==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-NOV-06 2NTH . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR Z.GUO,D.CASCIO,K.HIDEG,W.L.HUBBELL . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9087.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 68.9 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 7.3 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 1.2 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 . 10 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 50.0 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 0 1 2 1 0 0 1 1 1 0 0 0 0 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 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 75 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 147.2 -9.9 13.7 72.1 2 2 A N > - 0 0 70 156,-0.0 4,-2.3 95,-0.0 5,-0.2 -0.906 360.0 -81.2-155.3 176.2 -10.8 17.0 73.8 3 3 A I H > S+ 0 0 24 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.841 126.0 52.5 -57.8 -35.8 -9.1 20.4 74.3 4 4 A F H > S+ 0 0 76 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.943 112.6 42.7 -66.5 -47.0 -6.9 19.1 77.2 5 5 A E H > S+ 0 0 99 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.880 114.6 53.2 -65.4 -35.2 -5.5 16.1 75.3 6 6 A M H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.952 112.9 40.7 -64.9 -53.4 -5.1 18.3 72.2 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 5,-0.4 0.847 110.3 59.1 -66.7 -32.9 -3.0 21.0 74.0 8 8 A R H X S+ 0 0 102 -4,-2.2 4,-1.8 -5,-0.2 -1,-0.2 0.897 108.9 45.9 -61.7 -37.9 -1.1 18.3 76.0 9 9 A I H < S+ 0 0 57 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.947 117.5 43.0 -68.0 -46.8 0.0 16.9 72.6 10 10 A D H < S+ 0 0 20 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.826 123.9 33.6 -70.6 -32.2 0.9 20.3 71.2 11 11 A E H < S- 0 0 39 -4,-3.1 19,-0.5 1,-0.2 -1,-0.2 0.691 91.9-152.1 -98.7 -21.7 2.6 21.7 74.3 12 12 A G < - 0 0 23 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.2 -0.201 23.1 -89.1 75.7-173.5 4.3 18.7 75.9 13 13 A L + 0 0 44 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.930 44.3 166.6-143.6 116.7 5.0 18.3 79.6 14 14 A R E -A 28 0A 141 14,-1.8 14,-2.5 -2,-0.4 4,-0.1 -0.999 21.0-161.0-133.1 132.1 8.1 19.5 81.3 15 15 A L E S+ 0 0 66 -2,-0.4 43,-2.8 12,-0.2 2,-0.3 0.463 73.5 62.0 -93.9 -2.2 8.6 19.8 85.0 16 16 A K E S-C 57 0B 107 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.914 100.9 -86.3-122.5 148.6 11.5 22.1 85.1 17 17 A I E + 0 0 19 39,-2.0 2,-0.3 -2,-0.3 10,-0.2 -0.277 59.5 164.5 -52.3 133.1 11.7 25.6 83.7 18 18 A Y E -A 26 0A 28 8,-2.7 8,-3.2 -4,-0.1 2,-0.5 -0.900 39.3 -97.3-144.9 170.2 12.6 25.5 80.0 19 19 A K E -A 25 0A 129 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.847 35.4-142.3 -99.2 131.4 12.5 27.9 77.0 20 20 A D > - 0 0 45 4,-2.7 3,-1.4 -2,-0.5 -1,-0.1 0.109 43.6 -74.2 -75.1-167.5 9.6 27.7 74.6 21 21 A T T 3 S+ 0 0 106 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.757 134.4 48.0 -64.4 -23.3 9.7 28.1 70.9 22 22 A E T 3 S- 0 0 70 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.413 122.3-102.0 -95.4 -1.7 10.2 31.8 71.2 23 23 A G S < S+ 0 0 39 -3,-1.4 2,-0.3 1,-0.3 -2,-0.1 0.548 76.6 140.2 92.7 7.9 13.0 31.6 73.8 24 24 A Y - 0 0 76 1,-0.1 -4,-2.7 -5,-0.0 -1,-0.3 -0.680 61.1-103.1 -91.8 138.9 10.7 32.4 76.8 25 25 A Y E +AB 19 34A 34 9,-0.5 8,-2.6 11,-0.5 9,-1.2 -0.368 55.0 160.3 -59.9 130.9 10.8 30.7 80.2 26 26 A T E -AB 18 32A 2 -8,-3.2 -8,-2.7 6,-0.3 2,-0.3 -0.862 18.4-169.9-145.1 168.0 8.0 28.2 80.4 27 27 A I E > + B 0 31A 0 4,-1.5 4,-2.1 -2,-0.3 -12,-0.2 -0.982 50.2 5.7-159.4 164.2 7.1 25.2 82.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.8 -2,-0.3 2,-0.9 -0.368 122.5 -7.3 64.9-128.4 4.6 22.3 82.7 29 29 A I T 4 S- 0 0 6 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.2 -0.702 128.0 -50.5-105.5 77.9 2.2 22.1 79.8 30 30 A G T 4 S+ 0 0 13 -2,-0.9 2,-1.1 -19,-0.5 -2,-0.2 0.764 83.9 160.6 68.3 23.5 2.9 25.3 77.9 31 31 A H E < -B 27 0A 30 -4,-2.1 -4,-1.5 -20,-0.1 2,-0.3 -0.693 31.4-147.1 -84.0 102.3 2.6 27.6 80.9 32 32 A L E -B 26 0A 73 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.487 16.4-175.2 -66.8 127.9 4.5 30.8 79.9 33 33 A L E - 0 0 12 -8,-2.6 2,-0.3 1,-0.4 -7,-0.2 0.894 58.3 -33.2 -92.5 -45.8 6.1 32.3 82.9 34 34 A T E -B 25 0A 27 -9,-1.2 -9,-0.5 2,-0.1 -1,-0.4 -0.971 34.9-131.2-170.0 156.8 7.6 35.5 81.6 35 35 A K S S+ 0 0 135 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.435 74.3 118.8 -93.9 -1.7 9.0 37.1 78.4 36 36 A S - 0 0 36 1,-0.1 -11,-0.5 2,-0.1 -2,-0.1 -0.307 67.7-137.1 -64.3 143.9 11.8 38.4 80.7 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.599 78.0 99.4 -76.9 -12.8 15.4 37.2 79.9 38 38 A S > - 0 0 46 1,-0.2 4,-1.9 2,-0.0 3,-0.1 -0.683 59.2-160.7 -84.2 120.5 16.0 36.8 83.6 39 39 A L H > S+ 0 0 70 -2,-0.6 4,-2.6 1,-0.2 5,-0.2 0.854 96.0 56.9 -63.9 -34.8 15.7 33.3 85.0 40 40 A N H > S+ 0 0 124 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.875 104.7 50.9 -64.6 -35.4 15.3 34.8 88.5 41 41 A A H > S+ 0 0 32 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.921 111.0 49.4 -66.0 -42.0 12.3 36.7 87.2 42 42 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.877 109.3 51.1 -63.7 -39.8 10.9 33.5 85.8 43 43 A K H X S+ 0 0 44 -4,-2.6 4,-2.8 2,-0.2 11,-0.3 0.869 108.6 52.2 -66.7 -35.6 11.5 31.6 89.1 44 44 A S H X S+ 0 0 74 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.925 109.2 49.0 -66.0 -43.7 9.6 34.4 90.9 45 45 A E H X S+ 0 0 64 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.910 112.9 49.2 -60.6 -40.8 6.7 34.1 88.5 46 46 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.946 109.7 49.1 -63.9 -49.3 6.7 30.3 89.1 47 47 A D H X>S+ 0 0 40 -4,-2.8 4,-2.6 1,-0.2 5,-1.2 0.904 113.8 47.8 -57.0 -41.7 6.8 30.6 92.9 48 48 A K H <5S+ 0 0 142 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.882 111.9 50.0 -66.0 -39.4 3.9 33.0 92.7 49 49 A A H <5S+ 0 0 39 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.889 120.1 34.7 -67.7 -40.0 2.0 30.8 90.4 50 50 A I H <5S- 0 0 35 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.737 103.6-125.5 -86.7 -30.1 2.4 27.7 92.5 51 51 A G T <5S+ 0 0 68 -4,-2.6 2,-0.3 -5,-0.3 -3,-0.2 0.770 77.0 74.2 89.3 25.3 2.3 29.3 95.9 52 52 A R S - 0 0 14 -2,-1.1 3,-0.8 -11,-0.3 -1,-0.2 0.753 35.2-146.9 -94.7 -32.1 10.1 26.0 94.0 55 55 A N T 3 S- 0 0 104 1,-0.2 -2,-0.1 -12,-0.2 -11,-0.1 0.964 75.1 -49.7 54.6 52.8 13.5 27.0 92.6 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-2.0 1,-0.1 2,-0.4 0.372 114.4 95.9 75.2 0.9 12.4 25.9 89.1 57 57 A V B < +C 16 0B 73 -3,-0.8 2,-0.3 -41,-0.2 -41,-0.2 -0.984 42.9 176.6-128.6 133.7 10.9 22.4 89.5 58 58 A I - 0 0 5 -43,-2.8 2,-0.2 -2,-0.4 -30,-0.1 -0.772 28.2-106.6-126.9 172.6 7.3 21.4 89.9 59 59 A T > - 0 0 69 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.480 32.0-109.9 -93.2 168.6 5.3 18.2 90.2 60 60 A K H > S+ 0 0 113 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.901 120.7 54.0 -64.4 -39.5 3.1 16.7 87.5 61 61 A D H > S+ 0 0 121 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.910 109.6 47.8 -60.6 -42.1 0.0 17.5 89.7 62 62 A E H > S+ 0 0 40 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.904 110.0 52.0 -66.2 -40.7 1.2 21.2 89.8 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -34,-0.4 0.920 110.6 48.4 -61.9 -41.0 1.8 21.3 86.1 64 64 A E H X S+ 0 0 78 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.834 107.7 55.7 -69.8 -29.1 -1.8 20.0 85.5 65 65 A K H X S+ 0 0 131 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.944 109.3 45.0 -68.3 -45.4 -3.2 22.6 87.9 66 66 A L H X S+ 0 0 2 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.905 112.3 54.5 -63.1 -37.1 -1.6 25.4 86.0 67 67 A F H X S+ 0 0 11 -4,-2.1 4,-2.6 -5,-0.2 5,-0.2 0.929 106.6 49.1 -61.5 -46.3 -2.9 23.8 82.8 68 68 A N H X S+ 0 0 90 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.932 114.1 47.5 -58.4 -45.6 -6.5 23.6 84.1 69 69 A Q H X S+ 0 0 92 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.906 112.1 49.6 -62.7 -42.2 -6.2 27.3 85.0 70 70 A D H X S+ 0 0 35 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.879 111.7 46.6 -67.1 -38.5 -4.7 28.2 81.6 71 71 A V H X S+ 0 0 6 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.942 114.2 48.8 -68.8 -44.7 -7.4 26.4 79.6 72 72 A D H X S+ 0 0 100 -4,-2.4 4,-2.8 -5,-0.2 5,-0.3 0.942 111.7 50.4 -57.8 -47.4 -10.1 28.0 81.7 73 73 A A H X S+ 0 0 56 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.854 108.2 51.8 -61.5 -35.2 -8.4 31.4 81.2 74 74 A A H X S+ 0 0 3 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.922 111.8 47.1 -68.2 -42.9 -8.3 31.0 77.5 75 75 A V H X S+ 0 0 30 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.934 114.2 45.5 -64.7 -45.6 -12.0 30.1 77.3 76 76 A R H X S+ 0 0 120 -4,-2.8 4,-1.4 1,-0.2 -1,-0.2 0.861 110.3 55.6 -67.6 -31.2 -12.9 33.1 79.6 77 77 A G H X S+ 0 0 12 -4,-2.1 4,-0.5 -5,-0.3 -1,-0.2 0.869 108.4 48.6 -65.7 -37.7 -10.6 35.3 77.5 78 78 A I H >< S+ 0 0 0 -4,-1.9 3,-1.0 1,-0.2 7,-0.5 0.933 111.0 49.2 -66.4 -46.9 -12.5 34.3 74.4 79 79 A L H 3< S+ 0 0 61 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.754 111.3 50.0 -68.8 -20.6 -15.9 34.9 75.9 80 80 A R H 3< S+ 0 0 192 -4,-1.4 2,-0.7 -5,-0.2 -1,-0.2 0.503 91.6 89.6 -92.4 -7.2 -14.8 38.4 77.2 81 81 A N S+ 0 0 169 2,-0.1 4,-0.6 1,-0.1 -1,-0.2 0.873 116.9 37.7 -85.0 -41.2 -14.4 40.0 68.6 84 84 A L H > S+ 0 0 23 -7,-0.2 4,-2.7 -6,-0.2 3,-0.4 0.849 101.5 70.4 -81.7 -36.4 -13.8 36.4 69.5 85 85 A K H X S+ 0 0 86 -4,-2.7 4,-3.1 -7,-0.5 5,-0.2 0.918 98.1 49.4 -50.3 -51.0 -17.0 35.5 71.2 86 86 A P H > S+ 0 0 54 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.881 113.0 48.2 -57.6 -36.5 -19.2 35.6 68.1 87 87 A V H X S+ 0 0 2 -4,-0.6 4,-0.8 -3,-0.4 3,-0.4 0.956 112.8 47.3 -68.1 -47.9 -16.7 33.4 66.3 88 88 A Y H >< S+ 0 0 36 -4,-2.7 3,-1.3 1,-0.2 -1,-0.2 0.938 111.0 52.2 -57.6 -47.9 -16.5 30.9 69.1 89 89 A D H 3< S+ 0 0 74 -4,-3.1 -1,-0.2 -5,-0.3 -2,-0.2 0.819 106.0 55.4 -59.4 -29.9 -20.3 30.9 69.4 90 90 A S H 3< S+ 0 0 38 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.661 96.2 88.2 -78.0 -16.0 -20.6 30.1 65.7 91 91 A L S << S- 0 0 8 -3,-1.3 2,-0.1 -4,-0.8 31,-0.0 -0.449 75.4-120.0 -89.5 156.8 -18.4 27.0 65.9 92 92 A D > - 0 0 56 -2,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.364 46.1 -93.5 -78.7 168.5 -19.0 23.3 66.6 93 93 A A H > S+ 0 0 76 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.799 122.4 51.3 -58.2 -36.1 -17.2 21.8 69.6 94 94 A V H > S+ 0 0 27 2,-0.2 4,-1.4 1,-0.2 3,-0.2 0.943 113.2 44.0 -70.0 -46.4 -14.2 20.5 67.6 95 95 A R H > S+ 0 0 25 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.834 107.7 60.4 -68.0 -29.6 -13.5 23.8 65.9 96 96 A R H X S+ 0 0 76 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.894 102.7 52.5 -62.2 -38.1 -14.0 25.6 69.2 97 97 A A H X S+ 0 0 6 -4,-1.4 4,-2.8 -3,-0.2 -1,-0.2 0.891 106.0 53.7 -64.6 -37.9 -11.1 23.6 70.6 98 98 A A H X S+ 0 0 0 -4,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.906 109.5 48.0 -63.0 -39.0 -9.0 24.7 67.7 99 99 A L H X S+ 0 0 7 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.910 110.8 49.8 -68.4 -41.3 -9.8 28.3 68.6 100 100 A I H X S+ 0 0 8 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.923 108.2 55.8 -61.7 -40.2 -9.0 27.8 72.3 101 101 A N H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.933 108.1 46.8 -57.1 -49.3 -5.7 26.2 71.2 102 102 A M H X S+ 0 0 15 -4,-2.0 4,-2.7 1,-0.2 5,-0.4 0.920 113.8 48.0 -60.0 -44.0 -4.8 29.3 69.2 103 103 A V H X S+ 0 0 8 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.900 109.5 53.1 -65.2 -38.2 -5.7 31.6 72.2 104 104 A F H < S+ 0 0 30 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.938 114.8 42.4 -61.3 -43.8 -3.8 29.4 74.6 105 105 A Q H < S+ 0 0 52 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.903 133.5 14.5 -73.4 -41.9 -0.7 29.7 72.4 106 106 A M H < S- 0 0 55 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.530 101.2-121.0-115.9 -3.3 -0.7 33.4 71.5 107 107 A G < - 0 0 21 -4,-2.6 -1,-0.2 -5,-0.4 -3,-0.1 -0.017 12.3-110.9 85.1 165.4 -3.2 35.1 73.8 108 108 A E S > S+ 0 0 61 1,-0.1 3,-1.0 -4,-0.1 2,-0.3 0.817 102.3 64.8 -94.9 -49.6 -6.4 37.0 73.1 109 109 A T T 3 S+ 0 0 120 1,-0.2 3,-0.1 -6,-0.1 -1,-0.1 -0.535 109.4 16.6 -76.2 132.9 -4.9 40.3 74.2 110 110 A G T 3 S+ 0 0 82 -2,-0.3 2,-0.7 1,-0.2 -1,-0.2 0.579 85.7 139.2 83.2 9.0 -2.0 41.7 72.2 111 111 A V < - 0 0 51 -3,-1.0 2,-0.3 2,-0.0 -1,-0.2 -0.803 39.6-152.1 -93.3 118.1 -2.7 39.4 69.2 112 112 A A - 0 0 86 -2,-0.7 2,-0.1 -3,-0.1 -3,-0.0 -0.670 52.1 -7.6 -91.4 141.4 -2.2 41.3 65.9 113 113 A G + 0 0 56 -2,-0.3 23,-0.0 1,-0.1 -2,-0.0 -0.278 67.8 115.5 77.1-163.2 -4.1 40.4 62.7 114 114 A F > + 0 0 51 18,-0.1 4,-2.8 -2,-0.1 5,-0.2 0.452 43.4 121.5 75.9 4.7 -6.3 37.3 62.0 115 115 A T H > S+ 0 0 106 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.920 78.8 44.6 -61.2 -44.7 -9.4 39.5 61.6 116 116 A N H > S+ 0 0 89 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.876 111.9 52.7 -68.3 -37.9 -9.9 38.1 58.1 117 117 A S H > S+ 0 0 4 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.941 110.7 47.5 -62.2 -46.5 -9.2 34.5 59.3 118 118 A C H X S+ 0 0 27 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.900 109.9 52.9 -62.6 -40.1 -11.8 34.9 62.0 119 119 A R H X S+ 0 0 101 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.911 109.8 48.6 -62.4 -41.1 -14.3 36.4 59.5 120 120 A M H <>S+ 0 0 27 -4,-2.2 5,-2.4 2,-0.2 4,-0.4 0.852 110.4 50.9 -68.9 -32.6 -13.8 33.4 57.2 121 121 A L H ><5S+ 0 0 2 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.920 109.3 50.2 -69.6 -40.7 -14.3 30.9 60.1 122 122 A Q H 3<5S+ 0 0 96 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.807 110.6 50.4 -66.1 -28.2 -17.5 32.6 61.1 123 123 A Q T 3<5S- 0 0 83 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.521 111.6-126.2 -84.5 -7.7 -18.6 32.4 57.5 124 124 A K T < 5 + 0 0 96 -3,-1.2 2,-1.1 -4,-0.4 -3,-0.2 0.858 59.5 147.2 62.8 38.6 -17.7 28.7 57.5 125 125 A R >< + 0 0 122 -5,-2.4 4,-2.8 1,-0.2 5,-0.2 -0.682 21.5 174.6-101.2 73.1 -15.5 28.9 54.5 126 126 A W H > + 0 0 47 -2,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.834 69.4 45.4 -52.6 -48.0 -13.2 26.2 55.9 127 127 A D H > S+ 0 0 110 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.925 116.8 45.5 -66.6 -42.4 -10.8 25.8 53.0 128 128 A E H > S+ 0 0 106 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.877 113.1 50.5 -67.8 -38.0 -10.4 29.5 52.5 129 129 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 -9,-0.2 5,-0.2 0.918 108.2 53.7 -64.1 -44.2 -9.9 30.1 56.2 130 130 A A H X S+ 0 0 10 -4,-2.3 4,-1.0 -5,-0.2 -2,-0.2 0.898 110.3 45.9 -58.1 -43.4 -7.3 27.4 56.3 131 131 A V H < S+ 0 0 86 -4,-1.9 3,-0.4 1,-0.2 4,-0.4 0.927 114.1 49.3 -66.2 -42.6 -5.3 29.0 53.6 132 132 A N H >< S+ 0 0 35 -4,-2.3 3,-1.2 1,-0.2 -2,-0.2 0.866 105.3 56.2 -65.2 -39.1 -5.6 32.4 55.2 133 133 A L H 3< S+ 0 0 2 -4,-2.7 6,-0.4 1,-0.3 -1,-0.2 0.788 101.0 60.7 -63.7 -29.3 -4.5 31.2 58.7 134 134 A A T 3< S+ 0 0 27 -4,-1.0 2,-1.6 -3,-0.4 -1,-0.3 0.600 82.2 81.3 -75.8 -13.3 -1.3 29.9 57.1 135 135 A K S < S+ 0 0 158 -3,-1.2 2,-0.3 -4,-0.4 -1,-0.2 -0.497 81.9 100.8 -89.9 66.8 -0.2 33.3 55.9 136 136 A S S > S- 0 0 18 -2,-1.6 4,-2.4 1,-0.1 5,-0.2 -0.986 84.6-120.4-151.8 155.7 1.1 34.2 59.4 137 137 A R H > S+ 0 0 143 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.917 115.9 61.7 -60.1 -39.5 4.1 34.4 61.6 138 138 A W H > S+ 0 0 18 1,-0.2 4,-2.2 2,-0.2 8,-0.2 0.935 107.2 40.6 -50.7 -54.6 2.3 31.8 63.7 139 139 A Y H 4 S+ 0 0 57 -6,-0.4 -1,-0.2 1,-0.2 7,-0.2 0.923 115.9 50.9 -62.9 -44.4 2.3 29.2 60.9 140 140 A N H < S+ 0 0 111 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.893 114.1 42.6 -63.9 -39.2 5.8 30.0 59.8 141 141 A Q H < S+ 0 0 104 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.854 132.3 20.1 -77.2 -35.8 7.3 29.7 63.3 142 142 A T S X S+ 0 0 19 -4,-2.2 4,-2.8 -5,-0.3 -1,-0.2 -0.567 73.9 160.2-132.4 72.4 5.4 26.6 64.4 143 143 A P H > S+ 0 0 50 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.856 70.4 52.1 -65.2 -36.9 4.3 24.9 61.2 144 144 A N H > S+ 0 0 112 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.948 116.8 40.5 -67.5 -44.3 3.7 21.4 62.4 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.926 115.4 50.3 -67.2 -45.7 1.5 22.6 65.2 146 146 A A H X S+ 0 0 0 -4,-2.8 4,-3.3 1,-0.2 5,-0.2 0.912 108.2 54.6 -59.2 -39.2 -0.2 25.3 63.1 147 147 A K H X S+ 0 0 99 -4,-2.6 4,-2.8 -5,-0.2 -1,-0.2 0.904 108.9 48.0 -60.7 -42.3 -0.9 22.6 60.4 148 148 A R H X S+ 0 0 50 -4,-1.7 4,-1.8 2,-0.2 12,-0.2 0.944 114.7 45.0 -64.7 -45.7 -2.7 20.4 63.0 149 149 A V H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.908 114.8 48.2 -64.9 -41.6 -4.8 23.3 64.3 150 150 A I H X S+ 0 0 14 -4,-3.3 4,-3.0 -5,-0.2 -2,-0.2 0.911 109.2 52.7 -66.1 -41.1 -5.6 24.5 60.8 151 151 A T H X S+ 0 0 38 -4,-2.8 4,-2.5 -5,-0.2 6,-0.4 0.862 107.8 53.2 -61.3 -33.6 -6.6 20.9 59.7 152 152 A T H X S+ 0 0 0 -4,-1.8 4,-2.3 -5,-0.2 -1,-0.2 0.912 112.0 44.0 -68.5 -40.4 -8.9 20.9 62.8 153 153 A F H < S+ 0 0 0 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.876 115.0 49.6 -68.2 -40.0 -10.5 24.1 61.6 154 154 A R H < S+ 0 0 106 -4,-3.0 -2,-0.2 1,-0.1 -1,-0.2 0.900 126.1 23.1 -67.5 -41.1 -10.7 22.9 58.0 155 155 A T H < S- 0 0 39 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.703 84.6-135.5-101.4 -24.1 -12.3 19.5 58.7 156 156 A G S < S+ 0 0 18 -4,-2.3 2,-0.3 -5,-0.4 -62,-0.2 0.762 74.3 106.5 70.5 19.9 -14.0 19.8 62.1 157 157 A T S S- 0 0 45 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.807 79.4-123.8-123.9 168.7 -12.4 16.4 62.9 158 158 A W S >> S+ 0 0 34 -2,-0.3 3,-2.3 1,-0.2 4,-0.8 0.157 70.0 123.6 -97.4 17.4 -9.6 15.3 65.2 159 159 A D G >4 + 0 0 102 1,-0.3 3,-0.5 2,-0.2 -1,-0.2 0.791 67.9 57.4 -49.8 -34.7 -7.7 13.6 62.2 160 160 A A G 34 S+ 0 0 21 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.672 111.9 41.7 -74.0 -14.5 -4.6 15.7 62.8 161 161 A Y G X4 S+ 0 0 3 -3,-2.3 3,-0.6 -13,-0.1 2,-0.4 0.412 91.5 100.5-110.4 -3.6 -4.3 14.4 66.4 162 162 A K T << S+ 0 0 125 -4,-0.8 0, 0.0 -3,-0.5 0, 0.0 -0.705 95.2 8.7 -89.1 137.6 -5.2 10.8 65.9 163 163 A N T 3 0 0 180 -2,-0.4 -1,-0.2 1,-0.1 -4,-0.0 0.468 360.0 360.0 73.8 2.1 -2.3 8.3 65.7 164 164 A L < 0 0 120 -3,-0.6 -1,-0.1 0, 0.0 -2,-0.0 -0.500 360.0 360.0-107.4 360.0 -0.3 11.3 66.8