==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 19-OCT-09 3KAM . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR R.S.ROWLETT . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6636.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 84 65.1 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 . 9 7.0 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 . 0 0.0 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 . 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 . 1 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,-3.3 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 134.3 -2.2 -10.6 -9.7 2 2 A V B -A 39 0A 99 37,-0.2 37,-0.2 38,-0.1 2,-0.2 -0.937 360.0-150.6 -99.3 109.2 -2.2 -14.0 -11.5 3 3 A F - 0 0 13 35,-2.6 2,-0.2 -2,-0.7 3,-0.0 -0.473 10.3-125.1 -72.5 147.3 1.3 -15.3 -11.6 4 4 A G > - 0 0 35 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.570 34.6-106.6 -77.2 158.4 2.7 -17.5 -14.3 5 5 A R H > S+ 0 0 90 -2,-0.2 4,-2.1 2,-0.2 5,-0.1 0.922 118.2 37.7 -54.0 -53.3 4.2 -20.8 -13.0 6 6 A a H > S+ 0 0 41 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.866 113.8 58.0 -71.5 -34.4 7.9 -19.9 -13.5 7 7 A E H > S+ 0 0 91 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.931 110.5 42.8 -58.9 -45.6 7.3 -16.2 -12.5 8 8 A L H X S+ 0 0 0 -4,-2.7 4,-3.1 2,-0.2 -2,-0.2 0.897 111.0 54.8 -69.6 -38.1 6.0 -17.4 -9.1 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.942 111.1 46.7 -56.9 -45.9 8.7 -20.0 -8.7 10 10 A A H X S+ 0 0 32 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.932 113.3 46.9 -61.3 -50.1 11.2 -17.2 -9.2 11 11 A A H X S+ 0 0 21 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.895 110.9 53.0 -60.2 -43.1 9.5 -14.8 -6.8 12 12 A M H <>S+ 0 0 0 -4,-3.1 5,-2.4 2,-0.2 6,-0.4 0.912 110.9 47.0 -58.8 -41.5 9.2 -17.6 -4.2 13 13 A K H ><5S+ 0 0 89 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.930 109.2 53.1 -65.5 -43.8 12.9 -18.2 -4.5 14 14 A R H 3<5S+ 0 0 209 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.875 110.1 50.1 -58.0 -38.3 13.7 -14.5 -4.2 15 15 A H T 3<5S- 0 0 49 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.282 122.6-104.7 -90.4 10.3 11.6 -14.4 -1.0 16 16 A G T < 5S+ 0 0 36 -3,-1.8 -3,-0.2 -5,-0.1 -2,-0.1 0.676 83.0 121.3 84.8 20.1 13.4 -17.4 0.5 17 17 A L > < + 0 0 0 -5,-2.4 3,-2.2 2,-0.1 2,-0.4 0.659 36.9 113.9 -85.1 -18.5 11.0 -20.3 0.2 18 18 A D T 3 S- 0 0 59 -6,-0.4 6,-0.2 1,-0.3 3,-0.1 -0.418 103.6 -12.9 -62.7 112.4 13.3 -22.5 -1.8 19 19 A N T > S+ 0 0 96 4,-1.3 3,-2.4 -2,-0.4 -1,-0.3 0.583 90.0 166.3 61.3 16.3 13.9 -25.4 0.6 20 20 A Y G X S- 0 0 64 -3,-2.2 3,-2.3 3,-0.5 -1,-0.2 -0.399 78.2 -2.9 -56.9 128.3 12.5 -23.6 3.5 21 21 A R G 3 S- 0 0 144 1,-0.3 -1,-0.3 -2,-0.1 3,-0.1 0.800 135.0 -61.1 51.4 29.5 11.9 -26.2 6.2 22 22 A G G < S+ 0 0 57 -3,-2.4 2,-0.7 1,-0.2 -1,-0.3 0.493 103.0 132.0 83.1 3.2 13.2 -28.8 3.7 23 23 A Y < - 0 0 48 -3,-2.3 -4,-1.3 -6,-0.1 -3,-0.5 -0.810 52.9-133.6 -95.2 116.1 10.4 -28.2 1.2 24 24 A S >> - 0 0 42 -2,-0.7 3,-1.5 -5,-0.2 4,-1.0 -0.258 26.6-104.1 -63.1 155.9 11.7 -27.8 -2.4 25 25 A L H 3> S+ 0 0 1 1,-0.3 4,-2.3 2,-0.2 3,-0.3 0.817 119.4 63.0 -45.3 -44.7 10.4 -24.9 -4.6 26 26 A G H 3> S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.843 98.8 56.0 -53.6 -35.7 8.3 -27.3 -6.6 27 27 A N H <> S+ 0 0 21 -3,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.914 109.6 45.1 -59.9 -43.2 6.3 -28.1 -3.4 28 28 A W H X S+ 0 0 0 -4,-1.0 4,-2.2 -3,-0.3 -2,-0.2 0.860 114.1 48.3 -71.3 -41.3 5.5 -24.4 -2.9 29 29 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.919 112.1 49.4 -65.4 -43.9 4.5 -23.9 -6.5 30 30 A b H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 5,-0.2 0.928 111.5 49.8 -58.5 -47.0 2.3 -27.0 -6.5 31 31 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 5,-0.3 0.921 111.6 48.1 -60.6 -45.1 0.6 -25.8 -3.3 32 32 A A H X>S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 6,-1.3 0.901 108.4 55.1 -63.8 -39.5 -0.0 -22.4 -4.8 33 33 A K H X5S+ 0 0 63 -4,-2.4 4,-1.6 4,-0.2 -2,-0.2 0.956 116.7 35.2 -56.7 -47.7 -1.4 -23.8 -8.0 34 34 A F H <5S+ 0 0 58 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.709 119.5 49.3 -86.9 -18.4 -4.0 -25.9 -6.2 35 35 A E H <5S- 0 0 30 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.888 138.7 -6.2 -79.8 -43.9 -4.8 -23.4 -3.4 36 36 A S H ><5S- 0 0 11 -4,-2.4 3,-1.5 19,-0.4 -3,-0.2 0.391 84.5-114.9-134.8 -0.4 -5.3 -20.3 -5.6 37 37 A N T 3< - 0 0 45 4,-2.9 3,-2.0 -2,-0.3 -1,-0.0 -0.563 23.3-112.5 -89.0 155.6 -14.7 -21.9 5.2 47 47 A T T 3 S+ 0 0 161 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.822 116.4 59.0 -57.6 -30.3 -17.7 -23.7 6.7 48 48 A D T 3 S- 0 0 85 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.451 122.9-102.7 -80.5 -2.5 -16.7 -22.6 10.2 49 49 A G S < S+ 0 0 22 -3,-2.0 -2,-0.1 1,-0.4 -1,-0.1 0.249 85.7 119.6 97.1 -7.1 -16.9 -18.9 9.2 50 50 A S - 0 0 0 19,-0.1 -4,-2.9 -5,-0.1 -1,-0.4 -0.345 54.6-137.7 -76.5 169.8 -13.2 -18.3 8.8 51 51 A T E -B 45 0B 2 -6,-0.3 9,-2.6 -3,-0.1 2,-0.4 -0.978 1.6-135.6-130.8 146.4 -11.8 -17.2 5.3 52 52 A D E -BC 44 59B 26 -8,-3.0 -8,-1.9 -2,-0.3 2,-0.4 -0.851 26.6-159.0-100.7 133.0 -8.7 -18.3 3.3 53 53 A Y E > -BC 43 58B 24 5,-2.1 5,-2.2 -2,-0.4 3,-0.3 -0.955 31.6 -21.4-120.7 133.7 -6.7 -15.6 1.7 54 54 A G T > 5S- 0 0 0 -12,-2.8 3,-1.9 -2,-0.4 30,-0.2 -0.081 98.6 -25.5 85.8-173.5 -4.2 -15.3 -1.2 55 55 A I T 3 5S+ 0 0 1 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.796 141.4 33.5 -52.7 -33.9 -1.8 -17.5 -3.1 56 56 A L T 3 5S- 0 0 0 -3,-0.3 -1,-0.3 27,-0.2 -2,-0.2 0.201 105.8-123.1-110.8 15.6 -1.5 -19.9 -0.3 57 57 A Q T < 5 - 0 0 10 -3,-1.9 2,-0.3 1,-0.2 -3,-0.2 0.887 34.0-163.5 50.5 52.4 -5.0 -19.6 1.1 58 58 A I E < -C 53 0B 2 -5,-2.2 -5,-2.1 -6,-0.1 2,-0.3 -0.540 16.6-121.7 -77.6 131.3 -3.9 -18.7 4.6 59 59 A N E >> -C 52 0B 41 -2,-0.3 4,-2.4 -7,-0.2 3,-1.2 -0.580 8.1-148.7 -87.6 127.6 -6.8 -19.1 7.1 60 60 A S T 34 S+ 0 0 0 -9,-2.6 6,-0.2 -2,-0.3 13,-0.2 0.609 90.5 82.7 -64.5 -13.6 -8.1 -16.2 9.3 61 61 A R T 34 S- 0 0 57 -10,-0.2 12,-2.1 11,-0.2 -1,-0.2 0.869 120.0 -7.3 -56.0 -39.2 -8.9 -19.0 12.0 62 62 A W T <4 S+ 0 0 130 -3,-1.2 13,-2.8 10,-0.2 -2,-0.2 0.644 132.3 46.7-126.0 -32.7 -5.2 -18.7 13.1 63 63 A W S < S+ 0 0 33 -4,-2.4 13,-2.0 11,-0.3 15,-0.3 0.748 102.0 21.0-109.4 -26.3 -3.1 -16.6 11.0 64 64 A c - 0 0 0 -5,-0.5 2,-0.6 9,-0.4 11,-0.1 -0.946 68.3-112.5-142.8 159.9 -4.4 -13.2 10.0 65 65 A N B +d 79 0C 81 13,-2.4 15,-2.5 -2,-0.3 16,-0.4 -0.872 35.4 158.7 -97.5 123.3 -7.0 -10.7 11.2 66 66 A D - 0 0 38 -2,-0.6 -1,-0.1 13,-0.2 8,-0.0 0.331 52.0-123.7-116.9 1.8 -10.1 -10.1 9.0 67 67 A G S S+ 0 0 67 2,-0.1 -2,-0.1 -7,-0.1 0, 0.0 0.525 96.3 72.5 74.8 3.1 -12.3 -8.7 11.8 68 68 A R + 0 0 122 1,-0.1 -1,-0.1 2,-0.0 -3,-0.0 0.071 66.3 91.8-138.3 23.3 -15.1 -11.3 11.2 69 69 A T > - 0 0 10 -9,-0.1 3,-1.4 -19,-0.0 -2,-0.1 -0.793 69.4-141.7-121.2 91.3 -13.8 -14.6 12.5 70 70 A P T 3 S+ 0 0 110 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.105 80.6 11.5 -52.1 140.4 -14.8 -15.0 16.2 71 71 A G T 3 S+ 0 0 87 1,-0.2 2,-0.1 0, 0.0 -10,-0.0 0.632 99.4 148.7 75.6 13.8 -12.4 -16.6 18.6 72 72 A S < - 0 0 31 -3,-1.4 2,-0.2 1,-0.1 -1,-0.2 -0.347 40.3-140.4 -83.0 152.4 -9.7 -16.3 16.0 73 73 A R - 0 0 143 -12,-2.1 -9,-0.4 -13,-0.2 3,-0.1 -0.683 4.8-152.2-104.7 172.7 -6.0 -15.7 16.3 74 74 A N > + 0 0 49 -2,-0.2 3,-1.7 -11,-0.2 -11,-0.3 -0.543 28.1 161.9-140.9 63.5 -3.7 -13.5 14.2 75 75 A L T 3 S+ 0 0 66 -13,-2.8 -12,-0.2 1,-0.3 -11,-0.1 0.675 74.6 51.8 -71.6 -21.4 -0.4 -15.3 14.6 76 76 A d T 3 S- 0 0 13 -13,-2.0 -1,-0.3 2,-0.2 -12,-0.1 0.492 103.6-132.9 -87.8 -4.3 1.2 -13.6 11.6 77 77 A N < + 0 0 130 -3,-1.7 -13,-0.1 1,-0.2 -2,-0.1 0.914 64.9 111.3 51.9 53.4 0.2 -10.2 12.9 78 78 A I S S- 0 0 33 -15,-0.3 -13,-2.4 16,-0.0 2,-0.2 -0.991 75.3-102.5-148.4 148.8 -1.2 -8.9 9.7 79 79 A P B > -d 65 0C 71 0, 0.0 3,-1.8 0, 0.0 4,-0.4 -0.550 36.0-124.2 -67.3 138.8 -4.6 -7.9 8.2 80 80 A c G > S+ 0 0 1 -15,-2.5 3,-2.0 1,-0.3 -14,-0.1 0.823 109.3 71.3 -56.2 -32.6 -5.7 -10.8 6.0 81 81 A S G > S+ 0 0 84 -16,-0.4 3,-2.0 1,-0.3 -1,-0.3 0.822 86.0 66.4 -50.8 -33.1 -6.0 -8.1 3.2 82 82 A A G X S+ 0 0 30 -3,-1.8 3,-1.0 1,-0.3 9,-0.3 0.758 90.1 64.9 -59.4 -26.4 -2.2 -8.0 3.1 83 83 A L G < S+ 0 0 1 -3,-2.0 -28,-0.5 -4,-0.4 -1,-0.3 0.408 94.3 60.7 -77.3 1.0 -2.3 -11.6 1.9 84 84 A L G < S+ 0 0 41 -3,-2.0 -1,-0.2 -30,-0.2 -2,-0.2 0.406 76.8 122.0-108.6 2.7 -3.9 -10.4 -1.4 85 85 A S S < S- 0 0 54 -3,-1.0 6,-0.1 2,-0.2 -3,-0.0 -0.224 71.2-126.3 -65.0 150.8 -1.2 -8.1 -2.6 86 86 A S S S+ 0 0 72 2,-0.0 2,-0.6 -45,-0.0 -1,-0.1 0.788 102.1 76.7 -63.0 -25.3 0.5 -8.5 -6.0 87 87 A D S S- 0 0 89 1,-0.1 3,-0.5 -47,-0.0 4,-0.3 -0.793 76.1-156.1 -88.6 124.3 3.7 -8.4 -3.8 88 88 A I > + 0 0 6 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.395 62.6 105.7 -87.6 2.4 4.0 -11.8 -2.2 89 89 A T H > S+ 0 0 51 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.900 82.0 46.4 -48.4 -52.9 6.1 -10.8 0.9 90 90 A A H > S+ 0 0 24 -3,-0.5 4,-2.3 -8,-0.3 5,-0.2 0.924 114.5 47.1 -59.1 -43.6 3.3 -11.0 3.4 91 91 A S H > S+ 0 0 4 -9,-0.3 4,-2.7 -4,-0.3 -1,-0.2 0.927 114.5 47.3 -66.4 -42.7 2.1 -14.4 2.2 92 92 A V H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.941 112.0 48.8 -63.2 -49.2 5.6 -15.8 2.1 93 93 A N H X S+ 0 0 79 -4,-3.0 4,-1.1 -5,-0.2 -1,-0.2 0.885 115.1 44.9 -60.2 -39.3 6.5 -14.5 5.6 94 94 A d H X S+ 0 0 2 -4,-2.3 4,-2.3 -5,-0.2 3,-0.3 0.905 109.3 55.1 -73.2 -40.0 3.3 -15.9 7.0 95 95 A A H X S+ 0 0 0 -4,-2.7 4,-2.8 -5,-0.2 5,-0.2 0.873 101.8 59.0 -60.3 -33.9 3.7 -19.3 5.2 96 96 A K H X S+ 0 0 43 -4,-2.3 4,-0.8 1,-0.2 -1,-0.2 0.896 108.0 46.2 -59.8 -40.6 7.1 -19.6 6.8 97 97 A K H < S+ 0 0 107 -4,-1.1 4,-0.5 -3,-0.3 3,-0.4 0.925 113.1 49.1 -65.9 -43.9 5.4 -19.5 10.2 98 98 A I H >< S+ 0 0 5 -4,-2.3 3,-1.5 1,-0.2 5,-0.3 0.943 111.0 48.2 -60.3 -51.5 2.7 -21.9 9.2 99 99 A V H 3< S+ 0 0 3 -4,-2.8 5,-0.4 1,-0.3 3,-0.3 0.670 110.7 54.6 -66.7 -16.6 5.1 -24.5 7.8 100 100 A S T 3< S+ 0 0 36 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.490 81.9 90.7 -89.8 -7.9 7.2 -24.2 11.0 101 101 A D S < S- 0 0 80 -3,-1.5 -1,-0.2 -4,-0.5 -2,-0.1 0.412 109.8 -86.8 -80.8 6.6 4.4 -25.0 13.4 102 102 A G S S+ 0 0 65 -3,-0.3 -1,-0.1 -4,-0.1 -3,-0.1 -0.034 114.3 68.3 123.2 -31.6 4.9 -28.7 13.5 103 103 A N S > S- 0 0 114 -5,-0.3 3,-1.7 1,-0.3 4,-0.1 0.307 80.5-149.5-107.4 11.9 3.0 -30.3 10.7 104 104 A G G > - 0 0 11 -5,-0.4 3,-1.2 1,-0.3 -1,-0.3 -0.222 68.3 -18.0 58.8-141.1 5.0 -29.0 7.8 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.3 2,-0.1 7,-0.3 0.518 114.2 92.7 -80.5 0.1 3.1 -28.5 4.5 106 106 A N G < + 0 0 55 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.660 67.8 80.8 -66.1 -13.6 0.2 -30.7 5.7 107 107 A A G < S+ 0 0 51 -3,-1.2 2,-0.8 1,-0.1 -1,-0.3 0.727 83.4 66.9 -57.9 -27.7 -1.2 -27.4 7.0 108 108 A W S <> S- 0 0 8 -3,-2.3 4,-2.4 1,-0.2 3,-0.2 -0.871 73.1-162.6-100.2 105.3 -2.3 -26.9 3.3 109 109 A V H > S+ 0 0 78 -2,-0.8 4,-2.6 1,-0.3 5,-0.2 0.891 90.4 53.5 -57.9 -40.7 -4.9 -29.6 2.6 110 110 A A H > S+ 0 0 13 1,-0.2 4,-2.2 2,-0.2 5,-0.5 0.867 108.0 51.8 -63.3 -37.6 -4.6 -29.2 -1.2 111 111 A W H >>S+ 0 0 11 -3,-0.2 5,-3.0 -6,-0.2 4,-2.2 0.955 111.5 46.6 -60.0 -46.7 -0.8 -29.8 -0.8 112 112 A R H <5S+ 0 0 110 -4,-2.4 -2,-0.2 -7,-0.3 -1,-0.2 0.936 121.6 36.5 -57.9 -43.9 -1.5 -33.0 1.2 113 113 A N H <5S+ 0 0 108 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.686 133.1 21.1 -86.5 -23.0 -4.1 -34.3 -1.3 114 114 A R H <5S+ 0 0 139 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 0.606 130.3 27.1-124.6 -16.5 -2.6 -33.1 -4.6 115 115 A b T ><5S+ 0 0 0 -4,-2.2 3,-2.3 -5,-0.5 -3,-0.2 0.764 84.4 101.8-117.4 -47.1 1.1 -32.4 -4.2 116 116 A K T 3 + 0 0 94 1,-0.2 3,-1.4 -3,-0.1 4,-0.2 -0.530 56.0 167.0 -78.7 77.3 6.7 -35.3 -9.0 120 120 A V G > + 0 0 15 -2,-2.2 3,-1.6 1,-0.3 4,-0.3 0.734 63.3 75.9 -68.3 -21.2 6.7 -31.7 -7.7 121 121 A Q G > S+ 0 0 125 1,-0.3 3,-1.5 -3,-0.2 4,-0.4 0.764 80.8 73.5 -59.8 -26.9 9.9 -30.8 -9.5 122 122 A A G X S+ 0 0 39 -3,-1.4 3,-1.1 1,-0.3 -1,-0.3 0.842 85.6 64.7 -53.0 -34.9 7.7 -30.7 -12.7 123 123 A W G < S+ 0 0 53 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.709 109.6 36.5 -64.9 -21.9 6.3 -27.4 -11.4 124 124 A I G X S+ 0 0 40 -3,-1.5 3,-1.8 -4,-0.3 -1,-0.3 0.333 85.4 135.1-111.1 7.6 9.6 -25.8 -11.8 125 125 A R T < S+ 0 0 127 -3,-1.1 -3,-0.1 -4,-0.4 -119,-0.1 -0.321 78.5 4.7 -62.0 125.5 10.7 -27.6 -15.0 126 126 A G T 3 S+ 0 0 81 1,-0.2 2,-0.3 -2,-0.1 -1,-0.3 0.340 93.3 139.3 87.6 -8.2 12.2 -25.2 -17.5 127 127 A a < - 0 0 18 -3,-1.8 2,-0.8 1,-0.1 -1,-0.2 -0.537 53.6-136.5 -77.9 133.0 12.1 -22.1 -15.3 128 128 A R 0 0 231 -2,-0.3 -118,-0.1 1,-0.2 -1,-0.1 -0.798 360.0 360.0 -80.7 113.4 15.1 -19.7 -15.3 129 129 A L 0 0 93 -2,-0.8 -1,-0.2 -120,-0.1 -115,-0.1 0.856 360.0 360.0-111.2 360.0 15.2 -19.2 -11.5