==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-JUL-06 2HUL . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR D.R.BANATAO,D.CASCIO,T.O.YEATES . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8788.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 73.2 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 . 7 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 51.2 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 2 1 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 76 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 146.3 -7.5 2.9 24.5 2 2 A N > - 0 0 80 95,-0.0 4,-2.7 156,-0.0 5,-0.2 -0.892 360.0 -71.9-159.9-176.4 -4.0 3.5 23.4 3 3 A I H > S+ 0 0 20 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.835 126.8 52.4 -58.5 -39.0 -0.5 2.0 23.6 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.960 113.1 42.0 -65.8 -48.6 -0.1 2.9 27.3 5 5 A E H > S+ 0 0 89 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.886 114.2 54.0 -64.4 -40.9 -3.4 1.4 28.4 6 6 A M H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.933 111.9 43.1 -54.7 -52.7 -2.7 -1.7 26.2 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 5,-0.4 0.856 107.5 59.1 -68.7 -33.0 0.7 -2.3 27.8 8 8 A R H X S+ 0 0 96 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.929 110.5 44.8 -58.7 -41.6 -0.6 -1.7 31.4 9 9 A I H < S+ 0 0 42 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.937 117.7 42.7 -66.3 -47.8 -3.0 -4.6 30.7 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.813 127.5 28.8 -71.5 -30.1 -0.3 -6.8 29.1 11 11 A E H < S- 0 0 34 -4,-3.0 19,-0.4 -5,-0.1 -3,-0.2 0.703 89.8-153.9-103.0 -26.7 2.5 -6.1 31.6 12 12 A G < - 0 0 33 -4,-2.1 2,-0.4 -5,-0.4 18,-0.3 -0.014 26.2 -86.4 65.6 179.3 0.7 -5.3 34.9 13 13 A L + 0 0 89 16,-0.2 2,-0.3 17,-0.1 16,-0.2 -0.987 44.3 167.2-127.5 127.3 2.3 -3.0 37.6 14 14 A R E -A 28 0A 115 14,-1.5 14,-1.7 -2,-0.4 4,-0.1 -0.985 23.1-160.6-132.5 146.3 4.7 -4.1 40.4 15 15 A L E S+ 0 0 51 -2,-0.3 43,-3.0 12,-0.2 2,-0.3 0.412 77.9 59.2-105.0 -0.6 6.8 -1.8 42.6 16 16 A K E S-C 57 0B 119 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.926 99.7 -87.5-124.6 151.0 9.2 -4.6 43.6 17 17 A I E + 0 0 30 39,-1.3 2,-0.3 -2,-0.3 10,-0.2 -0.323 55.0 167.8 -57.4 133.4 11.5 -6.8 41.5 18 18 A Y E -A 26 0A 47 8,-2.5 8,-3.1 6,-0.1 2,-0.5 -0.946 35.3-110.5-139.7 164.0 9.7 -10.0 40.4 19 19 A K E -A 25 0A 121 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.855 29.0-136.5 -98.7 133.9 10.4 -12.7 37.9 20 20 A D > - 0 0 43 4,-2.6 3,-1.8 -2,-0.5 -1,-0.0 -0.087 40.1 -86.7 -70.2 179.3 8.3 -12.9 34.7 21 21 A T T 3 S+ 0 0 130 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.618 131.5 53.0 -69.4 -11.2 6.9 -16.2 33.4 22 22 A E T 3 S- 0 0 73 2,-0.1 -1,-0.3 120,-0.0 120,-0.0 0.387 123.8-104.9-100.0 -0.4 10.1 -16.8 31.5 23 23 A G S < S+ 0 0 33 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.429 72.7 141.4 96.0 2.2 12.1 -16.3 34.7 24 24 A Y - 0 0 68 -5,-0.1 -4,-2.6 1,-0.1 -1,-0.3 -0.599 56.7-112.4 -87.5 138.5 13.5 -12.8 33.9 25 25 A Y E +AB 19 34A 23 9,-0.7 8,-2.6 11,-0.4 9,-1.0 -0.444 48.0 166.8 -69.9 128.3 13.8 -10.1 36.6 26 26 A T E -AB 18 32A 5 -8,-3.1 -8,-2.5 6,-0.2 2,-0.3 -0.893 14.6-178.5-140.2 157.7 11.3 -7.3 35.8 27 27 A I E > + B 0 31A 0 4,-1.8 4,-2.2 -2,-0.3 -12,-0.2 -0.976 51.9 9.3-150.6 167.3 9.9 -4.3 37.7 28 28 A G E 4 S-A 14 0A 0 -14,-1.7 -14,-1.5 -2,-0.3 2,-0.9 -0.423 124.1 -14.6 69.9-135.3 7.3 -1.4 37.1 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -16,-0.2 -0.794 128.6 -45.6-106.7 83.8 5.3 -1.9 33.9 30 30 A G T 4 S+ 0 0 11 -2,-0.9 2,-0.9 -19,-0.4 -2,-0.2 0.733 84.3 160.8 67.2 25.3 7.2 -4.5 32.1 31 31 A H E < -B 27 0A 30 -4,-2.2 -4,-1.8 -20,-0.1 2,-0.4 -0.701 32.2-145.7 -80.8 107.2 10.7 -3.0 32.6 32 32 A L E -B 26 0A 74 -2,-0.9 -6,-0.2 -6,-0.2 3,-0.1 -0.595 16.7-174.7 -74.6 122.7 13.1 -5.9 32.0 33 33 A L E - 0 0 13 -8,-2.6 2,-0.3 -2,-0.4 -1,-0.2 0.887 61.3 -31.1 -85.7 -45.6 16.1 -5.5 34.4 34 34 A T E -B 25 0A 28 -9,-1.0 -9,-0.7 2,-0.1 -1,-0.4 -0.956 35.4-136.5-166.0 155.4 18.3 -8.3 33.1 35 35 A K S S+ 0 0 132 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.466 74.8 112.9 -96.0 -2.0 18.1 -11.7 31.6 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.356 75.2-130.0 -60.9 143.1 20.8 -12.9 34.0 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.504 77.5 109.5 -72.3 3.3 19.7 -15.4 36.6 38 38 A S > - 0 0 46 1,-0.2 4,-2.2 2,-0.0 -2,-0.1 -0.688 52.7-166.6 -93.2 118.6 21.3 -13.1 39.2 39 39 A L H > S+ 0 0 70 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.864 95.8 56.4 -64.1 -38.8 19.1 -11.2 41.7 40 40 A N H > S+ 0 0 122 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.903 105.8 50.3 -61.2 -39.1 22.2 -9.2 42.6 41 41 A A H > S+ 0 0 33 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.944 112.0 48.1 -58.5 -48.8 22.6 -8.2 38.9 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.913 109.8 52.0 -58.4 -43.6 18.9 -7.2 38.8 43 43 A K H X S+ 0 0 85 -4,-2.7 4,-2.1 1,-0.2 11,-0.2 0.924 112.3 46.0 -62.5 -43.3 19.2 -5.1 42.0 44 44 A C H X S+ 0 0 80 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.921 110.6 52.0 -65.8 -43.8 22.2 -3.2 40.6 45 45 A E H X S+ 0 0 79 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.893 108.7 52.8 -59.6 -37.0 20.4 -2.6 37.2 46 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 5,-0.3 0.955 107.8 49.4 -62.1 -50.6 17.4 -1.2 39.1 47 47 A D H X>S+ 0 0 46 -4,-2.1 4,-2.4 1,-0.2 5,-0.7 0.891 113.1 48.4 -56.0 -40.6 19.6 1.2 41.0 48 48 A K H <5S+ 0 0 153 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.910 111.2 49.0 -64.3 -44.9 21.2 2.3 37.7 49 49 A A H <5S+ 0 0 30 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.858 121.5 34.6 -64.9 -35.2 17.8 2.7 36.0 50 50 A I H <5S- 0 0 21 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.752 100.6-126.2 -94.2 -29.0 16.4 4.8 38.8 51 51 A G T <5S+ 0 0 69 -4,-2.4 2,-0.3 1,-0.3 -3,-0.2 0.685 77.0 68.0 85.9 20.6 19.5 6.8 40.0 52 52 A R S - 0 0 6 -2,-1.1 3,-1.5 -11,-0.2 -1,-0.2 0.644 31.6-140.1 -85.4 -18.5 16.3 1.5 45.8 55 55 A N T 3 S- 0 0 139 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.869 72.4 -59.5 55.1 35.9 16.7 -1.6 47.9 56 56 A G T 3 S+ 0 0 10 -13,-0.2 -39,-1.3 1,-0.1 2,-0.4 0.489 117.9 101.4 76.1 7.6 14.5 -3.4 45.3 57 57 A V B < -C 16 0B 66 -3,-1.5 2,-0.2 -41,-0.2 -41,-0.2 -0.986 47.0-173.6-129.1 130.4 11.5 -1.1 45.7 58 58 A I - 0 0 6 -43,-3.0 2,-0.2 -2,-0.4 -30,-0.1 -0.714 22.4-111.5-116.1 168.3 10.3 1.8 43.5 59 59 A T > - 0 0 66 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.517 30.7-108.8 -90.6 162.4 7.6 4.5 43.7 60 60 A K H > S+ 0 0 157 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.923 121.1 49.0 -55.9 -44.0 4.6 4.9 41.5 61 61 A D H > S+ 0 0 133 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.879 108.8 53.3 -68.0 -34.2 6.1 7.9 39.7 62 62 A E H > S+ 0 0 39 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.938 107.9 51.0 -63.9 -44.8 9.3 6.1 39.2 63 63 A A H X S+ 0 0 1 -4,-2.5 4,-2.1 1,-0.2 -34,-0.4 0.908 110.6 49.5 -56.5 -43.6 7.4 3.2 37.5 64 64 A E H X S+ 0 0 68 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.876 109.4 51.1 -65.0 -39.9 5.6 5.8 35.2 65 65 A K H X S+ 0 0 98 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.938 111.1 47.4 -64.5 -44.9 8.9 7.4 34.2 66 66 A L H X S+ 0 0 2 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.907 112.4 51.1 -60.5 -39.7 10.5 4.1 33.3 67 67 A F H X S+ 0 0 2 -4,-2.1 4,-2.5 -5,-0.2 5,-0.3 0.923 109.1 49.7 -66.7 -43.4 7.3 3.2 31.3 68 68 A N H X S+ 0 0 103 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.935 114.0 46.2 -57.7 -45.6 7.4 6.5 29.4 69 69 A Q H X S+ 0 0 88 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.855 112.3 50.8 -64.1 -37.6 11.1 5.9 28.6 70 70 A D H X S+ 0 0 37 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.866 110.4 47.2 -75.2 -39.0 10.5 2.3 27.5 71 71 A V H X S+ 0 0 7 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.916 114.0 49.1 -65.9 -41.1 7.6 3.1 25.2 72 72 A D H X S+ 0 0 101 -4,-2.1 4,-3.1 -5,-0.3 -2,-0.2 0.908 108.3 53.7 -65.9 -39.1 9.7 5.9 23.7 73 73 A A H X S+ 0 0 54 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.877 108.2 50.5 -59.5 -40.2 12.7 3.5 23.3 74 74 A A H X S+ 0 0 5 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.920 112.5 45.5 -64.4 -46.0 10.4 1.1 21.4 75 75 A V H X S+ 0 0 28 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.925 113.1 51.0 -62.4 -44.3 9.2 3.9 19.0 76 76 A R H X S+ 0 0 141 -4,-3.1 4,-1.5 1,-0.2 -2,-0.2 0.897 110.2 50.2 -57.1 -42.7 12.8 5.1 18.6 77 77 A G H < S+ 0 0 4 -4,-2.2 4,-0.5 -5,-0.2 -1,-0.2 0.861 110.9 48.2 -65.9 -39.4 13.8 1.5 17.7 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-1.0 1,-0.2 7,-0.5 0.920 110.5 51.8 -62.7 -44.7 11.0 1.2 15.1 79 79 A L H 3< S+ 0 0 78 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.779 110.6 47.3 -69.8 -26.8 11.9 4.5 13.5 80 80 A R T 3< S+ 0 0 139 -4,-1.5 2,-0.5 -5,-0.2 -1,-0.3 0.510 95.6 89.2 -87.2 -9.2 15.6 3.6 13.1 81 81 A N <> - 0 0 25 -3,-1.0 4,-2.7 -4,-0.5 3,-0.4 -0.810 65.1-150.3-105.4 125.6 15.0 0.2 11.6 82 82 A A T 4 S+ 0 0 90 -2,-0.5 -1,-0.1 1,-0.2 -4,-0.0 0.712 99.2 45.4 -64.7 -22.2 14.7 -0.3 7.8 83 83 A K T 4 S+ 0 0 92 2,-0.1 4,-0.4 3,-0.1 -1,-0.2 0.740 119.2 39.6 -91.1 -24.1 12.4 -3.3 8.3 84 84 A L T > S+ 0 0 0 -3,-0.4 4,-2.8 -6,-0.2 3,-0.2 0.875 104.4 62.9 -92.7 -42.4 10.1 -1.8 11.0 85 85 A K H X S+ 0 0 86 -4,-2.7 4,-3.1 -7,-0.5 5,-0.2 0.895 102.0 49.3 -53.1 -49.4 9.7 1.8 9.8 86 86 A P H > S+ 0 0 49 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.874 114.5 46.8 -60.5 -37.2 7.9 1.1 6.5 87 87 A V H >> S+ 0 0 2 -4,-0.4 4,-1.1 -3,-0.2 3,-0.5 0.959 113.4 47.3 -66.9 -52.4 5.5 -1.2 8.3 88 88 A Y H >< S+ 0 0 40 -4,-2.8 3,-0.8 1,-0.2 -3,-0.2 0.926 110.9 52.3 -51.2 -49.5 4.9 1.3 11.1 89 89 A D H 3< S+ 0 0 91 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.805 109.4 50.2 -58.9 -32.8 4.3 4.1 8.6 90 90 A S H << S+ 0 0 38 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.651 95.2 92.3 -80.5 -21.4 1.7 2.1 6.7 91 91 A L S << S- 0 0 5 -4,-1.1 31,-0.0 -3,-0.8 2,-0.0 -0.479 74.8-119.1 -84.3 148.9 -0.4 1.1 9.7 92 92 A D > - 0 0 57 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.213 43.5 -93.2 -69.7 171.1 -3.4 2.8 11.2 93 93 A A H > S+ 0 0 66 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.836 124.0 49.5 -63.4 -38.3 -3.2 4.1 14.9 94 94 A V H > S+ 0 0 26 2,-0.2 4,-1.4 62,-0.2 3,-0.4 0.957 113.8 44.7 -66.1 -51.9 -4.6 1.0 16.5 95 95 A R H > S+ 0 0 26 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.834 106.7 60.6 -64.1 -30.5 -2.3 -1.4 14.6 96 96 A R H X S+ 0 0 81 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.899 101.7 54.1 -60.9 -36.2 0.7 0.8 15.3 97 97 A A H X S+ 0 0 6 -4,-1.4 4,-2.6 -3,-0.4 -2,-0.2 0.902 105.5 52.6 -63.4 -40.6 0.0 0.2 19.0 98 98 A A H X S+ 0 0 0 -4,-1.4 4,-2.2 1,-0.2 -1,-0.2 0.930 110.9 47.8 -61.8 -41.0 0.2 -3.6 18.4 99 99 A L H X S+ 0 0 1 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.906 111.5 48.1 -64.2 -45.8 3.6 -3.1 16.7 100 100 A I H X S+ 0 0 13 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.909 108.6 57.0 -59.6 -40.8 4.9 -0.9 19.5 101 101 A N H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.951 107.5 47.1 -54.9 -53.3 3.7 -3.5 22.0 102 102 A M H X S+ 0 0 4 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.898 114.7 45.5 -56.0 -43.4 5.7 -6.2 20.2 103 103 A V H X S+ 0 0 5 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.880 108.7 56.3 -71.6 -35.7 8.9 -4.0 20.1 104 104 A F H < S+ 0 0 27 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.936 116.9 37.7 -57.7 -43.4 8.4 -3.0 23.8 105 105 A Q H < S+ 0 0 43 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.950 133.0 19.2 -73.0 -52.4 8.4 -6.7 24.7 106 106 A M H X S- 0 0 49 -4,-2.8 4,-0.5 -5,-0.2 -3,-0.2 0.560 102.4-119.7-105.4 -12.6 11.0 -8.2 22.4 107 107 A G H X - 0 0 30 -4,-2.2 4,-2.2 -5,-0.3 5,-0.3 0.007 33.8 -73.4 87.6 161.3 13.2 -5.3 21.2 108 108 A E H > S+ 0 0 38 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.930 129.1 48.0 -57.4 -51.9 13.9 -3.8 17.7 109 109 A T H > S+ 0 0 123 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.912 112.2 50.3 -58.5 -47.4 16.2 -6.7 16.6 110 110 A G H >< S+ 0 0 35 -4,-0.5 3,-0.8 1,-0.2 -1,-0.2 0.927 114.4 41.0 -56.8 -54.1 13.8 -9.4 17.7 111 111 A V H >< S+ 0 0 0 -4,-2.2 3,-1.9 1,-0.2 -1,-0.2 0.856 107.1 62.9 -69.4 -34.9 10.7 -7.9 16.0 112 112 A A H 3< S+ 0 0 9 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.743 94.5 65.6 -60.6 -19.9 12.7 -7.0 12.8 113 113 A G T << S+ 0 0 53 -4,-0.8 2,-1.9 -3,-0.8 -1,-0.3 0.558 73.3 90.3 -77.2 -9.4 13.3 -10.8 12.5 114 114 A F <> + 0 0 36 -3,-1.9 4,-2.8 1,-0.2 5,-0.3 -0.377 55.9 162.2 -81.4 59.0 9.6 -11.5 11.8 115 115 A T H > + 0 0 68 -2,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.867 66.9 38.7 -52.7 -51.5 10.3 -11.0 8.1 116 116 A N H > S+ 0 0 79 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.896 116.0 50.6 -71.8 -40.7 7.2 -12.7 6.6 117 117 A S H > S+ 0 0 4 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.927 110.1 51.1 -63.6 -42.8 4.7 -11.4 9.2 118 118 A L H X S+ 0 0 8 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.894 109.5 50.8 -57.3 -42.7 6.0 -7.8 8.7 119 119 A R H X S+ 0 0 104 -4,-1.7 4,-2.3 -5,-0.3 -2,-0.2 0.927 109.5 50.5 -61.7 -45.2 5.6 -8.1 5.0 120 120 A M H <>S+ 0 0 19 -4,-2.2 5,-3.0 1,-0.2 4,-0.3 0.871 110.0 49.5 -62.4 -40.1 2.0 -9.4 5.4 121 121 A L H ><5S+ 0 0 3 -4,-2.1 3,-1.0 3,-0.2 -1,-0.2 0.908 110.3 50.4 -66.0 -41.4 1.1 -6.5 7.7 122 122 A Q H 3<5S+ 0 0 92 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.904 111.9 48.4 -62.7 -37.9 2.6 -4.0 5.2 123 123 A Q T 3<5S- 0 0 95 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.489 114.6-122.6 -78.6 -4.0 0.5 -5.7 2.4 124 124 A K T < 5 + 0 0 107 -3,-1.0 2,-1.5 -4,-0.3 -3,-0.2 0.784 61.0 148.8 65.5 31.0 -2.6 -5.4 4.8 125 125 A R >< + 0 0 81 -5,-3.0 4,-2.5 1,-0.2 -1,-0.2 -0.663 17.2 170.5 -92.7 80.6 -3.1 -9.2 4.7 126 126 A W H > + 0 0 48 -2,-1.5 4,-2.4 1,-0.2 -1,-0.2 0.894 68.8 46.7 -67.2 -45.1 -4.5 -9.2 8.2 127 127 A D H > S+ 0 0 108 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.931 115.1 46.1 -64.0 -46.4 -5.8 -12.7 8.4 128 128 A E H > S+ 0 0 94 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.881 111.9 51.7 -65.7 -38.7 -2.7 -14.3 6.9 129 129 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.929 109.7 50.1 -61.3 -42.3 -0.5 -12.1 9.3 130 130 A A H X S+ 0 0 9 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.945 112.1 47.3 -63.2 -47.7 -2.5 -13.4 12.3 131 131 A V H < S+ 0 0 88 -4,-2.6 4,-0.3 1,-0.2 -1,-0.2 0.914 114.7 47.2 -54.8 -45.1 -2.1 -17.0 11.1 132 132 A N H >< S+ 0 0 44 -4,-2.5 3,-1.4 1,-0.2 4,-0.2 0.897 108.7 52.6 -68.8 -39.2 1.6 -16.5 10.6 133 133 A L H >< S+ 0 0 2 -4,-2.8 3,-1.5 1,-0.3 6,-0.4 0.836 101.3 62.1 -65.4 -31.1 2.2 -14.7 14.0 134 134 A A T 3< S+ 0 0 36 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.614 98.3 57.7 -72.0 -10.6 0.5 -17.6 15.7 135 135 A K T < S+ 0 0 159 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.458 88.3 103.1 -91.2 -5.1 3.3 -19.9 14.4 136 136 A S S X> S- 0 0 21 -3,-1.5 4,-0.6 -4,-0.2 3,-0.5 -0.329 83.1-118.3 -81.4 162.2 6.1 -17.9 16.0 137 137 A R H >> S+ 0 0 200 1,-0.2 4,-1.5 2,-0.2 3,-1.2 0.870 113.6 65.5 -62.7 -35.0 8.0 -18.7 19.2 138 138 A W H 3> S+ 0 0 3 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.861 90.5 63.7 -52.0 -42.0 6.6 -15.5 20.7 139 139 A Y H <4 S+ 0 0 58 -3,-0.5 -1,-0.3 -6,-0.4 -2,-0.2 0.773 111.7 34.9 -58.5 -34.2 3.1 -17.0 20.5 140 140 A N H << S+ 0 0 118 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.621 111.0 61.7 -93.1 -18.3 4.0 -19.7 23.1 141 141 A Q H < S+ 0 0 63 -4,-1.5 -2,-0.2 1,-0.2 -3,-0.2 0.921 129.4 7.2 -71.6 -44.2 6.5 -17.6 25.1 142 142 A T S X S+ 0 0 19 -4,-2.3 4,-2.5 -5,-0.1 -1,-0.2 -0.612 77.3 168.1-137.9 73.5 3.7 -15.1 26.1 143 143 A P H > + 0 0 44 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.784 69.6 55.0 -64.3 -34.5 0.4 -16.6 24.8 144 144 A N H > S+ 0 0 119 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.954 116.8 36.3 -68.2 -46.7 -2.1 -14.4 26.7 145 145 A R H > S+ 0 0 17 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.897 113.8 57.9 -72.0 -40.5 -0.7 -11.2 25.4 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.908 105.5 50.4 -58.2 -42.2 0.2 -12.6 22.0 147 147 A K H X S+ 0 0 90 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.920 113.2 45.7 -61.8 -42.6 -3.4 -13.6 21.3 148 148 A R H X S+ 0 0 57 -4,-1.5 4,-1.8 2,-0.2 12,-0.2 0.919 113.7 48.2 -66.1 -43.1 -4.6 -10.1 22.2 149 149 A V H X S+ 0 0 0 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.931 112.6 49.7 -63.1 -44.3 -1.9 -8.4 20.1 150 150 A I H X S+ 0 0 14 -4,-2.7 4,-3.0 -5,-0.3 -2,-0.2 0.920 108.0 52.5 -62.8 -42.4 -2.8 -10.7 17.2 151 151 A T H X S+ 0 0 41 -4,-2.3 4,-2.6 1,-0.2 6,-0.4 0.886 108.4 53.1 -56.2 -38.4 -6.5 -9.9 17.5 152 152 A T H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.927 112.3 42.6 -65.3 -46.1 -5.6 -6.2 17.4 153 153 A F H < S+ 0 0 0 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.875 115.7 50.6 -65.3 -40.5 -3.6 -6.7 14.1 154 154 A R H < S+ 0 0 112 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.919 126.7 21.1 -63.5 -44.6 -6.3 -9.0 12.7 155 155 A T H < S- 0 0 41 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.669 85.7-136.1-102.6 -22.7 -9.3 -6.6 13.4 156 156 A G S < S+ 0 0 19 -4,-2.4 2,-0.2 -5,-0.3 -62,-0.2 0.689 73.0 105.9 62.2 22.0 -7.7 -3.1 13.7 157 157 A T S S- 0 0 49 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.744 82.6-118.7-118.9 172.2 -10.0 -2.7 16.7 158 158 A W S >> S+ 0 0 60 -2,-0.2 3,-2.1 1,-0.2 4,-0.7 0.140 72.3 123.5 -92.2 16.3 -9.6 -2.7 20.5 159 159 A D G >4 + 0 0 119 1,-0.3 3,-0.8 2,-0.2 -1,-0.2 0.815 69.1 55.1 -46.7 -40.1 -11.9 -5.7 20.9 160 160 A A G 34 S+ 0 0 23 -3,-0.3 -1,-0.3 -12,-0.2 -2,-0.1 0.636 112.3 42.5 -73.3 -13.9 -9.2 -7.8 22.7 161 161 A Y G X4 S+ 0 0 1 -3,-2.1 3,-1.3 -13,-0.1 -1,-0.2 0.359 81.1 132.5-115.0 2.8 -8.7 -5.1 25.4 162 162 A K T << S- 0 0 142 -3,-0.8 -3,-0.0 -4,-0.7 0, 0.0 -0.357 84.2 -4.7 -61.2 123.7 -12.4 -4.2 26.0 163 163 A N T 3 0 0 147 -2,-0.2 -1,-0.3 1,-0.1 -2,-0.0 0.391 360.0 360.0 72.2 -1.4 -13.2 -4.1 29.7 164 164 A L < 0 0 114 -3,-1.3 -2,-0.1 0, 0.0 -1,-0.1 0.719 360.0 360.0 -77.0 360.0 -9.8 -5.3 30.8