==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (O-GLYCOSYL) 01-MAY-89 1L33 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR H.NICHOLSON,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8623.0 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 . 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 . 9 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 51.8 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 73 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 148.1 36.7 -23.4 9.1 2 2 A N > - 0 0 70 95,-0.0 4,-2.4 1,-0.0 3,-0.2 -0.856 360.0 -85.4-142.3 177.5 34.5 -20.9 10.9 3 3 A I H > S+ 0 0 21 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.827 124.0 52.4 -57.2 -41.1 34.2 -17.1 11.3 4 4 A F H > S+ 0 0 76 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.921 111.7 42.7 -63.8 -48.2 36.8 -17.0 14.1 5 5 A E H > S+ 0 0 92 -3,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.852 114.5 53.9 -66.6 -33.8 39.5 -18.9 12.2 6 6 A M H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.942 112.0 41.8 -65.7 -50.8 38.7 -16.9 9.1 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 5,-0.4 0.828 109.3 59.4 -66.4 -31.7 39.1 -13.5 10.9 8 8 A R H X S+ 0 0 106 -4,-1.9 4,-1.6 -5,-0.2 -1,-0.2 0.878 107.1 48.0 -65.9 -29.6 42.2 -14.8 12.7 9 9 A I H < S+ 0 0 52 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.951 115.9 43.0 -74.0 -45.7 43.8 -15.4 9.4 10 10 A D H < S+ 0 0 19 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.801 125.0 30.6 -70.8 -34.0 42.9 -12.0 8.0 11 11 A E H < S- 0 0 35 -4,-2.3 19,-0.3 -5,-0.1 -1,-0.2 0.693 91.7-151.2-100.6 -27.4 43.7 -9.9 11.0 12 12 A G < - 0 0 19 -4,-1.6 2,-0.4 -5,-0.4 -1,-0.1 -0.182 24.4 -86.5 79.0-178.4 46.5 -11.7 12.7 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.994 42.9 173.9-132.7 127.0 47.2 -11.6 16.4 14 14 A R E -A 28 0A 128 14,-1.4 14,-2.4 -2,-0.4 4,-0.1 -0.993 18.3-165.8-136.7 126.6 49.3 -8.9 18.1 15 15 A L E S+ 0 0 66 -2,-0.4 43,-2.3 12,-0.2 2,-0.3 0.391 73.7 62.3 -90.0 -1.3 49.8 -8.5 21.8 16 16 A K E S-C 57 0B 109 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.913 101.6 -86.4-124.3 146.0 51.3 -5.0 21.8 17 17 A I E + 0 0 22 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.246 59.3 172.4 -49.8 140.4 49.5 -1.8 20.5 18 18 A Y E -A 26 0A 26 8,-3.0 8,-3.1 -4,-0.1 2,-0.5 -0.908 34.6-105.7-144.2 171.4 50.1 -1.5 16.8 19 19 A K E -A 25 0A 121 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.877 33.9-138.6-103.0 134.5 49.0 0.6 13.8 20 20 A D > - 0 0 49 4,-2.9 3,-1.8 -2,-0.5 -1,-0.1 -0.028 40.5 -80.7 -78.1-172.4 46.6 -1.0 11.4 21 21 A T T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.816 134.4 48.2 -64.9 -24.4 46.8 -0.7 7.6 22 22 A E T 3 S- 0 0 79 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.401 124.4-102.9 -91.3 -1.8 45.1 2.7 7.9 23 23 A G S < S+ 0 0 35 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.507 74.0 141.2 91.7 12.1 47.5 3.8 10.6 24 24 A Y - 0 0 79 1,-0.1 -4,-2.9 -5,-0.0 -1,-0.3 -0.635 59.8-102.2 -93.2 151.0 45.1 3.5 13.5 25 25 A Y E +AB 19 34A 31 9,-0.8 8,-3.2 11,-0.4 9,-1.3 -0.479 54.1 160.7 -66.3 124.0 46.0 2.2 16.9 26 26 A T E -AB 18 32A 3 -8,-3.1 -8,-3.0 -2,-0.3 2,-0.3 -0.884 19.5-168.5-140.2 164.3 44.9 -1.4 17.3 27 27 A I E > + B 0 31A 0 4,-1.5 4,-1.9 -2,-0.3 -12,-0.2 -0.977 52.9 1.9-150.8 161.9 45.6 -4.4 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.4 -14,-1.4 -2,-0.3 2,-0.9 -0.373 122.8 -5.6 69.0-133.2 44.8 -8.2 19.5 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.674 127.8 -52.6-100.3 75.1 42.9 -9.6 16.7 30 30 A G T 4 S+ 0 0 16 -2,-0.9 2,-1.1 -19,-0.3 -2,-0.2 0.815 83.7 160.5 66.5 27.4 42.0 -6.4 14.7 31 31 A H E < -B 27 0A 34 -4,-1.9 -4,-1.5 1,-0.0 -1,-0.2 -0.699 33.5-143.0 -84.8 100.0 40.5 -4.6 17.7 32 32 A L E -B 26 0A 68 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.334 19.1-175.8 -60.2 131.7 40.6 -0.9 16.8 33 33 A L E - 0 0 14 -8,-3.2 2,-0.3 1,-0.4 -7,-0.2 0.903 58.0 -25.7 -96.2 -48.4 41.4 1.2 19.8 34 34 A T E -B 25 0A 27 -9,-1.3 -9,-0.8 2,-0.1 -1,-0.4 -0.973 35.8-137.7-161.2 150.0 41.1 4.8 18.5 35 35 A K S S+ 0 0 137 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.516 75.3 113.6 -88.3 -4.1 41.3 6.7 15.3 36 36 A S S S- 0 0 41 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.342 71.4-132.8 -68.9 144.0 43.2 9.3 17.4 37 37 A P S S+ 0 0 121 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.620 76.9 101.3 -73.3 -10.3 46.9 10.0 16.7 38 38 A S > - 0 0 49 1,-0.2 4,-1.9 2,-0.1 3,-0.4 -0.699 57.5-160.4 -89.7 120.1 47.8 9.9 20.3 39 39 A L H > S+ 0 0 66 -2,-0.7 4,-2.1 1,-0.3 -1,-0.2 0.717 100.3 57.0 -60.4 -23.7 49.4 6.7 21.6 40 40 A N H > S+ 0 0 118 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.898 101.3 50.4 -77.0 -40.1 48.2 8.0 24.9 41 41 A A H > S+ 0 0 35 -3,-0.4 4,-1.7 1,-0.2 -2,-0.2 0.871 113.4 50.5 -63.5 -30.9 44.7 8.2 23.8 42 42 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.879 106.7 51.6 -73.4 -41.0 45.2 4.6 22.7 43 43 A K H X S+ 0 0 50 -4,-2.1 4,-2.0 1,-0.2 11,-0.3 0.869 110.8 49.6 -65.4 -33.8 46.6 3.4 25.9 44 44 A S H X S+ 0 0 71 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.881 109.9 49.1 -70.6 -43.7 43.7 4.8 27.8 45 45 A E H X S+ 0 0 67 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.926 110.6 53.5 -62.9 -43.6 41.2 3.2 25.5 46 46 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-0.3 0.932 108.9 46.0 -55.9 -50.4 43.0 -0.1 26.0 47 47 A D H X>S+ 0 0 36 -4,-2.0 4,-2.2 1,-0.2 5,-0.7 0.866 112.3 52.3 -63.4 -35.0 42.9 0.1 29.8 48 48 A K H <5S+ 0 0 141 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.907 110.6 48.9 -64.9 -41.4 39.3 1.0 29.6 49 49 A A H <5S+ 0 0 46 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.859 120.8 33.1 -68.9 -34.1 38.6 -2.0 27.4 50 50 A I H <5S- 0 0 37 -4,-2.2 -2,-0.2 2,-0.3 -1,-0.2 0.732 99.5-126.7 -97.4 -26.3 40.4 -4.6 29.5 51 51 A G T <5S+ 0 0 67 -4,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.746 78.4 77.2 84.6 24.5 39.7 -3.2 33.0 52 52 A R S - 0 0 8 -2,-0.9 3,-1.3 -11,-0.3 -1,-0.2 0.707 30.9-142.5 -96.0 -21.8 47.9 -2.6 30.7 55 55 A N T 3 S- 0 0 126 1,-0.3 3,-0.1 -12,-0.2 -2,-0.1 0.910 74.5 -55.5 60.7 40.9 50.8 -0.4 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.6 1,-0.1 2,-0.4 0.545 119.5 96.8 72.9 4.8 50.0 -1.1 26.0 57 57 A V B < -C 16 0B 62 -3,-1.3 2,-0.3 -41,-0.2 -41,-0.2 -0.979 46.6-178.8-130.8 143.2 50.3 -4.8 26.3 58 58 A I - 0 0 5 -43,-2.3 2,-0.1 -2,-0.4 -30,-0.1 -0.859 25.2-111.8-130.7 166.0 47.7 -7.6 26.8 59 59 A T > - 0 0 67 -2,-0.3 4,-2.2 1,-0.1 3,-0.2 -0.477 34.6-103.8 -91.2 169.4 47.7 -11.4 27.1 60 60 A K H > S+ 0 0 109 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.902 122.6 52.9 -56.3 -46.6 46.4 -14.0 24.7 61 61 A D H > S+ 0 0 123 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.879 107.8 50.5 -54.8 -47.0 43.3 -14.5 26.8 62 62 A E H > S+ 0 0 37 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.888 110.3 50.2 -62.8 -41.4 42.6 -10.8 26.8 63 63 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -34,-0.4 0.863 110.5 49.3 -65.3 -38.6 42.9 -10.6 23.1 64 64 A E H X S+ 0 0 74 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.826 108.8 52.8 -70.8 -32.0 40.6 -13.6 22.6 65 65 A K H X S+ 0 0 135 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.960 110.1 46.9 -67.3 -45.7 38.0 -12.1 24.9 66 66 A L H X S+ 0 0 3 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.924 112.0 53.4 -57.2 -42.1 38.0 -8.8 22.9 67 67 A F H X S+ 0 0 12 -4,-2.0 4,-2.3 1,-0.2 5,-0.3 0.932 106.0 51.0 -61.9 -46.9 37.8 -10.9 19.7 68 68 A N H X S+ 0 0 89 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.938 112.1 48.1 -57.7 -43.6 34.7 -12.7 21.0 69 69 A Q H X S+ 0 0 93 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.897 111.0 50.1 -60.6 -44.6 33.0 -9.4 21.8 70 70 A D H X S+ 0 0 38 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.844 110.9 47.2 -64.4 -38.5 33.8 -7.9 18.5 71 71 A V H X S+ 0 0 6 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.954 114.8 48.9 -66.6 -46.7 32.5 -10.9 16.5 72 72 A D H X S+ 0 0 86 -4,-2.2 4,-2.5 -5,-0.3 5,-0.2 0.931 112.2 46.2 -55.4 -51.0 29.3 -10.9 18.6 73 73 A A H X S+ 0 0 43 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.883 111.0 54.4 -64.0 -36.6 28.8 -7.2 18.2 74 74 A A H X S+ 0 0 10 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.972 111.2 43.9 -61.0 -51.9 29.4 -7.5 14.4 75 75 A V H X S+ 0 0 32 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.935 114.9 49.2 -56.6 -47.2 26.7 -10.2 14.0 76 76 A R H X S+ 0 0 111 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.859 109.2 53.8 -63.3 -35.8 24.3 -8.2 16.3 77 77 A G H X S+ 0 0 3 -4,-2.5 4,-0.6 -5,-0.2 -1,-0.2 0.916 108.6 47.2 -67.7 -43.1 25.0 -5.1 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.1 3,-1.0 1,-0.2 7,-0.5 0.935 111.0 53.4 -60.6 -42.6 24.1 -6.9 11.0 79 79 A L H 3< S+ 0 0 69 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.761 112.3 44.1 -66.9 -24.0 20.9 -8.2 12.6 80 80 A R H 3< S+ 0 0 173 -4,-1.4 2,-0.6 -3,-0.2 -1,-0.3 0.381 93.0 95.8 -96.1 -6.8 19.8 -4.8 13.7 81 81 A N S+ 0 0 0 -6,-0.2 4,-2.5 -7,-0.2 3,-0.4 0.857 100.9 67.6 -85.8 -41.5 22.1 -5.8 6.2 85 85 A K H X S+ 0 0 78 -4,-2.5 4,-3.0 -7,-0.5 5,-0.2 0.896 99.0 50.5 -47.6 -50.9 19.7 -8.2 7.9 86 86 A P H > S+ 0 0 52 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.878 112.4 47.9 -60.8 -37.2 17.8 -9.2 4.7 87 87 A V H > S+ 0 0 2 -4,-0.4 4,-0.9 -3,-0.4 3,-0.3 0.953 112.6 48.3 -66.7 -48.5 21.0 -9.9 2.9 88 88 A Y H >< S+ 0 0 34 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.946 110.9 50.9 -54.3 -51.3 22.4 -11.9 5.8 89 89 A D H 3< S+ 0 0 79 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.807 108.0 53.6 -61.1 -28.2 19.1 -13.9 6.1 90 90 A S H 3< S+ 0 0 34 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.659 96.6 89.9 -81.1 -13.6 19.2 -14.7 2.4 91 91 A L S << S- 0 0 6 -3,-1.3 31,-0.0 -4,-0.9 30,-0.0 -0.569 74.6-117.2 -88.4 157.5 22.7 -16.1 2.5 92 92 A D > - 0 0 53 -2,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.125 43.6 -93.3 -75.8 169.5 24.1 -19.6 3.1 93 93 A A H > S+ 0 0 75 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.863 122.4 46.1 -58.9 -40.0 26.4 -20.3 6.0 94 94 A V H > S+ 0 0 27 62,-0.2 4,-1.2 2,-0.2 3,-0.4 0.945 113.8 47.4 -67.6 -48.6 29.7 -19.8 4.2 95 95 A R H > S+ 0 0 25 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.847 103.6 62.4 -62.0 -35.2 28.6 -16.5 2.6 96 96 A R H X S+ 0 0 82 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.903 101.0 54.6 -55.5 -41.8 27.3 -15.2 5.9 97 97 A C H X S+ 0 0 18 -4,-1.2 4,-2.2 -3,-0.4 -1,-0.2 0.874 103.8 54.0 -57.4 -41.7 30.9 -15.5 7.1 98 98 A A H X S+ 0 0 0 -4,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.869 110.2 46.8 -62.9 -39.0 32.1 -13.3 4.2 99 99 A L H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.897 110.6 52.0 -69.6 -39.6 29.5 -10.5 5.2 100 100 A I H X S+ 0 0 7 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.912 106.6 54.3 -63.8 -37.8 30.5 -10.7 8.8 101 101 A N H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.944 108.2 48.9 -60.7 -47.1 34.2 -10.3 7.8 102 102 A M H X S+ 0 0 3 -4,-1.9 4,-3.1 1,-0.2 5,-0.3 0.896 112.2 49.0 -58.6 -42.5 33.4 -7.1 5.9 103 103 A V H X S+ 0 0 10 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.911 108.8 52.0 -65.9 -40.9 31.4 -5.7 8.8 104 104 A F H < S+ 0 0 32 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.913 118.4 38.1 -60.4 -41.8 34.1 -6.5 11.3 105 105 A Q H < S+ 0 0 57 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.914 132.8 20.7 -76.7 -47.5 36.7 -4.7 9.1 106 106 A M H X S- 0 0 52 -4,-3.1 4,-0.6 -5,-0.2 -3,-0.2 0.499 103.1-116.9-110.8 1.4 34.7 -1.8 7.9 107 107 A G H X - 0 0 33 -4,-2.2 4,-2.0 -5,-0.3 5,-0.2 0.205 34.4 -80.0 74.6 155.8 31.8 -1.3 10.3 108 108 A E H > S+ 0 0 57 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.872 127.8 53.2 -50.8 -51.9 28.0 -1.6 9.6 109 109 A T H > S+ 0 0 120 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.918 108.2 49.2 -57.5 -47.0 27.8 1.7 8.1 110 110 A G H < S+ 0 0 32 -4,-0.6 3,-0.5 2,-0.2 -2,-0.2 0.917 114.6 43.9 -61.4 -45.3 30.5 1.2 5.6 111 111 A V H >< S+ 0 0 0 -4,-2.0 3,-2.9 1,-0.2 -2,-0.2 0.932 106.0 60.5 -67.2 -41.4 29.2 -2.1 4.4 112 112 A A H 3< S+ 0 0 13 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.785 95.0 67.5 -57.5 -22.6 25.6 -0.8 4.3 113 113 A G T 3< S+ 0 0 55 -4,-1.1 2,-1.1 -3,-0.5 -1,-0.3 0.548 75.6 85.7 -71.9 -10.1 27.0 1.7 1.7 114 114 A F <> + 0 0 40 -3,-2.9 4,-2.4 1,-0.2 3,-0.3 -0.234 55.6 158.3 -89.9 53.7 27.6 -1.1 -0.8 115 115 A T H > + 0 0 92 -2,-1.1 4,-1.7 1,-0.2 -1,-0.2 0.829 66.3 44.2 -40.0 -58.2 24.1 -0.8 -2.1 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.884 114.4 47.4 -63.2 -44.6 24.6 -2.4 -5.5 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.885 110.0 54.4 -64.8 -40.4 26.7 -5.3 -4.4 118 118 A L H X S+ 0 0 13 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.890 108.6 49.4 -58.4 -41.9 24.2 -6.0 -1.5 119 119 A R H X S+ 0 0 114 -4,-1.7 4,-2.0 -5,-0.2 -2,-0.2 0.925 111.8 48.2 -65.1 -43.7 21.4 -6.2 -4.1 120 120 A M H <>S+ 0 0 26 -4,-2.2 5,-2.4 2,-0.2 4,-0.3 0.914 110.7 50.0 -65.8 -40.3 23.3 -8.6 -6.3 121 121 A L H ><5S+ 0 0 1 -4,-2.4 3,-2.2 1,-0.2 -1,-0.2 0.953 109.9 52.2 -64.6 -42.0 24.3 -10.8 -3.3 122 122 A Q H 3<5S+ 0 0 93 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.891 109.8 48.9 -60.6 -35.3 20.6 -10.9 -2.4 123 123 A Q T 3<5S- 0 0 87 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.452 113.0-121.7 -81.7 0.1 19.7 -11.9 -5.8 124 124 A K T < 5 + 0 0 97 -3,-2.2 2,-1.2 -4,-0.3 -3,-0.2 0.780 61.2 147.2 63.0 31.3 22.4 -14.6 -5.8 125 125 A R >< + 0 0 116 -5,-2.4 4,-2.5 1,-0.2 5,-0.2 -0.707 21.4 175.7 -97.7 80.4 24.2 -13.2 -8.8 126 126 A W H > + 0 0 48 -2,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.879 69.8 44.1 -55.4 -52.0 27.6 -14.3 -7.6 127 127 A D H > S+ 0 0 113 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.910 114.7 49.3 -64.3 -43.3 29.8 -13.3 -10.4 128 128 A E H > S+ 0 0 98 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.898 111.7 48.8 -65.8 -40.8 28.2 -9.9 -10.9 129 129 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.862 108.3 53.3 -64.5 -38.9 28.5 -9.2 -7.2 130 130 A A H X S+ 0 0 10 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.905 110.8 48.6 -64.0 -38.8 32.2 -10.2 -7.0 131 131 A A H < S+ 0 0 54 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.890 112.7 46.6 -68.4 -38.8 32.9 -7.9 -9.9 132 132 A N H >< S+ 0 0 41 -4,-1.8 3,-1.3 1,-0.2 -2,-0.2 0.871 107.5 55.9 -71.2 -38.1 31.1 -5.0 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.7 6,-0.4 1,-0.2 -1,-0.2 0.827 99.4 63.5 -61.2 -30.9 32.7 -5.5 -4.9 134 134 A A T 3< S+ 0 0 27 -4,-1.1 2,-1.3 1,-0.2 -1,-0.2 0.674 85.7 76.7 -70.7 -15.1 36.1 -5.1 -6.6 135 135 A K S < S+ 0 0 162 -3,-1.3 2,-0.3 -4,-0.4 -1,-0.2 -0.571 80.2 96.5 -94.1 67.5 35.3 -1.6 -7.6 136 136 A S S > S- 0 0 18 -2,-1.3 4,-2.0 1,-0.1 3,-0.2 -0.989 84.6-116.3-150.9 156.5 35.9 -0.1 -4.2 137 137 A R H > S+ 0 0 141 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.912 115.3 64.5 -58.2 -41.4 38.6 1.7 -2.2 138 138 A W H > S+ 0 0 15 1,-0.2 4,-2.1 2,-0.2 8,-0.2 0.906 104.4 43.0 -46.2 -51.1 38.4 -1.4 0.1 139 139 A Y H 4 S+ 0 0 57 -6,-0.4 -1,-0.2 -3,-0.2 -2,-0.2 0.899 115.4 49.3 -68.6 -43.4 39.7 -3.7 -2.7 140 140 A N H < S+ 0 0 106 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.864 115.1 43.2 -65.1 -35.8 42.3 -1.2 -3.8 141 141 A Q H < S+ 0 0 107 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.839 131.8 18.1 -79.6 -39.5 43.7 -0.7 -0.3 142 142 A T S X S+ 0 0 23 -4,-2.1 4,-2.5 -5,-0.3 -1,-0.2 -0.530 73.4 163.6-132.0 66.7 43.7 -4.3 1.0 143 143 A P H > + 0 0 47 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.812 69.2 52.2 -58.7 -38.4 43.6 -6.3 -2.2 144 144 A N H > S+ 0 0 110 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.912 116.0 41.0 -67.8 -41.2 44.7 -9.8 -0.8 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.934 114.8 51.1 -68.3 -48.8 42.2 -9.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-3.1 -8,-0.2 5,-0.2 0.929 109.6 52.4 -54.5 -44.6 39.4 -8.3 -0.3 147 147 A K H X S+ 0 0 92 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.875 108.2 50.2 -59.1 -40.3 40.2 -11.1 -2.9 148 148 A R H X S+ 0 0 52 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.947 114.8 43.2 -63.7 -47.9 39.8 -13.8 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.920 113.9 51.1 -62.9 -44.2 36.4 -12.3 0.9 150 150 A I H X S+ 0 0 13 -4,-3.1 4,-2.5 -5,-0.2 -1,-0.2 0.889 108.6 51.0 -60.0 -42.5 35.3 -11.8 -2.6 151 151 A T H X S+ 0 0 33 -4,-2.3 4,-2.6 2,-0.2 6,-0.4 0.839 106.7 55.8 -63.7 -37.4 36.1 -15.5 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.918 111.5 42.6 -61.8 -43.6 34.2 -16.6 -0.6 153 153 A F H < S+ 0 0 1 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.893 115.0 51.0 -70.9 -38.9 31.1 -14.7 -1.9 154 154 A R H < S+ 0 0 104 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.926 126.1 21.2 -62.3 -45.6 31.7 -15.9 -5.4 155 155 A T H < S- 0 0 46 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.646 84.8-135.9-100.6 -26.9 32.0 -19.6 -4.6 156 156 A G S < S+ 0 0 17 -4,-2.1 2,-0.2 -5,-0.4 -62,-0.2 0.711 72.7 101.6 73.7 18.6 30.4 -20.2 -1.4 157 157 A T S S- 0 0 49 -6,-0.4 3,-0.3 -5,-0.1 -1,-0.3 -0.746 80.9-116.9-124.7 175.7 33.3 -22.4 -0.3 158 158 A W S >> S+ 0 0 28 -2,-0.2 3,-1.7 1,-0.2 4,-0.5 0.114 72.5 121.9 -99.7 22.0 36.4 -21.8 1.9 159 159 A D G >4 + 0 0 97 1,-0.3 3,-1.1 2,-0.2 4,-0.5 0.828 65.4 59.9 -52.7 -39.3 38.9 -22.3 -0.8 160 160 A A G 34 S+ 0 0 14 -3,-0.3 -1,-0.3 1,-0.3 4,-0.2 0.674 112.2 40.4 -64.5 -20.3 40.5 -18.9 -0.5 161 161 A Y G <4 S+ 0 0 1 -3,-1.7 -1,-0.3 2,-0.1 -2,-0.2 0.393 93.4 80.8-107.6 -3.6 41.5 -19.7 3.1 162 162 A K S << S+ 0 0 136 -3,-1.1 -2,-0.1 -4,-0.5 -3,-0.1 0.584 90.9 57.2 -84.1 -8.1 42.6 -23.4 2.7 163 163 A N 0 0 125 -4,-0.5 -1,-0.2 1,-0.1 -2,-0.1 0.898 360.0 360.0 -70.5 -53.5 45.7 -22.3 1.5 164 164 A L 0 0 118 -4,-0.2 -2,-0.2 0, 0.0 -1,-0.1 0.576 360.0 360.0 -77.3 360.0 46.5 -20.2 4.5