==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-OCT-00 1G0L . COMPND 2 MOLECULE: PROTEIN (LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.XU,W.A.BAASE,M.L.QUILLIN,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8778.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 73.8 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 . 9 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 53.7 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 1 0 3 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 77 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 156.3 43.5 -1.8 9.1 2 2 A N > - 0 0 70 156,-0.0 4,-3.0 95,-0.0 5,-0.2 -0.932 360.0 -82.5-155.8 174.6 40.4 -0.7 10.8 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.836 124.2 50.8 -55.8 -37.6 38.2 2.4 11.3 4 4 A F H > S+ 0 0 75 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.932 113.5 42.6 -69.8 -44.3 40.3 3.7 14.1 5 5 A E H > S+ 0 0 102 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.894 113.7 55.0 -67.3 -37.2 43.6 3.4 12.3 6 6 A M H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.961 112.3 40.4 -59.8 -53.2 41.9 4.8 9.2 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.4 0.844 109.2 60.2 -66.6 -32.4 40.7 8.0 10.9 8 8 A R H X S+ 0 0 105 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.901 108.1 46.9 -63.0 -35.6 43.9 8.3 12.9 9 9 A I H < S+ 0 0 53 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.957 116.3 42.9 -68.6 -47.7 45.6 8.6 9.5 10 10 A D H < S+ 0 0 21 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.838 125.7 30.5 -68.7 -35.4 43.1 11.1 8.1 11 11 A E H < S- 0 0 45 -4,-2.8 19,-0.3 -5,-0.2 -1,-0.2 0.696 91.0-153.5 -99.4 -24.4 42.8 13.4 11.1 12 12 A G < - 0 0 23 -4,-1.7 2,-0.4 -5,-0.4 -1,-0.2 -0.243 25.8 -87.7 76.2-171.6 46.2 13.1 12.8 13 13 A L + 0 0 38 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.951 42.1 173.6-141.7 121.8 46.7 13.7 16.6 14 14 A R E -A 28 0A 150 14,-1.8 14,-2.1 -2,-0.4 4,-0.1 -0.997 18.6-161.8-130.6 133.7 47.2 17.0 18.2 15 15 A L E S+ 0 0 64 -2,-0.4 43,-2.3 12,-0.2 2,-0.3 0.432 74.7 60.6 -93.7 -2.2 47.3 17.6 22.0 16 16 A K E S-C 57 0B 87 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.918 101.6 -85.2-123.4 149.8 46.8 21.4 21.9 17 17 A I E + 0 0 14 39,-1.7 2,-0.3 -2,-0.3 10,-0.2 -0.229 58.7 166.7 -51.6 136.0 43.8 23.2 20.5 18 18 A Y E -A 26 0A 26 8,-3.0 8,-3.5 -4,-0.1 2,-0.4 -0.874 36.7-100.9-143.5 177.1 44.2 23.9 16.8 19 19 A K E -A 25 0A 125 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.884 33.0-139.7-106.8 133.5 42.2 24.9 13.8 20 20 A D > - 0 0 50 4,-2.6 3,-1.8 -2,-0.4 -1,-0.1 -0.035 42.6 -78.4 -76.7-170.2 40.9 22.4 11.4 21 21 A T T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.721 134.4 49.1 -63.1 -24.7 40.7 22.7 7.6 22 22 A E T 3 S- 0 0 76 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.399 122.8-104.5 -91.6 -3.8 37.6 24.9 7.9 23 23 A G S < S+ 0 0 38 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.591 74.3 141.9 88.9 16.1 39.3 27.2 10.5 24 24 A Y - 0 0 74 1,-0.1 -4,-2.6 9,-0.0 -1,-0.3 -0.730 59.8-103.2 -94.5 143.7 37.3 25.6 13.5 25 25 A Y E +AB 19 34A 35 9,-0.7 8,-2.6 11,-0.4 9,-1.3 -0.409 54.7 160.3 -63.5 130.9 38.8 25.0 16.9 26 26 A T E -AB 18 32A 3 -8,-3.5 -8,-3.0 6,-0.2 2,-0.3 -0.876 19.8-165.4-144.5 169.0 39.5 21.3 17.3 27 27 A I E > + B 0 31A 0 4,-1.7 4,-2.0 -2,-0.3 2,-0.2 -0.983 50.7 1.8-154.7 161.0 41.6 19.0 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.1 -14,-1.8 -2,-0.3 2,-1.1 -0.414 122.3 -4.7 70.2-132.6 42.9 15.5 19.6 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.653 128.1 -53.5 -98.2 73.4 42.0 13.2 16.7 30 30 A G T 4 S+ 0 0 15 -2,-1.1 2,-0.9 -19,-0.3 -2,-0.2 0.755 83.5 160.9 70.3 20.3 39.7 15.5 14.8 31 31 A H E < -B 27 0A 33 -4,-2.0 -4,-1.7 1,-0.0 -1,-0.2 -0.653 33.3-142.0 -80.6 105.4 37.4 16.3 17.8 32 32 A L E -B 26 0A 76 -2,-0.9 -6,-0.2 -6,-0.2 3,-0.1 -0.426 21.1-178.9 -66.5 130.9 35.5 19.5 16.8 33 33 A L E - 0 0 15 -8,-2.6 2,-0.3 1,-0.4 -7,-0.2 0.875 58.6 -22.5 -97.4 -46.7 35.1 21.8 19.8 34 34 A T E -B 25 0A 27 -9,-1.3 -9,-0.7 2,-0.1 -1,-0.4 -0.977 34.5-140.7-164.3 151.7 33.2 24.7 18.4 35 35 A K S S+ 0 0 144 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.500 74.4 112.1 -91.2 -7.6 32.4 26.6 15.2 36 36 A S S S- 0 0 41 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.367 72.3-132.5 -71.0 146.3 32.7 29.8 17.2 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.480 76.5 100.6 -76.1 -2.8 35.5 32.1 16.5 38 38 A S > - 0 0 48 1,-0.2 4,-1.7 -13,-0.0 5,-0.1 -0.773 58.7-157.3 -96.6 126.0 36.4 32.5 20.1 39 39 A L H > S+ 0 0 64 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.819 97.4 56.5 -62.1 -32.1 39.3 30.7 21.7 40 40 A N H > S+ 0 0 120 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.944 103.7 50.0 -67.3 -45.4 37.6 31.1 25.1 41 41 A A H > S+ 0 0 34 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.885 112.5 50.7 -56.8 -37.9 34.5 29.4 24.0 42 42 A A H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.906 109.4 48.8 -66.6 -43.4 36.7 26.6 22.6 43 43 A K H X S+ 0 0 60 -4,-2.7 4,-2.4 1,-0.2 11,-0.2 0.915 111.2 51.8 -65.1 -36.6 38.6 26.3 25.9 44 44 A S H X S+ 0 0 72 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.929 109.6 46.8 -65.8 -42.5 35.3 26.2 27.7 45 45 A E H X S+ 0 0 67 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.902 111.2 54.6 -66.7 -37.1 33.9 23.4 25.5 46 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.4 0.947 108.4 47.0 -59.3 -48.9 37.2 21.5 26.0 47 47 A D H X>S+ 0 0 33 -4,-2.4 4,-3.0 1,-0.2 5,-1.2 0.935 112.7 49.6 -59.3 -44.0 37.1 21.6 29.8 48 48 A K H <5S+ 0 0 140 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.861 111.8 49.4 -63.7 -35.1 33.5 20.5 29.7 49 49 A A H <5S+ 0 0 43 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.898 120.6 34.5 -72.6 -36.1 34.4 17.6 27.4 50 50 A I H <5S- 0 0 34 -4,-2.4 -2,-0.2 2,-0.2 -3,-0.2 0.726 102.9-126.0 -90.1 -29.7 37.3 16.4 29.5 51 51 A G T <5S+ 0 0 65 -4,-3.0 2,-0.3 -5,-0.4 -3,-0.2 0.849 75.9 72.8 85.3 33.4 35.9 17.2 32.9 52 52 A R S - 0 0 1 -2,-0.9 3,-1.2 -11,-0.2 -1,-0.2 0.701 32.2-140.2 -91.6 -28.4 42.6 22.0 30.9 55 55 A N T 3 S- 0 0 122 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.797 71.6 -66.7 71.9 21.4 44.4 25.1 29.9 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.2 2,-0.4 0.530 115.7 101.5 72.4 6.7 43.8 24.0 26.1 57 57 A V B < -C 16 0B 60 -3,-1.2 2,-0.3 -41,-0.2 -41,-0.2 -0.984 47.1-179.2-125.0 138.0 46.1 21.0 26.5 58 58 A I - 0 0 3 -43,-2.3 2,-0.2 -2,-0.4 -30,-0.1 -0.791 25.1-110.7-127.8 168.6 45.2 17.4 26.9 59 59 A T > - 0 0 67 -2,-0.3 4,-2.4 1,-0.1 5,-0.1 -0.530 31.6-107.8 -94.4 172.6 47.0 14.1 27.3 60 60 A K H > S+ 0 0 110 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.898 120.6 52.7 -62.2 -42.1 47.1 11.2 24.8 61 61 A D H > S+ 0 0 123 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.901 109.7 48.5 -60.3 -42.8 44.8 9.1 26.9 62 62 A E H > S+ 0 0 38 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.902 110.1 52.3 -66.3 -41.5 42.3 11.9 27.0 63 63 A A H X S+ 0 0 1 -4,-2.4 4,-2.1 1,-0.2 -34,-0.4 0.915 110.1 48.2 -60.1 -43.0 42.6 12.3 23.2 64 64 A E H X S+ 0 0 82 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.832 108.0 55.4 -67.1 -30.6 41.9 8.7 22.7 65 65 A K H X S+ 0 0 138 -4,-1.7 4,-2.2 -5,-0.2 -2,-0.2 0.942 108.7 45.6 -69.4 -43.9 39.0 8.7 24.9 66 66 A L H X S+ 0 0 5 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.912 112.5 54.8 -62.4 -38.2 37.3 11.5 23.0 67 67 A F H X S+ 0 0 13 -4,-2.1 4,-2.6 -5,-0.2 5,-0.3 0.958 106.9 48.5 -60.1 -50.4 38.2 9.5 19.8 68 68 A N H X S+ 0 0 92 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.927 112.9 48.5 -55.9 -43.5 36.5 6.4 21.0 69 69 A Q H X S+ 0 0 96 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.929 110.9 51.4 -63.3 -41.6 33.4 8.4 22.0 70 70 A D H X S+ 0 0 33 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.873 109.7 47.3 -65.8 -38.0 33.4 10.1 18.6 71 71 A V H X S+ 0 0 8 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.944 112.1 51.5 -67.6 -43.7 33.6 6.9 16.6 72 72 A D H X S+ 0 0 100 -4,-2.2 4,-2.8 -5,-0.3 5,-0.2 0.940 110.3 48.7 -55.1 -48.2 30.9 5.4 18.7 73 73 A A H X S+ 0 0 61 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.873 108.2 54.6 -62.5 -36.8 28.7 8.4 18.1 74 74 A A H X S+ 0 0 9 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.937 110.1 46.1 -62.3 -46.8 29.3 8.3 14.4 75 75 A V H X S+ 0 0 31 -4,-2.6 4,-2.4 1,-0.2 3,-0.2 0.962 113.1 49.2 -61.0 -48.2 28.2 4.7 14.2 76 76 A R H X S+ 0 0 122 -4,-2.8 4,-1.4 1,-0.2 -1,-0.2 0.892 107.8 54.8 -62.6 -33.4 25.1 5.4 16.3 77 77 A G H X S+ 0 0 12 -4,-2.4 4,-0.6 -5,-0.2 -1,-0.2 0.900 108.4 48.9 -65.6 -39.5 24.2 8.4 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-1.2 -3,-0.2 7,-0.4 0.953 110.8 49.7 -63.8 -47.9 24.3 6.2 11.1 79 79 A L H 3< S+ 0 0 55 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.720 112.7 47.3 -68.3 -18.2 22.1 3.5 12.6 80 80 A R H 3< S+ 0 0 140 -4,-1.4 2,-0.6 -5,-0.2 -1,-0.3 0.512 92.2 95.4 -96.0 -9.3 19.6 6.0 13.7 81 81 A N S+ 0 0 127 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.806 119.9 40.8 -86.8 -32.3 18.7 7.5 5.1 84 84 A L H > S+ 0 0 0 -7,-0.2 4,-2.5 -6,-0.2 3,-0.3 0.848 100.9 68.5 -84.9 -38.5 22.0 6.1 6.2 85 85 A K H X S+ 0 0 86 -4,-2.9 4,-2.7 -7,-0.4 5,-0.2 0.901 98.2 49.4 -49.5 -51.8 21.0 3.0 7.9 86 86 A P H > S+ 0 0 51 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.882 112.5 49.3 -62.1 -31.9 19.9 1.1 4.9 87 87 A V H X S+ 0 0 2 -4,-0.5 4,-1.0 -3,-0.3 3,-0.3 0.964 111.0 48.5 -68.3 -51.3 23.1 2.0 3.0 88 88 A Y H >< S+ 0 0 34 -4,-2.5 3,-1.0 1,-0.2 -1,-0.2 0.925 109.8 52.7 -53.9 -45.6 25.3 0.9 5.8 89 89 A D H 3< S+ 0 0 75 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.851 107.6 53.1 -63.2 -29.9 23.4 -2.4 6.2 90 90 A S H 3< S+ 0 0 37 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.681 96.4 87.4 -78.9 -16.5 23.9 -3.1 2.5 91 91 A L S << S- 0 0 5 -4,-1.0 2,-0.1 -3,-1.0 31,-0.0 -0.500 76.1-115.8 -87.6 158.1 27.7 -2.6 2.6 92 92 A D > - 0 0 57 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.254 43.9 -93.5 -79.1 171.0 30.6 -5.0 3.3 93 93 A A H > S+ 0 0 78 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.818 121.4 48.6 -60.5 -39.3 32.8 -4.3 6.3 94 94 A V H >> S+ 0 0 29 2,-0.2 4,-1.3 1,-0.2 3,-0.5 0.956 112.7 47.2 -66.4 -48.9 35.5 -2.3 4.6 95 95 A R H 3> S+ 0 0 25 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.826 103.9 62.4 -63.2 -30.2 33.1 -0.0 2.8 96 96 A R H 3X S+ 0 0 76 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.921 99.4 56.6 -60.8 -37.0 31.2 0.5 6.0 97 97 A A H S+ 0 0 68 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.887 128.7 53.8 -63.2 -39.5 25.2 12.7 9.7 109 109 A T H > S+ 0 0 122 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.945 108.8 48.9 -61.3 -47.3 23.3 15.5 8.3 110 110 A G H >< S+ 0 0 32 -4,-0.6 3,-0.8 1,-0.2 4,-0.2 0.931 114.5 43.6 -56.6 -54.4 26.0 16.3 5.7 111 111 A V H >< S+ 0 0 0 -4,-2.4 3,-2.6 1,-0.2 -1,-0.2 0.893 105.2 61.0 -63.0 -42.0 26.3 12.8 4.5 112 112 A A H 3< S+ 0 0 10 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.765 95.6 68.2 -57.7 -20.5 22.6 12.1 4.4 113 113 A G T << S+ 0 0 52 -4,-0.9 2,-2.0 -3,-0.8 -1,-0.3 0.659 73.9 85.5 -73.0 -17.2 22.6 14.9 1.9 114 114 A F <> + 0 0 41 -3,-2.6 4,-2.7 1,-0.2 5,-0.3 -0.286 57.0 159.8 -83.3 56.5 24.6 12.9 -0.7 115 115 A T H > + 0 0 91 -2,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.852 65.9 43.6 -46.8 -54.5 21.3 11.4 -2.0 116 116 A N H > S+ 0 0 83 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.893 113.9 49.8 -62.9 -43.2 22.4 10.2 -5.4 117 117 A S H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.920 108.8 54.0 -62.6 -42.9 25.7 8.8 -4.2 118 118 A L H X S+ 0 0 12 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.904 107.5 49.9 -58.4 -43.5 24.0 6.8 -1.4 119 119 A R H X S+ 0 0 123 -4,-1.7 4,-2.0 -5,-0.3 -1,-0.2 0.930 111.1 49.9 -64.8 -39.3 21.6 5.3 -3.9 120 120 A M H X>S+ 0 0 28 -4,-2.1 5,-2.4 2,-0.2 4,-0.6 0.891 110.5 49.0 -68.1 -37.9 24.4 4.3 -6.1 121 121 A L H ><5S+ 0 0 1 -4,-2.6 3,-1.3 1,-0.2 -1,-0.2 0.934 109.3 52.8 -65.9 -41.3 26.3 2.7 -3.2 122 122 A Q H 3<5S+ 0 0 92 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.894 109.9 48.8 -58.6 -35.8 23.3 0.9 -2.2 123 123 A Q H 3<5S- 0 0 86 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.540 113.3-121.5 -80.8 -8.1 23.0 -0.5 -5.7 124 124 A K T <<5 + 0 0 100 -3,-1.3 2,-1.2 -4,-0.6 -3,-0.2 0.800 62.4 146.7 69.2 34.3 26.7 -1.5 -5.7 125 125 A R >< + 0 0 116 -5,-2.4 4,-2.9 1,-0.2 5,-0.2 -0.644 20.6 173.3 -99.3 72.4 27.5 0.7 -8.7 126 126 A W H > + 0 0 52 -2,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.882 69.1 44.2 -50.6 -53.8 31.0 1.5 -7.4 127 127 A D H > S+ 0 0 102 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.922 116.1 48.1 -64.3 -41.5 32.5 3.4 -10.3 128 128 A E H > S+ 0 0 113 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.905 111.6 49.0 -67.5 -39.6 29.4 5.4 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.9 4,-3.3 1,-0.2 5,-0.2 0.900 108.7 55.6 -64.3 -37.6 29.2 6.3 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.4 4,-1.4 -5,-0.2 -2,-0.2 0.926 108.6 46.4 -61.5 -42.6 32.9 7.3 -7.1 131 131 A V H X S+ 0 0 92 -4,-1.9 4,-0.7 1,-0.2 -1,-0.2 0.930 114.6 47.5 -65.8 -43.2 32.4 9.8 -9.9 132 132 A N H >< S+ 0 0 37 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.916 107.5 55.2 -66.2 -40.4 29.3 11.2 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-3.3 6,-0.4 1,-0.2 -1,-0.2 0.868 102.9 58.5 -60.9 -31.3 31.0 11.5 -4.8 134 134 A A H 3< S+ 0 0 27 -4,-1.4 2,-1.8 -5,-0.2 -1,-0.2 0.695 85.5 80.1 -71.7 -19.4 33.8 13.6 -6.4 135 135 A K S << S+ 0 0 161 -3,-1.2 2,-0.3 -4,-0.7 -1,-0.2 -0.527 81.5 95.8 -86.8 70.8 31.3 16.2 -7.6 136 136 A S S > S- 0 0 18 -2,-1.8 4,-2.1 1,-0.1 5,-0.2 -0.997 85.6-115.6-155.1 158.4 31.1 17.9 -4.3 137 137 A R H > S+ 0 0 150 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.905 115.4 63.1 -61.7 -37.6 32.5 20.6 -2.2 138 138 A W H > S+ 0 0 19 1,-0.2 4,-2.7 2,-0.2 8,-0.2 0.945 105.9 43.3 -50.2 -51.3 33.9 17.9 0.1 139 139 A Y H 4 S+ 0 0 56 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.916 115.2 49.0 -65.6 -42.2 36.1 16.6 -2.7 140 140 A N H < S+ 0 0 108 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.840 116.1 41.5 -68.9 -31.6 37.2 20.0 -3.9 141 141 A Q H < S+ 0 0 103 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.883 131.6 21.7 -83.7 -42.4 38.1 21.3 -0.4 142 142 A T S X S+ 0 0 20 -4,-2.7 4,-2.6 -5,-0.3 5,-0.2 -0.532 73.7 160.6-125.9 72.4 39.9 18.1 0.9 143 143 A P H > + 0 0 50 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.852 69.1 51.5 -61.5 -40.7 40.9 16.2 -2.2 144 144 A N H > S+ 0 0 114 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.935 116.2 40.7 -68.5 -39.8 43.6 13.9 -0.8 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.931 115.4 50.8 -70.7 -44.8 41.4 12.6 1.9 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 5,-0.3 0.918 107.8 53.8 -58.4 -43.2 38.3 12.4 -0.3 147 147 A K H X S+ 0 0 99 -4,-2.6 4,-2.4 -5,-0.2 -1,-0.2 0.902 108.8 50.4 -57.1 -40.8 40.3 10.5 -2.9 148 148 A R H X S+ 0 0 54 -4,-1.5 4,-1.6 -5,-0.2 -2,-0.2 0.962 113.8 42.7 -63.9 -49.0 41.3 8.0 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.918 114.3 50.9 -64.2 -44.0 37.7 7.4 1.0 150 150 A I H X S+ 0 0 14 -4,-3.2 4,-2.4 -5,-0.2 -1,-0.2 0.897 106.9 54.7 -61.7 -39.7 36.3 7.3 -2.5 151 151 A T H X S+ 0 0 40 -4,-2.4 4,-2.5 -5,-0.3 6,-0.4 0.857 105.6 53.0 -63.4 -32.9 39.0 4.7 -3.5 152 152 A V H X S+ 0 0 0 -4,-1.6 4,-2.7 2,-0.2 -1,-0.2 0.917 110.2 47.5 -68.2 -40.0 37.8 2.5 -0.6 153 153 A F H < S+ 0 0 1 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.890 114.3 48.0 -67.1 -36.5 34.2 2.7 -1.8 154 154 A R H < S+ 0 0 109 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.915 126.6 22.6 -69.4 -43.6 35.3 1.9 -5.3 155 155 A T H < S- 0 0 47 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.632 84.6-135.2-102.4 -20.8 37.5 -1.1 -4.5 156 156 A G S < S+ 0 0 16 -4,-2.7 2,-0.3 -5,-0.3 -62,-0.2 0.728 72.6 99.6 71.3 20.2 36.4 -2.5 -1.2 157 157 A T S S- 0 0 47 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.2 -0.840 77.8-122.2-131.5 174.3 40.0 -2.8 -0.1 158 158 A W S >> S+ 0 0 42 -2,-0.3 3,-1.9 1,-0.2 4,-0.7 0.170 71.9 118.2-100.3 15.2 42.3 -0.7 2.2 159 159 A D G >4 + 0 0 92 1,-0.3 3,-1.2 2,-0.2 -1,-0.2 0.854 67.0 62.5 -52.8 -35.8 45.0 -0.2 -0.4 160 160 A A G 34 S+ 0 0 24 -3,-0.3 -1,-0.3 1,-0.3 4,-0.1 0.712 108.2 43.2 -63.0 -21.8 44.6 3.6 -0.4 161 161 A Y G <4 S+ 0 0 2 -3,-1.9 2,-0.6 -13,-0.1 3,-0.3 0.452 88.7 101.3-103.6 -6.0 45.6 3.6 3.2 162 162 A K S << S+ 0 0 100 -3,-1.2 0, 0.0 -4,-0.7 0, 0.0 -0.796 82.6 32.6 -88.3 121.0 48.5 1.2 3.0 163 163 A N 0 0 175 -2,-0.6 -1,-0.2 0, 0.0 -2,-0.1 -0.397 360.0 360.0 128.7 -42.6 51.8 3.2 2.8 164 164 A L 0 0 112 -3,-0.3 -2,-0.2 -4,-0.1 -3,-0.1 0.873 360.0 360.0 -78.2 360.0 50.6 6.0 5.1