==== 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 1L47 . 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) . 8596.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 71.3 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 . 10 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 52.4 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 1 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 69 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 150.6 36.7 -23.4 9.1 2 2 A N > - 0 0 70 95,-0.0 4,-2.6 1,-0.0 3,-0.2 -0.852 360.0 -84.6-141.8 176.5 34.5 -20.9 10.9 3 3 A I H > S+ 0 0 20 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.846 124.7 52.8 -55.0 -40.1 34.2 -17.1 11.2 4 4 A F H > S+ 0 0 77 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.939 111.3 43.0 -64.9 -47.5 36.8 -17.0 14.0 5 5 A E H > S+ 0 0 89 -3,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.874 114.8 53.1 -67.1 -36.4 39.5 -18.9 12.1 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 3,-0.3 0.961 112.4 41.4 -63.0 -54.6 38.7 -16.9 9.1 7 7 A L H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 5,-0.4 0.848 109.5 60.2 -64.4 -29.9 39.1 -13.5 10.8 8 8 A R H X S+ 0 0 102 -4,-2.2 4,-1.4 -5,-0.3 -1,-0.2 0.895 107.3 46.5 -64.3 -33.1 42.2 -14.8 12.7 9 9 A I H < S+ 0 0 51 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.935 115.9 44.9 -72.4 -44.4 43.8 -15.4 9.3 10 10 A D H < S+ 0 0 20 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.830 124.1 29.6 -69.6 -37.6 42.9 -12.0 8.0 11 11 A E H < S- 0 0 32 -4,-2.5 19,-0.4 -5,-0.2 -1,-0.2 0.648 92.0-149.2 -99.3 -23.0 43.7 -9.8 11.0 12 12 A G < - 0 0 19 -4,-1.4 2,-0.4 -5,-0.4 -1,-0.1 -0.192 24.8 -87.9 76.1 178.8 46.6 -11.7 12.6 13 13 A L + 0 0 38 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.995 42.6 175.6-131.2 125.5 47.2 -11.6 16.4 14 14 A R E -A 28 0A 126 14,-1.5 14,-2.5 -2,-0.4 4,-0.1 -0.996 18.4-166.5-133.8 126.2 49.4 -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 0.403 74.4 65.2 -89.6 -1.6 49.8 -8.6 21.8 16 16 A K E S-C 57 0B 105 41,-0.2 41,-0.2 12,-0.1 10,-0.1 -0.935 100.3 -90.4-124.3 140.8 51.3 -5.1 21.6 17 17 A I E + 0 0 19 39,-1.7 2,-0.3 -2,-0.3 10,-0.2 -0.244 59.1 174.1 -47.4 137.6 49.6 -1.8 20.4 18 18 A Y E -A 26 0A 27 8,-2.9 8,-3.1 -4,-0.1 2,-0.5 -0.908 34.6-105.7-142.1 169.6 50.2 -1.5 16.7 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.864 35.4-140.6-101.2 130.5 49.3 0.6 13.8 20 20 A D > - 0 0 45 4,-3.0 3,-1.7 -2,-0.5 -1,-0.1 -0.035 39.3 -81.2 -77.6-173.3 46.9 -1.0 11.3 21 21 A T T 3 S+ 0 0 114 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.814 134.5 48.4 -62.7 -25.2 46.9 -0.7 7.6 22 22 A E T 3 S- 0 0 76 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.443 123.1-105.4 -91.3 -3.9 45.2 2.7 7.9 23 23 A G S < S+ 0 0 36 -3,-1.7 2,-0.3 1,-0.3 -2,-0.1 0.499 74.3 140.7 89.2 14.3 47.7 3.8 10.5 24 24 A Y - 0 0 79 1,-0.1 -4,-3.0 -5,-0.0 -1,-0.3 -0.678 61.5-100.3 -92.7 148.2 45.3 3.5 13.4 25 25 A Y E +AB 19 34A 33 9,-0.7 8,-2.6 11,-0.4 9,-1.3 -0.449 54.7 164.0 -62.7 121.6 46.2 2.2 16.9 26 26 A T E -AB 18 32A 3 -8,-3.1 -8,-2.9 6,-0.2 2,-0.3 -0.878 18.6-167.6-137.8 162.8 45.0 -1.5 17.2 27 27 A I E > - B 0 31A 0 4,-1.5 4,-2.0 -2,-0.3 -12,-0.2 -0.977 52.2 -4.1-150.1 158.0 45.6 -4.4 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.5 -2,-0.3 2,-0.8 -0.372 123.1 -3.2 68.5-129.2 44.9 -8.2 19.4 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.703 127.9 -53.7-101.8 71.8 42.9 -9.6 16.5 30 30 A G T 4 S+ 0 0 15 -2,-0.8 2,-1.0 -19,-0.4 -2,-0.2 0.781 82.9 160.7 66.8 28.8 42.1 -6.4 14.6 31 31 A H E < -B 27 0A 33 -4,-2.0 -4,-1.5 1,-0.0 -1,-0.2 -0.725 32.8-143.3 -85.8 104.6 40.6 -4.6 17.6 32 32 A L E -B 26 0A 68 -2,-1.0 -6,-0.2 -6,-0.2 3,-0.1 -0.398 19.9-178.4 -65.7 128.0 40.6 -0.8 16.7 33 33 A L E - 0 0 15 -8,-2.6 2,-0.3 1,-0.4 -7,-0.2 0.894 59.7 -21.8 -94.0 -50.5 41.4 1.2 19.7 34 34 A T E -B 25 0A 25 -9,-1.3 -9,-0.7 2,-0.1 -1,-0.4 -0.973 36.0-140.7-157.8 149.8 41.2 4.8 18.4 35 35 A K S S+ 0 0 139 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.491 75.5 114.2 -88.3 -4.0 41.4 6.7 15.2 36 36 A S S S- 0 0 39 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.325 70.6-134.8 -70.9 146.3 43.3 9.3 17.3 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.633 75.6 99.9 -78.0 -9.2 46.9 10.0 16.7 38 38 A S > - 0 0 50 1,-0.2 4,-1.6 2,-0.1 5,-0.1 -0.693 58.3-158.7 -87.1 124.5 47.9 10.0 20.2 39 39 A L H > S+ 0 0 65 -2,-0.6 4,-2.2 1,-0.3 -1,-0.2 0.701 100.3 56.6 -64.1 -21.3 49.5 6.8 21.5 40 40 A N H > S+ 0 0 120 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.895 101.5 51.2 -78.7 -39.6 48.3 8.0 24.8 41 41 A A H > S+ 0 0 33 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.876 112.3 51.8 -61.5 -31.3 44.7 8.2 23.7 42 42 A A H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.889 107.2 49.4 -70.8 -45.0 45.3 4.6 22.6 43 43 A K H X S+ 0 0 50 -4,-2.2 4,-2.2 2,-0.2 11,-0.3 0.867 110.5 51.4 -66.7 -30.7 46.7 3.4 25.8 44 44 A S H X S+ 0 0 71 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.926 110.1 48.0 -70.3 -44.4 43.8 4.9 27.7 45 45 A E H X S+ 0 0 68 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.892 110.5 54.3 -62.1 -38.9 41.3 3.3 25.4 46 46 A L H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 5,-0.3 0.914 109.1 45.6 -61.1 -46.0 43.1 0.0 25.9 47 47 A D H X>S+ 0 0 37 -4,-2.2 4,-2.3 2,-0.2 5,-0.9 0.880 111.6 52.7 -65.4 -39.1 43.0 0.2 29.6 48 48 A K H <5S+ 0 0 142 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.910 111.2 49.1 -60.2 -41.6 39.3 1.1 29.5 49 49 A A H <5S+ 0 0 45 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.839 119.0 34.2 -68.7 -36.4 38.7 -1.9 27.2 50 50 A I H <5S- 0 0 39 -4,-1.8 -1,-0.2 2,-0.3 -2,-0.2 0.697 99.6-126.1 -94.9 -23.8 40.5 -4.5 29.4 51 51 A G T <5S+ 0 0 69 -4,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.799 79.3 77.1 81.8 27.6 39.7 -3.1 32.8 52 52 A R S - 0 0 7 -2,-0.8 3,-1.6 -11,-0.3 -1,-0.2 0.678 31.6-144.7-100.0 -20.7 48.0 -2.6 30.5 55 55 A N T 3 S- 0 0 123 1,-0.3 -2,-0.1 -12,-0.1 3,-0.1 0.927 75.1 -52.0 55.7 47.7 50.7 -0.3 29.6 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.1 2,-0.4 0.521 120.2 96.0 70.9 7.2 50.1 -1.1 25.9 57 57 A V B < +C 16 0B 62 -3,-1.6 2,-0.3 -41,-0.2 -41,-0.2 -0.974 45.5 179.5-133.4 141.1 50.3 -4.8 26.2 58 58 A I - 0 0 5 -43,-2.3 2,-0.1 -2,-0.4 -30,-0.1 -0.858 26.8-112.3-131.0 163.7 47.7 -7.6 26.7 59 59 A T > - 0 0 68 -2,-0.3 4,-2.2 1,-0.1 5,-0.1 -0.444 34.8-104.8 -88.7 171.5 47.8 -11.4 27.0 60 60 A K H > S+ 0 0 106 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.878 122.3 54.3 -62.6 -41.1 46.4 -13.9 24.5 61 61 A D H > S+ 0 0 121 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.886 108.0 49.9 -56.3 -45.5 43.4 -14.6 26.6 62 62 A E H > S+ 0 0 36 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.902 110.0 51.2 -62.6 -42.2 42.6 -10.8 26.7 63 63 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -34,-0.4 0.866 110.9 48.3 -62.5 -41.9 43.0 -10.7 22.9 64 64 A E H X S+ 0 0 75 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.821 107.9 53.9 -67.9 -36.1 40.6 -13.5 22.6 65 65 A K H X S+ 0 0 137 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.969 110.4 46.8 -60.5 -49.4 38.1 -12.0 24.8 66 66 A L H X S+ 0 0 4 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.900 110.9 53.0 -56.1 -42.0 38.1 -8.8 22.8 67 67 A F H X S+ 0 0 13 -4,-1.8 4,-2.2 2,-0.2 5,-0.3 0.932 106.6 51.8 -63.8 -43.5 37.8 -10.9 19.6 68 68 A N H X S+ 0 0 88 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.952 111.7 47.9 -58.2 -45.9 34.7 -12.7 21.0 69 69 A Q H X S+ 0 0 94 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.890 111.2 50.0 -59.7 -43.5 33.1 -9.4 21.8 70 70 A D H X S+ 0 0 39 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.816 110.9 46.9 -65.0 -37.8 33.8 -7.9 18.4 71 71 A V H X S+ 0 0 6 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.935 113.9 50.5 -68.2 -45.8 32.5 -10.9 16.4 72 72 A D H X S+ 0 0 82 -4,-2.4 4,-2.4 -5,-0.3 5,-0.3 0.938 111.4 46.2 -56.1 -49.7 29.4 -10.9 18.6 73 73 A A H X S+ 0 0 44 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.853 109.8 54.9 -64.8 -34.8 28.8 -7.2 18.1 74 74 A A H X S+ 0 0 8 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.955 111.3 44.5 -63.5 -48.9 29.4 -7.5 14.3 75 75 A V H X S+ 0 0 32 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.935 115.5 47.2 -56.9 -51.0 26.7 -10.2 14.0 76 76 A R H X S+ 0 0 112 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.886 110.6 54.3 -60.8 -39.4 24.2 -8.2 16.3 77 77 A G H X S+ 0 0 3 -4,-2.5 4,-0.5 -5,-0.3 3,-0.4 0.939 108.4 46.6 -62.8 -47.3 25.0 -5.2 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.2 3,-1.0 1,-0.2 7,-0.4 0.920 111.5 53.9 -59.0 -40.8 24.1 -6.9 11.0 79 79 A L H 3< S+ 0 0 68 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.756 111.4 44.0 -68.2 -24.9 20.9 -8.2 12.6 80 80 A R H 3< S+ 0 0 175 -4,-1.7 2,-0.6 -3,-0.4 -1,-0.3 0.330 93.2 98.5 -94.3 -6.1 19.8 -4.8 13.7 81 81 A N S+ 0 0 0 -7,-0.2 4,-2.5 -6,-0.2 5,-0.2 0.844 100.2 67.5 -86.6 -41.3 22.0 -5.8 6.2 85 85 A K H X S+ 0 0 82 -4,-2.8 4,-3.1 -7,-0.4 5,-0.2 0.901 98.9 51.2 -50.1 -47.5 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 0.905 112.3 47.9 -61.8 -37.0 17.7 -9.2 4.7 87 87 A V H > S+ 0 0 2 -4,-0.5 4,-0.8 -3,-0.2 3,-0.4 0.957 112.3 47.5 -67.3 -48.2 21.0 -9.9 2.9 88 88 A Y H >< S+ 0 0 34 -4,-2.5 3,-1.1 1,-0.2 -1,-0.2 0.927 110.3 52.9 -58.3 -45.0 22.3 -12.0 5.8 89 89 A D H 3< S+ 0 0 77 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.817 107.4 53.8 -62.8 -26.9 19.0 -13.9 6.1 90 90 A S H 3< S+ 0 0 33 -4,-1.3 -1,-0.3 -3,-0.4 2,-0.2 0.637 95.8 89.0 -80.4 -18.5 19.2 -14.7 2.4 91 91 A L S << S- 0 0 5 -3,-1.1 31,-0.0 -4,-0.8 30,-0.0 -0.564 74.5-117.4 -86.4 156.5 22.6 -16.2 2.5 92 92 A D > - 0 0 55 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.190 44.9 -92.8 -74.4 169.3 24.0 -19.7 3.1 93 93 A A H > S+ 0 0 73 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.859 122.2 47.4 -59.3 -38.7 26.3 -20.3 6.1 94 94 A V H >> S+ 0 0 27 62,-0.2 4,-1.2 2,-0.2 3,-0.7 0.950 113.0 47.0 -68.5 -50.5 29.7 -19.8 4.3 95 95 A R H 3> S+ 0 0 25 1,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.848 103.5 64.1 -60.8 -31.9 28.6 -16.5 2.6 96 96 A R H 3X S+ 0 0 79 -4,-2.2 4,-2.2 1,-0.2 -1,-0.3 0.907 100.5 52.8 -57.8 -38.6 27.3 -15.3 5.9 97 97 A C H S+ 0 0 53 1,-0.2 4,-3.5 2,-0.2 5,-0.2 0.888 128.6 52.0 -52.2 -52.1 28.0 -1.6 9.5 109 109 A T H > S+ 0 0 122 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.920 108.0 50.7 -57.3 -48.2 27.7 1.8 8.0 110 110 A G H < S+ 0 0 32 -4,-0.6 3,-0.5 1,-0.2 -1,-0.2 0.919 115.7 40.6 -59.5 -46.9 30.6 1.2 5.6 111 111 A V H >< S+ 0 0 0 -4,-1.9 3,-2.8 1,-0.2 -2,-0.2 0.905 106.8 62.3 -71.2 -37.1 29.2 -2.1 4.3 112 112 A A H 3< S+ 0 0 14 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.783 95.8 66.0 -58.8 -21.7 25.6 -0.8 4.3 113 113 A G T 3< S+ 0 0 54 -4,-1.0 2,-1.5 -3,-0.5 -1,-0.3 0.586 75.2 85.6 -73.7 -15.6 27.0 1.6 1.7 114 114 A F <> + 0 0 39 -3,-2.8 4,-2.4 1,-0.2 3,-0.3 -0.257 56.3 159.7 -86.2 54.4 27.7 -1.1 -0.9 115 115 A T H > + 0 0 92 -2,-1.5 4,-1.9 1,-0.2 -1,-0.2 0.840 66.5 45.4 -40.2 -57.4 24.1 -0.8 -2.1 116 116 A N H > S+ 0 0 85 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.914 114.1 47.4 -61.7 -45.4 24.6 -2.4 -5.5 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.868 109.5 55.1 -64.1 -39.9 26.6 -5.3 -4.3 118 118 A L H X S+ 0 0 13 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.894 107.7 49.5 -58.6 -43.6 24.2 -6.0 -1.5 119 119 A R H X S+ 0 0 115 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.923 111.5 49.0 -63.2 -45.3 21.3 -6.2 -4.1 120 120 A M H <>S+ 0 0 21 -4,-2.1 5,-2.5 1,-0.2 4,-0.3 0.905 109.8 50.0 -64.5 -40.5 23.3 -8.6 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.4 3,-2.0 1,-0.2 -1,-0.2 0.952 110.1 52.4 -64.1 -44.0 24.2 -10.9 -3.3 122 122 A Q H 3<5S+ 0 0 93 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.909 110.3 47.4 -56.9 -39.7 20.5 -10.9 -2.3 123 123 A Q T 3<5S- 0 0 86 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.466 115.1-120.5 -80.1 -1.6 19.6 -11.9 -5.8 124 124 A K T < 5 + 0 0 97 -3,-2.0 2,-1.1 -4,-0.3 -3,-0.2 0.749 61.4 147.9 64.3 34.9 22.3 -14.6 -5.7 125 125 A R >< + 0 0 111 -5,-2.5 4,-2.8 1,-0.2 -1,-0.2 -0.714 18.5 173.1-100.4 77.5 24.2 -13.2 -8.7 126 126 A W H > S+ 0 0 48 -2,-1.1 4,-2.0 1,-0.2 -1,-0.2 0.865 71.3 46.6 -53.8 -50.6 27.6 -14.3 -7.4 127 127 A D H > S+ 0 0 104 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.900 114.5 46.9 -61.8 -47.2 29.7 -13.5 -10.4 128 128 A E H > S+ 0 0 87 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.889 112.2 50.3 -66.5 -41.0 28.2 -10.0 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.890 106.2 54.6 -63.9 -40.5 28.5 -9.2 -7.2 130 130 A A H X S+ 0 0 10 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.898 111.0 48.9 -59.2 -40.7 32.3 -10.3 -7.1 131 131 A V H < S+ 0 0 87 -4,-1.8 3,-0.4 1,-0.2 4,-0.4 0.929 113.2 44.3 -64.5 -49.8 32.9 -7.9 -10.0 132 132 A N H >< S+ 0 0 41 -4,-2.1 3,-1.1 1,-0.2 -2,-0.2 0.866 108.8 56.6 -66.9 -37.7 31.0 -4.9 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.7 6,-0.3 1,-0.2 -1,-0.2 0.820 99.6 60.7 -61.3 -34.4 32.7 -5.5 -4.9 134 134 A A T 3< S+ 0 0 28 -4,-1.0 2,-1.3 -3,-0.4 -1,-0.2 0.594 86.5 78.4 -70.5 -14.9 36.2 -5.2 -6.5 135 135 A K S < S+ 0 0 154 -3,-1.1 2,-0.3 -4,-0.4 -1,-0.2 -0.580 79.8 96.7 -92.9 65.7 35.4 -1.6 -7.6 136 136 A S S > S- 0 0 19 -2,-1.3 4,-1.9 1,-0.1 3,-0.2 -0.992 85.7-116.1-151.2 155.9 35.9 -0.1 -4.2 137 137 A R H > S+ 0 0 143 -2,-0.3 4,-3.3 1,-0.2 5,-0.3 0.910 115.0 64.7 -57.2 -40.9 38.6 1.6 -2.2 138 138 A W H > S+ 0 0 15 1,-0.2 4,-2.4 2,-0.2 8,-0.2 0.911 104.9 42.5 -47.1 -51.6 38.4 -1.5 0.1 139 139 A Y H 4 S+ 0 0 56 -6,-0.3 -1,-0.2 -3,-0.2 -2,-0.2 0.899 115.4 49.6 -68.3 -42.3 39.7 -3.8 -2.7 140 140 A N H < S+ 0 0 108 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.883 115.4 43.0 -66.1 -38.0 42.3 -1.3 -3.8 141 141 A Q H < S+ 0 0 109 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.860 132.0 18.1 -76.4 -44.6 43.7 -0.7 -0.3 142 142 A T S X S+ 0 0 23 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 -0.573 74.4 164.0-127.4 69.9 43.8 -4.4 1.0 143 143 A P H > + 0 0 48 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.842 69.5 51.7 -59.8 -37.8 43.6 -6.4 -2.2 144 144 A N H > S+ 0 0 113 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.918 115.5 41.0 -68.3 -42.2 44.7 -9.8 -0.9 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.918 115.2 51.3 -66.9 -47.4 42.2 -9.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 -8,-0.2 5,-0.2 0.915 108.6 53.8 -56.3 -40.9 39.4 -8.4 -0.3 147 147 A K H X S+ 0 0 92 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.884 107.0 49.8 -59.7 -42.1 40.2 -11.1 -2.8 148 148 A R H X S+ 0 0 53 -4,-1.5 4,-1.5 2,-0.2 12,-0.2 0.943 114.5 44.2 -62.5 -46.2 39.8 -13.8 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.909 113.4 50.6 -64.7 -44.3 36.4 -12.4 0.9 150 150 A I H X S+ 0 0 12 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.2 0.917 109.3 51.1 -61.5 -42.5 35.2 -11.9 -2.6 151 151 A T H X S+ 0 0 45 -4,-2.4 4,-2.3 -5,-0.2 6,-0.4 0.840 106.5 55.6 -62.4 -35.9 36.1 -15.5 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.915 110.5 44.1 -63.8 -42.4 34.2 -16.7 -0.6 153 153 A F H < S+ 0 0 1 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.873 114.4 51.0 -70.2 -36.0 31.1 -14.8 -1.9 154 154 A E H < S+ 0 0 85 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.919 124.7 22.5 -67.5 -42.4 31.6 -16.0 -5.4 155 155 A T H < S- 0 0 57 -4,-2.3 -2,-0.2 2,-0.2 -3,-0.2 0.675 84.4-136.1-100.2 -28.3 32.0 -19.7 -4.6 156 156 A G S < S+ 0 0 18 -4,-2.1 2,-0.3 -5,-0.3 -62,-0.2 0.746 73.0 99.8 73.6 21.9 30.4 -20.3 -1.3 157 157 A T S S- 0 0 50 -6,-0.4 3,-0.4 -5,-0.2 -1,-0.3 -0.816 81.4-116.1-130.4 173.6 33.3 -22.5 -0.2 158 158 A W S >> S+ 0 0 26 -2,-0.3 3,-1.7 1,-0.2 4,-0.8 0.138 71.9 122.2 -97.7 21.3 36.4 -21.9 2.0 159 159 A D H >> + 0 0 96 1,-0.3 3,-0.7 2,-0.2 4,-0.6 0.809 65.6 59.0 -52.7 -39.2 38.8 -22.4 -0.8 160 160 A A H 34 S+ 0 0 14 -3,-0.4 4,-0.3 1,-0.3 -1,-0.3 0.660 114.2 38.8 -67.5 -17.3 40.6 -19.0 -0.5 161 161 A Y H <4 S+ 0 0 0 -3,-1.7 -1,-0.3 2,-0.1 -2,-0.2 0.479 94.7 79.3-109.0 -8.7 41.5 -19.8 3.0 162 162 A K H << S+ 0 0 131 -4,-0.8 -2,-0.1 -3,-0.7 -3,-0.1 0.704 92.9 57.5 -76.5 -17.0 42.4 -23.5 2.8 163 163 A N < 0 0 127 -4,-0.6 -1,-0.2 1,-0.1 -2,-0.1 0.973 360.0 360.0 -56.5 -65.3 45.5 -22.3 1.5 164 164 A L 0 0 118 -4,-0.3 -2,-0.2 0, 0.0 -1,-0.1 0.563 360.0 360.0 -67.3 360.0 46.4 -20.2 4.5