==== 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 1L38 . 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) . 8687.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 114 69.5 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 7.3 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 . 84 51.2 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 2 0 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 0.000 360.0 360.0 360.0 147.8 36.9 -23.5 9.0 2 2 A N > - 0 0 70 95,-0.0 4,-2.5 1,-0.0 3,-0.3 -0.873 360.0 -87.3-144.1 172.0 34.8 -21.0 10.9 3 3 A I H > S+ 0 0 20 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.828 123.3 52.6 -53.4 -40.7 34.4 -17.2 11.3 4 4 A F H > S+ 0 0 75 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.938 112.3 42.5 -64.9 -45.5 37.0 -17.1 14.1 5 5 A E H > S+ 0 0 90 -3,-0.3 4,-1.5 2,-0.2 -2,-0.2 0.861 113.7 54.3 -66.4 -37.2 39.7 -19.0 12.2 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.942 112.4 41.9 -62.6 -48.9 38.9 -17.0 9.1 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 5,-0.4 0.826 108.2 59.7 -70.1 -30.5 39.3 -13.7 10.9 8 8 A R H X S+ 0 0 109 -4,-1.9 4,-1.6 -5,-0.2 -1,-0.2 0.886 107.4 48.0 -65.8 -29.8 42.4 -14.9 12.7 9 9 A I H < S+ 0 0 53 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.953 115.1 43.4 -74.8 -44.6 44.0 -15.4 9.3 10 10 A D H < S+ 0 0 20 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.778 125.1 30.9 -70.5 -32.0 43.0 -12.0 7.9 11 11 A E H < S- 0 0 35 -4,-2.2 19,-0.3 -5,-0.1 -1,-0.2 0.687 91.2-149.7-102.7 -28.1 43.9 -9.9 11.0 12 12 A G < - 0 0 19 -4,-1.6 2,-0.4 -5,-0.4 -1,-0.1 -0.184 24.2 -87.7 81.0 179.2 46.8 -11.7 12.7 13 13 A L + 0 0 42 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.983 42.7 173.8-132.3 124.3 47.4 -11.6 16.5 14 14 A R E -A 28 0A 131 14,-1.3 14,-2.5 -2,-0.4 4,-0.1 -1.000 18.3-166.9-134.3 128.5 49.5 -8.9 18.2 15 15 A L E S+ 0 0 68 -2,-0.4 43,-2.3 12,-0.2 2,-0.3 0.388 74.1 62.6 -93.9 -0.8 49.9 -8.5 21.9 16 16 A K E S-C 57 0B 108 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.922 101.3 -87.5-124.4 146.0 51.4 -5.0 21.8 17 17 A I E + 0 0 21 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.225 58.7 172.1 -50.2 140.7 49.7 -1.8 20.5 18 18 A Y E -A 26 0A 28 8,-3.0 8,-2.9 -4,-0.1 2,-0.4 -0.925 34.4-104.8-147.1 169.0 50.2 -1.5 16.8 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.849 33.4-138.7-101.1 137.4 49.2 0.5 13.9 20 20 A D > - 0 0 48 4,-2.9 3,-1.8 -2,-0.4 -1,-0.1 -0.059 39.6 -82.9 -79.2-171.8 46.8 -0.9 11.4 21 21 A T T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.827 134.1 49.3 -63.3 -31.0 46.9 -0.7 7.6 22 22 A E T 3 S- 0 0 80 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.366 125.0-103.4 -86.9 0.2 45.2 2.7 7.9 23 23 A G S < S+ 0 0 36 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.545 74.1 142.8 88.0 13.0 47.7 3.9 10.6 24 24 A Y - 0 0 80 1,-0.1 -4,-2.9 -5,-0.0 2,-0.4 -0.611 59.3-102.3 -93.3 150.9 45.3 3.4 13.5 25 25 A Y E +AB 19 34A 32 9,-0.9 8,-3.2 11,-0.3 9,-1.3 -0.535 54.3 160.9 -69.9 120.2 46.1 2.1 17.0 26 26 A T E -AB 18 32A 3 -8,-2.9 -8,-3.0 -2,-0.4 2,-0.3 -0.853 19.3-170.3-136.4 162.0 45.0 -1.5 17.3 27 27 A I E > + B 0 31A 0 4,-1.3 4,-1.9 -2,-0.3 -12,-0.2 -0.967 53.1 0.6-151.5 160.4 45.8 -4.5 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.3 -2,-0.3 2,-1.0 -0.348 123.2 -4.7 68.0-132.9 45.0 -8.3 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.650 127.3 -54.2 -97.7 74.6 43.0 -9.7 16.6 30 30 A G T 4 S+ 0 0 15 -2,-1.0 2,-1.0 -19,-0.3 -2,-0.2 0.788 83.0 160.5 65.3 28.4 42.2 -6.5 14.7 31 31 A H E < -B 27 0A 34 -4,-1.9 -4,-1.3 1,-0.0 -1,-0.2 -0.704 33.5-142.9 -85.2 101.7 40.6 -4.7 17.7 32 32 A L E -B 26 0A 68 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.388 19.0-175.7 -60.7 131.6 40.7 -1.0 16.8 33 33 A L E - 0 0 15 -8,-3.2 2,-0.3 1,-0.4 -7,-0.2 0.885 59.1 -25.9 -95.9 -46.0 41.4 1.2 19.8 34 34 A T E -B 25 0A 28 -9,-1.3 -9,-0.9 2,-0.1 -1,-0.4 -0.966 36.0-137.7-164.5 150.8 41.1 4.7 18.5 35 35 A K S S+ 0 0 140 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.459 75.1 114.5 -90.5 -3.2 41.5 6.7 15.3 36 36 A S S S- 0 0 41 1,-0.1 -11,-0.3 2,-0.1 6,-0.1 -0.363 71.8-132.4 -70.5 141.3 43.3 9.3 17.4 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.644 76.6 100.4 -71.4 -11.5 46.9 10.0 16.8 38 38 A S > - 0 0 50 1,-0.2 4,-2.2 2,-0.1 3,-0.2 -0.664 56.4-160.6 -87.7 122.0 47.9 9.9 20.4 39 39 A L H > S+ 0 0 65 -2,-0.6 4,-2.1 1,-0.3 -1,-0.2 0.734 100.2 56.9 -63.4 -22.4 49.5 6.7 21.7 40 40 A N H > S+ 0 0 119 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.902 101.8 50.8 -77.7 -38.5 48.4 7.9 25.0 41 41 A A H > S+ 0 0 34 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.917 113.3 50.4 -60.6 -37.5 44.8 8.1 23.9 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.865 107.0 50.5 -64.9 -44.6 45.4 4.5 22.7 43 43 A K H X S+ 0 0 52 -4,-2.1 4,-1.9 1,-0.2 11,-0.3 0.836 111.0 50.9 -67.2 -29.6 46.8 3.3 26.0 44 44 A S H X S+ 0 0 73 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.880 109.4 48.8 -72.0 -41.8 43.9 4.8 27.8 45 45 A E H X S+ 0 0 67 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.908 110.0 54.3 -65.7 -39.5 41.3 3.1 25.6 46 46 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 5,-0.3 0.935 107.8 46.8 -59.7 -49.1 43.1 -0.1 26.0 47 47 A D H X>S+ 0 0 39 -4,-1.9 4,-2.6 2,-0.2 5,-0.8 0.852 112.6 51.2 -61.8 -36.3 43.0 0.0 29.9 48 48 A K H <5S+ 0 0 145 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.907 111.3 48.5 -65.4 -44.5 39.4 0.9 29.7 49 49 A A H <5S+ 0 0 46 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.864 121.2 34.0 -66.1 -37.1 38.8 -2.0 27.4 50 50 A I H <5S- 0 0 38 -4,-2.4 -2,-0.2 2,-0.3 -1,-0.2 0.767 98.8-127.0 -92.0 -31.1 40.7 -4.6 29.6 51 51 A G T <5S+ 0 0 67 -4,-2.6 2,-0.3 1,-0.4 -3,-0.2 0.716 78.7 78.7 89.1 17.4 39.9 -3.3 33.0 52 52 A R S - 0 0 8 -2,-0.9 3,-1.1 -11,-0.3 -1,-0.2 0.717 32.3-144.0 -96.5 -24.4 48.1 -2.7 30.7 55 55 A N T 3 S- 0 0 126 1,-0.2 -2,-0.1 -12,-0.2 3,-0.1 0.914 74.5 -52.3 60.8 44.7 50.8 -0.4 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.1 2,-0.4 0.549 120.5 94.5 72.8 6.3 50.2 -1.1 26.0 57 57 A V B < +C 16 0B 60 -3,-1.1 2,-0.3 -41,-0.2 -41,-0.2 -0.983 46.4 179.6-135.7 144.0 50.5 -4.9 26.3 58 58 A I - 0 0 4 -43,-2.3 2,-0.1 -2,-0.4 -30,-0.1 -0.850 26.6-109.1-133.1 167.3 47.9 -7.7 26.8 59 59 A T > - 0 0 67 -2,-0.3 4,-2.0 1,-0.1 3,-0.2 -0.419 34.9-105.1 -90.8 167.5 47.9 -11.5 27.2 60 60 A K H > S+ 0 0 108 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.895 122.1 54.2 -56.2 -46.5 46.7 -14.0 24.6 61 61 A D H > S+ 0 0 121 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.838 107.4 49.4 -54.5 -44.6 43.6 -14.6 26.8 62 62 A E H > S+ 0 0 36 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.866 110.0 51.9 -65.5 -40.7 42.7 -10.9 26.8 63 63 A A H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -34,-0.4 0.862 111.1 47.1 -64.0 -40.6 43.1 -10.7 23.0 64 64 A E H X S+ 0 0 77 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.823 109.0 54.1 -72.1 -33.2 40.8 -13.6 22.6 65 65 A K H X S+ 0 0 138 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.962 110.6 45.8 -65.0 -46.3 38.3 -12.1 25.0 66 66 A L H X S+ 0 0 3 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.906 111.6 54.4 -59.3 -40.5 38.2 -8.9 22.9 67 67 A F H X S+ 0 0 12 -4,-2.0 4,-2.2 2,-0.2 5,-0.3 0.935 106.0 50.2 -61.1 -48.0 38.0 -11.0 19.8 68 68 A N H X S+ 0 0 89 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.946 111.8 49.5 -57.5 -44.2 34.9 -12.9 21.1 69 69 A Q H X S+ 0 0 97 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.905 110.9 49.5 -58.9 -44.1 33.2 -9.6 21.9 70 70 A D H X S+ 0 0 38 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.840 110.8 46.8 -65.5 -39.1 34.0 -8.1 18.5 71 71 A V H X S+ 0 0 6 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.923 114.5 49.5 -67.9 -44.5 32.6 -11.0 16.5 72 72 A D H X S+ 0 0 87 -4,-2.2 4,-2.6 -5,-0.3 5,-0.3 0.937 111.9 47.3 -58.2 -48.9 29.5 -11.1 18.7 73 73 A A H X S+ 0 0 42 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.880 111.0 52.7 -61.0 -39.6 29.0 -7.3 18.2 74 74 A A H X S+ 0 0 8 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.938 111.1 46.1 -62.2 -48.9 29.5 -7.7 14.4 75 75 A V H X S+ 0 0 33 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.954 115.1 46.1 -56.8 -53.2 26.9 -10.4 14.2 76 76 A R H X S+ 0 0 113 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.873 109.8 56.2 -59.1 -38.0 24.3 -8.5 16.4 77 77 A G H < S+ 0 0 2 -4,-2.4 4,-0.5 -5,-0.3 3,-0.3 0.945 107.5 46.6 -63.0 -44.2 25.1 -5.4 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-1.1 1,-0.2 7,-0.4 0.928 111.3 52.7 -60.4 -43.6 24.2 -7.1 11.1 79 79 A L H 3< S+ 0 0 71 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.722 112.3 45.1 -68.2 -22.1 21.0 -8.5 12.6 80 80 A R T 3< S+ 0 0 168 -4,-1.6 2,-0.5 -3,-0.3 -1,-0.3 0.345 93.1 96.0 -97.0 -5.6 19.9 -5.1 13.8 81 81 A N <> - 0 0 21 -3,-1.1 4,-2.4 -4,-0.5 -4,-0.0 -0.797 64.3-151.5 -94.6 128.2 20.7 -3.4 10.6 82 82 A A T 4 S+ 0 0 88 -2,-0.5 -1,-0.1 1,-0.2 -4,-0.0 0.755 97.6 42.6 -68.8 -19.9 17.8 -2.9 8.2 83 83 A K T 4 S+ 0 0 142 2,-0.1 4,-0.4 3,-0.1 -1,-0.2 0.777 120.7 39.8 -91.6 -31.6 20.0 -3.0 5.1 84 84 A L T > S+ 0 0 0 -6,-0.2 4,-2.5 -7,-0.2 3,-0.3 0.850 101.5 66.6 -85.4 -41.8 22.2 -5.9 6.2 85 85 A K H X S+ 0 0 79 -4,-2.4 4,-2.8 -7,-0.4 5,-0.2 0.866 99.2 51.1 -50.8 -47.2 19.8 -8.3 7.9 86 86 A P H > S+ 0 0 52 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.880 111.8 47.8 -63.6 -36.8 17.9 -9.2 4.8 87 87 A V H > S+ 0 0 2 -4,-0.4 4,-0.7 -3,-0.3 3,-0.3 0.950 112.7 48.7 -66.9 -47.7 21.1 -10.0 2.9 88 88 A Y H >< S+ 0 0 36 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.918 109.4 52.1 -54.3 -49.4 22.4 -12.1 5.7 89 89 A D H 3< S+ 0 0 77 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.819 107.9 53.3 -61.0 -30.7 19.2 -14.0 6.0 90 90 A S H 3< S+ 0 0 34 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.608 96.0 90.5 -79.7 -13.8 19.3 -14.7 2.3 91 91 A L S << S- 0 0 5 -3,-1.2 31,-0.0 -4,-0.7 30,-0.0 -0.594 73.9-119.0 -90.9 156.9 22.8 -16.2 2.4 92 92 A D > - 0 0 56 -2,-0.2 4,-2.0 1,-0.1 5,-0.1 -0.128 45.2 -91.1 -74.8 169.8 24.2 -19.7 2.9 93 93 A A H > S+ 0 0 76 1,-0.2 4,-1.2 2,-0.2 -2,-0.1 0.854 122.0 44.5 -56.7 -42.0 26.5 -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 0.935 113.9 48.8 -70.3 -46.9 29.9 -19.8 4.2 95 95 A R H > S+ 0 0 23 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.866 104.1 61.0 -62.0 -34.5 28.8 -16.6 2.5 96 96 A R H X S+ 0 0 82 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.912 101.3 54.5 -57.2 -40.7 27.4 -15.4 5.8 97 97 A C H X S+ 0 0 18 -4,-1.2 4,-2.2 -3,-0.4 -1,-0.2 0.878 103.6 55.7 -59.3 -38.7 31.0 -15.6 7.1 98 98 A A H X S+ 0 0 0 -4,-1.3 4,-1.9 1,-0.2 -1,-0.2 0.897 108.1 46.5 -63.1 -41.7 32.1 -13.4 4.3 99 99 A L H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.875 110.2 53.8 -69.5 -37.5 29.7 -10.6 5.3 100 100 A I H X S+ 0 0 7 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.919 106.7 53.5 -61.3 -39.1 30.6 -10.9 8.9 101 101 A N H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.952 108.6 47.8 -59.8 -50.4 34.3 -10.4 7.8 102 102 A M H X S+ 0 0 3 -4,-1.9 4,-3.1 1,-0.2 5,-0.3 0.895 112.5 49.5 -57.3 -45.1 33.6 -7.2 6.0 103 103 A V H X S+ 0 0 9 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.891 108.4 52.8 -65.4 -38.1 31.5 -5.8 8.9 104 104 A F H < S+ 0 0 32 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.929 118.3 37.4 -62.4 -41.0 34.3 -6.7 11.4 105 105 A Q H < S+ 0 0 59 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.886 132.0 22.1 -77.2 -47.0 36.8 -4.8 9.2 106 106 A M H X S- 0 0 53 -4,-3.1 4,-0.5 -5,-0.2 -3,-0.2 0.516 102.4-115.5-109.3 -0.6 34.8 -1.9 8.0 107 107 A G H X - 0 0 33 -4,-1.9 4,-2.0 -5,-0.3 5,-0.2 0.197 33.6 -82.4 76.4 152.6 31.9 -1.4 10.4 108 108 A E H > S+ 0 0 57 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.885 127.5 52.8 -51.8 -51.4 28.1 -1.7 9.7 109 109 A T H > S+ 0 0 123 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.914 108.6 49.8 -57.9 -45.0 27.8 1.7 8.2 110 110 A G H < S+ 0 0 30 -4,-0.5 3,-0.4 2,-0.2 -1,-0.2 0.899 113.9 43.3 -63.1 -44.5 30.6 1.1 5.8 111 111 A V H >< S+ 0 0 0 -4,-2.0 3,-2.7 1,-0.2 -2,-0.2 0.920 106.5 61.2 -69.4 -40.3 29.3 -2.2 4.5 112 112 A A H 3< S+ 0 0 15 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.767 94.9 66.9 -57.1 -22.6 25.7 -0.8 4.4 113 113 A G T 3< S+ 0 0 55 -4,-1.0 2,-1.4 -3,-0.4 -1,-0.3 0.590 75.4 85.6 -71.8 -14.0 27.2 1.7 1.9 114 114 A F <> + 0 0 39 -3,-2.7 4,-2.4 1,-0.2 3,-0.4 -0.243 57.0 160.2 -85.5 54.6 27.8 -1.1 -0.7 115 115 A T H > + 0 0 94 -2,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.829 67.1 42.4 -40.1 -59.2 24.3 -0.8 -2.0 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.852 114.0 50.3 -64.0 -40.9 24.7 -2.4 -5.4 117 117 A S H > S+ 0 0 1 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.863 109.6 53.0 -66.1 -38.5 26.9 -5.3 -4.2 118 118 A L H X S+ 0 0 14 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.894 108.1 50.2 -62.9 -41.3 24.3 -6.0 -1.5 119 119 A R H X S+ 0 0 111 -4,-1.7 4,-1.9 -5,-0.3 -2,-0.2 0.930 111.0 48.9 -63.8 -43.2 21.6 -6.2 -4.0 120 120 A M H <>S+ 0 0 23 -4,-2.1 5,-2.5 1,-0.2 4,-0.2 0.893 110.2 50.3 -66.0 -39.8 23.5 -8.5 -6.2 121 121 A L H ><5S+ 0 0 1 -4,-2.2 3,-2.1 1,-0.2 -1,-0.2 0.944 109.1 52.0 -64.3 -44.0 24.4 -10.8 -3.4 122 122 A Q H 3<5S+ 0 0 95 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.890 110.8 48.3 -57.9 -35.8 20.7 -10.9 -2.4 123 123 A E T 3<5S- 0 0 92 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.456 113.8-122.3 -84.4 0.7 19.9 -11.9 -5.9 124 124 A K T < 5 + 0 0 99 -3,-2.1 2,-1.1 -4,-0.2 -3,-0.2 0.792 59.9 149.2 61.5 35.5 22.6 -14.5 -5.8 125 125 A R >< + 0 0 103 -5,-2.5 4,-2.6 1,-0.2 -1,-0.2 -0.712 19.3 174.8-100.2 76.8 24.4 -13.0 -8.8 126 126 A W H > + 0 0 50 -2,-1.1 4,-1.7 2,-0.2 -1,-0.2 0.857 69.9 44.4 -52.5 -51.5 27.8 -14.2 -7.6 127 127 A D H > S+ 0 0 105 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.921 114.9 49.2 -66.8 -41.9 30.0 -13.3 -10.5 128 128 A E H > S+ 0 0 91 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.885 110.7 49.4 -65.0 -41.8 28.4 -9.9 -10.9 129 129 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.854 107.0 55.5 -65.4 -35.5 28.7 -9.1 -7.2 130 130 A A H X S+ 0 0 13 -4,-1.7 4,-1.1 1,-0.2 -2,-0.2 0.896 109.3 47.1 -62.5 -42.8 32.4 -10.1 -7.2 131 131 A V H < S+ 0 0 89 -4,-1.7 4,-0.5 1,-0.2 3,-0.3 0.905 113.5 48.3 -65.8 -42.7 33.3 -7.7 -9.9 132 132 A N H >< S+ 0 0 42 -4,-1.9 3,-1.2 1,-0.2 -2,-0.2 0.889 106.9 55.0 -66.7 -42.2 31.3 -4.9 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-2.5 6,-0.4 1,-0.2 -1,-0.2 0.830 100.5 61.4 -60.1 -32.8 32.9 -5.4 -4.8 134 134 A A T 3< S+ 0 0 26 -4,-1.1 2,-1.5 -3,-0.3 -1,-0.2 0.637 85.5 79.5 -71.1 -17.0 36.4 -5.0 -6.4 135 135 A K S < S+ 0 0 156 -3,-1.2 2,-0.3 -4,-0.5 -1,-0.2 -0.510 80.6 95.6 -89.6 65.6 35.5 -1.5 -7.5 136 136 A S S > S- 0 0 21 -2,-1.5 4,-2.1 1,-0.1 5,-0.2 -0.991 85.4-116.2-151.3 157.7 36.1 -0.0 -4.1 137 137 A R H > S+ 0 0 140 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.911 115.4 63.5 -58.9 -40.2 38.7 1.7 -2.0 138 138 A W H > S+ 0 0 15 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.929 105.6 42.3 -48.6 -53.6 38.5 -1.4 0.2 139 139 A Y H 4 S+ 0 0 56 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.908 115.2 49.8 -63.9 -44.8 39.8 -3.6 -2.6 140 140 A N H < S+ 0 0 108 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.879 115.8 42.5 -64.6 -35.4 42.5 -1.1 -3.7 141 141 A Q H < S+ 0 0 106 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.854 131.4 19.7 -80.0 -40.6 43.8 -0.6 -0.2 142 142 A T S X S+ 0 0 24 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.2 -0.549 74.1 162.7-128.2 64.6 43.9 -4.3 1.1 143 143 A P H > + 0 0 50 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.828 69.0 50.5 -56.5 -42.1 43.7 -6.3 -2.1 144 144 A N H > S+ 0 0 111 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.919 116.6 40.7 -64.7 -45.8 44.9 -9.8 -0.8 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.920 115.4 51.3 -66.3 -46.9 42.4 -9.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 -8,-0.2 5,-0.2 0.953 109.0 51.7 -56.2 -48.4 39.6 -8.3 -0.2 147 147 A K H X S+ 0 0 89 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.868 107.7 52.6 -56.6 -38.2 40.3 -11.0 -2.9 148 148 A R H X S+ 0 0 50 -4,-1.5 4,-1.5 -5,-0.2 -1,-0.2 0.949 113.5 42.8 -62.1 -45.4 40.0 -13.7 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.908 113.9 51.4 -65.0 -44.6 36.6 -12.3 0.9 150 150 A I H X S+ 0 0 14 -4,-3.0 4,-2.3 -5,-0.2 -1,-0.2 0.876 107.8 51.1 -60.8 -43.3 35.4 -11.8 -2.6 151 151 A T H X S+ 0 0 33 -4,-2.3 4,-2.7 -5,-0.2 5,-0.4 0.844 106.9 56.5 -64.0 -34.7 36.3 -15.4 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.881 111.4 41.8 -63.4 -38.6 34.3 -16.6 -0.6 153 153 A F H < S+ 0 0 2 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.860 115.3 51.8 -76.9 -35.7 31.3 -14.7 -1.9 154 154 A R H < S+ 0 0 100 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.923 125.2 20.7 -65.1 -47.4 31.9 -15.8 -5.4 155 155 A T H < S- 0 0 44 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.629 85.6-134.1-100.4 -23.9 32.3 -19.6 -4.7 156 156 A G S < S+ 0 0 17 -4,-1.8 2,-0.2 -5,-0.4 -62,-0.2 0.726 73.1 101.0 73.1 19.4 30.6 -20.2 -1.5 157 157 A T S S- 0 0 47 -6,-0.4 3,-0.4 -63,-0.1 -1,-0.3 -0.786 81.3-116.3-128.2 174.0 33.5 -22.3 -0.3 158 158 A W S >> S+ 0 0 28 -2,-0.2 3,-1.9 1,-0.2 4,-0.6 0.171 72.5 121.5 -96.8 16.9 36.6 -21.9 1.9 159 159 A D G >4 + 0 0 100 1,-0.3 3,-1.0 2,-0.2 4,-0.4 0.801 65.8 59.5 -48.6 -40.6 39.0 -22.3 -0.9 160 160 A A G 34 S+ 0 0 13 -3,-0.4 -1,-0.3 1,-0.3 4,-0.2 0.680 113.1 39.1 -67.0 -16.8 40.7 -18.9 -0.5 161 161 A Y G <4 S+ 0 0 1 -3,-1.9 -1,-0.3 2,-0.1 -2,-0.2 0.421 93.7 81.6-109.3 -4.8 41.7 -19.8 3.0 162 162 A K S << S+ 0 0 137 -3,-1.0 -2,-0.1 -4,-0.6 -3,-0.1 0.526 93.0 54.0 -83.7 -2.9 42.6 -23.4 2.6 163 163 A N 0 0 127 -4,-0.4 -1,-0.2 1,-0.1 -2,-0.1 0.877 360.0 360.0 -76.6 -57.1 45.9 -22.3 1.4 164 164 A L 0 0 117 -4,-0.2 -2,-0.2 0, 0.0 -3,-0.1 0.539 360.0 360.0 -71.8 360.0 46.7 -20.1 4.4