==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (O-GLYCOSYL) 13-JUN-95 192L . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR X.-J.ZHANG,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8378.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 71.0 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 . 12 7.4 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 . 6 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 51.9 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 1 0 2 1 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 79 0, 0.0 2,-0.2 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 146.3 43.8 -2.0 8.5 2 2 A N > - 0 0 67 156,-0.0 4,-2.3 95,-0.0 5,-0.2 -0.870 360.0 -87.0-146.4 175.2 40.7 -0.9 10.3 3 3 A I H > S+ 0 0 27 -2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.831 123.6 52.6 -57.7 -35.7 38.4 2.2 10.8 4 4 A F H > S+ 0 0 78 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.908 113.1 41.3 -69.8 -42.4 40.6 3.5 13.7 5 5 A E H > S+ 0 0 105 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.848 113.3 56.0 -72.7 -32.7 43.8 3.3 11.8 6 6 A M H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.920 110.6 42.8 -65.1 -44.5 42.1 4.7 8.7 7 7 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.4 0.833 107.8 58.8 -73.7 -33.1 40.8 7.8 10.6 8 8 A R H X S+ 0 0 99 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.865 109.3 46.9 -66.3 -30.4 44.2 8.4 12.4 9 9 A I H < S+ 0 0 89 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.873 116.6 43.6 -75.8 -38.4 45.8 8.7 8.9 10 10 A D H < S+ 0 0 18 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.822 126.1 28.8 -76.7 -31.4 43.1 11.0 7.6 11 11 A E H < S- 0 0 35 -4,-2.5 19,-0.4 1,-0.1 -3,-0.2 0.649 91.1-154.7-101.9 -26.0 42.8 13.3 10.6 12 12 A G < - 0 0 24 -4,-1.2 2,-0.4 -5,-0.4 -1,-0.1 -0.152 28.7 -79.8 72.5-175.0 46.2 13.2 12.1 13 13 A L + 0 0 42 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.957 45.9 177.2-131.8 108.8 46.8 14.0 15.9 14 14 A R E -A 28 0A 133 14,-2.0 14,-2.0 -2,-0.4 4,-0.1 -0.953 15.3-168.2-116.4 127.0 47.0 17.6 17.1 15 15 A L E S+ 0 0 69 -2,-0.4 43,-2.4 12,-0.2 2,-0.4 0.445 71.4 59.5 -95.4 4.7 47.5 18.5 20.8 16 16 A K E S-C 57 0B 101 41,-0.2 41,-0.2 12,-0.1 10,-0.1 -0.965 98.3 -89.7-133.6 143.8 46.7 22.1 20.6 17 17 A I E + 0 0 17 39,-1.7 2,-0.3 -2,-0.4 10,-0.2 -0.187 56.1 169.5 -50.1 144.5 43.5 23.8 19.4 18 18 A Y E -A 26 0A 32 8,-2.4 8,-2.9 -4,-0.1 2,-0.5 -0.921 35.0-104.6-150.3 172.5 43.5 24.5 15.7 19 19 A K E -A 25 0A 111 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.917 33.2-141.7-107.7 127.2 41.3 25.6 12.8 20 20 A D > - 0 0 46 4,-3.0 3,-2.4 -2,-0.5 -1,-0.0 -0.033 41.4 -78.5 -71.7-172.7 40.2 23.0 10.2 21 21 A T T 3 S+ 0 0 84 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.660 136.2 46.2 -61.0 -21.8 39.8 23.4 6.5 22 22 A E T 3 S- 0 0 70 2,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.128 123.4-107.3-105.4 11.8 36.6 25.3 7.0 23 23 A G S < S+ 0 0 31 -3,-2.4 2,-0.2 1,-0.2 -2,-0.1 0.502 71.3 142.9 75.4 9.2 38.2 27.4 9.7 24 24 A Y - 0 0 76 -5,-0.1 -4,-3.0 1,-0.1 2,-0.4 -0.541 59.4 -98.1 -83.9 155.9 36.4 25.8 12.7 25 25 A Y E +AB 19 34A 30 9,-0.9 8,-3.0 11,-0.4 9,-1.4 -0.530 53.9 164.7 -74.7 121.3 38.0 25.1 16.0 26 26 A T E -AB 18 32A 4 -8,-2.9 -8,-2.4 -2,-0.4 2,-0.3 -0.805 13.8-177.9-129.7 166.3 39.2 21.5 16.3 27 27 A I E > + B 0 31A 0 4,-1.5 4,-2.2 -2,-0.2 -12,-0.2 -0.988 49.7 5.4-160.5 162.0 41.5 19.4 18.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.0 -14,-2.0 -2,-0.3 2,-0.9 -0.361 123.0 -5.9 65.9-132.9 42.9 15.8 18.9 29 29 A I T 4 S- 0 0 3 34,-0.5 -1,-0.2 -16,-0.2 -17,-0.1 -0.621 128.8 -51.4 -99.0 72.5 41.9 13.4 16.2 30 30 A G T 4 S+ 0 0 15 -2,-0.9 2,-0.9 -19,-0.4 -2,-0.2 0.792 85.0 163.0 71.3 27.0 39.5 15.5 14.1 31 31 A H E < -B 27 0A 35 -4,-2.2 -4,-1.5 1,-0.0 2,-0.2 -0.707 32.6-142.1 -85.5 108.3 37.3 16.5 17.1 32 32 A L E -B 26 0A 77 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.414 20.0-178.2 -63.5 123.8 35.2 19.5 16.2 33 33 A L E - 0 0 22 -8,-3.0 2,-0.3 1,-0.3 -7,-0.2 0.900 57.0 -27.2 -90.9 -45.9 35.0 21.8 19.2 34 34 A T E -B 25 0A 30 -9,-1.4 -9,-0.9 2,-0.1 -1,-0.3 -0.987 34.3-136.5-163.5 158.7 32.7 24.6 18.0 35 35 A K S S+ 0 0 137 -2,-0.3 -1,-0.1 -11,-0.1 -3,-0.0 0.441 74.9 108.0-100.7 2.2 31.5 26.5 15.0 36 36 A S S S- 0 0 42 2,-0.1 -11,-0.4 1,-0.1 6,-0.2 -0.551 71.7-135.9 -78.7 139.3 31.8 29.8 16.8 37 37 A P S S+ 0 0 112 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.451 74.2 108.1 -75.5 -0.6 34.6 32.1 15.7 38 38 A S > - 0 0 51 1,-0.1 4,-2.1 2,-0.0 5,-0.1 -0.675 58.4-157.9 -84.9 127.2 35.5 32.8 19.3 39 39 A L H > S+ 0 0 80 -2,-0.5 4,-1.9 1,-0.2 -1,-0.1 0.716 97.1 55.4 -71.2 -21.5 38.6 31.3 20.6 40 40 A A H > S+ 0 0 72 2,-0.2 4,-1.9 3,-0.2 -1,-0.2 0.816 104.5 52.5 -80.7 -29.3 37.2 31.6 24.1 41 41 A A H > S+ 0 0 33 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.974 111.1 47.1 -67.3 -49.8 34.2 29.7 23.1 42 42 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.3 -2,-0.2 0.891 111.5 50.6 -56.0 -45.7 36.4 26.9 21.8 43 43 A K H X S+ 0 0 66 -4,-1.9 4,-1.8 1,-0.2 -1,-0.3 0.898 112.4 48.0 -61.4 -36.9 38.5 26.9 24.9 44 44 A A H X S+ 0 0 63 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.909 110.6 49.2 -67.8 -45.2 35.3 26.7 26.9 45 45 A A H X S+ 0 0 34 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.859 109.2 55.8 -63.0 -35.8 33.9 23.9 24.8 46 46 A L H X S+ 0 0 0 -4,-2.7 4,-1.8 -5,-0.2 5,-0.3 0.931 104.6 49.8 -64.5 -45.5 37.3 22.2 25.3 47 47 A A H X>S+ 0 0 24 -4,-1.8 4,-1.9 1,-0.2 5,-0.9 0.846 111.3 50.4 -62.3 -35.0 37.1 22.3 29.2 48 48 A A H <5S+ 0 0 85 -4,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.878 110.8 48.3 -66.8 -44.9 33.6 20.8 29.2 49 49 A A H <5S+ 0 0 47 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.828 124.0 31.8 -66.4 -32.8 34.6 17.9 26.9 50 50 A I H <5S- 0 0 33 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.626 99.5-132.0 -99.4 -22.3 37.7 17.1 29.0 51 51 A G T <5S+ 0 0 65 -4,-1.9 2,-0.3 -5,-0.3 -3,-0.2 0.784 73.7 96.1 73.1 25.2 36.3 18.1 32.3 52 52 A R S > - 0 0 66 -2,-0.3 4,-1.9 1,-0.1 3,-0.5 -0.544 34.5-109.6 -90.9 159.9 47.4 14.9 26.4 60 60 A K H 3> S+ 0 0 101 1,-0.3 4,-1.4 2,-0.2 5,-0.1 0.882 120.1 54.4 -57.5 -37.8 47.5 12.1 23.9 61 61 A D H 3> S+ 0 0 123 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.876 105.7 52.9 -63.3 -38.4 45.3 10.0 26.2 62 62 A E H <> S+ 0 0 38 -3,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.916 108.5 50.3 -61.5 -42.8 42.7 12.7 26.2 63 63 A A H X S+ 0 0 1 -4,-1.9 4,-1.7 1,-0.2 -34,-0.5 0.747 110.9 49.9 -63.4 -30.3 42.7 12.8 22.4 64 64 A E H X S+ 0 0 75 -4,-1.4 4,-2.3 -5,-0.2 -1,-0.2 0.827 107.7 51.7 -79.4 -35.3 42.3 9.1 22.3 65 65 A K H X S+ 0 0 138 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.897 111.5 47.6 -69.1 -38.5 39.4 9.1 24.7 66 66 A L H X S+ 0 0 5 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.912 110.1 54.1 -67.0 -40.2 37.7 11.7 22.5 67 67 A F H X S+ 0 0 15 -4,-1.7 4,-2.2 1,-0.2 5,-0.3 0.944 106.4 50.9 -58.5 -49.6 38.5 9.6 19.4 68 68 A N H X S+ 0 0 94 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.908 112.0 48.8 -55.0 -43.8 36.8 6.4 20.9 69 69 A Q H X S+ 0 0 99 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.892 111.1 48.4 -63.4 -44.4 33.7 8.5 21.7 70 70 A D H X S+ 0 0 33 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.836 110.4 49.8 -68.5 -33.9 33.4 10.1 18.2 71 71 A V H X S+ 0 0 7 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.936 112.7 48.3 -69.9 -46.7 33.8 6.7 16.3 72 72 A D H X S+ 0 0 88 -4,-1.9 4,-2.9 -5,-0.3 5,-0.3 0.971 111.9 49.5 -54.0 -50.0 31.1 5.2 18.6 73 73 A A H X S+ 0 0 42 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.871 110.0 51.5 -58.0 -37.5 28.8 8.2 17.9 74 74 A A H X S+ 0 0 6 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.903 111.6 45.9 -66.0 -46.1 29.4 7.9 14.2 75 75 A V H X S+ 0 0 37 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.917 115.3 46.5 -63.8 -45.2 28.5 4.2 14.1 76 76 A R H X S+ 0 0 114 -4,-2.9 4,-1.4 -5,-0.2 -2,-0.2 0.847 109.6 55.1 -66.2 -36.3 25.4 4.8 16.3 77 77 A G H X S+ 0 0 1 -4,-2.0 4,-1.3 -5,-0.3 -2,-0.2 0.926 109.0 47.7 -64.9 -40.6 24.3 7.8 14.1 78 78 A I H < S+ 0 0 0 -4,-1.9 7,-0.6 1,-0.2 3,-0.5 0.958 111.8 48.1 -59.7 -53.6 24.5 5.6 11.0 79 79 A L H < S+ 0 0 77 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.728 114.0 48.3 -60.0 -27.2 22.4 2.8 12.5 80 80 A R H < S+ 0 0 165 -4,-1.4 2,-0.4 -3,-0.2 -1,-0.2 0.640 93.0 91.5 -87.2 -28.5 19.8 5.2 13.8 81 81 A N X - 0 0 22 -4,-1.3 4,-2.5 -3,-0.5 3,-0.1 -0.616 66.4-148.5 -81.2 127.8 19.4 7.1 10.6 82 82 A A T 4 S+ 0 0 91 -2,-0.4 -1,-0.1 1,-0.2 -4,-0.0 0.709 98.9 43.5 -67.5 -18.4 16.7 6.0 8.2 83 83 A K T 4 S+ 0 0 120 2,-0.1 4,-0.4 3,-0.1 -1,-0.2 0.803 118.6 40.1 -93.5 -34.4 18.6 7.1 5.2 84 84 A L T >> S+ 0 0 0 -6,-0.2 4,-2.2 -7,-0.2 3,-0.6 0.892 103.5 66.5 -81.4 -45.0 22.1 5.9 6.2 85 85 A K H 3X S+ 0 0 78 -4,-2.5 4,-3.1 -7,-0.6 5,-0.2 0.853 99.1 48.0 -48.4 -52.7 21.1 2.5 7.7 86 86 A P H 3> S+ 0 0 47 0, 0.0 4,-1.6 0, 0.0 -1,-0.3 0.847 112.2 52.1 -61.3 -35.0 19.9 0.7 4.6 87 87 A V H <> S+ 0 0 3 -3,-0.6 4,-0.8 -4,-0.4 3,-0.2 0.964 112.0 44.8 -66.0 -48.9 23.0 1.9 2.8 88 88 A Y H >< S+ 0 0 40 -4,-2.2 3,-1.3 1,-0.2 -1,-0.2 0.937 110.0 56.4 -56.7 -48.6 25.3 0.5 5.5 89 89 A D H 3< S+ 0 0 75 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.837 105.6 51.8 -51.1 -41.0 23.3 -2.7 5.6 90 90 A S H 3< S+ 0 0 39 -4,-1.6 -1,-0.3 -3,-0.2 2,-0.2 0.611 96.9 89.2 -71.2 -20.2 23.9 -3.3 1.9 91 91 A L S << S- 0 0 6 -3,-1.3 31,-0.0 -4,-0.8 30,-0.0 -0.553 73.6-114.5 -93.7 155.1 27.7 -3.0 1.9 92 92 A D > - 0 0 55 -2,-0.2 4,-1.6 1,-0.1 5,-0.2 0.003 45.6 -96.1 -68.4 172.6 30.8 -5.2 2.4 93 93 A A H > S+ 0 0 84 2,-0.2 4,-1.0 1,-0.2 -1,-0.1 0.839 120.1 49.5 -69.9 -30.1 33.0 -4.6 5.4 94 94 A V H > S+ 0 0 26 62,-0.2 4,-1.1 2,-0.2 3,-0.5 0.949 112.4 46.3 -71.0 -49.3 35.6 -2.3 3.7 95 95 A R H > S+ 0 0 26 1,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.787 105.4 61.1 -65.6 -27.0 33.1 -0.0 2.1 96 96 A R H X S+ 0 0 78 -4,-1.6 4,-1.9 1,-0.2 -1,-0.3 0.891 100.7 55.3 -64.0 -39.0 31.2 0.2 5.4 97 97 A A H X S+ 0 0 8 -4,-1.0 4,-1.6 -3,-0.5 -1,-0.2 0.878 104.2 54.2 -59.6 -36.0 34.4 1.7 6.8 98 98 A A H X S+ 0 0 0 -4,-1.1 4,-2.0 1,-0.2 -1,-0.2 0.925 107.2 49.6 -64.7 -45.7 34.4 4.4 4.1 99 99 A L H X S+ 0 0 1 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.884 109.1 51.0 -62.3 -40.6 30.8 5.4 5.0 100 100 A I H X S+ 0 0 8 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.858 106.7 56.9 -65.8 -31.7 31.7 5.7 8.7 101 101 A N H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.981 107.1 47.6 -63.4 -49.8 34.8 7.9 7.7 102 102 A M H X S+ 0 0 5 -4,-2.0 4,-3.5 1,-0.2 -1,-0.2 0.874 112.7 48.6 -54.4 -46.9 32.4 10.3 5.9 103 103 A V H X S+ 0 0 8 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.873 109.5 52.0 -62.6 -41.6 30.0 10.5 9.0 104 104 A F H < S+ 0 0 26 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.915 117.0 41.0 -57.2 -47.2 32.9 11.1 11.4 105 105 A Q H < S+ 0 0 55 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.901 132.7 17.5 -73.2 -45.3 34.0 14.0 9.1 106 106 A M H X S- 0 0 49 -4,-3.5 4,-0.7 -5,-0.2 -3,-0.2 0.346 101.3-114.3-121.4 19.7 30.7 15.6 8.3 107 107 A G H X - 0 0 36 -4,-2.3 4,-2.1 -5,-0.2 5,-0.3 0.236 36.5 -78.3 71.5 157.3 28.1 14.4 10.7 108 108 A E H > S+ 0 0 51 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.939 130.0 49.9 -54.9 -54.2 25.0 12.3 10.2 109 109 A T H > S+ 0 0 123 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.909 108.3 53.2 -53.5 -48.8 23.0 15.1 8.7 110 110 A G H >< S+ 0 0 33 -4,-0.7 3,-0.7 1,-0.2 -1,-0.2 0.905 114.5 38.7 -56.1 -49.6 25.7 16.1 6.2 111 111 A V H >< S+ 0 0 0 -4,-2.1 3,-2.5 1,-0.2 -1,-0.2 0.869 106.2 66.6 -70.8 -36.4 26.1 12.7 4.7 112 112 A A H 3< S+ 0 0 11 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.696 95.1 61.9 -59.1 -12.4 22.4 12.0 4.8 113 113 A G T << S+ 0 0 53 -3,-0.7 2,-1.4 -4,-0.6 -1,-0.3 0.541 73.2 92.2 -91.9 -7.4 22.2 14.8 2.3 114 114 A F <> + 0 0 41 -3,-2.5 4,-2.4 1,-0.2 5,-0.3 -0.345 53.0 160.9 -84.6 53.8 24.2 13.1 -0.5 115 115 A T H > + 0 0 78 -2,-1.4 4,-1.3 1,-0.3 -1,-0.2 0.818 65.3 46.1 -46.6 -50.3 21.1 11.6 -2.0 116 116 A N H > S+ 0 0 94 -3,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.928 115.6 46.7 -65.7 -42.6 22.2 10.8 -5.4 117 117 A S H > S+ 0 0 7 -3,-0.3 4,-1.7 1,-0.2 -2,-0.2 0.889 109.1 51.3 -65.7 -48.6 25.4 9.1 -4.2 118 118 A L H X S+ 0 0 16 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.857 109.3 52.6 -58.7 -37.6 24.0 7.0 -1.4 119 119 A R H X S+ 0 0 118 -4,-1.3 4,-1.7 -5,-0.3 -1,-0.2 0.921 109.4 49.5 -67.3 -39.2 21.3 5.6 -3.9 120 120 A M H <>S+ 0 0 30 -4,-1.7 5,-3.2 2,-0.2 -1,-0.2 0.813 109.9 51.2 -66.8 -32.0 24.1 4.7 -6.3 121 121 A L H ><5S+ 0 0 3 -4,-1.7 3,-2.1 3,-0.2 -1,-0.2 0.912 107.3 52.7 -71.1 -43.2 26.0 2.9 -3.5 122 122 A Q H 3<5S+ 0 0 90 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.873 110.7 47.7 -61.2 -32.4 23.0 1.0 -2.6 123 123 A Q T 3<5S- 0 0 90 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.335 113.6-121.3 -86.9 5.0 22.7 -0.1 -6.2 124 124 A K T < 5 + 0 0 103 -3,-2.1 2,-1.5 1,-0.2 -3,-0.2 0.844 60.1 151.7 58.4 34.5 26.3 -1.0 -6.2 125 125 A R >< + 0 0 141 -5,-3.2 4,-2.2 1,-0.2 -1,-0.2 -0.588 18.0 174.9 -93.7 75.4 26.9 1.4 -9.1 126 126 A W H > + 0 0 56 -2,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.882 69.2 43.4 -48.8 -56.9 30.6 2.0 -8.0 127 127 A A H > S+ 0 0 73 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.915 113.9 50.1 -62.2 -45.2 31.8 4.2 -10.8 128 128 A A H > S+ 0 0 50 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.918 112.2 49.6 -59.9 -40.1 28.8 6.4 -11.0 129 129 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.916 109.3 49.6 -63.7 -47.6 28.9 6.9 -7.3 130 130 A A H X S+ 0 0 12 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.895 112.3 49.6 -58.8 -40.8 32.6 7.8 -7.3 131 131 A A H < S+ 0 0 52 -4,-2.2 4,-0.3 2,-0.2 -1,-0.2 0.833 111.7 47.4 -67.9 -35.9 32.0 10.4 -10.1 132 132 A A H >< S+ 0 0 26 -4,-1.8 3,-1.4 -5,-0.2 -2,-0.2 0.933 110.1 51.9 -73.4 -42.2 29.1 11.9 -8.3 133 133 A L H >< S+ 0 0 3 -4,-2.6 3,-1.4 1,-0.2 6,-0.4 0.797 98.9 67.4 -62.8 -27.3 31.0 12.2 -5.0 134 134 A A T 3< S+ 0 0 36 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.622 94.3 58.2 -70.5 -11.4 33.8 13.9 -6.9 135 135 A K T < S+ 0 0 166 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.1 0.228 82.9 109.6-101.4 7.9 31.6 17.0 -7.6 136 136 A S S <> S- 0 0 19 -3,-1.4 4,-1.7 1,-0.1 5,-0.2 -0.456 79.3-121.9 -83.7 161.7 30.9 17.8 -4.0 137 137 A R H > S+ 0 0 145 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.927 114.7 63.3 -59.4 -42.5 32.2 20.8 -2.1 138 138 A W H > S+ 0 0 19 1,-0.3 4,-1.9 2,-0.2 8,-0.2 0.906 103.3 45.7 -45.1 -52.3 33.6 18.1 0.3 139 139 A Y H 4 S+ 0 0 44 -6,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.913 112.9 49.3 -62.5 -43.9 35.8 16.8 -2.4 140 140 A N H < S+ 0 0 101 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.797 110.9 50.5 -70.2 -27.5 37.0 20.2 -3.5 141 141 A Q H < S+ 0 0 87 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.906 127.6 16.5 -79.1 -40.5 37.8 21.3 -0.1 142 142 A T S X S+ 0 0 25 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 -0.622 74.5 167.8-134.0 71.4 39.9 18.3 1.1 143 143 A P H > + 0 0 49 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.749 69.9 50.9 -60.2 -39.1 40.9 16.5 -2.1 144 144 A N H > S+ 0 0 119 2,-0.2 4,-1.3 1,-0.1 5,-0.1 0.906 116.0 42.2 -68.3 -44.7 43.6 14.0 -1.0 145 145 A R H > S+ 0 0 17 2,-0.2 4,-2.1 1,-0.2 3,-0.2 0.940 115.1 50.6 -66.3 -49.8 41.4 12.7 1.9 146 146 A A H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.910 107.6 52.9 -56.2 -41.6 38.3 12.6 -0.3 147 147 A K H X S+ 0 0 87 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.880 107.4 52.3 -62.4 -38.4 40.1 10.7 -3.1 148 148 A R H X S+ 0 0 65 -4,-1.3 4,-1.5 -3,-0.2 -1,-0.2 0.965 113.8 43.1 -61.5 -49.5 41.2 8.0 -0.6 149 149 A V H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 3,-0.3 0.947 114.5 50.8 -60.9 -46.6 37.6 7.6 0.6 150 150 A I H X S+ 0 0 14 -4,-3.1 4,-2.8 1,-0.3 -1,-0.2 0.914 109.2 49.1 -58.2 -47.2 36.3 7.6 -2.9 151 151 A T H X S+ 0 0 38 -4,-2.4 4,-2.5 -5,-0.2 6,-0.3 0.818 106.5 59.0 -63.2 -31.0 38.8 5.0 -4.1 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.4 -3,-0.3 -2,-0.2 0.905 111.0 40.4 -65.6 -42.0 37.8 2.9 -1.1 153 153 A F H < S+ 0 0 3 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.910 114.6 52.6 -70.3 -46.0 34.1 2.9 -2.3 154 154 A R H < S+ 0 0 123 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.936 125.8 22.4 -55.1 -48.3 35.1 2.4 -5.9 155 155 A T H < S- 0 0 45 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.700 84.1-136.3 -95.0 -32.2 37.3 -0.7 -5.2 156 156 A G S < S+ 0 0 16 -4,-2.4 2,-0.2 1,-0.3 -62,-0.2 0.629 72.3 102.8 79.1 11.3 36.2 -2.3 -1.9 157 157 A T S S- 0 0 48 -6,-0.3 3,-0.4 -5,-0.2 -1,-0.3 -0.729 78.6-122.3-119.5 170.4 40.0 -2.6 -0.9 158 158 A W S > S+ 0 0 51 -2,-0.2 3,-1.7 1,-0.2 4,-0.3 0.239 72.5 119.4 -97.9 17.4 42.3 -0.8 1.5 159 159 A D G > + 0 0 93 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.813 63.9 61.0 -49.7 -44.2 44.8 0.1 -1.2 160 160 A A G 3 S+ 0 0 34 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.719 111.2 41.0 -60.7 -18.2 44.6 3.9 -1.0 161 161 A Y G < 0 0 20 -3,-1.7 -1,-0.3 -13,-0.1 -2,-0.2 0.342 360.0 360.0-109.3 0.7 45.8 3.7 2.6 162 162 A K < 0 0 197 -3,-1.1 0, 0.0 -4,-0.3 0, 0.0 -0.861 360.0 360.0 -98.3 360.0 49.0 0.6 2.2