==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 10-JAN-92 1HEM . COMPND 2 MOLECULE: HEN EGG WHITE LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR K.P.WILSON,B.A.MALCOLM,B.W.MATTHEWS . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6810.0 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 . 27 20.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 26.4 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 1 0 2 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 75 0, 0.0 39,-2.2 0, 0.0 2,-0.8 0.000 360.0 360.0 360.0 129.9 2.6 10.5 9.2 2 2 A V B -A 39 0A 100 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.829 360.0-146.9 -95.5 109.4 2.6 13.8 7.3 3 3 A F - 0 0 14 35,-2.7 2,-0.2 -2,-0.8 3,-0.0 -0.349 8.5-123.5 -74.7 156.6 -1.0 15.1 7.2 4 4 A G > - 0 0 34 1,-0.1 4,-2.3 -2,-0.1 5,-0.3 -0.607 32.7-111.2 -86.4 153.3 -2.6 17.1 4.5 5 5 A R H > S+ 0 0 85 -2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.940 115.8 38.0 -52.7 -54.7 -4.1 20.4 5.6 6 6 A a H > S+ 0 0 41 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.808 112.8 57.6 -71.1 -31.4 -7.8 19.4 5.2 7 7 A E H > S+ 0 0 92 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.926 110.1 44.0 -66.5 -41.2 -7.2 15.9 6.3 8 8 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.884 109.7 56.0 -67.4 -42.4 -5.9 17.2 9.6 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.3 5,-0.2 0.946 109.4 47.5 -56.6 -43.1 -8.6 19.8 9.9 10 10 A A H X S+ 0 0 41 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.882 112.5 48.1 -70.1 -35.0 -11.2 17.0 9.6 11 11 A A H X S+ 0 0 20 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.888 112.7 47.1 -72.5 -39.0 -9.5 14.8 12.1 12 12 A M H <>S+ 0 0 1 -4,-2.7 5,-2.1 2,-0.2 6,-0.3 0.904 113.4 50.8 -67.5 -36.2 -9.1 17.6 14.7 13 13 A K H ><5S+ 0 0 84 -4,-2.5 3,-2.2 -5,-0.3 5,-0.3 0.929 108.9 50.0 -62.7 -47.2 -12.7 18.5 14.1 14 14 A R H 3<5S+ 0 0 197 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.779 106.6 57.4 -60.9 -28.3 -13.8 15.0 14.6 15 15 A H T 3<5S- 0 0 35 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.264 121.4-105.8 -90.2 14.3 -11.8 14.9 17.8 16 16 A G T < 5S+ 0 0 38 -3,-2.2 -3,-0.2 1,-0.1 -2,-0.1 0.649 82.8 125.1 75.4 18.3 -13.7 17.9 19.3 17 17 A L > < + 0 0 0 -5,-2.1 3,-2.0 -6,-0.1 2,-0.4 0.719 37.0 106.9 -84.2 -18.0 -11.0 20.6 18.8 18 18 A D T 3 S- 0 0 59 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.484 104.7 -10.1 -65.9 119.4 -13.2 23.1 16.8 19 19 A N T > S+ 0 0 90 4,-1.8 3,-2.4 -2,-0.4 2,-0.4 0.605 89.3 163.4 65.4 15.5 -13.9 25.9 19.2 20 20 A Y B X S-B 23 0B 70 -3,-2.0 3,-1.2 3,-0.7 -1,-0.3 -0.508 79.6 -3.5 -65.7 118.0 -12.6 24.0 22.0 21 21 A R T 3 S- 0 0 156 -2,-0.4 -1,-0.3 1,-0.2 3,-0.1 0.788 134.6 -60.7 69.7 22.6 -12.1 26.7 24.7 22 22 A G T < S+ 0 0 66 -3,-2.4 2,-0.7 1,-0.2 -1,-0.2 0.486 104.2 129.6 85.2 2.1 -13.2 29.3 22.1 23 23 A Y B < -B 20 0B 47 -3,-1.2 -4,-1.8 -6,-0.1 -3,-0.7 -0.833 54.1-133.6 -97.6 114.9 -10.4 28.6 19.6 24 24 A S >> - 0 0 37 -2,-0.7 3,-1.8 -5,-0.2 4,-1.0 -0.162 25.7-101.8 -62.2 157.4 -11.7 28.0 16.1 25 25 A L H 3> S+ 0 0 2 1,-0.3 4,-2.0 2,-0.2 5,-0.3 0.828 118.6 62.2 -49.0 -43.2 -10.5 25.1 14.0 26 26 A G H 3> S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.815 97.3 58.3 -63.0 -23.0 -8.2 27.3 11.9 27 27 A N H <> S+ 0 0 21 -3,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.937 106.6 48.2 -68.0 -44.1 -6.2 28.1 15.1 28 28 A W H X S+ 0 0 0 -4,-1.0 4,-2.1 -3,-0.2 -2,-0.2 0.888 114.3 44.5 -61.5 -43.2 -5.4 24.5 15.7 29 29 A V H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.893 111.7 53.1 -69.0 -41.3 -4.3 23.8 12.1 30 30 A b H X S+ 0 0 0 -4,-2.1 4,-2.0 -5,-0.3 -2,-0.2 0.923 109.7 48.9 -61.1 -45.6 -2.3 26.9 12.0 31 31 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.930 111.2 49.6 -60.6 -43.6 -0.5 25.9 15.1 32 32 A A H X>S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 6,-1.5 0.875 107.9 54.5 -62.8 -40.4 0.2 22.4 13.7 33 33 A K H X5S+ 0 0 63 -4,-2.7 4,-1.6 4,-0.2 -1,-0.2 0.969 116.9 35.4 -56.9 -49.9 1.5 23.8 10.5 34 34 A F H <5S+ 0 0 60 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.756 116.6 52.7 -80.5 -22.8 4.0 25.9 12.2 35 35 A E H <5S- 0 0 28 -4,-2.4 -1,-0.2 20,-0.2 -3,-0.2 0.882 137.2 -8.2 -79.8 -36.9 4.9 23.6 15.1 36 36 A S H ><5S- 0 0 13 -4,-2.0 3,-1.3 19,-0.4 -2,-0.2 0.283 87.8-109.4-142.1 2.3 5.7 20.5 13.1 37 37 A N T 3< - 0 0 53 4,-3.1 3,-1.3 -2,-0.3 -1,-0.0 -0.618 26.2-110.3-107.6 165.8 15.3 22.2 23.9 47 47 A T T 3 S+ 0 0 157 1,-0.3 -1,-0.1 -2,-0.2 4,-0.0 0.808 115.3 61.9 -64.1 -34.8 18.1 23.8 25.9 48 48 A D T 3 S- 0 0 86 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.537 121.9-107.2 -70.6 -1.1 16.6 22.9 29.2 49 49 A G S < S+ 0 0 28 -3,-1.3 -2,-0.1 1,-0.4 -1,-0.1 0.387 83.3 122.5 93.1 -6.1 17.0 19.3 28.1 50 50 A S - 0 0 0 19,-0.1 -4,-3.1 -5,-0.1 -1,-0.4 -0.345 51.4-141.5 -83.2 171.8 13.4 18.7 27.5 51 51 A T E -C 45 0C 3 -6,-0.3 9,-2.3 -3,-0.1 2,-0.4 -0.979 3.9-135.7-137.3 146.7 12.0 17.7 24.0 52 52 A D E -CD 44 59C 26 -8,-2.8 -8,-1.4 -2,-0.3 2,-0.4 -0.814 27.0-160.2-102.6 136.8 8.9 18.7 22.1 53 53 A Y E > -CD 43 58C 24 5,-1.6 5,-2.1 -2,-0.4 3,-0.4 -0.971 32.1 -11.2-130.1 139.2 6.9 15.9 20.4 54 54 A G T > 5S- 0 0 0 -12,-2.7 3,-1.3 -2,-0.4 30,-0.2 -0.141 98.9 -34.5 83.0-174.1 4.4 15.5 17.6 55 55 A I T 3 5S+ 0 0 2 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.752 141.0 35.8 -59.6 -26.8 2.3 17.6 15.5 56 56 A L T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.321 106.1-125.5-112.7 7.4 1.7 20.1 18.4 57 57 A Q T < 5 - 0 0 12 -3,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.929 32.3-163.6 49.3 59.2 5.1 19.8 19.8 58 58 A I E < -D 53 0C 2 -5,-2.1 -5,-1.6 -6,-0.1 -1,-0.2 -0.598 17.0-118.2 -81.4 129.9 4.1 18.9 23.3 59 59 A N E >> -D 52 0C 28 -2,-0.3 4,-1.8 -7,-0.2 5,-0.6 -0.436 7.0-148.1 -78.9 140.2 6.9 19.4 25.9 60 60 A S T 45S+ 0 0 0 -9,-2.3 14,-0.3 1,-0.2 13,-0.2 0.616 90.0 76.2 -81.4 -12.4 8.4 16.6 28.0 61 61 A R T 45S- 0 0 47 -10,-0.2 12,-1.3 11,-0.2 -1,-0.2 0.898 121.5 -1.5 -64.7 -39.4 9.1 19.0 30.9 62 62 A W T 45S+ 0 0 113 -3,-0.4 13,-3.3 10,-0.2 -2,-0.2 0.734 130.6 45.1-116.5 -38.7 5.4 19.0 31.9 63 63 A W T <5S+ 0 0 29 -4,-1.8 13,-1.8 11,-0.3 15,-0.3 0.715 106.0 16.4 -94.7 -28.6 3.1 17.0 29.7 64 64 A c < - 0 0 0 -5,-0.6 2,-0.6 11,-0.1 10,-0.4 -0.966 68.0-110.6-147.1 162.2 4.5 13.6 28.9 65 65 A N B +e 79 0D 78 13,-2.8 15,-2.4 -2,-0.3 16,-0.4 -0.872 34.2 159.1-103.2 124.7 7.1 11.1 30.0 66 66 A D - 0 0 37 -2,-0.6 -1,-0.1 13,-0.2 -6,-0.0 0.247 52.4-122.1-117.7 1.1 10.2 10.4 27.8 67 67 A G S S+ 0 0 62 2,-0.2 -2,-0.1 -7,-0.1 -7,-0.0 0.490 97.8 71.2 72.0 5.9 12.4 9.1 30.6 68 68 A R + 0 0 122 1,-0.1 -1,-0.1 2,-0.0 -3,-0.0 0.271 68.4 90.3-139.7 21.6 15.2 11.6 30.1 69 69 A T S > S- 0 0 9 -9,-0.1 3,-2.0 -18,-0.0 -2,-0.2 -0.922 70.4-143.9-118.5 92.0 13.7 14.9 31.4 70 70 A P T 3 S+ 0 0 113 0, 0.0 -2,-0.0 0, 0.0 -20,-0.0 -0.329 87.9 20.7 -58.8 128.1 14.6 15.0 35.2 71 71 A G T 3 S+ 0 0 67 1,-0.2 2,-0.1 -2,-0.1 0, 0.0 0.746 85.0 162.6 83.8 15.0 11.8 16.5 37.0 72 72 A S < - 0 0 29 -3,-2.0 -10,-0.2 1,-0.1 -1,-0.2 -0.426 28.0-156.0 -64.6 151.4 9.2 15.8 34.2 73 73 A R - 0 0 178 -12,-1.3 -11,-0.2 -13,-0.2 -1,-0.1 0.696 11.5-148.9-102.6 -21.4 5.6 16.1 35.6 74 74 A N > + 0 0 45 -10,-0.4 3,-1.7 -14,-0.3 -11,-0.3 0.883 26.7 170.4 56.3 44.0 3.8 13.9 33.1 75 75 A L T 3 S+ 0 0 96 -13,-3.3 -12,-0.2 1,-0.3 -11,-0.1 0.756 74.9 47.2 -58.5 -27.0 0.5 15.9 33.3 76 76 A d T 3 S- 0 0 23 -13,-1.8 -1,-0.3 2,-0.2 -12,-0.1 0.538 105.4-130.1 -92.2 -6.2 -1.1 14.0 30.4 77 77 A N < + 0 0 136 -3,-1.7 -13,-0.1 1,-0.2 -2,-0.1 0.942 65.3 108.4 63.0 52.0 -0.1 10.6 31.8 78 78 A I S S- 0 0 29 -15,-0.3 -13,-2.8 16,-0.0 -1,-0.2 -0.999 75.4-100.4-153.3 157.2 1.5 9.2 28.7 79 79 A P B > -e 65 0D 70 0, 0.0 3,-1.7 0, 0.0 4,-0.4 -0.514 37.6-123.4 -74.1 141.0 4.8 8.3 27.2 80 80 A c G > S+ 0 0 1 -15,-2.4 3,-2.1 1,-0.3 -14,-0.1 0.849 108.2 68.9 -56.5 -29.8 5.9 11.1 24.8 81 81 A S G > S+ 0 0 85 -16,-0.4 3,-1.8 1,-0.3 -1,-0.3 0.782 85.1 69.2 -63.8 -23.6 6.2 8.6 22.0 82 82 A A G X S+ 0 0 31 -3,-1.7 3,-0.7 1,-0.3 8,-0.3 0.709 91.1 63.3 -63.2 -19.2 2.4 8.2 22.0 83 83 A L G < S+ 0 0 1 -3,-2.1 -28,-0.5 -4,-0.4 -1,-0.3 0.465 94.9 59.8 -85.0 -0.5 2.4 11.8 20.6 84 84 A L G < S+ 0 0 42 -3,-1.8 -1,-0.2 -30,-0.2 -2,-0.2 0.379 79.3 116.6-105.8 -1.2 4.2 10.6 17.4 85 85 A S S < S- 0 0 57 -3,-0.7 6,-0.1 2,-0.2 -3,-0.0 -0.257 76.0-120.6 -65.1 159.9 1.5 8.1 16.3 86 86 A S S S+ 0 0 69 2,-0.1 2,-0.6 -45,-0.0 -1,-0.1 0.690 101.5 78.3 -72.1 -23.5 -0.4 8.5 13.0 87 87 A D S > S- 0 0 96 1,-0.1 3,-0.5 -47,-0.0 4,-0.3 -0.795 72.0-159.0 -88.9 113.4 -3.6 8.5 15.3 88 88 A I T 3> + 0 0 7 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.482 61.5 106.0 -76.9 -0.7 -3.8 12.0 16.7 89 89 A T H 3> S+ 0 0 46 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.874 80.2 44.6 -47.3 -50.7 -6.0 11.0 19.6 90 90 A A H <> S+ 0 0 26 -3,-0.5 4,-2.1 -8,-0.3 -1,-0.2 0.896 114.1 51.4 -66.9 -34.5 -3.4 11.2 22.4 91 91 A T H > S+ 0 0 5 -4,-0.3 4,-3.1 -9,-0.3 5,-0.2 0.965 111.3 47.4 -62.2 -51.3 -2.1 14.5 21.0 92 92 A V H X S+ 0 0 1 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.921 112.0 49.0 -57.0 -48.7 -5.6 16.0 21.0 93 93 A N H X S+ 0 0 89 -4,-2.3 4,-1.2 -5,-0.2 -1,-0.2 0.911 114.9 45.9 -60.2 -41.4 -6.4 14.8 24.6 94 94 A d H X S+ 0 0 2 -4,-2.1 4,-2.1 -5,-0.2 3,-0.3 0.918 109.1 54.1 -70.6 -41.9 -3.2 16.2 25.8 95 95 A A H X S+ 0 0 0 -4,-3.1 4,-2.9 1,-0.2 5,-0.3 0.876 103.8 56.7 -59.2 -36.2 -3.6 19.5 23.9 96 96 A K H X S+ 0 0 44 -4,-2.0 4,-1.1 -5,-0.2 -1,-0.2 0.912 107.3 48.6 -64.9 -35.4 -7.1 20.0 25.5 97 97 A K H X S+ 0 0 142 -4,-1.2 4,-0.5 -3,-0.3 -2,-0.2 0.922 113.5 48.3 -65.9 -44.3 -5.5 19.8 29.0 98 98 A I H >< S+ 0 0 8 -4,-2.1 3,-1.4 1,-0.2 5,-0.3 0.945 110.8 47.5 -60.6 -52.3 -2.8 22.2 27.9 99 99 A V H >< S+ 0 0 5 -4,-2.9 3,-0.5 1,-0.3 5,-0.4 0.769 109.4 55.5 -65.1 -23.1 -5.1 24.8 26.4 100 100 A S H 3< S+ 0 0 36 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.567 85.3 92.1 -84.2 -9.2 -7.3 24.6 29.5 101 101 A D T << S- 0 0 109 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.1 0.310 106.3 -90.4 -70.8 -0.3 -4.4 25.5 31.7 102 102 A G S < S+ 0 0 62 -3,-0.5 -3,-0.1 -4,-0.0 -1,-0.1 -0.147 115.4 62.3 121.0 -51.3 -4.7 29.2 31.9 103 103 A N S > S- 0 0 121 -5,-0.3 3,-1.7 1,-0.3 4,-0.1 0.375 83.8-154.8 -95.3 9.2 -2.7 30.8 29.1 104 104 A G G > - 0 0 10 -5,-0.4 3,-1.5 1,-0.3 -1,-0.3 -0.245 66.8 -14.1 56.4-138.7 -4.8 29.2 26.4 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.6 2,-0.2 7,-0.3 0.620 116.3 89.0 -72.6 -9.5 -3.0 28.7 23.0 106 106 A N G < + 0 0 45 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.761 69.2 80.0 -61.7 -15.7 -0.3 31.1 24.1 107 107 A A G < S+ 0 0 58 -3,-1.5 2,-0.8 1,-0.1 -1,-0.3 0.793 83.7 70.9 -57.8 -26.5 1.3 27.8 25.4 108 108 A W S <> S- 0 0 8 -3,-2.6 4,-2.4 1,-0.2 3,-0.4 -0.850 71.2-163.0 -99.8 108.8 2.3 27.3 21.8 109 109 A V H > S+ 0 0 72 -2,-0.8 4,-2.9 1,-0.3 5,-0.2 0.875 90.8 51.6 -58.9 -42.0 5.0 29.8 20.9 110 110 A A H > S+ 0 0 12 1,-0.2 4,-2.3 2,-0.2 5,-0.4 0.822 110.0 52.0 -67.1 -27.7 4.6 29.3 17.1 111 111 A W H >>S+ 0 0 11 -3,-0.4 5,-3.5 -6,-0.2 4,-2.3 0.946 111.8 44.1 -69.9 -46.8 0.9 29.9 17.7 112 112 A R H <5S+ 0 0 113 -4,-2.4 -2,-0.2 -7,-0.3 -1,-0.2 0.934 122.1 40.1 -60.9 -44.8 1.5 33.1 19.5 113 113 A N H <5S+ 0 0 116 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.767 132.3 16.7 -77.5 -29.4 4.2 34.2 17.0 114 114 A R H <5S+ 0 0 138 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.569 130.0 31.2-125.9 -12.0 2.6 33.1 13.7 115 115 A b T ><5S+ 0 0 0 -4,-2.3 3,-2.3 -5,-0.4 5,-0.2 0.743 84.0 100.4-115.3 -42.0 -1.1 32.5 14.2 116 116 A K T 3 + 0 0 110 1,-0.2 3,-2.1 -2,-0.2 4,-0.2 -0.535 53.7 169.5 -83.7 79.2 -6.8 35.3 9.5 120 120 A V G > + 0 0 15 -2,-2.1 3,-1.9 1,-0.3 4,-0.4 0.686 62.9 80.0 -66.4 -17.4 -6.6 31.8 10.7 121 121 A Q G >> S+ 0 0 141 1,-0.3 3,-1.3 2,-0.2 4,-0.6 0.768 77.8 74.8 -61.1 -19.8 -9.8 30.9 8.9 122 122 A A G X4 S+ 0 0 32 -3,-2.1 3,-0.7 1,-0.3 -1,-0.3 0.831 82.9 68.3 -59.8 -30.0 -7.5 30.7 5.9 123 123 A W G <4 S+ 0 0 56 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.695 106.8 34.6 -65.8 -20.5 -6.3 27.4 7.3 124 124 A I G X4 S+ 0 0 39 -3,-1.3 3,-2.1 -4,-0.4 -1,-0.2 0.451 85.6 129.8-116.5 5.8 -9.5 25.5 6.7 125 125 A R T << S+ 0 0 172 -3,-0.7 3,-0.1 -4,-0.6 -119,-0.0 -0.370 75.6 16.2 -63.2 133.0 -10.7 27.2 3.6 126 126 A G T 3 S+ 0 0 75 1,-0.3 2,-0.3 -2,-0.0 -1,-0.3 0.357 94.6 131.3 84.9 -2.0 -11.6 24.9 0.9 127 127 A a < - 0 0 23 -3,-2.1 2,-1.1 1,-0.1 -1,-0.3 -0.610 61.4-126.7 -86.3 146.8 -11.9 21.9 3.2 128 128 A R 0 0 238 -2,-0.3 -1,-0.1 -3,-0.1 -3,-0.0 -0.732 360.0 360.0 -85.0 102.2 -14.9 19.7 3.2 129 129 A L 0 0 95 -2,-1.1 -119,-0.1 -5,-0.1 -3,-0.0 -0.857 360.0 360.0-128.7 360.0 -15.9 19.8 6.8