==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 20-JUN-94 165L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.BLABER,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8564.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.8 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 7.4 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 . 7 4.3 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 76 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 151.4 43.7 -1.9 8.8 2 2 A N > - 0 0 72 156,-0.0 4,-2.9 1,-0.0 5,-0.2 -0.944 360.0 -85.4-150.3 172.6 40.6 -0.8 10.7 3 3 A I H > S+ 0 0 28 -2,-0.3 4,-2.5 1,-0.2 5,-0.3 0.853 122.6 50.1 -51.5 -45.3 38.4 2.3 11.3 4 4 A F H > S+ 0 0 76 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.949 114.8 43.3 -62.5 -46.3 40.5 3.7 14.1 5 5 A E H > S+ 0 0 103 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.876 112.5 53.2 -65.9 -39.6 43.7 3.4 12.2 6 6 A M H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.967 113.0 42.3 -60.8 -49.7 42.2 4.8 9.1 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.2 5,-0.4 0.865 108.7 58.9 -66.3 -35.3 40.8 7.8 10.8 8 8 A R H X S+ 0 0 93 -4,-2.1 4,-1.4 -5,-0.3 -1,-0.2 0.893 108.0 48.3 -62.6 -33.1 44.1 8.3 12.8 9 9 A I H < S+ 0 0 89 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.936 114.4 45.5 -72.0 -42.5 45.8 8.6 9.5 10 10 A D H < S+ 0 0 19 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.847 124.5 27.2 -72.4 -33.4 43.3 11.0 8.1 11 11 A E H < S- 0 0 43 -4,-2.6 19,-0.3 1,-0.2 -1,-0.2 0.639 91.4-150.8-102.9 -19.6 43.0 13.5 11.0 12 12 A G < - 0 0 26 -4,-1.4 2,-0.3 -5,-0.4 -1,-0.2 -0.189 23.4 -87.1 74.4-166.4 46.4 13.1 12.7 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.967 41.4 172.4-143.0 125.5 46.9 13.7 16.5 14 14 A R E -A 28 0A 137 14,-1.2 14,-2.2 -2,-0.3 4,-0.1 -0.999 20.7-159.6-135.6 133.4 47.6 17.0 18.3 15 15 A L E S+ 0 0 63 -2,-0.4 43,-2.2 12,-0.2 2,-0.4 0.331 77.4 64.2 -95.8 5.9 47.6 17.5 22.1 16 16 A K E S-C 57 0B 84 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.973 99.5 -88.8-132.6 141.4 47.1 21.2 21.8 17 17 A I E + 0 0 18 39,-1.7 2,-0.3 -2,-0.4 10,-0.2 -0.209 56.5 170.0 -47.4 132.3 44.1 23.2 20.5 18 18 A Y E -A 26 0A 26 8,-3.3 8,-3.5 -4,-0.1 2,-0.5 -0.846 33.7-103.5-140.7 176.0 44.5 23.8 16.8 19 19 A K E -A 25 0A 130 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.882 32.2-135.6-108.7 136.9 42.5 25.0 14.0 20 20 A D > - 0 0 48 4,-2.7 3,-1.8 -2,-0.5 -1,-0.1 0.003 38.3 -85.8 -78.9-175.2 41.1 22.8 11.4 21 21 A T T 3 S+ 0 0 93 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.764 131.7 47.8 -63.2 -24.9 41.1 23.1 7.7 22 22 A E T 3 S- 0 0 75 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.261 125.5-100.5 -93.2 1.6 38.0 25.2 8.0 23 23 A G S < S+ 0 0 35 -3,-1.8 2,-0.4 1,-0.3 -2,-0.1 0.609 75.7 144.5 87.0 15.3 39.5 27.4 10.6 24 24 A Y - 0 0 74 1,-0.1 -4,-2.7 -5,-0.0 2,-0.3 -0.688 57.3-105.5 -95.3 145.5 37.6 25.6 13.5 25 25 A Y E +AB 19 34A 39 9,-0.6 8,-2.8 11,-0.4 9,-1.3 -0.419 53.6 160.7 -62.6 122.9 39.0 25.0 16.9 26 26 A T E -AB 18 32A 3 -8,-3.5 -8,-3.3 -2,-0.3 2,-0.3 -0.845 19.1-170.8-136.5 169.3 39.8 21.4 17.3 27 27 A I E > + B 0 31A 0 4,-1.3 4,-1.8 -2,-0.3 -12,-0.2 -0.981 52.0 3.3-158.0 161.6 42.0 19.1 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.2 -14,-1.2 -2,-0.3 2,-0.9 -0.371 123.2 -6.1 66.1-130.2 43.2 15.4 19.6 29 29 A I T 4 S- 0 0 3 34,-0.5 -1,-0.2 -16,-0.2 -17,-0.1 -0.592 127.4 -51.5-101.8 73.0 42.1 13.3 16.7 30 30 A G T 4 S+ 0 0 17 -2,-0.9 2,-1.1 -19,-0.3 -2,-0.2 0.794 84.2 160.9 71.7 23.2 39.8 15.5 14.6 31 31 A H E < -B 27 0A 32 -4,-1.8 -4,-1.3 1,-0.0 -1,-0.2 -0.688 32.6-144.4 -82.3 100.9 37.7 16.4 17.7 32 32 A L E -B 26 0A 68 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.352 20.5-179.8 -64.3 127.4 35.8 19.6 16.8 33 33 A L E - 0 0 15 -8,-2.8 2,-0.3 1,-0.4 -7,-0.2 0.904 57.8 -22.3 -92.4 -50.3 35.4 21.8 19.8 34 34 A T E -B 25 0A 27 -9,-1.3 -9,-0.6 2,-0.1 -1,-0.4 -0.979 34.8-142.3-157.0 157.1 33.5 24.8 18.6 35 35 A K S S+ 0 0 139 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.456 73.2 111.2-101.0 -6.4 32.7 26.8 15.4 36 36 A S S S- 0 0 41 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.339 75.8-127.6 -69.2 143.2 33.0 30.0 17.4 37 37 A P S S+ 0 0 125 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.487 78.3 103.9 -72.9 3.7 35.9 32.3 16.6 38 38 A S > - 0 0 48 1,-0.2 4,-2.7 -13,-0.0 5,-0.2 -0.758 56.3-161.2-107.4 121.5 36.8 32.4 20.2 39 39 A L H > S+ 0 0 67 -2,-0.7 4,-2.6 1,-0.3 -1,-0.2 0.777 97.1 56.5 -60.3 -25.8 39.6 30.6 21.8 40 40 A N H > S+ 0 0 120 2,-0.2 4,-2.9 1,-0.2 -1,-0.3 0.950 105.6 48.3 -72.4 -46.2 38.0 31.0 25.1 41 41 A A H > S+ 0 0 34 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.947 112.3 51.2 -56.8 -45.1 34.9 29.4 24.0 42 42 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.896 110.4 49.8 -56.8 -44.1 37.2 26.6 22.6 43 43 A K H X S+ 0 0 56 -4,-2.6 4,-2.2 1,-0.2 11,-0.2 0.896 109.7 49.1 -64.5 -42.7 38.9 26.3 25.9 44 44 A S H X S+ 0 0 71 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.922 111.1 49.8 -66.6 -42.1 35.8 26.2 27.9 45 45 A E H X S+ 0 0 67 -4,-2.5 4,-2.6 -5,-0.3 -2,-0.2 0.938 109.1 53.2 -61.3 -43.5 34.3 23.5 25.6 46 46 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.4 0.940 108.1 49.5 -54.1 -48.5 37.5 21.5 26.0 47 47 A D H X>S+ 0 0 35 -4,-2.2 4,-2.3 1,-0.3 5,-0.9 0.910 112.0 49.1 -57.6 -42.7 37.4 21.6 29.8 48 48 A K H <5S+ 0 0 143 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.874 110.5 49.9 -63.7 -44.5 33.8 20.5 29.7 49 49 A A H <5S+ 0 0 43 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.888 121.8 33.1 -65.9 -36.5 34.6 17.6 27.3 50 50 A I H <5S- 0 0 38 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.728 102.5-126.3 -91.4 -28.6 37.6 16.3 29.4 51 51 A G T <5S+ 0 0 63 -4,-2.3 2,-0.3 -5,-0.4 -3,-0.2 0.758 74.7 75.9 88.2 23.2 36.3 17.2 32.7 52 52 A R S - 0 0 7 -2,-1.0 3,-1.2 -11,-0.2 -1,-0.2 0.781 31.5-146.8 -97.3 -23.3 42.9 21.9 30.8 55 55 A N T 3 S- 0 0 122 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.896 74.0 -58.0 61.8 36.7 44.4 25.2 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.1 2,-0.4 0.425 116.2 97.8 76.2 -1.6 44.3 24.0 26.0 57 57 A V B < +C 16 0B 72 -3,-1.2 2,-0.3 -41,-0.2 -41,-0.2 -0.976 45.3 178.6-126.4 134.4 46.5 20.9 26.4 58 58 A I - 0 0 5 -43,-2.2 2,-0.1 -2,-0.4 -30,-0.1 -0.783 26.9-112.1-124.8 164.7 45.4 17.3 26.8 59 59 A T > - 0 0 63 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.421 34.2-102.4 -90.8 172.1 47.4 14.0 27.2 60 60 A K H > S+ 0 0 100 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.933 121.9 51.6 -60.2 -46.0 47.5 11.2 24.7 61 61 A D H > S+ 0 0 118 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.841 108.4 52.2 -58.8 -38.9 45.1 9.0 26.6 62 62 A E H > S+ 0 0 37 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.891 108.2 50.8 -65.7 -39.5 42.6 11.9 26.8 63 63 A A H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -34,-0.5 0.881 112.0 48.9 -63.6 -37.6 42.8 12.3 23.0 64 64 A E H X S+ 0 0 74 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.820 107.2 53.8 -71.9 -34.4 42.2 8.6 22.7 65 65 A K H X S+ 0 0 137 -4,-2.0 4,-1.9 2,-0.2 5,-0.2 0.954 110.1 46.2 -68.7 -44.9 39.3 8.7 25.0 66 66 A L H X S+ 0 0 3 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.903 111.6 54.7 -59.6 -38.2 37.6 11.5 22.9 67 67 A F H X S+ 0 0 12 -4,-1.8 4,-2.4 2,-0.2 5,-0.3 0.944 105.5 50.6 -62.9 -47.1 38.4 9.5 19.8 68 68 A N H X S+ 0 0 92 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.941 112.2 47.6 -57.5 -44.0 36.6 6.4 21.0 69 69 A Q H X S+ 0 0 98 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.898 111.7 50.9 -61.6 -41.7 33.5 8.3 21.9 70 70 A D H X S+ 0 0 36 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.882 111.2 45.8 -65.3 -40.5 33.5 10.1 18.6 71 71 A V H X S+ 0 0 7 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.939 114.2 49.7 -67.4 -47.9 33.8 6.8 16.5 72 72 A D H X S+ 0 0 85 -4,-2.5 4,-2.4 -5,-0.3 5,-0.3 0.950 111.7 49.4 -55.2 -44.9 31.1 5.2 18.7 73 73 A A H X S+ 0 0 46 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.887 108.9 51.1 -63.2 -41.0 28.9 8.2 18.1 74 74 A A H X S+ 0 0 10 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.950 110.1 49.3 -63.5 -48.6 29.4 8.3 14.4 75 75 A V H X S+ 0 0 32 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.937 113.7 47.2 -54.9 -48.0 28.5 4.5 14.1 76 76 A R H X S+ 0 0 122 -4,-2.4 4,-2.1 -5,-0.3 -1,-0.2 0.915 107.7 55.3 -65.3 -37.1 25.3 5.1 16.2 77 77 A G H X S+ 0 0 0 -4,-2.4 4,-1.2 -5,-0.3 -1,-0.2 0.945 109.4 47.5 -61.0 -44.1 24.4 8.1 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.3 3,-0.7 1,-0.2 7,-0.4 0.947 111.3 51.4 -58.5 -47.9 24.5 6.0 11.0 79 79 A L H 3< S+ 0 0 68 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.805 113.7 43.6 -65.7 -24.5 22.5 3.3 12.6 80 80 A R H 3< S+ 0 0 179 -4,-2.1 2,-0.5 -5,-0.2 -1,-0.3 0.563 92.0 96.7 -92.3 -16.4 19.9 5.7 13.7 81 81 A N S+ 0 0 0 -7,-0.2 4,-2.4 -6,-0.2 3,-0.4 0.888 99.9 68.0 -88.1 -39.9 22.1 6.0 6.2 85 85 A K H X S+ 0 0 84 -4,-2.7 4,-2.7 -7,-0.4 5,-0.2 0.867 99.1 49.9 -47.3 -47.1 21.2 2.8 7.9 86 86 A P H > S+ 0 0 53 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.906 111.8 49.7 -64.6 -35.8 20.1 1.0 4.7 87 87 A V H > S+ 0 0 2 -4,-0.5 4,-0.6 -3,-0.4 3,-0.5 0.976 110.6 46.9 -66.1 -55.0 23.3 2.0 3.0 88 88 A Y H >< S+ 0 0 35 -4,-2.4 3,-1.4 1,-0.3 -1,-0.2 0.908 111.6 53.8 -52.3 -44.5 25.6 0.8 5.8 89 89 A D H 3< S+ 0 0 71 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.848 105.2 53.0 -63.9 -35.4 23.7 -2.5 6.0 90 90 A S H 3< S+ 0 0 34 -4,-1.7 -1,-0.3 -3,-0.5 2,-0.2 0.544 98.4 90.7 -73.7 -11.3 24.0 -3.2 2.4 91 91 A L S << S- 0 0 7 -3,-1.4 31,-0.0 -4,-0.6 30,-0.0 -0.633 73.8-117.5 -96.0 160.6 27.8 -2.7 2.5 92 92 A D > - 0 0 53 -2,-0.2 4,-2.0 1,-0.1 5,-0.2 -0.139 44.8 -94.3 -72.7 168.8 30.9 -5.0 3.0 93 93 A A H > S+ 0 0 83 2,-0.2 4,-1.3 1,-0.2 -1,-0.1 0.866 121.4 48.5 -58.2 -41.2 33.3 -4.4 6.1 94 94 A V H >> S+ 0 0 25 62,-0.2 4,-1.3 1,-0.2 3,-0.6 0.970 112.6 45.5 -66.1 -53.5 35.8 -2.2 4.2 95 95 A R H 3> S+ 0 0 23 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.845 105.8 61.8 -59.8 -32.7 33.3 0.1 2.6 96 96 A R H 3X S+ 0 0 78 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.901 101.9 53.4 -57.3 -39.1 31.4 0.4 6.0 97 97 A A H S+ 0 0 53 1,-0.2 4,-3.5 2,-0.2 5,-0.2 0.874 129.3 51.5 -60.2 -43.6 25.3 12.7 9.5 109 109 A T H > S+ 0 0 122 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.938 108.5 53.3 -62.2 -47.6 23.4 15.5 8.0 110 110 A G H >< S+ 0 0 29 -4,-0.7 3,-0.8 1,-0.2 -2,-0.2 0.958 115.5 37.9 -52.1 -57.9 26.2 16.2 5.7 111 111 A V H >< S+ 0 0 1 -4,-2.4 3,-2.6 1,-0.2 -2,-0.2 0.891 106.7 64.3 -61.2 -42.9 26.5 12.6 4.4 112 112 A A H 3< S+ 0 0 12 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.797 94.9 65.8 -53.5 -26.1 22.7 12.0 4.3 113 113 A G T << S+ 0 0 55 -4,-1.2 2,-1.7 -3,-0.8 -1,-0.3 0.571 73.4 86.4 -75.0 -8.3 22.7 14.8 1.7 114 114 A F <> + 0 0 41 -3,-2.6 4,-2.3 1,-0.2 5,-0.3 -0.402 57.6 162.5 -88.3 57.7 24.7 12.9 -0.9 115 115 A T H > + 0 0 81 -2,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.856 64.2 43.7 -44.8 -56.9 21.5 11.3 -2.1 116 116 A N H > S+ 0 0 81 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.883 113.6 47.5 -62.4 -45.8 22.5 10.1 -5.4 117 117 A A H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.869 109.7 56.9 -65.5 -33.5 25.8 8.6 -4.5 118 118 A L H X S+ 0 0 13 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.909 108.0 46.3 -62.1 -43.1 24.1 6.9 -1.6 119 119 A R H X S+ 0 0 118 -4,-1.7 4,-1.8 -5,-0.3 -1,-0.2 0.927 112.2 51.6 -68.6 -35.5 21.7 5.2 -3.9 120 120 A M H X>S+ 0 0 17 -4,-2.3 5,-2.2 1,-0.2 4,-0.5 0.882 107.1 52.0 -68.1 -37.6 24.6 4.3 -6.1 121 121 A L H ><5S+ 0 0 2 -4,-2.8 3,-1.5 1,-0.2 -1,-0.2 0.930 107.4 54.4 -64.9 -37.1 26.5 2.8 -3.3 122 122 A Q H 3<5S+ 0 0 86 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.911 107.4 48.7 -64.7 -35.2 23.4 0.8 -2.5 123 123 A Q H 3<5S- 0 0 93 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.472 113.6-118.3 -81.0 -2.5 23.2 -0.6 -5.9 124 124 A K T <<5 + 0 0 102 -3,-1.5 2,-1.1 -4,-0.5 -3,-0.2 0.797 62.4 149.4 66.8 35.3 26.9 -1.5 -5.9 125 125 A R >< + 0 0 116 -5,-2.2 4,-2.4 1,-0.2 5,-0.3 -0.686 17.7 172.8 -99.5 76.9 27.7 0.8 -8.7 126 126 A W H > + 0 0 52 -2,-1.1 4,-1.9 2,-0.2 -1,-0.2 0.877 69.9 46.2 -54.2 -56.8 31.2 1.6 -7.5 127 127 A D H > S+ 0 0 113 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.939 114.6 49.5 -57.7 -48.1 32.6 3.5 -10.5 128 128 A E H > S+ 0 0 106 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.898 110.0 47.8 -63.6 -42.4 29.5 5.7 -10.7 129 129 A A H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 -1,-0.2 0.887 108.9 55.0 -64.9 -36.6 29.3 6.6 -7.1 130 130 A A H X S+ 0 0 10 -4,-1.9 4,-1.0 -5,-0.3 -1,-0.2 0.888 107.2 49.3 -65.7 -36.6 32.9 7.5 -6.9 131 131 A V H X S+ 0 0 96 -4,-1.7 4,-0.7 2,-0.2 3,-0.5 0.912 112.9 47.5 -66.8 -41.5 32.5 9.9 -9.8 132 132 A N H >< S+ 0 0 39 -4,-2.0 3,-1.0 1,-0.2 -2,-0.2 0.907 106.0 58.1 -67.1 -38.1 29.5 11.5 -8.2 133 133 A L H 3< S+ 0 0 3 -4,-3.1 6,-0.3 1,-0.2 -1,-0.2 0.827 99.5 60.3 -62.5 -26.7 31.2 11.7 -4.8 134 134 A A H 3< S+ 0 0 27 -4,-1.0 2,-2.0 -3,-0.5 -1,-0.2 0.747 85.8 77.7 -74.3 -21.8 34.0 13.8 -6.4 135 135 A K S << S+ 0 0 158 -3,-1.0 2,-0.3 -4,-0.7 -1,-0.2 -0.499 81.1 95.2 -84.6 72.0 31.6 16.5 -7.6 136 136 A S S > S- 0 0 18 -2,-2.0 4,-1.9 1,-0.1 5,-0.1 -0.985 85.6-112.5-154.9 162.0 31.4 18.1 -4.2 137 137 A R H > S+ 0 0 151 -2,-0.3 4,-3.4 1,-0.2 5,-0.3 0.888 115.1 62.7 -61.8 -39.6 32.8 20.8 -2.0 138 138 A W H > S+ 0 0 18 1,-0.2 4,-2.2 2,-0.2 8,-0.2 0.926 105.3 42.6 -52.3 -50.8 34.2 18.1 0.2 139 139 A Y H 4 S+ 0 0 54 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.903 115.3 51.0 -65.6 -41.7 36.4 16.7 -2.6 140 140 A N H < S+ 0 0 111 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.881 114.8 41.4 -67.1 -35.5 37.4 20.2 -3.6 141 141 A Q H < S+ 0 0 92 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.878 131.8 20.6 -80.9 -36.4 38.4 21.4 -0.2 142 142 A T S X S+ 0 0 24 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 -0.545 72.8 162.7-130.6 68.9 40.2 18.2 1.1 143 143 A P H > S+ 0 0 53 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.788 70.5 51.4 -58.6 -37.5 41.1 16.4 -2.1 144 144 A N H > S+ 0 0 117 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.916 115.7 41.0 -70.7 -41.5 43.8 14.0 -0.7 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.941 115.1 50.7 -71.3 -47.5 41.6 12.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 -8,-0.2 -2,-0.2 0.866 108.3 54.3 -56.0 -39.5 38.5 12.6 -0.2 147 147 A K H X S+ 0 0 103 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.893 107.1 50.7 -61.6 -41.0 40.6 10.6 -2.8 148 148 A R H X S+ 0 0 68 -4,-1.5 4,-1.5 2,-0.2 12,-0.2 0.946 114.5 42.4 -60.8 -49.6 41.5 8.1 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.918 114.0 52.1 -64.9 -44.0 37.9 7.6 1.0 150 150 A I H X S+ 0 0 16 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.871 108.4 49.9 -62.8 -37.1 36.6 7.5 -2.5 151 151 A T H X S+ 0 0 40 -4,-2.2 4,-2.7 1,-0.2 6,-0.3 0.828 106.8 56.4 -68.5 -33.9 39.2 4.8 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-1.9 1,-0.2 -1,-0.2 0.862 109.0 46.3 -64.2 -37.6 38.1 2.8 -0.6 153 153 A F H < S+ 0 0 1 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.889 114.7 47.3 -72.2 -38.9 34.5 2.9 -1.9 154 154 A R H < S+ 0 0 108 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.960 124.7 26.6 -64.5 -49.8 35.6 2.1 -5.4 155 155 A T H < S- 0 0 46 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.670 84.2-137.0 -88.6 -32.7 37.8 -0.8 -4.6 156 156 A G S < S+ 0 0 15 -4,-1.9 2,-0.2 -5,-0.3 -62,-0.2 0.642 72.2 99.0 76.8 15.2 36.7 -2.3 -1.4 157 157 A T S S- 0 0 51 -6,-0.3 3,-0.4 -63,-0.1 -1,-0.3 -0.777 79.9-117.2-126.1 170.8 40.3 -2.7 -0.2 158 158 A W S >> S+ 0 0 41 -2,-0.2 3,-1.8 1,-0.2 4,-0.5 0.137 73.3 120.1 -94.9 18.8 42.6 -0.6 2.1 159 159 A D G >4 + 0 0 88 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.819 62.5 60.4 -55.0 -38.4 45.1 0.2 -0.5 160 160 A A G 34 S+ 0 0 36 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.669 112.0 45.0 -64.7 -16.1 44.8 4.0 -0.5 161 161 A Y G <4 0 0 18 -3,-1.8 -1,-0.3 -13,-0.1 -2,-0.2 0.445 360.0 360.0-106.8 -2.8 45.9 3.7 3.0 162 162 A K << 0 0 174 -3,-1.4 -2,-0.2 -4,-0.5 -3,-0.1 0.912 360.0 360.0 -91.8 360.0 48.7 1.2 2.6