==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-MAR-03 1OV5 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR B.Q.WEI,W.A.BAASE,L.H.WEAVER,B.W.MATTHEWS,B.K.SHOICHET . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8746.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 73.5 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 7.4 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 . 15 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 51.9 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 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 87 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 142.6 43.5 -1.9 9.1 2 2 A N > - 0 0 69 95,-0.0 4,-2.8 1,-0.0 5,-0.2 -0.937 360.0 -79.9-154.1 177.6 40.3 -0.7 10.8 3 3 A I H > S+ 0 0 22 -2,-0.3 4,-3.3 1,-0.2 5,-0.2 0.802 122.1 51.3 -51.8 -43.8 38.3 2.3 11.3 4 4 A F H > S+ 0 0 71 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.912 114.2 42.3 -68.5 -42.2 40.5 3.8 14.1 5 5 A E H > S+ 0 0 91 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.845 114.8 52.3 -69.2 -41.2 43.7 3.5 12.2 6 6 A M H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 3,-0.3 0.975 115.1 39.6 -60.6 -47.2 42.0 4.7 9.2 7 7 A L H X S+ 0 0 0 -4,-3.3 4,-2.4 1,-0.3 5,-0.4 0.874 109.7 60.4 -68.9 -36.1 40.7 7.7 10.9 8 8 A R H X S+ 0 0 103 -4,-2.6 4,-1.3 -5,-0.2 -1,-0.3 0.863 106.8 49.0 -60.4 -27.8 43.8 8.2 12.8 9 9 A I H < S+ 0 0 84 -4,-1.7 -2,-0.2 -3,-0.3 -1,-0.2 0.938 113.7 41.6 -73.5 -50.3 45.5 8.5 9.5 10 10 A D H < S+ 0 0 20 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.766 124.3 35.5 -71.7 -24.6 43.1 11.0 7.9 11 11 A E H < S- 0 0 42 -4,-2.4 19,-0.3 -5,-0.2 -1,-0.2 0.735 90.5-153.6-100.6 -27.4 42.7 13.3 11.0 12 12 A G < - 0 0 24 -4,-1.3 2,-0.4 -5,-0.4 -1,-0.1 -0.140 22.0 -85.9 77.3-174.2 46.0 13.2 12.8 13 13 A L + 0 0 43 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.991 41.2 170.9-137.0 126.3 46.7 13.7 16.5 14 14 A R E -A 28 0A 140 14,-1.3 14,-2.6 -2,-0.4 4,-0.1 -0.996 21.2-165.6-139.8 127.4 47.1 17.0 18.3 15 15 A L E S+ 0 0 73 -2,-0.4 43,-3.2 12,-0.2 2,-0.3 0.384 76.1 64.3 -89.5 -2.8 47.2 17.6 22.0 16 16 A K E S-C 57 0B 96 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.949 99.5 -88.2-125.3 139.7 46.7 21.4 21.7 17 17 A I E + 0 0 17 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.172 57.3 173.2 -47.2 136.7 43.7 23.3 20.4 18 18 A Y E -A 26 0A 20 8,-2.6 8,-3.5 6,-0.1 2,-0.4 -0.947 34.6-109.4-146.0 162.2 44.0 23.8 16.8 19 19 A K E -A 25 0A 121 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.793 33.1-138.6 -93.6 140.2 42.1 25.0 13.8 20 20 A D > - 0 0 48 4,-1.7 3,-2.6 -2,-0.4 4,-0.0 -0.301 41.1 -82.9 -89.6 174.5 40.9 22.5 11.3 21 21 A T T 3 S+ 0 0 119 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.720 134.6 52.4 -54.7 -18.3 40.9 22.9 7.5 22 22 A E T 3 S- 0 0 83 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.579 123.2-105.8 -91.8 -12.1 37.7 24.8 7.9 23 23 A G S < S+ 0 0 35 -3,-2.6 2,-0.4 1,-0.3 -2,-0.1 0.703 73.8 137.5 93.1 28.9 39.2 27.1 10.5 24 24 A Y - 0 0 73 -4,-0.0 -4,-1.7 1,-0.0 2,-0.3 -0.877 61.2 -99.0-113.2 144.6 37.4 25.6 13.5 25 25 A Y E +AB 19 34A 34 9,-0.7 8,-3.4 11,-0.5 9,-1.4 -0.350 56.2 152.9 -64.6 117.4 38.6 24.8 17.0 26 26 A T E -AB 18 32A 3 -8,-3.5 -8,-2.6 -2,-0.3 2,-0.3 -0.829 20.1-168.7-137.8 171.0 39.4 21.2 17.2 27 27 A I E > + B 0 31A 0 4,-1.2 4,-2.3 -2,-0.3 2,-0.3 -0.981 48.8 3.0-161.9 164.0 41.6 18.9 19.2 28 28 A G E 4 S-A 14 0A 0 -14,-2.6 -14,-1.3 -2,-0.3 2,-0.8 -0.347 121.9 -2.3 63.0-122.5 42.9 15.5 19.5 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -2,-0.3 -16,-0.1 -0.569 129.6 -51.2-106.5 71.1 41.9 13.2 16.8 30 30 A G T 4 S+ 0 0 15 -2,-0.8 2,-1.1 -19,-0.3 -2,-0.2 0.720 85.4 164.5 74.4 22.3 39.6 15.3 14.7 31 31 A H E < -B 27 0A 31 -4,-2.3 -4,-1.2 1,-0.1 -1,-0.2 -0.538 29.3-143.4 -84.8 103.4 37.6 16.4 17.7 32 32 A L E +B 26 0A 75 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.251 22.8 175.3 -61.1 129.8 35.4 19.4 16.9 33 33 A L E - 0 0 11 -8,-3.4 2,-0.3 1,-0.4 -7,-0.2 0.907 56.5 -24.8-101.5 -52.1 35.1 21.7 19.7 34 34 A T E -B 25 0A 28 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.974 32.0-140.8-162.0 152.5 33.2 24.7 18.4 35 35 A K S S+ 0 0 148 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.659 76.3 104.6 -87.8 -17.9 32.3 26.6 15.3 36 36 A S S S- 0 0 49 1,-0.1 -11,-0.5 2,-0.1 -2,-0.1 -0.276 72.2-136.5 -60.9 151.5 32.6 29.8 17.2 37 37 A P S S+ 0 0 112 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.375 74.1 103.6 -91.2 1.1 35.8 31.9 16.6 38 38 A S >> - 0 0 59 1,-0.2 4,-2.1 -13,-0.0 3,-0.6 -0.749 61.1-153.9 -88.3 115.5 36.4 32.7 20.3 39 39 A L H 3> S+ 0 0 55 -2,-0.7 4,-2.2 1,-0.3 -1,-0.2 0.665 96.2 59.9 -59.9 -13.9 39.2 30.6 21.7 40 40 A N H 3> S+ 0 0 104 2,-0.2 4,-2.5 1,-0.1 -1,-0.3 0.920 100.1 50.7 -86.5 -32.4 37.6 30.9 25.0 41 41 A A H <> S+ 0 0 33 -3,-0.6 4,-2.5 1,-0.2 -2,-0.2 0.933 111.7 52.5 -62.0 -40.4 34.4 29.3 23.9 42 42 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.950 109.1 47.6 -56.6 -52.7 36.7 26.6 22.6 43 43 A K H X S+ 0 0 47 -4,-2.2 4,-2.2 2,-0.2 11,-0.3 0.882 110.2 50.9 -57.6 -44.8 38.5 26.2 25.9 44 44 A S H X S+ 0 0 74 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.947 110.2 52.1 -58.9 -46.3 35.3 26.1 27.9 45 45 A E H X S+ 0 0 67 -4,-2.5 4,-2.6 -5,-0.3 -2,-0.2 0.915 108.8 48.7 -56.2 -44.4 34.1 23.4 25.5 46 46 A L H X S+ 0 0 0 -4,-2.6 4,-3.4 2,-0.2 5,-0.4 0.907 110.9 51.0 -60.2 -45.8 37.3 21.3 26.0 47 47 A D H X>S+ 0 0 30 -4,-2.2 4,-2.6 1,-0.2 5,-1.4 0.931 110.0 49.1 -59.2 -48.4 37.0 21.6 29.7 48 48 A K H <5S+ 0 0 139 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.923 114.6 45.9 -59.6 -46.0 33.4 20.5 29.6 49 49 A A H <5S+ 0 0 42 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.906 119.2 38.1 -65.5 -43.9 34.3 17.5 27.3 50 50 A I H <5S- 0 0 34 -4,-3.4 -1,-0.2 2,-0.2 -2,-0.2 0.801 106.2-121.8 -78.6 -34.6 37.3 16.3 29.3 51 51 A G T <5S+ 0 0 63 -4,-2.6 2,-0.3 -5,-0.4 -3,-0.2 0.765 78.7 61.8 99.8 21.3 36.0 16.9 32.6 52 52 A R S - 0 0 9 -2,-0.8 3,-1.1 -11,-0.3 -1,-0.2 0.745 28.9-146.0 -94.2 -28.1 42.6 21.8 30.4 55 55 A N T 3 S- 0 0 122 1,-0.3 3,-0.1 -12,-0.2 -2,-0.1 0.935 74.1 -52.2 59.6 44.5 43.9 25.1 29.5 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.1 2,-0.4 0.617 120.3 94.7 72.2 5.8 43.9 24.2 25.8 57 57 A V B < +C 16 0B 67 -3,-1.1 2,-0.3 -41,-0.2 -41,-0.2 -0.966 44.4 176.7-136.6 148.8 45.8 21.0 26.3 58 58 A I - 0 0 5 -43,-3.2 2,-0.2 -2,-0.4 -30,-0.1 -0.870 25.4-109.5-139.6 172.8 45.2 17.3 26.8 59 59 A T > - 0 0 61 -2,-0.3 4,-2.1 1,-0.1 5,-0.1 -0.473 34.0-106.3 -96.3 171.0 46.9 14.0 27.1 60 60 A K H > S+ 0 0 114 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.890 119.6 49.5 -58.8 -50.4 47.0 11.1 24.7 61 61 A D H > S+ 0 0 123 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.942 110.3 51.4 -59.4 -45.4 44.6 9.0 26.7 62 62 A E H > S+ 0 0 42 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.908 110.0 51.3 -58.1 -42.0 42.2 11.9 26.8 63 63 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -34,-0.4 0.942 111.1 46.1 -59.2 -50.0 42.5 12.2 23.1 64 64 A E H X S+ 0 0 67 -4,-2.9 4,-3.0 1,-0.2 5,-0.2 0.855 108.3 58.1 -65.2 -33.5 41.8 8.6 22.5 65 65 A K H X S+ 0 0 136 -4,-2.9 4,-1.9 -5,-0.2 5,-0.2 0.970 108.7 43.5 -60.1 -53.7 38.9 8.8 24.9 66 66 A L H X S+ 0 0 2 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.871 112.4 54.9 -56.7 -43.2 37.3 11.4 22.9 67 67 A F H X S+ 0 0 14 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.878 106.4 50.5 -56.2 -50.4 38.1 9.5 19.7 68 68 A N H X S+ 0 0 94 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.906 111.6 47.6 -55.2 -42.3 36.4 6.4 21.0 69 69 A Q H X S+ 0 0 94 -4,-1.9 4,-2.6 -5,-0.2 -1,-0.2 0.888 111.3 52.8 -68.4 -34.2 33.3 8.3 21.8 70 70 A D H X S+ 0 0 32 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.914 107.5 47.0 -67.6 -41.9 33.3 10.0 18.5 71 71 A V H X S+ 0 0 9 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.931 113.4 53.5 -65.6 -37.9 33.6 6.8 16.4 72 72 A D H X S+ 0 0 79 -4,-2.1 4,-3.2 -5,-0.3 -2,-0.2 0.962 107.1 47.5 -55.5 -56.7 30.9 5.5 18.5 73 73 A A H X S+ 0 0 49 -4,-2.6 4,-3.4 2,-0.2 -1,-0.2 0.797 109.5 57.0 -50.5 -40.1 28.6 8.5 17.9 74 74 A A H X S+ 0 0 11 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.964 109.5 42.4 -60.6 -54.4 29.3 8.2 14.2 75 75 A V H X S+ 0 0 29 -4,-2.4 4,-3.1 2,-0.2 5,-0.3 0.936 114.5 50.4 -60.7 -46.4 28.1 4.8 13.9 76 76 A R H X S+ 0 0 116 -4,-3.2 4,-1.8 -5,-0.3 -2,-0.2 0.964 108.5 53.8 -58.9 -40.7 25.2 5.5 16.1 77 77 A G H < S+ 0 0 6 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.869 111.0 47.4 -55.4 -39.4 24.4 8.5 14.0 78 78 A I H >< S+ 0 0 2 -4,-2.3 3,-1.9 1,-0.2 7,-0.4 0.949 109.8 50.0 -65.7 -55.9 24.4 6.3 10.9 79 79 A L H 3< S+ 0 0 72 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.692 110.6 53.7 -60.3 -20.3 22.2 3.6 12.5 80 80 A R T 3< S+ 0 0 166 -4,-1.8 2,-0.6 -5,-0.3 -1,-0.3 0.412 88.2 88.0 -95.2 -0.9 19.8 6.2 13.5 81 81 A N <> - 0 0 34 -3,-1.9 4,-2.9 -4,-0.2 -4,-0.0 -0.904 65.4-150.8-103.4 127.6 19.2 7.8 10.2 82 82 A A T 4 S+ 0 0 87 -2,-0.6 -1,-0.1 1,-0.2 -4,-0.0 0.709 98.5 46.7 -64.9 -22.4 16.5 6.2 8.0 83 83 A K T 4 S+ 0 0 147 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.876 119.0 39.2 -85.5 -37.9 18.2 7.2 4.8 84 84 A L T >> S+ 0 0 8 1,-0.2 4,-2.7 -7,-0.1 3,-1.0 0.895 101.8 70.4 -75.2 -44.6 21.6 6.0 5.9 85 85 A K H 3X S+ 0 0 95 -4,-2.9 4,-2.4 -7,-0.4 5,-0.2 0.866 97.9 47.0 -43.8 -54.5 20.8 2.9 7.7 86 86 A P H 3> S+ 0 0 56 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.783 113.4 49.3 -64.9 -27.4 19.7 0.9 4.8 87 87 A V H <> S+ 0 0 10 -3,-1.0 4,-0.9 -4,-0.5 3,-0.4 0.942 110.3 49.6 -79.1 -38.5 22.8 1.8 2.8 88 88 A Y H >< S+ 0 0 28 -4,-2.7 3,-1.2 1,-0.3 -3,-0.2 0.942 108.5 51.9 -64.2 -44.1 25.2 1.1 5.4 89 89 A D H 3< S+ 0 0 68 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.785 104.0 59.2 -67.7 -22.2 23.8 -2.3 6.1 90 90 A S H 3< S+ 0 0 41 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.700 93.7 88.1 -77.0 -16.8 24.0 -3.1 2.4 91 91 A L S << S- 0 0 7 -3,-1.2 2,-0.1 -4,-0.9 31,-0.0 -0.459 76.4-119.0 -84.7 164.0 27.7 -2.6 2.4 92 92 A D > - 0 0 57 -2,-0.1 4,-1.4 1,-0.0 5,-0.2 -0.255 43.6 -89.8 -83.4 172.3 30.6 -4.9 3.1 93 93 A A H > S+ 0 0 74 2,-0.2 4,-0.8 1,-0.2 -2,-0.1 0.852 119.7 46.5 -59.0 -36.2 33.0 -4.2 5.9 94 94 A V H >> S+ 0 0 31 1,-0.3 3,-2.5 62,-0.2 4,-1.2 0.992 113.3 48.8 -71.5 -53.1 35.6 -2.2 4.2 95 95 A R H 3> S+ 0 0 23 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.774 103.8 62.3 -55.3 -21.9 33.2 0.0 2.5 96 96 A R H 3X S+ 0 0 76 -4,-1.4 4,-1.8 1,-0.2 -1,-0.3 0.824 98.5 57.2 -76.5 -19.9 31.5 0.5 5.8 97 97 A C H S+ 0 0 68 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.648 130.9 58.3 -65.1 -18.6 25.0 12.9 9.5 109 109 A T H > S+ 0 0 115 2,-0.2 4,-0.8 -6,-0.1 -1,-0.2 0.978 105.8 42.7 -73.2 -66.9 23.7 16.1 8.1 110 110 A G H >< S+ 0 0 33 -4,-1.0 3,-1.5 1,-0.2 -2,-0.2 0.955 118.4 46.1 -46.8 -65.0 26.3 16.6 5.4 111 111 A V H >< S+ 0 0 6 -4,-2.2 3,-1.7 1,-0.3 -1,-0.2 0.802 97.6 71.7 -50.6 -41.0 26.2 12.9 4.3 112 112 A A H 3< S+ 0 0 25 -4,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.789 93.9 53.4 -49.5 -33.5 22.5 12.7 4.3 113 113 A G T << S+ 0 0 62 -3,-1.5 3,-0.3 -4,-0.8 -1,-0.2 0.179 77.1 96.7 -91.9 17.6 22.0 14.9 1.0 114 114 A F X> + 0 0 45 -3,-1.7 4,-2.4 1,-0.2 3,-1.1 -0.165 50.9 150.2 -94.4 33.0 24.4 12.8 -1.1 115 115 A T H 3> + 0 0 67 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.789 59.8 50.8 -36.1 -50.8 21.3 11.2 -2.2 116 116 A N H 3> S+ 0 0 71 -3,-0.3 4,-1.6 1,-0.2 -1,-0.3 0.905 113.2 45.3 -66.4 -34.8 22.4 10.2 -5.6 117 117 A S H <> S+ 0 0 3 -3,-1.1 4,-3.4 2,-0.2 5,-0.3 0.860 109.6 56.9 -74.4 -31.6 25.5 8.6 -4.3 118 118 A L H X S+ 0 0 23 -4,-2.4 4,-2.8 1,-0.3 5,-0.2 0.953 108.5 45.5 -58.9 -54.6 23.6 6.9 -1.7 119 119 A R H X S+ 0 0 129 -4,-2.5 4,-1.5 -5,-0.2 -1,-0.3 0.845 114.0 51.0 -59.2 -35.3 21.4 5.4 -4.2 120 120 A M H <>S+ 0 0 33 -4,-1.6 5,-2.3 -5,-0.2 4,-0.3 0.937 108.6 49.0 -72.8 -40.0 24.4 4.4 -6.2 121 121 A L H ><5S+ 0 0 9 -4,-3.4 3,-1.4 1,-0.2 -2,-0.2 0.860 108.5 55.7 -62.6 -40.1 26.2 2.8 -3.4 122 122 A Q H 3<5S+ 0 0 93 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.926 107.2 48.3 -62.8 -34.4 23.1 0.9 -2.6 123 123 A Q T 3<5S- 0 0 100 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.533 113.7-119.2 -80.6 -6.4 23.0 -0.5 -6.1 124 124 A K T < 5 + 0 0 98 -3,-1.4 2,-1.4 -4,-0.3 -3,-0.2 0.731 62.1 149.4 70.8 30.9 26.6 -1.4 -5.9 125 125 A R >< + 0 0 113 -5,-2.3 4,-2.9 1,-0.2 5,-0.3 -0.553 18.7 172.6 -93.5 67.2 27.5 0.9 -8.9 126 126 A W H > S+ 0 0 50 -2,-1.4 4,-2.6 1,-0.2 5,-0.2 0.865 70.1 44.5 -42.6 -62.2 31.0 1.6 -7.6 127 127 A D H > S+ 0 0 96 1,-0.2 4,-1.9 -3,-0.2 -1,-0.2 0.935 115.5 50.8 -58.8 -38.7 32.5 3.4 -10.4 128 128 A E H > S+ 0 0 110 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.935 110.7 46.5 -64.7 -46.0 29.4 5.5 -10.7 129 129 A A H X S+ 0 0 0 -4,-2.9 4,-3.7 1,-0.2 5,-0.2 0.895 108.8 57.0 -60.3 -42.5 29.2 6.4 -7.1 130 130 A A H X S+ 0 0 3 -4,-2.6 4,-1.2 -5,-0.3 -1,-0.2 0.893 108.0 45.7 -60.0 -40.4 32.8 7.3 -7.0 131 131 A V H X S+ 0 0 81 -4,-1.9 4,-1.0 -5,-0.2 3,-0.4 0.950 114.5 49.1 -66.3 -45.9 32.5 9.8 -9.9 132 132 A N H >< S+ 0 0 34 -4,-2.1 3,-1.3 1,-0.2 -2,-0.2 0.948 105.4 56.9 -57.9 -49.2 29.4 11.3 -8.3 133 133 A L H 3< S+ 0 0 1 -4,-3.7 6,-0.4 1,-0.3 -1,-0.2 0.859 101.3 57.5 -54.1 -35.9 31.0 11.6 -5.0 134 134 A A H 3< S+ 0 0 27 -4,-1.2 2,-2.9 -3,-0.4 -1,-0.3 0.779 85.7 82.4 -69.4 -23.3 33.9 13.7 -6.5 135 135 A K S << S+ 0 0 159 -3,-1.3 2,-0.3 -4,-1.0 -1,-0.2 -0.396 82.1 95.9 -81.2 71.0 31.4 16.2 -7.7 136 136 A S S > S- 0 0 17 -2,-2.9 4,-2.0 1,-0.1 5,-0.2 -0.995 85.0-117.4-159.5 157.8 31.3 17.9 -4.4 137 137 A R H > S+ 0 0 153 -2,-0.3 4,-2.2 2,-0.2 5,-0.3 0.917 113.2 60.4 -60.7 -40.6 32.5 20.6 -2.2 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.4 2,-0.2 3,-0.3 0.937 107.6 43.4 -53.0 -51.6 33.9 17.9 0.2 139 139 A Y H 4 S+ 0 0 66 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.898 114.8 50.1 -60.1 -46.7 36.2 16.5 -2.5 140 140 A N H < S+ 0 0 107 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.744 114.6 43.4 -65.8 -28.6 37.2 20.0 -3.7 141 141 A Q H < S+ 0 0 107 -4,-2.2 -2,-0.2 -3,-0.3 -1,-0.2 0.835 131.0 21.2 -88.3 -34.8 38.1 21.2 -0.3 142 142 A T S X S+ 0 0 25 -4,-2.4 4,-2.7 -5,-0.3 5,-0.2 -0.592 72.6 161.6-133.8 72.6 39.9 18.2 0.9 143 143 A P H > S+ 0 0 47 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.868 70.3 52.5 -61.8 -44.2 41.0 16.3 -2.2 144 144 A N H > S+ 0 0 114 2,-0.2 4,-1.2 3,-0.1 -2,-0.1 0.933 118.5 37.9 -61.9 -41.3 43.7 14.0 -0.8 145 145 A R H >> S+ 0 0 24 2,-0.2 4,-2.0 1,-0.2 3,-1.2 0.989 114.2 52.7 -68.3 -62.2 41.4 12.7 1.9 146 146 A A H 3X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.3 5,-0.2 0.883 108.5 54.8 -41.1 -43.7 38.3 12.6 -0.2 147 147 A K H 3X S+ 0 0 88 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.3 0.883 105.1 51.4 -62.5 -39.8 40.3 10.6 -2.7 148 148 A R H S+ 0 0 53 -2,-0.2 3,-1.4 1,-0.2 -6,-0.1 0.093 73.1 118.6 -90.5 12.8 42.4 -0.7 1.9 159 159 A D G > + 0 0 115 1,-0.3 3,-2.8 2,-0.2 -1,-0.2 0.888 67.1 58.9 -53.3 -35.4 44.7 0.1 -0.9 160 160 A A G 3 S+ 0 0 30 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.745 108.2 46.9 -65.8 -22.7 44.4 3.9 -0.5 161 161 A Y G < 0 0 6 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.228 360.0 360.0-100.4 16.4 45.6 3.6 2.9 162 162 A K < 0 0 208 -3,-2.8 -1,-0.3 -4,-0.1 -2,-0.1 -0.046 360.0 360.0 39.4 360.0 48.4 1.3 1.6