==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-DEC-99 1C6I . COMPND 2 MOLECULE: PROTEIN (LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.L.QUILLIN,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8844.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 73.5 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 . 8 4.9 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 . 87 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 1 0 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 64 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 157.0 43.3 -1.9 9.2 2 2 A N > - 0 0 67 1,-0.0 4,-3.0 156,-0.0 5,-0.2 -0.931 360.0 -79.6-157.7 176.3 40.1 -0.7 10.8 3 3 A I H > S+ 0 0 24 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.840 125.1 48.5 -53.6 -42.8 38.0 2.3 11.3 4 4 A F H > S+ 0 0 76 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.952 113.9 43.6 -66.9 -48.5 40.1 3.7 14.1 5 5 A E H > S+ 0 0 93 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.873 114.6 53.7 -64.4 -36.2 43.4 3.3 12.4 6 6 A M H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 3,-0.3 0.961 112.5 39.9 -61.8 -53.0 41.8 4.7 9.3 7 7 A L H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.843 110.0 60.9 -67.6 -28.1 40.5 7.9 10.9 8 8 A R H X S+ 0 0 104 -4,-2.2 4,-1.6 -5,-0.3 -1,-0.2 0.884 108.0 46.3 -65.9 -30.4 43.8 8.2 13.0 9 9 A I H < S+ 0 0 87 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.948 116.5 41.9 -76.0 -45.2 45.6 8.5 9.7 10 10 A D H < S+ 0 0 20 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.813 124.4 35.4 -70.9 -31.4 43.2 11.0 8.1 11 11 A E H < S- 0 0 45 -4,-2.7 19,-0.3 1,-0.2 -1,-0.2 0.701 90.7-154.0 -96.8 -27.2 42.8 13.1 11.2 12 12 A G < - 0 0 24 -4,-1.6 2,-0.3 -5,-0.3 -1,-0.2 -0.259 24.8 -89.4 78.3-171.8 46.2 13.1 12.8 13 13 A L + 0 0 37 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.945 41.9 173.0-143.6 120.0 46.7 13.6 16.6 14 14 A R E -A 28 0A 139 14,-1.6 14,-2.8 -2,-0.3 4,-0.1 -0.999 18.7-162.7-130.7 127.3 47.2 17.0 18.2 15 15 A L E S+ 0 0 64 -2,-0.4 43,-2.0 12,-0.2 2,-0.3 0.405 74.5 60.4 -91.8 2.4 47.3 17.5 22.0 16 16 A K E S-C 57 0B 142 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.920 102.7 -85.8-124.0 149.7 46.7 21.4 21.9 17 17 A I E + 0 0 30 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.288 58.5 170.7 -52.7 138.4 43.7 23.1 20.5 18 18 A Y E -A 26 0A 26 8,-3.3 8,-3.1 -4,-0.1 2,-0.5 -0.833 35.4-103.0-142.3 173.5 44.2 23.7 16.7 19 19 A K E -A 25 0A 122 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.878 33.8-138.0-104.2 138.6 42.2 24.9 13.8 20 20 A D > - 0 0 47 4,-2.9 3,-1.9 -2,-0.5 -1,-0.1 -0.058 41.9 -77.5 -79.9-171.9 40.9 22.4 11.4 21 21 A T T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.734 135.2 48.3 -63.5 -24.1 40.8 22.7 7.6 22 22 A E T 3 S- 0 0 80 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.369 123.8-104.1 -93.1 -0.8 37.7 25.0 7.8 23 23 A G S < S+ 0 0 38 -3,-1.9 2,-0.4 1,-0.3 -2,-0.1 0.628 75.2 140.6 85.2 21.6 39.4 27.2 10.6 24 24 A Y - 0 0 78 1,-0.1 -4,-2.9 9,-0.0 -1,-0.3 -0.805 60.3-100.6-100.9 141.4 37.4 25.7 13.5 25 25 A Y E +AB 19 34A 35 9,-0.6 8,-3.1 11,-0.4 9,-1.4 -0.355 54.4 158.9 -62.7 126.3 38.8 24.9 16.9 26 26 A T E -AB 18 32A 3 -8,-3.1 -8,-3.3 6,-0.3 2,-0.3 -0.885 19.2-168.1-140.6 168.6 39.5 21.2 17.3 27 27 A I E > + B 0 31A 0 4,-1.5 4,-1.8 -2,-0.3 2,-0.2 -0.981 52.2 3.1-155.4 162.4 41.7 19.0 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.8 -14,-1.6 -2,-0.3 2,-0.9 -0.473 122.6 -5.1 70.7-132.7 42.9 15.4 19.6 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -2,-0.2 -17,-0.1 -0.657 127.8 -53.6 -96.4 66.5 41.9 13.1 16.7 30 30 A G T 4 S+ 0 0 14 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.790 84.0 160.2 73.0 23.4 39.6 15.4 14.8 31 31 A H E < -B 27 0A 31 -4,-1.8 -4,-1.5 1,-0.0 -1,-0.2 -0.683 32.4-145.3 -84.5 101.5 37.4 16.3 17.8 32 32 A L E -B 26 0A 68 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.375 17.3-174.8 -65.9 129.7 35.6 19.5 16.8 33 33 A L E - 0 0 14 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.873 58.5 -27.7 -95.3 -41.3 35.1 21.7 19.8 34 34 A T E -B 25 0A 29 -9,-1.4 -9,-0.6 2,-0.1 -1,-0.4 -0.948 36.3-132.3-169.0 154.3 33.1 24.6 18.3 35 35 A K S S+ 0 0 140 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.491 75.4 114.3 -89.8 -3.7 32.4 26.6 15.2 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.369 70.6-136.6 -73.6 143.5 32.8 29.7 17.1 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.568 75.7 103.0 -72.4 -8.9 35.6 32.1 16.4 38 38 A S > - 0 0 45 1,-0.2 4,-2.1 -13,-0.0 5,-0.1 -0.671 56.6-160.4 -85.5 121.9 36.2 32.5 20.2 39 39 A L H > S+ 0 0 69 -2,-0.5 4,-2.7 1,-0.2 5,-0.2 0.869 96.0 56.2 -66.1 -31.7 39.2 30.6 21.6 40 40 A N H > S+ 0 0 122 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.902 103.8 51.1 -64.4 -44.5 37.6 31.0 25.0 41 41 A A H > S+ 0 0 31 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.949 110.3 50.3 -58.0 -43.8 34.5 29.4 23.8 42 42 A A H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.915 109.5 50.6 -59.7 -44.2 36.7 26.5 22.6 43 43 A K H X S+ 0 0 71 -4,-2.7 4,-2.2 2,-0.2 11,-0.2 0.886 110.8 50.5 -62.1 -36.5 38.5 26.2 25.9 44 44 A S H X S+ 0 0 70 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.936 110.5 47.0 -68.8 -47.2 35.2 26.1 27.7 45 45 A E H X S+ 0 0 66 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.900 111.7 53.1 -63.1 -37.7 33.8 23.4 25.5 46 46 A L H X S+ 0 0 0 -4,-2.9 4,-2.5 -5,-0.2 5,-0.3 0.950 109.0 47.8 -63.0 -41.5 37.1 21.4 25.9 47 47 A D H X>S+ 0 0 37 -4,-2.2 4,-2.5 1,-0.2 5,-1.4 0.918 111.7 50.0 -59.9 -43.6 36.9 21.6 29.7 48 48 A K H <5S+ 0 0 143 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.865 111.9 49.6 -61.1 -43.3 33.3 20.5 29.7 49 49 A A H <5S+ 0 0 43 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.889 119.7 35.0 -65.3 -42.0 34.3 17.5 27.3 50 50 A I H <5S- 0 0 36 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.719 102.8-124.5 -86.5 -30.9 37.2 16.3 29.5 51 51 A G T <5S+ 0 0 67 -4,-2.5 2,-0.3 -5,-0.3 -3,-0.2 0.790 78.2 65.8 91.3 24.7 35.8 17.1 32.9 52 52 A R S - 0 0 7 -2,-0.8 3,-1.3 -11,-0.2 -1,-0.2 0.697 32.8-141.2 -96.8 -18.7 42.7 21.7 30.8 55 55 A N T 3 S- 0 0 128 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.846 71.4 -57.0 61.8 31.7 44.0 25.0 29.9 56 56 A G T 3 S+ 0 0 7 -13,-0.2 -39,-1.6 1,-0.2 2,-0.4 0.526 118.5 98.4 79.0 6.6 43.8 23.9 26.1 57 57 A V B < +C 16 0B 54 -3,-1.3 2,-0.3 -41,-0.2 -41,-0.2 -0.983 46.5 178.6-130.7 142.2 45.9 20.9 26.5 58 58 A I - 0 0 6 -43,-2.0 2,-0.2 -2,-0.4 -30,-0.1 -0.855 26.0-111.4-134.5 164.4 45.1 17.2 26.9 59 59 A T > - 0 0 65 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.532 33.3-104.2 -94.7 173.3 46.9 14.0 27.3 60 60 A K H > S+ 0 0 119 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.867 120.7 51.7 -57.8 -43.6 47.1 11.1 24.8 61 61 A D H > S+ 0 0 123 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.882 109.1 50.2 -63.0 -39.6 44.7 9.0 26.8 62 62 A E H > S+ 0 0 37 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.915 109.5 49.9 -68.3 -41.9 42.2 11.8 26.9 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -34,-0.4 0.911 111.4 50.5 -58.0 -43.2 42.4 12.4 23.1 64 64 A E H X S+ 0 0 79 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.881 107.8 53.6 -64.1 -35.3 41.8 8.6 22.6 65 65 A K H X S+ 0 0 137 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.940 108.7 46.9 -63.9 -46.1 38.9 8.7 24.9 66 66 A L H X S+ 0 0 5 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.912 111.6 55.0 -59.1 -41.0 37.2 11.5 22.9 67 67 A F H X S+ 0 0 12 -4,-2.3 4,-3.0 1,-0.2 5,-0.3 0.940 106.1 48.4 -60.0 -50.9 38.0 9.6 19.8 68 68 A N H X S+ 0 0 90 -4,-2.7 4,-2.3 1,-0.2 5,-0.3 0.918 113.0 48.6 -56.6 -41.6 36.3 6.4 20.9 69 69 A Q H X S+ 0 0 100 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.927 111.6 51.1 -65.8 -40.3 33.2 8.4 21.9 70 70 A D H X S+ 0 0 36 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.883 110.5 46.4 -65.7 -37.9 33.2 10.1 18.6 71 71 A V H X S+ 0 0 7 -4,-3.0 4,-2.3 2,-0.2 5,-0.2 0.951 113.4 48.9 -68.3 -45.9 33.4 7.0 16.5 72 72 A D H X S+ 0 0 97 -4,-2.3 4,-2.6 -5,-0.3 5,-0.2 0.927 111.2 50.6 -56.3 -43.9 30.7 5.3 18.5 73 73 A A H X S+ 0 0 60 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.872 107.7 53.6 -63.2 -37.8 28.6 8.4 18.1 74 74 A A H X S+ 0 0 9 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.941 110.6 45.8 -61.9 -47.6 29.1 8.4 14.4 75 75 A V H X S+ 0 0 32 -4,-2.3 4,-3.0 1,-0.2 5,-0.2 0.935 112.8 50.4 -60.5 -47.0 28.0 4.7 14.0 76 76 A R H X S+ 0 0 118 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.903 107.5 54.3 -60.3 -37.8 25.0 5.3 16.2 77 77 A G H X S+ 0 0 12 -4,-2.1 4,-1.1 -5,-0.2 -1,-0.2 0.887 108.6 48.6 -61.4 -44.5 24.2 8.3 14.1 78 78 A I H >< S+ 0 0 3 -4,-2.2 3,-1.0 1,-0.2 7,-0.5 0.964 109.9 51.1 -60.1 -50.0 24.2 6.3 10.9 79 79 A L H 3< S+ 0 0 61 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.768 112.0 48.7 -64.3 -20.7 22.0 3.6 12.5 80 80 A R H 3< S+ 0 0 185 -4,-1.5 2,-0.6 -5,-0.2 -1,-0.3 0.639 91.9 90.8 -90.1 -16.8 19.5 6.2 13.6 81 81 A N S+ 0 0 9 -6,-0.2 4,-2.6 -3,-0.2 3,-0.4 0.888 100.1 66.2 -85.7 -46.3 21.8 6.2 6.0 85 85 A K H X S+ 0 0 93 -4,-3.0 4,-3.0 -7,-0.5 5,-0.3 0.903 98.8 51.8 -50.0 -46.7 21.0 3.0 7.7 86 86 A P H > S+ 0 0 55 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.898 112.7 46.2 -62.7 -34.7 19.8 1.1 4.7 87 87 A V H > S+ 0 0 10 -4,-0.5 4,-0.8 -3,-0.4 -2,-0.2 0.948 113.2 48.3 -68.4 -47.6 22.8 2.0 2.7 88 88 A Y H >< S+ 0 0 30 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.901 109.1 52.4 -59.3 -45.6 25.1 1.2 5.5 89 89 A D H 3< S+ 0 0 71 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.827 105.6 57.9 -64.8 -26.4 23.5 -2.3 6.2 90 90 A S H 3< S+ 0 0 37 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.673 94.5 87.5 -76.5 -16.7 23.9 -3.1 2.5 91 91 A L S << S- 0 0 7 -3,-0.9 2,-0.1 -4,-0.8 31,-0.0 -0.505 77.1-115.9 -84.6 159.0 27.6 -2.7 2.5 92 92 A D > - 0 0 54 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.262 43.7 -93.8 -77.9 168.1 30.5 -5.0 3.3 93 93 A A H > S+ 0 0 79 1,-0.2 4,-1.3 2,-0.2 -2,-0.1 0.840 121.2 49.6 -55.9 -45.3 32.7 -4.2 6.3 94 94 A V H >> S+ 0 0 27 2,-0.2 4,-1.6 1,-0.2 3,-0.6 0.960 113.1 46.4 -61.0 -50.0 35.4 -2.3 4.5 95 95 A R H 3> S+ 0 0 25 1,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.861 105.3 60.5 -65.5 -34.9 33.0 -0.0 2.7 96 96 A R H 3X S+ 0 0 79 -4,-2.6 4,-2.3 1,-0.2 -1,-0.3 0.907 100.3 55.7 -59.5 -34.0 31.1 0.5 5.9 97 97 A A H S+ 0 0 69 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.851 129.7 53.4 -55.5 -41.9 25.1 12.7 9.4 109 109 A T H > S+ 0 0 121 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.945 107.3 47.2 -59.6 -58.3 23.4 15.6 7.9 110 110 A G H >< S+ 0 0 34 -4,-0.8 3,-0.7 1,-0.2 -2,-0.2 0.882 115.8 46.0 -55.2 -48.3 26.1 16.4 5.4 111 111 A V H >< S+ 0 0 6 -4,-2.4 3,-2.2 1,-0.2 -1,-0.2 0.898 102.8 62.0 -68.8 -37.4 26.4 12.8 4.3 112 112 A A H 3< S+ 0 0 20 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.804 94.9 65.8 -63.7 -18.1 22.7 12.2 4.0 113 113 A G T << S+ 0 0 59 -4,-0.9 2,-1.1 -3,-0.7 -1,-0.3 0.482 75.2 87.4 -79.4 0.5 22.6 15.0 1.3 114 114 A F <> + 0 0 38 -3,-2.2 4,-2.7 1,-0.2 5,-0.3 -0.318 56.6 157.5 -92.5 57.3 24.7 12.8 -1.1 115 115 A T H > + 0 0 84 -2,-1.1 4,-1.7 1,-0.2 -1,-0.2 0.869 65.2 44.2 -47.7 -54.6 21.5 11.3 -2.4 116 116 A N H > S+ 0 0 83 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.878 114.4 50.1 -62.4 -42.3 22.6 10.1 -5.7 117 117 A S H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.907 109.2 52.8 -65.2 -40.4 25.9 8.7 -4.4 118 118 A L H X S+ 0 0 21 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.880 108.4 49.3 -59.1 -44.5 24.1 6.8 -1.7 119 119 A R H X S+ 0 0 114 -4,-1.7 4,-2.2 -5,-0.3 -1,-0.2 0.942 111.1 50.0 -65.6 -38.9 21.7 5.2 -4.1 120 120 A M H X>S+ 0 0 21 -4,-2.0 5,-2.3 1,-0.2 4,-0.6 0.922 111.5 48.8 -64.7 -41.7 24.7 4.1 -6.4 121 121 A L H ><5S+ 0 0 5 -4,-2.9 3,-1.4 1,-0.2 -1,-0.2 0.935 108.9 52.4 -63.4 -43.4 26.4 2.7 -3.4 122 122 A Q H 3<5S+ 0 0 88 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.905 111.5 47.6 -58.7 -36.7 23.2 0.8 -2.4 123 123 A Q H 3<5S- 0 0 91 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.520 113.0-121.6 -82.3 -4.2 23.1 -0.6 -6.0 124 124 A K T <<5 + 0 0 101 -3,-1.4 2,-1.3 -4,-0.6 -3,-0.2 0.784 61.8 147.3 68.8 29.2 26.8 -1.6 -5.8 125 125 A R >< + 0 0 125 -5,-2.3 4,-2.5 1,-0.2 5,-0.2 -0.704 21.5 175.0 -96.5 78.7 27.6 0.5 -8.8 126 126 A W H > + 0 0 52 -2,-1.3 4,-2.3 1,-0.2 -1,-0.2 0.908 69.1 44.5 -56.6 -53.5 31.2 1.3 -7.5 127 127 A D H > S+ 0 0 106 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.885 115.4 48.5 -62.8 -40.8 32.7 3.2 -10.3 128 128 A E H > S+ 0 0 106 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.892 110.9 50.5 -67.0 -40.0 29.7 5.4 -10.9 129 129 A A H X S+ 0 0 1 -4,-2.5 4,-3.0 1,-0.2 -1,-0.2 0.908 108.6 53.4 -62.1 -40.3 29.4 6.1 -7.2 130 130 A A H X S+ 0 0 11 -4,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.897 109.1 48.0 -64.8 -37.8 33.0 7.1 -7.2 131 131 A V H X S+ 0 0 94 -4,-1.9 4,-0.7 -5,-0.2 3,-0.3 0.933 113.7 46.4 -69.0 -42.5 32.6 9.5 -10.0 132 132 A N H >< S+ 0 0 35 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.902 107.7 58.1 -66.9 -34.8 29.5 11.1 -8.4 133 133 A L H 3< S+ 0 0 2 -4,-3.0 6,-0.4 1,-0.2 -1,-0.2 0.847 100.7 56.5 -63.0 -32.0 31.2 11.3 -5.0 134 134 A A H 3< S+ 0 0 26 -4,-1.2 2,-1.8 -3,-0.3 -1,-0.2 0.673 85.6 81.9 -74.9 -17.5 34.0 13.4 -6.5 135 135 A K S << S+ 0 0 161 -3,-0.9 2,-0.3 -4,-0.7 -1,-0.2 -0.562 80.3 99.0 -84.0 70.0 31.6 16.1 -7.8 136 136 A S S > S- 0 0 18 -2,-1.8 4,-2.0 1,-0.1 5,-0.2 -0.998 84.9-118.1-156.7 154.1 31.4 17.8 -4.4 137 137 A R H > S+ 0 0 146 -2,-0.3 4,-2.3 2,-0.2 5,-0.3 0.910 114.6 63.2 -61.9 -38.5 32.7 20.6 -2.4 138 138 A W H > S+ 0 0 13 1,-0.2 4,-2.5 2,-0.2 8,-0.2 0.936 105.2 44.5 -49.6 -50.8 34.1 17.9 -0.0 139 139 A Y H 4 S+ 0 0 56 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.876 113.8 49.1 -64.7 -42.4 36.4 16.5 -2.8 140 140 A N H < S+ 0 0 111 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.849 115.8 43.0 -69.2 -31.2 37.5 20.0 -4.0 141 141 A Q H < S+ 0 0 105 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.838 131.9 19.1 -81.2 -40.0 38.4 21.2 -0.5 142 142 A T S X S+ 0 0 21 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.2 -0.570 73.9 161.7-130.8 68.9 40.1 18.0 0.9 143 143 A P H > + 0 0 48 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.880 68.6 52.6 -58.8 -43.7 41.0 16.2 -2.2 144 144 A N H > S+ 0 0 115 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.937 116.3 39.6 -62.4 -42.0 43.7 13.8 -0.8 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.934 113.9 52.9 -69.7 -49.6 41.5 12.5 1.9 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.902 108.2 54.1 -54.0 -39.8 38.4 12.4 -0.3 147 147 A K H X S+ 0 0 104 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.891 106.7 50.2 -62.3 -40.5 40.5 10.3 -2.8 148 148 A R H X S+ 0 0 69 -4,-1.7 4,-1.3 2,-0.2 -1,-0.2 0.932 115.0 42.4 -63.8 -43.6 41.4 7.8 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.920 114.0 52.1 -67.7 -43.5 37.8 7.4 1.0 150 150 A I H X S+ 0 0 14 -4,-3.0 4,-2.3 -5,-0.2 -1,-0.2 0.899 108.6 50.1 -58.1 -43.4 36.5 7.3 -2.5 151 151 A T H X S+ 0 0 35 -4,-2.7 4,-2.8 1,-0.2 6,-0.4 0.840 107.2 56.2 -66.0 -29.2 39.0 4.6 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.903 109.9 43.0 -66.2 -46.0 37.9 2.6 -0.5 153 153 A F H < S+ 0 0 5 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.859 115.7 52.1 -69.2 -33.3 34.2 2.7 -1.6 154 154 A R H < S+ 0 0 109 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.938 123.6 22.8 -67.1 -48.6 35.3 1.9 -5.1 155 155 A T H < S- 0 0 41 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.602 84.8-135.8 -95.9 -20.4 37.5 -1.1 -4.4 156 156 A G S < S+ 0 0 17 -4,-2.4 2,-0.3 1,-0.3 -62,-0.2 0.720 74.7 98.9 70.7 13.6 36.2 -2.5 -1.1 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.820 81.6-119.1-126.3 173.4 39.9 -2.9 0.0 158 158 A W S >> S+ 0 0 34 -2,-0.3 3,-1.9 1,-0.2 4,-0.6 0.100 70.4 123.9 -95.9 22.1 42.3 -0.8 2.2 159 159 A D G >4 + 0 0 109 1,-0.3 3,-0.8 2,-0.2 -1,-0.2 0.801 67.3 59.0 -55.1 -32.1 44.8 -0.2 -0.6 160 160 A A G 34 S+ 0 0 33 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.655 108.0 46.4 -70.4 -18.7 44.5 3.7 -0.2 161 161 A Y G <4 0 0 19 -3,-1.9 -1,-0.2 -13,-0.1 -2,-0.2 0.505 360.0 360.0-106.4 -2.2 45.7 3.4 3.3 162 162 A K << 0 0 171 -3,-0.8 -2,-0.2 -4,-0.6 -3,-0.1 0.843 360.0 360.0 -93.7 360.0 48.6 1.1 2.7