==== 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 1SX7 . 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) . 8715.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.0 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 . 9 5.5 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 81 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 142.3 43.2 -1.6 8.8 2 2 A N > - 0 0 67 156,-0.0 4,-2.5 95,-0.0 5,-0.2 -0.922 360.0 -81.0-154.7 177.6 40.0 -0.7 10.5 3 3 A I H > S+ 0 0 20 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.839 126.1 51.7 -60.6 -36.8 37.9 2.5 11.1 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.957 113.0 43.4 -67.2 -47.6 40.1 3.7 14.0 5 5 A E H > S+ 0 0 97 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.884 114.1 53.0 -62.4 -37.4 43.4 3.4 12.0 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.942 112.5 42.1 -63.3 -51.0 41.7 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 0.848 109.4 58.7 -69.2 -31.1 40.4 8.0 10.8 8 8 A R H X S+ 0 0 107 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.910 109.1 45.7 -64.7 -39.2 43.7 8.3 12.6 9 9 A I H < S+ 0 0 44 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.931 117.6 43.2 -61.6 -46.6 45.4 8.6 9.2 10 10 A D H < S+ 0 0 19 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.783 126.5 29.6 -73.5 -29.9 42.8 11.1 7.9 11 11 A E H < S- 0 0 38 -4,-2.5 19,-0.5 -5,-0.1 -3,-0.2 0.647 90.5-151.4-107.1 -19.2 42.6 13.2 11.1 12 12 A G < - 0 0 22 -4,-2.1 2,-0.4 -5,-0.3 -1,-0.1 -0.125 24.1 -87.6 71.7-174.8 46.1 13.1 12.7 13 13 A L + 0 0 45 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.979 44.5 167.8-138.6 119.3 46.7 13.4 16.5 14 14 A R E -A 28 0A 134 14,-1.9 14,-2.4 -2,-0.4 4,-0.1 -1.000 22.0-160.7-134.0 135.4 47.3 16.8 18.2 15 15 A L E S+ 0 0 69 -2,-0.4 43,-2.6 12,-0.2 2,-0.3 0.516 75.2 60.5 -96.3 -2.7 47.3 17.3 21.9 16 16 A K E S-C 57 0B 140 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.916 100.2 -87.7-122.0 148.8 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 -0.246 58.0 163.9 -54.3 135.4 43.7 23.0 20.4 18 18 A Y E -A 26 0A 29 8,-2.6 8,-2.8 6,-0.1 2,-0.5 -0.909 40.0 -96.3-144.1 171.4 44.3 23.7 16.7 19 19 A K E -A 25 0A 125 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.860 35.2-140.5 -98.3 130.7 42.2 24.8 13.8 20 20 A D > - 0 0 44 4,-2.6 3,-2.2 -2,-0.5 -1,-0.1 0.047 43.2 -78.9 -74.1-172.6 41.0 22.1 11.4 21 21 A T T 3 S+ 0 0 104 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.704 133.8 51.9 -73.4 -9.9 40.9 22.4 7.6 22 22 A E T 3 S- 0 0 70 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.331 122.6-105.0 -95.1 2.0 37.7 24.5 7.9 23 23 A G S < S+ 0 0 40 -3,-2.2 2,-0.4 1,-0.3 -2,-0.1 0.586 76.0 138.3 87.2 12.0 39.3 26.9 10.4 24 24 A Y - 0 0 75 1,-0.1 -4,-2.6 9,-0.0 -1,-0.3 -0.767 61.7-101.2-102.2 138.8 37.4 25.4 13.4 25 25 A Y E +A 19 0A 36 11,-0.4 8,-2.7 9,-0.4 9,-1.2 -0.341 54.2 159.6 -62.7 130.8 38.9 24.7 16.8 26 26 A T E -AB 18 32A 3 -8,-2.8 -8,-2.6 6,-0.3 2,-0.3 -0.868 18.4-170.3-144.7 160.5 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 51.8 8.5-150.8 167.4 41.8 18.7 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.4 -14,-1.9 -2,-0.3 2,-0.8 -0.475 122.5 -11.1 71.5-133.9 42.9 15.1 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -2,-0.2 -16,-0.1 -0.807 128.8 -48.0-104.8 78.4 41.9 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 0.774 83.7 161.1 65.0 30.8 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 -0.710 30.9-147.1 -87.7 102.6 37.5 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 -0.483 16.8-176.0 -63.2 127.2 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 0.853 57.9 -33.2 -92.9 -42.1 35.1 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 35.6-129.7-171.7 155.9 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 0.412 74.7 115.6 -92.4 -4.4 32.5 26.5 15.2 36 36 A S - 0 0 41 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.382 69.0-137.4 -65.7 143.1 32.9 29.6 17.2 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.521 77.0 103.7 -75.6 -0.4 35.8 31.9 16.5 38 38 A S > - 0 0 50 1,-0.2 4,-1.9 2,-0.0 5,-0.2 -0.701 57.1-162.3 -88.7 117.9 36.3 32.3 20.2 39 39 A L H > S+ 0 0 65 -2,-0.7 4,-2.8 1,-0.2 5,-0.2 0.889 95.1 57.4 -59.6 -38.0 39.2 30.3 21.6 40 40 A N H > S+ 0 0 115 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.919 104.8 50.6 -60.6 -40.3 37.7 30.8 25.0 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.905 111.7 48.2 -59.0 -43.9 34.4 29.1 23.8 42 42 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.897 109.8 52.4 -64.9 -40.9 36.5 26.2 22.4 43 43 A K H X S+ 0 0 44 -4,-2.8 4,-2.3 2,-0.2 11,-0.3 0.904 108.7 50.1 -64.5 -38.1 38.4 25.9 25.7 44 44 A S H X S+ 0 0 73 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.931 109.7 50.7 -64.2 -43.3 35.2 25.7 27.7 45 45 A E H X S+ 0 0 74 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.908 109.9 51.4 -57.9 -42.5 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 0.918 108.5 49.4 -60.3 -49.1 37.2 21.1 25.9 47 47 A D H X>S+ 0 0 34 -4,-2.3 4,-2.6 1,-0.2 5,-1.0 0.906 112.8 48.2 -63.2 -38.5 37.0 21.2 29.7 48 48 A K H <5S+ 0 0 143 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.852 110.6 51.4 -65.0 -38.2 33.4 20.0 29.6 49 49 A A H <5S+ 0 0 41 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.858 121.7 31.2 -65.8 -40.2 34.3 17.2 27.2 50 50 A I H <5S- 0 0 36 -4,-2.2 -2,-0.2 2,-0.2 -3,-0.2 0.721 102.5-125.3 -95.6 -23.8 37.2 15.9 29.4 51 51 A G T <5S+ 0 0 66 -4,-2.6 2,-0.3 -5,-0.3 -3,-0.2 0.775 78.5 81.1 80.4 29.9 35.9 16.8 32.8 52 52 A R S - 0 0 11 -2,-0.8 3,-1.5 -11,-0.3 -1,-0.2 0.577 29.5-150.4-100.9 -26.6 42.4 21.9 30.5 55 55 A N T 3 S- 0 0 103 1,-0.2 -12,-0.1 -12,-0.2 -11,-0.1 0.863 78.9 -47.3 41.7 40.2 43.2 25.4 29.2 56 56 A G T 3 S+ 0 0 6 -13,-0.2 -39,-2.1 1,-0.1 2,-0.4 0.469 115.5 97.3 98.0 -1.5 43.7 23.8 25.7 57 57 A V B < +C 16 0B 63 -3,-1.5 2,-0.3 -41,-0.2 -41,-0.2 -0.981 39.8 173.8-132.4 133.0 45.9 20.7 26.3 58 58 A I - 0 0 4 -43,-2.6 2,-0.2 -2,-0.4 -30,-0.1 -0.844 29.3-108.7-127.8 170.2 45.0 17.1 26.7 59 59 A T > - 0 0 68 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.516 33.1-108.1 -89.8 164.9 46.9 13.8 27.0 60 60 A K H > S+ 0 0 115 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.909 121.0 54.5 -57.3 -43.8 47.0 11.0 24.3 61 61 A D H > S+ 0 0 126 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.930 109.6 47.7 -60.1 -41.0 44.8 8.8 26.5 62 62 A E H > S+ 0 0 38 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.910 109.9 51.9 -65.3 -43.4 42.2 11.6 26.6 63 63 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -34,-0.4 0.907 111.2 47.9 -57.0 -45.1 42.5 12.1 22.9 64 64 A E H X S+ 0 0 89 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.854 108.2 55.3 -67.0 -32.8 41.8 8.4 22.3 65 65 A K H X S+ 0 0 135 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.941 110.4 44.4 -65.5 -46.6 38.9 8.5 24.8 66 66 A L H X S+ 0 0 3 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.891 112.6 53.9 -60.3 -40.4 37.2 11.3 22.8 67 67 A F H X S+ 0 0 12 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.940 108.1 47.7 -63.1 -45.2 38.0 9.5 19.5 68 68 A N H X S+ 0 0 91 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.913 113.2 49.7 -63.0 -41.3 36.4 6.2 20.7 69 69 A Q H X S+ 0 0 93 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.939 111.6 48.6 -58.7 -46.8 33.4 8.2 21.8 70 70 A D H X S+ 0 0 40 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.889 113.2 45.7 -65.6 -42.3 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 0.943 114.3 48.7 -63.9 -47.0 33.5 6.8 16.4 72 72 A A H X S+ 0 0 54 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.919 113.1 47.7 -57.4 -46.0 30.9 5.0 18.6 73 73 A A H X S+ 0 0 60 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.2 0.836 108.7 54.3 -68.2 -31.7 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 0.946 112.2 43.7 -65.6 -46.6 29.0 8.1 14.5 75 75 A V H X S+ 0 0 35 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.942 115.6 48.3 -61.1 -47.3 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 -2,-0.2 0.907 112.4 49.1 -62.6 -41.3 25.1 4.8 16.6 77 77 A G H >X S+ 0 0 12 -4,-2.3 3,-1.0 2,-0.2 4,-0.5 0.922 107.5 54.0 -66.4 -42.0 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 0.929 107.8 51.4 -54.1 -45.3 24.0 6.3 11.4 79 79 A L H 3< S+ 0 0 45 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.628 111.0 47.5 -73.2 -14.5 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 0.343 93.3 93.8 -99.2 1.1 19.3 5.9 14.1 81 81 A N S+ 0 0 128 2,-0.1 4,-0.6 1,-0.1 -1,-0.2 0.864 121.6 36.4 -80.4 -40.8 18.5 7.8 5.3 84 84 A L H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.1 5,-0.2 0.831 101.9 70.8 -87.8 -32.4 21.8 6.4 6.4 85 85 A K H X S+ 0 0 98 -4,-2.9 4,-2.7 -7,-0.3 5,-0.2 0.923 99.5 46.3 -54.9 -50.2 20.8 3.2 8.2 86 86 A P H > S+ 0 0 55 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.906 114.7 48.3 -63.4 -37.4 19.6 1.2 5.2 87 87 A V H X S+ 0 0 5 -4,-0.6 4,-1.2 2,-0.2 3,-0.3 0.967 112.2 48.8 -65.1 -49.4 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 0.930 112.6 48.0 -51.9 -52.3 25.0 1.2 6.2 89 89 A D H 3< S+ 0 0 96 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.826 109.3 53.9 -65.4 -28.3 23.3 -2.1 6.6 90 90 A S H 3< S+ 0 0 36 -4,-1.8 2,-0.3 -3,-0.3 -1,-0.2 0.697 97.2 83.8 -75.3 -20.6 23.5 -2.8 2.9 91 91 A L S << S- 0 0 8 -4,-1.2 31,-0.0 -3,-0.9 30,-0.0 -0.605 81.9-113.8 -89.1 145.1 27.3 -2.3 2.8 92 92 A D > - 0 0 56 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.194 43.2 -95.9 -61.5 163.5 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 0.784 122.3 51.3 -62.9 -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,-0.8 0.963 112.5 44.8 -70.3 -49.9 35.0 -2.1 4.6 95 95 A R H 3> S+ 0 0 27 1,-0.3 4,-1.7 2,-0.2 3,-0.4 0.852 105.3 62.7 -64.4 -31.5 32.6 0.1 2.8 96 96 A E H 3X S+ 0 0 33 -4,-2.5 4,-2.4 1,-0.2 -1,-0.3 0.867 97.3 58.8 -55.9 -38.5 30.8 0.8 6.0 97 97 A C H S+ 0 0 62 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.880 126.7 52.3 -61.6 -46.5 25.1 12.9 9.8 109 109 A T H > S+ 0 0 123 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.906 109.6 50.7 -59.1 -44.5 22.9 15.6 8.3 110 110 A G H >4 S+ 0 0 34 -4,-0.4 3,-0.7 1,-0.2 4,-0.3 0.936 114.1 42.3 -58.5 -48.7 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 0.910 108.3 59.5 -65.7 -41.3 26.1 12.9 4.7 112 112 A A H 3< S+ 0 0 8 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.729 96.0 65.5 -61.1 -20.0 22.4 12.2 4.6 113 113 A G T << S+ 0 0 51 -4,-1.0 2,-2.1 -3,-0.7 3,-0.3 0.549 74.3 89.5 -77.4 -11.3 22.1 15.0 2.1 114 114 A F <> + 0 0 44 -3,-2.1 4,-2.8 -4,-0.3 5,-0.3 -0.323 54.1 158.8 -80.0 57.7 24.1 13.0 -0.5 115 115 A T H > + 0 0 78 -2,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.876 66.0 44.0 -57.6 -46.6 20.9 11.5 -1.8 116 116 A N H > S+ 0 0 82 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.929 115.0 47.5 -70.2 -39.9 22.0 10.4 -5.2 117 117 A S H > S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.895 110.0 53.6 -64.5 -42.2 25.3 9.0 -4.1 118 118 A L H X S+ 0 0 14 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.887 108.6 50.2 -59.4 -42.2 23.6 7.1 -1.2 119 119 A R H X S+ 0 0 112 -4,-2.0 4,-2.0 -5,-0.3 -1,-0.2 0.929 110.1 49.2 -61.2 -47.0 21.2 5.5 -3.8 120 120 A M H <>S+ 0 0 27 -4,-2.1 5,-2.7 1,-0.2 4,-0.4 0.895 111.3 50.8 -61.7 -39.8 24.1 4.5 -6.0 121 121 A L H ><5S+ 0 0 2 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.923 109.5 48.5 -62.8 -43.8 25.8 2.9 -3.1 122 122 A Q H 3<5S+ 0 0 94 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.835 111.0 51.6 -69.4 -25.4 22.8 1.0 -2.0 123 123 A Q T 3<5S- 0 0 98 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.512 112.0-124.4 -79.1 -7.6 22.4 -0.2 -5.6 124 124 A K T < 5 + 0 0 98 -3,-1.3 2,-1.2 -4,-0.4 -3,-0.2 0.816 61.8 146.4 63.0 36.8 26.1 -1.3 -5.6 125 125 A R >< + 0 0 129 -5,-2.7 4,-2.8 1,-0.2 -1,-0.2 -0.726 21.8 172.9 -96.3 76.5 26.8 0.8 -8.6 126 126 A W H > + 0 0 50 -2,-1.2 4,-2.2 1,-0.2 -1,-0.2 0.852 67.6 45.0 -67.3 -44.5 30.3 1.5 -7.2 127 127 A D H > S+ 0 0 104 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.909 115.8 48.9 -67.9 -39.4 32.0 3.4 -10.1 128 128 A E H > S+ 0 0 99 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.921 111.2 50.0 -62.4 -44.6 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 0.914 108.9 52.3 -60.2 -44.3 28.7 6.3 -6.9 130 130 A A H X S+ 0 0 11 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.897 109.6 49.0 -60.8 -43.0 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 0.922 114.4 46.1 -59.1 -44.9 31.9 9.7 -9.8 132 132 A N H >< S+ 0 0 40 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.896 105.3 58.4 -70.4 -37.4 29.0 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 0.809 100.4 58.8 -60.0 -34.4 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 0.639 83.3 83.1 -72.8 -16.6 33.4 13.7 -6.1 135 135 A K S < S+ 0 0 158 -3,-1.4 2,-0.3 -4,-0.4 -1,-0.2 -0.536 80.7 98.0 -86.6 71.2 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 86.0-116.9-156.3 150.2 30.9 18.0 -3.9 137 137 A R H > S+ 0 0 144 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.910 115.9 62.6 -54.3 -42.8 32.2 20.8 -1.8 138 138 A W H > S+ 0 0 17 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.933 106.2 41.0 -45.8 -56.6 33.6 17.9 0.3 139 139 A Y H 4 S+ 0 0 63 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.922 114.8 51.6 -64.0 -45.5 35.8 16.6 -2.4 140 140 A N H < S+ 0 0 111 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.900 114.8 41.3 -60.3 -40.7 36.9 20.1 -3.6 141 141 A Q H < S+ 0 0 106 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.837 133.6 19.8 -81.1 -31.5 37.9 21.2 -0.2 142 142 A T S X S+ 0 0 19 -4,-2.3 4,-2.6 -5,-0.3 -1,-0.3 -0.606 75.6 160.1-131.6 72.1 39.6 18.0 1.0 143 143 A P H > S+ 0 0 50 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.857 70.4 48.9 -71.1 -38.6 40.4 16.2 -2.3 144 144 A N H > S+ 0 0 113 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.931 115.6 43.3 -70.0 -38.9 43.1 13.8 -1.2 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.932 114.9 50.2 -68.2 -44.0 41.1 12.6 1.8 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.2 5,-0.2 0.908 106.9 55.8 -60.2 -40.6 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 0.904 108.1 48.4 -55.7 -44.0 39.8 10.4 -2.9 148 148 A R H X S+ 0 0 54 -4,-1.7 4,-1.7 2,-0.2 12,-0.2 0.921 113.7 45.4 -62.2 -47.4 40.8 7.9 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.926 113.8 49.9 -61.1 -46.0 37.3 7.5 1.1 150 150 A I H X S+ 0 0 14 -4,-3.3 4,-2.7 1,-0.2 -2,-0.2 0.905 107.8 52.8 -63.3 -40.5 35.9 7.3 -2.4 151 151 A T H X S+ 0 0 43 -4,-2.6 4,-2.5 -5,-0.2 6,-0.4 0.880 107.2 53.7 -60.1 -36.4 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 0.937 112.4 43.4 -64.0 -46.9 37.2 2.7 -0.3 153 153 A F H < S+ 0 0 2 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.879 115.6 49.1 -61.3 -41.6 33.6 2.9 -1.4 154 154 A R H < S+ 0 0 103 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.913 126.6 22.0 -69.1 -39.8 34.5 2.1 -5.1 155 155 A T H < S- 0 0 36 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.652 85.2-133.8-104.5 -24.1 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 74.3 106.7 64.9 24.7 35.7 -2.4 -0.9 157 157 A T S S- 0 0 46 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.801 79.5-123.4-125.7 167.2 39.4 -2.6 -0.2 158 158 A W >> + 0 0 48 -2,-0.3 3,-2.2 1,-0.2 4,-2.0 0.085 69.1 123.8 -93.5 20.1 41.9 -0.7 1.9 159 159 A D T 34 S+ 0 0 120 1,-0.3 -1,-0.2 2,-0.2 -7,-0.0 0.819 70.1 54.5 -56.0 -33.7 44.1 0.1 -1.1 160 160 A A T 34 S+ 0 0 24 -3,-0.3 -1,-0.3 -12,-0.2 -2,-0.1 0.612 118.1 34.8 -77.6 -9.8 44.0 3.8 -0.5 161 161 A Y T X4 S+ 0 0 1 -3,-2.2 3,-1.5 -13,-0.1 2,-0.3 0.561 84.8 111.6-113.5 -20.3 45.2 3.5 3.2 162 162 A K T 3< S+ 0 0 69 -4,-2.0 0, 0.0 1,-0.3 0, 0.0 -0.607 88.7 19.3 -78.1 136.9 47.6 0.6 3.0 163 163 A N T 3 0 0 100 -2,-0.3 -1,-0.3 1,-0.2 -4,-0.0 0.656 360.0 360.0 14.2 65.5 50.9 2.0 3.6 164 164 A L < 0 0 133 -3,-1.5 -1,-0.2 0, 0.0 -3,-0.1 -0.392 360.0 360.0-111.4 360.0 49.9 5.3 5.3