==== 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 222L . 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) . 8700.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 74.7 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 . 7 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 54.3 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 0 1 0 3 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 79 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 135.3 43.8 -1.8 9.1 2 2 A N > - 0 0 68 95,-0.0 4,-2.8 92,-0.0 3,-0.3 -0.919 360.0 -85.0-148.3 170.4 40.6 -0.8 10.8 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.837 124.4 53.8 -49.9 -37.9 38.5 2.4 11.2 4 4 A F H > S+ 0 0 80 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.932 111.8 41.6 -67.1 -46.8 40.6 3.6 14.1 5 5 A E H > S+ 0 0 98 -3,-0.3 4,-1.4 1,-0.2 -2,-0.2 0.887 114.9 55.1 -66.7 -37.5 43.9 3.3 12.3 6 6 A M H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 3,-0.4 0.952 110.7 40.9 -59.8 -52.7 42.3 4.8 9.3 7 7 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 5,-0.3 0.851 109.1 61.5 -67.4 -30.3 40.9 7.9 10.9 8 8 A R H X S+ 0 0 105 -4,-1.7 4,-1.6 -5,-0.2 -1,-0.2 0.843 106.0 48.1 -65.2 -29.4 44.2 8.3 12.8 9 9 A I H < S+ 0 0 89 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.845 115.2 43.1 -76.2 -38.7 45.9 8.6 9.5 10 10 A D H < S+ 0 0 20 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.750 124.6 32.2 -80.6 -26.7 43.5 11.2 8.1 11 11 A E H < S- 0 0 45 -4,-2.4 19,-0.3 -5,-0.1 -3,-0.2 0.690 89.4-155.7-103.6 -26.8 43.2 13.3 11.2 12 12 A G < - 0 0 24 -4,-1.6 2,-0.4 -5,-0.3 -1,-0.1 -0.078 27.3 -84.7 72.7-176.1 46.6 13.1 12.9 13 13 A L + 0 0 42 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.982 43.0 174.6-132.5 124.3 47.1 13.7 16.6 14 14 A R E -A 28 0A 143 14,-1.4 14,-2.3 -2,-0.4 4,-0.1 -0.988 18.8-162.3-131.0 125.9 47.6 17.1 18.2 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.5 12,-0.2 2,-0.3 0.520 74.3 59.2 -85.5 -2.8 47.8 17.8 22.0 16 16 A K E S-C 57 0B 129 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.905 100.1 -86.3-123.0 153.6 47.1 21.5 21.9 17 17 A I E + 0 0 28 39,-1.8 2,-0.3 -2,-0.3 10,-0.2 -0.155 58.2 169.3 -53.9 145.7 44.1 23.3 20.6 18 18 A Y E -A 26 0A 31 8,-2.7 8,-3.6 -4,-0.1 2,-0.4 -0.929 34.6-102.9-150.7 176.4 44.4 24.0 16.9 19 19 A K E -A 25 0A 126 -2,-0.3 6,-0.2 6,-0.3 5,-0.0 -0.907 31.8-139.4-110.5 137.8 42.5 25.1 13.9 20 20 A D > - 0 0 53 4,-2.6 3,-0.6 -2,-0.4 -1,-0.1 0.097 41.1 -80.2 -79.0-164.6 41.2 22.7 11.4 21 21 A T T 3 S+ 0 0 110 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.651 133.9 48.0 -73.6 -19.9 41.1 23.1 7.5 22 22 A E T 3 S- 0 0 72 2,-0.1 -1,-0.2 0, 0.0 -3,-0.0 0.462 125.2-102.4 -95.0 -12.0 38.0 25.2 7.8 23 23 A G S < S+ 0 0 33 -3,-0.6 2,-0.3 1,-0.3 -2,-0.1 0.428 73.5 143.6 99.4 12.5 39.5 27.4 10.6 24 24 A Y - 0 0 75 1,-0.1 -4,-2.6 -5,-0.0 2,-0.4 -0.583 58.1-103.7 -89.7 147.9 37.7 25.8 13.6 25 25 A Y E +AB 19 34A 36 9,-0.8 8,-3.2 11,-0.4 9,-1.3 -0.495 53.9 159.2 -67.5 119.8 39.0 25.1 16.9 26 26 A T E -AB 18 32A 2 -8,-3.6 -8,-2.7 -2,-0.4 2,-0.3 -0.820 19.3-170.3-136.6 169.3 39.9 21.4 17.3 27 27 A I E > + B 0 31A 0 4,-1.4 4,-1.7 -2,-0.3 2,-0.2 -0.980 52.8 2.2-158.5 160.8 42.1 19.2 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.3 -14,-1.4 -2,-0.3 2,-0.8 -0.402 122.9 -4.9 65.1-127.5 43.3 15.5 19.6 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.603 126.9 -53.4-102.9 72.3 42.1 13.3 16.7 30 30 A G T 4 S+ 0 0 15 -2,-0.8 2,-1.3 -19,-0.3 -2,-0.2 0.764 83.7 158.8 70.8 23.1 39.8 15.6 14.8 31 31 A H E < -B 27 0A 33 -4,-1.7 -4,-1.4 32,-0.0 -1,-0.2 -0.659 32.0-148.0 -84.8 101.5 37.7 16.4 17.8 32 32 A L E -B 26 0A 65 -2,-1.3 -6,-0.3 -6,-0.2 3,-0.1 -0.368 15.4-173.5 -62.7 130.1 36.0 19.7 16.7 33 33 A L E - 0 0 13 -8,-3.2 2,-0.3 1,-0.3 -7,-0.2 0.900 56.0 -20.7 -96.4 -42.2 35.4 21.9 19.7 34 34 A T E -B 25 0A 28 -9,-1.3 -9,-0.8 2,-0.1 -1,-0.3 -0.982 35.3-137.3-162.6 152.0 33.4 24.9 18.4 35 35 A K S S+ 0 0 138 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.543 76.4 112.2 -90.1 -2.3 32.5 26.8 15.3 36 36 A S - 0 0 45 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.336 69.9-137.6 -71.6 143.7 33.0 29.9 17.4 37 37 A P S S+ 0 0 118 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.554 74.6 101.8 -79.2 -7.3 35.9 32.3 16.7 38 38 A S > - 0 0 45 1,-0.2 4,-2.3 -13,-0.0 3,-0.2 -0.702 58.6-158.4 -89.1 122.5 36.7 32.7 20.3 39 39 A L H > S+ 0 0 70 -2,-0.6 4,-2.6 1,-0.2 -1,-0.2 0.774 96.8 58.8 -63.8 -22.7 39.6 30.8 21.8 40 40 A N H > S+ 0 0 118 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.914 104.0 48.1 -73.3 -41.5 37.9 31.3 25.1 41 41 A A H > S+ 0 0 34 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.940 112.5 50.3 -61.7 -44.5 34.9 29.6 24.0 42 42 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.918 109.8 50.4 -56.8 -47.0 37.1 26.8 22.6 43 43 A K H X S+ 0 0 77 -4,-2.6 4,-1.7 1,-0.2 11,-0.2 0.905 110.5 50.4 -60.9 -40.5 38.9 26.5 25.9 44 44 A S H X S+ 0 0 69 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.881 108.9 50.4 -67.8 -37.3 35.7 26.3 27.7 45 45 A E H X S+ 0 0 70 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.917 109.4 51.6 -68.1 -37.5 34.4 23.6 25.5 46 46 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 5,-0.3 0.856 108.0 50.9 -65.4 -36.4 37.5 21.5 26.0 47 47 A D H X>S+ 0 0 34 -4,-1.7 4,-2.0 2,-0.2 5,-1.8 0.860 110.2 50.8 -69.0 -35.6 37.4 21.7 29.8 48 48 A K H <5S+ 0 0 141 -4,-1.5 -2,-0.2 2,-0.2 -1,-0.2 0.876 111.4 47.9 -66.7 -43.2 33.7 20.6 29.6 49 49 A A H <5S+ 0 0 44 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.888 120.6 35.5 -66.8 -39.2 34.7 17.6 27.5 50 50 A I H <5S- 0 0 36 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.704 103.3-124.8 -89.0 -32.1 37.7 16.5 29.6 51 51 A G T <5S+ 0 0 61 -4,-2.0 2,-0.3 1,-0.3 -3,-0.2 0.915 74.7 74.1 84.9 41.6 36.2 17.3 32.9 52 52 A R S - 0 0 4 -2,-1.4 3,-0.8 -11,-0.2 -1,-0.2 0.785 32.9-140.6 -82.5 -31.3 42.9 21.9 30.9 55 55 A N T 3 - 0 0 121 1,-0.2 3,-0.1 -3,-0.1 -2,-0.1 0.745 69.4 -65.0 75.0 21.1 44.6 25.1 29.9 56 56 A G T 3 S+ 0 0 7 -13,-0.2 -39,-1.8 1,-0.2 2,-0.4 0.577 116.1 96.9 76.4 12.4 44.1 24.2 26.2 57 57 A V B < -C 16 0B 45 -3,-0.8 2,-0.2 -41,-0.2 -41,-0.2 -0.995 48.6-176.3-133.6 133.1 46.4 21.1 26.3 58 58 A I - 0 0 3 -43,-2.5 2,-0.2 -2,-0.4 -30,-0.1 -0.707 22.6-113.3-121.9 175.6 45.5 17.5 26.8 59 59 A T > - 0 0 56 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.602 33.4-102.8-103.3 167.5 47.4 14.2 27.1 60 60 A K H > S+ 0 0 114 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.896 121.2 51.4 -52.5 -50.5 47.5 11.2 24.8 61 61 A D H > S+ 0 0 122 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.872 110.7 50.3 -54.8 -44.4 45.1 9.2 26.9 62 62 A E H > S+ 0 0 37 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.902 108.7 50.3 -63.8 -43.0 42.7 12.0 26.9 63 63 A A H X S+ 0 0 1 -4,-2.5 4,-2.0 1,-0.2 -34,-0.4 0.898 111.6 49.9 -62.6 -37.6 42.9 12.4 23.1 64 64 A E H X S+ 0 0 76 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.814 106.3 54.1 -72.7 -33.3 42.2 8.7 22.7 65 65 A K H X S+ 0 0 131 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.906 109.6 47.1 -69.1 -38.7 39.3 8.7 25.0 66 66 A L H X S+ 0 0 5 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.929 110.8 54.2 -64.4 -42.1 37.6 11.5 23.0 67 67 A F H X S+ 0 0 13 -4,-2.0 4,-2.3 1,-0.2 5,-0.3 0.922 106.8 49.8 -57.2 -44.7 38.4 9.7 19.9 68 68 A N H X S+ 0 0 93 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.917 111.4 48.9 -60.2 -45.3 36.7 6.5 21.1 69 69 A Q H X S+ 0 0 98 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.872 111.9 51.0 -62.4 -38.8 33.6 8.4 22.1 70 70 A D H X S+ 0 0 34 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.826 108.9 47.5 -72.2 -35.4 33.6 10.0 18.7 71 71 A V H X S+ 0 0 7 -4,-2.3 4,-2.6 -5,-0.2 5,-0.2 0.919 113.9 48.6 -70.6 -43.7 33.9 6.9 16.7 72 72 A D H X S+ 0 0 107 -4,-2.2 4,-2.6 -5,-0.3 5,-0.2 0.972 111.0 49.8 -59.1 -49.3 31.1 5.3 18.7 73 73 A A H X S+ 0 0 62 -4,-2.6 4,-2.2 1,-0.2 5,-0.2 0.931 110.2 53.7 -54.6 -43.0 28.9 8.5 18.2 74 74 A A H X S+ 0 0 9 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.953 109.3 44.5 -57.4 -54.3 29.6 8.3 14.6 75 75 A V H X S+ 0 0 34 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.940 112.6 53.5 -56.4 -45.1 28.5 4.6 14.2 76 76 A R H X S+ 0 0 126 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.863 106.6 51.9 -59.8 -36.7 25.4 5.3 16.3 77 77 A G H X S+ 0 0 11 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.920 108.0 51.1 -67.6 -44.0 24.3 8.2 14.1 78 78 A I H < S+ 0 0 0 -4,-2.0 7,-0.6 1,-0.2 -2,-0.2 0.951 112.5 46.5 -56.9 -48.9 24.6 6.2 11.0 79 79 A L H < S+ 0 0 62 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.837 114.8 46.9 -66.7 -30.2 22.4 3.4 12.5 80 80 A R H < S+ 0 0 159 -4,-1.9 2,-0.3 -5,-0.2 -1,-0.2 0.775 93.3 97.0 -78.8 -29.9 19.9 5.9 13.8 81 81 A N X - 0 0 24 -4,-2.3 4,-2.4 -5,-0.2 -4,-0.0 -0.399 64.5-151.9 -66.2 124.9 19.8 7.7 10.5 82 82 A A T 4 S+ 0 0 88 -2,-0.3 -1,-0.2 1,-0.2 -4,-0.0 0.858 98.8 41.1 -64.6 -34.1 16.9 6.7 8.2 83 83 A K T > S+ 0 0 91 2,-0.1 4,-0.6 1,-0.1 -1,-0.2 0.830 120.6 42.3 -84.1 -30.5 18.9 7.6 5.1 84 84 A L H >> S+ 0 0 0 -7,-0.2 4,-2.1 1,-0.1 3,-0.7 0.928 98.1 69.3 -80.3 -48.9 22.2 6.1 6.3 85 85 A K H 3X S+ 0 0 92 -4,-2.4 4,-2.1 -7,-0.6 -1,-0.1 0.795 99.5 50.1 -40.1 -44.3 21.2 2.8 7.9 86 86 A P H 3> S+ 0 0 53 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.904 109.6 48.4 -70.5 -39.9 20.2 1.2 4.8 87 87 A V H < S+ 0 0 34 -4,-2.1 3,-1.2 1,-0.2 -1,-0.2 0.890 108.1 53.0 -56.4 -48.2 25.5 0.8 5.7 89 89 A D H 3< S+ 0 0 76 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.835 107.1 52.5 -61.4 -37.6 23.6 -2.5 6.0 90 90 A S H 3< S+ 0 0 41 -4,-1.7 -1,-0.3 -5,-0.1 2,-0.2 0.584 96.9 88.1 -74.6 -13.6 24.1 -3.2 2.4 91 91 A L S << S- 0 0 5 -3,-1.2 31,-0.0 -4,-0.5 30,-0.0 -0.612 74.8-114.5 -95.9 160.3 27.9 -2.7 2.4 92 92 A D > - 0 0 57 -2,-0.2 4,-1.9 1,-0.1 5,-0.1 -0.074 43.9 -92.4 -73.9 174.6 30.9 -4.9 3.1 93 93 A A H > S+ 0 0 81 2,-0.2 4,-1.4 1,-0.2 -1,-0.1 0.873 121.4 45.0 -63.2 -37.8 33.2 -4.3 6.1 94 94 A V H >> S+ 0 0 27 62,-0.2 4,-1.4 2,-0.2 3,-0.8 0.982 113.0 48.3 -71.0 -52.8 35.8 -2.2 4.4 95 95 A R H 3> S+ 0 0 23 1,-0.3 4,-1.6 2,-0.2 5,-0.2 0.882 106.6 59.5 -56.7 -33.2 33.3 0.1 2.6 96 96 A R H 3X S+ 0 0 79 -4,-1.9 4,-2.2 1,-0.2 -1,-0.3 0.921 100.5 56.2 -60.6 -38.4 31.5 0.4 5.9 97 97 A A H S+ 0 0 73 2,-0.2 4,-3.5 1,-0.2 5,-0.1 0.845 127.3 52.0 -67.0 -41.0 25.5 12.7 9.5 109 109 A T H > S+ 0 0 121 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.942 110.5 52.3 -59.6 -43.7 23.3 15.4 8.1 110 110 A G H >< S+ 0 0 32 -4,-0.5 3,-0.5 2,-0.2 4,-0.3 0.888 115.1 37.9 -57.4 -51.8 26.1 16.2 5.8 111 111 A V H >< S+ 0 0 5 -4,-2.1 3,-1.6 1,-0.2 -1,-0.2 0.887 108.7 63.8 -72.4 -36.5 26.5 12.8 4.5 112 112 A A H 3< S+ 0 0 12 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.747 94.8 63.3 -59.7 -21.1 22.8 12.1 4.6 113 113 A G T << S+ 0 0 50 -4,-1.0 2,-3.0 -3,-0.5 3,-0.3 0.701 74.6 90.3 -75.9 -21.5 22.5 14.9 1.9 114 114 A F <> + 0 0 47 -3,-1.6 4,-2.3 -4,-0.3 5,-0.3 -0.204 54.4 161.4 -71.4 53.4 24.5 13.0 -0.8 115 115 A T H > + 0 0 75 -2,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.823 65.0 46.3 -44.0 -53.0 21.3 11.5 -2.0 116 116 A N H > S+ 0 0 84 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.889 113.1 47.4 -63.0 -46.5 22.5 10.4 -5.4 117 117 A S H > S+ 0 0 2 -3,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.869 109.2 55.5 -65.5 -35.4 25.9 8.8 -4.3 118 118 A L H X S+ 0 0 12 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.911 107.9 49.3 -60.4 -43.0 24.1 6.9 -1.4 119 119 A R H X S+ 0 0 103 -4,-1.5 4,-2.3 -5,-0.3 -2,-0.2 0.932 111.1 47.3 -63.4 -45.6 21.8 5.4 -4.0 120 120 A M H X>S+ 0 0 27 -4,-2.0 5,-2.2 2,-0.2 4,-0.5 0.925 111.2 53.4 -64.7 -41.0 24.6 4.3 -6.3 121 121 A L H ><5S+ 0 0 3 -4,-2.8 3,-1.5 1,-0.2 -2,-0.2 0.945 109.1 48.6 -56.8 -48.7 26.5 2.9 -3.2 122 122 A Q H 3<5S+ 0 0 91 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.927 110.0 51.2 -59.4 -40.2 23.5 0.9 -2.3 123 123 A Q H 3<5S- 0 0 101 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.546 113.3-119.5 -75.7 -4.6 23.1 -0.4 -5.9 124 124 A K T <<5 + 0 0 102 -3,-1.5 2,-1.1 -4,-0.5 -3,-0.2 0.838 62.4 148.8 68.3 34.2 26.8 -1.4 -5.9 125 125 A R >< + 0 0 109 -5,-2.2 4,-2.1 1,-0.2 5,-0.2 -0.745 18.2 173.1 -99.5 78.0 27.7 0.9 -8.7 126 126 A W H > S+ 0 0 51 -2,-1.1 4,-1.6 2,-0.2 -1,-0.2 0.884 70.8 42.7 -56.9 -56.1 31.3 1.5 -7.5 127 127 A D H > S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.905 115.4 52.3 -61.3 -39.5 32.8 3.5 -10.4 128 128 A E H > S+ 0 0 98 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.907 109.8 46.2 -64.7 -41.8 29.6 5.6 -10.7 129 129 A A H X S+ 0 0 1 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.817 107.3 59.2 -71.4 -30.3 29.4 6.6 -7.1 130 130 A A H X S+ 0 0 11 -4,-1.6 4,-1.2 2,-0.2 -2,-0.2 0.953 107.5 44.8 -65.3 -47.0 33.1 7.4 -7.0 131 131 A V H >X S+ 0 0 87 -4,-1.9 4,-0.8 1,-0.2 3,-0.6 0.952 115.2 49.5 -58.1 -48.1 32.7 10.0 -9.8 132 132 A N H >< S+ 0 0 37 -4,-1.9 3,-0.8 1,-0.3 -2,-0.2 0.889 106.4 53.9 -64.4 -34.3 29.6 11.4 -8.1 133 133 A L H 3< S+ 0 0 8 -4,-2.8 6,-0.3 1,-0.2 -1,-0.3 0.834 102.6 62.9 -69.0 -22.4 31.2 11.6 -4.8 134 134 A A H << S+ 0 0 29 -4,-1.2 2,-1.8 -3,-0.6 -1,-0.2 0.747 83.4 76.2 -73.2 -25.2 33.9 13.6 -6.6 135 135 A K S << S+ 0 0 160 -4,-0.8 2,-0.3 -3,-0.8 -1,-0.2 -0.545 81.0 100.7 -85.8 72.0 31.6 16.5 -7.6 136 136 A S S > S- 0 0 20 -2,-1.8 4,-1.9 1,-0.1 3,-0.2 -0.999 83.2-116.4-152.4 159.6 31.4 18.1 -4.2 137 137 A R H > S+ 0 0 155 -2,-0.3 4,-2.5 1,-0.2 5,-0.3 0.899 114.7 63.0 -62.1 -35.3 32.8 20.8 -2.1 138 138 A W H > S+ 0 0 19 1,-0.2 4,-2.0 2,-0.2 8,-0.2 0.915 104.4 44.8 -54.0 -48.3 34.2 18.1 0.1 139 139 A Y H 4 S+ 0 0 64 -6,-0.3 -1,-0.2 -3,-0.2 -2,-0.2 0.852 114.5 50.0 -67.1 -36.0 36.5 16.8 -2.7 140 140 A N H < S+ 0 0 111 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.836 114.4 41.8 -73.7 -32.1 37.5 20.3 -3.7 141 141 A Q H < S+ 0 0 103 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.896 131.6 21.7 -81.2 -43.3 38.5 21.5 -0.2 142 142 A T S X S+ 0 0 22 -4,-2.0 4,-2.5 -5,-0.3 3,-0.3 -0.531 72.9 164.0-127.5 67.5 40.3 18.3 0.9 143 143 A P H > S+ 0 0 46 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.793 70.7 48.5 -53.2 -44.6 41.2 16.6 -2.2 144 144 A N H > S+ 0 0 107 2,-0.2 4,-1.6 3,-0.2 5,-0.1 0.900 115.3 42.7 -72.4 -38.6 43.8 14.1 -0.8 145 145 A R H > S+ 0 0 22 -3,-0.3 4,-2.1 2,-0.2 3,-0.3 0.963 115.8 48.9 -68.6 -50.6 41.7 12.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-3.2 -8,-0.2 5,-0.3 0.893 107.5 56.7 -53.1 -43.6 38.6 12.6 -0.1 147 147 A K H X S+ 0 0 89 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.914 108.3 48.0 -54.0 -46.0 40.7 10.7 -2.8 148 148 A R H X S+ 0 0 68 -4,-1.6 4,-1.5 -3,-0.3 -1,-0.2 0.906 114.3 44.3 -63.1 -44.1 41.6 8.1 -0.1 149 149 A V H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.920 114.3 49.1 -67.3 -45.1 38.0 7.7 1.1 150 150 A I H X S+ 0 0 12 -4,-3.2 4,-2.4 1,-0.2 -1,-0.2 0.849 108.5 53.8 -62.8 -38.0 36.6 7.6 -2.4 151 151 A T H X S+ 0 0 42 -4,-2.2 4,-2.5 -5,-0.3 5,-0.4 0.884 106.6 52.7 -66.1 -33.5 39.1 5.0 -3.4 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.899 109.9 47.5 -66.8 -38.1 38.1 2.9 -0.5 153 153 A F H < S+ 0 0 7 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.886 114.8 48.7 -67.9 -38.6 34.4 3.1 -1.6 154 154 A R H < S+ 0 0 105 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.921 124.5 22.8 -68.2 -46.4 35.4 2.3 -5.1 155 155 A T H < S- 0 0 45 -4,-2.5 -3,-0.2 2,-0.2 -2,-0.2 0.809 84.9-133.9 -94.8 -39.6 37.6 -0.7 -4.5 156 156 A G S < S+ 0 0 16 -4,-1.8 2,-0.2 -5,-0.4 -62,-0.2 0.667 73.0 96.6 88.6 18.7 36.7 -2.2 -1.2 157 157 A T S S- 0 0 48 -6,-0.3 -1,-0.4 -5,-0.1 3,-0.3 -0.715 81.0-116.3-130.0 174.6 40.4 -2.5 -0.1 158 158 A W S >> S+ 0 0 41 -2,-0.2 3,-2.5 1,-0.2 4,-0.7 0.152 71.7 122.6-100.8 16.5 42.8 -0.5 2.0 159 159 A D G >4 + 0 0 102 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.842 68.2 57.3 -49.5 -41.4 45.1 0.2 -0.8 160 160 A A G 34 S+ 0 0 37 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.731 110.6 47.7 -66.5 -15.5 44.9 4.0 -0.5 161 161 A Y G <4 0 0 20 -3,-2.5 -1,-0.3 -13,-0.1 -2,-0.2 0.555 360.0 360.0-104.1 -3.9 46.0 3.5 3.0 162 162 A K << 0 0 166 -3,-1.3 -3,-0.1 -4,-0.7 -2,-0.1 0.551 360.0 360.0-112.6 360.0 49.0 1.2 2.6