==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-JUN-09 3HT9 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR S.E.BOYCE,D.L.MOBLEY,G.J.ROCKLIN,A.P.GRAVES,K.A.DILL,B.K.SHO . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8805.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 71.6 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 6.2 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 . 13 8.0 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 1 0 0 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 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 80 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 146.9 -52.9 15.9 -7.0 2 2 A N > - 0 0 69 156,-0.0 4,-2.3 95,-0.0 5,-0.2 -0.891 360.0 -79.5-153.6 178.8 -50.5 18.3 -5.3 3 3 A I H > S+ 0 0 20 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.833 126.2 51.8 -60.3 -34.5 -46.8 18.5 -4.8 4 4 A F H > S+ 0 0 78 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.949 112.8 42.6 -68.3 -48.3 -46.8 15.9 -2.0 5 5 A E H > S+ 0 0 95 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.857 115.7 52.4 -63.8 -34.7 -48.7 13.2 -3.9 6 6 A M H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 3,-0.2 0.965 114.1 39.3 -68.7 -53.8 -46.7 14.0 -7.0 7 7 A L H X S+ 0 0 0 -4,-2.8 4,-3.1 1,-0.2 5,-0.4 0.830 110.3 60.8 -68.5 -30.2 -43.3 13.6 -5.4 8 8 A R H X S+ 0 0 104 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.900 108.6 44.7 -61.0 -40.3 -44.6 10.6 -3.3 9 9 A I H < S+ 0 0 73 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.937 118.0 43.6 -65.3 -45.4 -45.2 8.9 -6.7 10 10 A D H < S+ 0 0 19 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.847 124.9 31.7 -72.3 -30.7 -41.9 9.9 -8.1 11 11 A E H < S- 0 0 39 -4,-3.1 19,-0.5 1,-0.2 -1,-0.2 0.683 92.7-151.5-101.1 -25.2 -39.8 9.1 -5.0 12 12 A G < - 0 0 24 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.2 -0.202 22.8 -90.5 75.7-176.0 -41.6 6.2 -3.4 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.952 44.0 168.3-137.8 118.6 -41.5 5.5 0.3 14 14 A R E -A 28 0A 142 14,-2.2 14,-2.8 -2,-0.4 4,-0.1 -0.998 22.1-158.3-130.9 131.5 -38.9 3.2 1.9 15 15 A L E S+ 0 0 65 -2,-0.4 43,-2.5 12,-0.2 2,-0.3 0.551 74.3 60.2 -90.3 -7.8 -38.4 3.0 5.6 16 16 A K E S-C 57 0B 139 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.893 101.6 -82.6-119.9 155.9 -34.9 1.7 5.6 17 17 A I E + 0 0 29 39,-2.1 2,-0.3 -2,-0.3 10,-0.2 -0.235 59.3 167.4 -52.7 128.4 -31.7 3.3 4.2 18 18 A Y E -A 26 0A 28 8,-3.1 8,-3.3 -4,-0.1 2,-0.5 -0.889 38.2-104.0-134.0 169.2 -31.6 2.5 0.4 19 19 A K E -A 25 0A 124 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.842 34.9-137.3 -97.5 133.6 -29.5 3.7 -2.5 20 20 A D > - 0 0 43 4,-2.6 3,-2.3 -2,-0.5 -1,-0.1 -0.054 42.1 -78.4 -77.8-172.1 -31.3 6.1 -4.9 21 21 A T T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.708 135.5 51.6 -65.7 -18.4 -31.0 6.0 -8.7 22 22 A E T 3 S- 0 0 68 2,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.452 122.9-105.3 -96.9 0.4 -27.6 7.7 -8.4 23 23 A G S < S+ 0 0 38 -3,-2.3 2,-0.4 1,-0.3 -2,-0.1 0.583 74.6 140.0 88.4 13.1 -26.4 5.1 -5.8 24 24 A Y - 0 0 74 1,-0.1 -4,-2.6 9,-0.0 -1,-0.3 -0.771 61.1-101.2-101.6 140.5 -26.6 7.5 -2.9 25 25 A Y E +A 19 0A 32 9,-0.4 8,-3.0 11,-0.4 9,-1.3 -0.248 55.1 159.8 -59.0 129.3 -27.9 6.6 0.6 26 26 A T E -AB 18 32A 3 -8,-3.3 -8,-3.1 6,-0.3 2,-0.3 -0.915 19.6-169.2-147.8 158.0 -31.4 7.7 1.0 27 27 A I E > + B 0 31A 0 4,-1.9 4,-2.1 -2,-0.3 2,-0.2 -0.979 51.9 4.5-147.1 163.2 -34.4 7.0 3.2 28 28 A G E 4 S-A 14 0A 0 -14,-2.8 -14,-2.2 -2,-0.3 2,-0.8 -0.446 123.3 -8.1 77.4-132.5 -38.1 7.8 3.4 29 29 A I T 4 S- 0 0 5 34,-0.5 -1,-0.2 -16,-0.2 -17,-0.1 -0.795 128.4 -51.3-106.2 78.3 -39.6 9.8 0.5 30 30 A G T 4 S+ 0 0 14 -2,-0.8 2,-1.1 -19,-0.5 -2,-0.2 0.797 82.7 162.3 58.4 34.5 -36.4 10.6 -1.4 31 31 A H E < -B 27 0A 29 -4,-2.1 -4,-1.9 -20,-0.1 -1,-0.2 -0.738 32.6-143.5 -85.9 103.5 -34.6 12.1 1.6 32 32 A L E -B 26 0A 72 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.437 19.1-175.9 -68.0 128.7 -31.0 12.1 0.4 33 33 A L - 0 0 11 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.888 58.6 -32.9 -95.0 -44.6 -28.7 11.3 3.4 34 34 A T - 0 0 32 -9,-1.3 -9,-0.4 2,-0.1 -1,-0.4 -0.956 34.5-132.2-168.9 156.0 -25.3 11.6 1.9 35 35 A K S S+ 0 0 130 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.536 75.7 114.2 -89.3 -9.5 -23.3 11.2 -1.3 36 36 A S - 0 0 39 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.336 69.0-139.2 -61.6 136.1 -20.6 9.4 0.7 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.476 76.7 103.4 -74.1 0.1 -20.2 5.7 -0.1 38 38 A D >> - 0 0 83 1,-0.2 4,-1.6 2,-0.0 3,-0.6 -0.746 59.3-160.0 -90.5 115.9 -19.9 5.0 3.6 39 39 A L H 3> S+ 0 0 63 -2,-0.7 4,-2.3 1,-0.3 -1,-0.2 0.819 93.3 57.9 -63.2 -31.1 -23.0 3.5 5.1 40 40 A N H 3> S+ 0 0 113 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.849 102.8 53.4 -68.0 -33.4 -22.0 4.6 8.6 41 41 A A H <> S+ 0 0 29 -3,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.907 110.5 47.9 -63.8 -40.5 -21.8 8.2 7.4 42 42 A A H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.887 109.8 51.7 -67.6 -41.0 -25.4 7.9 6.1 43 43 A K H X S+ 0 0 53 -4,-2.3 4,-2.3 2,-0.2 11,-0.3 0.893 108.9 51.2 -64.9 -37.1 -26.6 6.3 9.4 44 44 A S H X S+ 0 0 72 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.958 110.3 48.6 -62.7 -51.6 -25.0 9.2 11.2 45 45 A E H X S+ 0 0 69 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.859 110.5 52.9 -51.5 -42.4 -26.9 11.7 9.0 46 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.932 110.1 45.6 -61.6 -47.7 -30.1 9.8 9.5 47 47 A D H X>S+ 0 0 33 -4,-2.3 4,-2.5 1,-0.2 5,-0.9 0.894 113.8 50.5 -64.4 -37.7 -29.7 10.0 13.3 48 48 A K H <5S+ 0 0 140 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.933 112.4 47.0 -61.9 -46.9 -28.9 13.7 13.0 49 49 A A H <5S+ 0 0 40 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.857 121.8 34.6 -66.3 -37.4 -32.0 14.3 10.8 50 50 A I H <5S- 0 0 37 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.766 101.7-127.1 -91.5 -27.4 -34.4 12.4 13.0 51 51 A G T <5S+ 0 0 67 -4,-2.5 2,-0.3 1,-0.3 -3,-0.2 0.747 77.7 69.6 81.4 27.0 -32.9 13.2 16.5 52 52 A R S - 0 0 10 -2,-1.0 3,-1.1 -11,-0.3 -1,-0.2 0.681 30.8-143.9 -90.0 -21.1 -32.4 5.0 14.2 55 55 A N T 3 S- 0 0 123 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.926 74.3 -53.1 44.8 55.7 -30.0 2.2 13.2 56 56 A G T 3 S+ 0 0 7 -13,-0.2 -39,-2.1 1,-0.1 2,-0.4 0.536 120.5 96.0 69.2 13.8 -30.9 2.8 9.5 57 57 A V B < +C 16 0B 67 -3,-1.1 2,-0.3 -41,-0.2 -41,-0.2 -0.996 43.5 175.8-140.9 135.0 -34.7 2.5 10.0 58 58 A I - 0 0 4 -43,-2.5 2,-0.1 -2,-0.4 -30,-0.1 -0.851 28.4-109.0-131.4 171.4 -37.5 5.1 10.5 59 59 A T > - 0 0 67 -2,-0.3 4,-2.6 1,-0.1 5,-0.1 -0.428 34.6-104.9 -94.9 172.5 -41.3 5.1 10.7 60 60 A K H > S+ 0 0 111 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.900 121.5 53.2 -66.1 -39.3 -43.7 6.4 8.1 61 61 A D H > S+ 0 0 123 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.932 109.7 47.9 -60.4 -45.7 -44.4 9.5 10.3 62 62 A E H > S+ 0 0 39 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.909 111.0 51.5 -63.9 -40.2 -40.7 10.2 10.5 63 63 A A H X S+ 0 0 1 -4,-2.6 4,-2.3 1,-0.2 -34,-0.5 0.904 111.9 46.6 -57.9 -44.5 -40.4 9.8 6.7 64 64 A E H X S+ 0 0 69 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.826 108.1 56.8 -71.7 -30.3 -43.3 12.2 6.1 65 65 A K H X S+ 0 0 135 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.965 110.5 42.7 -62.4 -52.4 -41.8 14.6 8.6 66 66 A L H X S+ 0 0 3 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.885 112.6 55.3 -57.3 -42.0 -38.5 14.8 6.6 67 67 A F H X S+ 0 0 10 -4,-2.3 4,-3.4 2,-0.2 5,-0.3 0.952 106.6 49.3 -56.9 -52.4 -40.5 14.9 3.4 68 68 A N H X S+ 0 0 90 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.931 114.5 46.4 -48.8 -49.5 -42.5 18.0 4.6 69 69 A Q H X S+ 0 0 99 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.933 113.4 48.4 -61.6 -43.7 -39.2 19.6 5.5 70 70 A D H X S+ 0 0 37 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.910 112.5 46.8 -67.6 -44.7 -37.6 18.7 2.2 71 71 A V H X S+ 0 0 5 -4,-3.4 4,-2.3 2,-0.2 -1,-0.2 0.957 113.5 49.2 -59.7 -50.6 -40.5 20.0 0.1 72 72 A D H X S+ 0 0 93 -4,-2.5 4,-3.1 -5,-0.3 -2,-0.2 0.917 111.6 48.7 -54.6 -47.7 -40.6 23.2 2.1 73 73 A A H X S+ 0 0 59 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.839 107.8 54.6 -65.0 -36.6 -36.8 23.7 1.7 74 74 A A H X S+ 0 0 11 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.954 112.3 44.0 -57.1 -51.3 -37.0 23.1 -2.0 75 75 A V H X S+ 0 0 31 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.947 114.8 48.1 -59.5 -50.7 -39.7 25.8 -2.4 76 76 A R H X S+ 0 0 117 -4,-3.1 4,-1.1 1,-0.2 -1,-0.2 0.863 110.8 52.8 -62.9 -34.4 -37.8 28.2 -0.1 77 77 A G H X S+ 0 0 12 -4,-2.4 4,-0.7 -5,-0.2 -1,-0.2 0.903 108.3 49.2 -63.7 -43.7 -34.6 27.5 -2.1 78 78 A I H >< S+ 0 0 3 -4,-2.4 3,-1.7 1,-0.2 7,-0.5 0.968 110.0 52.4 -56.4 -51.8 -36.3 28.4 -5.4 79 79 A L H 3< S+ 0 0 57 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.714 110.0 48.4 -61.1 -24.1 -37.6 31.6 -3.8 80 80 A R H 3< S+ 0 0 184 -4,-1.1 2,-0.7 -3,-0.2 -1,-0.3 0.523 91.8 95.9 -92.1 -3.1 -34.1 32.6 -2.7 81 81 A N S+ 0 0 11 -6,-0.2 4,-2.7 -3,-0.2 5,-0.2 0.821 102.2 68.2 -89.9 -36.0 -35.2 30.5 -10.4 85 85 A K H X S+ 0 0 82 -4,-3.2 4,-3.4 -7,-0.5 5,-0.2 0.922 99.2 47.8 -56.7 -51.6 -37.6 32.8 -8.5 86 86 A P H > S+ 0 0 56 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.858 115.8 45.9 -62.8 -31.7 -38.8 34.9 -11.5 87 87 A V H > S+ 0 0 9 -4,-0.4 4,-1.0 2,-0.2 3,-0.4 0.948 114.0 47.5 -69.5 -48.1 -39.4 31.8 -13.6 88 88 A Y H >< S+ 0 0 27 -4,-2.7 3,-1.0 1,-0.2 -3,-0.2 0.922 111.4 51.1 -58.9 -44.6 -41.2 30.1 -10.8 89 89 A D H 3< S+ 0 0 69 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.809 105.5 57.1 -67.8 -23.1 -43.3 33.2 -10.0 90 90 A S H 3< S+ 0 0 36 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.727 95.3 87.6 -75.5 -20.6 -44.3 33.4 -13.7 91 91 A L S << S- 0 0 6 -3,-1.0 2,-0.1 -4,-1.0 31,-0.0 -0.386 79.2-118.4 -84.2 153.4 -45.7 29.8 -13.6 92 92 A D > - 0 0 55 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.334 43.9 -92.5 -73.4 173.1 -49.2 28.7 -12.7 93 93 A A H > S+ 0 0 72 1,-0.2 4,-1.4 2,-0.2 -2,-0.1 0.847 122.7 50.2 -64.0 -41.0 -49.6 26.4 -9.7 94 94 A V H > S+ 0 0 29 2,-0.2 4,-1.3 1,-0.2 3,-0.5 0.949 113.2 45.6 -63.9 -49.2 -49.4 23.0 -11.5 95 95 A R H > S+ 0 0 25 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.850 106.3 61.2 -63.6 -33.8 -46.2 24.0 -13.4 96 96 A R H X S+ 0 0 79 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.868 100.7 55.2 -55.2 -37.6 -44.8 25.3 -10.1 97 97 A C H X S+ 0 0 18 -4,-1.4 4,-2.8 -3,-0.5 -1,-0.2 0.908 104.4 52.4 -63.4 -41.6 -45.1 21.7 -8.8 98 98 A A H X S+ 0 0 0 -4,-1.3 4,-2.5 2,-0.2 -2,-0.2 0.904 109.4 50.2 -56.3 -42.3 -43.0 20.5 -11.8 99 99 A A H X S+ 0 0 15 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.903 111.4 47.4 -64.9 -42.4 -40.4 23.1 -10.8 100 100 A I H X S+ 0 0 8 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.902 111.0 52.3 -65.5 -42.1 -40.4 21.9 -7.2 101 101 A N H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.957 109.7 48.5 -57.4 -49.1 -40.2 18.3 -8.3 102 102 A Q H X S+ 0 0 5 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.941 114.4 44.9 -60.7 -45.7 -37.2 19.0 -10.5 103 103 A V H X S+ 0 0 12 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.908 110.2 55.2 -64.7 -43.4 -35.4 20.9 -7.7 104 104 A F H < S+ 0 0 32 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.918 115.8 38.7 -50.7 -49.7 -36.2 18.2 -5.2 105 105 A Q H < S+ 0 0 49 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.930 133.9 18.7 -70.4 -49.4 -34.6 15.6 -7.4 106 106 A M H X S- 0 0 42 -4,-3.1 4,-0.6 -5,-0.2 -3,-0.2 0.548 97.3-130.6-108.0 -5.0 -31.6 17.5 -8.8 107 107 A G H X - 0 0 28 -4,-3.0 4,-1.7 -5,-0.3 3,-0.2 0.110 38.9 -73.6 73.0 165.2 -31.1 20.4 -6.4 108 108 A E H 4 S+ 0 0 69 2,-0.2 4,-0.5 1,-0.2 -1,-0.1 0.887 133.8 57.9 -58.7 -41.3 -30.6 24.0 -7.4 109 109 A T H >4 S+ 0 0 129 1,-0.2 3,-0.6 2,-0.2 4,-0.3 0.862 108.4 49.7 -56.9 -34.4 -27.0 23.3 -8.7 110 110 A G H >< S+ 0 0 23 -4,-0.6 3,-1.2 1,-0.2 -1,-0.2 0.912 105.3 53.3 -67.5 -45.1 -28.7 20.8 -10.9 111 111 A V G >< S+ 0 0 3 -4,-1.7 3,-0.6 1,-0.3 -1,-0.2 0.428 90.7 82.8 -77.2 4.6 -31.4 23.1 -12.3 112 112 A A G X S+ 0 0 57 -3,-0.6 3,-0.8 -4,-0.5 -1,-0.3 0.758 81.4 59.3 -80.2 -33.0 -28.5 25.5 -13.2 113 113 A G G < S+ 0 0 71 -3,-1.2 3,-0.4 -4,-0.3 -1,-0.2 0.530 91.5 77.8 -69.6 -2.7 -27.8 23.7 -16.5 114 114 A F G <> + 0 0 20 -3,-0.6 4,-3.2 1,-0.2 -1,-0.2 0.140 51.2 123.3-101.6 24.7 -31.4 24.5 -17.4 115 115 A T H <> S+ 0 0 83 -3,-0.8 4,-2.3 1,-0.2 -1,-0.2 0.872 77.8 45.6 -46.9 -51.9 -30.9 28.2 -18.3 116 116 A N H > S+ 0 0 80 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.894 114.2 47.3 -64.9 -42.2 -32.4 27.7 -21.8 117 117 A S H > S+ 0 0 1 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.907 110.9 53.8 -63.5 -43.0 -35.4 25.7 -20.6 118 118 A L H X S+ 0 0 23 -4,-3.2 4,-2.9 1,-0.2 -2,-0.2 0.907 107.3 49.4 -57.9 -47.3 -36.0 28.3 -17.8 119 119 A R H X S+ 0 0 117 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.934 112.9 47.7 -56.9 -45.6 -36.1 31.1 -20.4 120 120 A M H <>S+ 0 0 30 -4,-1.9 5,-2.8 2,-0.2 4,-0.4 0.892 111.8 49.9 -66.6 -37.6 -38.6 29.1 -22.5 121 121 A L H ><5S+ 0 0 4 -4,-2.8 3,-1.4 2,-0.2 -1,-0.2 0.936 110.2 50.0 -62.7 -48.4 -40.7 28.3 -19.5 122 122 A Q H 3<5S+ 0 0 93 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.886 111.6 49.3 -55.3 -39.6 -40.7 32.0 -18.5 123 123 A Q T 3<5S- 0 0 79 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.548 111.6-125.7 -77.3 -7.3 -41.8 32.8 -22.1 124 124 A K T < 5 + 0 0 95 -3,-1.4 2,-1.5 -4,-0.4 -3,-0.2 0.793 60.4 147.7 61.8 31.6 -44.5 30.1 -21.8 125 125 A R >< + 0 0 120 -5,-2.8 4,-2.7 1,-0.2 -1,-0.2 -0.642 22.3 173.9 -88.3 74.1 -43.2 28.4 -25.0 126 126 A W H > + 0 0 48 -2,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.797 67.1 45.1 -62.5 -41.2 -44.3 25.2 -23.5 127 127 A D H > S+ 0 0 115 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.932 116.6 47.4 -72.8 -41.7 -43.6 22.7 -26.4 128 128 A E H > S+ 0 0 106 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.905 111.8 50.6 -59.4 -43.7 -40.2 24.3 -27.0 129 129 A A H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 -1,-0.2 0.938 110.2 50.0 -58.6 -47.9 -39.4 24.1 -23.2 130 130 A A H X S+ 0 0 7 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.895 110.2 49.6 -61.8 -43.6 -40.4 20.5 -23.1 131 131 A V H X S+ 0 0 86 -4,-2.3 4,-0.5 1,-0.2 3,-0.3 0.953 114.6 45.3 -57.6 -46.7 -38.2 19.6 -26.1 132 132 A N H >< S+ 0 0 37 -4,-2.7 3,-1.3 1,-0.2 -2,-0.2 0.895 107.3 58.8 -67.4 -37.2 -35.2 21.4 -24.4 133 133 A L H 3< S+ 0 0 1 -4,-3.0 6,-0.4 1,-0.3 -1,-0.2 0.859 101.7 54.4 -59.1 -40.9 -35.9 19.8 -21.0 134 134 A A H 3< S+ 0 0 30 -4,-1.6 2,-1.9 -3,-0.3 -1,-0.3 0.602 85.9 84.3 -71.4 -16.1 -35.5 16.3 -22.4 135 135 A K S << S+ 0 0 161 -3,-1.3 2,-0.3 -4,-0.5 -1,-0.2 -0.535 81.1 98.9 -82.9 67.6 -32.0 17.2 -23.9 136 136 A S S > S- 0 0 17 -2,-1.9 4,-2.2 1,-0.1 5,-0.2 -0.994 86.1-119.1-156.9 152.1 -30.5 16.4 -20.5 137 137 A R H > S+ 0 0 143 -2,-0.3 4,-2.9 1,-0.2 5,-0.4 0.929 116.2 61.9 -57.0 -47.1 -28.6 13.9 -18.4 138 138 A W H > S+ 0 0 13 1,-0.2 4,-2.4 2,-0.2 8,-0.2 0.923 106.6 41.1 -39.1 -59.4 -31.7 14.2 -16.2 139 139 A Y H 4 S+ 0 0 53 -6,-0.4 -1,-0.2 1,-0.2 7,-0.2 0.923 116.5 48.6 -62.5 -46.3 -34.0 12.9 -18.8 140 140 A N H < S+ 0 0 110 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.831 115.7 43.2 -66.8 -32.4 -31.6 10.1 -20.0 141 141 A Q H < S+ 0 0 109 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.828 133.2 19.2 -82.6 -35.2 -30.9 8.9 -16.5 142 142 A T S X S+ 0 0 17 -4,-2.4 4,-2.8 -5,-0.4 -1,-0.2 -0.602 75.4 158.9-132.5 71.6 -34.5 9.0 -15.2 143 143 A P H > S+ 0 0 47 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.856 70.9 50.4 -68.6 -38.1 -36.6 9.1 -18.4 144 144 A D H > S+ 0 0 111 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.945 117.8 40.2 -66.7 -46.0 -40.0 7.8 -17.0 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.2 1,-0.2 3,-0.4 0.942 115.8 50.3 -62.3 -51.4 -39.9 10.3 -14.2 146 146 A A H X S+ 0 0 0 -4,-2.8 4,-3.3 1,-0.2 5,-0.3 0.907 107.4 54.9 -58.6 -40.3 -38.5 13.2 -16.4 147 147 A K H X S+ 0 0 90 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.875 108.8 48.9 -57.8 -38.9 -41.3 12.5 -19.0 148 148 A R H X S+ 0 0 69 -4,-1.3 4,-1.7 -3,-0.4 12,-0.2 0.944 114.7 43.3 -63.9 -47.3 -43.9 12.9 -16.2 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.931 115.2 49.6 -68.0 -45.0 -42.4 16.2 -14.9 150 150 A I H X S+ 0 0 7 -4,-3.3 4,-3.0 2,-0.2 -1,-0.2 0.879 108.1 52.7 -59.9 -43.2 -41.9 17.5 -18.5 151 151 A T H X S+ 0 0 28 -4,-2.3 4,-2.3 -5,-0.3 6,-0.4 0.891 108.7 52.0 -57.2 -37.8 -45.5 16.7 -19.4 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.919 112.3 44.4 -65.7 -44.3 -46.5 18.7 -16.3 153 153 A F H < S+ 0 0 3 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.868 115.2 49.4 -63.5 -40.0 -44.4 21.6 -17.5 154 154 A R H < S+ 0 0 85 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.879 127.3 19.6 -67.3 -39.3 -45.7 21.3 -21.1 155 155 A T H < S- 0 0 51 -4,-2.3 -3,-0.2 2,-0.2 -2,-0.2 0.631 83.5-134.4-109.6 -20.8 -49.5 21.1 -20.2 156 156 A G S < S+ 0 0 17 -4,-2.2 2,-0.3 -5,-0.3 -62,-0.2 0.801 73.8 109.4 59.1 28.9 -49.9 22.5 -16.7 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.800 79.1-123.4-122.2 170.2 -52.2 19.5 -16.1 158 158 A W >> + 0 0 59 -2,-0.3 3,-2.4 1,-0.2 4,-0.5 0.112 69.9 124.9 -99.4 20.7 -51.7 16.4 -13.9 159 159 A D G >4 + 0 0 122 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.820 69.3 55.2 -47.5 -39.2 -52.2 14.1 -16.9 160 160 A A G 34 S+ 0 0 29 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.625 105.2 53.5 -76.3 -9.8 -48.9 12.4 -16.3 161 161 A Y G <4 0 0 3 -3,-2.4 -1,-0.2 -13,-0.1 -2,-0.2 0.397 360.0 360.0-111.1 2.0 -49.9 11.5 -12.7 162 162 A K << 0 0 210 -3,-1.0 -2,-0.1 -4,-0.5 -3,-0.1 0.910 360.0 360.0 71.7 360.0 -53.2 9.8 -13.5