==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 08-FEB-08 3C82 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTERIOPHAGE T4; . AUTHOR B.H.M.MOOERS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8723.0 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 . 8 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 52.4 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 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 68 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 139.3 43.7 -1.8 9.0 2 2 A N > - 0 0 66 95,-0.0 4,-2.4 1,-0.0 3,-0.4 -0.915 360.0 -80.9-150.8 174.9 40.5 -0.7 10.8 3 3 A I H > S+ 0 0 21 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.821 123.6 51.8 -54.0 -36.8 38.4 2.5 11.4 4 4 A F H > S+ 0 0 73 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.907 112.4 43.7 -70.1 -41.6 40.7 3.8 14.1 5 5 A E H > S+ 0 0 98 -3,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.879 113.6 54.4 -69.2 -36.4 43.9 3.5 12.1 6 6 A M H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.960 113.1 39.7 -60.3 -53.9 42.1 4.9 9.1 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.4 0.817 109.5 60.5 -68.6 -29.9 40.9 8.0 10.9 8 8 A R H X S+ 0 0 91 -4,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.908 107.8 46.4 -64.1 -38.4 44.2 8.4 12.7 9 9 A I H < S+ 0 0 55 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.940 116.9 43.1 -68.1 -45.4 45.9 8.7 9.3 10 10 A D H < S+ 0 0 21 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.808 125.7 30.2 -70.7 -33.2 43.3 11.2 8.0 11 11 A E H < S- 0 0 44 -4,-2.7 19,-0.4 -5,-0.1 -1,-0.2 0.630 90.3-154.5-101.5 -20.9 43.0 13.4 11.0 12 12 A G < - 0 0 26 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.1 -0.125 25.8 -85.9 70.5-173.6 46.4 13.2 12.7 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.974 43.2 170.7-139.1 122.0 46.9 13.8 16.4 14 14 A R E -A 28 0A 147 14,-1.5 14,-2.3 -2,-0.4 4,-0.1 -0.999 19.7-161.8-134.0 131.5 47.5 17.2 18.1 15 15 A L E S+ 0 0 59 -2,-0.4 43,-2.4 12,-0.2 2,-0.3 0.434 74.1 61.8 -93.5 -0.3 47.5 17.7 21.9 16 16 A K E S-C 57 0B 141 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.928 101.4 -83.7-125.5 150.0 46.9 21.5 21.8 17 17 A I E + 0 0 30 39,-1.8 2,-0.3 -2,-0.3 10,-0.2 -0.203 58.8 169.5 -50.6 134.1 43.9 23.4 20.4 18 18 A Y E -A 26 0A 25 8,-3.0 8,-3.1 -4,-0.1 2,-0.5 -0.880 36.0-105.8-141.1 172.8 44.3 23.9 16.7 19 19 A K E -A 25 0A 120 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.892 33.4-140.6-104.4 134.0 42.2 25.1 13.7 20 20 A D > - 0 0 48 4,-2.5 3,-1.9 -2,-0.5 -1,-0.0 -0.103 42.8 -76.4 -79.6-172.2 41.0 22.5 11.3 21 21 A T T 3 S+ 0 0 94 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.713 134.6 47.9 -59.7 -23.3 40.9 22.9 7.6 22 22 A E T 3 S- 0 0 74 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.388 123.1-102.9 -97.2 0.6 37.8 25.0 7.8 23 23 A G S < S+ 0 0 33 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.572 74.2 140.5 90.5 12.5 39.3 27.2 10.5 24 24 A Y - 0 0 73 1,-0.1 -4,-2.5 9,-0.0 -1,-0.3 -0.694 60.2-100.9 -93.4 144.7 37.4 25.7 13.5 25 25 A Y E +AB 19 34A 31 9,-0.7 8,-3.0 11,-0.4 9,-1.3 -0.378 55.7 159.1 -63.4 127.6 38.9 25.0 16.9 26 26 A T E -AB 18 32A 3 -8,-3.1 -8,-3.0 6,-0.3 2,-0.3 -0.895 18.7-171.0-144.8 165.9 39.7 21.4 17.2 27 27 A I E > + B 0 31A 0 4,-1.5 4,-2.2 -2,-0.3 -12,-0.2 -0.981 50.3 7.4-156.7 166.9 41.9 19.1 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.5 -2,-0.3 2,-1.1 -0.355 123.3 -7.2 62.6-133.6 43.1 15.5 19.6 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.666 127.8 -52.5-100.0 77.5 42.2 13.3 16.7 30 30 A G T 4 S+ 0 0 15 -2,-1.1 2,-1.1 -19,-0.4 -2,-0.2 0.747 83.1 161.3 66.6 26.5 39.9 15.6 14.7 31 31 A H E < -B 27 0A 31 -4,-2.2 -4,-1.5 1,-0.0 -1,-0.2 -0.669 32.2-144.5 -83.7 101.2 37.6 16.4 17.7 32 32 A L E -B 26 0A 71 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.406 18.8-177.2 -63.2 131.7 35.8 19.6 16.7 33 33 A L E - 0 0 13 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.848 58.7 -27.4 -98.3 -44.0 35.3 21.8 19.7 34 34 A T E -B 25 0A 27 -9,-1.3 -9,-0.7 2,-0.1 -1,-0.4 -0.972 34.3-136.9-169.0 155.8 33.3 24.6 18.3 35 35 A K S S+ 0 0 141 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.473 74.8 109.4 -95.9 -4.4 32.5 26.6 15.2 36 36 A S S S- 0 0 43 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.422 74.5-130.6 -71.8 147.1 32.6 29.9 17.2 37 37 A P S S+ 0 0 116 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.551 76.3 107.2 -75.4 -6.1 35.6 32.1 16.5 38 38 A S > - 0 0 43 1,-0.2 4,-2.3 2,-0.0 5,-0.1 -0.630 55.2-161.7 -81.7 118.9 36.3 32.5 20.3 39 39 A L H > S+ 0 0 70 -2,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.790 96.8 56.0 -64.7 -24.9 39.3 30.6 21.6 40 40 A N H > S+ 0 0 119 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.928 103.6 50.2 -73.3 -43.8 37.7 31.0 25.0 41 41 A A H > S+ 0 0 32 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.931 112.5 50.8 -56.7 -43.0 34.5 29.4 23.9 42 42 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.912 108.2 49.6 -61.2 -45.4 36.8 26.6 22.6 43 43 A K H X S+ 0 0 59 -4,-2.3 4,-2.1 1,-0.2 11,-0.3 0.882 110.6 51.8 -64.3 -33.7 38.6 26.3 25.9 44 44 A S H X S+ 0 0 72 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.945 108.4 49.5 -67.1 -46.4 35.3 26.1 27.7 45 45 A E H X S+ 0 0 66 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.908 109.9 53.5 -58.4 -42.8 34.1 23.4 25.4 46 46 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.934 107.8 47.7 -58.4 -50.2 37.3 21.5 26.0 47 47 A D H X>S+ 0 0 34 -4,-2.1 4,-3.1 1,-0.2 5,-1.3 0.912 113.0 49.6 -58.5 -41.6 37.1 21.5 29.8 48 48 A K H <5S+ 0 0 143 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.887 112.3 47.8 -65.2 -39.0 33.5 20.4 29.6 49 49 A A H <5S+ 0 0 41 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.870 121.6 34.7 -69.7 -38.4 34.4 17.5 27.3 50 50 A I H <5S- 0 0 36 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.787 103.9-125.3 -89.0 -30.9 37.4 16.4 29.3 51 51 A G T <5S+ 0 0 65 -4,-3.1 2,-0.3 1,-0.3 -3,-0.2 0.786 77.1 68.8 89.7 32.0 36.0 17.1 32.8 52 52 A R S - 0 0 6 -2,-0.9 3,-1.2 -11,-0.3 -1,-0.2 0.686 33.4-145.8 -95.9 -25.0 42.8 21.9 30.6 55 55 A N T 3 S- 0 0 119 1,-0.3 3,-0.1 -12,-0.2 -12,-0.1 0.588 75.2 -50.9 62.5 18.6 43.7 25.4 29.6 56 56 A G T 3 S+ 0 0 10 1,-0.3 -39,-1.8 -13,-0.2 2,-0.4 0.505 119.7 92.2 102.6 7.5 43.8 24.2 26.0 57 57 A V B < -C 16 0B 54 -3,-1.2 2,-0.3 -41,-0.2 -1,-0.3 -0.991 45.7-179.3-137.4 143.7 46.0 21.2 26.2 58 58 A I - 0 0 4 -43,-2.4 2,-0.2 -2,-0.4 -30,-0.1 -0.825 26.1-106.7-133.0 172.3 45.3 17.5 26.8 59 59 A T > - 0 0 62 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.529 32.3-109.5 -95.7 166.8 47.2 14.2 27.1 60 60 A K H > S+ 0 0 107 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.865 120.7 53.7 -61.2 -39.2 47.4 11.4 24.6 61 61 A D H > S+ 0 0 124 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.922 110.2 46.8 -62.9 -42.6 45.2 9.2 26.8 62 62 A E H > S+ 0 0 38 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.924 111.3 51.7 -65.1 -42.6 42.6 12.0 26.9 63 63 A A H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -34,-0.4 0.912 111.2 47.9 -58.8 -44.6 42.9 12.4 23.1 64 64 A E H X S+ 0 0 75 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.848 109.3 53.8 -67.0 -33.2 42.4 8.6 22.6 65 65 A K H X S+ 0 0 134 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.950 110.1 45.6 -66.2 -48.1 39.5 8.7 24.9 66 66 A L H X S+ 0 0 3 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.892 112.2 53.1 -59.3 -43.0 37.7 11.4 23.0 67 67 A F H X S+ 0 0 11 -4,-2.2 4,-2.5 -5,-0.2 5,-0.3 0.929 108.6 49.0 -59.9 -46.8 38.5 9.6 19.7 68 68 A N H X S+ 0 0 89 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.927 112.0 48.7 -58.8 -47.2 37.0 6.4 21.0 69 69 A Q H X S+ 0 0 92 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.907 111.6 50.5 -59.1 -44.4 33.9 8.3 22.1 70 70 A D H X S+ 0 0 34 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.878 111.0 45.6 -64.3 -41.4 33.6 10.0 18.7 71 71 A V H X S+ 0 0 5 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.953 113.4 51.9 -67.2 -45.8 33.9 6.9 16.6 72 72 A D H X S+ 0 0 77 -4,-2.4 4,-2.5 -5,-0.3 5,-0.2 0.933 112.3 45.5 -53.6 -49.1 31.4 5.1 18.9 73 73 A A H X S+ 0 0 48 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.869 109.8 54.3 -64.2 -38.8 29.0 8.0 18.5 74 74 A A H X S+ 0 0 13 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.948 111.0 45.1 -62.0 -48.2 29.4 8.2 14.8 75 75 A V H X S+ 0 0 36 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.947 114.0 48.4 -60.7 -48.1 28.6 4.6 14.3 76 76 A R H X S+ 0 0 156 -4,-2.5 4,-1.0 -5,-0.3 -1,-0.2 0.902 110.6 53.7 -61.4 -35.2 25.6 4.7 16.6 77 77 A G H >X S+ 0 0 8 -4,-2.6 3,-0.9 -5,-0.2 4,-0.6 0.950 107.8 48.1 -63.1 -49.7 24.4 7.8 14.8 78 78 A I H >< S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.2 7,-0.4 0.930 109.1 55.3 -54.2 -49.0 24.6 6.1 11.4 79 79 A L H 3< S+ 0 0 82 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.695 112.5 40.7 -61.4 -22.2 22.7 3.2 12.8 80 80 A R H << S+ 0 0 173 -4,-1.0 2,-0.6 -3,-0.9 -1,-0.3 0.349 92.2 103.2-108.5 6.1 19.8 5.3 14.0 81 81 A N S+ 0 0 0 -6,-0.2 4,-2.7 -7,-0.1 3,-0.4 0.845 98.9 67.4 -91.6 -38.7 22.0 6.2 6.4 85 85 A A H X S+ 0 0 16 -4,-2.8 4,-3.0 -7,-0.4 5,-0.2 0.884 98.9 51.7 -52.2 -45.9 21.3 2.9 8.2 86 86 A P H > S+ 0 0 58 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.871 112.6 46.3 -62.6 -35.7 20.0 1.1 5.1 87 87 A V H >> S+ 0 0 2 -3,-0.4 3,-0.9 -4,-0.4 4,-0.8 0.966 113.1 48.3 -69.6 -50.9 23.1 2.1 3.1 88 88 A Y H >< S+ 0 0 28 -4,-2.7 3,-1.4 1,-0.3 -1,-0.2 0.924 110.3 52.6 -53.3 -48.4 25.4 1.1 5.9 89 89 A D H 3< S+ 0 0 115 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.765 105.6 55.5 -63.2 -22.6 23.6 -2.2 6.3 90 90 A S H << S+ 0 0 40 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.629 96.6 84.9 -85.5 -11.6 24.0 -3.0 2.6 91 91 A L S << S- 0 0 12 -3,-1.4 2,-0.0 -4,-0.8 31,-0.0 -0.535 77.2-114.0 -93.8 159.9 27.8 -2.6 2.6 92 92 A D > - 0 0 55 -2,-0.2 4,-1.8 1,-0.1 -1,-0.1 -0.258 44.2 -93.4 -77.6 170.5 30.7 -4.9 3.4 93 93 A A H > S+ 0 0 74 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.795 121.9 50.1 -60.5 -33.6 33.0 -4.2 6.4 94 94 A V H >> S+ 0 0 30 1,-0.2 3,-1.0 2,-0.2 4,-1.0 0.959 111.8 47.3 -71.8 -47.3 35.6 -2.2 4.5 95 95 A R H 3> S+ 0 0 24 1,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.812 100.4 66.9 -64.4 -27.4 33.1 0.1 2.9 96 96 A H H 3X S+ 0 0 39 -4,-1.8 4,-2.3 1,-0.2 -1,-0.3 0.905 98.8 55.5 -55.4 -40.6 31.4 0.6 6.3 97 97 A C H S+ 0 0 32 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.903 130.4 51.6 -56.9 -49.2 25.3 12.9 9.7 109 109 A T H > S+ 0 0 126 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.937 109.4 49.8 -57.2 -47.9 23.4 15.7 8.1 110 110 A G H >< S+ 0 0 32 -4,-0.6 3,-1.3 1,-0.2 -2,-0.2 0.961 115.6 42.4 -55.5 -54.6 26.2 16.5 5.7 111 111 A V H >< S+ 0 0 0 -4,-2.4 3,-2.4 1,-0.3 -2,-0.2 0.895 105.4 62.0 -62.5 -40.4 26.5 12.9 4.6 112 112 A A H 3< S+ 0 0 8 -4,-3.3 -1,-0.3 1,-0.3 -2,-0.2 0.712 95.0 67.1 -58.4 -16.9 22.7 12.4 4.5 113 113 A G T << S+ 0 0 56 -3,-1.3 2,-0.9 -4,-0.9 3,-0.3 0.547 75.7 83.5 -80.6 -10.0 22.9 15.2 1.8 114 114 A F <> + 0 0 36 -3,-2.4 4,-2.7 1,-0.2 3,-0.3 -0.263 57.2 155.0 -88.0 49.0 24.8 12.9 -0.7 115 115 A T H > + 0 0 80 -2,-0.9 4,-1.9 1,-0.2 -1,-0.2 0.846 66.7 43.1 -43.4 -54.9 21.5 11.4 -1.8 116 116 A N H > S+ 0 0 88 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.888 114.3 50.1 -65.6 -39.6 22.5 10.3 -5.3 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.899 109.4 53.5 -64.3 -41.2 25.8 8.9 -4.2 118 118 A L H X S+ 0 0 13 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.902 107.4 49.4 -62.0 -42.4 24.1 7.0 -1.4 119 119 A R H X S+ 0 0 98 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.942 110.7 51.1 -63.6 -43.7 21.6 5.4 -3.8 120 120 A M H <>S+ 0 0 28 -4,-2.1 5,-2.5 1,-0.2 4,-0.3 0.888 109.7 49.6 -60.5 -39.1 24.5 4.4 -6.1 121 121 A L H ><5S+ 0 0 2 -4,-2.3 3,-1.3 1,-0.2 -1,-0.2 0.914 108.9 52.7 -65.6 -40.4 26.4 2.8 -3.2 122 122 A Q H 3<5S+ 0 0 91 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.902 110.1 48.0 -61.1 -38.4 23.3 0.9 -2.2 123 123 A Q T 3<5S- 0 0 102 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.482 112.6-123.2 -80.1 -3.2 23.0 -0.4 -5.7 124 124 A K T < 5 + 0 0 98 -3,-1.3 2,-1.4 -4,-0.3 -3,-0.2 0.803 59.7 149.3 63.7 34.5 26.7 -1.3 -5.6 125 125 A R >< + 0 0 108 -5,-2.5 4,-2.7 1,-0.2 5,-0.2 -0.659 20.8 176.1 -96.3 74.9 27.5 0.8 -8.7 126 126 A W H > + 0 0 54 -2,-1.4 4,-2.1 1,-0.2 -1,-0.2 0.878 69.8 42.9 -50.8 -52.1 31.0 1.5 -7.4 127 127 A D H > S+ 0 0 115 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.905 115.5 50.2 -67.6 -37.2 32.5 3.4 -10.3 128 128 A E H > S+ 0 0 106 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.915 110.3 49.7 -67.1 -39.6 29.4 5.5 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.7 4,-3.1 1,-0.2 5,-0.2 0.912 107.5 55.2 -64.0 -40.4 29.3 6.3 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.887 108.0 48.0 -61.7 -39.2 32.9 7.4 -7.1 131 131 A V H X S+ 0 0 93 -4,-1.7 4,-0.6 1,-0.2 -1,-0.2 0.916 113.7 48.0 -68.8 -40.5 32.4 9.8 -9.9 132 132 A N H >< S+ 0 0 38 -4,-2.1 3,-1.1 1,-0.2 -2,-0.2 0.898 107.1 54.4 -67.1 -40.7 29.4 11.3 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-3.1 6,-0.4 1,-0.2 -1,-0.2 0.838 102.9 59.4 -61.8 -31.0 31.1 11.6 -4.8 134 134 A A H 3< S+ 0 0 27 -4,-1.3 2,-1.9 -5,-0.2 -1,-0.2 0.694 85.0 80.3 -72.2 -18.6 33.8 13.7 -6.5 135 135 A K S << S+ 0 0 164 -3,-1.1 2,-0.3 -4,-0.6 -1,-0.2 -0.549 81.9 96.8 -86.7 71.7 31.3 16.3 -7.7 136 136 A S S > S- 0 0 19 -2,-1.9 4,-2.0 1,-0.1 5,-0.2 -0.998 85.1-115.6-157.3 157.7 31.3 18.0 -4.3 137 137 A R H > S+ 0 0 151 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.923 115.4 62.3 -58.5 -43.2 32.6 20.8 -2.2 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.6 2,-0.2 8,-0.2 0.917 105.1 44.1 -47.2 -53.5 34.1 18.0 0.0 139 139 A Y H 4 S+ 0 0 65 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.906 114.9 48.9 -61.7 -43.7 36.3 16.7 -2.8 140 140 A N H < S+ 0 0 113 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.823 116.0 42.2 -69.5 -29.5 37.3 20.2 -3.9 141 141 A Q H < S+ 0 0 97 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.852 132.1 18.7 -85.5 -38.9 38.2 21.3 -0.4 142 142 A T S X S+ 0 0 22 -4,-2.6 4,-2.7 -5,-0.3 -1,-0.2 -0.568 73.8 162.2-131.4 72.3 40.1 18.2 0.9 143 143 A P H > + 0 0 46 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.837 69.7 51.9 -62.2 -40.5 41.0 16.3 -2.3 144 144 A N H > S+ 0 0 105 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.945 115.6 41.2 -66.8 -43.5 43.6 14.0 -0.9 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 3,-0.2 0.947 115.1 50.9 -67.2 -47.4 41.5 12.8 1.9 146 146 A A H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.3 0.911 107.3 55.0 -56.2 -41.7 38.4 12.6 -0.3 147 147 A K H X S+ 0 0 97 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.886 107.7 49.8 -60.3 -37.7 40.4 10.6 -2.9 148 148 A R H X S+ 0 0 53 -4,-1.6 4,-1.7 -3,-0.2 -1,-0.2 0.944 113.8 44.1 -65.9 -45.8 41.3 8.0 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.915 114.1 49.6 -64.9 -44.2 37.8 7.6 1.0 150 150 A I H X S+ 0 0 11 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.917 109.1 51.9 -62.5 -42.9 36.4 7.4 -2.5 151 151 A T H X S+ 0 0 33 -4,-2.3 4,-2.7 -5,-0.3 6,-0.4 0.860 107.0 55.2 -62.4 -33.3 39.0 4.8 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.935 110.2 44.1 -65.4 -43.7 37.9 2.8 -0.5 153 153 A F H < S+ 0 0 2 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.875 115.4 50.0 -67.6 -37.9 34.3 2.9 -1.7 154 154 A R H < S+ 0 0 95 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.938 124.2 24.8 -66.8 -48.2 35.3 2.0 -5.3 155 155 A T H < S- 0 0 48 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.667 84.7-137.0 -93.2 -23.8 37.5 -0.9 -4.5 156 156 A G S < S+ 0 0 16 -4,-2.4 2,-0.2 -5,-0.3 -62,-0.2 0.700 73.6 99.7 71.0 17.6 36.4 -2.3 -1.2 157 157 A T S S- 0 0 49 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.755 81.1-118.6-127.4 174.3 40.1 -2.7 -0.2 158 158 A W S >> S+ 0 0 40 -2,-0.2 3,-2.1 1,-0.2 4,-0.8 0.131 71.7 121.4 -99.6 16.3 42.6 -0.6 2.0 159 159 A D G >4 + 0 0 110 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.820 67.7 57.8 -50.5 -37.7 45.0 0.1 -0.9 160 160 A A G 34 S+ 0 0 27 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.705 110.2 45.2 -69.7 -16.5 44.6 3.9 -0.5 161 161 A Y G X4 S+ 0 0 2 -3,-2.1 3,-0.9 -13,-0.1 2,-0.3 0.463 89.0 105.4-104.6 -3.5 45.8 3.6 3.0 162 162 A K T << S+ 0 0 103 -3,-0.9 -3,-0.0 -4,-0.8 0, 0.0 -0.586 82.6 23.0 -78.7 138.6 48.7 1.3 2.3 163 163 A N T 3 0 0 171 -2,-0.3 -1,-0.2 0, 0.0 -4,-0.0 0.742 360.0 360.0 78.3 26.7 52.1 2.9 2.4 164 164 A L < 0 0 138 -3,-0.9 -2,-0.1 0, 0.0 -3,-0.0 0.623 360.0 360.0-119.7 360.0 50.9 5.8 4.7