==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-NOV-05 2F47 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.S.YOUSEF,N.BISCHOFF,C.M.DYER,W.A.BAASE,B.W.MATTHEWS . 175 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9587.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 126 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 . 13 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 1.1 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 . 7 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 52.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.7 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 2 0 1 2 1 0 0 0 1 1 0 0 0 0 1 0 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 1 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 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 61 0, 0.0 2,-0.3 0, 0.0 168,-0.0 0.000 360.0 360.0 360.0 148.6 40.3 -38.5 -40.6 2 2 A N > - 0 0 67 167,-0.0 4,-2.7 106,-0.0 5,-0.2 -0.926 360.0 -79.2-160.7 174.4 41.2 -35.2 -42.3 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.843 126.5 50.5 -56.5 -37.0 39.6 -31.9 -42.9 4 4 A F H > S+ 0 0 76 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.957 113.5 43.4 -67.3 -47.7 37.4 -33.1 -45.8 5 5 A E H > S+ 0 0 99 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.883 114.4 52.8 -64.7 -34.6 36.1 -36.1 -43.9 6 6 A M H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.951 112.6 42.1 -66.4 -48.9 35.5 -33.9 -40.8 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.4 0.833 108.8 59.3 -69.8 -29.5 33.5 -31.3 -42.7 8 8 A R H X S+ 0 0 105 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.908 108.6 46.6 -64.6 -37.5 31.6 -33.9 -44.7 9 9 A I H < S+ 0 0 49 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.951 117.2 42.0 -67.2 -45.7 30.4 -35.2 -41.3 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.820 124.0 35.0 -72.5 -30.6 29.5 -31.8 -39.9 11 11 A E H < S- 0 0 33 -4,-2.9 19,-0.5 -5,-0.2 -1,-0.2 0.716 91.5-155.7 -97.9 -21.8 27.9 -30.4 -43.1 12 12 A G < - 0 0 22 -4,-1.9 2,-0.4 -5,-0.4 -1,-0.1 -0.210 25.6 -87.4 72.5-170.8 26.2 -33.5 -44.5 13 13 A L + 0 0 45 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.943 44.6 171.1-143.2 115.8 25.4 -33.8 -48.2 14 14 A R E -A 28 0A 141 14,-1.9 14,-2.5 -2,-0.4 4,-0.1 -0.996 20.4-160.0-130.6 129.3 22.2 -32.6 -49.7 15 15 A L E S+ 0 0 72 -2,-0.4 54,-2.3 12,-0.2 2,-0.3 0.476 74.5 57.7 -89.5 -0.6 21.6 -32.4 -53.5 16 16 A K E S-C 68 0B 91 52,-0.2 52,-0.2 12,-0.1 12,-0.1 -0.928 98.3 -87.6-127.4 150.1 18.8 -29.9 -53.4 17 17 A I E + 0 0 27 50,-1.7 2,-0.3 -2,-0.3 10,-0.2 -0.299 53.1 170.2 -56.0 135.1 18.7 -26.3 -52.0 18 18 A Y E -A 26 0A 38 8,-2.7 8,-3.3 -4,-0.1 2,-0.5 -0.881 33.3-110.6-139.2 169.5 17.7 -26.2 -48.3 19 19 A K E -A 25 0A 102 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.908 28.6-148.6-107.6 133.8 17.7 -23.5 -45.6 20 20 A D > - 0 0 54 4,-2.4 3,-2.1 -2,-0.5 5,-0.0 -0.342 36.0 -90.2 -91.5 179.1 20.1 -23.8 -42.7 21 21 A T T 3 S+ 0 0 93 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.747 125.2 56.7 -64.7 -19.7 19.6 -22.6 -39.1 22 22 A E T 3 S- 0 0 79 2,-0.1 -1,-0.3 13,-0.0 -3,-0.0 0.436 122.2-104.3 -90.3 3.4 20.9 -19.2 -39.8 23 23 A G S < S+ 0 0 21 -3,-2.1 13,-2.4 1,-0.3 2,-0.4 0.653 74.4 140.2 86.0 15.5 18.4 -18.7 -42.6 24 24 A Y E - B 0 35A 67 11,-0.2 -4,-2.4 9,-0.0 2,-0.3 -0.790 55.6-124.8 -97.8 134.3 20.8 -19.2 -45.5 25 25 A Y E +AB 19 34A 12 9,-3.3 8,-3.0 -2,-0.4 9,-0.7 -0.599 45.2 174.3 -69.3 136.3 19.8 -21.1 -48.6 26 26 A T E -AB 18 32A 4 -8,-3.3 -8,-2.7 -2,-0.3 2,-0.3 -0.912 17.1-176.9-143.6 161.7 22.5 -23.8 -48.9 27 27 A I E > + B 0 31A 0 4,-1.7 4,-2.5 -2,-0.3 2,-0.2 -0.971 50.7 8.4-156.9 164.7 23.3 -26.9 -51.0 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.9 -2,-0.3 2,-0.8 -0.411 123.2 -10.9 68.7-128.0 25.8 -29.7 -51.3 29 29 A I T 4 S- 0 0 5 45,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.739 128.9 -48.9-108.8 77.9 28.3 -30.0 -48.4 30 30 A G T 4 S+ 0 0 14 -2,-0.8 2,-0.9 -19,-0.5 -2,-0.2 0.798 83.4 163.0 66.5 30.0 27.6 -26.7 -46.6 31 31 A H E < -B 27 0A 28 -4,-2.5 -4,-1.7 -20,-0.1 -1,-0.2 -0.735 30.1-143.9 -86.6 109.9 27.8 -24.5 -49.7 32 32 A L E +B 26 0A 88 -2,-0.9 -6,-0.2 -6,-0.2 3,-0.1 -0.481 25.7 171.0 -73.7 136.0 26.1 -21.2 -48.7 33 33 A L E - 0 0 10 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.799 51.4 -40.3-107.0 -69.7 24.1 -19.5 -51.5 34 34 A T E -B 25 0A 29 -9,-0.7 -9,-3.3 -11,-0.0 -1,-0.4 -0.960 60.8 -82.9-156.0 169.0 22.0 -16.5 -50.2 35 35 A K E -B 24 0A 149 -2,-0.3 -11,-0.2 -11,-0.2 -12,-0.1 -0.497 38.2-136.7 -79.1 150.1 19.8 -15.3 -47.3 36 36 A S - 0 0 26 -13,-2.4 3,-0.1 -2,-0.2 10,-0.1 -0.701 19.5-117.8-102.0 157.8 16.2 -16.2 -47.1 37 37 A P - 0 0 30 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 -0.081 50.4 -59.2 -82.1-171.3 13.4 -13.8 -46.2 38 38 A S - 0 0 79 1,-0.1 8,-0.0 4,-0.0 -15,-0.0 -0.321 49.3-111.5 -67.4 152.8 11.0 -14.0 -43.2 39 39 A I S S+ 0 0 145 1,-0.2 -1,-0.1 -3,-0.1 7,-0.0 0.659 125.6 39.0 -60.1 -9.8 8.8 -17.1 -43.0 40 40 A N S S+ 0 0 136 2,-0.0 -1,-0.2 6,-0.0 6,-0.2 0.816 79.4 129.4-102.5 -50.0 6.2 -14.5 -43.7 41 41 A A S >S- 0 0 21 4,-0.1 5,-0.5 3,-0.1 0, 0.0 0.306 77.0 -75.3 -16.0 107.1 7.9 -12.2 -46.2 42 42 A A T >5 - 0 0 61 3,-0.2 4,-2.5 1,-0.1 5,-0.2 0.576 37.8-104.3 -9.0 149.0 5.3 -12.0 -49.1 43 43 A K H >5S+ 0 0 181 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.861 126.1 47.1 -50.3 -40.9 4.5 -14.6 -51.6 44 44 A S H >5S+ 0 0 86 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.943 107.9 55.4 -67.5 -50.0 6.5 -12.6 -54.1 45 45 A E H >5S+ 0 0 79 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.880 106.4 51.8 -48.9 -47.7 9.4 -12.1 -51.7 46 46 A L H XS+ 0 0 39 -4,-2.4 4,-2.8 1,-0.2 5,-1.1 0.893 110.8 50.8 -61.2 -39.0 23.9 -21.6 -61.5 59 59 A K H <5S+ 0 0 141 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.902 112.0 47.5 -64.8 -41.0 26.7 -19.1 -61.4 60 60 A A H <5S+ 0 0 41 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.877 120.0 36.7 -69.8 -38.0 28.8 -21.4 -59.2 61 61 A I H <5S- 0 0 39 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.787 100.4-129.1 -84.6 -31.7 28.2 -24.5 -61.2 62 62 A G T <5S+ 0 0 70 -4,-2.8 2,-0.3 1,-0.4 -3,-0.2 0.744 76.9 80.3 86.8 23.6 28.3 -22.8 -64.6 63 63 A A S - 0 0 18 -2,-1.1 3,-1.2 -11,-0.3 -1,-0.2 0.687 34.5-144.3 -91.0 -23.5 20.7 -26.4 -62.4 66 66 A N T 3 S- 0 0 98 1,-0.2 3,-0.1 -12,-0.2 -12,-0.1 0.789 74.0 -55.7 60.3 27.4 17.2 -25.5 -61.3 67 67 A G T 3 S+ 0 0 0 -13,-0.2 -50,-1.7 1,-0.2 2,-0.4 0.626 117.5 100.5 84.8 13.1 18.3 -25.9 -57.6 68 68 A V B < +C 16 0B 74 -3,-1.2 2,-0.3 -52,-0.2 -52,-0.2 -0.998 43.6 178.5-135.0 134.7 19.6 -29.5 -57.9 69 69 A I - 0 0 5 -54,-2.3 2,-0.1 -2,-0.4 -41,-0.1 -0.855 26.5-111.6-130.2 167.2 23.2 -30.7 -58.3 70 70 A T > - 0 0 72 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.461 34.4-106.9 -90.6 168.3 25.0 -34.1 -58.5 71 71 A K H > S+ 0 0 117 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.912 121.6 54.2 -61.7 -41.4 27.3 -35.5 -55.9 72 72 A D H > S+ 0 0 122 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.908 109.3 47.9 -59.1 -44.4 30.3 -34.8 -58.1 73 73 A E H > S+ 0 0 60 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.907 109.6 52.3 -64.2 -40.8 29.2 -31.1 -58.4 74 74 A A H X S+ 0 0 1 -4,-2.4 4,-2.0 1,-0.2 -45,-0.4 0.910 109.6 50.1 -62.6 -37.3 28.7 -30.9 -54.6 75 75 A E H X S+ 0 0 74 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.837 108.1 53.3 -70.4 -31.4 32.3 -32.3 -54.1 76 76 A K H X S+ 0 0 132 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.942 110.4 45.3 -68.3 -45.7 33.7 -29.7 -56.6 77 77 A L H X S+ 0 0 2 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.897 112.8 53.9 -63.4 -35.6 32.1 -26.8 -54.7 78 78 A F H X S+ 0 0 12 -4,-2.0 4,-2.5 -5,-0.2 5,-0.3 0.925 106.7 49.6 -64.7 -43.8 33.3 -28.4 -51.5 79 79 A N H X S+ 0 0 91 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.933 113.8 47.1 -60.9 -43.2 37.0 -28.6 -52.7 80 80 A Q H X S+ 0 0 88 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.910 112.8 48.9 -63.0 -41.3 36.7 -24.9 -53.7 81 81 A D H X S+ 0 0 37 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.836 110.6 48.4 -70.9 -33.7 35.2 -24.0 -50.3 82 82 A V H X S+ 0 0 5 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.933 112.3 50.4 -69.0 -43.8 37.8 -25.8 -48.2 83 83 A D H X S+ 0 0 88 -4,-2.2 4,-2.9 -5,-0.3 5,-0.2 0.937 110.8 50.0 -57.6 -47.0 40.5 -24.2 -50.3 84 84 A A H X S+ 0 0 39 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.872 108.0 52.3 -61.6 -37.1 38.9 -20.8 -49.7 85 85 A A H X S+ 0 0 6 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.921 112.2 45.1 -65.8 -43.5 38.7 -21.3 -46.0 86 86 A V H X S+ 0 0 34 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.938 113.4 50.1 -65.0 -46.2 42.4 -22.2 -45.8 87 87 A R H X S+ 0 0 149 -4,-2.9 4,-1.6 -5,-0.2 -2,-0.2 0.901 108.7 53.6 -59.4 -37.7 43.3 -19.2 -48.0 88 88 A G H X S+ 0 0 3 -4,-2.4 4,-0.5 -5,-0.2 -1,-0.2 0.875 108.6 48.5 -63.4 -40.2 41.1 -17.0 -45.8 89 89 A I H >< S+ 0 0 0 -4,-1.8 3,-1.2 1,-0.2 7,-0.4 0.944 111.0 50.4 -64.8 -48.6 43.0 -18.1 -42.7 90 90 A L H 3< S+ 0 0 77 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.763 111.4 47.3 -67.3 -23.4 46.4 -17.5 -44.3 91 91 A R H 3< S+ 0 0 187 -4,-1.6 2,-0.5 -5,-0.2 -1,-0.3 0.511 94.1 93.0 -93.2 -4.1 45.6 -14.0 -45.5 92 92 A N S+ 0 0 116 2,-0.1 4,-0.7 3,-0.1 -1,-0.2 0.833 119.0 41.3 -91.8 -37.3 44.7 -12.6 -36.7 95 95 A L H > S+ 0 0 0 -7,-0.2 4,-2.9 2,-0.1 5,-0.2 0.866 103.3 65.1 -80.4 -35.7 44.0 -16.1 -37.8 96 96 A K H X S+ 0 0 95 -4,-2.7 4,-3.1 -7,-0.4 5,-0.3 0.938 100.9 48.6 -57.4 -50.5 47.3 -16.9 -39.5 97 97 A P H > S+ 0 0 52 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.867 114.0 47.3 -59.8 -33.1 49.5 -16.7 -36.4 98 98 A V H >X S+ 0 0 4 -4,-0.7 4,-0.9 -3,-0.2 3,-0.6 0.958 112.5 48.9 -69.2 -48.9 47.1 -19.0 -34.5 99 99 A Y H >< S+ 0 0 35 -4,-2.9 3,-1.2 1,-0.3 -3,-0.2 0.931 110.3 51.7 -54.7 -46.3 46.9 -21.5 -37.4 100 100 A D H 3< S+ 0 0 78 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.795 106.9 54.1 -64.4 -26.7 50.7 -21.6 -37.6 101 101 A S H << S+ 0 0 32 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.642 97.2 86.8 -80.5 -14.9 51.0 -22.3 -33.9 102 102 A L S << S- 0 0 6 -3,-1.2 2,-0.1 -4,-0.9 31,-0.0 -0.501 76.3-118.8 -91.4 158.6 48.6 -25.3 -34.1 103 103 A D > - 0 0 55 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.346 44.9 -91.6 -80.7 168.2 49.2 -29.0 -34.8 104 104 A A H > S+ 0 0 78 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.819 123.2 49.1 -54.8 -41.2 47.5 -30.6 -37.8 105 105 A V H > S+ 0 0 24 62,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.924 114.2 44.7 -68.9 -44.1 44.4 -31.8 -36.0 106 106 A R H > S+ 0 0 23 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.825 107.2 60.0 -70.8 -28.1 43.8 -28.5 -34.3 107 107 A R H X S+ 0 0 82 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.910 103.8 52.5 -62.0 -39.9 44.4 -26.7 -37.6 108 108 A A H X S+ 0 0 6 -4,-1.6 4,-2.6 1,-0.2 -1,-0.2 0.879 105.1 54.0 -63.3 -39.3 41.5 -28.7 -39.0 109 109 A A H X S+ 0 0 0 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.891 109.4 48.0 -62.8 -36.9 39.3 -27.6 -36.2 110 110 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.914 110.6 50.6 -70.5 -38.6 40.1 -23.9 -37.1 111 111 A I H X S+ 0 0 8 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.933 107.5 56.1 -63.0 -39.2 39.4 -24.5 -40.8 112 112 A N H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.934 108.2 46.4 -57.9 -46.1 36.1 -26.1 -39.7 113 113 A M H X S+ 0 0 3 -4,-1.9 4,-3.1 1,-0.2 5,-0.3 0.896 112.9 49.0 -63.0 -42.8 35.1 -23.0 -37.9 114 114 A V H X S+ 0 0 6 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.873 109.0 53.4 -66.1 -34.8 36.1 -20.7 -40.8 115 115 A F H < S+ 0 0 27 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.909 116.4 39.1 -65.6 -41.4 34.2 -22.9 -43.2 116 116 A Q H < S+ 0 0 56 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.929 133.5 18.8 -75.2 -42.5 31.1 -22.5 -41.1 117 117 A M H < S- 0 0 57 -4,-3.1 4,-0.4 -5,-0.2 -3,-0.2 0.517 104.2-115.7-111.0 -6.6 31.3 -18.9 -40.0 118 118 A G X - 0 0 32 -4,-2.3 4,-2.2 -5,-0.3 5,-0.3 0.177 33.4 -76.6 84.1 155.6 33.7 -17.2 -42.4 119 119 A E H > S+ 0 0 35 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.913 127.8 47.5 -50.3 -57.3 37.1 -15.6 -42.0 120 120 A T H > S+ 0 0 117 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.893 110.5 52.4 -59.6 -38.9 35.9 -12.4 -40.4 121 121 A G H >4 S+ 0 0 36 -4,-0.4 3,-0.8 1,-0.2 4,-0.2 0.945 113.7 41.1 -63.4 -46.9 33.5 -14.1 -38.0 122 122 A V H >< S+ 0 0 1 -4,-2.2 3,-2.1 1,-0.2 -1,-0.2 0.872 107.3 61.9 -70.8 -34.9 36.2 -16.4 -36.6 123 123 A A H 3< S+ 0 0 8 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.718 96.0 64.2 -62.8 -18.4 38.8 -13.7 -36.5 124 124 A G T << S+ 0 0 49 -3,-0.8 2,-2.3 -4,-0.8 -1,-0.3 0.595 73.6 90.6 -80.3 -12.3 36.5 -11.9 -34.1 125 125 A F <> + 0 0 43 -3,-2.1 4,-2.6 -4,-0.2 5,-0.3 -0.308 55.0 161.4 -79.0 57.7 36.9 -14.7 -31.4 126 126 A T H > + 0 0 71 -2,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.843 65.3 44.7 -50.6 -47.3 39.8 -12.7 -30.0 127 127 A N H > S+ 0 0 84 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.894 114.4 48.0 -69.1 -38.5 39.9 -14.2 -26.5 128 128 A S H > S+ 0 0 1 -3,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.905 110.3 53.1 -67.8 -41.3 39.5 -17.8 -27.7 129 129 A L H X S+ 0 0 13 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.902 108.0 50.4 -61.4 -40.4 42.2 -17.3 -30.4 130 130 A R H X S+ 0 0 110 -4,-1.8 4,-1.8 -5,-0.3 -1,-0.2 0.922 110.5 49.1 -65.4 -41.5 44.6 -16.0 -27.8 131 131 A M H <>S+ 0 0 23 -4,-1.9 5,-2.5 1,-0.2 -2,-0.2 0.889 110.9 50.6 -64.1 -39.7 44.0 -19.0 -25.5 132 132 A L H ><5S+ 0 0 2 -4,-2.5 3,-1.6 1,-0.2 -1,-0.2 0.922 109.1 50.4 -60.6 -46.5 44.5 -21.4 -28.5 133 133 A Q H 3<5S+ 0 0 89 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.833 111.4 49.7 -60.9 -31.5 47.8 -19.6 -29.3 134 134 A Q T 3<5S- 0 0 97 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.424 112.1-123.8 -86.5 0.9 48.8 -20.0 -25.6 135 135 A K T < 5 + 0 0 101 -3,-1.6 2,-1.5 1,-0.2 -3,-0.2 0.790 62.1 146.3 57.4 32.7 47.9 -23.8 -25.8 136 136 A R >< + 0 0 122 -5,-2.5 4,-2.6 1,-0.2 5,-0.2 -0.598 20.4 170.8 -94.0 73.1 45.5 -23.3 -22.9 137 137 A W H > + 0 0 47 -2,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.893 68.8 46.1 -57.9 -50.4 43.1 -25.9 -24.4 138 138 A D H > S+ 0 0 96 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.899 115.1 47.9 -63.5 -39.7 40.7 -26.3 -21.5 139 139 A E H > S+ 0 0 94 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.904 112.1 49.9 -64.6 -41.8 40.3 -22.6 -21.1 140 140 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.920 109.2 53.0 -62.4 -43.4 39.9 -22.1 -24.8 141 141 A A H X S+ 0 0 9 -4,-2.7 4,-1.2 -5,-0.2 -1,-0.2 0.891 110.0 46.6 -59.3 -41.6 37.2 -24.8 -24.8 142 142 A V H < S+ 0 0 87 -4,-2.0 4,-0.5 1,-0.2 3,-0.2 0.927 114.8 47.6 -66.8 -42.1 35.2 -23.1 -22.0 143 143 A N H >< S+ 0 0 44 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.884 106.4 56.4 -67.7 -39.4 35.5 -19.8 -23.8 144 144 A L H 3< S+ 0 0 2 -4,-2.9 6,-0.4 1,-0.2 -1,-0.2 0.835 101.3 58.2 -62.2 -31.9 34.4 -21.1 -27.2 145 145 A A T 3< S+ 0 0 30 -4,-1.2 2,-1.9 -3,-0.2 -1,-0.2 0.656 85.2 81.2 -73.2 -15.5 31.2 -22.5 -25.8 146 146 A K S < S+ 0 0 156 -3,-1.1 2,-0.3 -4,-0.5 -1,-0.2 -0.503 82.5 97.3 -87.8 67.9 30.1 -19.0 -24.6 147 147 A S S > S- 0 0 18 -2,-1.9 4,-2.3 1,-0.1 5,-0.2 -0.998 84.6-119.8-155.2 155.1 28.9 -18.1 -28.0 148 148 A R H > S+ 0 0 148 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.897 115.6 62.1 -60.5 -37.6 25.9 -17.9 -30.3 149 149 A W H > S+ 0 0 16 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.958 107.2 41.2 -51.3 -53.1 27.8 -20.4 -32.5 150 150 A Y H 4 S+ 0 0 63 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.921 115.3 50.9 -63.7 -43.4 27.7 -23.0 -29.7 151 151 A N H < S+ 0 0 116 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.866 114.3 43.3 -65.0 -36.8 24.1 -22.2 -28.7 152 152 A Q H < S+ 0 0 77 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.836 132.3 18.3 -78.4 -36.5 22.9 -22.5 -32.3 153 153 A T S X S+ 0 0 32 -4,-2.3 4,-2.7 -5,-0.3 -1,-0.2 -0.533 74.6 160.8-133.5 70.0 24.8 -25.7 -33.4 154 154 A P H > S+ 0 0 51 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.846 70.4 51.9 -61.6 -40.0 25.8 -27.3 -30.1 155 155 A N H > S+ 0 0 117 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.936 116.1 41.2 -66.5 -42.1 26.5 -30.8 -31.3 156 156 A R H > S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.929 115.4 50.2 -69.9 -42.9 28.8 -29.6 -34.0 157 157 A A H X S+ 0 0 0 -4,-2.7 4,-3.2 1,-0.2 5,-0.2 0.901 107.5 55.4 -63.2 -38.0 30.4 -27.0 -31.8 158 158 A K H X S+ 0 0 92 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.895 107.9 48.3 -61.1 -38.8 31.0 -29.6 -29.2 159 159 A R H X S+ 0 0 55 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.917 114.5 45.3 -67.8 -43.0 32.9 -31.8 -31.6 160 160 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.942 114.4 48.7 -64.6 -45.4 35.0 -28.9 -32.9 161 161 A I H X S+ 0 0 13 -4,-3.2 4,-2.4 1,-0.2 -2,-0.2 0.911 110.0 51.5 -60.4 -43.1 35.7 -27.8 -29.3 162 162 A T H X S+ 0 0 40 -4,-2.5 4,-2.8 -5,-0.2 5,-0.4 0.868 106.6 55.3 -61.8 -36.8 36.6 -31.3 -28.2 163 163 A T H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.919 110.1 44.7 -62.7 -42.6 39.0 -31.4 -31.1 164 164 A F H < S+ 0 0 0 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.866 114.3 52.1 -68.3 -34.3 40.7 -28.2 -29.9 165 165 A R H < S+ 0 0 130 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.952 125.4 20.3 -64.0 -50.5 40.7 -29.7 -26.3 166 166 A T H < S- 0 0 66 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.666 85.7-135.3 -95.7 -25.1 42.4 -33.0 -27.1 167 167 A G S < S+ 0 0 15 -4,-2.3 2,-0.3 -5,-0.4 -62,-0.2 0.766 73.9 103.1 70.5 22.3 44.1 -32.5 -30.4 168 168 A T S S- 0 0 62 -6,-0.3 3,-0.4 -5,-0.2 -1,-0.3 -0.808 81.3-118.8-127.9 171.5 42.7 -35.9 -31.5 169 169 A W S >> S+ 0 0 40 -2,-0.3 3,-2.3 1,-0.2 4,-0.6 0.175 71.8 121.4 -96.7 17.6 39.9 -37.0 -33.7 170 170 A D G >4 + 0 0 116 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.810 68.1 59.4 -52.4 -34.2 38.0 -38.8 -30.9 171 171 A A G 34 S+ 0 0 21 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.675 109.4 43.6 -71.4 -14.9 34.9 -36.7 -31.5 172 172 A Y G X4 S+ 0 0 3 -3,-2.3 3,-0.6 -13,-0.1 2,-0.4 0.368 86.5 109.9-109.0 1.6 34.5 -37.9 -35.0 173 173 A K T << S+ 0 0 99 -3,-0.9 -3,-0.0 -4,-0.6 0, 0.0 -0.652 82.5 20.2 -83.5 132.0 35.2 -41.6 -34.5 174 174 A N T 3 0 0 168 -2,-0.4 -1,-0.2 1,-0.1 -4,-0.0 0.901 360.0 360.0 77.5 44.0 32.2 -43.8 -35.0 175 175 A L < 0 0 122 -3,-0.6 -1,-0.1 0, 0.0 -4,-0.0 -0.719 360.0 360.0-133.4 360.0 30.3 -41.2 -37.1