==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-APR-02 1LI3 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR B.Q.WEI,W.A.BAASE,L.H.WEAVER,B.W.MATTHEWS,B.K.SHOICHET . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8787.0 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 . 6 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 52.5 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 1 2 0 0 1 1 0 0 0 0 1 0 0 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 85 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 147.1 43.4 -1.9 9.2 2 2 A N > - 0 0 72 95,-0.0 4,-2.1 92,-0.0 5,-0.2 -0.898 360.0 -83.2-149.4 176.4 40.3 -0.8 11.0 3 3 A I H > S+ 0 0 22 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.838 122.9 51.9 -54.6 -43.5 38.2 2.4 11.4 4 4 A F H > S+ 0 0 72 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.949 112.4 43.3 -64.8 -45.5 40.5 3.8 14.2 5 5 A E H > S+ 0 0 93 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.833 115.4 51.9 -65.1 -36.9 43.7 3.4 12.3 6 6 A M H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.933 114.5 39.2 -70.5 -48.2 42.1 4.7 9.3 7 7 A L H X S+ 0 0 0 -4,-3.0 4,-3.0 1,-0.2 5,-0.4 0.873 110.4 60.0 -73.1 -28.4 40.7 7.8 10.8 8 8 A R H X S+ 0 0 104 -4,-2.4 4,-1.3 -5,-0.3 -1,-0.2 0.898 107.3 48.2 -62.1 -34.0 43.8 8.3 12.9 9 9 A I H < S+ 0 0 84 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.923 115.1 43.6 -69.1 -44.6 45.6 8.5 9.6 10 10 A D H < S+ 0 0 20 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.822 123.5 33.3 -73.6 -26.3 43.1 11.0 8.1 11 11 A E H < S- 0 0 39 -4,-3.0 19,-0.4 -5,-0.1 -1,-0.2 0.641 90.7-151.3-104.3 -19.5 42.7 13.3 11.2 12 12 A G < - 0 0 26 -4,-1.3 2,-0.4 -5,-0.4 -1,-0.1 -0.132 25.1 -88.2 70.3-173.8 46.2 13.2 12.8 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.991 42.9 172.7-136.3 122.1 46.6 13.7 16.6 14 14 A R E -A 28 0A 138 14,-1.6 14,-2.4 -2,-0.4 4,-0.1 -0.998 19.8-164.4-134.2 129.4 47.1 17.1 18.3 15 15 A L E S+ 0 0 64 -2,-0.4 43,-2.5 12,-0.2 2,-0.3 0.432 72.9 63.7 -90.8 -0.2 47.1 17.6 22.0 16 16 A K E S-C 57 0B 127 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.914 100.9 -83.8-124.2 146.5 46.6 21.4 21.9 17 17 A I E + 0 0 10 39,-1.8 2,-0.3 -2,-0.3 10,-0.2 -0.187 59.7 173.8 -47.2 133.8 43.7 23.4 20.6 18 18 A Y E -A 26 0A 21 8,-3.0 8,-3.7 -4,-0.1 2,-0.4 -0.951 33.4-112.6-137.7 165.5 44.0 23.8 16.8 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.782 33.2-139.3 -98.6 140.4 42.1 25.1 13.9 20 20 A D > - 0 0 48 4,-2.0 3,-2.4 -2,-0.4 -1,-0.1 -0.257 39.5 -79.7 -87.2-173.9 40.9 22.6 11.4 21 21 A T T 3 S+ 0 0 118 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.730 134.6 48.4 -59.7 -21.5 40.8 22.9 7.6 22 22 A E T 3 S- 0 0 86 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.445 124.2-103.2 -96.2 -3.8 37.6 25.0 7.9 23 23 A G S < S+ 0 0 33 -3,-2.4 2,-0.4 1,-0.3 -2,-0.1 0.539 74.7 138.9 92.8 17.4 39.1 27.2 10.6 24 24 A Y - 0 0 68 1,-0.1 -4,-2.0 -5,-0.0 -1,-0.3 -0.734 59.6-101.8-103.0 145.1 37.4 25.7 13.6 25 25 A Y E +AB 19 34A 28 9,-0.6 8,-3.7 11,-0.5 9,-1.3 -0.268 55.2 151.3 -58.0 124.7 38.6 24.9 16.9 26 26 A T E -AB 18 32A 4 -8,-3.7 -8,-3.0 6,-0.3 2,-0.3 -0.890 20.5-166.4-147.2 172.0 39.3 21.3 17.3 27 27 A I E > + B 0 31A 0 4,-1.7 4,-2.6 -2,-0.3 2,-0.2 -0.984 48.4 5.7-158.2 169.2 41.6 19.0 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.4 -14,-1.6 -2,-0.3 2,-1.0 -0.378 122.2 -3.0 61.7-126.3 42.9 15.5 19.7 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -16,-0.1 -0.635 129.1 -53.5-103.1 72.3 41.9 13.2 16.8 30 30 A G T 4 S+ 0 0 14 -2,-1.0 2,-0.9 -19,-0.4 -2,-0.2 0.757 84.2 162.0 70.0 28.1 39.7 15.4 14.8 31 31 A H E < -B 27 0A 34 -4,-2.6 -4,-1.7 -20,-0.1 -1,-0.2 -0.592 30.8-144.3 -90.7 111.6 37.4 16.4 17.7 32 32 A L E -B 26 0A 75 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.416 19.7-179.9 -68.5 133.4 35.5 19.5 16.8 33 33 A L E - 0 0 15 -8,-3.7 2,-0.3 1,-0.4 -7,-0.2 0.853 58.0 -24.3-101.3 -44.9 35.0 21.7 19.8 34 34 A T E -B 25 0A 28 -9,-1.3 -9,-0.6 2,-0.1 -1,-0.4 -0.980 36.4-137.6-164.1 156.5 33.1 24.6 18.4 35 35 A K S S+ 0 0 144 -2,-0.3 -1,-0.1 -11,-0.1 -9,-0.0 0.558 75.3 104.5 -95.1 -8.2 32.3 26.6 15.3 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.5 2,-0.1 -2,-0.1 -0.413 73.8-133.2 -73.2 150.5 32.6 29.8 17.1 37 37 A P S S+ 0 0 113 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.494 74.7 107.9 -80.9 -7.8 35.6 32.0 16.6 38 38 A S > - 0 0 63 1,-0.2 4,-2.3 2,-0.0 3,-0.3 -0.607 53.9-162.0 -79.3 108.7 36.0 32.6 20.4 39 39 A L H > S+ 0 0 60 -2,-0.7 4,-2.0 1,-0.2 -1,-0.2 0.786 93.9 58.5 -59.8 -23.5 39.0 30.7 21.7 40 40 A N H > S+ 0 0 106 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.879 103.1 51.5 -76.4 -34.8 37.4 31.1 25.1 41 41 A A H > S+ 0 0 33 -3,-0.3 4,-2.2 1,-0.2 -2,-0.2 0.919 109.9 50.6 -62.6 -40.1 34.4 29.3 23.9 42 42 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.928 108.8 49.8 -68.4 -41.1 36.5 26.6 22.7 43 43 A K H X S+ 0 0 47 -4,-2.0 4,-2.4 1,-0.2 11,-0.3 0.899 110.3 51.8 -65.4 -34.7 38.4 26.2 26.0 44 44 A S H X S+ 0 0 71 -4,-2.1 4,-3.0 2,-0.2 5,-0.2 0.958 109.3 48.7 -61.6 -50.9 35.2 26.0 27.8 45 45 A E H X S+ 0 0 65 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.905 110.0 53.7 -58.7 -40.8 33.9 23.3 25.6 46 46 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 5,-0.4 0.949 109.0 46.5 -61.0 -47.0 37.1 21.5 26.0 47 47 A D H X>S+ 0 0 35 -4,-2.4 4,-2.6 1,-0.2 5,-1.5 0.892 112.3 51.4 -63.7 -41.2 36.8 21.6 29.8 48 48 A K H <5S+ 0 0 144 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.881 112.3 46.5 -60.4 -42.5 33.2 20.5 29.7 49 49 A A H <5S+ 0 0 44 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.893 120.5 36.9 -69.5 -37.4 34.2 17.6 27.4 50 50 A I H <5S- 0 0 37 -4,-2.7 -2,-0.2 2,-0.3 -3,-0.2 0.752 103.4-123.6 -87.8 -30.1 37.1 16.4 29.5 51 51 A G T <5S+ 0 0 67 -4,-2.6 2,-0.3 -5,-0.4 -3,-0.2 0.873 77.9 62.4 91.5 32.4 35.8 17.1 32.9 52 52 A R S - 0 0 8 -2,-0.9 3,-1.1 -11,-0.3 -1,-0.2 0.737 31.5-145.1 -91.4 -31.4 42.5 21.8 30.6 55 55 A N T 3 S- 0 0 126 1,-0.2 -2,-0.1 -12,-0.2 3,-0.1 0.938 74.6 -55.4 61.2 42.3 43.8 25.2 29.6 56 56 A G T 3 S+ 0 0 3 -13,-0.2 -39,-1.8 1,-0.1 2,-0.4 0.552 119.8 99.5 69.5 7.6 43.7 24.1 25.9 57 57 A V B < +C 16 0B 74 -3,-1.1 2,-0.2 -41,-0.2 -41,-0.2 -0.986 45.1 177.8-129.2 139.4 45.8 21.0 26.4 58 58 A I - 0 0 6 -43,-2.5 2,-0.2 -2,-0.4 -30,-0.1 -0.748 27.5-108.6-129.9 173.7 44.9 17.3 26.9 59 59 A T > - 0 0 60 -2,-0.2 4,-2.7 1,-0.1 5,-0.1 -0.586 32.3-109.7 -95.4 165.0 46.7 14.0 27.3 60 60 A K H > S+ 0 0 114 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.879 121.5 50.4 -58.8 -41.4 46.9 11.2 24.7 61 61 A D H > S+ 0 0 116 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.915 110.1 50.6 -65.8 -37.1 44.6 9.0 26.7 62 62 A E H > S+ 0 0 41 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.916 111.6 48.0 -64.0 -45.0 42.2 12.0 26.9 63 63 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -34,-0.4 0.892 111.8 49.7 -63.1 -40.4 42.4 12.3 23.2 64 64 A E H X S+ 0 0 69 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.798 108.8 53.0 -70.0 -30.3 41.9 8.6 22.7 65 65 A K H X S+ 0 0 135 -4,-2.0 4,-2.2 -5,-0.2 5,-0.2 0.949 107.8 48.7 -69.1 -47.2 38.9 8.7 24.9 66 66 A L H X S+ 0 0 5 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.942 110.9 54.6 -56.3 -40.8 37.3 11.5 23.0 67 67 A F H X S+ 0 0 11 -4,-2.1 4,-2.5 1,-0.2 5,-0.3 0.917 105.9 49.8 -61.3 -43.4 38.0 9.5 19.8 68 68 A N H X S+ 0 0 88 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.920 111.4 47.8 -61.6 -46.2 36.3 6.4 21.0 69 69 A Q H X S+ 0 0 98 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.884 111.8 52.5 -67.1 -29.7 33.3 8.2 22.0 70 70 A D H X S+ 0 0 34 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.890 108.3 47.6 -73.8 -33.1 33.3 10.0 18.7 71 71 A V H X S+ 0 0 9 -4,-2.5 4,-2.3 2,-0.2 5,-0.3 0.921 113.4 50.8 -69.9 -44.7 33.5 6.9 16.5 72 72 A D H X S+ 0 0 86 -4,-2.1 4,-2.5 -5,-0.3 5,-0.3 0.951 108.2 49.4 -56.4 -46.7 30.8 5.4 18.5 73 73 A A H X S+ 0 0 60 -4,-2.2 4,-3.3 1,-0.2 -1,-0.2 0.911 109.5 54.0 -60.5 -41.7 28.6 8.3 18.2 74 74 A A H X S+ 0 0 11 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.939 109.2 45.4 -58.0 -52.1 29.1 8.4 14.5 75 75 A V H X S+ 0 0 31 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.926 115.3 48.6 -56.5 -44.0 28.1 4.7 13.9 76 76 A R H X S+ 0 0 139 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.925 106.2 56.1 -66.1 -40.9 25.2 5.2 16.1 77 77 A G H X S+ 0 0 13 -4,-3.3 4,-1.0 -5,-0.3 3,-0.3 0.938 109.1 49.5 -58.4 -37.3 24.2 8.3 14.3 78 78 A I H >< S+ 0 0 4 -4,-2.3 3,-1.0 1,-0.2 7,-0.5 0.964 108.9 49.0 -64.1 -47.6 24.2 6.2 11.1 79 79 A L H 3< S+ 0 0 66 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.712 109.5 54.0 -68.7 -18.1 22.1 3.5 12.5 80 80 A R H 3< S+ 0 0 206 -4,-1.5 2,-0.4 -3,-0.3 -1,-0.3 0.632 89.9 90.1 -89.4 -19.8 19.6 6.0 13.7 81 81 A N > S+ 0 0 11 -6,-0.2 4,-2.5 2,-0.1 3,-1.0 0.889 100.1 66.2 -78.7 -51.9 21.4 6.1 6.1 85 85 A K H 3X S+ 0 0 77 -4,-2.5 4,-2.9 -7,-0.5 5,-0.2 0.856 99.5 51.3 -44.8 -49.3 20.9 2.7 7.8 86 86 A P H 3> S+ 0 0 57 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.849 111.7 47.5 -64.9 -30.8 19.8 0.8 4.8 87 87 A V H <> S+ 0 0 6 -3,-1.0 4,-0.7 -4,-0.4 3,-0.5 0.931 113.0 48.4 -72.4 -50.0 22.7 2.0 2.8 88 88 A Y H >< S+ 0 0 28 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.927 109.1 52.1 -56.3 -47.0 25.1 1.2 5.5 89 89 A D H 3< S+ 0 0 70 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.799 103.4 60.2 -68.0 -19.5 23.7 -2.3 6.1 90 90 A S H 3< S+ 0 0 38 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.639 93.3 85.4 -79.9 -11.5 24.0 -3.1 2.5 91 91 A L S << S- 0 0 7 -3,-1.2 2,-0.0 -4,-0.7 31,-0.0 -0.560 77.8-114.7 -90.6 162.8 27.7 -2.6 2.4 92 92 A D > - 0 0 57 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.219 44.6 -89.1 -80.2 176.2 30.6 -5.0 3.2 93 93 A A H > S+ 0 0 75 2,-0.2 4,-1.0 1,-0.2 -2,-0.1 0.831 121.4 46.2 -61.2 -39.4 33.0 -4.3 6.1 94 94 A V H >> S+ 0 0 26 62,-0.2 4,-1.6 2,-0.2 3,-1.1 0.958 113.0 48.4 -68.5 -51.2 35.6 -2.1 4.3 95 95 A R H 3> S+ 0 0 24 1,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.859 105.1 60.8 -58.4 -34.5 33.1 0.1 2.6 96 96 A R H 3X S+ 0 0 79 -4,-2.1 4,-2.0 1,-0.2 -1,-0.3 0.877 100.9 55.0 -61.1 -31.9 31.3 0.5 5.9 97 97 A C H > S+ 0 0 114 2,-0.2 3,-1.1 -3,-0.2 4,-0.6 0.936 102.1 48.3 -78.3 -57.7 24.0 16.3 8.1 110 110 A G H >< S+ 0 0 34 -4,-1.1 3,-0.7 1,-0.3 -2,-0.2 0.855 113.8 51.4 -53.1 -37.5 26.8 17.0 5.6 111 111 A V G >< S+ 0 0 5 -4,-1.8 3,-1.7 1,-0.2 -1,-0.3 0.679 88.1 76.5 -77.1 -23.3 26.2 13.5 4.3 112 112 A A G X4 S+ 0 0 50 -3,-1.1 3,-0.6 -4,-0.5 -1,-0.2 0.820 88.3 62.8 -63.4 -23.8 22.5 13.8 3.8 113 113 A G G << S+ 0 0 70 -3,-0.7 3,-0.4 -4,-0.6 -1,-0.3 0.436 84.5 78.3 -76.0 -2.8 23.2 15.8 0.6 114 114 A F G <> + 0 0 25 -3,-1.7 4,-2.8 1,-0.2 3,-0.4 0.180 56.2 130.6 -90.8 19.7 25.0 12.8 -1.0 115 115 A T H <> + 0 0 60 -3,-0.6 4,-2.1 1,-0.3 -1,-0.2 0.856 69.0 48.9 -44.2 -43.9 21.6 11.2 -1.8 116 116 A N H > S+ 0 0 114 -3,-0.4 4,-1.8 1,-0.2 -1,-0.3 0.932 113.0 46.1 -64.9 -44.7 22.5 10.5 -5.3 117 117 A S H > S+ 0 0 0 -3,-0.4 4,-2.5 1,-0.2 5,-0.3 0.879 108.8 58.0 -67.5 -32.5 25.7 8.9 -4.4 118 118 A L H X S+ 0 0 15 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.916 104.3 51.0 -63.1 -39.9 24.0 6.9 -1.7 119 119 A R H X S+ 0 0 76 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.916 109.7 49.7 -64.4 -38.5 21.7 5.4 -4.1 120 120 A M H <>S+ 0 0 41 -4,-1.8 5,-2.0 1,-0.2 4,-0.4 0.895 110.7 49.6 -69.0 -37.7 24.5 4.4 -6.4 121 121 A L H ><5S+ 0 0 5 -4,-2.5 3,-1.6 1,-0.2 -1,-0.2 0.913 108.8 52.8 -64.1 -40.6 26.4 2.8 -3.5 122 122 A Q H 3<5S+ 0 0 74 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.941 108.9 50.2 -63.2 -32.8 23.3 1.0 -2.5 123 123 A Q T 3<5S- 0 0 113 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.515 113.6-121.6 -78.9 -6.0 23.0 -0.3 -6.0 124 124 A K T < 5 + 0 0 102 -3,-1.6 2,-1.4 -4,-0.4 -3,-0.2 0.751 63.0 145.1 68.2 29.0 26.7 -1.4 -5.9 125 125 A R >< + 0 0 103 -5,-2.0 4,-2.7 1,-0.2 -1,-0.2 -0.635 22.0 173.2 -94.7 78.6 27.6 0.7 -8.9 126 126 A W H > + 0 0 48 -2,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.863 68.6 45.3 -58.6 -55.4 31.1 1.5 -7.6 127 127 A D H > S+ 0 0 103 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.924 115.4 50.4 -61.8 -37.4 32.7 3.3 -10.4 128 128 A E H > S+ 0 0 113 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.919 109.5 49.2 -65.4 -46.1 29.6 5.4 -10.9 129 129 A A H X S+ 0 0 1 -4,-2.7 4,-3.5 2,-0.2 5,-0.2 0.902 107.7 56.2 -57.1 -41.3 29.4 6.3 -7.2 130 130 A A H X S+ 0 0 4 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.896 109.0 45.8 -61.7 -44.1 33.1 7.3 -7.2 131 131 A V H X S+ 0 0 81 -4,-1.8 4,-0.7 2,-0.2 3,-0.5 0.935 113.9 48.3 -65.9 -45.1 32.6 9.7 -9.9 132 132 A N H >< S+ 0 0 32 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.934 108.0 55.5 -61.8 -40.4 29.4 11.2 -8.3 133 133 A L H 3< S+ 0 0 1 -4,-3.5 6,-0.4 1,-0.3 -1,-0.2 0.849 101.5 58.2 -62.1 -28.6 31.1 11.5 -5.0 134 134 A A H 3< S+ 0 0 26 -4,-1.1 2,-2.0 -3,-0.5 -1,-0.3 0.688 85.7 81.2 -76.4 -21.1 34.0 13.6 -6.5 135 135 A K S << S+ 0 0 161 -3,-1.2 2,-0.3 -4,-0.7 -1,-0.2 -0.528 81.3 94.2 -83.1 68.6 31.5 16.2 -7.7 136 136 A S S > S- 0 0 17 -2,-2.0 4,-2.3 1,-0.1 5,-0.2 -0.999 85.1-114.0-158.0 158.3 31.3 17.9 -4.4 137 137 A R H > S+ 0 0 146 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.919 114.6 60.5 -61.5 -39.9 32.6 20.6 -2.2 138 138 A W H > S+ 0 0 17 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.916 107.0 41.9 -52.8 -53.3 34.0 17.9 0.0 139 139 A Y H 4 S+ 0 0 68 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.940 116.9 49.6 -64.8 -39.2 36.3 16.4 -2.6 140 140 A N H < S+ 0 0 105 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.782 114.7 44.6 -70.3 -23.9 37.3 20.0 -3.8 141 141 A Q H < S+ 0 0 100 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.897 131.6 16.9 -87.4 -36.8 38.1 21.1 -0.3 142 142 A T S X S+ 0 0 25 -4,-2.3 4,-2.9 -5,-0.2 5,-0.3 -0.599 74.3 163.3-132.8 69.4 40.0 18.1 1.0 143 143 A P H > + 0 0 48 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.839 68.4 54.4 -56.6 -43.5 41.0 16.3 -2.1 144 144 A N H > S+ 0 0 112 2,-0.2 4,-1.3 1,-0.2 -2,-0.1 0.966 116.6 37.8 -62.7 -45.6 43.7 14.1 -0.8 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.2 1,-0.2 3,-0.4 0.937 114.5 54.6 -66.2 -50.7 41.6 12.6 2.0 146 146 A A H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 5,-0.3 0.920 105.9 56.1 -53.7 -35.3 38.4 12.5 -0.2 147 147 A K H X S+ 0 0 92 -4,-2.6 4,-2.7 -5,-0.3 -1,-0.2 0.903 105.4 48.3 -62.2 -43.0 40.5 10.5 -2.7 148 148 A R H X S+ 0 0 68 -4,-1.3 4,-1.2 -3,-0.4 -1,-0.2 0.874 114.4 46.2 -65.1 -39.4 41.4 7.8 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.911 112.4 50.2 -71.2 -40.9 37.8 7.5 1.0 150 150 A I H X S+ 0 0 14 -4,-2.6 4,-2.3 -5,-0.3 -2,-0.2 0.903 110.5 49.6 -62.9 -41.6 36.4 7.4 -2.6 151 151 A T H X S+ 0 0 53 -4,-2.7 4,-2.5 -5,-0.3 6,-0.4 0.834 108.7 54.7 -64.5 -31.9 38.9 4.7 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.2 4,-2.4 1,-0.2 -2,-0.2 0.923 111.5 42.5 -67.7 -46.8 37.9 2.9 -0.5 153 153 A F H < S+ 0 0 4 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.877 114.8 51.7 -70.1 -28.7 34.3 2.9 -1.6 154 154 A R H < S+ 0 0 82 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.907 123.3 25.6 -71.5 -38.8 35.2 2.2 -5.2 155 155 A T H < S- 0 0 61 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.572 83.7-135.8 -99.9 -21.9 37.3 -0.8 -4.4 156 156 A G S < S+ 0 0 17 -4,-2.4 2,-0.2 -5,-0.3 -62,-0.2 0.766 74.6 99.2 68.0 16.7 36.2 -2.4 -1.2 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.2 -0.811 79.8-119.1-128.4 171.8 40.0 -2.7 -0.2 158 158 A W S >> S+ 0 0 49 -2,-0.2 3,-1.4 1,-0.2 4,-0.6 0.106 71.8 120.3 -99.3 22.5 42.5 -0.7 2.0 159 159 A D G >4 + 0 0 116 1,-0.3 3,-0.7 2,-0.2 -1,-0.2 0.791 67.1 57.8 -58.2 -30.2 44.8 0.1 -0.8 160 160 A A G 34 S+ 0 0 31 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.706 110.8 45.2 -75.6 -16.2 44.5 3.9 -0.5 161 161 A Y G <4 0 0 7 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.514 360.0 360.0-101.3 -2.7 45.6 3.5 3.0 162 162 A K << 0 0 205 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.1 -0.424 360.0 360.0 65.4 360.0 48.4 1.1 1.8