==== 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 (O-GLYCOSYL) 01-MAY-89 1L19 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR H.NICHOLSON,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8716.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 70.7 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 . 85 51.8 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 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,-0.2 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 146.4 36.9 -23.5 9.0 2 2 A N > - 0 0 70 95,-0.0 4,-2.4 92,-0.0 3,-0.2 -0.831 360.0 -86.4-141.3 173.9 34.7 -21.0 10.9 3 3 A I H > S+ 0 0 21 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.831 123.7 52.8 -54.2 -39.6 34.4 -17.2 11.4 4 4 A F H > S+ 0 0 74 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.934 111.4 43.1 -64.3 -47.0 37.0 -17.1 14.1 5 5 A E H > S+ 0 0 88 -3,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.870 114.0 53.5 -67.2 -37.3 39.7 -19.0 12.2 6 6 A M H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.948 112.2 42.4 -62.8 -51.4 38.9 -16.9 9.1 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 5,-0.4 0.828 109.1 58.8 -66.3 -30.8 39.3 -13.6 10.9 8 8 A R H X S+ 0 0 109 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.885 107.2 48.4 -65.5 -32.8 42.3 -14.8 12.8 9 9 A I H < S+ 0 0 53 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.950 115.7 43.0 -70.9 -45.6 44.0 -15.4 9.4 10 10 A D H < S+ 0 0 19 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.799 125.3 30.2 -70.9 -32.8 43.0 -12.0 8.0 11 11 A E H < S- 0 0 33 -4,-2.3 19,-0.3 -5,-0.1 -1,-0.2 0.694 90.9-152.0-101.2 -28.5 43.8 -9.9 11.1 12 12 A G < - 0 0 19 -4,-1.7 2,-0.4 -5,-0.4 -1,-0.1 -0.181 24.5 -86.9 79.2-177.3 46.7 -11.8 12.8 13 13 A L + 0 0 42 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.986 42.3 173.9-135.4 125.8 47.4 -11.6 16.5 14 14 A R E -A 28 0A 130 14,-1.3 14,-2.3 -2,-0.4 4,-0.1 -0.999 18.0-165.0-135.7 125.9 49.5 -8.9 18.1 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.3 12,-0.2 2,-0.3 0.408 74.2 61.7 -91.0 -1.2 50.0 -8.6 21.9 16 16 A K E S-C 57 0B 107 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.925 102.0 -85.6-123.4 148.1 51.4 -5.0 21.9 17 17 A I E + 0 0 19 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.242 59.2 172.7 -51.1 135.6 49.7 -1.8 20.5 18 18 A Y E -A 26 0A 28 8,-2.8 8,-2.9 -4,-0.1 2,-0.4 -0.877 34.6-105.7-140.0 172.2 50.3 -1.6 16.8 19 19 A K E -A 25 0A 124 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.882 33.6-138.3-103.7 133.9 49.2 0.5 13.9 20 20 A D > - 0 0 49 4,-2.9 3,-2.0 -2,-0.4 -1,-0.1 -0.078 40.3 -82.2 -76.4-174.9 46.8 -1.0 11.4 21 21 A T T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.844 134.4 49.8 -61.1 -29.2 47.0 -0.7 7.6 22 22 A E T 3 S- 0 0 76 2,-0.1 -1,-0.3 1,-0.0 -3,-0.0 0.452 124.4-103.7 -86.3 -3.7 45.3 2.7 7.9 23 23 A G S < S+ 0 0 35 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.518 74.1 142.2 91.9 13.1 47.7 3.8 10.6 24 24 A Y - 0 0 81 1,-0.1 -4,-2.9 -5,-0.0 2,-0.3 -0.656 59.9-101.7 -94.2 149.4 45.3 3.4 13.5 25 25 A Y E +AB 19 34A 31 9,-0.8 8,-3.2 11,-0.3 9,-1.3 -0.476 55.0 159.9 -66.9 118.9 46.1 2.2 17.0 26 26 A T E -AB 18 32A 3 -8,-2.9 -8,-2.8 -2,-0.3 2,-0.3 -0.839 19.4-169.3-136.0 164.4 45.0 -1.5 17.3 27 27 A I E > + B 0 31A 0 4,-1.5 4,-1.9 -2,-0.3 -12,-0.2 -0.976 52.3 0.3-152.7 161.0 45.7 -4.5 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.3 -2,-0.3 2,-0.9 -0.350 123.2 -5.0 66.6-131.2 45.0 -8.2 19.6 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.658 127.4 -53.3-100.0 75.2 43.0 -9.6 16.7 30 30 A G T 4 S+ 0 0 15 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.779 83.5 159.3 66.3 27.4 42.1 -6.5 14.8 31 31 A H E < -B 27 0A 36 -4,-1.9 -4,-1.5 1,-0.0 -1,-0.2 -0.716 34.4-141.9 -85.8 104.0 40.6 -4.6 17.7 32 32 A L E -B 26 0A 68 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.369 19.4-176.0 -64.5 131.6 40.7 -0.9 16.8 33 33 A L E - 0 0 14 -8,-3.2 2,-0.3 1,-0.4 -7,-0.2 0.899 58.8 -26.1 -94.2 -49.1 41.5 1.2 19.8 34 34 A T E -B 25 0A 28 -9,-1.3 -9,-0.8 2,-0.1 -1,-0.4 -0.973 35.6-137.1-161.0 151.0 41.2 4.8 18.5 35 35 A K S S+ 0 0 140 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.484 75.6 114.8 -88.4 -2.0 41.5 6.8 15.3 36 36 A S - 0 0 40 1,-0.1 -11,-0.3 2,-0.1 6,-0.1 -0.385 69.5-137.2 -72.4 140.8 43.4 9.3 17.4 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 0.635 75.8 101.4 -71.8 -13.0 47.1 10.0 16.7 38 38 A D >> - 0 0 78 1,-0.2 4,-1.9 2,-0.1 3,-0.7 -0.669 58.0-159.9 -83.9 111.3 47.9 10.1 20.4 39 39 A L H 3> S+ 0 0 62 -2,-0.8 4,-2.0 1,-0.3 -1,-0.2 0.749 98.1 57.4 -54.1 -24.7 49.5 6.8 21.7 40 40 A N H 3> S+ 0 0 107 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.915 100.4 51.5 -76.3 -40.2 48.4 8.0 25.0 41 41 A A H <> S+ 0 0 34 -3,-0.7 4,-1.9 1,-0.2 -2,-0.2 0.897 112.0 51.6 -59.7 -35.9 44.8 8.2 23.9 42 42 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.875 106.7 50.7 -65.5 -43.8 45.3 4.5 22.7 43 43 A K H X S+ 0 0 50 -4,-2.0 4,-2.1 1,-0.2 11,-0.3 0.869 110.6 50.5 -65.3 -33.5 46.8 3.4 26.0 44 44 A S H X S+ 0 0 74 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.908 109.5 48.6 -70.2 -43.6 43.9 4.8 27.9 45 45 A E H X S+ 0 0 67 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.925 110.7 54.3 -62.8 -41.5 41.3 3.2 25.6 46 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 5,-0.3 0.938 108.1 46.2 -57.3 -50.5 43.2 -0.1 26.1 47 47 A D H X>S+ 0 0 36 -4,-2.1 4,-2.4 1,-0.2 5,-0.8 0.882 112.8 51.4 -61.4 -36.2 43.1 0.1 29.9 48 48 A K H <5S+ 0 0 145 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.887 110.9 49.0 -66.3 -40.7 39.4 1.0 29.7 49 49 A A H <5S+ 0 0 45 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.872 120.3 33.9 -68.8 -37.1 38.8 -2.0 27.4 50 50 A I H <5S- 0 0 38 -4,-2.3 -2,-0.2 2,-0.3 -1,-0.2 0.739 99.7-126.0 -92.8 -27.9 40.6 -4.6 29.6 51 51 A G T <5S+ 0 0 67 -4,-2.4 2,-0.3 1,-0.4 -3,-0.2 0.713 78.8 76.5 87.8 21.1 39.9 -3.2 33.0 52 52 A R S - 0 0 8 -2,-0.9 3,-1.3 -11,-0.3 -1,-0.2 0.710 31.6-144.7 -98.2 -22.3 48.1 -2.6 30.7 55 55 A N T 3 S- 0 0 127 1,-0.3 -2,-0.1 -12,-0.2 3,-0.1 0.922 75.1 -53.8 57.7 42.9 50.9 -0.3 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.6 1,-0.1 2,-0.4 0.552 119.2 97.1 71.7 9.2 50.2 -1.1 26.0 57 57 A V B < -C 16 0B 61 -3,-1.3 2,-0.3 -41,-0.2 -41,-0.2 -0.987 45.9-179.5-135.6 141.4 50.5 -4.8 26.4 58 58 A I - 0 0 5 -43,-2.3 2,-0.1 -2,-0.4 -30,-0.1 -0.849 25.2-111.9-131.1 165.2 47.9 -7.7 26.8 59 59 A T > - 0 0 66 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.458 34.5-104.9 -90.6 168.3 47.9 -11.4 27.2 60 60 A K H > S+ 0 0 109 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.893 121.6 53.4 -57.5 -46.1 46.6 -14.0 24.7 61 61 A D H > S+ 0 0 123 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.861 108.0 49.7 -56.3 -44.0 43.5 -14.6 26.8 62 62 A E H > S+ 0 0 36 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.892 110.3 51.4 -64.5 -40.8 42.7 -10.8 26.9 63 63 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -34,-0.4 0.880 110.9 47.7 -63.0 -42.3 43.1 -10.7 23.1 64 64 A E H X S+ 0 0 77 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.815 108.8 54.0 -69.6 -31.6 40.8 -13.6 22.6 65 65 A K H X S+ 0 0 136 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.971 109.8 46.2 -66.1 -48.8 38.3 -12.1 24.9 66 66 A L H X S+ 0 0 4 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.902 111.3 54.5 -55.6 -42.6 38.2 -8.9 23.0 67 67 A F H X S+ 0 0 11 -4,-2.1 4,-2.3 2,-0.2 5,-0.3 0.924 105.9 50.8 -59.8 -46.4 37.9 -11.0 19.8 68 68 A N H X S+ 0 0 90 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.937 112.2 48.0 -58.2 -43.7 34.8 -12.8 21.1 69 69 A Q H X S+ 0 0 96 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.909 111.2 49.8 -62.0 -43.3 33.2 -9.5 21.9 70 70 A D H X S+ 0 0 39 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.840 111.3 47.3 -64.6 -38.6 34.0 -8.0 18.6 71 71 A V H X S+ 0 0 6 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.942 113.9 49.0 -67.6 -46.4 32.6 -11.0 16.6 72 72 A D H X S+ 0 0 85 -4,-2.3 4,-2.6 -5,-0.3 5,-0.3 0.931 112.1 47.3 -56.3 -50.4 29.5 -11.0 18.7 73 73 A A H X S+ 0 0 43 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.876 110.4 53.7 -62.9 -35.9 28.9 -7.3 18.3 74 74 A A H X S+ 0 0 8 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.959 111.3 45.0 -63.7 -49.5 29.5 -7.7 14.5 75 75 A V H X S+ 0 0 33 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.942 115.1 47.1 -56.2 -50.0 26.8 -10.4 14.2 76 76 A R H X S+ 0 0 117 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.864 109.4 55.8 -61.9 -37.2 24.3 -8.4 16.4 77 77 A G H X S+ 0 0 2 -4,-2.3 4,-0.6 -5,-0.3 -1,-0.2 0.929 107.5 47.3 -62.9 -44.2 25.1 -5.3 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.1 3,-1.0 1,-0.2 7,-0.5 0.929 110.8 52.7 -61.0 -45.0 24.1 -7.1 11.1 79 79 A L H 3< S+ 0 0 70 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.766 111.8 45.3 -64.8 -25.9 21.0 -8.4 12.7 80 80 A R H 3< S+ 0 0 167 -4,-1.6 2,-0.5 -3,-0.2 -1,-0.3 0.427 92.9 95.7 -93.0 -8.8 19.9 -5.0 13.8 81 81 A N S+ 0 0 0 -6,-0.2 4,-2.5 -7,-0.2 3,-0.3 0.865 101.4 67.0 -85.0 -42.8 22.2 -5.9 6.2 85 85 A K H X S+ 0 0 83 -4,-2.6 4,-2.9 -7,-0.5 5,-0.2 0.868 99.4 50.2 -47.8 -50.0 19.8 -8.2 7.9 86 86 A P H > S+ 0 0 52 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.877 112.5 48.3 -62.4 -36.7 17.9 -9.2 4.8 87 87 A V H > S+ 0 0 2 -4,-0.4 4,-0.9 -3,-0.3 3,-0.3 0.956 112.0 48.1 -66.4 -49.6 21.1 -9.9 2.9 88 88 A Y H >< S+ 0 0 37 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.934 110.2 52.8 -54.6 -48.3 22.5 -12.0 5.8 89 89 A D H 3< S+ 0 0 74 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.839 107.3 52.4 -60.2 -32.1 19.2 -13.9 6.0 90 90 A S H 3< S+ 0 0 35 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.654 96.2 90.5 -77.7 -17.0 19.3 -14.8 2.4 91 91 A L S << S- 0 0 6 -3,-1.2 31,-0.0 -4,-0.9 30,-0.0 -0.507 74.3-118.6 -86.6 157.6 22.8 -16.2 2.4 92 92 A D > - 0 0 56 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.192 44.9 -91.4 -76.1 172.5 24.2 -19.7 3.0 93 93 A A H > S+ 0 0 75 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.866 122.1 45.4 -58.6 -42.4 26.5 -20.4 6.0 94 94 A V H > S+ 0 0 27 62,-0.2 4,-1.2 2,-0.2 3,-0.4 0.944 113.9 48.4 -68.2 -46.3 29.9 -19.8 4.3 95 95 A R H > S+ 0 0 25 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.858 103.6 61.7 -62.5 -34.7 28.8 -16.6 2.6 96 96 A R H X S+ 0 0 81 -4,-2.1 4,-2.2 1,-0.2 -1,-0.3 0.918 101.2 54.5 -56.8 -38.9 27.3 -15.4 5.8 97 97 A C H X S+ 0 0 18 -4,-1.3 4,-2.2 -3,-0.4 -1,-0.2 0.861 103.2 55.6 -62.3 -37.0 31.0 -15.6 7.2 98 98 A A H X S+ 0 0 0 -4,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.880 108.5 47.2 -62.4 -40.3 32.2 -13.4 4.3 99 99 A L H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.892 110.3 52.0 -69.2 -39.3 29.7 -10.6 5.3 100 100 A I H X S+ 0 0 7 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.924 106.8 54.3 -61.5 -41.9 30.6 -10.8 8.9 101 101 A N H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.947 108.5 48.5 -57.0 -49.8 34.3 -10.4 7.9 102 102 A M H X S+ 0 0 2 -4,-1.9 4,-3.1 1,-0.2 5,-0.3 0.899 112.1 49.0 -57.3 -43.6 33.5 -7.2 6.0 103 103 A V H X S+ 0 0 10 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.889 109.1 52.1 -65.5 -39.4 31.5 -5.8 8.9 104 104 A F H < S+ 0 0 31 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.924 117.7 39.2 -62.1 -42.6 34.3 -6.6 11.4 105 105 A Q H < S+ 0 0 58 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.906 132.8 19.1 -73.9 -47.3 36.8 -4.8 9.1 106 106 A M H X S- 0 0 51 -4,-3.1 4,-0.6 -5,-0.2 -3,-0.2 0.473 102.2-114.9-112.7 2.7 34.8 -1.8 8.0 107 107 A G H X - 0 0 34 -4,-2.1 4,-2.0 -5,-0.3 5,-0.2 0.206 35.6 -80.9 75.0 154.9 31.9 -1.4 10.4 108 108 A E H > S+ 0 0 57 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.893 127.6 53.8 -52.5 -49.7 28.1 -1.7 9.6 109 109 A T H > S+ 0 0 124 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.927 107.5 49.6 -58.7 -46.1 27.9 1.7 8.1 110 110 A G H < S+ 0 0 32 -4,-0.6 3,-0.3 1,-0.2 4,-0.2 0.902 114.1 44.0 -61.9 -44.1 30.6 1.1 5.7 111 111 A V H >< S+ 0 0 0 -4,-2.0 3,-2.5 1,-0.2 -2,-0.2 0.911 106.8 59.6 -69.2 -39.2 29.3 -2.2 4.5 112 112 A A H 3< S+ 0 0 14 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.783 95.3 67.8 -59.2 -22.4 25.7 -0.8 4.3 113 113 A G T 3< S+ 0 0 55 -4,-1.1 2,-1.4 -3,-0.3 -1,-0.3 0.628 76.5 84.2 -69.1 -17.7 27.2 1.7 1.8 114 114 A F <> + 0 0 39 -3,-2.5 4,-2.4 -4,-0.2 3,-0.3 -0.246 56.8 158.8 -85.1 52.1 27.8 -1.1 -0.7 115 115 A T H > + 0 0 92 -2,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.818 66.4 43.7 -39.8 -57.9 24.2 -0.8 -2.0 116 116 A N H > S+ 0 0 85 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.880 114.7 48.3 -64.3 -43.0 24.7 -2.4 -5.5 117 117 A S H > S+ 0 0 0 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.883 109.8 53.0 -64.0 -42.7 26.8 -5.3 -4.3 118 118 A L H X S+ 0 0 14 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.882 108.8 50.9 -59.1 -41.0 24.4 -6.1 -1.5 119 119 A R H X S+ 0 0 116 -4,-1.7 4,-1.7 -5,-0.3 -2,-0.2 0.923 110.9 48.2 -64.4 -44.4 21.5 -6.2 -4.0 120 120 A M H <>S+ 0 0 27 -4,-2.1 5,-2.5 2,-0.2 4,-0.4 0.904 110.4 50.7 -65.7 -40.7 23.5 -8.6 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.4 3,-1.9 1,-0.2 -2,-0.2 0.954 109.1 52.4 -63.0 -43.9 24.4 -10.9 -3.3 122 122 A Q H 3<5S+ 0 0 95 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.859 110.3 48.2 -58.6 -34.9 20.7 -10.9 -2.4 123 123 A Q T 3<5S- 0 0 90 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.488 113.2-121.6 -83.2 -3.8 19.9 -11.9 -5.9 124 124 A K T < 5 + 0 0 100 -3,-1.9 2,-1.1 -4,-0.4 -3,-0.2 0.801 60.8 148.3 65.4 33.6 22.5 -14.6 -5.8 125 125 A R >< + 0 0 120 -5,-2.5 4,-2.5 1,-0.2 -1,-0.2 -0.696 19.2 174.2-100.1 77.1 24.4 -13.2 -8.8 126 126 A W H > S+ 0 0 47 -2,-1.1 4,-1.8 1,-0.2 -1,-0.2 0.843 70.2 45.2 -51.6 -53.2 27.8 -14.3 -7.6 127 127 A D H > S+ 0 0 109 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.895 115.1 48.2 -63.9 -43.1 30.0 -13.4 -10.5 128 128 A E H > S+ 0 0 95 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.879 110.9 50.2 -67.3 -40.8 28.4 -10.0 -10.9 129 129 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.860 107.8 53.1 -65.0 -37.0 28.7 -9.2 -7.2 130 130 A A H X S+ 0 0 11 -4,-1.8 4,-1.1 2,-0.2 -2,-0.2 0.890 109.9 49.2 -64.1 -40.2 32.4 -10.1 -7.1 131 131 A V H < S+ 0 0 87 -4,-1.7 4,-0.4 1,-0.2 3,-0.3 0.924 113.9 45.6 -65.1 -44.0 33.1 -7.8 -10.0 132 132 A N H >< S+ 0 0 42 -4,-2.0 3,-1.1 1,-0.2 -2,-0.2 0.875 107.9 55.9 -68.4 -39.6 31.2 -4.9 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.6 6,-0.4 1,-0.2 -1,-0.2 0.841 100.3 61.4 -61.1 -32.2 32.8 -5.5 -4.8 134 134 A A T 3< S+ 0 0 27 -4,-1.1 2,-1.4 -3,-0.3 -1,-0.2 0.637 86.1 78.4 -69.9 -16.5 36.3 -5.1 -6.5 135 135 A K S < S+ 0 0 154 -3,-1.1 2,-0.3 -4,-0.4 -1,-0.2 -0.537 80.5 96.3 -92.0 66.6 35.5 -1.5 -7.5 136 136 A S S > S- 0 0 20 -2,-1.4 4,-2.0 1,-0.1 3,-0.2 -0.994 85.0-116.8-152.0 156.6 36.1 -0.1 -4.1 137 137 A R H > S+ 0 0 142 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.919 115.0 63.9 -58.3 -42.2 38.7 1.7 -2.1 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.907 105.4 43.2 -44.7 -53.7 38.5 -1.4 0.2 139 139 A Y H 4 S+ 0 0 58 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.895 114.9 49.0 -64.3 -45.0 39.8 -3.7 -2.6 140 140 A N H < S+ 0 0 110 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.859 115.6 43.2 -66.4 -34.7 42.5 -1.2 -3.7 141 141 A Q H < S+ 0 0 107 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.837 131.8 18.5 -78.9 -40.3 43.8 -0.7 -0.2 142 142 A T S X S+ 0 0 21 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.2 -0.559 73.7 162.9-131.2 68.5 43.9 -4.3 1.0 143 143 A P H > + 0 0 48 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.857 69.3 51.4 -60.5 -40.1 43.7 -6.3 -2.2 144 144 A N H > S+ 0 0 111 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.941 115.9 40.6 -66.2 -43.9 44.9 -9.8 -0.8 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.927 115.3 51.7 -66.3 -46.6 42.4 -9.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.933 108.9 52.2 -55.7 -44.5 39.6 -8.4 -0.2 147 147 A K H X S+ 0 0 91 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.887 107.1 52.1 -59.1 -41.9 40.3 -11.1 -2.8 148 148 A R H X S+ 0 0 53 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.949 113.9 43.1 -60.0 -46.1 40.0 -13.8 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.914 113.1 51.7 -66.2 -42.8 36.6 -12.4 0.9 150 150 A I H X S+ 0 0 13 -4,-3.0 4,-2.3 -5,-0.2 -1,-0.2 0.890 108.0 51.6 -59.8 -42.8 35.4 -11.9 -2.6 151 151 A T H X S+ 0 0 34 -4,-2.4 4,-2.7 1,-0.2 5,-0.4 0.855 106.9 55.4 -63.3 -35.6 36.3 -15.5 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.897 110.9 43.0 -63.7 -41.3 34.3 -16.6 -0.6 153 153 A F H < S+ 0 0 1 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.871 115.5 50.8 -72.3 -36.8 31.2 -14.8 -1.9 154 154 A R H < S+ 0 0 100 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.920 125.3 21.6 -64.2 -47.6 31.8 -15.9 -5.4 155 155 A T H < S- 0 0 45 -4,-2.7 -3,-0.2 2,-0.2 -2,-0.2 0.655 85.3-135.8 -99.2 -24.1 32.2 -19.7 -4.7 156 156 A G S < S+ 0 0 17 -4,-2.0 2,-0.2 -5,-0.4 -62,-0.2 0.746 72.6 100.3 71.4 21.1 30.5 -20.2 -1.4 157 157 A T S S- 0 0 50 -6,-0.4 3,-0.3 -5,-0.1 -1,-0.3 -0.765 81.4-115.7-128.2 176.4 33.5 -22.4 -0.3 158 158 A W S >> S+ 0 0 29 -2,-0.2 3,-1.8 1,-0.2 4,-0.6 0.135 72.1 121.9-100.3 19.5 36.6 -21.9 1.9 159 159 A D G >4 + 0 0 98 1,-0.3 3,-0.9 2,-0.2 4,-0.3 0.792 66.3 59.5 -51.3 -36.8 39.0 -22.4 -0.9 160 160 A A G 34 S+ 0 0 13 -3,-0.3 4,-0.3 1,-0.3 -1,-0.3 0.688 112.6 40.4 -69.8 -16.6 40.7 -19.0 -0.5 161 161 A Y G <4 S+ 0 0 1 -3,-1.8 -1,-0.3 2,-0.1 -2,-0.2 0.423 93.9 80.1-108.5 -3.9 41.6 -19.8 3.1 162 162 A K S << S+ 0 0 136 -3,-0.9 -2,-0.1 -4,-0.6 -3,-0.1 0.488 93.1 54.2 -86.4 -1.8 42.7 -23.5 2.6 163 163 A N 0 0 128 -4,-0.3 -1,-0.2 1,-0.1 -2,-0.1 0.885 360.0 360.0 -78.1 -60.0 45.9 -22.4 1.4 164 164 A L 0 0 119 -4,-0.3 -2,-0.2 0, 0.0 -3,-0.1 0.521 360.0 360.0 -68.3 360.0 46.7 -20.1 4.4