==== 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) 01-MAY-89 1L30 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.A.BELL,S.DAO-PIN,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8740.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 71.3 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 . 12 7.3 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 . 8 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 52.4 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 1 0 0 2 2 0 0 1 1 0 0 0 0 0 0 1 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 0 2 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 75 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 146.2 36.8 -23.5 9.0 2 2 A N > - 0 0 70 95,-0.0 4,-2.4 1,-0.0 3,-0.3 -0.862 360.0 -83.9-143.9 176.6 34.6 -21.0 10.9 3 3 A I H > S+ 0 0 21 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.811 124.1 52.2 -56.6 -39.9 34.3 -17.2 11.4 4 4 A F H > S+ 0 0 78 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.922 111.5 43.7 -64.0 -48.8 36.9 -17.2 14.1 5 5 A E H > S+ 0 0 91 -3,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.890 113.1 54.0 -64.4 -38.8 39.6 -19.0 12.2 6 6 A M H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.955 112.5 41.6 -62.5 -53.7 38.9 -17.0 9.1 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.832 109.3 58.6 -63.7 -33.9 39.3 -13.6 10.9 8 8 A R H X S+ 0 0 107 -4,-1.9 4,-2.0 -5,-0.2 -1,-0.2 0.908 108.2 48.2 -62.2 -35.7 42.4 -14.8 12.8 9 9 A I H < S+ 0 0 53 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.951 115.6 43.5 -66.6 -47.5 44.0 -15.5 9.4 10 10 A D H < S+ 0 0 20 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.810 125.7 28.4 -69.7 -36.0 43.0 -12.0 8.0 11 11 A E H < S- 0 0 33 -4,-2.4 19,-0.3 -5,-0.2 -1,-0.2 0.695 91.6-150.3-100.2 -28.1 43.9 -9.9 11.0 12 12 A G < - 0 0 18 -4,-2.0 2,-0.4 -5,-0.3 -1,-0.1 -0.196 23.8 -88.1 80.1-177.9 46.7 -11.7 12.8 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.979 42.0 173.6-136.2 125.3 47.4 -11.6 16.5 14 14 A R E -A 28 0A 133 14,-1.2 14,-2.5 -2,-0.4 4,-0.1 -0.995 18.4-163.6-135.2 126.9 49.6 -8.9 18.1 15 15 A L E S+ 0 0 68 -2,-0.4 43,-2.5 12,-0.2 2,-0.3 0.427 74.2 63.6 -88.9 -4.4 50.0 -8.6 21.9 16 16 A K E S-C 57 0B 108 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.921 101.2 -87.2-117.6 149.9 51.5 -5.0 21.8 17 17 A I E + 0 0 20 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.288 59.0 171.8 -52.3 137.2 49.7 -1.8 20.5 18 18 A Y E -A 26 0A 29 8,-3.0 8,-2.7 -4,-0.1 2,-0.4 -0.872 34.9-106.2-141.9 172.0 50.3 -1.5 16.8 19 19 A K E -A 25 0A 125 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.854 34.4-138.7-102.9 136.9 49.2 0.6 13.8 20 20 A D > - 0 0 49 4,-2.9 3,-2.0 -2,-0.4 -1,-0.1 -0.110 39.6 -80.7 -82.3-168.5 46.8 -1.0 11.4 21 21 A T T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.816 134.6 49.7 -66.3 -28.9 46.9 -0.7 7.7 22 22 A E T 3 S- 0 0 78 2,-0.1 -1,-0.3 1,-0.0 -3,-0.0 0.415 123.3-105.0 -87.5 2.5 45.3 2.6 8.0 23 23 A G S < S+ 0 0 35 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.593 74.1 141.4 86.3 13.4 47.7 3.8 10.6 24 24 A Y - 0 0 80 1,-0.1 -4,-2.9 -5,-0.0 -1,-0.3 -0.687 60.7-100.7 -93.9 150.7 45.3 3.5 13.5 25 25 A Y E +AB 19 34A 32 9,-0.7 8,-3.0 11,-0.4 9,-1.4 -0.475 56.4 158.3 -64.7 122.8 46.1 2.2 17.0 26 26 A T E -AB 18 32A 3 -8,-2.7 -8,-3.0 6,-0.3 2,-0.3 -0.884 19.7-172.3-141.4 164.4 45.0 -1.5 17.3 27 27 A I E > + B 0 31A 0 4,-1.3 4,-1.9 -2,-0.3 -12,-0.2 -0.983 51.3 6.2-156.3 161.3 45.8 -4.5 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.2 -2,-0.3 2,-1.0 -0.426 121.9 -7.6 75.2-130.8 45.0 -8.2 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.624 126.6 -53.0-103.9 71.1 43.1 -9.6 16.7 30 30 A G T 4 S+ 0 0 16 -2,-1.0 2,-1.0 -19,-0.3 -2,-0.2 0.796 83.5 158.6 74.0 25.1 42.1 -6.5 14.8 31 31 A H E < -B 27 0A 34 -4,-1.9 -4,-1.3 1,-0.0 -1,-0.2 -0.722 34.9-142.1 -88.0 97.9 40.6 -4.6 17.7 32 32 A L E -B 26 0A 68 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.325 18.4-174.7 -59.0 128.6 40.7 -0.9 16.8 33 33 A L E - 0 0 13 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.887 59.3 -27.0 -92.7 -47.2 41.5 1.2 19.8 34 34 A T E -B 25 0A 27 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.979 36.3-136.7-162.3 150.7 41.2 4.8 18.5 35 35 A K S S+ 0 0 142 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.438 75.9 111.5 -87.6 -1.8 41.5 6.7 15.3 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.376 72.1-131.8 -74.2 149.1 43.4 9.4 17.3 37 37 A P S S+ 0 0 117 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.638 75.8 100.8 -78.8 -8.5 47.0 10.0 16.7 38 38 A S > - 0 0 51 1,-0.2 4,-1.7 2,-0.1 3,-0.2 -0.697 56.9-159.0 -87.4 121.5 48.0 9.9 20.3 39 39 A L H > S+ 0 0 66 -2,-0.6 4,-1.9 1,-0.3 -1,-0.2 0.729 100.1 58.8 -63.6 -19.5 49.6 6.7 21.6 40 40 A N H > S+ 0 0 120 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.918 100.7 49.8 -75.6 -43.7 48.5 8.1 24.8 41 41 A A H > S+ 0 0 35 -3,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.895 113.2 50.8 -57.0 -37.9 44.9 8.2 23.8 42 42 A A H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.821 105.7 52.3 -70.0 -42.1 45.3 4.5 22.7 43 43 A K H X S+ 0 0 52 -4,-1.9 4,-2.1 2,-0.2 11,-0.3 0.868 110.7 50.1 -64.2 -31.5 46.9 3.3 25.9 44 44 A S H X S+ 0 0 72 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.888 109.2 48.9 -72.5 -44.5 43.9 4.8 27.8 45 45 A E H X S+ 0 0 68 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.909 111.2 53.7 -62.6 -41.1 41.3 3.2 25.6 46 46 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 5,-0.3 0.934 108.4 46.1 -57.5 -51.5 43.2 -0.1 26.1 47 47 A D H X>S+ 0 0 36 -4,-2.1 4,-2.2 1,-0.2 5,-0.8 0.871 113.1 51.7 -60.5 -38.1 43.1 0.1 29.8 48 48 A K H <5S+ 0 0 145 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.878 111.0 47.8 -63.1 -39.2 39.5 1.0 29.6 49 49 A A H <5S+ 0 0 46 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.876 121.2 34.2 -73.8 -34.9 38.7 -2.0 27.4 50 50 A I H <5S- 0 0 37 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.723 100.1-127.4 -91.4 -31.6 40.6 -4.5 29.5 51 51 A G T <5S+ 0 0 69 -4,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.752 77.2 76.8 86.3 23.9 39.9 -3.2 32.9 52 52 A R S - 0 0 8 -2,-0.9 3,-1.2 -11,-0.3 -1,-0.2 0.710 31.0-145.2 -95.1 -27.3 48.2 -2.7 30.6 55 55 A N T 3 S- 0 0 126 1,-0.3 3,-0.1 -12,-0.2 -2,-0.1 0.892 76.2 -52.1 62.4 41.6 51.0 -0.3 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.6 1,-0.2 2,-0.4 0.561 120.1 98.1 79.7 1.4 50.3 -1.1 26.0 57 57 A V B < +C 16 0B 58 -3,-1.2 2,-0.3 -41,-0.2 -41,-0.2 -0.968 44.8 179.5-132.3 142.5 50.5 -4.8 26.4 58 58 A I - 0 0 5 -43,-2.5 2,-0.2 -2,-0.4 -30,-0.1 -0.851 25.7-112.6-131.2 167.7 47.9 -7.7 26.8 59 59 A T > - 0 0 66 -2,-0.3 4,-2.0 1,-0.1 3,-0.4 -0.517 34.4-105.8 -92.2 166.3 47.9 -11.5 27.1 60 60 A K H > S+ 0 0 109 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.910 121.3 54.9 -56.2 -49.8 46.6 -14.0 24.6 61 61 A D H > S+ 0 0 123 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.863 107.4 49.6 -48.5 -47.8 43.6 -14.6 26.8 62 62 A E H > S+ 0 0 37 -3,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.872 109.7 51.0 -65.2 -38.8 42.7 -10.9 26.8 63 63 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -34,-0.4 0.832 110.2 49.6 -67.2 -38.6 43.1 -10.7 23.0 64 64 A E H X S+ 0 0 78 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.792 108.3 53.0 -71.8 -30.8 40.8 -13.6 22.6 65 65 A K H X S+ 0 0 137 -4,-1.6 4,-2.4 -5,-0.2 -2,-0.2 0.965 110.3 46.7 -67.7 -43.6 38.2 -12.1 24.9 66 66 A L H X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.916 111.7 53.5 -58.5 -42.7 38.2 -8.8 22.9 67 67 A F H X S+ 0 0 11 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.925 107.0 50.3 -59.7 -47.7 37.9 -10.9 19.7 68 68 A N H X S+ 0 0 91 -4,-2.4 4,-2.2 1,-0.2 5,-0.3 0.939 112.9 47.7 -57.3 -45.9 34.9 -12.8 21.1 69 69 A Q H X S+ 0 0 98 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.905 111.3 49.8 -62.0 -41.4 33.2 -9.5 21.9 70 70 A D H X S+ 0 0 37 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.842 110.9 47.6 -69.1 -34.4 34.0 -8.0 18.5 71 71 A V H X S+ 0 0 6 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.943 112.8 50.7 -70.8 -43.4 32.6 -11.0 16.5 72 72 A D H X S+ 0 0 83 -4,-2.2 4,-2.6 -5,-0.3 5,-0.3 0.929 112.1 45.8 -56.0 -47.5 29.5 -11.0 18.7 73 73 A A H X S+ 0 0 43 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 0.884 109.6 55.3 -68.7 -34.5 29.0 -7.3 18.1 74 74 A A H X S+ 0 0 8 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.942 112.0 43.6 -61.2 -49.0 29.6 -7.7 14.3 75 75 A V H X S+ 0 0 32 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.936 114.7 48.9 -57.7 -48.5 26.8 -10.3 14.1 76 76 A R H X S+ 0 0 114 -4,-2.6 4,-1.7 1,-0.2 5,-0.2 0.898 109.4 54.4 -63.0 -36.3 24.4 -8.3 16.4 77 77 A G H X S+ 0 0 2 -4,-2.2 4,-0.8 -5,-0.3 -1,-0.2 0.931 107.6 47.4 -70.1 -38.9 25.1 -5.3 14.3 78 78 A I H >< S+ 0 0 0 -4,-1.9 3,-0.9 1,-0.2 7,-0.5 0.955 111.0 53.0 -60.9 -44.4 24.2 -7.1 11.0 79 79 A L H 3< S+ 0 0 72 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.783 111.1 48.1 -64.8 -23.5 21.0 -8.4 12.7 80 80 A R H 3< S+ 0 0 170 -4,-1.7 2,-0.7 -5,-0.1 -1,-0.3 0.456 93.9 82.7 -92.6 -18.0 20.0 -4.9 13.7 81 81 A N S S+ 0 0 77 -2,-0.7 4,-1.5 1,-0.2 -1,-0.2 0.890 96.2 43.2 -51.5 -50.7 17.6 -3.7 8.1 83 83 A K H > S+ 0 0 140 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.924 117.6 46.8 -66.1 -39.6 19.5 -3.7 4.8 84 84 A L H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.876 108.7 52.4 -69.4 -46.3 22.2 -6.0 6.2 85 85 A K H X S+ 0 0 77 -4,-2.7 4,-3.0 -7,-0.5 -1,-0.2 0.863 104.6 57.7 -57.2 -40.5 19.8 -8.5 7.9 86 86 A L H X S+ 0 0 99 -4,-1.5 4,-0.9 -5,-0.3 -1,-0.2 0.938 112.4 40.3 -58.0 -46.9 17.9 -9.0 4.6 87 87 A V H >X S+ 0 0 3 -4,-1.3 4,-0.9 2,-0.2 3,-0.6 0.930 114.5 52.6 -66.2 -46.8 21.1 -10.0 2.9 88 88 A Y H >< S+ 0 0 39 -4,-2.7 3,-1.2 1,-0.3 -2,-0.2 0.936 108.5 49.7 -51.3 -53.5 22.4 -12.1 5.8 89 89 A D H 3< S+ 0 0 81 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.748 108.0 55.2 -62.2 -26.3 19.2 -14.1 6.0 90 90 A S H << S+ 0 0 33 -4,-0.9 -1,-0.3 -3,-0.6 2,-0.2 0.636 95.9 87.5 -80.6 -16.0 19.3 -14.8 2.3 91 91 A L S << S- 0 0 5 -3,-1.2 31,-0.0 -4,-0.9 30,-0.0 -0.585 75.6-116.6 -90.2 159.8 22.7 -16.3 2.3 92 92 A D > - 0 0 55 -2,-0.2 4,-2.2 1,-0.1 5,-0.1 -0.077 44.9 -93.0 -74.7 170.5 24.2 -19.8 2.9 93 93 A A H > S+ 0 0 74 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.864 122.1 47.0 -59.8 -39.2 26.5 -20.5 5.9 94 94 A V H > S+ 0 0 28 62,-0.2 4,-1.3 2,-0.2 3,-0.4 0.952 112.8 47.8 -68.2 -50.7 29.8 -19.9 4.2 95 95 A R H > S+ 0 0 23 1,-0.2 4,-1.8 2,-0.2 3,-0.3 0.894 104.2 62.6 -58.5 -35.5 28.7 -16.6 2.5 96 96 A R H X S+ 0 0 79 -4,-2.2 4,-2.4 1,-0.2 3,-0.2 0.951 100.2 54.8 -54.8 -40.1 27.4 -15.4 5.9 97 97 A C H X S+ 0 0 18 -4,-1.3 4,-2.3 -3,-0.4 -1,-0.2 0.857 103.5 54.7 -59.4 -38.9 31.0 -15.7 7.1 98 98 A A H X S+ 0 0 0 -4,-1.3 4,-2.0 -3,-0.3 -1,-0.2 0.874 108.5 47.3 -65.0 -40.5 32.2 -13.4 4.3 99 99 A L H X S+ 0 0 0 -4,-1.8 4,-2.0 -3,-0.2 -2,-0.2 0.886 110.4 52.5 -70.9 -36.0 29.6 -10.6 5.2 100 100 A I H X S+ 0 0 7 -4,-2.4 4,-2.8 -5,-0.3 5,-0.2 0.952 106.7 53.1 -64.2 -41.5 30.6 -10.9 8.9 101 101 A N H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.954 109.2 49.4 -55.8 -49.1 34.3 -10.4 7.9 102 102 A M H X S+ 0 0 3 -4,-2.0 4,-3.2 1,-0.2 5,-0.4 0.897 111.9 48.8 -53.2 -47.5 33.5 -7.2 6.0 103 103 A V H X S+ 0 0 9 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.928 109.3 51.4 -63.3 -41.9 31.5 -5.9 8.9 104 104 A F H < S+ 0 0 34 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.933 117.9 39.7 -60.8 -42.1 34.2 -6.6 11.4 105 105 A Q H < S+ 0 0 59 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.907 132.6 18.8 -72.8 -47.9 36.8 -4.8 9.1 106 106 A M H X S- 0 0 52 -4,-3.2 4,-0.6 -5,-0.2 -3,-0.2 0.546 102.1-114.7-113.4 2.0 34.8 -1.9 8.0 107 107 A G H X - 0 0 31 -4,-2.3 4,-2.2 -5,-0.4 5,-0.2 0.143 34.1 -81.5 79.4 153.6 31.8 -1.4 10.3 108 108 A E H > S+ 0 0 57 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.884 127.0 51.5 -53.9 -49.5 28.1 -1.7 9.6 109 109 A T H > S+ 0 0 119 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.958 108.9 50.0 -58.9 -51.9 27.8 1.7 8.1 110 110 A G H < S+ 0 0 33 -4,-0.6 3,-0.4 2,-0.2 4,-0.3 0.909 113.9 43.8 -55.1 -46.3 30.6 1.1 5.7 111 111 A V H >< S+ 0 0 0 -4,-2.2 3,-2.8 1,-0.2 -2,-0.2 0.942 107.0 60.1 -69.9 -39.9 29.3 -2.2 4.5 112 112 A A H 3< S+ 0 0 19 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.803 94.6 66.2 -57.1 -27.1 25.8 -0.9 4.3 113 113 A G T 3< S+ 0 0 54 -4,-1.5 2,-1.6 -3,-0.4 -1,-0.3 0.646 76.3 87.2 -67.1 -17.3 27.1 1.7 1.8 114 114 A F <> + 0 0 39 -3,-2.8 4,-2.3 -4,-0.3 3,-0.4 -0.217 57.3 158.4 -78.7 52.5 27.9 -1.2 -0.7 115 115 A T H > + 0 0 92 -2,-1.6 4,-1.7 1,-0.3 -1,-0.2 0.814 65.1 42.0 -41.6 -58.6 24.3 -0.8 -2.0 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-2.2 1,-0.2 -1,-0.3 0.878 114.5 49.5 -65.3 -45.3 24.7 -2.4 -5.4 117 117 A S H > S+ 0 0 1 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.843 109.1 53.4 -57.8 -46.8 26.9 -5.3 -4.3 118 118 A L H X S+ 0 0 14 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.892 108.6 50.8 -55.5 -43.8 24.4 -6.1 -1.5 119 119 A R H X S+ 0 0 116 -4,-1.7 4,-2.1 -5,-0.2 -2,-0.2 0.946 111.1 48.6 -60.1 -45.2 21.5 -6.2 -4.1 120 120 A M H <>S+ 0 0 26 -4,-2.2 5,-2.2 1,-0.2 4,-0.4 0.920 110.8 48.9 -64.1 -42.4 23.6 -8.6 -6.3 121 121 A L H ><5S+ 0 0 1 -4,-2.2 3,-2.0 1,-0.2 -1,-0.2 0.952 109.6 52.7 -64.7 -43.5 24.4 -10.9 -3.4 122 122 A Q H 3<5S+ 0 0 87 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.902 110.1 49.6 -55.3 -37.3 20.7 -11.0 -2.4 123 123 A Q T 3<5S- 0 0 89 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.467 113.6-122.3 -80.7 -3.9 19.9 -11.9 -5.9 124 124 A K T < 5 + 0 0 99 -3,-2.0 2,-1.2 -4,-0.4 -3,-0.2 0.731 61.4 147.2 63.8 33.6 22.5 -14.7 -5.9 125 125 A R >< + 0 0 118 -5,-2.2 4,-2.6 1,-0.2 5,-0.2 -0.705 20.2 173.9 -94.9 76.6 24.4 -13.2 -8.9 126 126 A W H > + 0 0 50 -2,-1.2 4,-1.6 1,-0.2 -1,-0.2 0.882 69.3 45.1 -57.1 -49.2 27.8 -14.3 -7.5 127 127 A D H > S+ 0 0 106 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.904 115.4 47.8 -65.2 -41.8 30.1 -13.4 -10.4 128 128 A E H > S+ 0 0 94 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.873 110.3 49.8 -69.3 -44.6 28.5 -10.0 -10.9 129 129 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.831 108.5 54.4 -60.8 -35.7 28.7 -9.1 -7.3 130 130 A A H X S+ 0 0 11 -4,-1.6 4,-1.0 -5,-0.2 -2,-0.2 0.923 108.7 48.4 -63.6 -44.0 32.4 -10.1 -7.1 131 131 A V H < S+ 0 0 89 -4,-1.8 4,-0.5 1,-0.2 3,-0.5 0.930 113.8 47.2 -59.9 -44.9 33.2 -7.8 -10.0 132 132 A N H >< S+ 0 0 42 -4,-2.0 3,-1.1 1,-0.2 -2,-0.2 0.882 107.4 55.4 -66.0 -39.8 31.3 -5.0 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.6 6,-0.4 1,-0.2 -1,-0.2 0.805 100.3 60.5 -64.0 -28.5 32.9 -5.5 -4.9 134 134 A A T 3< S+ 0 0 27 -4,-1.0 2,-1.6 -3,-0.5 -1,-0.2 0.662 85.8 79.1 -76.2 -15.0 36.4 -5.1 -6.4 135 135 A K S < S+ 0 0 156 -3,-1.1 2,-0.3 -4,-0.5 -1,-0.2 -0.566 80.7 99.6 -88.0 63.9 35.5 -1.5 -7.6 136 136 A S S > S- 0 0 18 -2,-1.6 4,-2.0 1,-0.1 5,-0.2 -0.992 85.2-119.2-148.4 156.3 36.1 -0.1 -4.1 137 137 A R H > S+ 0 0 143 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.924 115.2 63.7 -58.3 -41.6 38.7 1.7 -2.1 138 138 A W H > S+ 0 0 17 1,-0.2 4,-2.1 2,-0.2 8,-0.2 0.912 105.0 42.2 -43.4 -57.3 38.6 -1.5 0.2 139 139 A Y H 4 S+ 0 0 58 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.923 115.6 49.6 -63.8 -45.3 39.8 -3.7 -2.6 140 140 A N H < S+ 0 0 109 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.884 115.1 43.8 -65.2 -32.5 42.5 -1.2 -3.7 141 141 A Q H < S+ 0 0 106 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.856 131.4 18.0 -79.4 -43.0 43.8 -0.7 -0.2 142 142 A T S X S+ 0 0 19 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 -0.574 73.9 164.0-130.2 68.9 43.9 -4.3 1.1 143 143 A P H > + 0 0 47 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.839 69.1 51.3 -59.2 -41.7 43.8 -6.4 -2.1 144 144 A N H > S+ 0 0 112 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.931 115.9 41.3 -67.4 -46.5 44.9 -9.8 -0.8 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.915 115.3 50.5 -59.2 -52.7 42.4 -9.9 2.0 146 146 A A H X S+ 0 0 0 -4,-2.2 4,-3.1 1,-0.2 5,-0.2 0.951 109.5 52.3 -54.2 -45.8 39.6 -8.4 -0.2 147 147 A K H X S+ 0 0 93 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.873 107.6 52.6 -58.6 -38.4 40.3 -11.1 -2.8 148 148 A R H X S+ 0 0 52 -4,-1.6 4,-1.5 -5,-0.2 -1,-0.2 0.945 114.2 41.1 -62.2 -46.7 40.0 -13.8 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.910 114.1 52.9 -66.8 -41.0 36.6 -12.4 1.0 150 150 A I H X S+ 0 0 13 -4,-3.1 4,-2.7 -5,-0.3 -1,-0.2 0.910 108.0 49.9 -60.3 -45.9 35.4 -11.9 -2.6 151 151 A T H X S+ 0 0 32 -4,-2.3 4,-3.0 -5,-0.2 5,-0.4 0.848 106.8 57.2 -59.5 -42.5 36.3 -15.4 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.934 111.3 40.8 -53.8 -45.6 34.3 -16.6 -0.6 153 153 A F H < S+ 0 0 2 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.884 115.6 53.1 -72.7 -35.8 31.2 -14.8 -1.8 154 154 A R H < S+ 0 0 100 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.950 124.8 20.8 -62.4 -48.4 31.9 -15.9 -5.4 155 155 A T H < S- 0 0 45 -4,-3.0 -2,-0.2 2,-0.2 -3,-0.2 0.674 84.7-135.4 -96.2 -28.1 32.3 -19.7 -4.6 156 156 A G S < S+ 0 0 17 -4,-2.4 2,-0.2 -5,-0.4 -62,-0.2 0.771 74.3 98.9 74.2 19.1 30.5 -20.3 -1.4 157 157 A T S S- 0 0 49 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.798 81.2-116.4-130.9 176.0 33.5 -22.4 -0.3 158 158 A W S > S+ 0 0 28 -2,-0.2 3,-1.9 1,-0.2 4,-0.5 0.245 71.4 121.4-103.2 22.6 36.6 -21.9 1.9 159 159 A D G > + 0 0 99 1,-0.3 3,-1.3 2,-0.2 4,-0.3 0.779 65.4 59.8 -52.5 -41.0 39.1 -22.4 -0.8 160 160 A A G 3 S+ 0 0 13 -3,-0.3 -1,-0.3 1,-0.3 4,-0.2 0.695 112.4 41.3 -65.0 -17.2 40.8 -19.0 -0.5 161 161 A Y G < S+ 0 0 1 -3,-1.9 -1,-0.3 2,-0.1 -2,-0.2 0.422 94.4 80.1-106.0 -4.5 41.6 -19.8 3.1 162 162 A K S < S+ 0 0 136 -3,-1.3 -2,-0.1 -4,-0.5 -3,-0.1 0.426 93.2 53.3 -91.0 2.3 42.7 -23.5 2.6 163 163 A N 0 0 128 -4,-0.3 -1,-0.2 -3,-0.0 -2,-0.1 0.851 360.0 360.0 -79.2 -57.4 45.9 -22.4 1.4 164 164 A L 0 0 118 -4,-0.2 -2,-0.2 0, 0.0 -3,-0.1 0.535 360.0 360.0 -69.2 360.0 46.7 -20.1 4.4