==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 20-JAN-92 1HEW . COMPND 2 MOLECULE: HEN EGG WHITE LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR J.C.CHEETHAM,P.J.ARTYMIUK,D.C.PHILLIPS . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6877.0 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 . 9 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 22.5 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 . 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 77 0, 0.0 39,-2.9 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 137.6 2.5 10.4 9.4 2 2 A V B -A 39 0A 101 37,-0.2 37,-0.2 38,-0.1 2,-0.1 -0.935 360.0-148.4-109.4 108.4 2.4 13.7 7.5 3 3 A F - 0 0 15 35,-2.5 2,-0.2 -2,-0.7 3,-0.0 -0.407 9.2-123.4 -76.8 151.8 -1.2 14.9 7.4 4 4 A G > - 0 0 35 -2,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.596 31.8-109.6 -89.3 156.2 -2.8 17.0 4.6 5 5 A R H > S+ 0 0 85 -2,-0.2 4,-2.2 2,-0.2 5,-0.1 0.942 117.7 36.9 -50.3 -62.2 -4.3 20.4 5.6 6 6 A a H > S+ 0 0 44 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.894 113.8 58.1 -59.6 -44.8 -7.9 19.4 5.1 7 7 A E H > S+ 0 0 91 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.910 110.0 43.1 -50.6 -50.1 -7.3 15.9 6.4 8 8 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.897 110.0 56.2 -64.6 -44.2 -6.0 17.2 9.7 9 9 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.916 110.3 46.1 -52.5 -49.1 -8.8 19.8 9.9 10 10 A A H X S+ 0 0 42 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.861 111.5 51.3 -63.3 -40.7 -11.3 17.0 9.6 11 11 A A H X S+ 0 0 17 -4,-1.9 4,-0.5 -5,-0.2 -1,-0.2 0.828 113.2 44.5 -68.0 -35.0 -9.5 14.8 12.2 12 12 A M H ><>S+ 0 0 1 -4,-2.5 5,-1.9 2,-0.2 3,-0.8 0.898 110.1 55.7 -75.4 -42.8 -9.4 17.6 14.7 13 13 A K H ><5S+ 0 0 81 -4,-2.6 3,-1.2 1,-0.3 5,-0.2 0.869 108.1 47.9 -55.1 -44.8 -13.0 18.5 14.1 14 14 A R H 3<5S+ 0 0 192 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.667 107.9 57.5 -71.5 -18.3 -14.2 15.0 14.8 15 15 A H T <<5S- 0 0 33 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.225 122.9-101.8 -96.6 13.5 -12.0 15.0 18.0 16 16 A G T < 5S+ 0 0 34 -3,-1.2 -3,-0.2 -4,-0.1 -2,-0.1 0.579 84.3 121.4 79.7 19.2 -13.8 18.1 19.4 17 17 A L > < + 0 0 0 -5,-1.9 3,-2.4 2,-0.1 2,-0.3 0.720 35.4 106.1 -85.3 -23.7 -11.4 20.9 18.7 18 18 A D T 3 S- 0 0 64 1,-0.3 6,-0.2 -5,-0.2 4,-0.0 -0.577 110.6 -9.9 -64.0 117.6 -13.6 23.3 16.5 19 19 A N T > S+ 0 0 99 4,-1.3 3,-1.6 -2,-0.3 2,-0.6 0.535 87.4 165.6 65.2 26.7 -14.3 26.0 19.2 20 20 A Y B X S-B 23 0B 70 -3,-2.4 3,-1.0 3,-0.8 -1,-0.2 -0.624 83.2 -7.5 -72.4 116.1 -12.8 24.0 22.2 21 21 A R T 3 S- 0 0 167 -2,-0.6 -1,-0.3 1,-0.2 3,-0.1 0.794 135.0 -57.3 63.8 33.3 -12.5 26.7 24.9 22 22 A G T < S+ 0 0 70 -3,-1.6 2,-0.7 1,-0.2 -1,-0.2 0.501 102.6 131.7 78.8 9.2 -13.4 29.3 22.2 23 23 A Y B < -B 20 0B 48 -3,-1.0 -4,-1.3 -6,-0.2 -3,-0.8 -0.845 51.4-134.9 -98.3 114.0 -10.6 28.5 19.8 24 24 A S >> - 0 0 43 -2,-0.7 3,-1.7 -5,-0.2 4,-0.9 -0.193 25.5-105.6 -63.2 154.1 -11.8 28.1 16.1 25 25 A L H 3> S+ 0 0 2 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.778 117.8 64.7 -49.3 -38.7 -10.5 25.2 14.0 26 26 A G H 3> S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.822 97.5 57.5 -57.7 -35.4 -8.2 27.5 12.0 27 27 A N H <> S+ 0 0 20 -3,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.925 108.5 43.7 -60.2 -51.3 -6.2 28.1 15.3 28 28 A W H X S+ 0 0 0 -4,-0.9 4,-2.5 2,-0.2 -2,-0.2 0.867 115.0 48.0 -63.0 -44.3 -5.4 24.5 15.8 29 29 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.919 113.6 48.1 -65.2 -44.8 -4.5 23.8 12.2 30 30 A b H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.906 111.4 50.3 -61.2 -45.2 -2.3 26.8 12.1 31 31 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.922 111.5 48.0 -60.3 -48.1 -0.7 25.8 15.3 32 32 A A H X>S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 6,-1.2 0.877 109.3 54.8 -59.9 -41.9 0.0 22.3 14.0 33 33 A K H X5S+ 0 0 64 -4,-2.4 4,-1.3 4,-0.2 -1,-0.2 0.936 115.7 35.9 -56.7 -53.4 1.4 23.7 10.8 34 34 A F H <5S+ 0 0 56 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.757 119.2 50.1 -77.9 -24.3 4.0 25.9 12.5 35 35 A E H <5S- 0 0 30 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.919 137.0 -5.9 -78.6 -47.5 4.8 23.5 15.3 36 36 A S H ><5S- 0 0 12 -4,-2.6 3,-1.1 19,-0.4 -3,-0.2 0.375 85.5-113.9-130.1 0.9 5.4 20.3 13.4 37 37 A N T 3< - 0 0 56 4,-2.9 3,-1.9 -2,-0.3 -1,-0.0 -0.663 27.6-105.6-110.3 163.9 15.1 22.3 24.2 47 47 A T T 3 S+ 0 0 155 1,-0.3 -1,-0.0 -2,-0.2 -2,-0.0 0.767 116.5 59.7 -56.1 -35.4 17.8 24.0 26.3 48 48 A D T 3 S- 0 0 71 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.319 120.9-105.3 -80.1 5.5 16.3 22.9 29.6 49 49 A G S < S+ 0 0 26 -3,-1.9 -2,-0.1 1,-0.3 2,-0.1 0.367 83.6 122.7 85.5 -3.1 16.7 19.3 28.5 50 50 A S - 0 0 0 19,-0.1 -4,-2.9 -5,-0.0 2,-0.3 -0.384 51.3-141.1 -83.6 168.9 13.0 18.7 27.8 51 51 A T E -C 45 0C 4 -6,-0.3 9,-2.1 -2,-0.1 2,-0.4 -0.977 5.3-133.2-134.4 143.8 11.8 17.5 24.4 52 52 A D E -CD 44 59C 25 -8,-3.5 -8,-1.7 -2,-0.3 2,-0.4 -0.853 27.9-155.1 -99.5 134.6 8.7 18.6 22.3 53 53 A Y E > -CD 43 58C 24 5,-2.4 5,-2.3 -2,-0.4 3,-0.4 -0.949 30.2 -27.0-127.4 137.4 6.7 15.7 20.8 54 54 A G T > 5S- 0 0 0 -12,-2.4 3,-2.0 -2,-0.4 -13,-0.2 -0.098 97.9 -26.4 74.7-167.0 4.4 15.2 17.9 55 55 A I T 3 5S+ 0 0 2 28,-0.6 -19,-0.4 -15,-0.3 -17,-0.3 0.753 142.1 36.1 -52.0 -33.9 1.9 17.2 15.8 56 56 A L T 3 5S- 0 0 1 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.195 104.8-127.0-108.9 13.4 1.4 19.7 18.6 57 57 A Q T < 5 - 0 0 13 -3,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.886 34.4-165.0 38.5 61.2 4.9 19.6 19.9 58 58 A I E < -D 53 0C 2 -5,-2.3 -5,-2.4 25,-0.1 2,-0.3 -0.578 17.6-115.8 -78.0 132.6 3.9 18.8 23.5 59 59 A N E >>> -D 52 0C 25 -2,-0.3 4,-2.6 -7,-0.2 3,-0.8 -0.541 8.8-148.9 -81.2 132.7 6.6 19.3 26.1 60 60 A S T 345S+ 0 0 0 -9,-2.1 6,-0.2 -2,-0.3 9,-0.2 0.556 92.5 66.7 -73.0 -14.4 8.1 16.6 28.2 61 61 A R T 345S+ 0 0 67 11,-0.1 12,-1.7 -10,-0.1 -1,-0.2 0.715 122.3 12.1 -80.6 -21.9 8.8 18.8 31.3 62 62 A W T <45S+ 0 0 127 -3,-0.8 13,-2.2 10,-0.2 -2,-0.2 0.759 131.6 29.6-119.4 -44.5 5.1 19.2 31.9 63 63 A W T <5S+ 0 0 31 -4,-2.6 13,-1.8 11,-0.2 2,-0.3 0.683 110.4 23.1-101.6 -22.1 2.8 16.9 29.9 64 64 A c < - 0 0 0 -5,-0.7 2,-0.5 9,-0.3 -1,-0.2 -0.967 66.0-117.9-146.8 158.6 4.4 13.6 29.1 65 65 A N B +e 79 0D 68 13,-2.0 15,-2.5 -2,-0.3 16,-0.4 -0.869 29.3 163.1-104.4 128.8 7.1 11.3 30.3 66 66 A D - 0 0 37 -2,-0.5 -1,-0.1 -6,-0.2 -6,-0.0 0.116 54.9-119.7-122.8 9.8 10.0 10.4 28.2 67 67 A G S S+ 0 0 66 2,-0.1 -2,-0.1 1,-0.1 -7,-0.0 0.582 99.9 77.2 56.7 18.3 12.1 9.1 31.1 68 68 A R + 0 0 136 -8,-0.1 -1,-0.1 -17,-0.0 -3,-0.0 0.263 63.2 92.2-135.0 10.5 14.8 11.7 30.4 69 69 A T > - 0 0 7 1,-0.2 3,-0.5 -9,-0.2 -2,-0.1 -0.953 68.7-143.4-111.5 120.5 13.4 15.0 31.7 70 70 A P T 3 S+ 0 0 103 0, 0.0 2,-1.4 0, 0.0 -1,-0.2 0.938 82.5 17.2 -53.0 -94.0 14.6 15.4 35.3 71 71 A G T 3 S+ 0 0 60 2,-0.0 2,-0.2 0, 0.0 -10,-0.1 -0.822 94.9 161.1 -96.8 88.5 12.2 17.0 37.6 72 72 A S < - 0 0 38 -2,-1.4 2,-0.3 -3,-0.5 -10,-0.2 -0.682 36.2-146.7-114.6 150.8 9.1 16.4 35.3 73 73 A R - 0 0 167 -12,-1.7 -9,-0.3 -2,-0.2 2,-0.2 -0.828 5.3-155.3-111.1 150.3 5.3 16.4 35.6 74 74 A N > + 0 0 48 -2,-0.3 3,-1.4 -11,-0.2 -11,-0.2 -0.683 25.4 164.9-131.5 68.2 3.3 14.0 33.5 75 75 A L T 3 S+ 0 0 76 -13,-2.2 -12,-0.2 1,-0.3 -11,-0.1 0.733 77.3 46.8 -60.8 -28.6 0.0 15.9 33.6 76 76 A d T 3 S- 0 0 25 -13,-1.8 -1,-0.3 2,-0.2 -12,-0.1 0.449 106.6-130.5 -92.2 -2.2 -1.5 14.0 30.6 77 77 A N < + 0 0 141 -3,-1.4 -13,-0.1 1,-0.2 -2,-0.1 0.969 64.2 120.9 48.8 69.2 -0.3 10.8 32.3 78 78 A I S S- 0 0 32 -15,-0.2 -13,-2.0 16,-0.0 -1,-0.2 -0.941 70.0-110.2-164.2 139.5 1.3 9.5 29.1 79 79 A P B > -e 65 0D 71 0, 0.0 3,-1.9 0, 0.0 4,-0.3 -0.496 35.5-126.1 -67.2 135.0 4.6 8.3 27.6 80 80 A c G > S+ 0 0 1 -15,-2.5 3,-1.9 1,-0.3 -14,-0.1 0.792 107.0 68.2 -52.5 -33.6 5.7 10.9 25.2 81 81 A S G > S+ 0 0 86 -16,-0.4 3,-1.8 1,-0.3 -1,-0.3 0.782 86.1 69.1 -58.3 -29.9 6.1 8.3 22.5 82 82 A A G X S+ 0 0 33 -3,-1.9 3,-0.6 1,-0.3 -1,-0.3 0.695 92.1 60.6 -62.6 -22.3 2.3 7.9 22.5 83 83 A L G < S+ 0 0 3 -3,-1.9 -28,-0.6 -4,-0.3 -1,-0.3 0.391 91.4 67.1 -87.6 1.2 2.1 11.4 20.9 84 84 A L G < S+ 0 0 46 -3,-1.8 -1,-0.2 -30,-0.2 -2,-0.1 0.226 76.3 116.4-105.1 10.9 4.0 10.4 17.8 85 85 A S S < S- 0 0 59 -3,-0.6 6,-0.1 2,-0.3 -3,-0.0 -0.372 75.8-121.8 -78.5 156.8 1.4 8.0 16.4 86 86 A S S S+ 0 0 66 -2,-0.1 2,-0.8 2,-0.1 -1,-0.1 0.750 101.8 79.1 -67.5 -24.7 -0.5 8.4 13.2 87 87 A D S > S- 0 0 97 1,-0.1 3,-0.6 -47,-0.0 4,-0.3 -0.802 71.4-161.6 -88.0 110.2 -3.7 8.4 15.4 88 88 A I T 3> + 0 0 8 -2,-0.8 4,-2.6 1,-0.2 5,-0.2 0.326 60.9 105.7 -78.1 7.2 -3.9 11.9 16.9 89 89 A T H 3> S+ 0 0 50 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.888 80.4 47.2 -52.9 -48.3 -6.2 10.9 19.7 90 90 A A H <> S+ 0 0 25 -3,-0.6 4,-2.0 -8,-0.3 -1,-0.2 0.930 113.0 49.0 -59.4 -48.8 -3.6 11.1 22.4 91 91 A S H > S+ 0 0 3 -4,-0.3 4,-2.6 -9,-0.2 -2,-0.2 0.901 112.6 46.7 -58.3 -49.1 -2.3 14.4 21.2 92 92 A V H X S+ 0 0 1 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.861 111.3 50.9 -64.6 -40.8 -5.7 16.0 21.0 93 93 A N H X S+ 0 0 85 -4,-2.3 4,-1.0 -5,-0.2 -1,-0.2 0.841 113.9 45.2 -65.9 -35.8 -6.8 14.7 24.5 94 94 A d H X S+ 0 0 4 -4,-2.0 4,-2.2 -5,-0.2 3,-0.3 0.899 109.9 55.2 -71.1 -43.5 -3.6 16.1 26.0 95 95 A A H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 5,-0.2 0.878 102.0 57.3 -55.9 -41.8 -4.0 19.4 24.1 96 96 A K H X S+ 0 0 44 -4,-2.1 4,-0.9 1,-0.2 -1,-0.2 0.882 108.2 47.7 -57.5 -40.4 -7.5 19.8 25.6 97 97 A K H < S+ 0 0 130 -4,-1.0 3,-0.2 -3,-0.3 -1,-0.2 0.905 113.1 48.3 -67.3 -44.1 -5.8 19.6 29.0 98 98 A I H >< S+ 0 0 7 -4,-2.2 3,-1.9 1,-0.2 5,-0.4 0.934 108.9 50.5 -62.3 -53.2 -3.1 22.2 28.0 99 99 A V H 3< S+ 0 0 6 -4,-3.2 3,-0.5 1,-0.3 5,-0.3 0.693 107.9 55.8 -61.1 -23.9 -5.4 24.8 26.5 100 100 A S T 3< S+ 0 0 39 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.2 0.309 83.8 89.1 -90.3 4.2 -7.6 24.7 29.7 101 101 A D S < S- 0 0 111 -3,-1.9 -1,-0.2 3,-0.1 -2,-0.1 0.582 107.5 -89.4 -80.5 -13.8 -4.7 25.5 32.1 102 102 A G S S+ 0 0 66 -3,-0.5 -3,-0.1 -4,-0.2 -2,-0.1 0.138 115.8 67.1 130.0 -23.2 -4.9 29.3 32.1 103 103 A N S > S- 0 0 121 -5,-0.4 3,-2.1 1,-0.3 4,-0.1 0.271 82.2-157.3-109.1 7.2 -2.7 30.6 29.3 104 104 A G G > - 0 0 11 -5,-0.3 3,-1.3 1,-0.3 -1,-0.3 -0.188 66.9 -16.0 53.3-142.1 -5.0 29.2 26.6 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.1 2,-0.1 -1,-0.3 0.464 116.3 91.9 -69.9 -4.6 -3.3 28.6 23.2 106 106 A N G < + 0 0 48 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.653 68.5 79.0 -64.7 -14.9 -0.4 30.9 24.3 107 107 A A G < S+ 0 0 60 -3,-1.3 2,-0.8 1,-0.1 -1,-0.3 0.648 81.9 73.2 -65.0 -17.9 1.2 27.6 25.5 108 108 A W X> - 0 0 8 -3,-2.1 4,-2.4 1,-0.2 3,-0.5 -0.882 69.2-163.9-105.1 102.7 2.1 27.1 21.8 109 109 A V H 3> S+ 0 0 77 -2,-0.8 4,-2.3 1,-0.3 5,-0.2 0.874 91.2 52.1 -50.9 -46.6 5.0 29.4 20.9 110 110 A A H 3> S+ 0 0 12 1,-0.2 4,-1.7 2,-0.2 5,-0.3 0.854 111.0 49.4 -61.0 -35.5 4.4 28.9 17.2 111 111 A W H <>>S+ 0 0 11 -3,-0.5 5,-3.0 -6,-0.2 4,-2.1 0.921 109.3 50.4 -66.9 -49.7 0.7 29.8 17.7 112 112 A R H <5S+ 0 0 115 -4,-2.4 -2,-0.2 -7,-0.3 -1,-0.2 0.898 120.8 33.6 -56.3 -47.9 1.5 33.0 19.7 113 113 A N H <5S+ 0 0 114 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.625 132.0 23.6 -87.3 -19.7 3.9 34.3 17.2 114 114 A R H <5S+ 0 0 148 -4,-1.7 -3,-0.2 -5,-0.2 -2,-0.2 0.496 129.7 27.7-126.4 -7.9 2.5 33.2 13.8 115 115 A b T ><5S+ 0 0 0 -4,-2.1 3,-2.4 -5,-0.3 5,-0.2 0.695 86.5 99.1-120.0 -45.1 -1.2 32.5 14.3 116 116 A K T 3 + 0 0 107 -2,-0.2 3,-1.8 1,-0.2 4,-0.2 -0.664 48.6 174.4 -89.8 83.1 -7.0 35.3 9.8 120 120 A V G > + 0 0 15 -2,-1.7 3,-2.6 1,-0.3 4,-0.4 0.720 65.1 82.7 -60.3 -23.5 -6.8 31.7 10.9 121 121 A Q G > S+ 0 0 135 1,-0.3 3,-0.9 2,-0.2 -1,-0.3 0.701 76.8 70.6 -55.9 -21.8 -10.0 31.1 8.9 122 122 A A G X S+ 0 0 28 -3,-1.8 3,-1.3 1,-0.2 -1,-0.3 0.745 84.6 69.7 -67.5 -25.4 -7.7 30.8 5.9 123 123 A W G < S+ 0 0 51 -3,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.759 100.7 44.5 -66.6 -25.5 -6.4 27.4 7.3 124 124 A I G X S+ 0 0 38 -3,-0.9 3,-1.8 -4,-0.4 2,-0.3 0.276 82.9 141.0-100.6 10.8 -9.7 25.7 6.6 125 125 A R T < S+ 0 0 187 -3,-1.3 -119,-0.1 1,-0.3 -3,-0.1 -0.401 75.8 3.4 -64.6 115.9 -10.2 27.2 3.1 126 126 A G T 3 S+ 0 0 83 -2,-0.3 -1,-0.3 1,-0.3 2,-0.2 0.388 95.5 143.6 89.8 3.4 -11.7 24.7 0.7 127 127 A a < - 0 0 24 -3,-1.8 2,-1.1 1,-0.1 -1,-0.3 -0.448 53.4-130.1 -77.6 145.9 -12.1 22.0 3.3 128 128 A R 0 0 229 -2,-0.2 -1,-0.1 0, 0.0 -118,-0.0 -0.765 360.0 360.0 -95.9 87.6 -15.0 19.6 3.3 129 129 A L 0 0 100 -2,-1.1 -119,-0.1 -5,-0.1 -123,-0.0 -0.727 360.0 360.0-121.7 360.0 -16.2 19.9 6.9