==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-APR-03 1P64 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR B.H.MOOERS,D.DATTA,W.A.BAASE,E.S.ZOLLARS,S.L.MAYO, . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8763.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 70.1 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 . 8 4.9 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 . 84 51.2 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 2 0 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 62 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 142.7 43.1 -1.7 8.9 2 2 A N > - 0 0 67 156,-0.0 4,-2.7 95,-0.0 5,-0.2 -0.949 360.0 -77.8-159.3 173.9 39.7 -0.7 10.5 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.837 126.3 49.6 -52.2 -39.2 37.7 2.4 11.1 4 4 A F H > S+ 0 0 70 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.938 114.3 43.1 -71.6 -41.1 39.7 3.6 14.0 5 5 A E H > S+ 0 0 96 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.861 115.2 53.5 -69.0 -30.9 43.1 3.2 12.2 6 6 A M H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.941 112.4 39.7 -66.3 -54.6 41.4 4.7 9.2 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 -5,-0.2 5,-0.3 0.847 110.5 60.6 -68.4 -28.0 40.2 7.7 10.8 8 8 A R H X S+ 0 0 102 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.887 107.2 47.4 -64.4 -33.6 43.4 8.0 12.8 9 9 A I H < S+ 0 0 52 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.951 115.9 42.7 -70.9 -46.2 45.2 8.3 9.6 10 10 A D H < S+ 0 0 19 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.734 123.7 34.5 -70.6 -26.7 42.8 10.9 8.1 11 11 A E H < S- 0 0 41 -4,-2.4 19,-0.4 -5,-0.2 -1,-0.2 0.634 92.0-153.0-104.4 -18.7 42.4 13.1 11.2 12 12 A G < - 0 0 23 -4,-1.5 2,-0.4 -5,-0.3 -1,-0.1 -0.209 24.2 -88.9 72.3-171.8 45.9 12.9 12.9 13 13 A L + 0 0 43 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.956 45.6 167.3-141.6 114.1 46.5 13.4 16.6 14 14 A R E -A 28 0A 142 14,-1.9 14,-2.4 -2,-0.4 4,-0.1 -1.000 21.2-160.8-131.7 130.3 47.2 16.8 18.1 15 15 A L E S+ 0 0 58 -2,-0.4 43,-2.2 12,-0.2 2,-0.3 0.431 72.7 63.6 -91.1 -1.2 47.1 17.3 21.9 16 16 A K E S-C 57 0B 150 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.902 100.8 -86.1-119.5 152.5 46.6 21.1 21.8 17 17 A I E + 0 0 31 39,-1.7 2,-0.3 -2,-0.3 10,-0.2 -0.280 58.8 166.5 -58.2 134.7 43.6 23.0 20.5 18 18 A Y E -A 26 0A 29 8,-3.1 8,-3.1 -4,-0.1 2,-0.5 -0.861 37.6-100.5-140.2 173.9 44.1 23.6 16.7 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.866 34.7-141.2-104.2 136.7 42.0 24.7 13.8 20 20 A D > - 0 0 44 4,-2.9 3,-2.1 -2,-0.5 -1,-0.1 0.013 42.6 -74.0 -79.0-168.8 40.7 22.1 11.4 21 21 A T T 3 S+ 0 0 109 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.734 133.5 49.4 -61.6 -22.8 40.4 22.3 7.6 22 22 A E T 3 S- 0 0 72 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.381 123.3-100.7 -95.1 0.4 37.5 24.5 7.9 23 23 A G S < S+ 0 0 40 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.597 77.3 139.4 92.0 8.8 39.0 26.9 10.4 24 24 A Y - 0 0 68 1,-0.1 -4,-2.9 -5,-0.0 -1,-0.3 -0.723 59.8-105.1-100.2 140.5 37.2 25.4 13.4 25 25 A Y E +A 19 0A 35 11,-0.5 8,-2.7 9,-0.4 9,-1.3 -0.346 54.2 154.8 -60.4 129.2 38.7 24.7 16.8 26 26 A T E -AB 18 32A 2 -8,-3.1 -8,-3.1 6,-0.3 2,-0.3 -0.900 20.9-166.3-145.7 169.3 39.4 21.1 17.3 27 27 A I E > + B 0 31A 0 4,-1.8 4,-2.5 -2,-0.3 -12,-0.2 -0.968 51.2 8.9-153.7 169.4 41.6 18.8 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.4 -14,-1.9 -2,-0.3 2,-0.9 -0.407 123.3 -7.3 66.1-129.2 42.8 15.2 19.6 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.2 -0.692 128.2 -53.0-102.7 72.7 41.8 13.0 16.7 30 30 A G T 4 S+ 0 0 13 -2,-0.9 2,-1.1 -19,-0.4 -2,-0.2 0.834 81.9 163.2 65.7 33.8 39.5 15.3 14.9 31 31 A H E < -B 27 0A 30 -4,-2.5 -4,-1.8 -20,-0.1 -1,-0.2 -0.731 30.5-145.1 -90.5 103.9 37.4 16.1 17.8 32 32 A L E -B 26 0A 72 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.448 17.8-175.8 -66.5 129.5 35.5 19.2 16.8 33 33 A L - 0 0 13 -8,-2.7 2,-0.3 1,-0.4 -7,-0.2 0.856 56.9 -34.0 -96.3 -42.3 34.9 21.5 19.7 34 34 A T - 0 0 31 -9,-1.3 -9,-0.4 2,-0.1 -1,-0.4 -0.959 36.4-127.6-171.1 160.8 32.9 24.3 18.3 35 35 A K S S+ 0 0 135 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.411 74.3 117.1 -95.3 -2.0 32.3 26.4 15.2 36 36 A S - 0 0 39 1,-0.1 -11,-0.5 2,-0.1 -2,-0.1 -0.348 67.4-138.8 -67.0 144.4 32.7 29.5 17.2 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.485 77.5 102.3 -81.9 -1.6 35.5 31.8 16.4 38 38 A S > - 0 0 53 1,-0.2 4,-1.8 2,-0.0 5,-0.1 -0.750 57.7-162.1 -88.6 117.1 36.0 32.3 20.2 39 39 A L H > S+ 0 0 62 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.859 93.8 56.4 -62.0 -35.9 39.0 30.3 21.6 40 40 A N H > S+ 0 0 116 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.938 104.0 51.4 -65.0 -41.8 37.6 30.7 25.0 41 41 A A H > S+ 0 0 32 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.909 110.8 49.9 -60.5 -38.9 34.4 29.1 23.9 42 42 A A H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.904 107.5 52.5 -66.7 -39.2 36.4 26.3 22.5 43 43 A K H X S+ 0 0 58 -4,-2.8 4,-2.4 1,-0.2 11,-0.2 0.876 108.5 52.2 -63.4 -36.8 38.3 25.9 25.7 44 44 A S H X S+ 0 0 78 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.913 109.2 48.2 -62.2 -46.6 34.9 25.7 27.6 45 45 A E H X S+ 0 0 72 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.904 111.1 53.7 -62.1 -38.3 33.7 23.0 25.3 46 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 5,-0.3 0.947 108.8 45.3 -64.0 -49.3 37.0 21.2 25.8 47 47 A D H X>S+ 0 0 31 -4,-2.4 4,-3.2 1,-0.2 5,-1.2 0.925 113.3 51.9 -61.3 -39.1 36.8 21.2 29.6 48 48 A K H <5S+ 0 0 143 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.903 110.6 48.1 -62.5 -41.8 33.2 20.1 29.5 49 49 A A H <5S+ 0 0 41 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.884 120.5 36.2 -66.8 -38.1 34.1 17.2 27.2 50 50 A I H <5S- 0 0 37 -4,-2.2 -2,-0.2 2,-0.3 -1,-0.2 0.717 103.9-124.8 -87.6 -30.6 37.0 16.0 29.4 51 51 A G T <5S+ 0 0 66 -4,-3.2 2,-0.3 1,-0.3 -3,-0.2 0.757 78.1 70.9 90.2 22.6 35.5 16.8 32.7 52 52 A R S - 0 0 9 -2,-1.2 3,-0.9 -11,-0.2 -1,-0.2 0.660 35.3-139.9 -86.3 -25.2 42.4 21.7 30.8 55 55 A N T 3 S- 0 0 125 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.912 73.5 -59.6 62.7 34.8 43.7 25.0 29.5 56 56 A G T 3 S+ 0 0 6 -13,-0.2 -39,-1.7 1,-0.1 2,-0.4 0.615 115.8 100.5 65.4 22.2 43.5 23.6 25.9 57 57 A V B < +C 16 0B 74 -3,-0.9 2,-0.3 -41,-0.2 -41,-0.2 -1.000 43.6 175.5-136.1 133.9 45.8 20.7 26.4 58 58 A I - 0 0 3 -43,-2.2 2,-0.2 -2,-0.4 -30,-0.1 -0.821 27.9-108.1-131.3 171.2 44.9 17.1 26.8 59 59 A T > - 0 0 67 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.507 32.5-106.1 -96.0 171.9 46.7 13.8 27.1 60 60 A K H > S+ 0 0 108 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.896 120.7 51.9 -59.8 -43.1 46.9 11.0 24.6 61 61 A D H > S+ 0 0 120 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.937 109.3 49.3 -61.9 -44.2 44.6 8.9 26.6 62 62 A E H > S+ 0 0 39 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.925 110.1 51.7 -62.3 -41.5 42.0 11.7 26.8 63 63 A A H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -34,-0.4 0.942 109.7 49.1 -61.1 -41.1 42.2 12.2 23.1 64 64 A E H X S+ 0 0 80 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.880 107.3 57.4 -65.0 -33.3 41.6 8.5 22.5 65 65 A K H X S+ 0 0 135 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.964 108.6 42.8 -63.4 -49.0 38.8 8.6 24.8 66 66 A L H X S+ 0 0 3 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.894 112.9 56.2 -62.1 -37.4 37.0 11.4 22.9 67 67 A F H X S+ 0 0 12 -4,-2.5 4,-2.6 -5,-0.3 5,-0.3 0.944 106.6 47.7 -62.1 -45.4 37.9 9.5 19.7 68 68 A N H X S+ 0 0 93 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.945 113.8 47.8 -61.2 -41.5 36.2 6.3 20.8 69 69 A Q H X S+ 0 0 97 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.890 112.0 51.1 -64.5 -37.4 33.2 8.3 21.8 70 70 A D H X S+ 0 0 33 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.867 109.5 47.5 -68.8 -37.3 33.2 10.1 18.5 71 71 A V H X S+ 0 0 5 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.953 113.2 49.5 -67.8 -45.8 33.4 6.9 16.4 72 72 A D H X S+ 0 0 89 -4,-2.5 4,-3.6 -5,-0.3 5,-0.2 0.949 110.8 49.9 -56.9 -46.5 30.6 5.3 18.4 73 73 A A H X S+ 0 0 61 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.881 108.7 53.5 -60.6 -37.6 28.4 8.4 18.1 74 74 A A H X S+ 0 0 9 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.950 112.0 42.5 -65.2 -45.9 29.0 8.4 14.4 75 75 A V H X S+ 0 0 29 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.948 114.6 51.5 -63.4 -46.9 27.9 4.8 13.9 76 76 A R H X S+ 0 0 128 -4,-3.6 4,-0.8 -5,-0.3 -1,-0.2 0.868 108.0 52.5 -58.6 -32.9 25.0 5.4 16.2 77 77 A G H < S+ 0 0 7 -4,-2.2 4,-0.5 -5,-0.2 3,-0.4 0.879 107.2 52.5 -68.4 -39.1 24.0 8.4 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-1.4 1,-0.2 7,-0.3 0.950 107.7 51.7 -61.2 -48.8 24.1 6.4 11.1 79 79 A L H 3< S+ 0 0 70 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.665 111.7 46.7 -63.6 -19.4 21.8 3.8 12.6 80 80 A R T 3< S+ 0 0 182 -4,-0.8 2,-0.7 -3,-0.4 -1,-0.3 0.370 92.5 90.9-102.5 -0.2 19.2 6.4 13.7 81 81 A N X> - 0 0 23 -3,-1.4 4,-2.7 -4,-0.5 3,-0.9 -0.860 64.0-153.8-103.7 114.2 19.1 8.2 10.4 82 82 A A T 34 S+ 0 0 89 -2,-0.7 -1,-0.1 1,-0.3 -4,-0.0 0.691 94.9 53.0 -57.2 -19.1 16.5 7.0 8.1 83 83 A K T 34 S+ 0 0 146 2,-0.1 4,-0.4 1,-0.1 -1,-0.3 0.815 118.1 33.1 -85.0 -30.0 18.4 8.2 5.2 84 84 A L T <> S+ 0 0 0 -3,-0.9 4,-2.9 -6,-0.2 5,-0.2 0.752 100.7 73.1 -96.4 -32.1 21.6 6.5 6.1 85 85 A K H X S+ 0 0 81 -4,-2.7 4,-3.4 -7,-0.3 5,-0.3 0.951 96.2 48.4 -53.3 -55.2 20.7 3.3 7.8 86 86 A P H > S+ 0 0 61 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.938 114.3 46.9 -55.9 -45.0 19.5 1.3 4.8 87 87 A V H > S+ 0 0 0 -4,-0.4 4,-0.7 1,-0.2 -2,-0.2 0.970 113.6 48.3 -63.3 -43.5 22.5 2.2 2.8 88 88 A Y H >< S+ 0 0 30 -4,-2.9 3,-1.2 1,-0.2 -1,-0.2 0.931 110.6 50.7 -59.8 -44.7 24.8 1.3 5.6 89 89 A D H 3< S+ 0 0 71 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.831 105.7 57.7 -65.2 -27.4 23.0 -2.0 6.2 90 90 A S H 3< S+ 0 0 44 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.673 95.8 86.4 -75.7 -14.0 23.4 -2.8 2.5 91 91 A L S << S- 0 0 5 -3,-1.2 2,-0.1 -4,-0.7 31,-0.0 -0.545 76.0-118.6 -92.7 158.4 27.2 -2.5 2.6 92 92 A D > - 0 0 57 -2,-0.2 4,-2.3 1,-0.0 5,-0.2 -0.224 45.9 -91.3 -77.0 170.2 30.0 -4.8 3.4 93 93 A A H > S+ 0 0 77 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.858 121.8 49.6 -57.2 -42.1 32.4 -3.9 6.4 94 94 A V H > S+ 0 0 28 1,-0.2 4,-1.7 2,-0.2 3,-0.2 0.971 114.0 45.1 -65.8 -49.0 35.0 -2.0 4.5 95 95 A R H > S+ 0 0 25 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.891 107.2 59.0 -64.5 -32.8 32.5 0.2 2.7 96 96 A R H X S+ 0 0 80 -4,-2.3 4,-2.5 1,-0.2 -1,-0.3 0.932 102.3 55.0 -60.0 -39.6 30.6 0.7 5.9 97 97 A A H X S+ 0 0 5 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.923 103.5 55.6 -60.1 -40.9 33.8 2.2 7.4 98 98 A A H X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.903 107.8 47.6 -59.5 -39.1 33.9 4.6 4.5 99 99 A L H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.931 110.6 51.0 -69.5 -39.1 30.5 5.9 5.3 100 100 A I H X S+ 0 0 8 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.931 107.5 56.0 -60.0 -42.9 31.3 6.2 9.1 101 101 A N H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.956 108.4 46.1 -52.9 -53.2 34.5 8.2 8.0 102 102 A M H X S+ 0 0 0 -4,-2.1 4,-3.4 1,-0.2 5,-0.3 0.918 112.2 50.5 -58.9 -44.9 32.3 10.7 6.0 103 103 A V H X S+ 0 0 9 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.887 109.8 50.6 -62.6 -36.1 29.8 11.0 8.9 104 104 A F H < S+ 0 0 29 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.949 115.0 44.1 -67.2 -42.3 32.7 11.7 11.4 105 105 A Q H < S+ 0 0 49 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.919 133.7 11.0 -71.2 -42.3 34.1 14.3 9.1 106 106 A M H X S- 0 0 52 -4,-3.4 4,-0.6 -5,-0.2 -3,-0.2 0.501 101.6-102.7-124.6 6.2 30.9 16.1 8.2 107 107 A G H X - 0 0 31 -4,-2.4 4,-3.0 -5,-0.3 5,-0.2 0.236 37.4 -86.9 88.8 145.1 27.9 15.1 10.2 108 108 A E H > S+ 0 0 65 1,-0.2 4,-3.1 2,-0.2 -1,-0.1 0.820 128.7 54.2 -58.7 -29.6 25.1 12.8 9.3 109 109 A T H > S+ 0 0 121 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.941 107.4 50.2 -65.8 -49.2 23.2 15.7 7.8 110 110 A G H >< S+ 0 0 26 -4,-0.6 3,-0.8 1,-0.2 -2,-0.2 0.959 116.0 44.0 -52.3 -53.4 26.2 16.5 5.6 111 111 A V H >< S+ 0 0 0 -4,-3.0 3,-2.5 1,-0.3 -2,-0.2 0.900 104.8 59.0 -62.0 -43.5 26.3 12.9 4.6 112 112 A A H 3< S+ 0 0 6 -4,-3.1 3,-0.4 1,-0.3 -1,-0.3 0.795 93.6 71.3 -60.6 -20.3 22.6 12.5 4.1 113 113 A G T << S+ 0 0 61 -4,-1.4 3,-0.3 -3,-0.8 -1,-0.3 0.543 77.4 79.2 -71.8 -4.5 22.9 15.3 1.5 114 114 A F <> + 0 0 29 -3,-2.5 4,-3.5 1,-0.2 5,-0.4 -0.138 59.1 148.3 -94.7 40.6 24.7 12.8 -0.8 115 115 A T H > + 0 0 79 -3,-0.4 4,-2.0 1,-0.3 -1,-0.2 0.828 66.4 43.7 -40.8 -49.9 21.4 11.4 -1.8 116 116 A N H > S+ 0 0 80 -3,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.896 114.6 47.2 -72.1 -40.1 22.3 10.4 -5.2 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.927 112.0 53.4 -64.5 -42.6 25.7 9.0 -4.4 118 118 A L H X S+ 0 0 8 -4,-3.5 4,-2.2 1,-0.2 -2,-0.2 0.912 106.0 51.7 -58.0 -44.1 24.1 7.1 -1.6 119 119 A R H X S+ 0 0 90 -4,-2.0 4,-1.6 -5,-0.4 -1,-0.2 0.933 107.0 53.9 -60.5 -39.5 21.5 5.6 -3.9 120 120 A M H <>S+ 0 0 31 -4,-2.0 5,-2.4 1,-0.2 4,-0.4 0.907 107.4 51.7 -62.8 -37.5 24.3 4.5 -6.3 121 121 A L H ><5S+ 0 0 0 -4,-2.3 3,-1.2 1,-0.2 -1,-0.2 0.913 106.8 52.3 -63.9 -39.8 26.0 2.7 -3.4 122 122 A Q H 3<5S+ 0 0 88 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.845 109.7 49.2 -65.3 -29.2 22.8 0.9 -2.5 123 123 A Q T 3<5S- 0 0 84 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.517 112.5-125.5 -84.3 -5.3 22.5 -0.2 -6.1 124 124 A K T < 5 + 0 0 99 -3,-1.2 2,-1.2 -4,-0.4 -3,-0.2 0.855 60.1 147.5 62.7 38.4 26.1 -1.3 -5.8 125 125 A R >< + 0 0 125 -5,-2.4 4,-2.9 1,-0.2 5,-0.2 -0.707 22.2 176.2-102.1 74.8 27.2 0.8 -8.9 126 126 A W H > + 0 0 51 -2,-1.2 4,-2.6 2,-0.2 -1,-0.2 0.875 69.6 44.5 -52.5 -50.6 30.6 1.4 -7.4 127 127 A D H > S+ 0 0 109 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.936 116.2 48.1 -62.6 -44.7 32.3 3.3 -10.2 128 128 A E H > S+ 0 0 104 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.873 110.4 50.7 -62.0 -44.1 29.3 5.4 -10.7 129 129 A A H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.940 109.2 52.5 -62.1 -44.8 28.9 6.2 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.883 108.3 49.6 -60.6 -37.3 32.5 7.1 -6.9 131 131 A V H < S+ 0 0 95 -4,-2.0 4,-0.4 1,-0.2 3,-0.3 0.930 112.4 48.6 -66.6 -40.9 32.2 9.6 -9.8 132 132 A N H >< S+ 0 0 36 -4,-2.1 3,-1.4 1,-0.2 -2,-0.2 0.873 104.0 57.7 -66.5 -39.8 29.2 11.1 -8.3 133 133 A F H 3< S+ 0 0 0 -4,-2.7 6,-0.4 1,-0.3 -1,-0.2 0.816 99.6 62.5 -60.8 -29.5 30.8 11.6 -4.8 134 134 A A T 3< S+ 0 0 28 -4,-1.0 2,-1.8 -3,-0.3 -1,-0.3 0.640 82.6 80.5 -71.7 -15.2 33.5 13.6 -6.4 135 135 A K S < S+ 0 0 158 -3,-1.4 2,-0.3 -4,-0.4 -1,-0.2 -0.535 80.6 95.2 -91.6 74.0 31.1 16.2 -7.6 136 136 A S S > S- 0 0 18 -2,-1.8 4,-2.2 1,-0.1 5,-0.2 -0.998 84.8-115.8-159.1 157.3 31.0 17.9 -4.2 137 137 A R H > S+ 0 0 145 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.906 115.1 63.5 -59.0 -41.5 32.3 20.7 -2.2 138 138 A W H > S+ 0 0 18 1,-0.2 4,-2.5 2,-0.2 8,-0.2 0.929 106.1 42.5 -46.9 -51.6 33.7 17.9 0.1 139 139 A Y H 4 S+ 0 0 63 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.914 114.8 50.4 -66.1 -43.2 35.9 16.6 -2.7 140 140 A N H < S+ 0 0 108 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.909 116.2 39.9 -64.4 -40.3 37.0 20.0 -3.8 141 141 A Q H < S+ 0 0 111 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.853 132.6 22.3 -79.4 -36.3 38.0 21.2 -0.3 142 142 A T S X S+ 0 0 19 -4,-2.5 4,-2.5 -5,-0.3 -1,-0.2 -0.558 74.6 160.5-128.1 71.7 39.6 18.0 1.0 143 143 A P H > + 0 0 46 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.883 68.9 49.4 -64.3 -40.2 40.6 16.2 -2.2 144 144 A N H > S+ 0 0 101 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.945 115.6 43.1 -67.5 -41.9 43.2 13.8 -0.9 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.946 114.3 50.7 -63.4 -48.7 41.1 12.6 1.9 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-3.3 1,-0.3 5,-0.3 0.909 107.1 55.2 -55.7 -43.1 38.0 12.4 -0.3 147 147 A K H X S+ 0 0 93 -4,-2.7 4,-2.5 1,-0.2 -1,-0.3 0.899 107.9 49.6 -59.5 -38.4 39.9 10.4 -2.8 148 148 A R H X S+ 0 0 53 -4,-1.9 4,-1.7 2,-0.2 12,-0.2 0.934 113.5 43.7 -65.5 -45.0 40.8 7.9 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.922 113.9 51.0 -66.2 -41.6 37.3 7.5 1.1 150 150 A I H X S+ 0 0 15 -4,-3.3 4,-2.5 1,-0.2 -1,-0.2 0.891 107.6 53.5 -61.9 -40.6 36.0 7.3 -2.5 151 151 A T H X S+ 0 0 39 -4,-2.5 4,-2.2 -5,-0.3 6,-0.4 0.871 107.4 52.6 -61.5 -35.5 38.5 4.6 -3.4 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 5,-0.3 0.915 110.4 45.8 -66.8 -45.5 37.3 2.7 -0.4 153 153 A F H < S+ 0 0 1 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.875 114.2 50.2 -66.6 -35.7 33.7 2.9 -1.6 154 154 A R H < S+ 0 0 104 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.919 125.2 22.5 -67.9 -41.3 34.6 2.0 -5.1 155 155 A T H < S- 0 0 37 -4,-2.2 -2,-0.2 2,-0.2 -3,-0.2 0.656 85.1-133.6-102.4 -23.7 36.7 -1.1 -4.4 156 156 A G S < S+ 0 0 18 -4,-2.5 2,-0.3 1,-0.3 -62,-0.2 0.771 74.9 105.0 72.0 21.6 35.6 -2.4 -1.0 157 157 A T S S- 0 0 45 -6,-0.4 3,-0.3 -5,-0.3 -1,-0.3 -0.831 78.4-123.8-127.5 170.3 39.4 -2.7 -0.1 158 158 A W >> + 0 0 37 -2,-0.3 3,-2.1 1,-0.2 4,-1.2 0.056 67.9 125.5-100.4 26.3 41.7 -0.7 2.1 159 159 A D T 34 + 0 0 104 1,-0.3 3,-0.4 2,-0.2 -1,-0.2 0.845 67.3 57.2 -56.0 -34.2 44.1 -0.0 -0.7 160 160 A A T 34 S+ 0 0 25 -3,-0.3 -1,-0.3 -12,-0.2 -2,-0.1 0.619 113.7 39.5 -72.9 -10.8 44.0 3.7 -0.3 161 161 A Y T X4 S+ 0 0 2 -3,-2.1 3,-1.3 -13,-0.1 2,-0.2 0.429 89.2 105.4-113.9 -9.0 45.1 3.4 3.3 162 162 A K T 3< S+ 0 0 94 -4,-1.2 0, 0.0 -3,-0.4 0, 0.0 -0.563 89.5 15.4 -77.2 139.6 47.6 0.7 3.0 163 163 A N T 3 0 0 169 1,-0.3 -1,-0.3 -2,-0.2 -4,-0.0 0.679 360.0 360.0 72.0 20.8 51.2 2.0 3.2 164 164 A L < 0 0 121 -3,-1.3 -1,-0.3 0, 0.0 -3,-0.0 -0.906 360.0 360.0-112.1 360.0 50.0 5.3 4.7