==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 13-MAY-93 1DYF . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR H.-J.ZHOU,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8626.0 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 . 8 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 53.1 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 0 1 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 79 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 146.7 43.8 -1.8 8.8 2 2 A N > - 0 0 69 95,-0.0 4,-2.6 1,-0.0 5,-0.2 -0.884 360.0 -85.9-146.8 175.0 40.7 -0.8 10.8 3 3 A I H > S+ 0 0 21 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.831 123.3 51.5 -54.6 -41.2 38.6 2.3 11.3 4 4 A F H > S+ 0 0 74 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.941 112.6 44.2 -65.0 -46.4 40.7 3.7 14.0 5 5 A E H > S+ 0 0 100 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.905 114.0 52.8 -64.3 -39.1 43.9 3.4 12.0 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.956 113.1 40.9 -61.6 -53.8 42.1 4.8 9.0 7 7 A L H X S+ 0 0 0 -4,-3.1 4,-2.7 1,-0.2 5,-0.4 0.859 108.8 60.5 -65.8 -32.7 40.9 7.8 10.8 8 8 A R H X S+ 0 0 104 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.907 107.7 47.6 -62.4 -32.4 44.2 8.4 12.6 9 9 A I H < S+ 0 0 88 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.923 115.6 42.4 -73.7 -41.9 45.8 8.7 9.2 10 10 A D H < S+ 0 0 19 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.806 126.2 30.6 -75.9 -30.2 43.2 11.1 7.8 11 11 A E H < S- 0 0 45 -4,-2.7 19,-0.3 -5,-0.2 -2,-0.2 0.724 90.3-152.4-101.4 -26.0 42.9 13.3 10.9 12 12 A G < - 0 0 25 -4,-1.9 2,-0.4 -5,-0.4 -1,-0.1 -0.123 24.5 -88.1 76.9-176.9 46.3 13.2 12.6 13 13 A L + 0 0 42 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.988 42.5 172.0-136.9 124.0 46.8 13.7 16.4 14 14 A R E -A 28 0A 132 14,-1.3 14,-2.3 -2,-0.4 4,-0.1 -0.998 19.7-163.0-136.5 130.1 47.4 17.0 18.1 15 15 A L E S+ 0 0 66 -2,-0.4 43,-2.3 12,-0.2 2,-0.4 0.296 74.0 64.1 -94.8 6.8 47.4 17.6 21.8 16 16 A K E S-C 57 0B 93 41,-0.2 41,-0.2 12,-0.1 10,-0.1 -0.967 99.5 -87.6-132.5 144.9 46.9 21.3 21.7 17 17 A I E + 0 0 16 39,-1.8 2,-0.3 -2,-0.4 10,-0.2 -0.177 58.5 169.0 -47.9 138.9 43.9 23.2 20.4 18 18 A Y E -A 26 0A 29 8,-3.1 8,-3.0 -4,-0.1 2,-0.5 -0.902 35.9-103.4-147.0 171.9 44.2 23.9 16.7 19 19 A K E -A 25 0A 126 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.865 32.9-139.4-101.9 137.3 42.3 25.1 13.8 20 20 A D > - 0 0 51 4,-2.7 3,-1.6 -2,-0.5 -1,-0.1 -0.041 41.3 -80.4 -78.3-168.2 41.0 22.6 11.3 21 21 A T T 3 S+ 0 0 106 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.635 134.8 47.7 -67.8 -18.8 41.0 23.0 7.6 22 22 A E T 3 S- 0 0 80 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.321 124.4-102.7-102.1 3.0 37.8 25.1 7.9 23 23 A G S < S+ 0 0 33 -3,-1.6 2,-0.4 1,-0.3 -2,-0.1 0.559 74.1 142.0 86.1 14.1 39.3 27.2 10.7 24 24 A Y - 0 0 74 1,-0.1 -4,-2.7 9,-0.0 -1,-0.3 -0.718 59.2-103.6 -95.2 146.3 37.4 25.6 13.5 25 25 A Y E +AB 19 34A 34 9,-0.7 8,-3.1 11,-0.4 9,-1.4 -0.393 54.2 158.8 -65.4 125.7 38.8 24.9 16.8 26 26 A T E -AB 18 32A 3 -8,-3.0 -8,-3.1 6,-0.3 2,-0.3 -0.894 19.0-169.7-143.2 167.0 39.7 21.2 17.2 27 27 A I E > + B 0 31A 0 4,-1.6 4,-2.1 -2,-0.3 -12,-0.2 -0.956 51.0 4.8-154.4 167.2 41.9 19.0 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.3 -2,-0.3 2,-1.1 -0.306 122.1 -6.3 61.2-130.6 43.1 15.4 19.4 29 29 A I T 4 S- 0 0 5 34,-0.5 -1,-0.2 -16,-0.2 -16,-0.1 -0.642 127.6 -52.3-100.5 76.3 42.1 13.2 16.6 30 30 A G T 4 S+ 0 0 16 -2,-1.1 2,-0.9 -19,-0.3 -2,-0.2 0.774 84.1 159.3 66.6 28.6 39.8 15.4 14.7 31 31 A H E < -B 27 0A 31 -4,-2.1 -4,-1.6 32,-0.0 2,-0.2 -0.695 33.1-144.0 -88.2 104.4 37.5 16.3 17.7 32 32 A L E -B 26 0A 69 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.456 18.9-177.2 -65.7 129.2 35.7 19.5 16.8 33 33 A L E - 0 0 16 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.879 58.0 -27.3 -94.0 -45.4 35.3 21.7 19.7 34 34 A T E -B 25 0A 28 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.985 33.3-135.7-166.9 157.3 33.3 24.5 18.3 35 35 A K S S+ 0 0 141 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.286 74.4 109.7 -98.6 2.4 32.5 26.6 15.3 36 36 A S S S- 0 0 42 2,-0.1 -11,-0.4 1,-0.1 -2,-0.1 -0.548 73.5-130.3 -81.3 147.2 32.8 29.8 17.2 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.575 77.0 105.8 -72.3 -10.8 35.7 32.2 16.6 38 38 A S > - 0 0 49 1,-0.2 4,-2.1 2,-0.0 5,-0.2 -0.629 56.4-161.1 -84.0 115.8 36.4 32.4 20.2 39 39 A L H > S+ 0 0 68 -2,-0.7 4,-2.8 1,-0.2 5,-0.2 0.817 96.9 55.7 -58.1 -28.5 39.4 30.6 21.6 40 40 A N H > S+ 0 0 115 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.933 102.3 52.1 -72.5 -43.5 37.8 30.9 24.9 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.891 113.1 48.6 -56.6 -35.4 34.6 29.3 23.9 42 42 A A H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.920 109.5 49.5 -67.6 -48.3 36.9 26.5 22.6 43 43 A K H X S+ 0 0 52 -4,-2.8 4,-1.7 2,-0.2 11,-0.3 0.879 112.4 49.9 -60.7 -33.7 38.8 26.3 25.8 44 44 A S H X S+ 0 0 70 -4,-3.0 4,-2.1 1,-0.2 5,-0.2 0.966 109.5 49.1 -71.5 -47.3 35.6 26.2 27.6 45 45 A E H X S+ 0 0 62 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.906 108.9 55.8 -57.8 -40.5 34.2 23.4 25.5 46 46 A L H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 5,-0.3 0.910 107.2 46.5 -58.1 -45.5 37.4 21.5 25.9 47 47 A D H X>S+ 0 0 34 -4,-1.7 4,-2.7 1,-0.2 5,-0.8 0.893 111.3 52.5 -65.1 -38.0 37.3 21.5 29.7 48 48 A K H <5S+ 0 0 145 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.848 111.6 47.0 -65.4 -35.5 33.7 20.5 29.7 49 49 A A H <5S+ 0 0 45 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.862 122.3 33.6 -76.5 -32.0 34.5 17.6 27.4 50 50 A I H <5S- 0 0 39 -4,-2.3 -2,-0.2 2,-0.2 -3,-0.2 0.722 101.2-130.6 -92.0 -29.3 37.5 16.4 29.4 51 51 A G T <5S+ 0 0 65 -4,-2.7 2,-0.3 -5,-0.3 -3,-0.2 0.771 74.1 77.3 83.2 27.0 36.1 17.3 32.7 52 52 A R S - 0 0 10 -2,-0.9 3,-1.0 -11,-0.3 -1,-0.2 0.748 31.5-146.8 -95.3 -31.5 42.9 21.8 30.5 55 55 A N T 3 S- 0 0 118 1,-0.3 3,-0.1 -12,-0.2 -2,-0.1 0.905 74.7 -56.4 58.9 41.7 44.1 25.2 29.5 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.8 1,-0.1 2,-0.4 0.560 118.3 99.1 69.9 14.4 43.8 24.0 25.9 57 57 A V B < +C 16 0B 64 -3,-1.0 2,-0.3 -41,-0.2 -41,-0.2 -0.982 44.4 178.8-134.6 144.9 46.1 21.0 26.2 58 58 A I - 0 0 3 -43,-2.3 2,-0.2 -2,-0.4 -30,-0.1 -0.858 26.1-109.7-135.2 170.7 45.4 17.4 26.6 59 59 A T > - 0 0 65 -2,-0.3 4,-2.4 1,-0.1 5,-0.1 -0.470 32.7-109.0 -94.6 169.2 47.2 14.1 27.0 60 60 A K H > S+ 0 0 103 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.896 120.6 54.7 -62.4 -43.5 47.3 11.3 24.4 61 61 A D H > S+ 0 0 119 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.916 109.4 47.2 -56.1 -47.3 45.2 9.2 26.6 62 62 A E H > S+ 0 0 35 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.888 110.1 52.9 -62.9 -41.6 42.6 12.0 26.7 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -34,-0.5 0.905 110.1 48.5 -61.5 -40.1 42.8 12.3 22.9 64 64 A E H X S+ 0 0 76 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.787 107.8 55.0 -69.7 -31.5 42.2 8.6 22.5 65 65 A K H X S+ 0 0 139 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.946 109.0 46.1 -67.7 -46.0 39.3 8.7 24.8 66 66 A L H X S+ 0 0 4 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.909 112.0 53.9 -60.9 -40.1 37.6 11.4 22.8 67 67 A F H X S+ 0 0 13 -4,-1.8 4,-2.6 2,-0.2 5,-0.3 0.927 106.8 49.5 -61.2 -47.4 38.4 9.4 19.7 68 68 A N H X S+ 0 0 93 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.941 113.2 48.4 -57.9 -42.4 36.7 6.3 21.0 69 69 A Q H X S+ 0 0 99 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.919 111.6 48.4 -61.9 -46.9 33.7 8.3 21.9 70 70 A D H X S+ 0 0 32 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.873 111.3 48.6 -64.5 -40.1 33.5 10.0 18.5 71 71 A V H X S+ 0 0 6 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.925 112.9 48.8 -66.5 -43.3 33.8 6.7 16.6 72 72 A D H X S+ 0 0 84 -4,-2.3 4,-2.8 -5,-0.3 5,-0.3 0.943 111.1 50.2 -60.4 -46.8 31.1 5.1 18.7 73 73 A A H X S+ 0 0 47 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.893 109.4 51.7 -58.4 -42.1 28.8 8.1 18.2 74 74 A A H X S+ 0 0 9 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.959 111.6 45.6 -61.2 -50.8 29.3 8.0 14.5 75 75 A V H X S+ 0 0 37 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.967 115.2 47.1 -57.1 -51.5 28.4 4.3 14.2 76 76 A R H X S+ 0 0 125 -4,-2.8 4,-0.9 -5,-0.2 -1,-0.2 0.925 110.9 53.2 -58.3 -39.4 25.4 4.7 16.4 77 77 A G H >X S+ 0 0 0 -4,-2.7 4,-0.8 -5,-0.3 3,-0.8 0.924 108.6 48.5 -63.1 -43.6 24.4 7.8 14.5 78 78 A I H >< S+ 0 0 0 -4,-2.6 3,-1.1 1,-0.2 7,-0.4 0.946 109.8 53.0 -59.4 -45.1 24.5 5.9 11.2 79 79 A L H 3< S+ 0 0 69 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.644 111.4 45.9 -68.9 -12.6 22.5 3.1 12.7 80 80 A R H << S+ 0 0 174 -4,-0.9 2,-0.5 -3,-0.8 -1,-0.3 0.467 91.1 98.6-101.1 -14.1 19.8 5.4 13.8 81 81 A N S+ 0 0 132 2,-0.1 4,-0.5 3,-0.1 -1,-0.2 0.820 120.4 40.5 -88.9 -34.8 18.8 7.3 5.3 84 84 A L H > S+ 0 0 0 -7,-0.2 4,-2.5 2,-0.1 3,-0.4 0.867 100.9 67.4 -82.8 -39.0 22.1 6.0 6.4 85 85 A K H X S+ 0 0 81 -4,-3.0 4,-3.1 -7,-0.4 5,-0.2 0.888 98.5 50.3 -52.2 -48.2 21.2 2.7 7.9 86 86 A P H > S+ 0 0 51 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.881 111.8 49.2 -63.0 -33.4 20.1 0.9 4.8 87 87 A V H X S+ 0 0 2 -4,-0.5 4,-0.8 -3,-0.4 3,-0.2 0.966 112.1 47.4 -68.7 -48.8 23.2 1.9 3.0 88 88 A Y H >< S+ 0 0 37 -4,-2.5 3,-1.7 1,-0.3 -1,-0.2 0.946 110.6 53.1 -53.6 -51.1 25.4 0.8 5.8 89 89 A D H 3< S+ 0 0 75 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.834 106.8 53.2 -58.0 -34.6 23.5 -2.5 6.0 90 90 A S H 3< S+ 0 0 36 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.637 96.0 87.1 -78.3 -13.0 24.0 -3.1 2.4 91 91 A L S << S- 0 0 7 -3,-1.7 31,-0.0 -4,-0.8 2,-0.0 -0.565 74.7-115.2 -92.8 160.4 27.8 -2.7 2.3 92 92 A D > - 0 0 56 -2,-0.2 4,-1.6 1,-0.1 5,-0.2 -0.218 45.8 -91.6 -75.6 171.0 30.7 -5.0 2.9 93 93 A A H > S+ 0 0 74 1,-0.2 4,-1.5 2,-0.2 -2,-0.1 0.896 120.8 47.8 -54.9 -48.5 33.1 -4.4 5.8 94 94 A V H >> S+ 0 0 25 1,-0.2 4,-1.4 62,-0.2 3,-0.7 0.960 112.8 46.6 -60.9 -52.0 35.6 -2.2 4.1 95 95 A R H 3> S+ 0 0 23 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.785 104.5 62.8 -63.3 -26.3 33.2 0.1 2.5 96 96 A R H 3X S+ 0 0 78 -4,-1.6 4,-2.3 1,-0.2 -1,-0.3 0.895 100.8 53.4 -64.3 -37.0 31.3 0.4 5.7 97 97 A C H S+ 0 0 52 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.894 128.7 52.2 -56.3 -45.5 25.3 12.5 9.7 109 109 A T H > S+ 0 0 123 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.925 108.0 51.3 -60.7 -47.1 23.4 15.3 8.3 110 110 A G H >< S+ 0 0 31 -4,-0.7 3,-0.9 1,-0.2 -2,-0.2 0.934 114.1 42.3 -58.5 -48.8 26.1 16.2 5.9 111 111 A V H >< S+ 0 0 0 -4,-2.6 3,-2.5 1,-0.3 -1,-0.2 0.885 104.3 64.0 -68.5 -36.2 26.4 12.7 4.6 112 112 A A H 3< S+ 0 0 12 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.751 94.4 65.2 -59.2 -21.1 22.7 12.1 4.4 113 113 A G T << S+ 0 0 57 -4,-0.9 2,-0.7 -3,-0.9 3,-0.3 0.429 75.5 87.4 -79.7 0.1 22.7 14.9 1.8 114 114 A F <> + 0 0 39 -3,-2.5 4,-3.0 1,-0.2 5,-0.3 -0.277 56.7 155.5 -95.1 52.3 24.8 12.8 -0.6 115 115 A T H > + 0 0 83 -2,-0.7 4,-1.9 1,-0.2 -1,-0.2 0.827 64.8 43.0 -45.9 -54.9 21.5 11.4 -1.9 116 116 A N H > S+ 0 0 88 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.938 115.2 48.9 -65.7 -43.9 22.5 10.4 -5.3 117 117 A S H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.889 109.8 53.4 -59.8 -43.7 25.8 8.9 -4.2 118 118 A L H X S+ 0 0 13 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.912 108.0 50.4 -59.9 -41.3 24.1 6.9 -1.4 119 119 A R H X S+ 0 0 119 -4,-1.9 4,-1.8 -5,-0.3 -1,-0.2 0.917 110.9 49.0 -64.4 -39.6 21.6 5.4 -3.9 120 120 A M H <>S+ 0 0 23 -4,-2.2 5,-2.1 2,-0.2 -1,-0.2 0.858 109.4 50.9 -69.1 -36.2 24.4 4.4 -6.1 121 121 A L H ><5S+ 0 0 2 -4,-2.1 3,-1.8 1,-0.2 -1,-0.2 0.924 108.6 53.7 -66.8 -37.9 26.4 2.8 -3.3 122 122 A Q H 3<5S+ 0 0 88 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.897 107.9 49.1 -63.3 -33.2 23.3 1.0 -2.4 123 123 A Q T 3<5S- 0 0 85 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.416 113.2-119.4 -85.7 4.9 23.0 -0.3 -5.9 124 124 A K T < 5 + 0 0 99 -3,-1.8 2,-1.2 -4,-0.2 -3,-0.2 0.752 63.2 146.6 62.4 32.5 26.7 -1.4 -5.9 125 125 A R >< + 0 0 109 -5,-2.1 4,-2.6 1,-0.2 5,-0.2 -0.652 20.8 174.8 -97.7 73.3 27.6 0.8 -8.8 126 126 A W H > S+ 0 0 50 -2,-1.2 4,-2.1 1,-0.2 5,-0.2 0.871 70.0 43.3 -50.2 -56.0 31.1 1.6 -7.6 127 127 A D H > S+ 0 0 104 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.918 115.3 49.8 -64.4 -40.0 32.6 3.6 -10.4 128 128 A E H > S+ 0 0 99 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.923 110.3 48.9 -67.6 -41.0 29.5 5.7 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.895 108.0 56.4 -63.2 -37.0 29.2 6.5 -7.2 130 130 A A H X S+ 0 0 10 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.887 107.8 47.6 -62.8 -38.8 32.9 7.5 -7.1 131 131 A M H X S+ 0 0 131 -4,-1.8 4,-0.6 -5,-0.2 -1,-0.2 0.922 112.1 48.6 -71.7 -38.0 32.4 9.9 -9.8 132 132 A N H >< S+ 0 0 46 -4,-1.9 3,-1.2 1,-0.2 -2,-0.2 0.905 106.7 55.3 -67.2 -41.3 29.4 11.4 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-2.9 6,-0.4 1,-0.2 -1,-0.2 0.874 100.8 62.9 -57.1 -32.9 31.1 11.7 -4.8 134 134 A A H 3< S+ 0 0 26 -4,-1.3 2,-1.8 1,-0.2 -1,-0.2 0.709 84.9 77.2 -66.9 -23.0 33.8 13.8 -6.5 135 135 A K S << S+ 0 0 178 -3,-1.2 2,-0.3 -4,-0.6 -1,-0.2 -0.503 81.4 96.6 -90.0 71.7 31.4 16.5 -7.5 136 136 A S S > S- 0 0 18 -2,-1.8 4,-2.2 1,-0.1 5,-0.2 -0.995 84.0-114.9-154.9 158.4 31.2 18.1 -4.1 137 137 A R H > S+ 0 0 151 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.906 115.6 62.0 -56.8 -43.3 32.6 20.8 -2.0 138 138 A W H > S+ 0 0 17 1,-0.2 4,-2.4 2,-0.2 8,-0.3 0.915 105.7 43.8 -48.5 -52.2 34.0 18.0 0.2 139 139 A Y H 4 S+ 0 0 62 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.901 114.9 49.9 -63.8 -43.2 36.2 16.8 -2.6 140 140 A N H < S+ 0 0 110 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.803 114.8 43.0 -68.2 -29.5 37.2 20.3 -3.6 141 141 A Q H < S+ 0 0 101 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.869 132.0 17.6 -83.8 -40.2 38.2 21.3 -0.1 142 142 A T S X S+ 0 0 22 -4,-2.4 4,-2.9 -5,-0.3 5,-0.2 -0.602 72.9 163.1-134.4 75.0 40.1 18.2 1.0 143 143 A P H > + 0 0 48 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.851 69.7 52.6 -64.1 -41.4 40.9 16.4 -2.1 144 144 A N H > S+ 0 0 111 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.926 116.1 40.2 -65.0 -43.4 43.6 14.0 -0.9 145 145 A R H > S+ 0 0 18 2,-0.2 4,-2.4 1,-0.2 3,-0.4 0.949 115.3 51.8 -68.4 -49.3 41.5 12.7 1.9 146 146 A A H X S+ 0 0 0 -4,-2.9 4,-3.1 -8,-0.3 5,-0.2 0.940 108.5 52.7 -52.4 -47.1 38.4 12.6 -0.3 147 147 A K H X S+ 0 0 94 -4,-2.9 4,-2.1 -5,-0.2 -1,-0.2 0.867 107.4 51.5 -58.0 -36.9 40.3 10.7 -2.8 148 148 A R H X S+ 0 0 67 -4,-1.5 4,-1.7 -3,-0.4 -1,-0.2 0.942 113.5 43.7 -65.7 -45.3 41.3 8.1 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.924 113.8 51.4 -65.1 -43.4 37.7 7.6 0.9 150 150 A I H X S+ 0 0 14 -4,-3.1 4,-2.2 -5,-0.3 -1,-0.2 0.880 108.3 50.2 -62.2 -39.5 36.5 7.5 -2.6 151 151 A T H X S+ 0 0 36 -4,-2.1 4,-2.9 -5,-0.2 6,-0.4 0.865 107.1 56.2 -67.2 -34.0 39.0 4.9 -3.7 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.7 1,-0.2 5,-0.2 0.931 110.7 43.4 -60.5 -45.1 38.0 2.8 -0.7 153 153 A F H < S+ 0 0 2 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.872 115.4 50.7 -66.2 -39.0 34.3 2.9 -1.9 154 154 A R H < S+ 0 0 103 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.926 124.5 23.9 -67.2 -44.3 35.4 2.2 -5.5 155 155 A T H < S- 0 0 44 -4,-2.9 -2,-0.2 2,-0.2 -3,-0.2 0.677 85.7-134.7 -98.6 -25.6 37.6 -0.8 -4.8 156 156 A G S < S+ 0 0 15 -4,-2.7 2,-0.2 -5,-0.3 -62,-0.2 0.672 73.8 100.4 76.5 11.2 36.4 -2.3 -1.5 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.789 80.0-119.1-125.2 173.7 40.1 -2.6 -0.4 158 158 A W S > S+ 0 0 38 -2,-0.2 3,-2.2 1,-0.2 4,-0.5 0.151 73.3 119.4 -94.4 12.7 42.5 -0.6 1.9 159 159 A D G > + 0 0 98 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.826 65.6 59.8 -50.2 -38.7 44.9 0.2 -0.9 160 160 A A G 3 S+ 0 0 35 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.727 110.1 44.6 -65.1 -19.1 44.6 3.9 -0.6 161 161 A Y G < 0 0 19 -3,-2.2 -1,-0.3 -13,-0.1 -2,-0.2 0.357 360.0 360.0-105.3 1.9 45.8 3.7 2.9 162 162 A K < 0 0 167 -3,-1.5 -2,-0.2 -4,-0.5 -3,-0.1 0.826 360.0 360.0-106.5 360.0 48.6 1.3 2.3