==== 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) 28-JAN-91 1L48 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR S.DAOPIN,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8613.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.0 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 . 11 6.7 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 1 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 67 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 137.6 37.0 -23.5 8.9 2 2 A N > - 0 0 70 95,-0.0 4,-2.5 1,-0.0 3,-0.4 -0.843 360.0 -89.0-134.5 174.3 34.9 -21.1 10.9 3 3 A I H > S+ 0 0 20 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.829 123.0 52.2 -53.4 -41.4 34.5 -17.3 11.3 4 4 A F H > S+ 0 0 75 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.893 112.3 43.8 -64.9 -46.0 37.2 -17.2 14.1 5 5 A E H > S+ 0 0 91 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.914 113.6 52.8 -64.7 -41.0 39.8 -19.0 12.1 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.934 114.1 40.6 -62.0 -49.3 39.0 -17.0 9.1 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 5,-0.3 0.813 109.1 60.1 -71.4 -29.5 39.4 -13.7 10.8 8 8 A R H X S+ 0 0 107 -4,-1.8 4,-1.7 -5,-0.2 -1,-0.2 0.901 107.8 47.3 -66.1 -31.1 42.4 -14.9 12.7 9 9 A I H < S+ 0 0 53 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.945 115.6 43.3 -72.1 -45.6 44.0 -15.4 9.3 10 10 A D H < S+ 0 0 19 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.821 125.5 29.8 -71.1 -29.5 43.0 -12.1 7.9 11 11 A E H < S- 0 0 38 -4,-2.3 19,-0.4 -5,-0.2 -1,-0.2 0.704 91.2-150.1-104.5 -27.7 43.9 -9.9 10.9 12 12 A G < - 0 0 22 -4,-1.7 2,-0.4 -5,-0.3 -1,-0.1 -0.066 23.9 -87.0 78.9-178.3 46.7 -11.7 12.6 13 13 A L + 0 0 38 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.998 42.0 175.1-128.8 130.1 47.4 -11.7 16.4 14 14 A R E -A 28 0A 134 14,-1.1 14,-2.6 -2,-0.4 4,-0.1 -0.998 17.6-166.4-138.9 123.5 49.5 -8.9 18.0 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.4 12,-0.2 2,-0.3 0.408 74.3 60.6 -90.9 1.9 50.0 -8.6 21.8 16 16 A K E S-C 57 0B 102 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.923 100.9 -88.8-126.9 145.2 51.5 -5.1 21.7 17 17 A I E + 0 0 17 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.305 58.6 168.3 -53.1 141.5 49.7 -1.9 20.4 18 18 A Y E -A 26 0A 28 8,-2.7 8,-3.0 6,-0.1 2,-0.5 -0.897 37.2 -98.0-147.1 172.2 50.4 -1.5 16.8 19 19 A K E -A 25 0A 119 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.823 34.5-141.2 -99.0 134.7 49.3 0.5 13.8 20 20 A D > - 0 0 43 4,-2.7 3,-1.5 -2,-0.5 -1,-0.1 -0.024 41.9 -80.3 -76.6-168.1 46.8 -1.0 11.4 21 21 A T T 3 S+ 0 0 96 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.862 133.3 49.0 -64.1 -37.5 47.0 -0.6 7.7 22 22 A E T 3 S- 0 0 81 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.234 125.0-101.0 -83.8 4.2 45.4 2.8 7.9 23 23 A G S < S+ 0 0 35 -3,-1.5 2,-0.2 1,-0.3 -2,-0.1 0.528 76.0 140.3 85.0 12.2 47.8 3.9 10.6 24 24 A Y - 0 0 77 1,-0.1 -4,-2.7 -5,-0.1 2,-0.3 -0.590 60.7 -99.4 -93.5 155.6 45.4 3.4 13.5 25 25 A Y E +AB 19 34A 29 9,-0.9 8,-3.2 11,-0.3 9,-1.2 -0.506 54.4 162.6 -70.9 121.4 46.1 2.1 16.9 26 26 A T E -AB 18 32A 3 -8,-3.0 -8,-2.7 -2,-0.3 2,-0.3 -0.828 17.5-169.8-135.7 164.3 45.1 -1.6 17.2 27 27 A I E > - B 0 31A 0 4,-1.1 4,-1.8 -2,-0.3 -12,-0.2 -0.972 52.3 -3.3-154.1 159.2 45.8 -4.6 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.6 -14,-1.1 -2,-0.3 2,-1.0 -0.340 124.0 -4.4 62.4-130.3 45.2 -8.3 19.5 29 29 A I T 4 S- 0 0 6 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.669 127.3 -52.6 -95.7 76.3 43.1 -9.7 16.6 30 30 A G T 4 S+ 0 0 16 -2,-1.0 2,-1.2 -19,-0.4 -2,-0.2 0.733 83.3 158.4 67.4 25.0 42.1 -6.5 14.6 31 31 A H E < -B 27 0A 35 -4,-1.8 -4,-1.1 1,-0.0 -1,-0.2 -0.649 34.2-144.1 -84.5 99.7 40.7 -4.7 17.7 32 32 A L E -B 26 0A 69 -2,-1.2 -6,-0.3 -6,-0.2 3,-0.1 -0.300 18.7-176.3 -60.6 134.0 40.7 -1.0 16.8 33 33 A L E - 0 0 15 -8,-3.2 2,-0.3 1,-0.4 -7,-0.2 0.874 59.2 -23.6 -98.2 -50.0 41.5 1.1 19.8 34 34 A T E -B 25 0A 27 -9,-1.2 -9,-0.9 2,-0.1 -1,-0.4 -0.989 37.0-138.7-158.5 154.5 41.3 4.7 18.6 35 35 A K S S+ 0 0 138 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.573 74.2 114.7 -90.4 -9.2 41.5 6.7 15.4 36 36 A S S S- 0 0 39 1,-0.1 -11,-0.3 2,-0.1 6,-0.2 -0.286 71.9-133.0 -65.0 139.1 43.4 9.2 17.4 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.580 77.1 103.1 -71.2 -4.4 47.1 10.0 16.7 38 38 A S > - 0 0 50 1,-0.2 4,-2.7 2,-0.1 5,-0.1 -0.686 56.3-161.7 -91.9 120.3 47.9 9.8 20.3 39 39 A L H > S+ 0 0 64 -2,-0.7 4,-1.9 1,-0.3 -1,-0.2 0.774 99.3 53.3 -60.1 -26.4 49.6 6.6 21.6 40 40 A N H > S+ 0 0 116 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.894 102.8 52.4 -78.2 -40.0 48.5 7.8 24.9 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.0 2,-0.2 3,-0.3 0.962 112.1 51.9 -56.7 -40.7 44.9 8.1 23.9 42 42 A A H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.843 107.2 48.2 -60.8 -43.9 45.5 4.5 22.7 43 43 A K H X S+ 0 0 47 -4,-1.9 4,-1.8 2,-0.2 11,-0.3 0.817 109.6 54.5 -70.7 -29.9 46.9 3.1 25.9 44 44 A S H X S+ 0 0 71 -4,-1.9 4,-2.2 -3,-0.3 -2,-0.2 0.912 107.9 48.8 -67.2 -45.2 44.0 4.8 27.8 45 45 A E H X S+ 0 0 63 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.902 109.5 54.8 -62.6 -38.6 41.4 3.0 25.6 46 46 A L H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.931 107.5 46.1 -62.4 -46.8 43.2 -0.2 26.2 47 47 A D H X>S+ 0 0 36 -4,-1.8 4,-2.4 2,-0.2 5,-0.7 0.879 112.9 52.2 -66.1 -34.8 43.1 -0.1 29.9 48 48 A K H <5S+ 0 0 143 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.917 112.6 45.6 -64.5 -43.5 39.5 0.8 29.7 49 49 A A H <5S+ 0 0 46 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.890 120.7 36.6 -69.5 -36.3 38.9 -2.1 27.4 50 50 A I H <5S- 0 0 36 -4,-2.7 -2,-0.2 2,-0.3 -3,-0.2 0.812 100.4-125.0 -88.0 -33.2 40.8 -4.7 29.5 51 51 A G T <5S+ 0 0 67 -4,-2.4 2,-0.3 1,-0.4 -3,-0.2 0.626 78.8 76.8 95.6 14.4 40.0 -3.5 32.9 52 52 A R S - 0 0 8 -2,-0.9 3,-1.5 -11,-0.3 -1,-0.2 0.636 34.4-144.8-102.0 -23.0 48.3 -2.8 30.6 55 55 A N T 3 S- 0 0 124 1,-0.3 -2,-0.1 -12,-0.2 -11,-0.1 0.918 75.4 -50.2 55.0 48.3 50.8 -0.3 29.6 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.6 1,-0.1 2,-0.4 0.516 120.1 95.6 73.2 6.0 50.3 -1.2 25.9 57 57 A V B < +C 16 0B 63 -3,-1.5 2,-0.3 -41,-0.2 -41,-0.2 -0.982 45.4 178.4-135.1 140.1 50.5 -4.9 26.3 58 58 A I - 0 0 4 -43,-2.4 2,-0.2 -2,-0.4 -30,-0.1 -0.836 26.8-110.0-131.9 166.0 48.0 -7.8 26.7 59 59 A T > - 0 0 68 -2,-0.3 4,-2.3 1,-0.1 3,-0.2 -0.454 34.6-104.9 -91.6 166.1 48.0 -11.5 27.1 60 60 A K H > S+ 0 0 107 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.909 121.7 53.9 -55.7 -47.0 46.7 -14.1 24.6 61 61 A D H > S+ 0 0 120 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.853 107.5 49.4 -55.0 -43.8 43.7 -14.7 26.7 62 62 A E H > S+ 0 0 36 2,-0.2 4,-2.5 -3,-0.2 -1,-0.2 0.890 109.6 52.5 -66.5 -40.5 42.8 -11.0 26.7 63 63 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -34,-0.4 0.873 110.7 48.2 -60.0 -40.6 43.2 -10.8 22.9 64 64 A E H X S+ 0 0 76 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.845 108.4 53.3 -70.9 -34.3 40.9 -13.6 22.6 65 65 A K H X S+ 0 0 139 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.952 110.8 46.1 -66.0 -47.6 38.3 -12.1 25.0 66 66 A L H X S+ 0 0 4 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.904 111.8 54.7 -58.1 -39.1 38.3 -8.9 22.9 67 67 A F H X S+ 0 0 11 -4,-2.1 4,-2.1 2,-0.2 5,-0.3 0.931 105.8 49.8 -62.5 -48.6 38.0 -11.1 19.8 68 68 A N H X S+ 0 0 93 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.935 112.9 49.0 -60.1 -36.8 34.9 -12.9 21.2 69 69 A Q H X S+ 0 0 97 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.899 109.3 50.3 -66.5 -41.2 33.3 -9.6 21.9 70 70 A D H X S+ 0 0 38 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.876 111.0 47.0 -67.0 -38.3 34.0 -8.1 18.5 71 71 A V H X S+ 0 0 6 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.922 114.0 49.9 -69.3 -42.2 32.6 -11.0 16.5 72 72 A D H X S+ 0 0 84 -4,-2.0 4,-2.8 -5,-0.3 5,-0.3 0.938 111.6 47.0 -59.6 -49.6 29.5 -11.0 18.7 73 73 A A H X S+ 0 0 44 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.2 0.908 112.0 52.0 -60.6 -40.6 29.0 -7.3 18.3 74 74 A A H X S+ 0 0 8 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.945 111.6 45.2 -60.2 -51.2 29.5 -7.7 14.5 75 75 A V H X S+ 0 0 35 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.945 115.0 47.2 -59.8 -47.4 26.9 -10.5 14.3 76 76 A R H X S+ 0 0 110 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.905 110.0 55.3 -62.2 -37.8 24.4 -8.6 16.5 77 77 A G H < S+ 0 0 2 -4,-2.6 4,-0.5 -5,-0.3 3,-0.3 0.934 107.4 47.1 -62.5 -46.2 25.1 -5.5 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-1.1 1,-0.2 7,-0.5 0.939 112.0 52.9 -57.3 -45.7 24.2 -7.2 11.1 79 79 A L H 3< S+ 0 0 70 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.744 112.2 43.6 -64.5 -26.5 21.0 -8.6 12.7 80 80 A R T 3< S+ 0 0 170 -4,-1.6 2,-0.6 -3,-0.3 -1,-0.3 0.317 94.5 95.0 -95.2 -5.3 19.8 -5.2 13.9 81 81 A N <> - 0 0 20 -3,-1.1 4,-2.7 -4,-0.5 3,-0.1 -0.811 65.1-150.1 -98.4 128.5 20.6 -3.4 10.7 82 82 A A T 4 S+ 0 0 88 -2,-0.6 -1,-0.1 1,-0.2 -4,-0.0 0.744 97.0 43.5 -67.6 -19.5 17.8 -3.0 8.2 83 83 A K T 4 S+ 0 0 135 2,-0.1 4,-0.5 3,-0.1 -1,-0.2 0.807 121.1 39.4 -90.1 -31.1 20.0 -3.1 5.1 84 84 A L T >> S+ 0 0 0 -6,-0.2 4,-2.4 -7,-0.2 3,-0.6 0.885 102.1 66.2 -85.3 -45.2 22.2 -6.0 6.3 85 85 A K H 3X S+ 0 0 78 -4,-2.7 4,-3.1 -7,-0.5 5,-0.2 0.881 99.7 50.7 -48.9 -49.6 19.8 -8.4 7.9 86 86 A P H 3> S+ 0 0 50 0, 0.0 4,-1.3 0, 0.0 -1,-0.3 0.891 111.8 47.7 -61.7 -36.7 17.9 -9.2 4.8 87 87 A V H <> S+ 0 0 2 -3,-0.6 4,-0.8 -4,-0.5 -2,-0.2 0.937 112.5 48.8 -68.2 -45.1 21.1 -10.0 2.9 88 88 A Y H >< S+ 0 0 35 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.949 109.9 52.8 -57.4 -49.4 22.4 -12.1 5.7 89 89 A D H 3< S+ 0 0 75 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.815 107.5 52.6 -58.4 -31.1 19.1 -14.0 6.0 90 90 A S H 3< S+ 0 0 34 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.621 96.3 91.1 -80.1 -13.7 19.3 -14.7 2.3 91 91 A L S << S- 0 0 7 -3,-1.6 31,-0.0 -4,-0.8 2,-0.0 -0.535 73.7-117.2 -91.9 159.7 22.7 -16.3 2.3 92 92 A D > - 0 0 56 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.190 45.5 -93.2 -74.9 170.5 24.1 -19.7 2.8 93 93 A A H > S+ 0 0 74 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.853 121.9 47.4 -58.8 -41.3 26.4 -20.5 5.8 94 94 A V H > S+ 0 0 28 1,-0.2 4,-1.4 2,-0.2 3,-0.5 0.963 113.7 47.2 -64.8 -48.9 29.8 -19.8 4.2 95 95 A R H > S+ 0 0 22 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.822 105.9 60.1 -61.3 -34.9 28.7 -16.5 2.6 96 96 A R H X S+ 0 0 86 -4,-1.9 4,-1.8 1,-0.2 -1,-0.3 0.897 102.7 52.2 -61.3 -40.1 27.2 -15.5 5.9 97 97 A C H X S+ 0 0 22 -4,-1.5 4,-2.3 -3,-0.5 -1,-0.2 0.855 105.9 56.0 -61.1 -35.8 30.7 -15.8 7.4 98 98 A V H X S+ 0 0 0 -4,-1.4 4,-2.2 1,-0.2 -1,-0.2 0.893 105.5 48.8 -66.6 -38.5 32.0 -13.5 4.6 99 99 A L H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.887 110.0 53.5 -67.8 -37.2 29.6 -10.7 5.4 100 100 A I H X S+ 0 0 7 -4,-1.8 4,-3.0 2,-0.2 5,-0.3 0.942 106.1 53.4 -61.1 -41.8 30.6 -11.1 9.1 101 101 A N H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.970 110.3 46.3 -56.7 -51.0 34.3 -10.7 8.0 102 102 A M H X S+ 0 0 3 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.851 112.6 49.7 -57.6 -43.2 33.5 -7.4 6.1 103 103 A V H X S+ 0 0 8 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.913 108.7 52.5 -67.2 -41.1 31.5 -6.0 9.0 104 104 A F H < S+ 0 0 32 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.911 118.0 38.8 -56.5 -44.4 34.2 -6.8 11.5 105 105 A Q H < S+ 0 0 58 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.906 131.8 19.4 -75.4 -45.8 36.7 -4.9 9.3 106 106 A M H X S- 0 0 47 -4,-3.0 4,-0.6 -5,-0.2 -3,-0.2 0.480 103.5-113.7-115.1 3.7 34.8 -2.0 8.0 107 107 A G H X - 0 0 32 -4,-2.0 4,-2.3 -5,-0.3 5,-0.2 0.158 33.0 -82.0 78.2 153.9 31.9 -1.5 10.4 108 108 A E H > S+ 0 0 54 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.922 128.7 51.3 -57.5 -48.4 28.2 -1.9 9.8 109 109 A T H > S+ 0 0 123 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.901 109.3 51.6 -58.8 -42.5 27.8 1.5 8.3 110 110 A G H >< S+ 0 0 29 -4,-0.6 3,-0.6 2,-0.2 4,-0.3 0.920 113.0 42.5 -63.0 -46.0 30.6 0.9 5.9 111 111 A V H >< S+ 0 0 1 -4,-2.3 3,-2.4 1,-0.2 -2,-0.2 0.931 107.6 61.3 -69.1 -39.0 29.3 -2.4 4.6 112 112 A A H 3< S+ 0 0 15 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.760 94.5 65.9 -57.2 -22.8 25.8 -0.9 4.4 113 113 A G T << S+ 0 0 53 -4,-1.0 2,-2.0 -3,-0.6 -1,-0.3 0.633 75.2 87.1 -72.2 -17.2 27.1 1.6 1.9 114 114 A F <> + 0 0 46 -3,-2.4 4,-2.6 -4,-0.3 5,-0.3 -0.349 55.9 160.6 -82.5 57.9 27.9 -1.1 -0.7 115 115 A T H > + 0 0 88 -2,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.846 67.0 43.3 -47.2 -53.2 24.3 -0.8 -2.0 116 116 A N H > S+ 0 0 88 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.884 115.2 48.8 -66.4 -41.1 24.8 -2.3 -5.5 117 117 A S H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.867 109.0 52.7 -63.9 -47.0 26.9 -5.2 -4.2 118 118 A L H X S+ 0 0 13 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.902 109.6 50.3 -56.3 -41.3 24.4 -6.0 -1.4 119 119 A R H X S+ 0 0 114 -4,-1.7 4,-1.8 -5,-0.3 -2,-0.2 0.933 111.4 48.1 -63.3 -43.7 21.5 -6.1 -4.0 120 120 A M H <>S+ 0 0 28 -4,-2.0 5,-2.6 2,-0.2 -1,-0.2 0.884 110.4 49.7 -67.3 -40.1 23.6 -8.5 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.2 3,-1.9 1,-0.2 -1,-0.2 0.925 109.8 53.5 -67.2 -39.2 24.5 -10.8 -3.3 122 122 A Q H 3<5S+ 0 0 91 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.902 109.9 46.1 -60.0 -36.9 20.8 -10.9 -2.4 123 123 A Q T 3<5S- 0 0 85 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.405 114.4-121.6 -84.3 0.5 19.9 -11.9 -5.9 124 124 A K T < 5 + 0 0 99 -3,-1.9 2,-1.2 1,-0.2 -3,-0.2 0.758 60.9 148.9 62.8 32.5 22.7 -14.5 -5.8 125 125 A R >< + 0 0 120 -5,-2.6 4,-2.2 1,-0.2 -1,-0.2 -0.728 19.1 173.6 -97.9 79.5 24.5 -13.0 -8.8 126 126 A W H > S+ 0 0 46 -2,-1.2 4,-2.0 2,-0.2 -1,-0.2 0.870 70.2 44.8 -54.2 -55.6 27.9 -14.1 -7.5 127 127 A D H > S+ 0 0 103 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.915 114.4 49.4 -62.3 -42.5 30.2 -13.2 -10.4 128 128 A E H > S+ 0 0 94 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.893 110.8 49.7 -65.5 -40.8 28.5 -9.8 -10.9 129 129 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.841 107.2 55.1 -65.1 -36.3 28.8 -9.0 -7.2 130 130 A A H X S+ 0 0 11 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.921 108.5 48.9 -62.1 -43.2 32.6 -9.9 -7.2 131 131 A V H < S+ 0 0 87 -4,-1.9 4,-0.4 1,-0.2 -2,-0.2 0.915 113.5 46.1 -64.7 -40.4 33.2 -7.5 -10.0 132 132 A N H >< S+ 0 0 44 -4,-1.8 3,-1.1 1,-0.2 -2,-0.2 0.900 108.8 54.0 -70.9 -41.3 31.4 -4.7 -8.2 133 133 A L H 3< S+ 0 0 2 -4,-2.6 6,-0.3 1,-0.2 -1,-0.2 0.843 100.8 62.0 -61.0 -33.0 33.0 -5.2 -4.8 134 134 A A T 3< S+ 0 0 29 -4,-1.4 2,-1.4 1,-0.2 -1,-0.2 0.665 87.9 77.1 -67.9 -18.1 36.5 -5.0 -6.5 135 135 A K S < S+ 0 0 152 -3,-1.1 2,-0.3 -4,-0.4 -1,-0.2 -0.524 81.2 91.1 -91.6 66.8 35.6 -1.4 -7.5 136 136 A S S > S- 0 0 21 -2,-1.4 4,-1.9 1,-0.1 3,-0.2 -0.994 85.2-112.7-154.7 158.5 36.2 0.1 -4.1 137 137 A R H > S+ 0 0 142 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.901 114.9 63.3 -58.7 -40.5 38.8 1.8 -2.0 138 138 A W H > S+ 0 0 19 1,-0.2 4,-2.1 2,-0.2 8,-0.2 0.905 105.9 43.5 -47.5 -50.4 38.6 -1.3 0.3 139 139 A Y H 4 S+ 0 0 51 -6,-0.3 -1,-0.2 -3,-0.2 -2,-0.2 0.926 113.7 50.6 -66.6 -47.3 39.9 -3.6 -2.5 140 140 A N H < S+ 0 0 106 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.839 114.7 44.6 -60.4 -34.9 42.6 -1.1 -3.6 141 141 A Q H < S+ 0 0 94 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.863 130.2 19.0 -80.4 -41.2 43.9 -0.7 -0.1 142 142 A T S X S+ 0 0 28 -4,-2.1 4,-2.6 -5,-0.2 5,-0.3 -0.578 73.5 162.8-130.0 66.5 43.9 -4.4 1.1 143 143 A P H > S+ 0 0 51 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.848 70.2 50.9 -59.5 -38.4 43.8 -6.3 -2.2 144 144 A N H > S+ 0 0 113 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.925 116.2 41.0 -69.0 -41.2 45.0 -9.7 -0.9 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.937 115.6 51.1 -65.6 -50.3 42.4 -9.8 1.9 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 5,-0.3 0.902 108.8 52.5 -54.7 -44.6 39.7 -8.3 -0.4 147 147 A K H X S+ 0 0 90 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.898 108.2 50.3 -61.1 -38.7 40.4 -11.0 -3.0 148 148 A R H X S+ 0 0 49 -4,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.947 114.6 44.0 -61.2 -49.7 40.1 -13.7 -0.4 149 149 A V H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 5,-0.2 0.936 114.8 48.8 -57.9 -51.8 36.8 -12.3 0.7 150 150 A I H X S+ 0 0 13 -4,-3.2 4,-1.9 1,-0.2 -1,-0.2 0.877 109.9 50.7 -58.8 -44.3 35.6 -11.8 -2.8 151 151 A T H X S+ 0 0 41 -4,-2.3 4,-2.7 -5,-0.3 5,-0.4 0.873 107.3 55.8 -62.6 -37.0 36.5 -15.3 -4.0 152 152 A T H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.907 109.2 44.6 -63.0 -41.8 34.7 -16.7 -1.0 153 153 A F H < S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.867 113.3 56.2 -67.2 -33.9 31.4 -14.8 -2.1 154 154 A R H < S+ 0 0 102 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.940 123.4 16.4 -62.5 -50.7 32.2 -16.0 -5.6 155 155 A T H < S- 0 0 50 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.655 86.1-133.1-103.4 -23.2 32.4 -19.7 -4.9 156 156 A G S < S+ 0 0 16 -4,-2.4 2,-0.2 -5,-0.4 -62,-0.2 0.682 71.9 102.8 76.5 17.2 30.8 -20.3 -1.6 157 157 A T S S- 0 0 51 -6,-0.3 3,-0.4 -5,-0.2 -1,-0.3 -0.763 78.8-118.3-124.9 175.1 33.6 -22.5 -0.4 158 158 A W S >> S+ 0 0 30 -2,-0.2 3,-2.1 1,-0.2 4,-0.7 0.297 73.2 119.0 -95.3 9.4 36.6 -22.0 1.9 159 159 A D H >> + 0 0 97 1,-0.3 3,-0.9 2,-0.2 4,-0.7 0.790 66.5 60.8 -44.7 -39.7 39.2 -22.7 -0.8 160 160 A A H 34 S+ 0 0 16 -3,-0.4 4,-0.3 1,-0.3 -1,-0.3 0.699 112.3 38.2 -66.1 -19.0 40.8 -19.2 -0.5 161 161 A Y H <4 S+ 0 0 0 -3,-2.1 -1,-0.3 2,-0.1 -2,-0.2 0.449 97.2 79.5-106.4 -10.3 41.7 -19.7 3.0 162 162 A K H << S+ 0 0 131 -3,-0.9 -2,-0.2 -4,-0.7 -3,-0.1 0.731 91.8 54.8 -74.9 -19.0 42.7 -23.4 2.8 163 163 A N < 0 0 133 -4,-0.7 -1,-0.2 1,-0.1 -2,-0.1 0.981 360.0 360.0 -59.0 -63.8 45.9 -22.4 1.4 164 164 A L 0 0 113 -4,-0.3 -2,-0.2 0, 0.0 -1,-0.1 0.647 360.0 360.0 -63.7 360.0 46.7 -20.1 4.4