 -3,-1.1 2,-0.3 1,-0.2 -3,-0.2 0.958 35.2-166.3 54.0 58.6 9.5 10.7 28.6 59 59 A I E < -D 54 0C 2 -5,-2.1 -5,-2.5 25,-0.1 2,-0.3 -0.605 17.6-117.0 -80.6 133.3 10.0 10.8 32.4 60 60 A N E >>> -D 53 0C 26 -2,-0.3 4,-2.0 -7,-0.2 3,-0.9 -0.520 5.9-145.8 -80.9 135.2 9.3 7.5 34.2 61 61 A S T 345S+ 0 0 0 -9,-2.1 6,-0.2 -2,-0.3 7,-0.1 0.608 90.0 75.1 -69.0 -16.5 6.5 7.0 36.8 62 62 A R T 345S+ 0 0 37 11,-0.2 12,-2.5 -10,-0.1 -1,-0.2 0.841 120.5 1.2 -68.4 -30.6 8.6 4.5 38.8 63 63 A Y T <45S+ 0 0 122 -3,-0.9 13,-3.2 10,-0.2 14,-0.2 0.696 131.6 42.9-125.8 -33.6 10.9 7.1 40.3 64 64 A W T <5S+ 0 0 31 -4,-2.0 13,-2.1 11,-0.3 15,-0.4 0.839 109.3 17.0 -93.4 -40.2 10.0 10.6 39.2 65 65 A c S S- 0 0 13 -9,-0.1 3,-0.9 -18,-0.0 -19,-0.1 -0.810 77.1-118.5 -90.7 124.6 2.9 1.9 39.2 71 71 A P T 3 S- 0 0 45 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.335 85.8 -5.9 -63.2 139.4 4.0 -0.7 41.7 72 72 A G T 3 S+ 0 0 83 1,-0.2 2,-0.2 -2,-0.0 -10,-0.0 0.829 95.8 162.2 44.3 46.7 6.5 0.3 44.4 73 73 A A < - 0 0 35 -3,-0.9 2,-0.3 -5,-0.1 -10,-0.2 -0.560 28.5-153.9 -97.2 158.4 7.0 3.7 42.9 74 74 A V - 0 0 87 -12,-2.5 2,-0.2 -2,-0.2 -9,-0.2 -0.753 12.7-139.5-121.4 169.2 8.4 6.9 44.3 75 75 A N > + 0 0 49 -2,-0.3 3,-1.2 1,-0.1 -11,-0.3 -0.626 29.3 163.8-132.2 70.8 7.8 10.5 43.3 76 76 A A T 3 S+ 0 0 23 -13,-3.2 -12,-0.2 1,-0.3 -11,-0.1 0.837 79.6 50.5 -61.3 -33.2 11.2 12.2 43.5 77 77 A d T 3 S- 0 0 21 -13,-2.1 -1,-0.3 -14,-0.2 -12,-0.1 0.596 102.8-133.4 -81.2 -9.0 9.9 15.2 41.5 78 78 A H < + 0 0 154 -3,-1.2 2,-0.3 -14,-0.2 -13,-0.1 0.936 64.0 124.0 54.0 51.7 6.9 15.6 43.8 79 79 A L - 0 0 33 -15,-0.4 -13,-2.5 16,-0.0 2,-0.3 -0.979 68.6-117.2-139.4 147.1 4.6 15.9 40.8 80 80 A S B > -e 66 0D 70 -2,-0.3 3,-1.5 -15,-0.2 4,-0.4 -0.641 34.6-121.9 -76.1 145.5 1.5 14.1 39.5 81 81 A c G > S+ 0 0 2 -15,-2.5 3,-1.4 -2,-0.3 -14,-0.1 0.770 110.3 73.9 -61.8 -20.5 2.5 12.6 36.2 82 82 A S G > S+ 0 0 82 -16,-0.4 3,-2.0 1,-0.3 -1,-0.3 0.850 84.9 65.0 -58.3 -35.4 -0.4 14.7 34.8 83 83 A A G X S+ 0 0 16 -3,-1.5 3,-0.9 1,-0.3 9,-0.3 0.768 93.7 60.4 -59.2 -26.9 1.9 17.7 35.2 84 84 A L G < S+ 0 0 4 -3,-1.4 -28,-0.3 -4,-0.4 -1,-0.3 0.254 97.0 61.2 -85.8 10.9 4.2 16.3 32.6 85 85 A L G < S+ 0 0 56 -3,-2.0 -1,-0.2 -30,-0.1 -2,-0.2 0.272 79.1 111.5-118.2 9.3 1.5 16.3 29.9 86 86 A Q S < S- 0 0 88 -3,-0.9 6,-0.1 2,-0.2 -3,-0.0 -0.345 73.5-125.7 -79.8 163.2 0.8 20.1 29.9 87 87 A D S S+ 0 0 96 -2,-0.1 2,-0.7 -46,-0.1 -1,-0.1 0.754 98.7 77.5 -75.7 -30.2 1.6 22.4 26.9 88 88 A N S > S- 0 0 107 1,-0.1 3,-0.5 -48,-0.0 4,-0.3 -0.785 71.8-160.7 -82.2 113.8 3.6 24.6 29.4 89 89 A V T 3> + 0 0 6 -2,-0.7 4,-2.7 1,-0.2 5,-0.2 0.392 60.3 106.2 -79.7 5.0 6.9 22.7 29.9 90 90 A A H 3> S+ 0 0 39 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.867 84.0 42.5 -52.3 -46.7 7.9 24.4 33.1 91 91 A D H <> S+ 0 0 60 -3,-0.5 4,-1.9 -8,-0.2 -1,-0.2 0.882 113.6 51.7 -68.9 -40.7 7.1 21.4 35.4 92 92 A A H > S+ 0 0 8 -9,-0.3 4,-2.3 -4,-0.3 -2,-0.2 0.883 112.1 48.0 -62.0 -39.2 8.7 18.9 32.9 93 93 A V H X S+ 0 0 3 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.915 109.4 51.5 -68.9 -42.8 11.8 21.0 32.9 94 94 A A H X S+ 0 0 55 -4,-2.2 4,-1.2 -5,-0.2 -1,-0.2 0.863 113.8 45.6 -61.9 -34.7 12.0 21.3 36.7 95 95 A d H X S+ 0 0 2 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.873 108.8 53.6 -76.8 -38.2 11.6 17.5 36.9 96 96 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.884 106.3 55.1 -62.2 -37.5 14.3 16.8 34.2 97 97 A K H < S+ 0 0 44 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.903 107.7 49.5 -61.7 -40.1 16.6 19.0 36.3 98 98 A R H >< S+ 0 0 70 -4,-1.2 3,-1.4 1,-0.2 4,-0.3 0.921 106.5 55.5 -64.2 -44.1 15.9 16.7 39.3 99 99 A V H >< S+ 0 0 2 -4,-2.4 3,-1.1 1,-0.3 6,-0.3 0.902 108.0 48.2 -56.4 -44.6 16.7 13.6 37.2 100 100 A V T 3< S+ 0 0 0 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.481 93.4 74.5 -78.8 -2.3 20.1 14.9 36.2 101 101 A R T < S+ 0 0 120 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.2 0.533 83.1 87.8 -82.3 -9.9 21.1 15.8 39.7 102 102 A D S X S- 0 0 65 -3,-1.1 3,-1.9 -4,-0.3 6,-0.1 -0.540 102.0 -94.8 -81.6 160.0 21.5 12.1 40.4 103 103 A P T 3 S+ 0 0 129 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.807 120.0 55.9 -43.1 -49.9 24.9 10.4 39.6 104 104 A Q T > S- 0 0 111 1,-0.2 3,-1.9 -5,-0.1 -4,-0.1 0.704 82.4-177.3 -60.6 -25.6 24.1 9.2 36.1 105 105 A G G X - 0 0 11 -3,-1.9 3,-1.8 -6,-0.3 -1,-0.2 -0.300 69.0 -6.2 62.1-136.8 23.2 12.7 34.9 106 106 A I G > S+ 0 0 11 1,-0.3 3,-1.4 -6,-0.2 -1,-0.3 0.685 123.9 78.4 -63.0 -20.9 21.9 12.7 31.3 107 107 A R G < + 0 0 112 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.631 67.6 87.4 -66.1 -13.6 22.8 9.0 31.0 108 108 A A G < S+ 0 0 35 -3,-1.8 2,-0.8 -6,-0.1 -1,-0.3 0.828 79.5 70.0 -55.6 -31.5 19.6 8.1 32.9 109 109 A W S X> S- 0 0 20 -3,-1.4 3,-1.0 1,-0.2 4,-1.0 -0.808 72.1-158.8 -92.7 115.4 17.9 8.1 29.5 110 110 A V H 3> S+ 0 0 78 -2,-0.8 4,-2.0 1,-0.3 3,-0.3 0.843 90.6 62.3 -60.4 -35.2 19.0 5.1 27.5 111 111 A A H 3> S+ 0 0 21 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.841 97.0 59.0 -60.2 -33.2 17.9 6.9 24.2 112 112 A W H <>>S+ 0 0 14 -3,-1.0 5,-2.5 -6,-0.2 4,-2.4 0.923 106.6 47.1 -61.6 -44.0 20.5 9.6 24.9 113 113 A R H <5S+ 0 0 94 -4,-1.0 -2,-0.2 -3,-0.3 -1,-0.2 0.910 115.6 46.1 -62.2 -45.5 23.3 7.0 24.9 114 114 A N H <5S+ 0 0 95 -4,-2.0 -2,-0.2 1,-0.1 -1,-0.2 0.888 130.6 14.9 -66.7 -45.5 22.0 5.4 21.7 115 115 A R H <5S+ 0 0 112 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.541 132.2 29.8-114.4 -2.6 21.4 8.5 19.6 116 116 A b T ><5S+ 0 0 1 -4,-2.4 3,-1.8 -5,-0.3 -3,-0.2 0.713 83.8 99.4-122.7 -42.8 23.1 11.6 21.2 117 117 A Q T 3 + 0 0 21 -2,-1.1 3,-1.5 1,-0.2 4,-0.4 0.374 47.5 102.6 -95.2 7.6 24.5 17.3 18.2 122 122 A R G >> + 0 0 146 1,-0.3 3,-1.6 2,-0.2 4,-0.9 0.860 67.7 71.5 -58.0 -35.3 25.1 20.9 16.9 123 123 A Q G 34 S+ 0 0 120 -3,-0.4 3,-0.3 1,-0.3 -1,-0.3 0.774 86.7 64.6 -52.5 -32.3 22.4 20.3 14.3 124 124 A Y G <4 S+ 0 0 19 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.799 113.0 30.4 -66.6 -28.9 19.6 20.4 16.9 125 125 A V T X4 S+ 0 0 26 -3,-1.6 3,-1.7 -4,-0.4 5,-0.4 0.383 87.6 130.0-110.5 3.0 20.2 24.1 17.8 126 126 A Q T 3< S+ 0 0 93 -4,-0.9 -120,-0.1 -3,-0.3 -3,-0.0 -0.369 79.4 3.8 -67.8 129.7 21.5 25.4 14.5 127 127 A G T 3 S+ 0 0 81 -2,-0.2 -1,-0.3 3,-0.1 -4,-0.0 0.431 98.2 110.6 79.7 3.6 19.8 28.6 13.3 128 128 A a S < S- 0 0 1 -3,-1.7 -2,-0.1 2,-0.1 -118,-0.1 0.520 82.8-121.1 -87.7 -8.8 17.7 29.0 16.4 129 129 A G 0 0 79 -4,-0.3 -3,-0.1 1,-0.2 -4,-0.0 0.824 360.0 360.0 74.6 32.4 19.4 32.0 17.9 130 130 A V 0 0 64 -5,-0.4 -1,-0.2 -117,-0.0 -3,-0.1 -0.594 360.0 360.0-116.7 360.0 20.4 30.4 21.1