==== 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 1L39 . 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) . 8676.0 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 . 86 52.4 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 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 68 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 154.9 36.9 -23.5 9.0 2 2 A N > - 0 0 71 95,-0.0 4,-2.7 92,-0.0 3,-0.4 -0.911 360.0 -87.0-146.2 170.3 34.7 -21.0 10.9 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.814 123.4 53.1 -51.6 -41.7 34.3 -17.2 11.2 4 4 A F H > S+ 0 0 75 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.928 112.4 41.3 -63.0 -48.6 36.8 -17.1 14.1 5 5 A E H > S+ 0 0 95 -3,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.873 114.5 55.0 -66.1 -36.4 39.6 -19.0 12.3 6 6 A M H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 3,-0.3 0.960 111.7 41.0 -62.1 -53.0 38.8 -17.0 9.2 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 5,-0.4 0.834 109.1 60.1 -64.8 -30.9 39.2 -13.6 10.9 8 8 A R H X S+ 0 0 105 -4,-1.7 4,-1.4 -5,-0.2 -1,-0.2 0.880 107.4 47.2 -66.2 -26.9 42.2 -14.8 12.8 9 9 A I H < S+ 0 0 53 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.948 114.4 45.9 -75.4 -49.1 43.9 -15.4 9.5 10 10 A D H < S+ 0 0 19 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.832 124.5 29.2 -63.8 -34.6 42.9 -12.1 8.0 11 11 A E H < S- 0 0 40 -4,-2.2 19,-0.3 -5,-0.2 -1,-0.2 0.674 91.8-150.0-104.0 -21.9 43.8 -9.9 11.0 12 12 A G < - 0 0 22 -4,-1.4 2,-0.4 -5,-0.4 -1,-0.1 -0.177 25.2 -85.2 77.2-174.4 46.7 -11.7 12.7 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.978 41.5 177.7-137.8 122.8 47.4 -11.6 16.5 14 14 A R E -A 28 0A 132 14,-1.6 14,-2.6 -2,-0.4 4,-0.1 -0.993 17.2-166.6-131.0 125.4 49.4 -8.8 18.2 15 15 A L E S+ 0 0 70 -2,-0.4 43,-2.2 12,-0.2 2,-0.3 0.488 74.7 57.0 -88.2 -2.2 50.0 -8.5 21.9 16 16 A K E S-C 57 0B 108 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.931 101.7 -84.5-127.9 146.2 51.4 -5.0 21.9 17 17 A I E + 0 0 20 39,-1.8 2,-0.3 -2,-0.3 10,-0.2 -0.221 59.2 170.2 -50.0 139.2 49.7 -1.7 20.5 18 18 A Y E -A 26 0A 25 8,-2.7 8,-2.7 -4,-0.1 2,-0.4 -0.922 35.5-103.9-144.7 168.3 50.3 -1.4 16.8 19 19 A K E -A 25 0A 126 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.843 33.9-140.1-101.1 135.2 49.2 0.6 13.9 20 20 A D > - 0 0 48 4,-2.9 3,-1.8 -2,-0.4 -1,-0.1 -0.044 40.3 -80.5 -79.1-170.9 46.8 -0.9 11.5 21 21 A T T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.850 131.7 49.2 -64.4 -29.2 46.9 -0.6 7.7 22 22 A E T 3 S- 0 0 82 2,-0.1 -1,-0.3 1,-0.0 -3,-0.0 0.395 123.8-101.4 -86.6 0.0 45.2 2.9 8.0 23 23 A G S < S+ 0 0 37 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.534 76.6 140.0 92.0 11.2 47.6 4.1 10.5 24 24 A Y - 0 0 78 1,-0.1 -4,-2.9 -5,-0.0 -1,-0.3 -0.685 60.4-100.8 -96.5 151.0 45.2 3.6 13.5 25 25 A Y E +AB 19 34A 34 9,-0.7 8,-3.0 11,-0.4 9,-1.4 -0.462 54.4 160.4 -67.0 119.8 46.1 2.3 17.0 26 26 A T E -AB 18 32A 3 -8,-2.7 -8,-2.7 -2,-0.3 2,-0.3 -0.839 18.1-172.4-135.8 163.1 45.0 -1.4 17.3 27 27 A I E > + B 0 31A 0 4,-1.1 4,-1.6 -2,-0.3 -12,-0.2 -0.960 53.5 3.6-153.2 162.8 45.8 -4.4 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.6 -14,-1.6 -2,-0.3 2,-0.9 -0.351 123.1 -6.0 66.8-131.4 45.0 -8.1 19.6 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.659 126.1 -53.2-101.3 72.5 43.0 -9.5 16.7 30 30 A G T 4 S+ 0 0 15 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.734 83.9 159.7 68.0 23.0 42.1 -6.4 14.7 31 31 A H E < -B 27 0A 33 -4,-1.6 -4,-1.1 1,-0.0 -1,-0.2 -0.647 33.9-142.8 -80.1 100.2 40.6 -4.6 17.7 32 32 A L E -B 26 0A 70 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.327 20.6-178.7 -61.0 130.9 40.6 -0.9 16.8 33 33 A L E - 0 0 14 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.881 59.0 -19.0 -96.5 -48.8 41.4 1.2 19.8 34 34 A T E -B 25 0A 27 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.983 35.3-143.6-157.4 150.9 41.2 4.8 18.5 35 35 A K S S+ 0 0 141 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.583 75.0 110.0 -90.0 -11.3 41.4 6.8 15.3 36 36 A S S S- 0 0 44 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.227 74.5-130.8 -66.2 146.1 43.3 9.5 17.3 37 37 A P S S+ 0 0 121 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.568 76.4 103.2 -76.9 -4.2 46.9 10.1 16.7 38 38 A S > - 0 0 49 1,-0.2 4,-2.1 2,-0.1 5,-0.1 -0.706 54.7-162.3 -93.1 125.6 47.8 10.0 20.4 39 39 A L H > S+ 0 0 66 -2,-0.6 4,-2.3 1,-0.3 -1,-0.2 0.762 99.5 55.9 -65.6 -24.8 49.5 6.8 21.7 40 40 A N H > S+ 0 0 114 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.885 102.8 49.4 -77.3 -40.5 48.3 8.1 25.0 41 41 A A H > S+ 0 0 34 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.905 113.1 51.9 -62.5 -34.7 44.7 8.3 23.9 42 42 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.901 107.7 49.6 -66.3 -46.5 45.3 4.6 22.7 43 43 A K H X S+ 0 0 54 -4,-2.3 4,-2.2 1,-0.2 11,-0.3 0.859 110.4 51.5 -62.5 -33.1 46.7 3.4 25.9 44 44 A S H X S+ 0 0 72 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.907 110.1 47.1 -74.6 -38.5 43.8 5.0 27.8 45 45 A E H X S+ 0 0 66 -4,-1.8 4,-2.8 1,-0.2 -2,-0.2 0.890 110.7 55.7 -66.7 -37.3 41.2 3.3 25.6 46 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 5,-0.3 0.938 106.6 46.6 -62.6 -46.9 43.1 0.1 26.1 47 47 A D H X>S+ 0 0 37 -4,-2.2 4,-2.8 2,-0.2 5,-0.9 0.872 113.2 49.9 -63.4 -38.3 43.0 0.2 29.8 48 48 A K H <5S+ 0 0 143 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.919 111.1 51.0 -63.4 -45.0 39.3 1.0 29.8 49 49 A A H <5S+ 0 0 43 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.871 122.2 30.3 -60.9 -39.0 38.7 -1.9 27.3 50 50 A I H <5S- 0 0 36 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.708 99.2-127.0 -98.6 -22.3 40.6 -4.4 29.5 51 51 A G T <5S+ 0 0 67 -4,-2.8 2,-0.3 1,-0.3 -3,-0.2 0.768 77.4 75.5 81.6 24.3 39.9 -3.1 33.0 52 52 A R S - 0 0 7 -2,-1.0 3,-1.0 -11,-0.3 -1,-0.2 0.829 30.6-146.3 -93.1 -27.2 48.1 -2.5 30.7 55 55 A N T 3 S- 0 0 122 1,-0.2 3,-0.1 -12,-0.2 -2,-0.1 0.822 73.0 -56.5 66.1 30.5 50.8 -0.3 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.8 1,-0.2 2,-0.4 0.520 118.9 96.6 81.1 6.8 50.1 -1.1 26.1 57 57 A V B < +C 16 0B 65 -3,-1.0 2,-0.3 -41,-0.2 -41,-0.2 -0.993 47.0 179.8-132.5 135.8 50.6 -4.8 26.4 58 58 A I - 0 0 3 -43,-2.2 2,-0.1 -2,-0.4 -30,-0.1 -0.839 26.1-109.4-128.7 166.3 47.9 -7.5 26.9 59 59 A T > - 0 0 66 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.450 33.6-105.8 -88.1 166.0 47.9 -11.4 27.2 60 60 A K H > S+ 0 0 110 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.918 122.8 51.9 -53.4 -48.2 46.6 -14.0 24.7 61 61 A D H > S+ 0 0 122 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.871 108.4 49.6 -53.4 -48.7 43.5 -14.5 26.8 62 62 A E H > S+ 0 0 36 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.905 110.3 51.5 -62.0 -41.7 42.8 -10.8 26.9 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -34,-0.4 0.875 110.9 48.5 -62.9 -40.4 43.2 -10.6 23.1 64 64 A E H X S+ 0 0 77 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.812 107.6 53.5 -70.2 -31.3 40.8 -13.4 22.7 65 65 A K H X S+ 0 0 136 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.936 110.2 47.2 -71.2 -38.2 38.2 -12.0 25.0 66 66 A L H X S+ 0 0 3 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.916 111.4 53.1 -63.3 -41.6 38.2 -8.8 23.0 67 67 A F H X S+ 0 0 12 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.947 106.2 51.6 -60.8 -46.6 38.0 -10.9 19.8 68 68 A N H X S+ 0 0 90 -4,-2.6 4,-2.2 1,-0.2 5,-0.3 0.949 111.6 48.0 -57.3 -44.5 34.9 -12.8 21.1 69 69 A Q H X S+ 0 0 95 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.867 110.2 50.8 -64.3 -40.0 33.1 -9.5 21.9 70 70 A D H X S+ 0 0 36 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.829 109.9 48.9 -65.6 -36.6 33.9 -8.0 18.6 71 71 A V H X S+ 0 0 6 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.924 113.4 48.4 -66.4 -45.1 32.6 -11.0 16.6 72 72 A D H X S+ 0 0 92 -4,-2.2 4,-2.5 1,-0.2 5,-0.3 0.921 112.2 48.2 -58.6 -47.9 29.4 -10.9 18.7 73 73 A A H X S+ 0 0 43 -4,-2.2 4,-2.8 -5,-0.3 -1,-0.2 0.914 109.6 52.9 -63.2 -40.6 29.0 -7.2 18.2 74 74 A A H X S+ 0 0 8 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.966 112.3 44.9 -58.3 -53.8 29.6 -7.7 14.4 75 75 A V H X S+ 0 0 35 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.921 114.7 48.1 -53.8 -50.2 26.8 -10.4 14.1 76 76 A R H X S+ 0 0 109 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.890 108.6 56.0 -60.1 -41.9 24.4 -8.3 16.3 77 77 A G H X S+ 0 0 3 -4,-2.8 4,-0.9 -5,-0.3 -1,-0.2 0.930 109.2 44.7 -56.2 -49.9 25.1 -5.2 14.2 78 78 A I H >< S+ 0 0 0 -4,-2.1 3,-0.7 1,-0.2 7,-0.4 0.924 111.7 53.8 -60.5 -43.5 24.1 -7.0 11.0 79 79 A L H 3< S+ 0 0 70 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.810 113.4 43.3 -63.4 -28.3 21.0 -8.4 12.7 80 80 A R H 3< S+ 0 0 169 -4,-1.9 2,-0.6 -3,-0.2 -1,-0.3 0.510 94.4 95.0 -90.1 -16.8 19.9 -4.9 13.8 81 81 A N > S+ 0 0 0 -7,-0.2 4,-2.6 -6,-0.1 3,-0.7 0.856 99.4 69.0 -86.0 -41.6 22.1 -5.9 6.2 85 85 A K H 3X S+ 0 0 80 -4,-2.7 4,-3.0 -7,-0.4 5,-0.2 0.877 99.4 49.4 -46.7 -50.4 19.7 -8.3 7.9 86 86 A P H 3> S+ 0 0 53 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.782 112.0 48.5 -62.8 -33.9 17.9 -9.3 4.7 87 87 A V H <> S+ 0 0 2 -3,-0.7 4,-0.8 -4,-0.4 -2,-0.2 0.945 112.7 48.0 -70.3 -48.0 21.1 -10.0 2.9 88 88 A Y H >< S+ 0 0 32 -4,-2.6 3,-1.5 1,-0.2 -3,-0.2 0.949 110.4 51.5 -53.9 -50.5 22.4 -12.1 5.8 89 89 A D H 3< S+ 0 0 75 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.839 108.6 53.6 -58.5 -31.2 19.1 -14.0 6.1 90 90 A S H 3< S+ 0 0 35 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.658 95.3 90.6 -78.5 -17.2 19.3 -14.8 2.4 91 91 A L S << S- 0 0 6 -3,-1.5 31,-0.0 -4,-0.8 2,-0.0 -0.523 74.0-119.9 -87.3 153.4 22.8 -16.2 2.5 92 92 A D > - 0 0 56 -2,-0.2 4,-1.8 1,-0.1 -1,-0.1 -0.186 46.2 -92.0 -71.8 170.6 24.2 -19.8 3.0 93 93 A A H > S+ 0 0 81 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.849 121.5 47.9 -61.7 -37.0 26.5 -20.4 6.0 94 94 A V H > S+ 0 0 26 62,-0.2 4,-1.5 2,-0.2 3,-0.3 0.955 112.9 46.9 -70.0 -48.2 29.8 -19.7 4.4 95 95 A R H > S+ 0 0 24 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.838 105.7 60.9 -62.3 -33.1 28.8 -16.5 2.6 96 96 A R H X S+ 0 0 81 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.929 102.0 52.3 -59.2 -41.3 27.3 -15.3 5.9 97 97 A A H X S+ 0 0 7 -4,-1.3 4,-2.5 -3,-0.3 -2,-0.2 0.912 105.9 55.4 -60.4 -39.6 30.9 -15.6 7.4 98 98 A A H X S+ 0 0 0 -4,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.844 108.4 46.5 -59.1 -40.6 32.1 -13.4 4.4 99 99 A L H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.882 111.1 52.6 -72.3 -37.5 29.6 -10.6 5.3 100 100 A I H X S+ 0 0 8 -4,-2.3 4,-2.6 -5,-0.2 5,-0.2 0.949 106.6 53.9 -63.6 -41.9 30.6 -10.8 8.9 101 101 A N H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.947 108.7 47.8 -55.1 -50.4 34.2 -10.5 8.0 102 102 A M H X S+ 0 0 2 -4,-1.8 4,-2.6 1,-0.2 5,-0.4 0.901 112.8 49.3 -55.6 -46.3 33.5 -7.2 6.0 103 103 A V H X S+ 0 0 9 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.883 107.9 52.2 -65.2 -39.2 31.5 -5.8 8.9 104 104 A F H < S+ 0 0 31 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.902 118.0 40.2 -62.6 -37.7 34.2 -6.6 11.5 105 105 A Q H < S+ 0 0 57 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.820 132.6 17.0 -79.0 -42.8 36.7 -4.8 9.2 106 106 A M H X S- 0 0 51 -4,-2.6 4,-0.6 -5,-0.2 -3,-0.2 0.520 103.6-114.4-119.8 -1.4 34.9 -1.8 8.0 107 107 A G H X - 0 0 31 -4,-1.9 4,-2.5 -5,-0.4 5,-0.2 0.206 32.7 -80.3 79.9 155.0 31.8 -1.4 10.2 108 108 A E H > S+ 0 0 52 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.866 128.5 51.3 -51.6 -49.1 28.1 -1.7 9.6 109 109 A T H > S+ 0 0 124 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.958 109.6 50.8 -58.4 -51.3 27.8 1.7 8.1 110 110 A G H >< S+ 0 0 32 -4,-0.6 3,-0.7 1,-0.2 4,-0.3 0.916 114.1 41.5 -52.9 -53.7 30.7 1.0 5.8 111 111 A V H >< S+ 0 0 0 -4,-2.5 3,-2.9 1,-0.2 -1,-0.2 0.926 107.0 62.2 -65.4 -40.2 29.3 -2.3 4.5 112 112 A A H 3< S+ 0 0 15 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.773 94.6 65.8 -56.6 -23.4 25.7 -0.9 4.3 113 113 A G T << S+ 0 0 56 -4,-1.1 2,-1.6 -3,-0.7 -1,-0.3 0.636 75.8 85.6 -72.0 -15.2 27.1 1.6 1.7 114 114 A F <> + 0 0 38 -3,-2.9 4,-2.3 -4,-0.3 3,-0.4 -0.207 57.5 158.6 -82.4 51.7 27.9 -1.2 -0.8 115 115 A T H > + 0 0 91 -2,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.820 66.5 43.5 -38.5 -57.3 24.2 -0.9 -2.0 116 116 A N H > S+ 0 0 85 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.863 114.2 49.0 -63.4 -43.0 24.7 -2.5 -5.5 117 117 A S H > S+ 0 0 1 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.877 109.8 53.4 -63.8 -42.6 26.8 -5.4 -4.3 118 118 A L H X S+ 0 0 14 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.879 108.3 50.0 -59.5 -44.9 24.3 -6.2 -1.5 119 119 A R H X S+ 0 0 114 -4,-1.7 4,-1.5 -5,-0.3 -1,-0.2 0.917 111.4 48.6 -64.3 -39.0 21.5 -6.3 -4.0 120 120 A M H <>S+ 0 0 27 -4,-1.9 5,-2.3 2,-0.2 4,-0.3 0.868 109.9 50.9 -69.1 -37.2 23.5 -8.7 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.2 3,-2.0 1,-0.2 -1,-0.2 0.939 108.7 52.5 -65.8 -45.0 24.4 -10.9 -3.3 122 122 A Q H 3<5S+ 0 0 95 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.855 109.4 48.8 -56.5 -36.3 20.8 -11.1 -2.4 123 123 A Q T 3<5S- 0 0 88 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.475 113.3-119.5 -85.4 1.5 19.9 -12.1 -5.9 124 124 A K T < 5 + 0 0 97 -3,-2.0 2,-1.4 -4,-0.3 -3,-0.2 0.764 62.3 147.1 65.7 29.7 22.6 -14.8 -5.9 125 125 A R >< + 0 0 113 -5,-2.3 4,-2.6 1,-0.2 5,-0.2 -0.627 20.2 174.3 -97.6 78.7 24.4 -13.3 -8.9 126 126 A W H > + 0 0 49 -2,-1.4 4,-1.4 1,-0.2 -1,-0.2 0.856 69.2 44.4 -54.9 -50.1 27.8 -14.4 -7.6 127 127 A D H > S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 3,-0.4 0.946 114.2 50.2 -65.8 -44.8 30.1 -13.4 -10.4 128 128 A E H > S+ 0 0 94 1,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.884 110.6 49.1 -59.4 -46.9 28.5 -10.1 -10.9 129 129 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.3 0.781 107.1 55.0 -61.6 -35.3 28.8 -9.2 -7.3 130 130 A A H X S+ 0 0 12 -4,-1.4 4,-1.0 -3,-0.4 -2,-0.2 0.898 109.5 48.1 -66.7 -41.5 32.5 -10.3 -7.1 131 131 A V H < S+ 0 0 88 -4,-1.9 4,-0.4 2,-0.2 3,-0.2 0.891 113.6 47.2 -65.4 -42.6 33.2 -7.9 -9.9 132 132 A N H >< S+ 0 0 39 -4,-1.9 3,-1.2 1,-0.2 -2,-0.2 0.891 107.2 54.6 -68.9 -39.4 31.3 -5.0 -8.2 133 133 A L H 3< S+ 0 0 3 -4,-2.3 6,-0.4 1,-0.2 -1,-0.2 0.831 100.4 62.6 -62.7 -30.3 32.8 -5.5 -4.8 134 134 A A T 3< S+ 0 0 28 -4,-1.0 2,-1.4 -3,-0.2 -1,-0.2 0.630 86.1 78.9 -72.3 -13.9 36.4 -5.2 -6.4 135 135 A K S < S+ 0 0 151 -3,-1.2 2,-0.3 -4,-0.4 -1,-0.2 -0.573 80.3 94.8 -93.3 67.4 35.5 -1.6 -7.5 136 136 A S S > S- 0 0 19 -2,-1.4 4,-2.3 1,-0.1 5,-0.1 -0.992 85.4-115.7-155.3 156.8 36.1 -0.1 -4.1 137 137 A R H > S+ 0 0 142 -2,-0.3 4,-3.8 1,-0.2 5,-0.3 0.896 116.1 63.1 -58.2 -39.7 38.7 1.6 -2.1 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.933 105.6 41.3 -47.9 -56.1 38.5 -1.5 0.1 139 139 A Y H 4 S+ 0 0 60 -6,-0.4 -1,-0.2 2,-0.2 -2,-0.2 0.924 116.5 50.7 -61.2 -46.8 39.7 -3.8 -2.7 140 140 A N H < S+ 0 0 108 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.918 115.0 42.2 -61.7 -42.3 42.4 -1.2 -3.7 141 141 A Q H < S+ 0 0 110 -4,-3.8 -2,-0.2 1,-0.2 -1,-0.2 0.861 132.0 18.2 -72.9 -43.1 43.7 -0.7 -0.2 142 142 A T S X S+ 0 0 22 -4,-2.3 4,-2.7 -5,-0.3 -1,-0.2 -0.512 71.1 162.1-129.4 62.5 43.8 -4.3 1.0 143 143 A P H > S+ 0 0 45 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.793 70.2 55.7 -51.4 -36.4 43.7 -6.4 -2.1 144 144 A E H > S+ 0 0 121 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.939 115.9 35.5 -69.3 -46.2 45.0 -9.7 -0.6 145 145 A R H > S+ 0 0 20 -3,-0.2 4,-2.4 2,-0.2 5,-0.3 0.921 116.9 54.4 -68.9 -46.7 42.4 -9.8 2.1 146 146 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.925 107.1 52.3 -53.6 -44.1 39.7 -8.4 -0.2 147 147 A K H X S+ 0 0 74 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.872 107.9 51.1 -60.8 -39.1 40.4 -11.1 -2.8 148 148 A R H X S+ 0 0 51 -4,-1.3 4,-1.4 -5,-0.2 12,-0.2 0.942 113.7 44.1 -64.6 -43.3 40.0 -13.8 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.900 113.6 49.9 -65.6 -42.2 36.6 -12.4 1.0 150 150 A I H X S+ 0 0 14 -4,-2.6 4,-2.4 -5,-0.3 -1,-0.2 0.882 108.7 52.5 -64.1 -42.4 35.4 -11.9 -2.5 151 151 A T H X S+ 0 0 34 -4,-2.1 4,-2.6 -5,-0.2 6,-0.3 0.826 106.0 54.7 -60.9 -37.1 36.4 -15.5 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.882 111.2 44.7 -65.1 -38.8 34.4 -16.8 -0.5 153 153 A F H < S+ 0 0 2 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.884 114.4 49.8 -72.3 -39.8 31.3 -14.8 -1.9 154 154 A R H < S+ 0 0 104 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.933 125.4 24.1 -64.9 -44.2 31.9 -16.1 -5.4 155 155 A T H < S- 0 0 46 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.706 84.6-136.2-100.0 -27.2 32.3 -19.7 -4.5 156 156 A G S < S+ 0 0 18 -4,-2.1 2,-0.2 1,-0.3 -62,-0.2 0.691 74.4 98.7 74.5 19.1 30.5 -20.4 -1.3 157 157 A T S S- 0 0 48 -6,-0.3 3,-0.3 -5,-0.2 -1,-0.3 -0.806 82.8-116.0-129.8 172.2 33.5 -22.5 -0.2 158 158 A W S >> S+ 0 0 34 -2,-0.2 3,-1.6 1,-0.2 4,-0.7 0.133 70.8 124.6 -94.5 21.1 36.5 -21.9 2.1 159 159 A D H >> + 0 0 95 1,-0.3 3,-1.2 2,-0.2 4,-0.7 0.833 65.0 57.9 -49.0 -44.0 39.0 -22.3 -0.7 160 160 A A H 34 S+ 0 0 12 -3,-0.3 4,-0.3 1,-0.3 -1,-0.3 0.697 112.0 42.4 -63.3 -20.7 40.8 -19.0 -0.4 161 161 A Y H <4 S+ 0 0 1 -3,-1.6 -1,-0.3 2,-0.1 -2,-0.2 0.501 94.4 77.6-103.8 -8.2 41.6 -19.8 3.2 162 162 A K H << S+ 0 0 132 -3,-1.2 -2,-0.2 -4,-0.7 -3,-0.1 0.728 92.6 56.5 -77.3 -17.7 42.6 -23.4 2.8 163 163 A N < 0 0 130 -4,-0.7 -1,-0.2 1,-0.1 -2,-0.1 0.932 360.0 360.0 -62.0 -56.8 45.8 -22.2 1.4 164 164 A L 0 0 118 -4,-0.3 -2,-0.2 0, 0.0 -1,-0.1 0.487 360.0 360.0 -78.5 360.0 46.7 -20.1 4.5