==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-JUN-97 225L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR E.P.BALDWIN,W.A.BAASE,X.-J.ZHANG,V.FEHER,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8655.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.8 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 7.4 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 . 9 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 52.5 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 78 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 152.5 43.6 -2.0 8.9 2 2 A N > - 0 0 68 1,-0.0 4,-2.7 95,-0.0 5,-0.2 -0.885 360.0 -85.7-145.8 177.5 40.6 -0.8 10.8 3 3 A I H > S+ 0 0 22 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.846 123.2 48.6 -56.9 -42.5 38.5 2.2 11.3 4 4 A F H > S+ 0 0 74 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.923 113.2 46.8 -65.6 -42.8 40.6 3.7 14.1 5 5 A E H > S+ 0 0 104 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.903 114.1 50.3 -66.1 -37.0 43.8 3.3 12.1 6 6 A M H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.931 113.8 42.1 -63.6 -53.5 42.1 4.7 9.1 7 7 A L H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 5,-0.4 0.864 108.7 59.8 -65.4 -33.9 40.8 7.8 10.9 8 8 A R H X S+ 0 0 99 -4,-2.5 4,-1.7 -5,-0.3 -1,-0.2 0.885 107.5 47.0 -62.0 -34.4 44.0 8.2 12.7 9 9 A I H < S+ 0 0 91 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.922 115.7 44.5 -70.5 -42.5 45.8 8.6 9.3 10 10 A D H < S+ 0 0 19 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.770 125.1 29.9 -73.2 -30.5 43.2 11.0 7.9 11 11 A E H < S- 0 0 41 -4,-2.3 19,-0.4 -5,-0.2 -2,-0.2 0.661 90.7-151.1-103.3 -27.0 42.9 13.3 11.1 12 12 A G < - 0 0 24 -4,-1.7 2,-0.4 -5,-0.4 -1,-0.1 -0.117 24.2 -86.8 77.1-175.5 46.3 13.1 12.8 13 13 A L + 0 0 44 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.931 42.9 172.9-138.4 114.4 46.9 13.6 16.5 14 14 A R E -A 28 0A 135 14,-2.3 14,-2.5 -2,-0.4 4,-0.1 -0.989 18.6-165.0-126.3 126.7 47.3 17.0 18.1 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.7 12,-0.2 2,-0.3 0.396 73.9 62.7 -88.3 -1.7 47.5 17.5 21.9 16 16 A K E S-C 57 0B 104 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.939 100.8 -85.9-127.3 145.5 47.0 21.2 21.8 17 17 A I E + 0 0 22 39,-1.6 2,-0.3 -2,-0.3 10,-0.2 -0.219 58.9 171.6 -49.3 134.7 43.9 23.2 20.5 18 18 A Y E -A 26 0A 25 8,-3.1 8,-3.2 -4,-0.1 2,-0.5 -0.938 36.1-105.7-143.8 164.3 44.3 23.7 16.7 19 19 A K E -A 25 0A 126 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.833 33.3-143.2 -95.5 128.4 42.3 25.0 13.8 20 20 A D > - 0 0 49 4,-3.4 3,-1.6 -2,-0.5 -1,-0.1 0.032 43.1 -76.2 -70.7-167.6 41.0 22.4 11.5 21 21 A T T 3 S+ 0 0 97 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.713 134.1 48.4 -68.2 -19.5 40.9 23.0 7.7 22 22 A E T 3 S- 0 0 86 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.303 125.7 -99.1 -98.8 5.1 37.9 25.2 7.9 23 23 A G S < S+ 0 0 35 -3,-1.6 2,-0.3 1,-0.3 -2,-0.1 0.612 76.0 145.7 86.4 18.3 39.4 27.3 10.7 24 24 A Y - 0 0 74 1,-0.1 -4,-3.4 9,-0.0 2,-0.3 -0.689 56.6-106.7 -94.4 144.0 37.6 25.5 13.5 25 25 A Y E +AB 19 34A 33 9,-0.8 8,-3.1 -2,-0.3 9,-1.4 -0.453 53.4 159.2 -65.8 123.0 39.0 24.9 16.9 26 26 A T E -AB 18 32A 4 -8,-3.2 -8,-3.1 -2,-0.3 2,-0.3 -0.874 19.6-168.9-139.1 166.2 39.8 21.2 17.3 27 27 A I E > + B 0 31A 0 4,-1.5 4,-2.1 -2,-0.3 -12,-0.2 -0.960 51.8 4.3-154.0 163.6 41.9 18.9 19.4 28 28 A G E 4 S-A 14 0A 1 -14,-2.5 -14,-2.3 -2,-0.3 2,-0.8 -0.362 122.0 -7.8 68.4-130.2 43.1 15.3 19.5 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.739 127.5 -51.0-106.0 74.1 42.1 13.1 16.6 30 30 A G T 4 S+ 0 0 15 -2,-0.8 2,-0.9 -19,-0.4 -2,-0.2 0.752 84.1 158.7 68.0 30.4 39.8 15.3 14.7 31 31 A H E < -B 27 0A 32 -4,-2.1 -4,-1.5 1,-0.0 -1,-0.2 -0.722 34.1-142.3 -91.1 106.7 37.6 16.2 17.7 32 32 A L E -B 26 0A 70 -2,-0.9 -6,-0.3 -6,-0.2 3,-0.1 -0.401 20.0-178.7 -65.6 126.4 35.7 19.5 16.8 33 33 A L E - 0 0 15 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.894 59.9 -23.5 -91.9 -48.2 35.4 21.7 19.8 34 34 A T E -B 25 0A 26 -9,-1.4 -9,-0.8 2,-0.1 -1,-0.4 -0.977 35.6-138.5-163.4 154.0 33.5 24.6 18.5 35 35 A K S S+ 0 0 144 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.268 74.2 110.4 -95.8 4.9 32.6 26.5 15.3 36 36 A S S S- 0 0 40 2,-0.2 -11,-0.3 1,-0.1 6,-0.1 -0.674 74.8-129.6 -90.4 134.2 33.0 29.8 17.1 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.568 78.9 102.9 -54.2 -15.0 35.9 32.2 16.4 38 38 A S > - 0 0 50 1,-0.1 4,-1.8 -13,-0.0 -2,-0.2 -0.672 56.5-161.5 -88.6 123.6 36.7 32.4 20.2 39 39 A L H > S+ 0 0 67 -2,-0.5 4,-2.7 1,-0.2 5,-0.2 0.740 95.4 58.5 -67.1 -22.0 39.5 30.5 21.7 40 40 A N H > S+ 0 0 120 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.904 103.2 48.9 -74.3 -41.9 37.9 31.0 25.0 41 41 A A H > S+ 0 0 33 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.871 112.8 51.0 -61.8 -34.7 34.8 29.3 23.9 42 42 A A H X S+ 0 0 0 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.933 109.8 48.1 -67.1 -47.9 37.1 26.5 22.6 43 43 A K H X S+ 0 0 54 -4,-2.7 4,-2.0 2,-0.2 11,-0.2 0.868 111.8 50.7 -62.0 -35.7 38.9 26.3 25.9 44 44 A S H X S+ 0 0 69 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.987 109.9 49.5 -65.4 -52.9 35.6 26.1 27.8 45 45 A E H X S+ 0 0 67 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.884 109.5 53.3 -51.9 -42.8 34.3 23.4 25.5 46 46 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 5,-0.3 0.930 107.8 47.9 -62.3 -45.6 37.5 21.4 26.0 47 47 A D H X>S+ 0 0 33 -4,-2.0 4,-2.6 1,-0.2 5,-1.1 0.902 112.9 50.2 -61.5 -38.6 37.4 21.5 29.8 48 48 A K H <5S+ 0 0 142 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.830 112.3 46.5 -67.3 -37.5 33.7 20.5 29.7 49 49 A A H <5S+ 0 0 46 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.879 120.7 38.1 -73.8 -35.4 34.5 17.6 27.4 50 50 A I H <5S- 0 0 35 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.745 101.5-126.3 -87.8 -31.4 37.5 16.4 29.4 51 51 A G T <5S+ 0 0 68 -4,-2.6 2,-0.3 1,-0.3 -3,-0.2 0.735 77.1 67.2 91.2 18.0 36.2 17.0 32.8 52 52 A R S - 0 0 7 -2,-1.0 3,-1.3 -11,-0.2 -1,-0.2 0.711 32.2-146.3 -89.9 -30.3 43.0 21.6 30.6 55 55 A N T 3 S- 0 0 114 1,-0.3 -2,-0.1 -12,-0.2 -11,-0.1 0.981 73.5 -53.0 54.7 59.3 44.1 25.0 29.6 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.6 1,-0.1 2,-0.4 0.494 120.0 101.1 57.1 7.8 44.0 24.0 25.9 57 57 A V B < +C 16 0B 62 -3,-1.3 2,-0.3 -41,-0.2 -41,-0.2 -0.960 44.6 177.3-129.1 139.4 46.1 21.0 26.4 58 58 A I - 0 0 4 -43,-2.7 2,-0.2 -2,-0.4 -30,-0.1 -0.797 25.5-113.7-129.2 171.4 45.3 17.3 26.7 59 59 A T > - 0 0 63 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.600 31.4-109.2 -99.8 163.9 47.1 14.0 27.1 60 60 A K H > S+ 0 0 109 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.902 121.4 54.3 -54.9 -45.9 47.3 11.2 24.6 61 61 A D H > S+ 0 0 124 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.901 108.5 48.1 -54.9 -47.1 45.1 9.2 26.8 62 62 A E H > S+ 0 0 34 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.864 109.5 52.9 -63.4 -40.2 42.5 11.9 26.8 63 63 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -34,-0.4 0.887 108.6 50.6 -62.9 -38.9 42.7 12.2 23.0 64 64 A E H X S+ 0 0 74 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.820 107.4 53.7 -71.2 -27.9 42.1 8.5 22.6 65 65 A K H X S+ 0 0 137 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.940 109.5 46.7 -70.9 -45.6 39.1 8.7 24.9 66 66 A L H X S+ 0 0 4 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.910 112.2 52.4 -60.5 -39.1 37.5 11.4 22.9 67 67 A F H X S+ 0 0 10 -4,-2.1 4,-2.7 1,-0.2 5,-0.3 0.931 107.6 50.5 -63.5 -45.5 38.3 9.4 19.7 68 68 A N H X S+ 0 0 92 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.923 112.5 47.6 -58.9 -43.7 36.7 6.3 21.1 69 69 A Q H X S+ 0 0 102 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.905 112.3 49.0 -64.4 -41.9 33.5 8.3 22.0 70 70 A D H X S+ 0 0 36 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.889 110.4 49.1 -66.9 -38.3 33.4 10.0 18.6 71 71 A V H X S+ 0 0 9 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.951 113.5 47.2 -66.6 -44.5 33.8 6.7 16.6 72 72 A D H X S+ 0 0 84 -4,-2.0 4,-2.8 -5,-0.3 5,-0.3 0.935 111.4 51.8 -58.9 -45.3 31.0 5.1 18.7 73 73 A A H X S+ 0 0 44 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.906 109.1 49.8 -60.0 -41.6 28.9 8.1 18.2 74 74 A A H X S+ 0 0 9 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.961 112.1 47.0 -62.3 -51.6 29.3 8.0 14.4 75 75 A V H X S+ 0 0 34 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.951 114.9 45.8 -54.3 -51.4 28.4 4.3 14.2 76 76 A R H X S+ 0 0 111 -4,-2.8 4,-1.2 1,-0.2 -1,-0.2 0.901 110.7 55.0 -62.4 -36.3 25.3 4.8 16.4 77 77 A G H >X S+ 0 0 1 -4,-2.4 4,-1.1 -5,-0.3 3,-0.6 0.947 108.8 46.8 -61.1 -46.5 24.4 7.8 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.7 3,-0.9 1,-0.2 7,-0.4 0.947 110.6 53.1 -58.0 -46.8 24.5 5.9 11.1 79 79 A L H 3< S+ 0 0 67 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.684 111.9 44.8 -66.8 -18.0 22.5 3.1 12.6 80 80 A R H << S+ 0 0 176 -4,-1.2 2,-0.6 -3,-0.6 -1,-0.3 0.533 91.2 99.6 -96.8 -17.5 19.8 5.4 13.8 81 81 A N S+ 0 0 0 -6,-0.2 4,-2.6 -7,-0.2 3,-0.3 0.842 99.9 68.4 -85.6 -37.6 22.1 5.9 6.3 85 85 A K H X S+ 0 0 81 -4,-3.1 4,-3.2 -7,-0.4 5,-0.2 0.904 98.4 48.8 -51.2 -53.0 21.2 2.6 7.9 86 86 A P H > S+ 0 0 49 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.870 112.9 49.6 -59.1 -36.1 20.1 0.7 4.8 87 87 A V H > S+ 0 0 3 -4,-0.5 4,-0.7 -3,-0.3 3,-0.3 0.969 112.3 47.4 -64.9 -51.2 23.1 1.8 2.9 88 88 A Y H >< S+ 0 0 34 -4,-2.6 3,-1.5 1,-0.3 -1,-0.2 0.933 111.2 51.2 -53.7 -49.6 25.3 0.7 5.8 89 89 A D H 3< S+ 0 0 79 -4,-3.2 -1,-0.3 1,-0.3 -2,-0.2 0.796 107.1 55.1 -61.3 -32.1 23.5 -2.6 6.0 90 90 A S H 3< S+ 0 0 34 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.595 95.2 89.6 -77.9 -12.1 24.0 -3.2 2.3 91 91 A L S << S- 0 0 7 -3,-1.5 31,-0.0 -4,-0.7 2,-0.0 -0.588 73.1-119.4 -94.4 158.2 27.8 -2.7 2.4 92 92 A D > - 0 0 56 -2,-0.2 4,-1.8 1,-0.0 5,-0.2 -0.143 46.2 -89.6 -74.7 171.2 30.7 -5.1 2.9 93 93 A A H > S+ 0 0 76 2,-0.2 4,-1.4 1,-0.2 -2,-0.1 0.883 121.2 45.3 -57.1 -46.2 33.2 -4.5 5.8 94 94 A V H > S+ 0 0 25 62,-0.2 4,-1.6 1,-0.2 3,-0.4 0.947 112.7 49.9 -66.2 -48.0 35.7 -2.2 4.1 95 95 A R H > S+ 0 0 23 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.853 103.9 60.8 -60.1 -32.2 33.1 0.1 2.5 96 96 A R H X S+ 0 0 77 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.919 101.7 53.6 -59.6 -42.1 31.3 0.4 5.8 97 97 A C H X S+ 0 0 19 -4,-1.4 4,-2.7 -3,-0.4 -1,-0.2 0.911 104.2 54.9 -57.8 -42.2 34.5 1.9 7.2 98 98 A A H X S+ 0 0 0 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.899 108.7 48.1 -60.4 -38.3 34.5 4.5 4.4 99 99 A L H X S+ 0 0 1 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.893 109.7 52.4 -69.2 -37.6 30.9 5.5 5.3 100 100 A I H X S+ 0 0 9 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.940 107.0 54.8 -63.9 -40.3 31.9 5.7 9.0 101 101 A N H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.929 107.9 47.3 -55.3 -50.2 34.8 8.0 8.0 102 102 A M H X S+ 0 0 11 -4,-1.9 4,-3.2 1,-0.2 5,-0.4 0.933 111.5 50.1 -60.1 -46.4 32.7 10.5 6.2 103 103 A V H X S+ 0 0 9 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.878 109.0 52.3 -60.3 -38.0 30.1 10.7 9.0 104 104 A F H < S+ 0 0 30 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.922 116.2 42.3 -63.5 -40.7 32.9 11.3 11.5 105 105 A Q H < S+ 0 0 59 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.880 134.0 11.4 -73.8 -46.6 34.2 14.1 9.3 106 106 A M H X S- 0 0 54 -4,-3.2 4,-0.7 -5,-0.2 -3,-0.2 0.461 101.4-114.9-122.3 4.5 31.0 15.8 8.2 107 107 A G H X - 0 0 27 -4,-2.2 4,-2.5 -5,-0.4 5,-0.2 0.150 37.0 -74.2 80.8 158.6 28.2 14.5 10.3 108 108 A E H > S+ 0 0 54 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.816 128.8 53.1 -55.9 -43.1 25.1 12.5 9.4 109 109 A T H > S+ 0 0 125 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.942 109.1 48.1 -62.6 -49.9 23.4 15.4 7.9 110 110 A G H >< S+ 0 0 31 -4,-0.7 3,-1.1 1,-0.2 4,-0.3 0.938 116.1 43.1 -58.5 -50.8 26.2 16.2 5.6 111 111 A V H >< S+ 0 0 1 -4,-2.5 3,-2.2 1,-0.3 -1,-0.2 0.918 106.3 61.4 -63.8 -40.0 26.6 12.6 4.5 112 112 A A H 3< S+ 0 0 14 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.741 94.1 68.0 -58.1 -20.0 22.9 12.2 4.2 113 113 A G T << S+ 0 0 56 -3,-1.1 2,-1.8 -4,-0.9 3,-0.3 0.626 75.4 83.1 -73.3 -15.9 23.1 15.0 1.5 114 114 A F <> + 0 0 36 -3,-2.2 4,-3.1 -4,-0.3 5,-0.3 -0.203 58.0 155.0 -85.9 54.9 25.0 12.8 -1.0 115 115 A T H > + 0 0 80 -2,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.881 67.0 42.5 -47.0 -54.6 21.7 11.4 -2.1 116 116 A N H > S+ 0 0 83 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.934 115.5 49.0 -66.2 -42.9 22.7 10.3 -5.5 117 117 A S H > S+ 0 0 13 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.890 110.8 51.4 -61.0 -43.1 26.0 8.8 -4.4 118 118 A L H X S+ 0 0 17 -4,-3.1 4,-2.3 2,-0.2 -1,-0.2 0.912 109.0 51.5 -62.6 -40.3 24.3 6.9 -1.6 119 119 A R H X S+ 0 0 117 -4,-2.1 4,-1.6 -5,-0.3 -2,-0.2 0.938 110.4 47.3 -63.9 -41.6 21.8 5.5 -4.0 120 120 A M H <>S+ 0 0 25 -4,-2.2 5,-2.0 2,-0.2 4,-0.4 0.909 109.1 54.4 -66.2 -39.4 24.5 4.3 -6.3 121 121 A L H ><5S+ 0 0 9 -4,-2.6 3,-1.6 1,-0.3 -1,-0.2 0.934 107.1 52.5 -56.6 -42.7 26.4 2.8 -3.4 122 122 A Q H 3<5S+ 0 0 96 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.861 107.6 50.2 -64.9 -29.5 23.3 0.9 -2.6 123 123 A Q T 3<5S- 0 0 92 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.402 112.6-118.7 -89.9 6.6 23.1 -0.3 -6.2 124 124 A K T < 5 + 0 0 100 -3,-1.6 2,-1.2 -4,-0.4 -3,-0.2 0.753 66.6 143.3 62.3 29.9 26.7 -1.5 -6.1 125 125 A R >< + 0 0 109 -5,-2.0 4,-2.2 1,-0.2 5,-0.2 -0.653 21.4 171.4 -97.2 70.8 27.6 0.8 -9.0 126 126 A W H > + 0 0 46 -2,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.885 67.2 47.2 -53.6 -52.0 31.0 1.6 -7.5 127 127 A D H > S+ 0 0 107 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.918 112.9 49.7 -63.1 -39.7 32.6 3.5 -10.4 128 128 A E H > S+ 0 0 103 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.915 108.8 52.0 -66.5 -39.7 29.6 5.7 -10.8 129 129 A A H X S+ 0 0 8 -4,-2.2 4,-3.1 1,-0.2 -1,-0.2 0.914 107.9 52.8 -60.3 -42.1 29.4 6.5 -7.2 130 130 A A H X S+ 0 0 15 -4,-2.0 4,-1.0 1,-0.2 -1,-0.2 0.863 110.2 47.0 -63.5 -38.1 33.0 7.6 -7.1 131 131 A V H < S+ 0 0 89 -4,-1.9 4,-0.4 -5,-0.2 3,-0.2 0.932 114.7 46.2 -72.0 -41.9 32.6 9.9 -10.0 132 132 A N H >< S+ 0 0 42 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.918 109.6 53.2 -66.1 -43.3 29.4 11.5 -8.5 133 133 A G H 3< S+ 0 0 7 -4,-3.1 6,-0.3 1,-0.3 -1,-0.2 0.798 99.2 65.6 -63.8 -22.9 30.9 11.9 -5.0 134 134 A A T 3< S+ 0 0 27 -4,-1.0 2,-1.7 -3,-0.2 -1,-0.3 0.685 83.8 78.4 -73.0 -17.3 33.9 13.7 -6.5 135 135 A K S < S+ 0 0 159 -3,-1.5 2,-0.3 -4,-0.4 -1,-0.2 -0.512 79.7 97.5 -90.3 72.4 31.6 16.5 -7.6 136 136 A S S > S- 0 0 18 -2,-1.7 4,-2.0 1,-0.1 5,-0.2 -0.993 83.5-115.5-157.2 155.8 31.3 18.1 -4.2 137 137 A R H > S+ 0 0 157 -2,-0.3 4,-2.6 1,-0.2 5,-0.3 0.902 115.3 62.2 -56.3 -43.3 32.6 20.8 -2.1 138 138 A W H > S+ 0 0 21 1,-0.2 4,-2.0 2,-0.2 8,-0.2 0.925 106.2 44.5 -48.6 -50.4 34.0 18.1 0.2 139 139 A Y H 4 S+ 0 0 52 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.889 114.0 48.9 -64.3 -42.2 36.2 16.8 -2.6 140 140 A N H < S+ 0 0 109 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.771 113.1 47.0 -71.4 -27.2 37.4 20.2 -3.7 141 141 A Q H < S+ 0 0 93 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.837 130.5 16.7 -82.4 -37.6 38.2 21.3 -0.1 142 142 A T S X S+ 0 0 24 -4,-2.0 4,-2.5 -5,-0.3 -1,-0.2 -0.593 73.7 165.7-135.4 67.7 40.2 18.2 1.0 143 143 A P H > S+ 0 0 50 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.856 71.8 51.6 -54.9 -45.7 41.0 16.4 -2.2 144 144 A N H > S+ 0 0 116 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.938 115.0 41.0 -62.0 -47.3 43.6 14.0 -0.8 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.2 1,-0.2 3,-0.3 0.963 116.1 51.5 -63.3 -49.8 41.5 12.7 2.0 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.900 107.6 52.4 -53.1 -45.6 38.5 12.6 -0.3 147 147 A K H X S+ 0 0 88 -4,-3.2 4,-2.3 1,-0.2 -1,-0.2 0.874 108.3 51.2 -61.2 -36.9 40.4 10.6 -2.9 148 148 A R H X S+ 0 0 68 -4,-1.6 4,-1.5 -3,-0.3 -1,-0.2 0.918 113.4 43.3 -66.8 -42.9 41.4 8.1 -0.3 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.897 114.0 52.1 -68.3 -38.3 37.8 7.6 0.9 150 150 A I H X S+ 0 0 19 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.893 108.1 49.9 -64.1 -41.5 36.5 7.5 -2.6 151 151 A T H X S+ 0 0 38 -4,-2.3 4,-2.8 2,-0.2 6,-0.4 0.842 108.4 53.9 -65.0 -35.9 39.0 4.8 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.922 111.9 44.3 -64.1 -43.5 38.0 2.7 -0.6 153 153 A F H < S+ 0 0 19 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.895 115.8 49.1 -66.1 -42.1 34.3 3.0 -1.7 154 154 A R H < S+ 0 0 97 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.912 125.8 23.0 -65.3 -43.8 35.3 2.2 -5.3 155 155 A T H < S- 0 0 43 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.617 85.0-135.1-101.8 -18.7 37.5 -0.8 -4.6 156 156 A G S < S+ 0 0 16 -4,-2.7 2,-0.3 -5,-0.3 -62,-0.2 0.696 73.9 102.0 69.9 14.8 36.4 -2.3 -1.3 157 157 A T S S- 0 0 47 -6,-0.4 3,-0.4 -5,-0.2 -1,-0.3 -0.798 79.6-121.4-124.3 171.8 40.1 -2.6 -0.4 158 158 A W S >> S+ 0 0 39 -2,-0.3 3,-2.4 1,-0.2 4,-0.6 0.176 70.9 122.0 -96.4 15.2 42.5 -0.6 1.9 159 159 A D G >4 + 0 0 94 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.842 66.3 59.5 -47.0 -38.1 44.8 0.1 -0.9 160 160 A A G 34 S+ 0 0 34 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.682 109.1 46.1 -67.0 -18.0 44.6 3.9 -0.5 161 161 A Y G <4 0 0 21 -3,-2.4 -1,-0.3 -13,-0.1 -2,-0.2 0.392 360.0 360.0-105.9 -1.9 45.8 3.6 3.0 162 162 A K << 0 0 172 -3,-1.3 -2,-0.1 -4,-0.6 -3,-0.1 0.716 360.0 360.0-113.5 360.0 48.7 1.3 2.4