==== 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 1L26 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.A.BELL,S.DAO-PIN,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) . 122 74.4 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 . 12 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 53.7 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 0 0 1 3 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 90 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 144.9 36.9 -23.5 9.0 2 2 A N > - 0 0 70 95,-0.0 4,-2.7 1,-0.0 3,-0.2 -0.828 360.0 -87.6-139.7 174.2 34.8 -21.0 11.0 3 3 A I H > S+ 0 0 20 -2,-0.3 4,-2.4 1,-0.2 5,-0.3 0.851 123.3 51.1 -57.0 -40.0 34.4 -17.3 11.4 4 4 A F H > S+ 0 0 76 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.915 112.6 43.7 -67.8 -41.8 37.0 -17.1 14.1 5 5 A E H > S+ 0 0 89 -3,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.890 113.7 52.6 -66.3 -42.5 39.7 -19.0 12.2 6 6 A M H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.925 111.5 45.2 -60.6 -46.9 38.9 -17.0 9.1 7 7 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 5,-0.4 0.810 108.0 57.2 -72.8 -25.0 39.3 -13.7 10.9 8 8 A R H X S+ 0 0 92 -4,-1.4 4,-2.2 -5,-0.3 -1,-0.2 0.910 104.5 51.2 -78.4 -19.6 42.3 -14.7 12.6 9 9 A I H < S+ 0 0 60 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.942 116.4 42.9 -69.8 -44.2 44.0 -15.4 9.2 10 10 A D H < S+ 0 0 19 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.784 125.7 29.5 -75.2 -29.7 43.0 -12.0 8.0 11 11 A E H < S- 0 0 35 -4,-1.9 19,-0.3 -5,-0.2 -2,-0.2 0.783 89.9-153.4-103.9 -34.3 43.8 -10.0 11.0 12 12 A G < - 0 0 19 -4,-2.2 2,-0.4 -5,-0.4 -1,-0.1 -0.290 24.8 -84.6 86.1-176.8 46.7 -11.8 12.8 13 13 A L + 0 0 45 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.978 42.9 171.3-137.3 120.0 47.5 -11.7 16.5 14 14 A R E -A 28 0A 124 14,-0.9 14,-2.7 -2,-0.4 4,-0.1 -0.997 17.9-166.7-133.1 123.8 49.6 -8.9 18.1 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.8 12,-0.2 2,-0.3 0.455 72.9 63.6 -90.9 -2.2 50.0 -8.6 21.9 16 16 A K E S-C 57 0B 122 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.904 101.5 -86.1-121.8 144.5 51.5 -5.0 21.8 17 17 A I E + 0 0 23 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.231 59.4 171.5 -51.2 139.5 49.7 -1.8 20.6 18 18 A Y E -A 26 0A 34 8,-2.7 8,-3.0 -4,-0.1 2,-0.4 -0.876 32.2-101.3-143.7 171.4 50.3 -1.5 16.8 19 19 A K E -A 25 0A 127 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.912 32.5-124.6-106.6 140.0 49.1 0.6 13.8 20 20 A D > - 0 0 56 4,-2.5 3,-1.3 -2,-0.4 -1,-0.1 0.052 37.7 -96.8 -50.0 175.0 46.4 -0.5 11.2 21 21 A T T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.742 134.8 54.7 -69.1 -24.5 47.0 -0.6 7.6 22 22 A E T 3 S- 0 0 85 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.499 125.8-105.0 -87.2 -6.3 45.4 2.7 8.0 23 23 A G S < S+ 0 0 35 -3,-1.3 2,-0.3 1,-0.3 -2,-0.1 0.465 74.4 140.2 92.0 9.8 47.8 4.0 10.6 24 24 A Y - 0 0 71 1,-0.1 -4,-2.5 -5,-0.0 2,-0.4 -0.620 60.1-103.2 -92.5 151.6 45.4 3.5 13.5 25 25 A Y E +AB 19 34A 31 9,-0.8 8,-3.4 11,-0.3 9,-1.2 -0.460 54.5 155.6 -68.3 122.0 46.1 2.2 16.9 26 26 A T E -AB 18 32A 3 -8,-3.0 -8,-2.7 -2,-0.4 2,-0.3 -0.870 21.1-167.7-138.6 166.8 45.1 -1.5 17.4 27 27 A I E > + B 0 31A 0 4,-1.6 4,-1.8 -2,-0.3 -12,-0.2 -0.990 51.0 1.3-154.0 162.8 45.8 -4.5 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.7 2,-1.1 -2,-0.3 -14,-0.9 -0.340 121.6 -3.5 70.5-132.7 45.1 -8.2 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.538 127.3 -54.7 -99.0 70.4 43.1 -9.6 16.7 30 30 A G T 4 S+ 0 0 16 -2,-1.1 2,-1.1 -19,-0.3 -2,-0.2 0.731 83.7 158.1 72.2 21.9 42.2 -6.5 14.8 31 31 A H E < -B 27 0A 33 -4,-1.8 -4,-1.6 32,-0.0 -1,-0.2 -0.670 34.0-144.9 -82.7 98.4 40.7 -4.7 17.8 32 32 A L E -B 26 0A 70 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.397 17.3-174.9 -62.2 130.2 40.8 -0.9 16.8 33 33 A L E - 0 0 15 -8,-3.4 2,-0.3 1,-0.4 -7,-0.2 0.890 59.9 -21.5 -93.1 -49.8 41.5 1.2 19.9 34 34 A T E -B 25 0A 28 -9,-1.2 -9,-0.8 2,-0.1 -1,-0.4 -0.986 37.9-139.3-157.7 152.0 41.3 4.8 18.6 35 35 A K S S+ 0 0 140 -2,-0.3 -1,-0.1 -11,-0.1 -3,-0.0 0.455 75.2 111.4 -91.0 -3.3 41.5 6.7 15.4 36 36 A S S S- 0 0 38 2,-0.1 -11,-0.3 1,-0.1 6,-0.2 -0.472 74.4-128.0 -71.2 138.6 43.5 9.4 17.3 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.620 77.1 98.1 -69.9 -8.7 47.1 10.0 16.7 38 38 A S > - 0 0 53 1,-0.2 4,-2.2 2,-0.0 3,-0.4 -0.683 56.8-158.2 -91.5 127.6 48.2 9.7 20.4 39 39 A L H > S+ 0 0 71 -2,-0.6 4,-2.2 1,-0.3 -1,-0.2 0.776 100.6 60.1 -60.8 -25.5 49.7 6.6 21.7 40 40 A N H > S+ 0 0 127 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.937 101.8 47.8 -73.7 -39.4 48.6 8.0 24.9 41 41 A A H > S+ 0 0 34 -3,-0.4 4,-1.8 1,-0.2 3,-0.3 0.933 113.9 51.4 -60.6 -40.4 44.9 8.2 24.0 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.867 105.9 52.7 -65.8 -39.7 45.3 4.6 22.8 43 43 A K H X S+ 0 0 45 -4,-2.2 4,-1.7 -5,-0.2 11,-0.3 0.813 108.6 50.5 -68.0 -28.6 46.8 3.4 25.9 44 44 A S H X S+ 0 0 72 -4,-1.3 4,-1.5 -3,-0.3 -2,-0.2 0.851 108.7 50.5 -77.5 -34.3 44.0 4.8 27.9 45 45 A E H X S+ 0 0 66 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.929 109.1 54.8 -68.2 -41.4 41.4 3.1 25.7 46 46 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 5,-0.4 0.924 108.1 45.4 -57.1 -48.0 43.3 -0.1 26.2 47 47 A D H X>S+ 0 0 35 -4,-1.7 4,-1.9 1,-0.2 5,-0.8 0.861 113.5 51.2 -68.8 -31.3 43.2 -0.0 29.9 48 48 A K H <5S+ 0 0 146 -4,-1.5 -2,-0.2 2,-0.2 -1,-0.2 0.876 111.6 48.5 -67.1 -40.3 39.5 1.0 29.8 49 49 A A H <5S+ 0 0 47 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.853 122.2 32.2 -70.0 -33.9 38.8 -2.0 27.5 50 50 A I H <5S- 0 0 37 -4,-2.3 -2,-0.2 2,-0.2 -3,-0.2 0.745 100.9-126.8 -96.2 -32.7 40.7 -4.6 29.6 51 51 A G T <5S+ 0 0 66 -4,-1.9 2,-0.3 1,-0.4 -3,-0.2 0.768 76.7 74.9 88.9 28.7 40.0 -3.2 33.1 52 52 A R S - 0 0 5 -2,-0.8 3,-1.2 -11,-0.3 -1,-0.2 0.782 30.0-146.9 -98.8 -29.9 48.2 -2.6 30.7 55 55 A N T 3 S- 0 0 125 1,-0.3 3,-0.1 -12,-0.2 -11,-0.1 0.792 76.0 -53.9 64.8 33.3 51.0 -0.3 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.2 2,-0.4 0.562 119.5 97.9 83.7 3.1 50.4 -1.1 26.0 57 57 A V B < -C 16 0B 63 -3,-1.2 2,-0.3 -41,-0.2 -41,-0.2 -0.966 45.1-179.4-135.5 137.8 50.6 -4.9 26.4 58 58 A I - 0 0 4 -43,-2.8 2,-0.2 -2,-0.4 -30,-0.1 -0.811 26.0-111.7-124.4 167.7 48.0 -7.6 26.8 59 59 A T > - 0 0 66 -2,-0.3 4,-2.2 1,-0.1 3,-0.5 -0.541 32.9-108.8 -90.4 163.6 47.9 -11.5 27.2 60 60 A K H > S+ 0 0 107 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.898 121.7 57.3 -54.0 -47.1 46.7 -14.0 24.6 61 61 A D H > S+ 0 0 110 2,-0.2 4,-1.1 1,-0.2 -1,-0.3 0.850 106.0 45.0 -49.6 -48.6 43.8 -14.5 26.9 62 62 A E H > S+ 0 0 31 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.825 111.0 56.9 -71.7 -31.6 42.8 -10.8 26.9 63 63 A A H X S+ 0 0 1 -4,-2.2 4,-2.0 1,-0.2 -34,-0.4 0.907 107.8 45.8 -66.1 -40.6 43.2 -10.8 23.1 64 64 A E H X S+ 0 0 82 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.779 109.4 55.4 -71.6 -29.1 40.8 -13.6 22.6 65 65 A K H X S+ 0 0 115 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.927 109.8 45.7 -70.5 -42.3 38.3 -12.1 25.0 66 66 A L H X S+ 0 0 3 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.901 112.0 53.0 -64.5 -39.5 38.3 -8.9 23.0 67 67 A F H X S+ 0 0 13 -4,-2.0 4,-2.4 1,-0.2 5,-0.3 0.934 106.6 52.7 -64.8 -44.5 38.0 -11.0 19.8 68 68 A N H X S+ 0 0 88 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.943 111.5 46.1 -55.7 -46.6 35.0 -12.8 21.2 69 69 A Q H X S+ 0 0 100 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.865 111.6 51.8 -62.9 -39.8 33.2 -9.5 22.0 70 70 A D H X S+ 0 0 37 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.893 110.6 45.4 -66.3 -40.2 34.0 -8.1 18.6 71 71 A V H X S+ 0 0 7 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.941 113.8 51.4 -68.3 -45.8 32.7 -11.0 16.6 72 72 A D H X S+ 0 0 82 -4,-2.2 4,-2.4 -5,-0.3 5,-0.3 0.968 111.9 46.9 -52.7 -48.4 29.5 -11.0 18.8 73 73 A A H X S+ 0 0 45 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.878 110.0 53.4 -63.8 -38.1 29.1 -7.3 18.2 74 74 A A H X S+ 0 0 8 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.953 111.2 45.0 -60.7 -52.3 29.6 -7.8 14.4 75 75 A V H X S+ 0 0 35 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.928 115.1 48.7 -55.1 -48.5 26.9 -10.5 14.2 76 76 A R H X S+ 0 0 130 -4,-2.4 4,-1.5 -5,-0.3 -1,-0.2 0.867 108.9 53.7 -62.7 -33.1 24.5 -8.3 16.4 77 77 A G H < S+ 0 0 2 -4,-2.3 4,-0.5 -5,-0.3 -1,-0.2 0.906 108.2 47.9 -69.9 -42.2 25.1 -5.4 14.3 78 78 A I H >< S+ 0 0 0 -4,-1.9 3,-0.9 1,-0.2 7,-0.6 0.932 112.2 50.7 -56.8 -47.4 24.2 -7.2 11.1 79 79 A L H 3< S+ 0 0 72 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.722 112.3 47.3 -66.0 -26.2 21.0 -8.5 12.7 80 80 A R T 3< S+ 0 0 182 -4,-1.5 2,-0.6 -5,-0.1 -1,-0.3 0.420 94.5 90.8 -93.2 -10.8 20.0 -5.0 13.9 81 81 A N <> - 0 0 26 -3,-0.9 4,-2.5 -4,-0.5 5,-0.3 -0.818 65.2-151.8-100.3 125.9 20.6 -3.4 10.6 82 82 A A H > S+ 0 0 83 -2,-0.6 4,-1.0 1,-0.2 -1,-0.2 0.938 97.4 43.4 -54.8 -55.3 17.8 -3.2 8.2 83 83 A K H > S+ 0 0 145 1,-0.2 4,-0.9 2,-0.1 -1,-0.2 0.949 120.0 42.7 -60.1 -44.1 19.9 -3.2 5.0 84 84 A L H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.864 105.2 57.8 -75.1 -44.8 22.3 -6.0 6.3 85 85 A K H X S+ 0 0 79 -4,-2.5 4,-2.5 -7,-0.6 5,-0.2 0.840 102.1 56.7 -57.2 -38.0 19.8 -8.6 7.9 86 86 A C H X S+ 0 0 60 -4,-1.0 4,-0.9 -5,-0.3 -1,-0.2 0.939 112.2 40.3 -66.2 -41.4 17.9 -9.0 4.7 87 87 A V H >X S+ 0 0 2 -4,-0.9 4,-0.8 2,-0.2 3,-0.6 0.955 114.8 53.5 -69.4 -44.9 21.1 -10.0 2.8 88 88 A Y H >< S+ 0 0 36 -4,-2.7 3,-1.3 1,-0.3 -2,-0.2 0.925 107.7 50.1 -52.7 -52.7 22.4 -12.2 5.7 89 89 A D H 3< S+ 0 0 83 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.761 108.6 53.9 -59.7 -29.4 19.2 -14.1 6.0 90 90 A S H << S+ 0 0 35 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.606 96.8 86.0 -81.7 -15.8 19.2 -14.8 2.3 91 91 A L S << S- 0 0 6 -3,-1.3 31,-0.0 -4,-0.8 30,-0.0 -0.580 75.8-115.2 -91.4 160.4 22.8 -16.3 2.3 92 92 A D > - 0 0 56 -2,-0.2 4,-2.0 1,-0.1 5,-0.1 -0.153 44.7 -91.5 -75.7 174.0 24.2 -19.8 2.9 93 93 A A H > S+ 0 0 74 1,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.836 122.1 45.8 -62.9 -39.2 26.5 -20.5 5.9 94 94 A V H > S+ 0 0 28 2,-0.2 4,-1.1 62,-0.2 3,-0.4 0.907 113.4 47.7 -70.9 -45.1 29.9 -19.8 4.2 95 95 A R H > S+ 0 0 23 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.848 104.2 62.2 -66.1 -29.8 28.8 -16.6 2.5 96 96 A R H X S+ 0 0 79 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.896 100.1 54.8 -58.2 -40.8 27.4 -15.5 5.8 97 97 A C H X S+ 0 0 17 -4,-1.0 4,-2.1 -3,-0.4 -1,-0.2 0.847 103.9 55.2 -55.9 -40.5 31.0 -15.7 7.1 98 98 A A H X S+ 0 0 0 -4,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.875 108.4 47.0 -65.6 -35.5 32.2 -13.3 4.3 99 99 A L H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.911 110.1 52.9 -75.7 -36.4 29.6 -10.6 5.3 100 100 A I H X S+ 0 0 9 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.911 107.3 52.7 -62.9 -38.1 30.6 -10.9 8.9 101 101 A N H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.935 109.2 48.6 -61.0 -48.3 34.3 -10.4 7.9 102 102 A M H X S+ 0 0 3 -4,-1.8 4,-3.2 1,-0.2 5,-0.4 0.897 111.8 50.0 -59.9 -44.0 33.5 -7.2 6.0 103 103 A V H X S+ 0 0 8 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.931 109.2 50.2 -63.2 -42.7 31.4 -5.9 9.0 104 104 A F H < S+ 0 0 33 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.875 117.9 40.6 -58.7 -45.4 34.3 -6.6 11.5 105 105 A Q H < S+ 0 0 58 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.929 132.9 19.1 -71.7 -49.0 36.8 -4.7 9.2 106 106 A M H X S- 0 0 56 -4,-3.2 4,-0.6 -5,-0.2 -3,-0.2 0.571 101.8-119.5-109.1 -3.0 34.7 -1.9 8.1 107 107 A G H X - 0 0 31 -4,-2.7 4,-2.1 -5,-0.4 5,-0.2 0.156 37.3 -75.7 79.5 158.6 31.9 -1.5 10.5 108 108 A E H > S+ 0 0 53 1,-0.2 4,-2.7 2,-0.2 -1,-0.1 0.816 129.3 51.2 -53.1 -48.8 28.1 -1.8 9.8 109 109 A T H > S+ 0 0 115 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.949 107.8 50.7 -60.3 -51.6 27.9 1.6 8.2 110 110 A G H >< S+ 0 0 32 -4,-0.6 3,-0.8 1,-0.2 -2,-0.2 0.921 114.6 43.1 -53.9 -50.7 30.7 1.0 5.9 111 111 A V H >< S+ 0 0 0 -4,-2.1 3,-2.5 1,-0.3 -1,-0.2 0.903 105.5 61.1 -68.7 -38.0 29.3 -2.2 4.6 112 112 A A H 3< S+ 0 0 18 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.746 95.1 66.4 -62.2 -18.0 25.8 -0.9 4.3 113 113 A G T << S+ 0 0 56 -4,-1.2 2,-1.1 -3,-0.8 3,-0.3 0.559 75.1 86.0 -77.2 -7.3 27.1 1.6 1.8 114 114 A F X> + 0 0 41 -3,-2.5 4,-2.0 1,-0.2 3,-0.7 -0.222 57.7 158.1 -87.3 53.5 27.9 -1.1 -0.7 115 115 A T H 3> + 0 0 91 -2,-1.1 4,-1.5 1,-0.3 -1,-0.2 0.793 65.1 45.1 -39.5 -56.4 24.3 -0.8 -1.9 116 116 A N H 3> S+ 0 0 87 -3,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.809 113.5 47.6 -68.1 -37.4 24.8 -2.3 -5.4 117 117 A S H <> S+ 0 0 2 -3,-0.7 4,-2.0 2,-0.2 -1,-0.2 0.824 109.5 54.2 -69.9 -40.3 26.8 -5.3 -4.3 118 118 A L H X S+ 0 0 14 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.893 108.4 51.3 -55.1 -42.9 24.4 -6.1 -1.5 119 119 A R H X S+ 0 0 113 -4,-1.5 4,-1.8 -5,-0.2 -2,-0.2 0.926 111.1 46.7 -63.8 -47.1 21.6 -6.2 -4.1 120 120 A M H <>S+ 0 0 29 -4,-1.8 5,-2.3 1,-0.2 4,-0.4 0.866 110.5 52.0 -65.6 -39.3 23.5 -8.5 -6.3 121 121 A L H ><5S+ 0 0 2 -4,-2.0 3,-1.7 2,-0.2 -2,-0.2 0.934 108.6 51.8 -67.9 -38.0 24.4 -10.8 -3.4 122 122 A Q H 3<5S+ 0 0 82 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.905 109.4 49.7 -61.5 -35.7 20.7 -11.0 -2.5 123 123 A Q T 3<5S- 0 0 97 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.463 113.5-122.1 -78.0 -5.4 19.9 -11.9 -6.0 124 124 A K T < 5 + 0 0 99 -3,-1.7 2,-1.3 -4,-0.4 -3,-0.2 0.750 61.7 147.4 65.7 32.0 22.6 -14.6 -5.9 125 125 A R >< + 0 0 128 -5,-2.3 4,-2.7 1,-0.2 5,-0.2 -0.665 19.0 172.0 -96.4 73.4 24.5 -13.1 -8.9 126 126 A W H > + 0 0 49 -2,-1.3 4,-1.7 2,-0.2 -1,-0.2 0.863 68.6 46.0 -54.6 -49.6 27.8 -14.2 -7.5 127 127 A D H > S+ 0 0 105 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.921 114.9 47.6 -68.5 -40.2 30.0 -13.3 -10.5 128 128 A E H > S+ 0 0 96 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.905 111.1 50.4 -67.2 -41.7 28.5 -9.9 -10.9 129 129 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.851 107.1 55.0 -64.5 -35.0 28.7 -9.1 -7.3 130 130 A A H X S+ 0 0 9 -4,-1.7 4,-0.9 2,-0.2 -1,-0.2 0.859 109.1 47.5 -64.0 -38.7 32.5 -10.1 -7.2 131 131 A V H X S+ 0 0 88 -4,-1.5 4,-0.6 1,-0.2 3,-0.5 0.953 113.8 47.5 -67.5 -45.6 33.3 -7.8 -10.0 132 132 A N H >< S+ 0 0 45 -4,-2.1 3,-0.6 1,-0.2 -2,-0.2 0.826 107.9 54.2 -63.8 -40.6 31.3 -4.9 -8.3 133 133 A L H 3< S+ 0 0 1 -4,-2.1 6,-0.4 1,-0.2 -1,-0.2 0.818 102.0 60.5 -63.5 -31.5 32.9 -5.4 -4.8 134 134 A A H 3< S+ 0 0 26 -4,-0.9 2,-1.8 -3,-0.5 -1,-0.2 0.699 85.8 78.8 -74.3 -18.3 36.4 -5.1 -6.4 135 135 A K S << S+ 0 0 146 -3,-0.6 2,-0.3 -4,-0.6 -1,-0.2 -0.434 82.4 97.4 -84.8 63.5 35.5 -1.6 -7.6 136 136 A S S > S- 0 0 20 -2,-1.8 4,-2.2 1,-0.1 5,-0.2 -0.993 84.8-116.6-150.0 159.4 36.2 -0.1 -4.1 137 137 A R H > S+ 0 0 141 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.927 116.0 61.7 -56.9 -45.5 38.7 1.7 -2.0 138 138 A W H > S+ 0 0 12 1,-0.2 4,-1.9 2,-0.2 8,-0.2 0.867 106.9 42.6 -47.5 -49.4 38.5 -1.5 0.2 139 139 A Y H 4 S+ 0 0 62 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.904 115.4 48.8 -69.6 -44.1 39.9 -3.7 -2.6 140 140 A N H < S+ 0 0 112 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.840 115.7 43.5 -64.3 -33.6 42.5 -1.2 -3.7 141 141 A Q H < S+ 0 0 98 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.829 132.2 17.9 -82.2 -38.0 43.8 -0.6 -0.2 142 142 A T S X S+ 0 0 24 -4,-1.9 4,-2.4 -5,-0.3 -1,-0.2 -0.549 73.3 163.6-135.7 68.9 43.9 -4.3 1.0 143 143 A P H > + 0 0 51 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.804 69.4 51.2 -56.9 -41.3 43.7 -6.3 -2.1 144 144 A N H > S+ 0 0 111 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.929 116.3 40.5 -70.4 -43.9 44.9 -9.8 -0.8 145 145 A R H > S+ 0 0 19 2,-0.2 4,-2.2 1,-0.1 5,-0.3 0.924 115.9 51.1 -62.1 -52.4 42.4 -9.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.4 4,-3.3 -8,-0.2 5,-0.2 0.930 109.8 51.3 -53.7 -43.5 39.5 -8.3 -0.1 147 147 A K H X S+ 0 0 83 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.865 106.7 52.5 -69.2 -26.3 40.2 -10.9 -2.8 148 148 A R H X S+ 0 0 49 -4,-1.2 4,-1.6 -3,-0.2 12,-0.2 0.921 114.5 43.1 -66.9 -46.1 40.0 -13.7 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 5,-0.2 0.924 113.1 52.5 -66.6 -43.4 36.6 -12.4 0.9 150 150 A I H X S+ 0 0 9 -4,-3.3 4,-2.3 -5,-0.3 -1,-0.2 0.916 108.1 49.2 -60.3 -44.2 35.5 -11.8 -2.6 151 151 A T H X S+ 0 0 35 -4,-2.0 4,-2.9 -5,-0.2 5,-0.4 0.861 107.0 58.6 -60.8 -35.6 36.3 -15.4 -3.7 152 152 A T H X S+ 0 0 0 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.895 110.6 40.6 -61.0 -40.4 34.4 -16.6 -0.6 153 153 A F H < S+ 0 0 2 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.826 116.1 52.0 -76.0 -35.6 31.2 -14.7 -1.9 154 154 A R H < S+ 0 0 85 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.933 124.0 22.7 -65.6 -47.0 31.9 -15.9 -5.4 155 155 A T H < S- 0 0 51 -4,-2.9 -2,-0.2 2,-0.2 -3,-0.2 0.705 83.5-135.3 -94.6 -29.9 32.3 -19.6 -4.7 156 156 A G S < S+ 0 0 18 -4,-2.1 2,-0.2 -5,-0.4 -62,-0.2 0.691 73.5 103.2 76.8 13.3 30.5 -20.3 -1.5 157 157 A T S S- 0 0 48 -6,-0.4 3,-0.3 -5,-0.1 -1,-0.3 -0.771 79.4-120.0-126.8 170.3 33.6 -22.4 -0.4 158 158 A W S > S+ 0 0 37 -2,-0.2 3,-1.7 1,-0.2 4,-0.4 0.190 73.4 118.9 -95.7 17.1 36.6 -22.0 1.9 159 159 A D T >> + 0 0 91 1,-0.3 3,-0.9 2,-0.2 4,-0.7 0.720 64.8 60.0 -52.6 -36.3 39.1 -22.4 -0.8 160 160 A A H 3> S+ 0 0 15 -3,-0.3 4,-0.6 1,-0.2 -1,-0.3 0.707 109.4 46.5 -67.4 -20.2 40.7 -18.9 -0.5 161 161 A Y H <4 S+ 0 0 4 -3,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.392 94.7 77.0-101.3 -2.2 41.6 -19.8 3.1 162 162 A K H <4 S+ 0 0 134 -3,-0.9 -2,-0.2 -4,-0.4 -1,-0.1 0.829 94.6 49.4 -72.4 -44.9 43.0 -23.3 2.3 163 163 A N H < 0 0 126 -4,-0.7 -2,-0.2 1,-0.3 -1,-0.1 0.998 360.0 360.0 -55.4 -62.2 46.1 -22.0 1.0 164 164 A L < 0 0 110 -4,-0.6 -1,-0.3 0, 0.0 -2,-0.1 0.017 360.0 360.0 -62.7 360.0 46.5 -19.8 4.0