==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-MAR-04 1SWY . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR B.H.M.MOOERS,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8671.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 . 10 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 51.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 2 0 1 2 1 0 0 1 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 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 M 0 0 68 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 154.8 43.2 -1.5 8.7 2 2 A N > - 0 0 66 156,-0.0 4,-2.5 95,-0.0 5,-0.2 -0.916 360.0 -82.4-162.7 178.2 40.0 -0.7 10.6 3 3 A I H > S+ 0 0 20 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.835 126.2 51.1 -60.0 -37.6 37.9 2.5 11.2 4 4 A F H > S+ 0 0 73 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.954 113.2 43.6 -66.7 -48.1 40.1 3.7 14.0 5 5 A E H > S+ 0 0 100 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.886 114.0 52.9 -61.6 -37.4 43.4 3.4 11.9 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.946 112.5 42.2 -63.5 -51.9 41.6 4.9 8.9 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.841 109.2 59.0 -69.3 -30.3 40.4 8.0 10.8 8 8 A R H X S+ 0 0 109 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.908 108.9 45.5 -64.9 -39.3 43.7 8.3 12.6 9 9 A I H < S+ 0 0 48 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.929 117.8 43.4 -61.4 -45.5 45.4 8.6 9.2 10 10 A D H < S+ 0 0 19 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.780 126.3 29.4 -75.2 -28.5 42.8 11.1 7.9 11 11 A E H < S- 0 0 36 -4,-2.5 19,-0.5 -5,-0.1 -3,-0.2 0.640 90.6-151.5-108.1 -19.3 42.6 13.3 11.1 12 12 A G < - 0 0 22 -4,-2.1 2,-0.4 -5,-0.3 -1,-0.1 -0.117 23.8 -87.5 72.0-175.6 46.0 13.1 12.7 13 13 A L + 0 0 45 16,-0.2 2,-0.4 -4,-0.1 16,-0.2 -0.973 44.5 167.9-137.5 120.9 46.7 13.4 16.5 14 14 A R E -A 28 0A 133 14,-2.0 14,-2.3 -2,-0.4 4,-0.1 -1.000 22.3-160.8-135.5 138.0 47.3 16.8 18.2 15 15 A L E S+ 0 0 68 -2,-0.4 43,-2.7 12,-0.2 2,-0.3 0.510 75.2 60.5 -99.5 -2.8 47.3 17.3 21.9 16 16 A K E S-C 57 0B 91 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.912 100.0 -87.7-123.1 148.3 46.7 21.1 21.9 17 17 A I E + 0 0 30 39,-2.1 2,-0.3 -2,-0.3 10,-0.2 -0.255 57.9 164.2 -54.8 134.6 43.8 23.0 20.4 18 18 A Y E -A 26 0A 28 8,-2.6 8,-2.8 6,-0.1 2,-0.5 -0.904 39.8 -96.6-143.0 171.6 44.3 23.7 16.7 19 19 A K E -A 25 0A 124 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.852 35.9-141.9 -98.7 131.2 42.2 24.8 13.8 20 20 A D > - 0 0 44 4,-2.6 3,-2.1 -2,-0.5 -1,-0.1 0.029 43.0 -75.8 -75.1-172.3 41.0 22.1 11.4 21 21 A T T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.700 134.6 49.3 -64.0 -19.8 40.8 22.3 7.6 22 22 A E T 3 S- 0 0 68 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.288 122.5-104.0 -96.9 1.8 37.7 24.5 7.9 23 23 A G S < S+ 0 0 40 -3,-2.1 2,-0.4 1,-0.3 -2,-0.1 0.569 76.1 137.9 85.9 13.9 39.3 26.9 10.4 24 24 A Y - 0 0 72 1,-0.1 -4,-2.6 9,-0.0 -1,-0.3 -0.743 61.9-101.2-102.8 140.7 37.4 25.4 13.4 25 25 A Y E +A 19 0A 35 11,-0.4 8,-2.7 9,-0.4 9,-1.2 -0.345 54.2 159.7 -63.9 131.1 38.9 24.7 16.8 26 26 A T E -AB 18 32A 2 -8,-2.8 -8,-2.6 6,-0.3 2,-0.3 -0.868 18.5-169.8-145.2 160.5 39.6 21.0 17.2 27 27 A I E > + B 0 31A 0 4,-1.8 4,-2.3 -2,-0.3 2,-0.2 -0.977 51.7 8.6-150.1 167.6 41.8 18.7 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-2.0 -2,-0.3 2,-0.8 -0.470 122.4 -11.3 72.1-132.9 42.8 15.1 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -2,-0.2 -16,-0.2 -0.803 128.7 -48.1-106.8 79.3 42.0 12.9 16.6 30 30 A G T 4 S+ 0 0 12 -2,-0.8 2,-1.1 -19,-0.5 -2,-0.2 0.776 83.8 160.8 63.7 31.6 39.6 15.2 14.7 31 31 A H E < -B 27 0A 30 -4,-2.3 -4,-1.8 -20,-0.1 2,-0.2 -0.698 31.3-146.8 -88.1 102.3 37.4 16.1 17.7 32 32 A L E -B 26 0A 73 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.487 16.6-175.3 -63.7 127.5 35.6 19.3 16.7 33 33 A L - 0 0 13 -8,-2.7 2,-0.3 1,-0.4 -7,-0.2 0.854 58.0 -34.5 -92.7 -41.7 35.2 21.5 19.7 34 34 A T - 0 0 32 -9,-1.2 -1,-0.4 2,-0.1 -9,-0.4 -0.940 35.7-129.1-172.0 157.5 33.1 24.4 18.3 35 35 A K S S+ 0 0 135 -2,-0.3 -1,-0.0 -11,-0.1 7,-0.0 0.418 74.6 116.1 -94.8 -3.9 32.5 26.5 15.2 36 36 A S - 0 0 40 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.349 68.7-137.2 -64.2 142.9 32.8 29.6 17.3 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.526 77.1 103.0 -75.8 -1.5 35.8 31.9 16.5 38 38 A S > - 0 0 50 1,-0.2 4,-2.0 2,-0.0 5,-0.2 -0.674 57.6-161.9 -89.6 117.2 36.3 32.3 20.2 39 39 A L H > S+ 0 0 68 -2,-0.7 4,-2.7 1,-0.2 5,-0.2 0.909 94.8 58.1 -59.5 -38.1 39.2 30.3 21.6 40 40 A N H > S+ 0 0 116 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.911 104.5 50.6 -56.8 -41.3 37.7 30.8 25.0 41 41 A A H > S+ 0 0 34 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.907 111.1 48.6 -62.1 -42.6 34.5 29.1 23.8 42 42 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.899 109.9 52.4 -65.0 -39.9 36.5 26.2 22.4 43 43 A K H X S+ 0 0 45 -4,-2.7 4,-2.3 2,-0.2 13,-0.2 0.892 108.6 50.1 -65.0 -37.8 38.4 25.9 25.7 44 44 A S H X S+ 0 0 75 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.931 109.8 50.5 -65.3 -41.5 35.2 25.7 27.7 45 45 A E H X S+ 0 0 71 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.911 110.1 51.6 -58.8 -42.0 33.9 23.0 25.4 46 46 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 5,-0.3 0.930 108.4 48.9 -60.4 -48.8 37.2 21.1 25.9 47 47 A D H X>S+ 0 0 36 -4,-2.3 4,-2.5 1,-0.2 5,-1.0 0.899 112.9 49.3 -63.4 -39.6 37.0 21.2 29.7 48 48 A K H <5S+ 0 0 140 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.873 110.6 50.7 -58.9 -44.1 33.4 20.0 29.5 49 49 A A H <5S+ 0 0 40 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.871 121.3 31.7 -65.2 -40.3 34.3 17.2 27.2 50 50 A I H <5S- 0 0 37 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.701 102.0-124.8 -95.6 -23.3 37.2 15.9 29.4 51 51 A G T <5S+ 0 0 66 -4,-2.5 2,-0.3 -5,-0.3 -3,-0.2 0.766 76.4 69.2 83.4 27.1 35.9 16.8 32.8 52 52 A R S - 0 0 12 -2,-1.0 3,-1.6 -11,-0.2 -1,-0.2 0.627 34.9-152.0 -90.2 -22.3 42.8 21.4 30.5 55 55 A N T 3 S- 0 0 103 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.878 79.8 -43.2 20.5 55.4 43.3 25.2 29.3 56 56 A G T 3 S+ 0 0 7 -13,-0.2 -39,-2.1 1,-0.2 2,-0.4 0.495 122.1 96.9 96.3 4.7 43.6 23.8 25.8 57 57 A V B < +C 16 0B 68 -3,-1.6 2,-0.3 -41,-0.2 -41,-0.2 -0.993 42.2 175.4-133.0 131.8 45.9 20.8 26.3 58 58 A I - 0 0 5 -43,-2.7 2,-0.2 -2,-0.4 -30,-0.1 -0.845 28.7-109.0-126.2 169.9 45.0 17.1 26.7 59 59 A T > - 0 0 67 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.495 33.1-108.9 -88.0 163.1 46.9 13.8 27.0 60 60 A K H > S+ 0 0 116 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.922 121.1 54.3 -57.9 -43.7 47.0 11.0 24.4 61 61 A D H > S+ 0 0 126 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.932 109.6 48.2 -57.4 -42.6 44.8 8.8 26.5 62 62 A E H > S+ 0 0 39 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.914 110.0 51.2 -64.8 -44.6 42.3 11.6 26.6 63 63 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -34,-0.4 0.910 110.6 49.5 -56.3 -44.8 42.5 12.2 22.9 64 64 A E H X S+ 0 0 89 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.857 108.0 53.8 -66.9 -32.9 41.9 8.4 22.4 65 65 A K H X S+ 0 0 134 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.961 110.1 45.9 -66.7 -47.8 38.9 8.5 24.7 66 66 A L H X S+ 0 0 3 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.913 112.1 54.1 -57.1 -40.3 37.2 11.3 22.8 67 67 A F H X S+ 0 0 12 -4,-2.1 4,-2.7 -5,-0.2 5,-0.2 0.938 108.5 46.0 -62.5 -45.5 38.0 9.5 19.6 68 68 A N H X S+ 0 0 92 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.915 113.3 51.2 -67.3 -37.7 36.4 6.2 20.6 69 69 A Q H X S+ 0 0 94 -4,-2.5 4,-2.8 -5,-0.2 -1,-0.2 0.943 111.4 47.7 -57.3 -47.4 33.4 8.2 21.8 70 70 A D H X S+ 0 0 39 -4,-2.8 4,-1.9 -5,-0.2 -2,-0.2 0.890 113.8 45.8 -65.4 -42.0 33.2 10.0 18.5 71 71 A V H X S+ 0 0 6 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.941 114.1 48.8 -63.5 -48.0 33.5 6.8 16.4 72 72 A A H X S+ 0 0 52 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.915 113.2 47.8 -56.8 -45.0 30.9 4.9 18.6 73 73 A A H X S+ 0 0 62 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.826 108.4 54.3 -68.6 -33.0 28.5 7.9 18.3 74 74 A A H X S+ 0 0 11 -4,-1.9 4,-2.5 -5,-0.2 -2,-0.2 0.953 112.4 43.6 -65.3 -45.5 29.0 8.1 14.5 75 75 A V H X S+ 0 0 36 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.944 115.4 48.3 -62.1 -47.5 28.0 4.5 14.1 76 76 A R H X S+ 0 0 114 -4,-2.5 4,-0.6 -5,-0.2 -1,-0.2 0.910 112.5 48.9 -63.0 -40.7 25.1 4.7 16.6 77 77 A G H >X S+ 0 0 13 -4,-2.3 3,-1.0 1,-0.2 4,-0.5 0.918 107.5 54.3 -68.2 -40.5 23.8 7.9 14.9 78 78 A I H >< S+ 0 0 0 -4,-2.5 3,-1.4 1,-0.3 7,-0.3 0.931 107.7 51.3 -54.5 -45.1 24.0 6.3 11.4 79 79 A L H 3< S+ 0 0 46 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.614 111.0 48.0 -72.8 -13.7 21.9 3.4 12.7 80 80 A R H << S+ 0 0 177 -3,-1.0 2,-0.6 -4,-0.6 -1,-0.3 0.341 93.1 93.4 -99.8 -0.0 19.3 5.9 14.1 81 81 A N S+ 0 0 88 2,-0.1 4,-0.7 1,-0.1 -1,-0.2 0.862 121.7 36.7 -81.6 -41.2 18.5 7.9 5.3 84 84 A L H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.1 5,-0.2 0.834 101.7 70.7 -86.6 -32.8 21.9 6.4 6.4 85 85 A K H X S+ 0 0 99 -4,-2.8 4,-2.7 -7,-0.3 5,-0.2 0.919 99.4 46.3 -55.0 -51.2 20.8 3.2 8.2 86 86 A P H > S+ 0 0 58 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.906 114.7 48.2 -63.0 -37.3 19.6 1.2 5.2 87 87 A V H X S+ 0 0 6 -4,-0.7 4,-1.2 2,-0.2 3,-0.3 0.969 112.3 48.7 -64.9 -49.2 22.7 2.2 3.2 88 88 A Y H >< S+ 0 0 34 -4,-2.9 3,-0.9 1,-0.2 -1,-0.2 0.927 112.6 48.0 -52.2 -51.9 25.0 1.2 6.2 89 89 A D H 3< S+ 0 0 97 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.825 109.4 53.9 -66.0 -28.1 23.3 -2.1 6.6 90 90 A S H 3< S+ 0 0 29 -4,-1.8 2,-0.2 -3,-0.3 -1,-0.2 0.697 97.3 83.8 -75.7 -20.3 23.5 -2.9 2.9 91 91 A L S << S- 0 0 8 -4,-1.2 31,-0.0 -3,-0.9 30,-0.0 -0.600 82.0-113.4 -90.6 145.7 27.3 -2.3 2.8 92 92 A D > - 0 0 58 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.189 42.9 -96.3 -61.8 163.5 30.1 -4.7 3.6 93 93 A A H > S+ 0 0 70 1,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.788 122.4 51.5 -62.8 -30.5 32.2 -3.9 6.6 94 94 A V H >> S+ 0 0 32 2,-0.2 4,-1.0 1,-0.2 3,-0.9 0.965 112.5 44.8 -70.5 -49.6 35.0 -2.2 4.6 95 95 A R H 3> S+ 0 0 27 1,-0.3 4,-1.6 2,-0.2 3,-0.4 0.849 105.2 63.1 -64.2 -32.1 32.6 0.1 2.8 96 96 A E H 3X S+ 0 0 32 -4,-2.5 4,-2.5 1,-0.2 -1,-0.3 0.860 97.2 58.4 -55.1 -39.8 30.8 0.8 6.0 97 97 A C H S+ 0 0 61 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.895 126.6 52.0 -62.0 -47.8 25.1 13.0 9.8 109 109 A T H > S+ 0 0 123 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.906 109.5 50.5 -59.4 -44.0 22.9 15.6 8.3 110 110 A G H >4 S+ 0 0 32 -4,-0.4 3,-0.6 1,-0.2 4,-0.3 0.937 113.9 43.5 -61.7 -45.6 25.6 16.5 5.8 111 111 A V H >< S+ 0 0 1 -4,-2.2 3,-2.1 1,-0.2 -1,-0.2 0.912 107.5 59.5 -65.4 -41.2 26.1 12.9 4.7 112 112 A A H 3< S+ 0 0 9 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.752 95.8 65.3 -61.7 -19.8 22.4 12.2 4.6 113 113 A G T << S+ 0 0 54 -4,-1.1 2,-2.1 -3,-0.6 3,-0.3 0.573 74.3 90.2 -77.9 -10.1 22.1 15.0 2.1 114 114 A F <> + 0 0 44 -3,-2.1 4,-2.9 -4,-0.3 5,-0.3 -0.307 54.1 158.3 -79.3 56.0 24.1 13.0 -0.5 115 115 A T H > + 0 0 87 -2,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.872 65.7 43.8 -55.7 -47.3 20.9 11.5 -1.8 116 116 A N H > S+ 0 0 83 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.926 115.2 47.3 -69.8 -40.8 22.0 10.4 -5.2 117 117 A S H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.899 110.2 53.6 -63.6 -42.8 25.3 9.0 -4.1 118 118 A L H X S+ 0 0 13 -4,-2.9 4,-2.5 2,-0.2 -1,-0.2 0.885 108.5 50.2 -57.9 -43.0 23.6 7.1 -1.2 119 119 A R H X S+ 0 0 112 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.924 110.3 49.1 -60.9 -46.7 21.2 5.5 -3.8 120 120 A M H <>S+ 0 0 25 -4,-2.1 5,-2.7 1,-0.2 4,-0.3 0.888 111.7 50.0 -62.2 -40.0 24.1 4.5 -6.0 121 121 A L H ><5S+ 0 0 2 -4,-2.6 3,-1.4 3,-0.2 -1,-0.2 0.921 109.4 50.1 -61.8 -45.3 25.8 2.9 -3.1 122 122 A Q H 3<5S+ 0 0 85 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.852 111.7 49.2 -61.2 -33.1 22.7 1.0 -2.0 123 123 A Q T 3<5S- 0 0 94 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.451 111.8-125.6 -80.6 -6.2 22.4 -0.2 -5.6 124 124 A K T < 5 + 0 0 98 -3,-1.4 2,-1.3 -4,-0.3 -3,-0.2 0.803 59.6 148.5 56.4 38.8 26.1 -1.2 -5.5 125 125 A R >< + 0 0 125 -5,-2.7 4,-2.8 1,-0.2 -1,-0.2 -0.718 21.4 174.1 -90.9 76.4 26.8 0.8 -8.6 126 126 A W H > + 0 0 50 -2,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.858 67.7 44.5 -67.1 -44.9 30.3 1.5 -7.3 127 127 A D H > S+ 0 0 95 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.916 116.1 48.9 -68.2 -39.8 32.0 3.4 -10.1 128 128 A E H > S+ 0 0 101 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.921 111.3 50.0 -62.6 -43.8 28.9 5.6 -10.6 129 129 A A H X S+ 0 0 1 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.914 108.8 52.4 -61.0 -43.3 28.7 6.3 -6.9 130 130 A A H X S+ 0 0 13 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.898 109.5 49.0 -61.0 -42.3 32.4 7.2 -6.9 131 131 A V H < S+ 0 0 85 -4,-2.1 4,-0.4 1,-0.2 3,-0.3 0.922 114.2 46.3 -59.8 -45.6 31.9 9.7 -9.8 132 132 A N H >< S+ 0 0 42 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.903 105.3 58.4 -69.0 -37.0 28.9 11.2 -8.0 133 133 A L H 3< S+ 0 0 2 -4,-2.8 6,-0.4 1,-0.3 -1,-0.2 0.809 100.3 58.6 -60.7 -33.5 30.6 11.6 -4.6 134 134 A A T 3< S+ 0 0 28 -4,-1.2 2,-1.8 -3,-0.3 -1,-0.3 0.646 83.4 83.1 -74.5 -15.2 33.4 13.7 -6.1 135 135 A K S < S+ 0 0 157 -3,-1.4 2,-0.3 -4,-0.4 -1,-0.2 -0.538 81.0 98.0 -86.6 71.1 30.9 16.3 -7.3 136 136 A S S > S- 0 0 17 -2,-1.8 4,-2.3 1,-0.1 5,-0.2 -0.998 86.1-116.4-156.8 151.0 30.8 18.0 -3.9 137 137 A R H > S+ 0 0 147 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.912 115.9 62.0 -52.7 -43.5 32.1 20.8 -1.8 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.940 106.3 41.3 -47.6 -56.0 33.6 17.9 0.3 139 139 A Y H 4 S+ 0 0 65 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.928 114.5 51.8 -65.1 -44.7 35.8 16.6 -2.4 140 140 A N H < S+ 0 0 112 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.901 114.6 41.5 -60.0 -40.6 36.9 20.1 -3.6 141 141 A Q H < S+ 0 0 113 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.829 133.7 19.6 -81.0 -31.5 37.9 21.3 -0.1 142 142 A T S X S+ 0 0 20 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.3 -0.606 75.6 160.0-132.3 72.0 39.6 18.0 1.0 143 143 A P H > + 0 0 51 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.860 69.6 50.5 -71.5 -37.8 40.4 16.2 -2.3 144 144 A N H > S+ 0 0 114 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.928 115.5 42.0 -70.7 -38.5 43.1 13.8 -1.2 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.932 114.7 51.7 -69.2 -43.5 41.1 12.5 1.8 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-3.2 1,-0.2 5,-0.2 0.922 106.7 54.8 -59.2 -39.5 37.9 12.4 -0.2 147 147 A K H X S+ 0 0 105 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.898 108.5 48.6 -57.4 -43.5 39.8 10.4 -2.9 148 148 A R H X S+ 0 0 56 -4,-1.7 4,-1.7 2,-0.2 12,-0.2 0.924 113.7 45.4 -61.4 -46.9 40.8 7.9 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.922 113.6 50.1 -61.2 -46.3 37.3 7.5 1.1 150 150 A I H X S+ 0 0 15 -4,-3.2 4,-2.8 -5,-0.2 -2,-0.2 0.903 107.8 52.9 -62.5 -40.9 35.9 7.3 -2.4 151 151 A T H X S+ 0 0 51 -4,-2.6 4,-2.6 -5,-0.2 6,-0.4 0.877 107.1 53.6 -60.4 -36.5 38.4 4.6 -3.4 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.935 112.1 44.2 -64.6 -45.3 37.3 2.6 -0.3 153 153 A F H < S+ 0 0 2 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.884 115.6 48.3 -62.1 -40.4 33.6 2.9 -1.4 154 154 A R H < S+ 0 0 108 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.945 126.4 22.5 -68.0 -44.7 34.5 2.0 -5.0 155 155 A T H < S- 0 0 37 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.612 85.2-134.0 -98.4 -24.0 36.6 -1.0 -4.3 156 156 A G S < S+ 0 0 17 -4,-2.4 2,-0.3 -5,-0.3 -62,-0.2 0.748 73.8 106.6 63.2 25.6 35.7 -2.3 -0.9 157 157 A T S S- 0 0 47 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.803 79.3-123.1-125.5 168.0 39.4 -2.6 -0.2 158 158 A W >> + 0 0 50 -2,-0.3 3,-2.3 1,-0.2 4,-1.7 0.098 69.3 123.1 -92.8 18.9 41.9 -0.7 1.9 159 159 A D T 34 S+ 0 0 119 1,-0.3 -1,-0.2 2,-0.2 -7,-0.1 0.814 70.0 55.0 -58.4 -30.8 44.1 0.1 -1.0 160 160 A A T 34 S+ 0 0 24 -3,-0.3 -1,-0.3 -12,-0.2 -2,-0.1 0.609 115.6 38.4 -77.3 -9.8 44.0 3.8 -0.5 161 161 A Y T X4 S+ 0 0 0 -3,-2.3 3,-2.0 -13,-0.1 2,-0.5 0.519 82.9 122.3-114.4 -14.7 45.2 3.5 3.2 162 162 A K T 3< S+ 0 0 63 -4,-1.7 0, 0.0 1,-0.3 0, 0.0 -0.792 86.5 6.5 -84.3 126.0 47.8 0.7 2.9 163 163 A N T 3 0 0 150 -2,-0.5 -1,-0.3 -3,-0.0 -2,-0.0 0.278 360.0 360.0-109.6 113.0 50.4 2.0 4.0 164 164 A L < 0 0 115 -3,-2.0 -2,-0.1 0, 0.0 -4,-0.0 -0.068 360.0 360.0-107.9 360.0 49.9 5.4 5.4