==== 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 1L23 . 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) . 8701.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 70.1 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 . 9 5.5 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 75 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 151.0 36.8 -23.5 9.0 2 2 A N > - 0 0 70 95,-0.0 4,-2.5 1,-0.0 3,-0.3 -0.878 360.0 -86.5-144.1 173.7 34.7 -21.0 10.9 3 3 A I H > S+ 0 0 21 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.834 124.0 52.6 -55.1 -38.1 34.4 -17.2 11.3 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.936 111.4 43.4 -65.2 -46.4 37.0 -17.1 14.1 5 5 A E H > S+ 0 0 91 -3,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.889 114.3 53.2 -66.9 -38.7 39.6 -19.0 12.2 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.952 112.8 41.6 -59.9 -55.3 38.9 -16.9 9.1 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 5,-0.4 0.820 109.5 59.3 -64.2 -31.6 39.3 -13.6 10.9 8 8 A R H X S+ 0 0 108 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.887 107.5 47.2 -65.2 -33.9 42.3 -14.9 12.7 9 9 A I H < S+ 0 0 52 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.951 115.8 44.3 -71.0 -45.6 44.0 -15.5 9.4 10 10 A D H < S+ 0 0 20 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.810 124.9 29.8 -69.5 -33.6 43.0 -12.1 8.0 11 11 A E H < S- 0 0 34 -4,-2.4 19,-0.3 -5,-0.2 -1,-0.2 0.713 91.6-152.0-100.9 -27.1 43.9 -9.9 11.0 12 12 A G < - 0 0 19 -4,-1.7 2,-0.4 -5,-0.4 -1,-0.1 -0.199 25.0 -85.8 79.9-174.9 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 42.8 174.2-134.0 125.9 47.4 -11.6 16.5 14 14 A R E -A 28 0A 130 14,-1.5 14,-2.5 -2,-0.4 4,-0.1 -0.998 17.3-166.7-135.6 127.2 49.6 -8.9 18.1 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.1 12,-0.2 2,-0.3 0.390 73.2 63.7 -92.4 -1.2 50.0 -8.6 21.8 16 16 A K E S-C 57 0B 106 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.913 101.3 -87.6-121.3 148.3 51.5 -5.1 21.8 17 17 A I E + 0 0 20 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.285 59.6 172.6 -52.1 136.6 49.7 -1.8 20.5 18 18 A Y E -A 26 0A 28 8,-2.6 8,-2.9 -4,-0.1 2,-0.5 -0.888 34.7-105.4-140.7 170.4 50.3 -1.5 16.8 19 19 A K E -A 25 0A 122 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.875 34.0-138.4-102.2 133.9 49.3 0.5 13.9 20 20 A D > - 0 0 49 4,-3.0 3,-1.9 -2,-0.5 -1,-0.1 -0.044 40.1 -82.3 -77.7-174.7 46.8 -1.0 11.4 21 21 A T T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.836 134.1 49.6 -61.9 -26.0 47.0 -0.7 7.6 22 22 A E T 3 S- 0 0 76 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.417 123.7-104.4 -88.8 -2.2 45.3 2.7 8.0 23 23 A G S < S+ 0 0 35 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.545 74.4 141.0 89.3 14.0 47.7 3.9 10.6 24 24 A Y - 0 0 79 1,-0.1 -4,-3.0 -5,-0.0 2,-0.3 -0.687 60.4-101.6 -95.7 150.0 45.4 3.5 13.5 25 25 A Y E +AB 19 34A 33 9,-0.7 8,-3.2 11,-0.4 9,-1.4 -0.478 54.5 159.8 -66.7 121.1 46.2 2.2 16.9 26 26 A T E -AB 18 32A 3 -8,-2.9 -8,-2.6 -2,-0.3 2,-0.3 -0.843 19.1-168.7-136.6 164.6 45.0 -1.5 17.3 27 27 A I E > + B 0 31A 0 4,-1.6 4,-1.9 -2,-0.3 -12,-0.2 -0.978 52.5 2.0-152.3 163.4 45.8 -4.5 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.5 -2,-0.3 2,-0.9 -0.351 123.6 -5.1 66.5-132.0 45.1 -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 -0.647 127.6 -53.8 -99.8 74.2 43.1 -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 0.775 83.3 160.2 65.5 30.2 42.3 -6.5 14.8 31 31 A H E < -B 27 0A 34 -4,-1.9 -4,-1.6 32,-0.0 -1,-0.2 -0.714 33.8-142.2 -85.1 101.4 40.7 -4.7 17.7 32 32 A L E -B 26 0A 68 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.387 19.1-175.3 -64.7 133.8 40.8 -0.9 16.8 33 33 A L E - 0 0 14 -8,-3.2 2,-0.3 1,-0.4 -7,-0.2 0.892 58.5 -26.1 -95.7 -48.6 41.5 1.2 19.8 34 34 A T E -B 25 0A 28 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.964 35.7-137.4-162.8 152.3 41.2 4.8 18.5 35 35 A K S S+ 0 0 144 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.497 75.4 114.3 -90.0 -5.5 41.5 6.8 15.3 36 36 A S S S- 0 0 39 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.335 71.6-133.0 -68.8 141.1 43.4 9.4 17.3 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.612 76.1 100.2 -72.2 -10.5 47.0 10.1 16.7 38 38 A S > - 0 0 49 1,-0.2 4,-1.8 2,-0.0 5,-0.1 -0.713 57.4-159.4 -89.7 121.5 48.0 9.9 20.3 39 39 A L H > S+ 0 0 67 -2,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.740 100.1 56.7 -61.0 -25.3 49.6 6.8 21.6 40 40 A N H > S+ 0 0 119 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.919 102.3 51.1 -74.9 -42.3 48.4 8.0 25.0 41 41 A A H > S+ 0 0 34 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.889 112.8 49.6 -60.7 -34.5 44.9 8.2 23.8 42 42 A A H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.880 107.6 50.9 -71.0 -41.9 45.4 4.6 22.7 43 43 A K H X S+ 0 0 51 -4,-2.3 4,-2.1 2,-0.2 11,-0.3 0.882 110.6 51.0 -65.9 -31.8 46.9 3.3 25.9 44 44 A S H X S+ 0 0 73 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.910 109.7 48.2 -69.2 -45.0 43.9 4.9 27.8 45 45 A E H X S+ 0 0 69 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.920 110.6 54.1 -61.7 -42.6 41.4 3.2 25.6 46 46 A L H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 5,-0.3 0.935 108.5 46.1 -56.8 -51.4 43.2 -0.1 26.0 47 47 A D H X>S+ 0 0 36 -4,-2.1 4,-2.3 1,-0.2 5,-0.8 0.866 112.4 52.4 -61.3 -36.0 43.1 0.1 29.8 48 48 A K H <5S+ 0 0 144 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.882 111.1 48.3 -65.0 -39.2 39.4 1.0 29.6 49 49 A A H <5S+ 0 0 46 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.859 120.6 33.5 -71.9 -34.9 38.8 -2.0 27.4 50 50 A I H <5S- 0 0 37 -4,-2.2 -2,-0.2 2,-0.3 -1,-0.2 0.730 99.4-126.1 -95.2 -28.7 40.6 -4.5 29.5 51 51 A G T <5S+ 0 0 68 -4,-2.3 2,-0.3 1,-0.4 -3,-0.2 0.748 78.7 77.1 85.8 24.9 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 0.671 32.0-143.7 -98.5 -21.2 48.2 -2.7 30.6 55 55 A N T 3 S- 0 0 126 1,-0.2 -2,-0.1 -12,-0.1 -11,-0.1 0.944 75.2 -52.1 56.1 47.9 50.9 -0.3 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.1 2,-0.4 0.538 120.0 95.1 68.6 7.8 50.3 -1.2 25.9 57 57 A V B < +C 16 0B 60 -3,-1.3 2,-0.3 -41,-0.2 -41,-0.2 -0.984 45.9 179.0-136.0 144.6 50.5 -4.9 26.3 58 58 A I - 0 0 5 -43,-2.1 2,-0.1 -2,-0.4 -30,-0.1 -0.866 26.6-109.1-133.5 165.1 48.0 -7.7 26.8 59 59 A T > - 0 0 68 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.412 35.1-104.8 -89.2 168.6 47.9 -11.5 27.1 60 60 A K H > S+ 0 0 108 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.919 121.7 53.3 -56.4 -47.4 46.6 -14.0 24.6 61 61 A D H > S+ 0 0 123 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.874 108.0 49.5 -53.7 -46.9 43.5 -14.6 26.7 62 62 A E H > S+ 0 0 37 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.885 110.5 51.0 -63.6 -40.3 42.7 -10.9 26.8 63 63 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -34,-0.4 0.877 110.7 49.1 -64.6 -39.8 43.1 -10.7 23.0 64 64 A E H X S+ 0 0 74 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.811 108.3 53.1 -70.2 -30.4 40.8 -13.6 22.6 65 65 A K H X S+ 0 0 138 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.967 109.5 47.0 -68.3 -47.9 38.2 -12.1 24.9 66 66 A L H X S+ 0 0 4 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.906 111.7 54.5 -55.7 -42.7 38.2 -8.8 22.9 67 67 A F H X S+ 0 0 11 -4,-2.0 4,-2.4 2,-0.2 5,-0.3 0.940 105.7 50.0 -59.0 -48.9 37.9 -11.0 19.8 68 68 A N H X S+ 0 0 91 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.949 112.9 48.4 -56.9 -43.4 34.9 -12.8 21.0 69 69 A Q H X S+ 0 0 98 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.914 111.0 49.6 -60.9 -44.6 33.2 -9.5 21.8 70 70 A D H X S+ 0 0 36 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.849 111.3 47.9 -64.0 -39.8 34.0 -8.0 18.4 71 71 A V H X S+ 0 0 6 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.949 113.9 47.8 -66.4 -48.4 32.7 -11.0 16.5 72 72 A D H X S+ 0 0 85 -4,-2.3 4,-2.5 -5,-0.3 5,-0.2 0.923 112.6 48.5 -56.1 -48.3 29.5 -11.0 18.6 73 73 A A H X S+ 0 0 40 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.880 109.3 53.2 -61.9 -38.8 29.1 -7.2 18.1 74 74 A A H X S+ 0 0 8 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.954 111.7 45.3 -62.5 -48.9 29.6 -7.6 14.3 75 75 A V H X S+ 0 0 31 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.930 113.2 50.4 -56.8 -47.5 26.9 -10.3 14.0 76 76 A R H X S+ 0 0 113 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.884 108.3 53.4 -60.5 -40.3 24.5 -8.2 16.2 77 77 A A H X S+ 0 0 10 -4,-2.5 4,-0.8 -5,-0.2 -1,-0.2 0.922 108.2 48.9 -64.3 -43.6 25.1 -5.1 14.1 78 78 A I H >< S+ 0 0 0 -4,-1.9 3,-0.7 1,-0.2 7,-0.4 0.934 111.4 50.1 -58.7 -45.0 24.2 -7.0 10.9 79 79 A L H 3< S+ 0 0 70 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.765 113.4 45.7 -66.8 -27.9 21.0 -8.3 12.6 80 80 A R H 3< S+ 0 0 170 -4,-1.8 2,-0.6 -5,-0.1 -1,-0.3 0.457 94.3 93.7 -89.2 -11.4 19.9 -4.8 13.7 81 81 A N S+ 0 0 0 -7,-0.2 4,-2.5 -6,-0.2 3,-0.3 0.846 101.3 66.1 -85.1 -40.3 22.2 -5.8 6.1 85 85 A K H X S+ 0 0 81 -4,-2.5 4,-2.8 -7,-0.4 5,-0.2 0.883 99.0 51.4 -51.5 -49.0 19.8 -8.3 7.8 86 86 A P H > S+ 0 0 50 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.878 112.2 47.5 -60.8 -38.6 17.9 -9.2 4.7 87 87 A V H > S+ 0 0 2 -4,-0.5 4,-1.0 -3,-0.3 3,-0.4 0.953 112.1 48.9 -66.7 -48.0 21.1 -10.0 2.9 88 88 A Y H >< S+ 0 0 36 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.943 109.8 52.5 -53.5 -49.6 22.5 -12.1 5.7 89 89 A D H 3< S+ 0 0 76 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.816 107.9 52.6 -60.6 -30.2 19.2 -14.0 6.0 90 90 A S H 3< S+ 0 0 34 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.656 95.7 88.2 -79.8 -17.7 19.4 -14.8 2.4 91 91 A L S << S- 0 0 6 -3,-1.2 31,-0.0 -4,-1.0 2,-0.0 -0.508 75.1-116.9 -85.5 157.4 22.9 -16.2 2.4 92 92 A D > - 0 0 55 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.218 44.6 -90.8 -76.2 173.6 24.2 -19.8 3.0 93 93 A A H > S+ 0 0 76 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.843 122.7 46.4 -57.8 -41.4 26.6 -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 0.939 113.7 47.1 -67.5 -47.3 29.9 -19.8 4.2 95 95 A R H > S+ 0 0 25 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.845 103.8 62.6 -63.8 -33.3 28.8 -16.6 2.5 96 96 A R H X S+ 0 0 81 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.913 100.9 54.4 -57.5 -39.8 27.4 -15.4 5.9 97 97 A C H X S+ 0 0 18 -4,-1.2 4,-2.2 -3,-0.4 -1,-0.2 0.861 103.1 55.7 -61.3 -38.5 31.0 -15.6 7.1 98 98 A A H X S+ 0 0 0 -4,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.878 109.3 45.9 -62.4 -39.1 32.2 -13.4 4.3 99 99 A L H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.887 110.1 53.1 -71.3 -39.4 29.7 -10.6 5.2 100 100 A I H X S+ 0 0 8 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.936 106.8 53.5 -62.1 -40.3 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 0.938 108.4 49.2 -58.2 -46.6 34.3 -10.4 7.9 102 102 A M H X S+ 0 0 3 -4,-1.8 4,-3.3 1,-0.2 5,-0.3 0.912 111.9 48.8 -58.6 -44.7 33.5 -7.2 5.9 103 103 A V H X S+ 0 0 8 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.894 109.9 51.3 -63.7 -40.6 31.5 -5.7 8.9 104 104 A F H < S+ 0 0 32 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.911 118.1 39.2 -63.3 -40.6 34.3 -6.6 11.3 105 105 A Q H < S+ 0 0 56 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.924 132.6 18.8 -76.7 -48.5 36.8 -4.8 9.1 106 106 A M H X S- 0 0 52 -4,-3.3 4,-0.5 -5,-0.2 -3,-0.2 0.528 102.6-114.0-109.7 -3.3 34.9 -1.8 7.9 107 107 A G H X - 0 0 31 -4,-2.2 4,-2.2 -5,-0.3 5,-0.2 0.178 33.6 -81.4 82.5 152.8 32.0 -1.3 10.2 108 108 A E H > S+ 0 0 54 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.867 128.0 51.9 -51.5 -49.1 28.2 -1.6 9.6 109 109 A T H > S+ 0 0 117 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.945 108.7 49.3 -59.9 -49.0 28.0 1.8 8.1 110 110 A G H < S+ 0 0 33 -4,-0.5 3,-0.4 1,-0.2 4,-0.3 0.901 115.0 43.7 -58.5 -46.2 30.8 1.1 5.7 111 111 A V H >< S+ 0 0 0 -4,-2.2 3,-2.6 1,-0.2 -2,-0.2 0.930 106.4 59.3 -68.8 -42.1 29.3 -2.2 4.5 112 112 A A H 3< S+ 0 0 13 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.774 95.5 68.1 -58.3 -22.2 25.8 -0.9 4.3 113 113 A G T 3< S+ 0 0 55 -4,-1.1 2,-1.6 -3,-0.4 -1,-0.3 0.643 75.6 84.8 -69.6 -16.7 27.2 1.7 1.8 114 114 A F <> + 0 0 39 -3,-2.6 4,-2.3 -4,-0.3 3,-0.3 -0.239 56.4 158.3 -84.3 52.5 27.9 -1.1 -0.8 115 115 A T H > + 0 0 93 -2,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.841 66.3 44.2 -40.2 -58.4 24.3 -0.8 -2.0 116 116 A N H > S+ 0 0 89 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.885 114.5 48.2 -63.1 -42.6 24.7 -2.4 -5.5 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.854 109.7 53.9 -65.8 -37.2 26.8 -5.3 -4.3 118 118 A L H X S+ 0 0 14 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.913 108.1 49.9 -62.6 -43.1 24.4 -6.1 -1.5 119 119 A R H X S+ 0 0 113 -4,-1.8 4,-1.7 -5,-0.2 -2,-0.2 0.915 111.8 48.3 -62.9 -42.9 21.5 -6.2 -4.1 120 120 A M H <>S+ 0 0 28 -4,-2.0 5,-2.5 2,-0.2 4,-0.3 0.907 110.3 50.6 -66.3 -41.0 23.5 -8.6 -6.3 121 121 A L H ><5S+ 0 0 1 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.944 110.0 51.3 -63.2 -43.3 24.4 -10.9 -3.3 122 122 A Q H 3<5S+ 0 0 95 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.862 110.2 48.7 -61.0 -33.9 20.7 -11.0 -2.3 123 123 A Q T 3<5S- 0 0 89 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.448 113.6-121.6 -84.0 -1.2 19.8 -12.0 -5.9 124 124 A K T < 5 + 0 0 97 -3,-1.9 2,-1.2 -4,-0.3 -3,-0.2 0.766 61.2 147.6 64.6 32.4 22.5 -14.7 -5.8 125 125 A R >< + 0 0 118 -5,-2.5 4,-2.3 1,-0.2 -1,-0.2 -0.728 19.8 174.6-100.4 80.8 24.4 -13.2 -8.8 126 126 A W H > + 0 0 49 -2,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.868 69.8 45.9 -55.8 -51.2 27.8 -14.4 -7.5 127 127 A D H > S+ 0 0 110 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.888 114.7 48.3 -63.9 -40.7 30.0 -13.4 -10.4 128 128 A E H > S+ 0 0 95 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.898 110.8 50.3 -68.3 -40.4 28.5 -10.0 -10.9 129 129 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.863 107.0 54.1 -64.6 -37.6 28.7 -9.2 -7.2 130 130 A A H X S+ 0 0 11 -4,-1.8 4,-1.1 1,-0.2 -1,-0.2 0.895 110.1 47.9 -63.7 -39.1 32.5 -10.2 -7.1 131 131 A V H < S+ 0 0 89 -4,-1.7 4,-0.5 2,-0.2 -1,-0.2 0.903 113.8 46.8 -67.5 -42.3 33.2 -7.8 -9.9 132 132 A N H >< S+ 0 0 43 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.893 107.7 55.7 -68.1 -39.3 31.2 -5.0 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.8 6,-0.3 1,-0.2 -1,-0.2 0.843 100.3 61.3 -61.3 -33.0 32.8 -5.6 -4.9 134 134 A A T 3< S+ 0 0 27 -4,-1.1 2,-1.5 1,-0.2 -1,-0.2 0.646 85.3 78.7 -70.7 -16.1 36.3 -5.1 -6.5 135 135 A K S < S+ 0 0 156 -3,-1.2 2,-0.3 -4,-0.5 -1,-0.2 -0.529 79.5 95.4 -92.1 68.6 35.6 -1.6 -7.6 136 136 A S S > S- 0 0 20 -2,-1.5 4,-2.0 1,-0.1 3,-0.2 -0.987 85.2-114.6-151.7 159.4 36.1 -0.1 -4.2 137 137 A R H > S+ 0 0 144 -2,-0.3 4,-3.3 1,-0.2 5,-0.3 0.915 115.5 64.0 -59.8 -41.2 38.8 1.7 -2.1 138 138 A W H > S+ 0 0 17 1,-0.2 4,-2.2 2,-0.2 8,-0.2 0.890 105.7 42.7 -45.5 -51.7 38.6 -1.5 0.2 139 139 A Y H 4 S+ 0 0 57 -6,-0.3 -1,-0.2 -3,-0.2 -2,-0.2 0.885 115.6 48.9 -66.5 -45.4 39.9 -3.7 -2.6 140 140 A N H < S+ 0 0 109 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.880 115.8 43.5 -66.2 -35.1 42.5 -1.2 -3.8 141 141 A Q H < S+ 0 0 107 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.846 131.6 17.7 -79.1 -39.4 43.8 -0.7 -0.2 142 142 A T S X S+ 0 0 21 -4,-2.2 4,-2.4 -5,-0.3 -1,-0.2 -0.543 73.8 163.9-132.5 67.6 43.9 -4.4 1.1 143 143 A P H > + 0 0 49 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.838 69.4 51.4 -58.3 -40.5 43.8 -6.4 -2.1 144 144 A N H > S+ 0 0 114 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.909 116.0 41.3 -67.6 -41.0 44.9 -9.8 -0.8 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.909 115.0 51.2 -69.0 -45.3 42.4 -9.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.934 109.1 52.1 -57.4 -45.4 39.6 -8.4 -0.3 147 147 A K H X S+ 0 0 92 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.870 107.3 52.6 -58.9 -41.1 40.3 -11.2 -2.9 148 148 A R H X S+ 0 0 52 -4,-1.5 4,-1.5 -5,-0.2 12,-0.2 0.955 114.2 41.9 -59.6 -48.1 40.0 -13.8 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.912 114.2 51.2 -64.4 -45.2 36.6 -12.4 0.9 150 150 A I H X S+ 0 0 13 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.912 108.4 51.4 -59.5 -44.1 35.4 -11.9 -2.6 151 151 A T H X S+ 0 0 34 -4,-2.4 4,-2.6 1,-0.2 6,-0.4 0.851 106.9 55.7 -62.8 -33.5 36.3 -15.5 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.906 111.2 42.5 -65.0 -41.0 34.4 -16.7 -0.6 153 153 A F H < S+ 0 0 1 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.875 115.1 51.9 -72.4 -37.8 31.3 -14.8 -1.9 154 154 A R H < S+ 0 0 100 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.935 125.2 20.5 -61.8 -49.7 31.9 -16.0 -5.4 155 155 A T H < S- 0 0 43 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.645 84.6-134.9 -99.3 -24.1 32.2 -19.7 -4.6 156 156 A G S < S+ 0 0 17 -4,-2.1 2,-0.2 -5,-0.4 -62,-0.2 0.719 73.2 101.4 72.4 18.2 30.6 -20.3 -1.4 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.4 -5,-0.2 -1,-0.3 -0.770 81.0-116.8-125.3 174.9 33.5 -22.4 -0.3 158 158 A W S >> S+ 0 0 28 -2,-0.2 3,-1.5 1,-0.2 4,-0.7 0.122 72.4 121.1 -98.4 20.0 36.6 -21.9 1.9 159 159 A D G >4 + 0 0 99 1,-0.2 3,-1.1 2,-0.2 4,-0.4 0.834 65.6 59.7 -52.5 -39.9 39.1 -22.4 -0.8 160 160 A A G 34 S+ 0 0 14 -3,-0.4 4,-0.3 1,-0.3 -1,-0.2 0.688 113.4 39.7 -65.0 -18.2 40.7 -18.9 -0.5 161 161 A Y G <4 S+ 0 0 1 -3,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.447 93.6 80.6-109.2 -4.9 41.7 -19.8 3.1 162 162 A K S << S+ 0 0 135 -3,-1.1 -2,-0.1 -4,-0.7 -3,-0.1 0.509 93.4 54.4 -84.4 -2.5 42.7 -23.5 2.7 163 163 A N 0 0 130 -4,-0.4 -1,-0.2 1,-0.1 -2,-0.1 0.883 360.0 360.0 -76.9 -58.9 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 0.547 360.0 360.0 -68.8 360.0 46.7 -20.1 4.4