==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 12-OCT-93 205L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR D.W.HEINZ,B.W.MATTHEWS . 159 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8389.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 72.3 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 . 10 6.3 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 1.3 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 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 52.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 1 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 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, 0.0 155,-0.0 0.000 360.0 360.0 360.0 124.9 43.2 -2.0 9.0 2 2 A N > - 0 0 67 154,-0.0 4,-2.9 93,-0.0 5,-0.2 -0.854 360.0 -89.8-141.8 171.5 40.1 -0.9 10.7 3 3 A I H > S+ 0 0 25 -2,-0.3 4,-2.7 2,-0.2 5,-0.3 0.878 122.8 53.5 -56.7 -37.9 37.9 2.2 11.0 4 4 A F H > S+ 0 0 76 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.950 113.3 40.6 -64.5 -49.2 40.0 3.5 13.9 5 5 A E H > S+ 0 0 95 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.880 113.7 56.4 -67.4 -36.3 43.2 3.3 12.2 6 6 A M H X S+ 0 0 0 -4,-2.9 4,-1.4 1,-0.2 -2,-0.2 0.907 112.7 39.7 -62.6 -43.1 41.6 4.5 9.0 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 5,-0.4 0.816 107.3 61.7 -75.3 -32.0 40.4 7.7 10.7 8 8 A R H X S+ 0 0 112 -4,-2.3 4,-1.8 -5,-0.3 -2,-0.2 0.933 108.4 47.0 -59.7 -36.9 43.5 8.2 12.7 9 9 A I H < S+ 0 0 84 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.914 114.5 44.1 -66.8 -49.6 45.3 8.5 9.4 10 10 A D H < S+ 0 0 20 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.779 124.9 31.5 -66.4 -33.9 42.8 10.9 7.8 11 11 A E H < S- 0 0 37 -4,-2.6 19,-0.4 1,-0.1 -2,-0.2 0.667 91.4-153.5-101.2 -26.5 42.4 13.2 10.8 12 12 A G < - 0 0 21 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.1 -0.144 24.5 -84.6 77.5-172.6 45.7 13.1 12.5 13 13 A L + 0 0 45 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.989 45.0 168.1-137.3 123.9 46.3 13.8 16.1 14 14 A R E -A 28 0A 127 14,-1.1 14,-2.0 -2,-0.4 4,-0.1 -0.994 18.5-163.3-138.4 120.8 46.7 17.3 17.5 15 15 A L E S+ 0 0 63 -2,-0.4 41,-2.1 12,-0.2 2,-0.4 0.452 71.1 65.3 -89.8 0.9 46.7 17.9 21.2 16 16 A K E S-C 55 0B 109 39,-0.2 39,-0.2 12,-0.1 10,-0.1 -0.948 98.8 -90.1-124.5 139.3 46.1 21.6 21.2 17 17 A I E + 0 0 16 37,-2.3 2,-0.3 -2,-0.4 10,-0.2 -0.081 59.2 164.9 -40.3 153.7 42.9 23.3 19.9 18 18 A Y E -A 26 0A 32 8,-2.4 8,-2.9 -4,-0.1 2,-0.4 -0.989 37.3-102.7-163.7 167.5 43.3 24.1 16.3 19 19 A K E -A 25 0A 128 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.814 30.9-139.4-101.6 150.8 41.3 25.0 13.4 20 20 A D > - 0 0 46 4,-2.3 3,-2.8 -2,-0.4 -1,-0.0 -0.268 42.5 -79.6 -94.8 174.8 40.4 22.6 10.8 21 21 A T T 3 S+ 0 0 88 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.630 132.7 51.4 -52.2 -10.5 40.3 23.1 7.0 22 22 A E T 3 S- 0 0 78 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.493 120.9-104.2-106.4 -0.0 37.0 24.8 7.6 23 23 A G S < S+ 0 0 34 -3,-2.8 2,-0.2 1,-0.3 -2,-0.1 0.239 74.8 138.8 100.7 -12.2 38.0 27.2 10.2 24 24 A Y - 0 0 106 -5,-0.1 -4,-2.3 1,-0.1 -1,-0.3 -0.476 60.5-112.2 -81.8 140.0 36.4 25.3 13.0 25 25 A Y E +A 19 0A 45 -2,-0.2 9,-1.7 -6,-0.2 8,-1.7 -0.395 51.8 161.7 -63.0 129.0 37.9 24.8 16.3 26 26 A T E -AB 18 32A 1 -8,-2.9 -8,-2.4 6,-0.3 2,-0.3 -0.911 16.5-171.2-143.4 169.0 38.7 21.2 16.5 27 27 A I E > + B 0 31A 0 4,-2.3 4,-2.9 -2,-0.3 2,-0.2 -0.992 45.3 4.6-160.5 166.2 40.9 19.1 18.6 28 28 A G E 4 S-A 14 0A 0 -14,-2.0 2,-1.1 -2,-0.3 -14,-1.1 -0.384 123.8 -2.9 63.6-126.2 42.4 15.5 19.1 29 29 A I T 4 S- 0 0 4 32,-0.5 -1,-0.2 -16,-0.2 -17,-0.1 -0.600 130.4 -55.1-100.3 71.0 41.5 13.1 16.4 30 30 A G T 4 S+ 0 0 11 -2,-1.1 2,-1.1 -19,-0.4 -2,-0.2 0.824 83.1 166.0 67.3 29.1 39.2 15.4 14.4 31 31 A H E < -B 27 0A 29 -4,-2.9 -4,-2.3 -20,-0.1 2,-0.5 -0.715 31.7-140.2 -82.4 104.8 37.0 16.1 17.4 32 32 A L E +B 26 0A 83 -2,-1.1 -6,-0.3 -6,-0.2 -7,-0.1 -0.528 25.4 176.8 -65.6 115.2 35.0 19.1 16.2 33 33 A L 0 0 16 -8,-1.7 -7,-0.2 -2,-0.5 -1,-0.2 0.929 360.0 360.0 -84.9 -51.8 34.6 21.6 19.1 34 34 A T 0 0 59 -9,-1.7 -1,-0.2 9,-0.0 -9,-0.1 -0.870 360.0 360.0-114.9 360.0 32.7 24.5 17.4 35 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 36 41 A A > 0 0 85 0, 0.0 4,-1.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 166.1 35.0 31.0 18.0 37 42 A A H > + 0 0 44 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.771 360.0 32.0 -54.9 -59.2 38.0 30.9 20.3 38 43 A K H > S+ 0 0 166 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.735 119.2 57.3 -78.2 -21.6 37.2 31.2 24.0 39 44 A S H > S+ 0 0 61 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.757 107.2 47.7 -73.6 -30.7 34.0 29.6 23.3 40 44AA A H X S+ 0 0 0 -4,-1.0 4,-2.9 2,-0.2 -2,-0.2 0.846 107.9 53.6 -82.3 -33.2 35.9 26.7 21.9 41 44BA A H X S+ 0 0 14 -4,-1.8 4,-1.7 1,-0.2 11,-0.3 0.859 111.8 47.9 -68.0 -28.8 38.2 26.6 24.9 42 44CA A H X S+ 0 0 51 -4,-1.4 4,-1.8 2,-0.2 5,-0.3 0.951 109.1 50.9 -71.4 -49.9 35.1 26.4 26.9 43 45 A E H X S+ 0 0 69 -4,-2.3 4,-2.5 1,-0.3 3,-0.3 0.943 110.7 52.6 -51.6 -47.5 33.6 23.7 24.7 44 46 A L H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -1,-0.3 0.881 107.3 48.5 -57.1 -44.3 36.8 21.8 25.2 45 47 A D H X>S+ 0 0 38 -4,-1.7 5,-2.1 -3,-0.2 4,-1.3 0.845 112.6 48.5 -67.5 -34.0 36.8 22.0 29.0 46 48 A K H <5S+ 0 0 143 -4,-1.8 -2,-0.2 -3,-0.3 -1,-0.2 0.837 111.1 51.6 -68.2 -41.3 33.2 20.8 29.2 47 49 A A H <5S+ 0 0 44 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.865 121.8 31.8 -68.1 -32.1 34.0 17.9 26.8 48 50 A I H <5S- 0 0 32 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.640 103.9-129.3 -98.8 -20.4 36.9 16.8 28.9 49 51 A G T <5S+ 0 0 63 -4,-1.3 2,-0.3 1,-0.3 -3,-0.2 0.883 73.4 83.7 71.4 41.3 35.5 17.9 32.1 50 52 A R S - 0 0 6 -2,-1.1 3,-0.8 -11,-0.3 -1,-0.2 0.857 28.8-146.0 -86.7 -38.2 42.1 22.4 29.8 53 55 A N T 3 S- 0 0 154 1,-0.2 -2,-0.1 -12,-0.2 3,-0.1 0.878 75.7 -61.3 72.0 36.0 44.0 25.5 28.9 54 56 A G T 3 S+ 0 0 6 -13,-0.2 -37,-2.3 1,-0.1 2,-0.4 0.501 119.5 94.0 65.3 12.8 43.4 24.6 25.2 55 57 A V B < -C 16 0B 63 -3,-0.8 2,-0.3 -39,-0.2 -39,-0.2 -0.985 47.8-178.6-143.5 141.7 45.4 21.4 25.6 56 58 A I - 0 0 6 -41,-2.1 -28,-0.1 -2,-0.4 2,-0.0 -0.855 28.0-102.8-132.8 167.0 44.7 17.7 26.3 57 59 A T > - 0 0 68 -2,-0.3 4,-1.7 1,-0.1 5,-0.1 -0.234 34.2-112.3 -80.4 174.1 46.5 14.3 26.8 58 60 A K H > S+ 0 0 111 2,-0.2 4,-1.5 1,-0.2 -1,-0.1 0.784 120.0 57.5 -73.4 -32.9 46.7 11.5 24.2 59 61 A D H > S+ 0 0 117 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.927 108.7 43.6 -66.3 -40.9 44.6 9.6 26.5 60 62 A E H > S+ 0 0 40 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.825 112.0 52.1 -74.3 -34.1 41.8 12.2 26.4 61 63 A A H X S+ 0 0 0 -4,-1.7 4,-1.5 1,-0.2 -32,-0.5 0.842 109.4 51.4 -68.6 -28.2 42.1 12.7 22.8 62 64 A E H X S+ 0 0 83 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.793 107.2 53.9 -74.0 -28.5 41.7 8.9 22.5 63 65 A K H X S+ 0 0 138 -4,-1.3 4,-2.5 2,-0.2 5,-0.2 0.939 107.4 49.3 -70.9 -45.3 38.6 9.1 24.7 64 66 A L H X S+ 0 0 3 -4,-2.2 4,-3.3 1,-0.2 -1,-0.2 0.920 109.1 54.6 -56.3 -42.9 37.0 11.6 22.5 65 67 A F H X S+ 0 0 13 -4,-1.5 4,-2.8 1,-0.2 5,-0.3 0.922 107.6 47.8 -58.1 -48.1 37.8 9.5 19.5 66 68 A N H X S+ 0 0 88 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.941 112.9 48.8 -58.2 -49.0 36.1 6.4 20.9 67 69 A Q H X S+ 0 0 96 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.946 112.2 51.2 -58.3 -45.4 33.1 8.5 21.8 68 70 A D H X S+ 0 0 33 -4,-3.3 4,-1.7 -5,-0.2 -2,-0.2 0.827 109.9 46.1 -60.3 -41.1 33.1 9.9 18.3 69 71 A V H X S+ 0 0 6 -4,-2.8 4,-2.2 2,-0.2 5,-0.3 0.949 113.4 49.8 -72.3 -44.5 33.3 6.6 16.5 70 72 A D H X S+ 0 0 87 -4,-2.7 4,-2.7 -5,-0.3 5,-0.3 0.964 109.5 52.5 -56.4 -46.2 30.6 5.1 18.6 71 73 A A H X S+ 0 0 47 -4,-2.6 4,-2.7 -5,-0.3 -1,-0.2 0.913 109.1 50.4 -57.5 -37.6 28.4 8.2 17.9 72 74 A A H X S+ 0 0 8 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.927 110.3 45.6 -69.1 -46.1 28.8 7.9 14.3 73 75 A V H X S+ 0 0 33 -4,-2.2 4,-2.7 2,-0.2 3,-0.2 0.977 115.1 49.9 -61.5 -47.2 28.0 4.2 13.9 74 76 A R H X S+ 0 0 118 -4,-2.7 4,-1.4 -5,-0.3 -2,-0.2 0.903 110.0 51.0 -56.8 -41.5 25.0 4.8 16.2 75 77 A G H < S+ 0 0 2 -4,-2.7 4,-0.5 -5,-0.3 -1,-0.3 0.856 109.9 49.0 -65.3 -36.5 23.9 7.7 14.1 76 78 A I H >< S+ 0 0 0 -4,-2.2 3,-1.4 -3,-0.2 7,-0.5 0.956 111.0 50.2 -64.5 -48.9 24.1 5.8 10.9 77 79 A L H 3< S+ 0 0 69 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.751 112.1 47.4 -62.2 -25.3 22.1 3.0 12.4 78 80 A R T 3< S+ 0 0 179 -4,-1.4 2,-0.6 -5,-0.2 -1,-0.3 0.406 93.6 99.0 -92.4 -7.7 19.4 5.4 13.6 79 81 A N <> - 0 0 22 -3,-1.4 4,-2.8 -4,-0.5 3,-0.2 -0.740 64.3-149.7 -93.9 131.8 19.2 7.1 10.3 80 82 A A T 4 S+ 0 0 81 -2,-0.6 -1,-0.2 1,-0.3 -4,-0.0 0.839 98.3 37.1 -62.3 -40.8 16.5 6.3 7.9 81 83 A K T 4 S+ 0 0 117 2,-0.1 4,-0.4 1,-0.1 -1,-0.3 0.688 122.1 45.5 -86.8 -16.6 18.4 7.0 4.8 82 84 A L T > S+ 0 0 0 -6,-0.2 4,-3.2 -3,-0.2 3,-0.3 0.877 98.9 64.2 -90.7 -40.8 21.7 5.7 6.1 83 85 A K H X S+ 0 0 80 -4,-2.8 4,-3.0 -7,-0.5 5,-0.2 0.863 100.3 50.6 -48.9 -50.8 20.9 2.5 7.7 84 86 A P H > S+ 0 0 55 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.854 111.9 50.0 -61.8 -35.8 19.7 0.7 4.6 85 87 A V H > S+ 0 0 2 -4,-0.4 4,-0.6 -3,-0.3 3,-0.4 0.976 112.0 46.6 -67.4 -51.2 22.9 1.8 2.8 86 88 A Y H >< S+ 0 0 32 -4,-3.2 3,-2.1 1,-0.2 -1,-0.2 0.955 109.5 52.8 -52.6 -53.5 25.1 0.6 5.6 87 89 A D H 3< S+ 0 0 69 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.877 105.5 56.3 -53.3 -35.5 23.3 -2.7 6.0 88 90 A S H 3< S+ 0 0 36 -4,-1.4 -1,-0.3 -3,-0.4 2,-0.2 0.561 95.5 88.9 -72.4 -13.1 23.7 -3.4 2.3 89 91 A L S << S- 0 0 6 -3,-2.1 31,-0.0 -4,-0.6 30,-0.0 -0.651 75.3-117.5 -95.7 156.9 27.5 -3.0 2.4 90 92 A D > - 0 0 56 -2,-0.2 4,-1.6 1,-0.1 -1,-0.1 -0.182 47.3 -93.5 -69.8 168.4 30.5 -5.4 3.0 91 93 A A H > S+ 0 0 81 2,-0.2 4,-1.2 1,-0.2 -1,-0.1 0.813 120.5 52.1 -62.5 -29.4 32.7 -4.6 6.0 92 94 A V H >> S+ 0 0 24 1,-0.2 4,-1.4 62,-0.2 3,-0.6 0.977 111.0 46.1 -70.5 -51.3 35.3 -2.4 4.1 93 95 A R H 3> S+ 0 0 22 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.767 104.6 62.6 -59.7 -28.6 32.8 -0.2 2.6 94 96 A R H 3X S+ 0 0 81 -4,-1.6 4,-2.6 1,-0.2 -1,-0.2 0.909 102.1 53.0 -60.0 -41.2 31.0 0.2 5.9 95 97 A A H S+ 0 0 58 1,-0.2 4,-2.6 2,-0.2 -1,-0.1 0.872 126.8 54.2 -57.4 -46.9 24.9 12.4 9.4 107 109 A T H > S+ 0 0 122 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.925 107.9 47.7 -61.6 -45.3 23.0 15.1 8.0 108 110 A G H >< S+ 0 0 32 -4,-0.7 3,-0.7 1,-0.2 -1,-0.2 0.865 111.8 49.5 -66.5 -36.0 25.6 16.0 5.5 109 111 A V H >< S+ 0 0 1 -4,-2.2 3,-2.6 1,-0.2 -1,-0.2 0.936 101.2 64.3 -68.0 -38.9 26.1 12.4 4.3 110 112 A A H 3< S+ 0 0 7 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.622 94.1 62.1 -55.8 -18.7 22.3 12.0 4.0 111 113 A G T << S+ 0 0 57 -3,-0.7 2,-1.0 -4,-0.6 3,-0.3 0.473 76.4 87.9 -87.4 -4.9 22.3 14.6 1.2 112 114 A F <> + 0 0 37 -3,-2.6 4,-3.1 1,-0.2 5,-0.2 -0.312 58.1 153.0 -87.2 46.8 24.6 12.5 -1.0 113 115 A T H > + 0 0 79 -2,-1.0 4,-1.6 1,-0.2 -1,-0.2 0.830 62.9 44.5 -45.5 -49.7 21.3 11.0 -2.2 114 116 A N H > S+ 0 0 80 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.861 115.6 46.3 -72.0 -38.1 22.4 10.0 -5.6 115 117 A S H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.848 109.3 56.8 -69.0 -38.3 25.7 8.5 -4.5 116 118 A L H X S+ 0 0 12 -4,-3.1 4,-1.9 2,-0.2 -2,-0.2 0.892 108.0 47.8 -61.1 -39.1 23.9 6.7 -1.6 117 119 A R H X S+ 0 0 112 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.931 110.9 49.3 -70.5 -41.0 21.6 5.0 -4.1 118 120 A M H <>S+ 0 0 32 -4,-1.8 5,-1.8 1,-0.2 4,-0.2 0.904 108.2 54.3 -64.4 -38.1 24.3 3.9 -6.4 119 121 A L H ><5S+ 0 0 2 -4,-2.4 3,-1.7 1,-0.2 -1,-0.2 0.943 107.8 51.8 -59.7 -39.7 26.2 2.5 -3.5 120 122 A Q H 3<5S+ 0 0 92 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.881 106.7 51.6 -60.1 -41.7 23.1 0.5 -2.6 121 123 A Q T 3<5S- 0 0 91 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.341 114.7-118.0 -75.9 2.5 22.9 -0.9 -6.1 122 124 A K T < 5 + 0 0 95 -3,-1.7 2,-1.6 -4,-0.2 -3,-0.2 0.664 62.9 151.4 61.8 25.7 26.5 -1.9 -5.9 123 125 A R >< + 0 0 123 -5,-1.8 4,-2.1 1,-0.2 5,-0.2 -0.596 15.8 170.7 -83.8 67.4 27.3 0.5 -8.8 124 126 A W H > + 0 0 53 -2,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.901 65.7 45.4 -49.0 -61.1 30.9 1.1 -7.7 125 127 A D H > S+ 0 0 109 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.915 116.8 48.7 -54.9 -42.0 32.5 3.0 -10.5 126 128 A E H > S+ 0 0 111 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.806 106.5 50.9 -72.2 -34.8 29.6 5.1 -10.8 127 129 A A H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.847 107.8 56.8 -69.6 -32.0 29.2 6.0 -7.3 128 130 A A H X S+ 0 0 12 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.927 107.9 46.9 -60.9 -47.2 32.9 7.0 -7.2 129 131 A V H < S+ 0 0 86 -4,-1.8 4,-0.5 1,-0.2 3,-0.4 0.921 114.1 47.8 -63.3 -43.7 32.4 9.4 -10.0 130 132 A N H >< S+ 0 0 42 -4,-2.0 3,-1.0 1,-0.2 -2,-0.2 0.860 106.3 56.1 -66.5 -37.4 29.3 10.8 -8.4 131 133 A L H 3< S+ 0 0 2 -4,-2.5 6,-0.4 1,-0.2 -1,-0.2 0.776 100.0 63.1 -65.6 -27.4 30.9 11.2 -4.9 132 134 A A T 3< S+ 0 0 26 -4,-1.2 2,-1.8 -3,-0.4 -1,-0.2 0.641 84.2 76.4 -73.0 -21.3 33.7 13.3 -6.5 133 135 A K S < S+ 0 0 154 -3,-1.0 2,-0.4 -4,-0.5 -1,-0.2 -0.521 80.2 103.0 -86.3 64.9 31.3 16.1 -7.7 134 136 A S S > S- 0 0 16 -2,-1.8 4,-1.5 1,-0.2 5,-0.2 -0.985 82.9-121.5-146.1 160.6 31.0 17.5 -4.4 135 137 A R H > S+ 0 0 149 -2,-0.4 4,-2.5 1,-0.2 3,-0.3 0.940 112.6 64.7 -63.0 -41.4 32.3 20.3 -2.4 136 138 A W H > S+ 0 0 19 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.916 103.9 44.4 -42.2 -56.6 33.6 17.7 -0.0 137 139 A Y H 4 S+ 0 0 56 -6,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.854 113.3 50.1 -61.9 -39.0 36.0 16.3 -2.6 138 140 A N H < S+ 0 0 110 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.763 113.4 46.4 -72.9 -25.4 37.2 19.8 -3.8 139 141 A Q H < S+ 0 0 81 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.859 132.4 15.3 -83.9 -39.9 37.9 20.9 -0.3 140 142 A T S X S+ 0 0 27 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 -0.590 75.4 164.4-132.7 70.0 39.7 17.9 0.9 141 143 A P H > S+ 0 0 54 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.824 70.3 52.4 -61.0 -41.0 40.6 16.0 -2.3 142 144 A N H > S+ 0 0 115 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.920 115.3 41.0 -65.1 -43.2 43.3 13.6 -0.9 143 145 A R H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.903 114.5 53.6 -66.3 -46.0 41.1 12.3 1.9 144 146 A A H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.918 106.3 51.6 -58.1 -40.2 38.2 12.2 -0.3 145 147 A K H X S+ 0 0 101 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.875 108.1 51.4 -66.8 -34.9 40.0 10.2 -2.8 146 148 A R H X S+ 0 0 66 -4,-1.4 4,-2.0 2,-0.2 12,-0.2 0.937 113.8 44.5 -64.2 -45.1 41.1 7.6 -0.2 147 149 A V H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 5,-0.2 0.928 114.4 49.5 -64.6 -46.9 37.5 7.2 1.0 148 150 A I H X S+ 0 0 15 -4,-2.9 4,-1.8 -5,-0.3 -2,-0.2 0.921 108.7 53.0 -61.3 -38.1 36.3 7.1 -2.6 149 151 A T H X S+ 0 0 38 -4,-2.8 4,-2.6 -5,-0.2 5,-0.3 0.937 105.9 53.9 -63.1 -38.9 38.9 4.5 -3.4 150 152 A T H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.857 110.1 46.8 -60.8 -36.2 37.7 2.4 -0.5 151 153 A F H < S+ 0 0 3 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.796 114.5 48.3 -77.6 -26.9 34.1 2.5 -1.9 152 154 A R H < S+ 0 0 102 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.888 125.6 24.3 -76.3 -42.0 35.3 1.7 -5.4 153 155 A T H < S- 0 0 39 -4,-2.6 -3,-0.2 2,-0.2 -2,-0.2 0.627 84.5-136.9-100.0 -26.4 37.5 -1.3 -4.5 154 156 A G S < S+ 0 0 14 -4,-2.0 2,-0.2 -5,-0.3 -62,-0.2 0.547 74.5 102.5 74.3 5.2 36.2 -2.6 -1.3 155 157 A T S S- 0 0 45 -6,-0.3 3,-0.3 -63,-0.1 -1,-0.3 -0.687 81.4-122.9-114.0 174.3 39.8 -2.9 -0.2 156 158 A W S > S+ 0 0 44 -2,-0.2 3,-1.3 1,-0.2 4,-0.2 0.041 70.8 122.5-101.1 25.0 42.1 -0.9 2.0 157 159 A D G > + 0 0 100 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 0.819 68.2 59.2 -54.5 -38.4 44.6 -0.3 -0.8 158 160 A A G 3 S+ 0 0 32 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.632 105.7 48.2 -68.1 -17.4 44.3 3.5 -0.5 159 161 A Y G < 0 0 20 -3,-1.3 -1,-0.3 -13,-0.1 -2,-0.2 0.348 360.0 360.0-106.1 6.4 45.4 3.4 3.1 160 162 A K < 0 0 179 -3,-1.4 -2,-0.1 -4,-0.2 -3,-0.1 0.658 360.0 360.0-116.7 360.0 48.4 1.2 2.5