==== 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) 28-JAN-91 1L37 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR S.DAOPIN,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8677.0 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 . 7 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 6.1 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 74 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 150.3 36.8 -23.5 9.0 2 2 A N > - 0 0 70 95,-0.0 4,-2.5 92,-0.0 5,-0.2 -0.836 360.0 -88.0-140.4 173.2 34.7 -21.0 10.9 3 3 A I H > S+ 0 0 22 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.827 123.1 53.1 -54.0 -39.4 34.4 -17.2 11.3 4 4 A F H > S+ 0 0 79 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.928 111.6 42.9 -65.8 -46.5 37.0 -17.1 14.1 5 5 A E H > S+ 0 0 89 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.871 113.6 53.8 -67.5 -35.8 39.6 -18.9 12.2 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.939 112.8 42.4 -62.9 -47.0 38.8 -16.9 9.1 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 5,-0.3 0.839 108.7 57.7 -69.7 -32.4 39.2 -13.7 10.9 8 8 A R H X S+ 0 0 108 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.874 107.9 49.5 -66.3 -30.4 42.3 -14.8 12.7 9 9 A I H < S+ 0 0 54 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.967 115.2 42.8 -71.3 -47.0 43.9 -15.4 9.3 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.769 125.4 30.3 -67.8 -33.2 42.9 -12.0 8.0 11 11 A E H < S- 0 0 31 -4,-2.1 19,-0.4 -5,-0.2 -1,-0.2 0.679 90.7-149.4-103.8 -25.7 43.8 -9.9 11.0 12 12 A G < - 0 0 20 -4,-1.7 2,-0.4 -5,-0.3 -1,-0.1 -0.193 24.5 -90.5 78.9-179.2 46.7 -11.7 12.7 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.989 41.9 175.9-134.8 126.5 47.3 -11.6 16.5 14 14 A R E -A 28 0A 129 14,-1.7 14,-2.1 -2,-0.4 4,-0.1 -1.000 18.0-164.8-134.3 129.8 49.4 -8.9 18.1 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.2 12,-0.2 2,-0.3 0.427 73.9 62.4 -95.0 1.0 49.9 -8.5 21.8 16 16 A K E S-C 57 0B 106 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.916 102.3 -85.7-123.2 145.8 51.4 -5.0 21.8 17 17 A I E + 0 0 21 39,-1.7 2,-0.3 -2,-0.3 10,-0.2 -0.263 60.1 173.9 -48.6 138.3 49.6 -1.8 20.5 18 18 A Y E -A 26 0A 28 8,-3.1 8,-2.9 -4,-0.1 2,-0.5 -0.866 33.9-107.3-141.7 170.4 50.2 -1.6 16.8 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.902 33.0-139.8-104.6 132.2 49.1 0.5 13.8 20 20 A D > - 0 0 48 4,-3.1 3,-1.7 -2,-0.5 -1,-0.0 -0.089 40.0 -81.9 -76.0-169.2 46.7 -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 0.824 133.9 49.9 -67.2 -27.4 46.9 -0.7 7.6 22 22 A E T 3 S- 0 0 78 2,-0.1 -1,-0.3 1,-0.0 -3,-0.0 0.463 123.8-104.8 -87.1 -3.7 45.1 2.7 7.9 23 23 A G S < S+ 0 0 35 -3,-1.7 2,-0.3 1,-0.3 -2,-0.1 0.577 73.6 140.5 91.8 14.1 47.5 3.8 10.6 24 24 A Y - 0 0 80 1,-0.1 -4,-3.1 -5,-0.0 -1,-0.3 -0.678 60.5-100.6 -97.3 152.0 45.2 3.5 13.5 25 25 A Y E +AB 19 34A 32 9,-0.7 8,-3.1 11,-0.4 9,-1.4 -0.471 54.4 160.6 -66.4 120.8 46.0 2.2 16.9 26 26 A T E -AB 18 32A 3 -8,-2.9 -8,-3.1 -2,-0.3 2,-0.3 -0.877 19.1-169.5-138.7 162.2 44.9 -1.5 17.3 27 27 A I E > + B 0 31A 0 4,-1.4 4,-1.9 -2,-0.3 -12,-0.2 -0.963 53.4 1.7-148.6 164.5 45.7 -4.4 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.1 -14,-1.7 -2,-0.3 2,-0.8 -0.351 123.0 -5.6 66.8-130.9 44.9 -8.2 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.709 127.1 -53.3-104.0 75.0 43.0 -9.6 16.6 30 30 A G T 4 S+ 0 0 15 -2,-0.8 2,-1.1 -19,-0.4 -2,-0.2 0.769 83.6 159.7 65.4 28.8 42.1 -6.4 14.7 31 31 A H E < -B 27 0A 35 -4,-1.9 -4,-1.4 1,-0.0 -1,-0.2 -0.701 34.1-142.8 -84.7 101.8 40.6 -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 -0.347 18.7-175.3 -62.1 131.8 40.6 -0.9 16.8 33 33 A L E - 0 0 14 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.892 59.1 -25.1 -94.4 -47.4 41.4 1.2 19.8 34 34 A T E -B 25 0A 26 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.982 36.3-137.3-160.8 152.4 41.1 4.7 18.5 35 35 A K S S+ 0 0 143 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.509 75.4 113.8 -90.8 -3.8 41.4 6.7 15.3 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.323 71.7-133.4 -68.4 142.5 43.3 9.3 17.4 37 37 A P S S+ 0 0 117 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.652 76.5 102.3 -73.1 -10.9 46.9 10.0 16.7 38 38 A S > - 0 0 48 1,-0.2 4,-2.1 2,-0.1 5,-0.1 -0.662 55.4-162.5 -84.9 122.4 47.8 9.9 20.3 39 39 A L H > S+ 0 0 66 -2,-0.6 4,-2.2 1,-0.3 -1,-0.2 0.722 100.0 56.4 -67.1 -21.3 49.4 6.7 21.6 40 40 A N H > S+ 0 0 117 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.933 102.5 49.9 -77.2 -41.5 48.4 8.0 24.9 41 41 A A H > S+ 0 0 34 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.912 113.5 50.6 -60.0 -35.4 44.8 8.2 23.8 42 42 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.866 106.8 50.8 -67.9 -43.0 45.3 4.5 22.7 43 43 A K H X S+ 0 0 51 -4,-2.2 4,-1.8 2,-0.2 11,-0.3 0.841 110.9 50.5 -68.7 -26.0 46.7 3.3 25.9 44 44 A S H X S+ 0 0 74 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.895 109.8 48.7 -73.7 -43.4 43.8 4.8 27.8 45 45 A E H X S+ 0 0 65 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.916 110.0 54.3 -62.9 -42.7 41.3 3.2 25.6 46 46 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 5,-0.3 0.929 108.0 47.2 -58.5 -47.3 43.1 -0.1 26.0 47 47 A D H X>S+ 0 0 37 -4,-1.8 4,-2.4 1,-0.2 5,-0.7 0.865 112.1 51.2 -63.4 -35.8 43.0 0.0 29.8 48 48 A K H <5S+ 0 0 145 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.874 110.9 48.9 -65.9 -38.5 39.3 0.9 29.7 49 49 A A H <5S+ 0 0 45 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.825 120.9 34.1 -72.4 -34.2 38.7 -2.0 27.4 50 50 A I H <5S- 0 0 38 -4,-2.0 -2,-0.2 2,-0.3 -1,-0.2 0.714 99.9-127.3 -93.7 -29.8 40.6 -4.6 29.5 51 51 A G T <5S+ 0 0 68 -4,-2.4 2,-0.3 1,-0.4 -3,-0.2 0.717 78.2 77.0 86.5 20.1 39.8 -3.3 32.9 52 52 A R S - 0 0 8 -2,-0.9 3,-1.1 -11,-0.3 -1,-0.2 0.727 30.7-145.2 -94.5 -26.7 48.1 -2.7 30.6 55 55 A N T 3 S- 0 0 126 1,-0.2 -2,-0.1 -12,-0.2 3,-0.1 0.939 74.2 -52.8 60.0 46.5 50.8 -0.4 29.6 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.1 2,-0.4 0.517 120.7 94.0 71.2 6.4 50.2 -1.1 25.9 57 57 A V B < +C 16 0B 62 -3,-1.1 2,-0.3 -41,-0.2 -41,-0.2 -0.981 46.5 178.6-135.9 144.4 50.4 -4.9 26.2 58 58 A I - 0 0 5 -43,-2.2 2,-0.2 -2,-0.4 -30,-0.1 -0.877 27.4-109.4-135.7 164.6 47.8 -7.7 26.8 59 59 A T > - 0 0 66 -2,-0.3 4,-2.2 1,-0.1 3,-0.3 -0.475 35.2-104.1 -89.6 168.6 47.9 -11.5 27.1 60 60 A K H > S+ 0 0 109 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.890 122.5 55.1 -55.6 -46.2 46.6 -14.0 24.6 61 61 A D H > S+ 0 0 121 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.873 107.4 48.2 -54.5 -46.4 43.5 -14.5 26.8 62 62 A E H > S+ 0 0 36 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.850 110.6 53.1 -65.2 -37.3 42.7 -10.8 26.8 63 63 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -34,-0.4 0.892 110.9 45.9 -65.5 -41.1 43.1 -10.8 23.0 64 64 A E H X S+ 0 0 76 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.819 108.9 54.7 -70.2 -34.4 40.7 -13.6 22.6 65 65 A K H X S+ 0 0 137 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.969 110.1 46.7 -64.9 -44.7 38.2 -12.1 24.9 66 66 A L H X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.894 111.7 52.8 -58.9 -40.6 38.2 -8.9 22.9 67 67 A F H X S+ 0 0 11 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.940 106.5 51.4 -63.6 -47.9 37.9 -11.0 19.7 68 68 A N H X S+ 0 0 89 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.950 112.0 48.2 -55.9 -45.4 34.9 -12.9 21.1 69 69 A Q H X S+ 0 0 95 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.898 111.5 49.3 -60.6 -41.7 33.2 -9.6 21.9 70 70 A D H X S+ 0 0 36 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.864 110.6 47.6 -67.7 -37.6 33.9 -8.1 18.5 71 71 A V H X S+ 0 0 6 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.937 114.3 49.5 -67.8 -45.4 32.6 -11.0 16.5 72 72 A D H X S+ 0 0 87 -4,-2.2 4,-2.8 -5,-0.3 5,-0.3 0.936 112.2 46.6 -56.2 -49.8 29.4 -11.0 18.7 73 73 A A H X S+ 0 0 43 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.893 111.2 52.5 -64.2 -37.1 28.9 -7.3 18.2 74 74 A A H X S+ 0 0 9 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.961 112.0 45.2 -63.1 -49.3 29.5 -7.7 14.4 75 75 A V H X S+ 0 0 32 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.943 115.4 46.5 -56.4 -51.3 26.8 -10.4 14.2 76 76 A R H X S+ 0 0 112 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.856 110.0 56.3 -60.1 -36.8 24.3 -8.5 16.4 77 77 A G H >X S+ 0 0 2 -4,-2.5 4,-0.7 -5,-0.3 3,-0.6 0.944 107.3 46.6 -61.3 -50.1 25.0 -5.4 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.1 3,-0.8 1,-0.2 7,-0.4 0.894 111.3 52.8 -57.2 -43.6 24.1 -7.1 11.1 79 79 A L H 3< S+ 0 0 69 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.750 112.5 44.3 -70.9 -18.0 20.9 -8.5 12.7 80 80 A R H << S+ 0 0 173 -4,-1.3 2,-0.5 -3,-0.6 -1,-0.3 0.417 93.7 95.4 -99.4 -8.3 19.8 -5.1 13.8 81 81 A N S+ 0 0 0 -7,-0.1 4,-2.3 -6,-0.1 3,-0.4 0.862 100.1 66.4 -86.4 -44.5 22.1 -5.8 6.3 85 85 A K H X S+ 0 0 83 -4,-2.5 4,-2.9 -7,-0.4 5,-0.2 0.862 99.3 51.8 -47.5 -46.7 19.7 -8.3 7.9 86 86 A P H > S+ 0 0 52 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.883 111.7 47.6 -63.1 -38.2 17.8 -9.2 4.7 87 87 A V H > S+ 0 0 3 -4,-0.4 4,-0.8 -3,-0.4 -2,-0.2 0.939 112.7 47.9 -65.3 -49.6 21.1 -9.9 2.9 88 88 A Y H >< S+ 0 0 35 -4,-2.3 3,-1.5 1,-0.2 -1,-0.2 0.947 111.0 51.1 -54.5 -51.6 22.4 -12.0 5.8 89 89 A D H 3< S+ 0 0 74 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.813 107.4 54.9 -59.4 -30.7 19.2 -14.0 6.0 90 90 A S H 3< S+ 0 0 33 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.642 96.3 88.3 -78.1 -15.9 19.3 -14.7 2.3 91 91 A L S << S- 0 0 5 -3,-1.5 31,-0.0 -4,-0.8 30,-0.0 -0.568 74.6-117.8 -90.4 158.4 22.7 -16.2 2.4 92 92 A D > - 0 0 55 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.123 45.4 -91.6 -74.0 170.7 24.1 -19.7 2.9 93 93 A A H > S+ 0 0 73 1,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.857 121.4 45.6 -59.5 -39.6 26.4 -20.4 5.9 94 94 A V H > S+ 0 0 27 62,-0.2 4,-1.3 2,-0.2 3,-0.4 0.923 113.6 48.6 -70.5 -45.1 29.8 -19.7 4.2 95 95 A R H > S+ 0 0 23 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.880 103.4 61.6 -64.0 -34.8 28.8 -16.5 2.5 96 96 A R H X S+ 0 0 82 -4,-2.1 4,-2.3 1,-0.2 -1,-0.3 0.908 101.5 54.6 -55.4 -38.3 27.3 -15.3 5.8 97 97 A C H X S+ 0 0 18 -4,-1.0 4,-2.3 -3,-0.4 -1,-0.2 0.895 104.1 54.0 -61.4 -38.9 30.9 -15.6 7.1 98 98 A A H X S+ 0 0 0 -4,-1.3 4,-2.0 1,-0.2 -1,-0.2 0.893 109.4 47.0 -63.2 -42.1 32.1 -13.3 4.3 99 99 A L H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.891 110.6 51.9 -68.1 -38.8 29.6 -10.6 5.2 100 100 A I H X S+ 0 0 7 -4,-2.3 4,-2.5 -5,-0.2 5,-0.2 0.933 107.3 53.8 -62.5 -38.9 30.5 -10.8 8.9 101 101 A N H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.946 108.4 48.9 -58.6 -48.6 34.2 -10.4 7.9 102 102 A M H X S+ 0 0 2 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.905 112.0 49.4 -57.3 -45.6 33.4 -7.2 5.9 103 103 A V H X S+ 0 0 10 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.894 108.8 51.7 -63.6 -39.1 31.4 -5.8 8.9 104 104 A F H < S+ 0 0 32 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.927 117.8 38.9 -64.4 -40.5 34.2 -6.6 11.4 105 105 A Q H < S+ 0 0 57 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.891 133.0 19.4 -75.5 -46.8 36.8 -4.8 9.2 106 106 A M H X S- 0 0 50 -4,-2.7 4,-0.6 -5,-0.2 -3,-0.2 0.452 101.6-117.9-111.7 0.3 34.8 -1.9 8.0 107 107 A G H X - 0 0 33 -4,-2.1 4,-1.9 -5,-0.2 5,-0.2 0.240 34.9 -79.4 71.2 156.6 31.8 -1.4 10.3 108 108 A E H > S+ 0 0 57 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.884 128.6 53.4 -53.1 -51.7 28.1 -1.7 9.6 109 109 A T H > S+ 0 0 125 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.935 108.2 50.4 -56.2 -48.8 27.9 1.7 8.1 110 110 A G H < S+ 0 0 30 -4,-0.6 -1,-0.2 2,-0.2 -2,-0.2 0.882 113.8 42.2 -58.6 -46.1 30.7 1.0 5.7 111 111 A V H >< S+ 0 0 0 -4,-1.9 3,-3.5 1,-0.2 -1,-0.2 0.921 106.6 61.5 -70.4 -39.4 29.3 -2.2 4.4 112 112 A A H 3< S+ 0 0 14 -4,-3.2 3,-0.2 1,-0.3 -1,-0.2 0.799 94.1 68.5 -57.6 -22.9 25.8 -0.8 4.2 113 113 A G T 3< S+ 0 0 58 -4,-1.1 2,-0.7 1,-0.2 -1,-0.3 0.602 78.4 79.4 -68.9 -15.0 27.5 1.6 1.8 114 114 A F <> + 0 0 35 -3,-3.5 4,-2.4 1,-0.2 3,-0.5 -0.180 58.4 155.9 -91.7 52.2 27.9 -1.2 -0.7 115 115 A E H > + 0 0 116 -2,-0.7 4,-1.8 -3,-0.2 -1,-0.2 0.842 67.0 44.9 -38.0 -58.1 24.3 -0.9 -1.9 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.862 113.5 48.2 -63.8 -43.2 24.7 -2.4 -5.3 117 117 A S H > S+ 0 0 0 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.893 109.9 53.4 -65.3 -43.3 26.8 -5.3 -4.3 118 118 A L H X S+ 0 0 13 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.869 107.5 52.0 -58.0 -41.2 24.4 -6.1 -1.5 119 119 A R H X S+ 0 0 118 -4,-1.8 4,-1.8 -5,-0.3 -1,-0.2 0.931 110.5 47.9 -62.8 -44.0 21.5 -6.2 -4.0 120 120 A M H <>S+ 0 0 27 -4,-1.9 5,-2.4 1,-0.2 4,-0.4 0.888 110.2 51.4 -66.9 -39.1 23.4 -8.6 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.2 3,-1.9 2,-0.2 -1,-0.2 0.947 108.8 51.4 -63.7 -44.0 24.3 -10.9 -3.3 122 122 A Q H 3<5S+ 0 0 93 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.891 110.9 49.5 -58.8 -34.9 20.6 -11.0 -2.3 123 123 A Q T 3<5S- 0 0 87 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.514 112.2-123.2 -81.4 -3.9 19.9 -11.9 -5.9 124 124 A K T < 5 + 0 0 100 -3,-1.9 2,-1.2 -4,-0.4 -3,-0.2 0.766 60.6 146.9 66.2 29.2 22.4 -14.6 -5.8 125 125 A R >< + 0 0 119 -5,-2.4 4,-2.7 1,-0.2 5,-0.2 -0.663 20.9 174.7 -98.6 76.7 24.3 -13.1 -8.8 126 126 A W H > + 0 0 51 -2,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.858 69.9 43.9 -49.9 -53.8 27.7 -14.3 -7.6 127 127 A D H > S+ 0 0 107 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.909 115.0 49.7 -64.4 -41.9 29.9 -13.3 -10.5 128 128 A E H > S+ 0 0 100 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.898 111.0 48.5 -66.1 -43.7 28.4 -10.0 -10.9 129 129 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.835 107.4 55.3 -63.9 -36.0 28.6 -9.1 -7.3 130 130 A A H X S+ 0 0 11 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.917 109.9 47.5 -62.9 -42.0 32.4 -10.2 -7.1 131 131 A V H < S+ 0 0 90 -4,-1.9 4,-0.4 1,-0.2 3,-0.3 0.916 113.8 47.2 -64.5 -45.4 33.1 -7.8 -10.0 132 132 A N H >< S+ 0 0 41 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.869 107.4 54.8 -65.7 -42.6 31.2 -4.9 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.6 6,-0.4 1,-0.2 -1,-0.2 0.845 100.2 63.1 -58.6 -34.0 32.8 -5.5 -4.8 134 134 A A T 3< S+ 0 0 27 -4,-1.2 2,-1.4 -3,-0.3 -1,-0.2 0.640 86.4 77.6 -66.5 -17.5 36.3 -5.1 -6.5 135 135 A K S < S+ 0 0 155 -3,-1.2 2,-0.3 -4,-0.4 -1,-0.2 -0.502 79.7 93.2 -95.2 68.1 35.4 -1.5 -7.5 136 136 A S S > S- 0 0 20 -2,-1.4 4,-1.7 1,-0.1 3,-0.2 -0.979 85.8-113.8-152.5 160.0 35.9 0.0 -4.1 137 137 A R H > S+ 0 0 139 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.892 115.7 65.1 -60.1 -41.1 38.6 1.7 -2.0 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.2 2,-0.2 8,-0.2 0.914 104.4 42.7 -46.8 -53.5 38.5 -1.4 0.2 139 139 A Y H 4 S+ 0 0 59 -6,-0.4 -1,-0.2 2,-0.2 -2,-0.2 0.884 115.1 49.5 -65.9 -41.0 39.8 -3.6 -2.7 140 140 A N H < S+ 0 0 110 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.898 115.9 42.7 -67.7 -36.7 42.4 -1.1 -3.8 141 141 A Q H < S+ 0 0 107 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.835 131.4 18.7 -77.6 -41.7 43.8 -0.7 -0.2 142 142 A T S X S+ 0 0 22 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 -0.565 73.7 163.4-129.9 68.3 43.8 -4.3 1.0 143 143 A P H > + 0 0 48 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.842 69.0 50.5 -60.3 -41.1 43.7 -6.3 -2.1 144 144 A N H > S+ 0 0 111 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.929 116.8 40.9 -66.6 -43.7 44.8 -9.8 -0.9 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.926 115.3 51.7 -65.3 -48.0 42.3 -9.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.958 109.5 51.2 -54.9 -46.3 39.6 -8.3 -0.2 147 147 A K H X S+ 0 0 90 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.868 107.6 52.0 -57.7 -41.6 40.2 -11.0 -2.8 148 148 A R H X S+ 0 0 52 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.953 113.9 43.0 -60.6 -45.9 39.9 -13.7 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.914 113.5 52.2 -64.6 -44.5 36.5 -12.3 0.9 150 150 A I H X S+ 0 0 13 -4,-2.9 4,-2.2 -5,-0.3 -1,-0.2 0.897 108.4 49.7 -58.9 -44.7 35.4 -11.8 -2.7 151 151 A T H X S+ 0 0 34 -4,-2.4 4,-2.7 -5,-0.2 6,-0.4 0.862 107.2 57.1 -63.8 -34.8 36.3 -15.4 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.906 111.7 40.4 -62.2 -42.1 34.3 -16.5 -0.5 153 153 A F H < S+ 0 0 2 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.846 115.7 52.8 -74.3 -35.7 31.1 -14.7 -1.8 154 154 A R H < S+ 0 0 99 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.950 125.1 20.3 -63.9 -49.8 31.8 -15.9 -5.4 155 155 A T H < S- 0 0 43 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.627 85.7-135.1 -97.1 -25.9 32.1 -19.6 -4.7 156 156 A G S < S+ 0 0 17 -4,-1.9 2,-0.2 -5,-0.4 -62,-0.2 0.753 73.9 97.9 72.1 21.5 30.5 -20.2 -1.4 157 157 A T S S- 0 0 49 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.803 82.1-114.9-131.0 176.9 33.4 -22.4 -0.3 158 158 A W S >> S+ 0 0 26 -2,-0.2 3,-1.8 1,-0.2 4,-0.6 0.131 72.2 122.1-101.6 18.2 36.6 -21.8 1.9 159 159 A D G >4 + 0 0 98 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.779 66.1 59.9 -50.8 -35.4 39.0 -22.3 -0.9 160 160 A A G 34 S+ 0 0 14 -3,-0.3 -1,-0.3 1,-0.3 4,-0.3 0.701 113.7 38.1 -70.1 -17.5 40.6 -18.9 -0.5 161 161 A Y G <4 S+ 0 0 1 -3,-1.8 -1,-0.3 2,-0.1 -2,-0.2 0.404 94.2 82.3-109.0 -2.2 41.6 -19.7 3.0 162 162 A K S << S+ 0 0 133 -3,-0.9 -2,-0.1 -4,-0.6 -3,-0.1 0.580 92.0 54.3 -84.6 -5.6 42.5 -23.4 2.6 163 163 A N 0 0 128 -4,-0.4 -1,-0.2 1,-0.1 -2,-0.1 0.883 360.0 360.0 -72.4 -53.5 45.7 -22.4 1.4 164 164 A L 0 0 115 -4,-0.3 -2,-0.2 0, 0.0 -1,-0.1 0.554 360.0 360.0 -77.8 360.0 46.6 -20.1 4.4