==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 31-AUG-11 3TMW . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR J.KMETKO,M.A.WARKENTIN,U.ENGLICH,R.E.THORNE . 129 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6771.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 85 65.9 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 . 27 20.9 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,-3.0 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 136.2 -2.0 -10.5 -9.8 2 2 A V B -A 39 0A 104 37,-0.2 37,-0.2 38,-0.1 2,-0.2 -0.923 360.0-148.2-106.6 113.3 -2.1 -13.9 -11.6 3 3 A F - 0 0 14 35,-2.8 2,-0.2 -2,-0.7 3,-0.0 -0.475 8.7-123.1 -81.3 149.9 1.5 -15.2 -11.7 4 4 A G > - 0 0 34 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.519 32.4-108.3 -76.5 158.9 3.0 -17.4 -14.3 5 5 A R H > S+ 0 0 93 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.961 117.8 35.2 -55.9 -61.9 4.5 -20.7 -13.2 6 6 A a H > S+ 0 0 43 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.854 115.3 59.2 -62.6 -34.3 8.3 -19.9 -13.6 7 7 A E H > S+ 0 0 93 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.930 108.7 43.2 -58.8 -46.0 7.6 -16.2 -12.4 8 8 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.923 110.2 56.1 -66.9 -41.2 6.2 -17.4 -9.1 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.943 109.0 48.0 -53.7 -46.2 9.0 -19.9 -8.7 10 10 A A H X S+ 0 0 50 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.874 112.2 47.5 -61.8 -42.5 11.5 -17.1 -9.0 11 11 A A H X S+ 0 0 19 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.930 111.3 51.4 -68.9 -42.6 9.7 -14.8 -6.5 12 12 A M H <>S+ 0 0 0 -4,-3.0 5,-2.5 1,-0.2 6,-0.4 0.915 111.7 47.8 -58.5 -41.8 9.4 -17.7 -4.0 13 13 A K H ><5S+ 0 0 85 -4,-2.2 3,-2.0 -5,-0.2 -2,-0.2 0.921 108.3 54.2 -65.1 -46.6 13.2 -18.4 -4.3 14 14 A R H 3<5S+ 0 0 200 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.837 107.9 50.6 -56.2 -36.2 14.0 -14.7 -3.9 15 15 A H T 3<5S- 0 0 29 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.207 121.4-106.8 -92.8 14.9 12.1 -14.6 -0.7 16 16 A G T < 5S+ 0 0 36 -3,-2.0 -3,-0.2 -5,-0.1 -2,-0.1 0.700 81.8 124.4 77.2 26.3 13.9 -17.7 0.7 17 17 A L > < + 0 0 0 -5,-2.5 3,-2.0 2,-0.1 2,-0.3 0.701 38.3 108.6 -89.1 -17.8 11.2 -20.4 0.4 18 18 A D T 3 S- 0 0 71 -6,-0.4 6,-0.2 1,-0.3 4,-0.1 -0.425 102.6 -7.0 -68.6 118.3 13.3 -22.8 -1.7 19 19 A N T > S+ 0 0 94 4,-1.2 3,-2.3 -2,-0.3 -1,-0.3 0.526 90.1 162.6 61.7 15.8 14.2 -25.7 0.6 20 20 A Y G X S- 0 0 72 -3,-2.0 3,-1.9 3,-0.5 -1,-0.2 -0.411 77.7 -2.9 -62.6 130.2 12.7 -23.9 3.6 21 21 A R G 3 S- 0 0 159 1,-0.3 -1,-0.3 -2,-0.1 3,-0.1 0.762 135.3 -61.7 49.8 30.1 12.1 -26.6 6.4 22 22 A G G < S+ 0 0 57 -3,-2.3 2,-0.6 1,-0.2 -1,-0.3 0.506 102.8 131.9 83.9 7.1 13.3 -29.1 3.8 23 23 A Y < - 0 0 49 -3,-1.9 -4,-1.2 -6,-0.2 -3,-0.5 -0.851 52.7-132.5 -99.3 113.9 10.6 -28.6 1.2 24 24 A S >> - 0 0 42 -2,-0.6 3,-1.4 -5,-0.2 4,-1.1 -0.165 27.4-102.4 -57.6 154.2 12.0 -28.0 -2.4 25 25 A L H 3> S+ 0 0 5 1,-0.3 4,-2.2 2,-0.2 3,-0.2 0.800 119.4 62.8 -43.8 -42.4 10.7 -25.2 -4.6 26 26 A G H 3> S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.840 98.6 55.0 -56.8 -37.2 8.5 -27.5 -6.6 27 27 A N H <> S+ 0 0 21 -3,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.883 109.8 46.4 -62.4 -41.2 6.4 -28.4 -3.5 28 28 A W H X S+ 0 0 0 -4,-1.1 4,-2.2 -3,-0.2 -2,-0.2 0.877 113.8 47.7 -69.3 -43.8 5.7 -24.7 -2.8 29 29 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.911 112.3 50.2 -62.3 -43.1 4.7 -24.0 -6.6 30 30 A b H X S+ 0 0 1 -4,-2.5 4,-1.9 2,-0.2 5,-0.2 0.907 110.5 49.5 -59.9 -46.6 2.5 -27.2 -6.6 31 31 A A H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 5,-0.2 0.931 111.8 48.9 -59.6 -46.8 0.7 -26.0 -3.3 32 32 A A H X>S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 6,-1.2 0.896 107.8 56.1 -61.2 -39.6 0.1 -22.5 -4.8 33 33 A K H X5S+ 0 0 61 -4,-2.3 4,-1.5 4,-0.2 -1,-0.2 0.946 115.4 34.2 -57.3 -52.1 -1.2 -24.0 -8.1 34 34 A F H <5S+ 0 0 63 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.704 119.8 50.5 -83.1 -20.6 -4.0 -26.1 -6.4 35 35 A E H <5S- 0 0 39 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.913 137.9 -6.2 -76.2 -45.1 -4.7 -23.6 -3.6 36 36 A S H ><5S- 0 0 11 -4,-2.4 3,-1.4 19,-0.4 -3,-0.2 0.405 83.2-116.5-133.1 -3.8 -5.2 -20.4 -5.7 37 37 A N T 3< - 0 0 48 4,-2.6 3,-2.0 -2,-0.4 -1,-0.0 -0.527 23.8-111.0 -87.2 156.4 -15.0 -22.0 5.2 47 47 A T T 3 S+ 0 0 160 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.806 116.4 59.3 -54.4 -33.0 -18.0 -23.7 6.8 48 48 A D T 3 S- 0 0 108 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.397 122.0-103.0 -79.6 1.5 -16.9 -22.5 10.2 49 49 A G S < S+ 0 0 25 -3,-2.0 -2,-0.1 1,-0.4 -1,-0.1 0.259 85.4 121.2 93.7 -10.3 -17.1 -18.8 9.2 50 50 A S - 0 0 2 19,-0.1 -4,-2.6 -5,-0.1 -1,-0.4 -0.324 52.9-139.5 -73.8 172.3 -13.3 -18.4 8.8 51 51 A T E -B 45 0B 4 -6,-0.2 9,-2.3 -3,-0.1 2,-0.4 -0.983 1.5-138.4-137.8 144.0 -11.8 -17.3 5.3 52 52 A D E -BC 44 59B 30 -8,-2.5 -8,-1.5 -2,-0.3 2,-0.4 -0.841 25.8-161.2-102.8 135.7 -8.7 -18.4 3.3 53 53 A Y E > -BC 43 58B 25 5,-2.0 5,-2.1 -2,-0.4 3,-0.4 -0.975 30.6 -16.7-129.5 131.8 -6.7 -15.7 1.6 54 54 A G T > 5S- 0 0 0 -12,-2.6 3,-1.9 -2,-0.4 30,-0.2 -0.150 97.7 -26.4 89.7-171.6 -4.1 -15.4 -1.2 55 55 A I T 3 5S+ 0 0 1 28,-0.5 -19,-0.4 1,-0.3 -17,-0.3 0.742 141.9 32.1 -56.4 -31.9 -1.7 -17.5 -3.2 56 56 A L T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.181 106.6-122.5-110.6 16.2 -1.4 -20.1 -0.4 57 57 A Q T < 5 - 0 0 12 -3,-1.9 2,-0.3 1,-0.2 -3,-0.2 0.900 34.5-165.5 49.1 52.0 -5.0 -19.7 1.0 58 58 A I E < -C 53 0B 2 -5,-2.1 -5,-2.0 -6,-0.1 2,-0.2 -0.584 16.5-123.3 -74.4 132.0 -3.9 -18.8 4.6 59 59 A N E >>> -C 52 0B 28 -2,-0.3 4,-2.0 -7,-0.2 3,-0.7 -0.544 5.8-143.5 -91.3 139.1 -6.8 -19.1 7.1 60 60 A S T 345S+ 0 0 0 -9,-2.3 6,-0.2 -2,-0.2 13,-0.1 0.536 90.3 82.2 -71.4 -9.0 -8.2 -16.3 9.4 61 61 A R T 345S- 0 0 94 -10,-0.2 12,-2.0 11,-0.1 -1,-0.2 0.901 118.8 -5.2 -65.8 -38.5 -8.8 -18.9 12.2 62 62 A W T <45S+ 0 0 107 -3,-0.7 13,-2.5 10,-0.2 -2,-0.2 0.685 132.3 45.2-120.0 -31.9 -5.2 -18.8 13.3 63 63 A W T <5S+ 0 0 27 -4,-2.0 13,-1.7 11,-0.3 15,-0.3 0.702 102.5 21.9-110.2 -24.1 -3.0 -16.7 11.1 64 64 A c < - 0 0 0 -5,-0.5 2,-0.6 9,-0.4 11,-0.1 -0.943 68.0-112.1-145.6 159.8 -4.4 -13.3 10.1 65 65 A N B +d 79 0C 81 13,-2.7 15,-2.4 -2,-0.3 16,-0.4 -0.886 35.6 158.2 -99.5 123.0 -7.0 -10.7 11.3 66 66 A D - 0 0 36 -2,-0.6 -1,-0.1 13,-0.2 8,-0.0 0.404 52.0-123.1-115.2 -1.1 -10.1 -10.1 9.2 67 67 A G S S+ 0 0 68 2,-0.1 -2,-0.1 1,-0.1 0, 0.0 0.521 97.0 71.7 77.6 -1.2 -12.4 -8.7 11.9 68 68 A R + 0 0 120 1,-0.1 -1,-0.1 2,-0.0 -3,-0.0 0.082 64.9 91.8-135.7 22.5 -15.1 -11.3 11.3 69 69 A T S > S- 0 0 14 -9,-0.1 3,-1.6 -19,-0.0 -2,-0.1 -0.770 71.6-138.2-117.9 86.8 -13.8 -14.7 12.7 70 70 A P T 3 S+ 0 0 125 0, 0.0 -2,-0.0 0, 0.0 -20,-0.0 -0.093 79.5 4.6 -48.3 133.7 -15.0 -15.0 16.3 71 71 A G T 3 S+ 0 0 68 1,-0.2 2,-0.1 0, 0.0 -10,-0.0 0.631 97.9 139.3 72.0 15.6 -12.5 -16.4 18.8 72 72 A S < - 0 0 32 -3,-1.6 -10,-0.2 1,-0.1 2,-0.2 -0.329 45.1-130.7 -85.4 172.0 -9.6 -16.6 16.3 73 73 A R - 0 0 145 -12,-2.0 -9,-0.4 -13,-0.1 3,-0.1 -0.624 2.8-147.2-113.3 170.9 -5.9 -15.7 16.6 74 74 A N > + 0 0 49 -2,-0.2 3,-1.6 -11,-0.2 -11,-0.3 -0.594 29.3 163.4-138.3 66.9 -3.6 -13.6 14.3 75 75 A L T 3 S+ 0 0 57 -13,-2.5 -12,-0.2 1,-0.3 -11,-0.1 0.788 74.8 53.4 -67.1 -24.6 -0.3 -15.5 14.7 76 76 A d T 3 S- 0 0 16 -13,-1.7 -1,-0.3 2,-0.1 -12,-0.1 0.516 105.1-131.1 -83.0 -5.1 1.3 -13.8 11.7 77 77 A N < + 0 0 133 -3,-1.6 -13,-0.1 1,-0.2 -2,-0.1 0.906 65.9 111.1 53.6 53.0 0.4 -10.3 13.1 78 78 A I S S- 0 0 32 -15,-0.3 -13,-2.7 16,-0.0 2,-0.2 -0.994 74.7-103.5-147.8 153.8 -1.1 -9.0 9.9 79 79 A P B > -d 65 0C 71 0, 0.0 3,-1.6 0, 0.0 4,-0.4 -0.571 36.8-123.9 -73.2 139.7 -4.5 -8.0 8.4 80 80 A c G > S+ 0 0 2 -15,-2.4 3,-1.8 1,-0.3 4,-0.2 0.814 108.5 71.2 -54.9 -31.3 -5.7 -10.8 6.1 81 81 A S G > S+ 0 0 81 -16,-0.4 3,-2.0 1,-0.3 -1,-0.3 0.825 85.1 65.2 -53.0 -34.3 -5.9 -8.2 3.3 82 82 A A G X S+ 0 0 32 -3,-1.6 3,-0.7 1,-0.3 9,-0.3 0.703 92.1 65.7 -62.0 -20.3 -2.0 -8.0 3.2 83 83 A L G < S+ 0 0 2 -3,-1.8 -28,-0.5 -4,-0.4 -1,-0.3 0.472 94.7 58.0 -78.3 -4.2 -2.2 -11.6 1.9 84 84 A L G < S+ 0 0 43 -3,-2.0 -1,-0.2 -30,-0.2 -2,-0.2 0.397 80.4 122.0-105.4 -2.4 -3.9 -10.5 -1.3 85 85 A S S < S- 0 0 55 -3,-0.7 6,-0.1 -4,-0.2 -3,-0.0 -0.177 72.2-124.2 -59.0 150.3 -1.1 -8.0 -2.5 86 86 A S S S+ 0 0 77 2,-0.0 2,-0.5 -45,-0.0 -1,-0.1 0.810 102.5 74.8 -63.3 -24.6 0.7 -8.3 -5.8 87 87 A D S S- 0 0 85 1,-0.1 3,-0.4 -47,-0.0 4,-0.3 -0.807 75.1-156.9 -89.0 125.1 3.9 -8.5 -3.7 88 88 A I > + 0 0 6 -2,-0.5 4,-2.3 1,-0.2 5,-0.2 0.404 62.4 106.4 -87.5 -0.4 4.1 -11.9 -2.0 89 89 A T H > S+ 0 0 47 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.892 81.2 47.1 -46.5 -49.9 6.3 -11.0 0.9 90 90 A A H > S+ 0 0 25 -3,-0.4 4,-2.0 -8,-0.3 -1,-0.2 0.904 113.3 48.8 -63.0 -42.7 3.5 -11.2 3.5 91 91 A S H > S+ 0 0 4 -9,-0.3 4,-2.4 -4,-0.3 -1,-0.2 0.899 113.6 46.6 -60.6 -42.1 2.3 -14.6 2.2 92 92 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.933 111.6 49.6 -70.8 -44.0 5.8 -16.1 2.2 93 93 A N H X S+ 0 0 85 -4,-2.7 4,-1.1 -5,-0.2 -1,-0.2 0.865 114.7 45.1 -62.3 -39.6 6.7 -14.8 5.7 94 94 A d H X S+ 0 0 3 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.881 109.7 54.6 -70.2 -40.4 3.4 -16.2 7.1 95 95 A A H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.881 102.8 58.7 -58.9 -37.2 3.8 -19.5 5.3 96 96 A K H X S+ 0 0 44 -4,-2.3 4,-0.8 1,-0.2 -1,-0.2 0.908 108.1 44.4 -57.4 -44.0 7.2 -19.9 6.9 97 97 A K H < S+ 0 0 95 -4,-1.1 3,-0.4 -3,-0.2 4,-0.3 0.919 114.0 51.0 -67.3 -41.5 5.6 -19.7 10.4 98 98 A I H >< S+ 0 0 8 -4,-2.5 3,-1.6 1,-0.2 5,-0.3 0.938 108.8 48.7 -61.1 -48.6 2.8 -22.2 9.3 99 99 A V H 3< S+ 0 0 3 -4,-2.9 5,-0.5 1,-0.3 3,-0.4 0.689 109.2 55.9 -67.9 -16.6 5.2 -24.8 7.9 100 100 A S T 3< S+ 0 0 33 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.434 80.7 95.7 -85.7 -2.4 7.2 -24.6 11.2 101 101 A D S < S- 0 0 111 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.1 0.570 107.3 -89.1 -77.9 -11.5 4.1 -25.4 13.3 102 102 A G S S+ 0 0 65 -3,-0.4 -1,-0.1 -4,-0.1 -3,-0.1 -0.061 114.4 67.0 134.6 -33.6 4.8 -29.2 13.7 103 103 A N S > S- 0 0 122 1,-0.3 3,-1.5 -5,-0.3 -3,-0.1 0.296 82.2-146.7-106.8 12.0 3.0 -30.8 10.7 104 104 A G G > - 0 0 13 -5,-0.5 3,-1.3 1,-0.2 -1,-0.3 -0.297 68.6 -19.8 61.6-143.5 5.1 -29.5 7.9 105 105 A M G > S+ 0 0 0 1,-0.3 3,-1.9 2,-0.1 7,-0.3 0.538 116.9 90.2 -81.3 -3.2 3.2 -28.9 4.5 106 106 A N G < + 0 0 52 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.697 68.4 80.3 -59.8 -16.8 0.4 -31.2 5.7 107 107 A A G < S+ 0 0 56 -3,-1.3 2,-0.9 1,-0.1 -1,-0.3 0.818 84.3 67.4 -58.8 -27.1 -1.1 -27.9 7.1 108 108 A W S X> S- 0 0 11 -3,-1.9 4,-1.9 1,-0.2 3,-0.6 -0.822 76.0-162.0 -96.6 103.6 -2.2 -27.3 3.5 109 109 A V H 3> S+ 0 0 83 -2,-0.9 4,-2.3 1,-0.2 5,-0.2 0.882 89.0 53.9 -55.9 -40.1 -4.8 -30.0 2.9 110 110 A A H 3> S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 5,-0.4 0.838 105.3 53.9 -63.7 -32.5 -4.5 -29.6 -1.0 111 111 A W H <>>S+ 0 0 12 -3,-0.6 5,-3.1 -6,-0.2 4,-2.2 0.942 111.2 45.8 -64.8 -46.7 -0.7 -30.2 -0.8 112 112 A R H <5S+ 0 0 116 -4,-1.9 -2,-0.2 -7,-0.3 -1,-0.2 0.926 121.1 38.4 -57.5 -47.0 -1.3 -33.5 1.1 113 113 A N H <5S+ 0 0 102 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.755 133.2 19.2 -81.1 -23.9 -4.0 -34.6 -1.4 114 114 A R H <5S+ 0 0 141 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.578 131.9 26.7-124.0 -12.0 -2.6 -33.3 -4.7 115 115 A b T ><5S+ 0 0 0 -4,-2.2 3,-2.2 -5,-0.4 -3,-0.2 0.729 84.8 103.2-124.7 -43.8 1.2 -32.7 -4.4 116 116 A K T 3 + 0 0 98 1,-0.2 3,-1.5 -3,-0.1 4,-0.3 -0.495 56.5 167.4 -75.3 75.1 6.8 -35.6 -9.2 120 120 A V G > + 0 0 16 -2,-2.2 3,-1.7 1,-0.3 4,-0.3 0.753 63.4 75.5 -67.2 -20.6 6.9 -32.0 -7.8 121 121 A Q G > S+ 0 0 88 1,-0.3 3,-1.7 -3,-0.2 4,-0.5 0.779 80.4 73.4 -60.1 -27.5 10.1 -31.1 -9.7 122 122 A A G X S+ 0 0 38 -3,-1.5 3,-1.0 1,-0.3 -1,-0.3 0.828 84.9 66.7 -53.6 -32.8 7.8 -30.9 -12.8 123 123 A W G < S+ 0 0 57 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.700 109.7 33.7 -63.5 -22.6 6.5 -27.6 -11.4 124 124 A I G X S+ 0 0 36 -3,-1.7 3,-2.0 -4,-0.3 -1,-0.2 0.319 87.0 134.3-113.8 8.3 9.9 -25.9 -11.9 125 125 A R T < S+ 0 0 122 -3,-1.0 3,-0.1 -4,-0.5 -119,-0.1 -0.264 76.8 9.1 -64.3 132.1 11.0 -27.8 -15.1 126 126 A G T 3 S+ 0 0 82 1,-0.2 2,-0.3 3,-0.0 -1,-0.3 0.394 93.7 137.2 79.9 -6.7 12.4 -25.5 -17.7 127 127 A a < - 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