==== 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 05-OCT-97 232L . 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) . 8564.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.8 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 . 7 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.4 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 73 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 150.9 43.4 -1.9 9.1 2 2 A N > - 0 0 70 1,-0.0 4,-2.9 156,-0.0 5,-0.2 -0.944 360.0 -82.1-152.7 178.4 40.2 -0.7 10.7 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.852 123.9 51.3 -53.1 -42.8 38.1 2.4 11.3 4 4 A F H > S+ 0 0 76 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.933 113.7 42.0 -64.9 -45.9 40.3 3.7 14.1 5 5 A E H > S+ 0 0 96 2,-0.2 4,-1.8 -3,-0.2 -2,-0.2 0.909 114.1 54.0 -66.6 -40.7 43.5 3.4 12.2 6 6 A M H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.936 112.8 41.6 -59.1 -51.8 41.9 4.8 9.1 7 7 A L H X S+ 0 0 0 -4,-2.9 4,-2.7 -5,-0.2 5,-0.4 0.867 109.0 59.2 -68.0 -31.1 40.6 7.8 10.9 8 8 A R H X S+ 0 0 108 -4,-2.1 4,-1.6 -5,-0.3 -1,-0.2 0.877 108.2 47.6 -65.2 -30.5 43.9 8.3 12.8 9 9 A I H < S+ 0 0 85 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.939 114.6 45.4 -74.2 -44.6 45.6 8.5 9.5 10 10 A D H < S+ 0 0 20 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.849 125.9 27.1 -68.1 -35.1 43.1 11.0 8.1 11 11 A E H < S- 0 0 45 -4,-2.7 19,-0.3 1,-0.1 -1,-0.2 0.666 91.8-152.6-102.2 -21.9 42.8 13.3 11.0 12 12 A G < - 0 0 24 -4,-1.6 2,-0.4 -5,-0.4 -1,-0.1 -0.132 26.6 -84.4 74.1-171.9 46.2 12.9 12.7 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.988 42.6 173.2-135.6 125.9 46.7 13.5 16.5 14 14 A R E -A 28 0A 144 14,-1.5 14,-2.3 -2,-0.4 4,-0.1 -1.000 17.6-164.2-133.9 129.6 47.3 16.9 18.2 15 15 A L E S+ 0 0 67 -2,-0.4 43,-3.0 12,-0.2 2,-0.3 0.424 74.3 63.1 -90.8 -5.9 47.3 17.4 21.9 16 16 A K E S-C 57 0B 89 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.923 101.8 -86.8-119.7 144.5 46.9 21.2 21.9 17 17 A I E + 0 0 14 39,-1.9 2,-0.3 -2,-0.3 10,-0.2 -0.249 58.1 170.4 -50.2 128.9 43.9 23.1 20.6 18 18 A Y E -A 26 0A 25 8,-2.9 8,-3.4 -4,-0.1 2,-0.5 -0.828 35.1-104.6-135.6 172.7 44.3 23.7 16.8 19 19 A K E -A 25 0A 125 -2,-0.3 6,-0.2 6,-0.2 2,-0.0 -0.843 33.8-139.9 -99.9 137.6 42.3 25.0 13.8 20 20 A D > - 0 0 47 4,-2.8 3,-2.5 -2,-0.5 -1,-0.1 -0.154 41.2 -78.2 -82.5-172.2 41.1 22.5 11.4 21 21 A T T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.700 135.4 48.2 -61.1 -21.6 40.9 22.9 7.5 22 22 A E T 3 S- 0 0 80 2,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.369 123.9-105.7 -96.5 -0.3 37.8 25.1 7.9 23 23 A G S < S+ 0 0 38 -3,-2.5 2,-0.4 1,-0.3 -2,-0.1 0.706 73.5 141.2 83.1 24.2 39.5 27.2 10.6 24 24 A Y - 0 0 78 1,-0.0 -4,-2.8 13,-0.0 -1,-0.3 -0.862 59.6-100.9-106.5 146.0 37.6 25.7 13.5 25 25 A Y E +AB 19 34A 36 9,-0.6 8,-2.7 11,-0.5 9,-1.5 -0.340 54.2 159.6 -62.7 125.0 38.9 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 -0.876 19.8-161.7-141.9 166.6 39.6 21.2 17.3 27 27 A I E > - B 0 31A 0 4,-2.1 4,-2.5 -2,-0.3 2,-0.2 -0.989 50.3 -3.8-151.3 159.3 41.6 18.9 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.5 -2,-0.3 2,-1.0 -0.381 123.3 -1.8 67.5-128.3 43.0 15.3 19.5 29 29 A I T 4 S- 0 0 2 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.650 129.8 -54.4-100.4 73.4 42.0 13.1 16.7 30 30 A G T 4 S+ 0 0 15 -2,-1.0 2,-0.9 -19,-0.3 -2,-0.2 0.805 83.0 161.6 64.7 33.8 39.8 15.5 14.8 31 31 A H E < -B 27 0A 31 -4,-2.5 -4,-2.1 1,-0.0 2,-0.2 -0.749 32.8-141.6 -88.1 104.6 37.5 16.3 17.7 32 32 A L E -B 26 0A 72 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.405 20.0-177.5 -64.4 122.7 35.7 19.6 16.8 33 33 A L E - 0 0 15 -8,-2.7 2,-0.3 1,-0.3 -7,-0.2 0.914 58.5 -24.6 -89.4 -44.8 35.3 21.8 19.8 34 34 A T E -B 25 0A 27 -9,-1.5 -9,-0.6 2,-0.1 -1,-0.3 -0.962 35.2-137.2-167.0 151.3 33.4 24.7 18.4 35 35 A K S S+ 0 0 145 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.547 76.2 106.9 -90.8 -7.3 32.5 26.6 15.3 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.5 2,-0.1 -2,-0.1 -0.319 74.5-130.8 -71.9 147.6 33.0 29.9 17.2 37 37 A P S S+ 0 0 126 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.287 75.6 105.8 -85.7 13.9 36.0 32.1 16.6 38 38 A S > - 0 0 41 1,-0.2 4,-2.2 -13,-0.0 5,-0.1 -0.855 56.6-159.4-101.9 122.2 36.7 32.4 20.3 39 39 A L H > S+ 0 0 62 -2,-0.6 4,-2.6 1,-0.2 5,-0.2 0.795 96.3 57.8 -62.7 -27.2 39.6 30.5 21.7 40 40 A N H > S+ 0 0 117 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.936 103.6 48.7 -72.1 -42.2 37.9 31.0 25.0 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.950 111.8 52.1 -59.0 -42.6 34.8 29.3 24.0 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.930 109.2 47.9 -56.8 -49.0 37.0 26.6 22.6 43 43 A K H X S+ 0 0 57 -4,-2.6 4,-2.8 1,-0.2 11,-0.3 0.887 110.9 52.6 -63.1 -37.0 38.8 26.1 25.9 44 44 A S H X S+ 0 0 70 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.909 109.8 46.9 -65.2 -41.3 35.6 26.1 27.8 45 45 A E H X S+ 0 0 64 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.905 111.0 53.8 -67.1 -40.7 34.2 23.4 25.5 46 46 A L H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.2 5,-0.4 0.968 109.1 46.8 -57.2 -52.8 37.4 21.5 26.0 47 47 A D H X>S+ 0 0 33 -4,-2.8 4,-2.6 1,-0.3 5,-1.3 0.927 113.2 49.8 -55.0 -46.4 37.2 21.6 29.8 48 48 A K H <5S+ 0 0 142 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.853 110.7 50.0 -60.7 -38.2 33.6 20.5 29.7 49 49 A A H <5S+ 0 0 43 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.866 120.9 32.0 -73.0 -31.6 34.4 17.6 27.4 50 50 A I H <5S- 0 0 39 -4,-2.1 -2,-0.2 2,-0.3 -1,-0.2 0.615 105.1-123.5 -97.3 -25.4 37.3 16.2 29.4 51 51 A G T <5S+ 0 0 64 -4,-2.6 2,-0.3 -5,-0.4 -3,-0.2 0.800 75.2 74.3 85.8 32.1 36.0 17.2 32.8 52 52 A R S - 0 0 8 -2,-0.9 3,-1.0 -11,-0.3 -1,-0.2 0.758 31.0-145.3 -93.2 -30.1 42.8 21.8 30.8 55 55 A N T 3 S- 0 0 117 1,-0.2 3,-0.1 -12,-0.1 -2,-0.1 0.799 73.2 -60.5 67.4 27.9 44.3 25.1 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.9 1,-0.2 2,-0.4 0.518 117.1 96.4 77.1 3.3 44.1 24.0 26.1 57 57 A V B < -C 16 0B 68 -3,-1.0 2,-0.3 -41,-0.2 -41,-0.2 -0.969 47.0-179.7-127.9 141.6 46.2 20.9 26.4 58 58 A I - 0 0 4 -43,-3.0 2,-0.2 -2,-0.4 -30,-0.1 -0.847 26.6-107.4-132.8 171.2 45.3 17.2 26.9 59 59 A T > - 0 0 59 -2,-0.3 4,-2.5 1,-0.1 5,-0.1 -0.515 31.8-109.2 -93.4 166.7 46.9 14.0 27.2 60 60 A K H > S+ 0 0 115 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.846 120.1 51.4 -60.8 -40.5 47.1 11.2 24.7 61 61 A D H > S+ 0 0 122 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.883 109.5 51.9 -65.6 -37.1 44.8 9.0 26.7 62 62 A E H > S+ 0 0 40 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.934 109.7 48.4 -63.3 -47.5 42.4 11.9 26.9 63 63 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -34,-0.4 0.857 110.3 52.6 -59.1 -38.0 42.5 12.2 23.1 64 64 A E H X S+ 0 0 75 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.845 106.9 53.1 -67.4 -33.7 41.9 8.5 22.7 65 65 A K H X S+ 0 0 143 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.930 108.7 46.4 -66.8 -47.6 38.9 8.7 24.9 66 66 A L H X S+ 0 0 5 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.902 111.0 56.1 -58.8 -42.8 37.3 11.5 22.9 67 67 A F H X S+ 0 0 12 -4,-2.0 4,-2.7 1,-0.2 5,-0.3 0.938 107.5 47.1 -55.4 -50.5 38.2 9.5 19.7 68 68 A N H X S+ 0 0 90 -4,-2.4 4,-2.5 1,-0.2 5,-0.3 0.931 112.6 48.8 -59.1 -44.2 36.3 6.4 20.9 69 69 A Q H X S+ 0 0 94 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.877 113.0 49.1 -63.5 -37.9 33.3 8.4 21.9 70 70 A D H X S+ 0 0 35 -4,-2.4 4,-1.6 -5,-0.2 -2,-0.2 0.867 110.7 47.5 -70.2 -35.9 33.3 10.1 18.6 71 71 A V H X S+ 0 0 6 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.953 112.8 51.4 -67.9 -45.5 33.6 6.9 16.5 72 72 A D H X S+ 0 0 84 -4,-2.5 4,-2.6 1,-0.3 5,-0.2 0.918 109.7 48.8 -55.9 -45.1 30.9 5.4 18.6 73 73 A A H X S+ 0 0 49 -4,-1.9 4,-3.0 -5,-0.3 -1,-0.3 0.904 106.0 55.6 -66.3 -36.2 28.7 8.2 18.1 74 74 A A H X S+ 0 0 10 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.948 110.3 47.7 -61.4 -43.6 29.2 8.3 14.3 75 75 A V H X S+ 0 0 30 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.936 111.9 49.1 -61.5 -46.1 28.1 4.7 14.1 76 76 A R H X S+ 0 0 131 -4,-2.6 4,-1.4 -5,-0.2 -1,-0.2 0.909 108.7 52.4 -63.2 -35.6 25.2 5.4 16.2 77 77 A G H X S+ 0 0 3 -4,-3.0 4,-0.9 -5,-0.2 -1,-0.2 0.891 108.6 51.5 -63.7 -40.5 24.2 8.3 14.1 78 78 A I H >< S+ 0 0 0 -4,-2.2 3,-1.1 -5,-0.2 7,-0.4 0.957 109.8 49.3 -59.1 -49.9 24.4 6.2 11.0 79 79 A L H 3< S+ 0 0 70 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.676 111.8 49.6 -64.7 -23.4 22.1 3.5 12.6 80 80 A R H 3< S+ 0 0 180 -4,-1.4 2,-0.5 -3,-0.2 -1,-0.3 0.537 91.4 93.3 -90.5 -15.4 19.6 6.1 13.6 81 81 A N > S+ 0 0 0 -6,-0.2 4,-2.5 -7,-0.2 3,-0.5 0.864 100.9 63.8 -81.8 -43.1 22.0 6.2 6.2 85 85 A K H 3X S+ 0 0 87 -4,-3.0 4,-2.7 -7,-0.4 5,-0.2 0.883 98.4 52.3 -51.3 -47.2 21.1 3.0 7.8 86 86 A P H 3> S+ 0 0 52 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.870 111.7 48.6 -63.0 -31.3 19.9 1.1 4.7 87 87 A V H <> S+ 0 0 2 -3,-0.5 4,-0.8 -4,-0.5 3,-0.2 0.934 111.6 47.6 -71.1 -46.8 23.1 1.9 2.9 88 88 A Y H >< S+ 0 0 34 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.933 109.2 54.1 -59.8 -44.9 25.3 0.9 5.7 89 89 A D H 3< S+ 0 0 73 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.852 107.5 52.5 -60.3 -30.6 23.4 -2.4 6.2 90 90 A S H 3< S+ 0 0 42 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.607 96.7 88.6 -81.7 -11.5 23.9 -3.2 2.5 91 91 A L S << S- 0 0 6 -3,-1.2 2,-0.1 -4,-0.8 31,-0.0 -0.544 75.7-115.3 -91.3 159.6 27.7 -2.7 2.5 92 92 A D > - 0 0 54 -2,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.205 43.7 -95.7 -75.3 168.4 30.6 -4.9 3.2 93 93 A A H > S+ 0 0 76 2,-0.2 4,-1.5 1,-0.2 -2,-0.1 0.872 120.7 49.6 -59.7 -41.6 32.9 -4.2 6.1 94 94 A V H >> S+ 0 0 27 1,-0.2 4,-1.5 62,-0.2 3,-0.6 0.977 113.1 47.6 -63.3 -49.3 35.6 -2.2 4.3 95 95 A R H 3> S+ 0 0 25 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.868 104.4 60.0 -61.7 -34.5 33.0 -0.0 2.7 96 96 A R H 3X S+ 0 0 76 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.912 102.2 55.1 -58.6 -38.3 31.2 0.5 6.0 97 97 A A H S+ 0 0 46 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.856 128.1 55.1 -58.8 -42.0 25.1 12.7 9.6 109 109 A T H > S+ 0 0 125 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.918 107.6 49.0 -60.8 -46.0 23.3 15.5 8.1 110 110 A G H >< S+ 0 0 32 -4,-0.7 3,-0.7 1,-0.2 -2,-0.2 0.903 115.3 41.9 -60.7 -50.5 26.0 16.3 5.5 111 111 A V H >< S+ 0 0 0 -4,-2.0 3,-2.1 1,-0.2 -1,-0.2 0.856 103.8 65.1 -69.4 -38.2 26.4 12.8 4.3 112 112 A A H 3< S+ 0 0 14 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.734 95.3 64.4 -56.8 -20.7 22.6 12.1 4.3 113 113 A G T << S+ 0 0 59 -3,-0.7 2,-0.6 -4,-0.7 3,-0.3 0.459 75.7 87.1 -80.2 -3.5 22.6 14.9 1.5 114 114 A F <> + 0 0 37 -3,-2.1 4,-3.1 1,-0.2 5,-0.3 -0.272 53.8 153.4 -93.0 49.1 24.6 12.8 -0.9 115 115 A T H > + 0 0 75 -2,-0.6 4,-2.5 1,-0.2 -1,-0.2 0.854 64.6 48.4 -45.4 -54.7 21.5 11.2 -2.1 116 116 A N H > S+ 0 0 86 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.914 115.3 44.7 -58.4 -44.7 22.6 10.3 -5.6 117 117 A S H > S+ 0 0 1 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.898 110.3 55.1 -68.8 -39.8 25.8 8.7 -4.3 118 118 A L H X S+ 0 0 12 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.898 107.4 49.9 -60.4 -41.2 24.1 6.9 -1.6 119 119 A R H X S+ 0 0 103 -4,-2.5 4,-2.4 -5,-0.3 -1,-0.2 0.938 110.2 50.2 -60.1 -45.2 21.7 5.3 -4.1 120 120 A K H X>S+ 0 0 53 -4,-2.1 5,-2.4 2,-0.2 4,-0.7 0.885 109.8 50.9 -62.8 -38.3 24.7 4.2 -6.3 121 121 A L H ><5S+ 0 0 2 -4,-2.2 3,-1.5 2,-0.2 -1,-0.2 0.958 108.6 51.7 -64.9 -46.3 26.4 2.7 -3.3 122 122 A Q H 3<5S+ 0 0 89 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.888 110.4 48.7 -55.0 -40.7 23.3 0.8 -2.4 123 123 A Q H 3<5S- 0 0 84 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.586 112.1-122.3 -74.8 -12.2 23.1 -0.5 -6.0 124 124 A K T <<5 + 0 0 101 -3,-1.5 2,-1.0 -4,-0.7 -3,-0.2 0.810 61.9 146.8 71.5 33.1 26.8 -1.5 -5.8 125 125 A R >< + 0 0 112 -5,-2.4 4,-2.6 1,-0.2 5,-0.2 -0.689 21.8 175.7-100.1 73.1 27.7 0.6 -8.8 126 126 A W H > S+ 0 0 48 -2,-1.0 4,-2.2 1,-0.2 -1,-0.2 0.842 70.6 44.1 -50.6 -50.4 31.2 1.4 -7.5 127 127 A D H > S+ 0 0 109 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.911 113.9 50.0 -68.6 -40.1 32.6 3.4 -10.3 128 128 A E H > S+ 0 0 93 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.914 110.6 49.8 -65.4 -38.6 29.5 5.4 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.6 4,-3.3 2,-0.2 5,-0.2 0.918 108.0 54.1 -62.9 -43.3 29.3 6.3 -7.1 130 130 A A H X S+ 0 0 9 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.922 108.5 49.6 -58.1 -44.0 33.0 7.4 -7.1 131 131 A V H < S+ 0 0 98 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.905 114.2 44.4 -62.5 -42.3 32.4 9.7 -9.9 132 132 A N H >< S+ 0 0 36 -4,-1.8 3,-1.4 1,-0.2 -2,-0.2 0.896 108.9 55.7 -69.7 -41.8 29.3 11.3 -8.2 133 133 A L H 3< S+ 0 0 1 -4,-3.3 6,-0.4 1,-0.3 -1,-0.2 0.835 101.7 59.7 -58.1 -32.9 31.0 11.5 -4.9 134 134 A A T 3< S+ 0 0 29 -4,-1.4 2,-1.6 -5,-0.2 -1,-0.3 0.671 85.6 79.2 -72.1 -16.9 33.8 13.6 -6.5 135 135 A K S < S+ 0 0 154 -3,-1.4 2,-0.3 -4,-0.4 -1,-0.2 -0.576 81.2 98.9 -90.7 68.1 31.4 16.2 -7.6 136 136 A S S > S- 0 0 16 -2,-1.6 4,-2.1 1,-0.1 5,-0.2 -0.990 84.3-117.6-153.2 156.5 31.3 17.8 -4.2 137 137 A R H > S+ 0 0 150 -2,-0.3 4,-3.0 2,-0.2 5,-0.3 0.889 114.8 63.1 -61.3 -38.0 32.6 20.6 -2.2 138 138 A W H > S+ 0 0 18 1,-0.2 4,-2.5 2,-0.2 8,-0.2 0.955 105.1 44.7 -51.7 -48.1 34.1 17.9 0.0 139 139 A Y H 4 S+ 0 0 63 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.942 114.6 47.2 -65.1 -46.1 36.2 16.6 -2.8 140 140 A N H < S+ 0 0 110 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.848 116.0 44.4 -67.4 -31.5 37.4 20.0 -3.9 141 141 A Q H < S+ 0 0 107 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.870 132.2 17.1 -81.9 -38.0 38.2 21.2 -0.4 142 142 A T S X S+ 0 0 24 -4,-2.5 4,-2.6 -5,-0.3 5,-0.2 -0.523 73.8 161.7-132.8 68.2 40.0 18.1 0.9 143 143 A P H > + 0 0 48 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.836 69.1 54.0 -59.3 -38.9 40.9 16.2 -2.2 144 144 A N H > S+ 0 0 105 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.974 115.7 38.5 -66.1 -45.7 43.6 13.9 -0.8 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.936 116.5 51.6 -66.5 -44.5 41.5 12.6 1.9 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.940 107.6 55.0 -57.4 -43.3 38.4 12.5 -0.3 147 147 A K H X S+ 0 0 92 -4,-3.0 4,-2.6 -5,-0.2 5,-0.3 0.926 106.8 50.3 -57.3 -42.8 40.4 10.5 -2.8 148 148 A R H X S+ 0 0 68 -4,-2.0 4,-1.4 -5,-0.2 12,-0.2 0.925 112.8 44.5 -62.0 -42.5 41.3 7.9 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.911 113.2 52.2 -67.4 -41.5 37.7 7.4 0.9 150 150 A I H X S+ 0 0 10 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.909 108.8 49.1 -62.6 -42.3 36.5 7.3 -2.6 151 151 A T H X S+ 0 0 29 -4,-2.6 4,-2.9 -5,-0.3 6,-0.4 0.864 107.7 56.3 -63.7 -34.7 39.0 4.6 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.4 4,-2.6 -5,-0.3 5,-0.3 0.924 109.6 43.8 -63.0 -44.5 38.0 2.7 -0.6 153 153 A F H < S+ 0 0 1 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.842 114.9 51.6 -67.7 -34.8 34.4 2.7 -1.8 154 154 A R H < S+ 0 0 95 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.921 123.1 25.2 -67.0 -44.3 35.5 1.9 -5.3 155 155 A T H < S- 0 0 54 -4,-2.9 -2,-0.2 2,-0.2 -3,-0.2 0.678 85.2-135.6 -97.9 -24.4 37.7 -1.1 -4.5 156 156 A G S < S+ 0 0 17 -4,-2.6 2,-0.2 1,-0.3 -62,-0.2 0.667 74.8 105.2 70.5 16.6 36.3 -2.5 -1.2 157 157 A T S S- 0 0 46 -6,-0.4 3,-0.3 -5,-0.3 -1,-0.3 -0.794 79.8-123.9-123.1 170.0 40.1 -2.7 -0.1 158 158 A W S >> S+ 0 0 43 -2,-0.2 3,-2.3 1,-0.2 4,-0.7 0.231 71.5 121.4 -96.1 12.4 42.4 -0.7 2.2 159 159 A D G >4 + 0 0 95 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.782 66.3 58.5 -43.7 -42.9 44.8 -0.1 -0.6 160 160 A A G 34 S+ 0 0 34 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.669 108.9 48.3 -66.0 -21.7 44.6 3.8 -0.3 161 161 A Y G <4 0 0 19 -3,-2.3 -1,-0.3 -13,-0.1 -2,-0.2 0.586 360.0 360.0 -99.0 -8.5 45.7 3.4 3.2 162 162 A K << 0 0 170 -3,-0.9 -3,-0.0 -4,-0.7 0, 0.0 -0.366 360.0 360.0 -89.6 360.0 48.8 1.1 2.9