==== 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 07-OCT-97 233L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR L.A.LIPSCOMB,D.L.DREW,N.GASSNER,W.A.BAASE,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8604.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 74.1 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 7.4 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 . 13 8.0 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 1 0 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 74 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 148.0 43.4 -1.7 9.2 2 2 A N > - 0 0 71 156,-0.0 4,-2.2 95,-0.0 5,-0.2 -0.910 360.0 -82.5-153.2 179.1 40.2 -0.8 10.9 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.886 124.1 53.3 -59.6 -41.3 38.2 2.4 11.3 4 4 A F H > S+ 0 0 78 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.935 112.4 42.0 -59.4 -51.8 40.2 3.6 14.2 5 5 A E H > S+ 0 0 98 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.858 114.3 55.0 -63.0 -38.0 43.5 3.4 12.4 6 6 A M H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 3,-0.5 0.970 111.0 40.7 -61.9 -56.1 41.9 4.8 9.3 7 7 A L H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 5,-0.3 0.816 109.5 61.7 -64.6 -27.1 40.6 7.9 10.9 8 8 A R H X S+ 0 0 97 -4,-1.8 4,-1.2 -5,-0.3 -1,-0.2 0.853 107.6 45.7 -66.7 -29.0 43.8 8.3 12.9 9 9 A I H < S+ 0 0 84 -4,-1.3 -2,-0.2 -3,-0.5 -1,-0.2 0.939 115.6 45.0 -75.2 -49.5 45.6 8.6 9.6 10 10 A D H < S+ 0 0 19 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.789 124.8 30.4 -67.4 -29.7 43.1 11.0 8.1 11 11 A E H < S- 0 0 47 -4,-2.4 19,-0.4 -5,-0.2 -1,-0.2 0.644 90.8-153.5-107.5 -16.7 42.8 13.3 11.1 12 12 A G < - 0 0 24 -4,-1.2 2,-0.3 -5,-0.3 -1,-0.2 -0.220 25.8 -87.5 73.9-161.8 46.2 13.1 12.8 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.899 41.6 174.0-152.2 119.2 46.6 13.7 16.5 14 14 A R E -A 28 0A 140 14,-1.7 14,-2.3 -2,-0.3 4,-0.1 -0.998 18.9-162.7-131.0 130.3 47.2 17.0 18.3 15 15 A L E S+ 0 0 65 -2,-0.4 43,-1.8 12,-0.2 2,-0.3 0.485 74.5 63.0 -88.9 -5.6 47.3 17.6 22.0 16 16 A K E S-C 57 0B 102 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.870 100.6 -87.3-121.0 148.5 46.8 21.4 21.9 17 17 A I E + 0 0 20 39,-1.7 2,-0.3 -2,-0.3 10,-0.2 -0.299 59.2 169.5 -53.8 139.0 43.8 23.2 20.6 18 18 A Y E -A 26 0A 26 8,-2.9 8,-3.4 -4,-0.1 2,-0.5 -0.893 35.6-100.6-143.3 173.4 44.1 23.8 16.8 19 19 A K E -A 25 0A 123 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.826 32.5-141.1-100.6 131.3 42.2 25.0 13.8 20 20 A D > - 0 0 51 4,-2.9 3,-1.8 -2,-0.5 -1,-0.1 -0.135 42.6 -80.7 -76.8-171.9 40.9 22.4 11.4 21 21 A T T 3 S+ 0 0 114 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.707 135.5 50.2 -62.8 -22.7 40.8 22.9 7.6 22 22 A E T 3 S- 0 0 77 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.455 122.8-108.2 -92.5 -6.0 37.7 25.0 7.9 23 23 A G S < S+ 0 0 30 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.558 73.0 138.1 88.1 19.2 39.4 27.1 10.6 24 24 A Y - 0 0 79 1,-0.1 -4,-2.9 9,-0.0 -1,-0.3 -0.722 61.5 -95.9 -98.9 150.0 37.4 25.8 13.6 25 25 A Y E +AB 19 34A 34 9,-0.6 8,-2.9 11,-0.4 9,-1.7 -0.425 54.9 159.7 -67.8 126.0 38.7 24.9 16.9 26 26 A T E -AB 18 32A 3 -8,-3.4 -8,-2.9 6,-0.3 2,-0.3 -0.857 18.7-166.1-139.2 167.0 39.5 21.3 17.3 27 27 A I E > - B 0 31A 0 4,-1.8 4,-2.0 -2,-0.3 2,-0.2 -0.982 51.1 -0.8-155.1 162.0 41.6 19.0 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.7 -2,-0.3 2,-1.0 -0.414 122.5 -3.0 68.0-129.8 42.9 15.4 19.6 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.665 128.2 -53.6 -98.7 71.6 41.9 13.2 16.8 30 30 A G T 4 S+ 0 0 15 -2,-1.0 2,-1.1 -19,-0.4 -2,-0.2 0.750 84.3 161.5 67.8 22.8 39.6 15.5 14.8 31 31 A H E < -B 27 0A 30 -4,-2.0 -4,-1.8 1,-0.0 -1,-0.2 -0.657 32.1-142.4 -83.7 102.7 37.5 16.3 17.8 32 32 A L E +B 26 0A 71 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.380 21.1 180.0 -64.1 124.4 35.6 19.5 16.9 33 33 A L E - 0 0 14 -8,-2.9 2,-0.3 1,-0.3 -7,-0.2 0.893 57.6 -22.5 -92.8 -49.2 35.1 21.8 19.7 34 34 A T E -B 25 0A 26 -9,-1.7 -9,-0.6 2,-0.1 -1,-0.3 -0.994 31.7-142.3-161.4 153.1 33.2 24.7 18.4 35 35 A K S S+ 0 0 142 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.512 75.3 109.9 -93.2 -6.1 32.4 26.6 15.3 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.361 72.8-132.3 -71.2 146.4 32.6 29.8 17.3 37 37 A P S S+ 0 0 118 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.569 76.0 100.2 -76.0 -8.8 35.5 32.1 16.7 38 38 A S > - 0 0 46 1,-0.2 4,-2.1 -13,-0.0 3,-0.3 -0.704 59.7-155.8 -87.4 121.4 36.4 32.6 20.3 39 39 A L H > S+ 0 0 66 -2,-0.6 4,-1.9 1,-0.2 -1,-0.2 0.765 99.1 57.3 -61.0 -24.8 39.3 30.6 21.7 40 40 A N H > S+ 0 0 119 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.934 101.7 53.0 -72.0 -41.7 37.6 31.0 25.1 41 41 A A H > S+ 0 0 32 -3,-0.3 4,-2.5 1,-0.2 -2,-0.2 0.933 111.8 47.9 -56.7 -44.9 34.4 29.4 23.8 42 42 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.880 110.2 50.2 -62.9 -40.5 36.6 26.5 22.7 43 43 A K H X S+ 0 0 50 -4,-1.9 4,-2.2 2,-0.2 11,-0.3 0.893 111.4 49.7 -66.8 -37.3 38.5 26.2 26.0 44 44 A S H X S+ 0 0 72 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.916 111.3 47.9 -65.7 -47.0 35.2 26.2 27.8 45 45 A E H X S+ 0 0 69 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.924 111.3 53.1 -64.3 -38.9 33.9 23.4 25.6 46 46 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 5,-0.3 0.945 107.7 47.5 -61.5 -47.4 37.1 21.5 26.1 47 47 A D H X>S+ 0 0 34 -4,-2.2 4,-2.5 1,-0.2 5,-1.3 0.916 112.0 52.1 -62.7 -35.4 37.0 21.6 29.9 48 48 A K H <5S+ 0 0 142 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.862 110.5 47.3 -67.5 -36.1 33.4 20.5 29.8 49 49 A A H <5S+ 0 0 44 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.832 121.1 36.1 -74.0 -31.7 34.2 17.5 27.5 50 50 A I H <5S- 0 0 36 -4,-2.0 -2,-0.2 2,-0.3 -3,-0.2 0.696 103.4-126.2 -90.7 -30.1 37.2 16.4 29.6 51 51 A G T <5S+ 0 0 68 -4,-2.5 2,-0.3 1,-0.3 -3,-0.2 0.771 76.1 73.9 87.1 30.2 35.8 17.2 33.0 52 52 A R S - 0 0 9 -2,-1.0 3,-0.9 -11,-0.3 -1,-0.2 0.818 31.7-143.5 -84.7 -33.8 42.5 21.9 30.8 55 55 A N T 3 S- 0 0 117 1,-0.2 3,-0.1 -12,-0.2 -2,-0.1 0.791 74.9 -61.1 67.9 28.5 44.0 25.2 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.2 2,-0.4 0.552 117.9 100.5 77.0 9.7 43.7 24.0 26.1 57 57 A V B < +C 16 0B 66 -3,-0.9 2,-0.3 -41,-0.2 -41,-0.2 -0.972 44.1 175.4-127.3 140.6 46.0 21.0 26.5 58 58 A I - 0 0 5 -43,-1.8 2,-0.2 -2,-0.4 -30,-0.1 -0.876 27.4-109.1-135.3 171.4 45.1 17.3 27.0 59 59 A T > - 0 0 66 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.511 32.7-104.2 -98.3 173.2 46.9 14.1 27.3 60 60 A K H > S+ 0 0 105 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.854 121.2 51.6 -63.0 -37.1 47.0 11.2 24.8 61 61 A D H > S+ 0 0 126 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.903 108.7 49.8 -65.3 -45.1 44.7 9.1 26.8 62 62 A E H > S+ 0 0 38 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.885 110.6 51.3 -61.4 -42.3 42.2 11.9 27.0 63 63 A A H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 -34,-0.4 0.930 110.5 49.5 -62.0 -40.8 42.5 12.3 23.2 64 64 A E H X S+ 0 0 68 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.833 107.2 54.4 -68.7 -30.2 41.9 8.7 22.7 65 65 A K H X S+ 0 0 138 -4,-1.7 4,-2.0 2,-0.2 5,-0.2 0.961 109.1 46.0 -72.0 -42.3 38.9 8.8 25.0 66 66 A L H X S+ 0 0 5 -4,-2.4 4,-3.0 1,-0.2 -2,-0.2 0.935 111.9 56.0 -62.3 -36.6 37.3 11.5 22.9 67 67 A F H X S+ 0 0 12 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.942 106.3 47.3 -60.5 -46.8 38.2 9.5 19.9 68 68 A N H X S+ 0 0 90 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.907 113.2 48.4 -59.6 -42.8 36.4 6.4 21.0 69 69 A Q H X S+ 0 0 99 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.911 112.0 50.7 -64.5 -41.5 33.3 8.4 22.0 70 70 A D H X S+ 0 0 37 -4,-3.0 4,-2.0 -5,-0.2 -2,-0.2 0.872 110.1 48.1 -67.3 -37.8 33.4 10.1 18.6 71 71 A V H X S+ 0 0 7 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.960 113.7 49.1 -65.7 -47.8 33.6 6.8 16.7 72 72 A D H X S+ 0 0 83 -4,-2.3 4,-2.3 -5,-0.3 5,-0.2 0.929 108.9 51.1 -55.8 -45.7 30.9 5.4 18.7 73 73 A A H X S+ 0 0 47 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.928 107.0 54.3 -62.8 -39.3 28.7 8.3 18.2 74 74 A A H X S+ 0 0 10 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.911 109.4 47.6 -59.6 -44.5 29.2 8.2 14.4 75 75 A V H X S+ 0 0 30 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.929 114.0 46.7 -61.8 -43.9 28.1 4.6 14.1 76 76 A R H X S+ 0 0 124 -4,-2.3 4,-1.4 -5,-0.2 -2,-0.2 0.884 107.2 56.6 -68.7 -32.9 25.2 5.3 16.2 77 77 A G H X S+ 0 0 3 -4,-2.9 4,-0.7 -5,-0.2 -1,-0.2 0.923 109.8 48.8 -59.0 -42.4 24.3 8.4 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-0.8 1,-0.2 7,-0.5 0.908 108.5 50.8 -62.5 -46.7 24.3 6.1 11.1 79 79 A L H 3< S+ 0 0 68 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.700 111.3 49.0 -70.9 -20.8 22.1 3.4 12.6 80 80 A R H 3< S+ 0 0 175 -4,-1.4 2,-0.6 -5,-0.2 -1,-0.3 0.569 91.5 95.1 -91.5 -15.5 19.6 5.9 13.7 81 81 A N > S+ 0 0 0 -7,-0.2 4,-2.3 -6,-0.2 3,-1.1 0.889 101.4 66.5 -81.8 -47.6 22.0 6.1 6.2 85 85 A K H 3X S+ 0 0 85 -4,-3.2 4,-2.4 -7,-0.5 5,-0.2 0.868 99.2 50.1 -47.2 -47.5 21.1 2.9 7.9 86 86 A P H 3> S+ 0 0 53 0, 0.0 4,-1.1 0, 0.0 -1,-0.3 0.843 111.5 48.4 -64.7 -31.5 20.0 1.1 4.8 87 87 A V H <> S+ 0 0 1 -3,-1.1 4,-0.9 -4,-0.4 3,-0.5 0.948 112.5 48.9 -72.1 -45.6 23.2 1.9 2.9 88 88 A Y H >< S+ 0 0 31 -4,-2.3 3,-0.9 1,-0.3 -1,-0.2 0.891 109.0 52.8 -57.9 -41.6 25.3 0.9 5.7 89 89 A D H 3< S+ 0 0 75 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.835 106.3 54.2 -68.6 -29.0 23.5 -2.3 6.1 90 90 A S H 3< S+ 0 0 39 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.617 95.8 87.4 -79.2 -13.0 24.0 -3.1 2.4 91 91 A L S << S- 0 0 6 -3,-0.9 2,-0.0 -4,-0.9 31,-0.0 -0.522 73.7-117.4 -92.1 160.5 27.8 -2.7 2.5 92 92 A D > - 0 0 56 -2,-0.2 4,-1.8 1,-0.0 5,-0.2 -0.198 47.1 -86.4 -78.5 172.8 30.7 -5.0 3.3 93 93 A A H > S+ 0 0 81 1,-0.2 4,-1.3 2,-0.2 -2,-0.1 0.875 123.1 46.8 -51.6 -45.0 33.1 -4.4 6.1 94 94 A V H >> S+ 0 0 25 1,-0.2 4,-1.9 62,-0.2 3,-0.6 0.959 111.6 47.7 -62.4 -55.7 35.5 -2.1 4.3 95 95 A R H 3> S+ 0 0 23 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.790 105.8 59.3 -61.9 -30.1 33.0 0.1 2.7 96 96 A R H 3X S+ 0 0 78 -4,-1.8 4,-2.4 2,-0.2 -1,-0.3 0.896 103.1 54.1 -63.5 -37.5 31.2 0.6 6.0 97 97 A A H S+ 0 0 50 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.886 129.0 52.5 -56.7 -40.7 25.2 12.6 9.7 109 109 A T H > S+ 0 0 120 2,-0.2 4,-0.8 1,-0.2 -1,-0.3 0.900 107.7 49.5 -65.5 -41.5 23.3 15.4 8.1 110 110 A G H >< S+ 0 0 32 -4,-0.7 3,-1.0 -3,-0.2 4,-0.2 0.963 115.6 43.7 -63.5 -51.0 26.0 16.3 5.7 111 111 A V H >< S+ 0 0 0 -4,-2.6 3,-2.3 1,-0.2 -2,-0.2 0.922 104.8 61.0 -62.8 -43.0 26.4 12.8 4.5 112 112 A A H 3< S+ 0 0 9 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.759 95.2 66.7 -57.3 -18.7 22.7 12.0 4.3 113 113 A G T << S+ 0 0 56 -3,-1.0 2,-1.3 -4,-0.8 3,-0.3 0.559 74.1 87.1 -77.8 -10.5 22.5 14.9 1.7 114 114 A F <> + 0 0 41 -3,-2.3 4,-2.7 -4,-0.2 5,-0.3 -0.312 55.8 155.2 -82.9 49.7 24.7 12.8 -0.9 115 115 A T H > + 0 0 80 -2,-1.3 4,-2.0 1,-0.3 -1,-0.2 0.894 66.7 46.6 -48.8 -49.7 21.4 11.3 -2.0 116 116 A N H > S+ 0 0 91 -3,-0.3 4,-1.7 1,-0.2 -1,-0.3 0.925 113.8 46.3 -62.5 -43.3 22.5 10.4 -5.4 117 117 A S H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.874 110.3 55.8 -66.5 -36.7 25.8 8.9 -4.2 118 118 A L H X S+ 0 0 12 -4,-2.7 4,-2.8 2,-0.2 -1,-0.2 0.926 106.4 48.7 -61.6 -47.3 24.0 6.9 -1.5 119 119 A R H X S+ 0 0 123 -4,-2.0 4,-1.6 -5,-0.3 -1,-0.2 0.915 110.7 52.2 -60.9 -39.4 21.7 5.3 -3.9 120 120 A L H <>S+ 0 0 18 -4,-1.7 5,-2.0 2,-0.2 4,-0.4 0.881 110.1 47.5 -63.6 -44.2 24.7 4.4 -6.2 121 121 A L H ><5S+ 0 0 3 -4,-2.4 3,-1.9 1,-0.2 -1,-0.2 0.927 109.5 54.1 -65.6 -44.0 26.5 2.8 -3.3 122 122 A Q H 3<5S+ 0 0 95 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.858 108.0 50.9 -56.7 -32.1 23.4 0.9 -2.4 123 123 A Q T 3<5S- 0 0 86 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.544 112.9-120.8 -84.4 -3.6 23.2 -0.4 -5.9 124 124 A K T < 5 + 0 0 100 -3,-1.9 2,-1.2 -4,-0.4 -3,-0.2 0.712 64.4 144.5 71.2 25.8 26.8 -1.6 -5.8 125 125 A R >< + 0 0 113 -5,-2.0 4,-2.5 1,-0.2 5,-0.2 -0.617 20.5 171.3 -94.3 71.1 27.7 0.7 -8.7 126 126 A W H > + 0 0 49 -2,-1.2 4,-2.3 1,-0.2 5,-0.2 0.886 69.8 46.5 -53.3 -52.3 31.2 1.5 -7.4 127 127 A D H > S+ 0 0 113 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.938 115.8 46.7 -62.9 -40.9 32.7 3.3 -10.3 128 128 A E H > S+ 0 0 114 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.907 111.2 51.3 -66.0 -41.0 29.6 5.4 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.917 107.9 53.2 -58.3 -42.1 29.4 6.2 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.903 108.1 49.5 -66.0 -38.8 33.0 7.3 -7.1 131 131 A V H X S+ 0 0 97 -4,-1.8 4,-0.6 1,-0.2 3,-0.4 0.947 114.3 45.5 -65.5 -47.4 32.5 9.7 -9.9 132 132 A N H >< S+ 0 0 49 -4,-2.4 3,-1.0 1,-0.2 -2,-0.2 0.886 107.4 56.5 -60.7 -44.3 29.4 11.2 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-3.1 6,-0.3 1,-0.2 -1,-0.2 0.839 102.1 59.9 -60.7 -25.7 31.1 11.5 -4.9 134 134 A A H 3< S+ 0 0 28 -4,-1.1 2,-1.8 -3,-0.4 -1,-0.2 0.715 85.1 76.7 -75.9 -23.0 33.8 13.5 -6.5 135 135 A K S << S+ 0 0 168 -3,-1.0 2,-0.3 -4,-0.6 -1,-0.2 -0.540 81.8 96.1 -85.6 72.7 31.5 16.2 -7.7 136 136 A S S > S- 0 0 20 -2,-1.8 4,-1.5 1,-0.1 3,-0.3 -0.990 84.8-113.7-155.8 157.6 31.2 17.8 -4.3 137 137 A R H > S+ 0 0 142 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.851 114.2 66.1 -57.5 -42.7 32.7 20.6 -2.2 138 138 A W H > S+ 0 0 15 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.933 104.1 41.4 -43.6 -54.2 34.0 17.9 0.0 139 139 A Y H 4 S+ 0 0 63 -6,-0.3 -1,-0.2 -3,-0.3 -2,-0.2 0.860 114.2 51.7 -71.0 -33.9 36.3 16.6 -2.6 140 140 A N H < S+ 0 0 111 -4,-1.5 -1,-0.2 2,-0.1 -2,-0.2 0.793 115.0 42.7 -72.1 -25.4 37.4 20.0 -3.8 141 141 A Q H < S+ 0 0 106 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.927 131.7 19.0 -88.1 -40.8 38.3 21.2 -0.3 142 142 A T S X S+ 0 0 19 -4,-2.3 4,-2.8 -5,-0.3 -1,-0.2 -0.638 74.9 162.2-130.2 73.2 40.0 18.1 1.0 143 143 A P H > + 0 0 46 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.873 69.7 50.9 -61.9 -42.3 40.9 16.3 -2.1 144 144 A N H > S+ 0 0 108 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.932 115.9 41.9 -67.9 -40.7 43.6 13.9 -0.8 145 145 A R H >> S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 3,-0.6 0.975 114.7 50.9 -67.5 -50.6 41.4 12.7 2.0 146 146 A A H 3X S+ 0 0 0 -4,-2.8 4,-3.2 1,-0.3 5,-0.2 0.933 107.0 56.0 -53.8 -44.6 38.4 12.5 -0.2 147 147 A K H 3X S+ 0 0 89 -4,-3.0 4,-2.0 1,-0.2 -1,-0.3 0.896 106.7 49.6 -54.1 -42.3 40.4 10.5 -2.7 148 148 A R H > S+ 0 0 43 -2,-0.3 3,-2.4 1,-0.2 4,-0.6 0.195 71.4 119.7 -95.0 12.4 42.4 -0.7 2.2 159 159 A D G >4 + 0 0 94 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.808 65.9 60.6 -48.8 -35.8 44.9 0.1 -0.5 160 160 A A G 34 S+ 0 0 36 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.661 108.6 45.8 -70.7 -15.5 44.6 3.8 -0.3 161 161 A Y G <4 0 0 20 -3,-2.4 -1,-0.3 -13,-0.1 -2,-0.2 0.429 360.0 360.0-107.6 -0.8 45.7 3.6 3.3 162 162 A K << 0 0 176 -3,-1.1 -2,-0.2 -4,-0.6 -3,-0.1 0.884 360.0 360.0 -97.4 360.0 48.7 1.3 2.7