==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-SEP-99 1D2W . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR N.C.GASSNER,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8670.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 74.1 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 . 8 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 53.1 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 1 2 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 75 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 162.9 43.4 -1.9 9.3 2 2 A N > - 0 0 69 156,-0.0 4,-3.0 1,-0.0 3,-0.3 -0.955 360.0 -76.1-163.2 175.2 40.1 -0.8 10.8 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-3.3 1,-0.3 5,-0.3 0.841 124.0 49.3 -50.5 -46.9 38.1 2.4 11.3 4 4 A F H > S+ 0 0 77 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.917 114.2 43.7 -60.7 -54.0 40.1 3.7 14.2 5 5 A E H > S+ 0 0 93 -3,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.856 113.7 53.6 -57.2 -39.6 43.4 3.3 12.4 6 6 A M H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.966 112.5 40.9 -65.0 -51.1 41.9 4.7 9.3 7 7 A L H X S+ 0 0 0 -4,-3.3 4,-3.5 -5,-0.2 5,-0.5 0.866 108.2 61.7 -63.6 -39.0 40.6 7.9 10.9 8 8 A R H X S+ 0 0 93 -4,-2.2 4,-1.4 -5,-0.3 -1,-0.2 0.910 108.4 45.7 -53.7 -36.7 43.8 8.3 13.0 9 9 A I H < S+ 0 0 88 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.922 115.7 44.1 -73.0 -45.9 45.5 8.6 9.7 10 10 A D H < S+ 0 0 18 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.834 124.4 31.7 -65.3 -36.0 43.0 10.9 8.2 11 11 A E H < S- 0 0 46 -4,-3.5 19,-0.3 -5,-0.2 -1,-0.2 0.692 92.1-151.6 -96.7 -24.9 42.7 13.2 11.1 12 12 A G < - 0 0 25 -4,-1.4 2,-0.3 -5,-0.5 -1,-0.2 -0.261 22.7 -89.6 80.8-172.2 46.0 13.1 12.8 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.957 42.6 169.1-146.3 121.7 46.6 13.7 16.5 14 14 A R E -A 28 0A 135 14,-1.8 14,-1.9 -2,-0.3 4,-0.1 -1.000 21.2-161.3-138.0 136.5 47.2 17.0 18.2 15 15 A L E S+ 0 0 60 -2,-0.4 43,-1.5 12,-0.1 2,-0.3 0.300 74.3 62.8-105.5 14.9 47.1 17.7 21.9 16 16 A K E S-C 57 0B 83 41,-0.2 12,-0.3 12,-0.1 41,-0.2 -0.899 100.7 -86.5-131.7 147.0 46.7 21.4 21.8 17 17 A I E + 0 0 13 39,-1.2 2,-0.3 -2,-0.3 10,-0.2 -0.347 58.1 169.4 -54.6 140.9 43.7 23.2 20.4 18 18 A Y E -A 26 0A 28 8,-3.1 8,-3.2 -4,-0.1 2,-0.4 -0.902 35.1-102.2-144.5 174.2 44.1 23.8 16.7 19 19 A K E -A 25 0A 121 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.863 33.1-139.9-105.0 134.6 42.1 24.9 13.8 20 20 A D > - 0 0 50 4,-3.3 3,-1.0 -2,-0.4 -1,-0.1 0.008 41.7 -77.6 -77.4-164.9 40.8 22.4 11.4 21 21 A T T 3 S+ 0 0 107 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.755 134.8 46.7 -67.9 -25.0 40.6 22.7 7.6 22 22 A E T 3 S- 0 0 79 2,-0.1 -1,-0.2 0, 0.0 -3,-0.0 0.452 124.5-103.2 -91.5 -5.6 37.5 25.0 7.8 23 23 A G S < S+ 0 0 34 -3,-1.0 2,-0.3 1,-0.3 -2,-0.1 0.649 74.2 142.0 93.1 18.3 39.2 27.1 10.5 24 24 A Y - 0 0 68 1,-0.1 -4,-3.3 9,-0.0 -1,-0.3 -0.768 60.1-101.0 -98.5 150.6 37.3 25.7 13.5 25 25 A Y E +AB 19 34A 35 9,-0.8 8,-3.1 11,-0.4 9,-1.4 -0.468 52.8 166.0 -69.9 123.7 38.7 25.0 16.9 26 26 A T E -AB 18 32A 2 -8,-3.2 -8,-3.1 6,-0.3 2,-0.3 -0.877 18.3-160.1-134.0 163.1 39.5 21.3 17.2 27 27 A M E > - B 0 31A 0 4,-1.4 4,-1.6 -2,-0.3 2,-0.4 -0.996 53.0 -15.6-143.5 148.1 41.4 19.1 19.6 28 28 A G E 4 S+A 14 0A 0 -14,-1.9 -14,-1.8 -12,-0.3 2,-0.6 -0.519 124.0 4.6 75.2-123.2 42.9 15.7 19.5 29 29 A I T 4 S- 0 0 3 -2,-0.4 -1,-0.2 34,-0.3 -17,-0.1 -0.684 127.3 -58.7-104.4 67.6 41.7 13.4 16.8 30 30 A G T 4 S+ 0 0 15 -2,-0.6 2,-1.1 -19,-0.3 -2,-0.2 0.684 82.4 159.6 67.6 23.9 39.5 15.6 14.8 31 31 A H E < -B 27 0A 33 -4,-1.6 -4,-1.4 1,-0.0 -1,-0.2 -0.529 33.7-143.4 -78.5 101.9 37.3 16.4 17.7 32 32 A L E -B 26 0A 73 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.394 19.3-176.7 -63.6 137.9 35.5 19.6 16.7 33 33 A L E - 0 0 16 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.849 58.0 -19.6 -98.4 -46.1 35.0 21.8 19.7 34 34 A T E -B 25 0A 27 -9,-1.4 -9,-0.8 2,-0.1 -1,-0.4 -0.970 35.9-140.2-163.0 147.8 33.1 24.8 18.3 35 35 A K S S+ 0 0 146 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.516 77.6 105.9 -86.4 -9.0 32.2 26.6 15.1 36 36 A S S S- 0 0 41 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.449 73.1-134.1 -76.1 155.1 32.6 29.8 17.0 37 37 A P S S+ 0 0 115 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.489 74.2 102.3 -79.9 -16.5 35.6 32.1 16.6 38 38 A S > - 0 0 61 1,-0.1 4,-1.3 -13,-0.0 -2,-0.1 -0.738 58.0-156.8 -78.4 126.0 36.2 32.7 20.3 39 39 A L H > S+ 0 0 74 -2,-0.5 4,-2.7 1,-0.2 -1,-0.1 0.741 96.3 56.1 -67.3 -29.5 39.2 30.6 21.7 40 40 A N H > S+ 0 0 118 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.910 103.3 51.3 -70.6 -46.5 37.6 31.0 25.1 41 41 A A H > S+ 0 0 37 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.862 112.8 48.4 -57.6 -36.9 34.5 29.4 23.9 42 42 A A H X S+ 0 0 0 -4,-1.3 4,-3.2 2,-0.2 -2,-0.2 0.932 110.4 49.6 -69.3 -41.9 36.6 26.7 22.6 43 43 A K H X S+ 0 0 58 -4,-2.7 4,-2.0 2,-0.2 11,-0.2 0.895 110.1 52.8 -63.4 -37.4 38.5 26.3 25.7 44 44 A S H X S+ 0 0 72 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.950 109.6 45.8 -65.0 -49.1 35.3 26.2 27.6 45 45 A E H X S+ 0 0 71 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.904 109.5 58.6 -61.0 -39.0 33.9 23.4 25.4 46 46 A L H X S+ 0 0 0 -4,-3.2 4,-2.5 1,-0.2 5,-0.2 0.952 108.7 42.4 -54.8 -50.3 37.2 21.6 25.8 47 47 A D H X>S+ 0 0 32 -4,-2.0 4,-2.5 2,-0.2 5,-1.4 0.813 112.0 53.3 -66.4 -38.5 37.0 21.5 29.6 48 48 A K H <5S+ 0 0 139 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.898 112.4 47.1 -62.1 -37.9 33.4 20.6 29.6 49 49 A A H <5S+ 0 0 45 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.871 119.8 38.1 -68.6 -43.1 34.3 17.6 27.3 50 50 A I H <5S- 0 0 32 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.782 104.3-124.5 -85.9 -29.9 37.1 16.6 29.3 51 51 A G T <5S+ 0 0 67 -4,-2.5 2,-0.3 1,-0.3 -3,-0.2 0.768 77.7 57.8 90.3 25.8 35.8 17.1 32.8 52 52 A R S - 0 0 10 -2,-0.8 3,-1.0 -11,-0.2 -1,-0.2 0.704 34.6-142.9 -93.1 -26.2 42.7 21.7 30.9 55 55 A N T 3 S- 0 0 115 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.894 70.7 -57.3 61.4 39.0 43.9 25.0 29.9 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.2 1,-0.1 2,-0.4 0.492 118.1 90.3 76.3 5.8 43.9 23.9 26.2 57 57 A V B < +C 16 0B 78 -3,-1.0 2,-0.3 -41,-0.2 -41,-0.2 -0.999 48.0 177.7-130.6 137.7 46.1 20.9 26.4 58 58 A I - 0 0 6 -43,-1.5 2,-0.2 -2,-0.4 -30,-0.1 -0.807 30.0-103.5-129.2 174.6 45.1 17.2 27.1 59 59 A T > - 0 0 64 -2,-0.3 4,-2.2 1,-0.1 3,-0.4 -0.582 34.0-105.2 -96.3 167.3 46.9 13.9 27.3 60 60 A K H > S+ 0 0 110 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.842 121.4 55.4 -56.8 -40.7 47.0 11.2 24.7 61 61 A D H > S+ 0 0 117 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.904 106.4 48.5 -58.0 -50.1 44.7 9.2 26.8 62 62 A E H > S+ 0 0 39 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.893 111.2 52.3 -58.8 -40.8 42.1 11.9 27.0 63 63 A A H X S+ 0 0 1 -4,-2.2 4,-2.5 1,-0.3 -34,-0.3 0.911 110.1 48.7 -61.7 -38.7 42.3 12.3 23.2 64 64 A E H X S+ 0 0 76 -4,-2.4 4,-2.8 1,-0.2 -1,-0.3 0.830 106.8 54.2 -74.2 -32.7 41.8 8.8 22.7 65 65 A K H X S+ 0 0 140 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.957 110.2 46.9 -68.7 -41.0 38.9 8.7 24.9 66 66 A L H X S+ 0 0 5 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.919 111.0 54.6 -56.2 -43.2 37.2 11.5 22.9 67 67 A F H X S+ 0 0 13 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.956 105.8 49.8 -63.2 -45.0 38.0 9.7 19.9 68 68 A N H X S+ 0 0 86 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.918 111.4 49.4 -58.8 -40.6 36.4 6.5 21.0 69 69 A Q H X S+ 0 0 99 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.916 110.9 50.4 -66.0 -39.6 33.3 8.4 21.9 70 70 A D H X S+ 0 0 34 -4,-2.9 4,-1.7 -5,-0.2 -2,-0.2 0.889 109.0 49.8 -64.7 -40.8 33.2 10.1 18.6 71 71 A V H X S+ 0 0 6 -4,-2.7 4,-2.1 1,-0.2 3,-0.3 0.970 112.3 49.4 -61.4 -50.2 33.6 6.9 16.7 72 72 A D H X S+ 0 0 101 -4,-2.6 4,-2.4 -5,-0.3 5,-0.3 0.914 109.0 51.4 -52.2 -43.8 30.8 5.4 18.6 73 73 A A H X S+ 0 0 62 -4,-2.2 4,-2.7 -5,-0.3 -1,-0.2 0.883 107.0 53.6 -69.1 -31.7 28.5 8.4 18.1 74 74 A A H X S+ 0 0 10 -4,-1.7 4,-2.5 -3,-0.3 -1,-0.2 0.944 109.6 47.8 -65.2 -44.7 29.1 8.3 14.3 75 75 A V H X S+ 0 0 32 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.978 113.1 48.3 -58.5 -51.3 28.1 4.7 14.1 76 76 A R H X S+ 0 0 145 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.924 108.5 54.7 -62.8 -31.2 25.0 5.3 16.2 77 77 A G H X S+ 0 0 5 -4,-2.7 4,-0.9 -5,-0.3 -1,-0.2 0.970 108.6 47.9 -66.4 -50.8 24.1 8.3 14.1 78 78 A I H >< S+ 0 0 0 -4,-2.5 3,-1.0 1,-0.2 7,-0.5 0.923 110.6 51.8 -48.8 -48.5 24.2 6.2 11.0 79 79 A L H 3< S+ 0 0 59 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.854 111.8 45.5 -65.7 -34.4 22.1 3.5 12.5 80 80 A R H 3< S+ 0 0 175 -4,-2.2 2,-0.7 -5,-0.2 -1,-0.3 0.497 93.7 98.3 -80.3 -9.1 19.5 6.0 13.6 81 81 A N > S+ 0 0 0 -3,-0.4 4,-2.7 -6,-0.2 3,-0.5 0.827 100.4 67.7 -89.7 -47.3 21.9 6.1 6.1 85 85 A K H 3X S+ 0 0 84 -4,-3.4 4,-2.6 -7,-0.5 5,-0.2 0.909 100.1 49.4 -40.8 -54.3 21.1 3.0 7.9 86 86 A P H 3> S+ 0 0 52 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 0.881 110.7 49.5 -61.6 -34.8 20.0 1.1 4.9 87 87 A V H <> S+ 0 0 1 -3,-0.5 4,-0.9 -4,-0.4 -2,-0.2 0.953 112.7 47.2 -68.2 -47.5 23.0 1.9 2.9 88 88 A Y H >< S+ 0 0 28 -4,-2.7 3,-0.9 1,-0.2 -1,-0.2 0.907 107.8 55.7 -57.0 -40.9 25.3 1.0 5.7 89 89 A D H 3< S+ 0 0 71 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.929 106.8 52.4 -66.5 -30.5 23.4 -2.3 6.2 90 90 A S H 3< S+ 0 0 41 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.611 96.6 90.4 -78.5 -9.5 24.0 -3.2 2.6 91 91 A L S << S- 0 0 6 -3,-0.9 31,-0.0 -4,-0.9 30,-0.0 -0.568 75.1-115.1 -92.0 157.3 27.7 -2.7 2.6 92 92 A D > - 0 0 53 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.105 42.9 -95.7 -80.2 163.9 30.7 -4.9 3.3 93 93 A A H > S+ 0 0 80 2,-0.2 4,-1.2 1,-0.2 -2,-0.1 0.856 121.0 48.2 -61.1 -38.6 32.9 -4.2 6.3 94 94 A V H >> S+ 0 0 26 62,-0.2 4,-1.5 1,-0.2 3,-0.7 0.957 113.0 48.0 -63.4 -51.3 35.6 -2.2 4.5 95 95 A R H 3> S+ 0 0 22 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.826 104.5 59.4 -61.8 -33.3 33.1 0.0 2.8 96 96 A R H 3X S+ 0 0 79 -4,-1.9 4,-2.4 1,-0.2 -1,-0.3 0.904 101.0 56.3 -58.4 -39.3 31.2 0.6 6.0 97 97 A A H S+ 0 0 62 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.874 126.8 53.1 -54.7 -46.9 25.1 12.6 9.4 109 109 A T H > S+ 0 0 119 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.964 108.5 47.9 -58.6 -52.5 23.3 15.4 8.0 110 110 A G H >< S+ 0 0 34 -4,-0.7 3,-0.7 1,-0.2 -2,-0.2 0.904 115.5 44.8 -56.8 -48.3 25.9 16.4 5.6 111 111 A V H >< S+ 0 0 0 -4,-2.8 3,-2.6 1,-0.2 -1,-0.2 0.898 102.2 63.0 -66.9 -43.0 26.4 12.9 4.4 112 112 A A H 3< S+ 0 0 13 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.784 93.5 71.4 -50.9 -24.2 22.7 12.0 4.1 113 113 A G T << S+ 0 0 56 -4,-1.0 2,-1.4 -3,-0.7 3,-0.3 0.569 72.2 82.9 -69.9 -11.1 22.8 14.8 1.4 114 114 A F <> + 0 0 37 -3,-2.6 4,-2.9 1,-0.2 3,-0.4 -0.278 57.7 157.2 -88.6 57.9 24.7 12.7 -1.1 115 115 A T H > + 0 0 88 -2,-1.4 4,-1.8 1,-0.3 -1,-0.2 0.837 66.9 47.7 -49.2 -51.7 21.5 11.2 -2.2 116 116 A N H > S+ 0 0 90 -3,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.892 113.2 45.7 -61.2 -43.2 22.5 10.2 -5.5 117 117 A S H > S+ 0 0 0 -3,-0.4 4,-3.1 1,-0.2 5,-0.3 0.872 110.7 56.9 -67.4 -31.1 25.9 8.6 -4.4 118 118 A L H X S+ 0 0 12 -4,-2.9 4,-2.9 1,-0.2 -1,-0.2 0.944 106.5 48.4 -60.8 -44.3 24.0 6.8 -1.6 119 119 A R H X S+ 0 0 141 -4,-1.8 4,-1.9 -5,-0.3 -1,-0.2 0.922 111.5 47.8 -69.2 -37.5 21.8 5.3 -4.0 120 120 A M H <>S+ 0 0 30 -4,-1.8 5,-2.5 1,-0.2 4,-0.3 0.866 110.9 52.8 -68.7 -35.5 24.6 4.1 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-3.1 3,-2.2 1,-0.2 -1,-0.2 0.939 107.3 52.0 -64.4 -46.9 26.4 2.8 -3.3 122 122 A Q H 3<5S+ 0 0 89 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.906 110.2 48.5 -54.4 -38.1 23.3 0.9 -2.3 123 123 A Q T 3<5S- 0 0 80 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.445 113.0-118.5 -82.6 -2.2 23.1 -0.6 -5.7 124 124 A K T < 5 + 0 0 102 -3,-2.2 2,-1.4 -4,-0.3 -3,-0.2 0.753 61.6 149.0 66.7 32.6 26.8 -1.6 -5.7 125 125 A R >< + 0 0 109 -5,-2.5 4,-2.1 1,-0.2 -1,-0.2 -0.733 20.5 174.4 -95.2 77.8 27.6 0.6 -8.7 126 126 A W H > + 0 0 52 -2,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.934 68.0 42.0 -55.5 -56.1 31.2 1.2 -7.5 127 127 A D H > S+ 0 0 105 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.912 116.1 51.3 -65.9 -30.8 32.8 3.2 -10.3 128 128 A E H > S+ 0 0 108 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.895 108.2 49.2 -71.6 -44.0 29.7 5.3 -10.7 129 129 A A H X S+ 0 0 1 -4,-2.1 4,-3.3 2,-0.2 -1,-0.2 0.900 108.9 55.2 -60.7 -34.6 29.4 6.2 -7.1 130 130 A A H X S+ 0 0 9 -4,-2.2 4,-0.8 1,-0.2 -2,-0.2 0.881 108.8 47.8 -70.4 -35.4 33.1 7.1 -7.1 131 131 A V H >X S+ 0 0 90 -4,-1.9 3,-0.9 -5,-0.2 4,-0.6 0.949 114.6 45.2 -69.4 -47.2 32.5 9.5 -10.0 132 132 A N H >< S+ 0 0 41 -4,-2.7 3,-1.4 1,-0.3 -2,-0.2 0.929 106.9 57.5 -66.3 -38.3 29.5 11.0 -8.4 133 133 A L H 3< S+ 0 0 1 -4,-3.3 6,-0.3 1,-0.2 -1,-0.3 0.817 100.0 61.5 -60.9 -27.0 31.1 11.4 -5.0 134 134 A A H << S+ 0 0 27 -3,-0.9 2,-1.8 -4,-0.8 -1,-0.2 0.672 83.8 80.4 -76.7 -15.1 33.9 13.5 -6.6 135 135 A K S << S+ 0 0 158 -3,-1.4 2,-0.4 -4,-0.6 -1,-0.2 -0.530 80.2 98.1 -89.1 70.6 31.5 16.2 -7.7 136 136 A S S > S- 0 0 18 -2,-1.8 4,-2.0 1,-0.1 5,-0.2 -0.999 84.0-117.7-158.7 155.8 31.3 17.8 -4.5 137 137 A R H > S+ 0 0 143 -2,-0.4 4,-2.9 1,-0.2 5,-0.2 0.922 113.8 62.5 -56.8 -50.2 32.6 20.6 -2.4 138 138 A W H > S+ 0 0 15 1,-0.2 4,-2.4 2,-0.2 8,-0.2 0.890 105.9 44.8 -38.6 -48.9 34.0 17.9 -0.0 139 139 A Y H 4 S+ 0 0 55 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.880 114.2 48.6 -71.6 -38.8 36.3 16.5 -2.8 140 140 A N H < S+ 0 0 104 -4,-2.0 -2,-0.2 1,-0.1 -1,-0.2 0.874 115.1 44.4 -69.7 -35.2 37.4 20.0 -3.9 141 141 A Q H < S+ 0 0 109 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.903 131.5 17.8 -78.6 -43.9 38.2 21.2 -0.4 142 142 A T S X S+ 0 0 22 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 -0.659 74.3 163.5-128.4 69.2 40.0 18.1 0.9 143 143 A P H > + 0 0 51 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.859 68.0 52.4 -58.1 -41.4 41.0 16.2 -2.2 144 144 A N H > S+ 0 0 116 2,-0.2 4,-1.8 1,-0.2 -2,-0.0 0.962 115.2 41.9 -66.5 -40.1 43.6 13.8 -0.8 145 145 A R H > S+ 0 0 22 1,-0.2 4,-1.9 2,-0.2 5,-0.3 0.937 114.0 51.4 -69.9 -46.3 41.4 12.5 1.9 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.927 106.8 55.5 -60.9 -35.7 38.4 12.4 -0.2 147 147 A K H X S+ 0 0 98 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.879 106.2 52.0 -61.6 -36.7 40.5 10.4 -2.7 148 148 A R H X S+ 0 0 68 -4,-1.8 4,-1.4 2,-0.2 12,-0.2 0.914 112.1 42.5 -61.1 -48.7 41.3 7.9 -0.1 149 149 A V H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.837 114.3 52.1 -67.0 -39.3 37.7 7.2 1.0 150 150 A I H X S+ 0 0 16 -4,-2.3 4,-2.9 -5,-0.3 -2,-0.2 0.934 108.1 50.1 -67.0 -44.0 36.4 7.1 -2.5 151 151 A T H X S+ 0 0 38 -4,-2.3 4,-2.9 1,-0.2 6,-0.4 0.877 109.5 54.0 -59.8 -35.3 39.1 4.6 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.907 110.6 43.9 -68.3 -41.2 38.0 2.6 -0.5 153 153 A F H < S+ 0 0 2 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.903 116.0 50.0 -69.4 -38.4 34.3 2.7 -1.7 154 154 A R H < S+ 0 0 99 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.917 125.0 22.7 -64.2 -45.4 35.4 1.9 -5.2 155 155 A T H < S- 0 0 45 -4,-2.9 -2,-0.2 2,-0.2 -3,-0.2 0.644 84.8-137.9 -99.8 -22.4 37.6 -1.1 -4.4 156 156 A G S < S+ 0 0 16 -4,-2.5 2,-0.2 -5,-0.3 -62,-0.2 0.669 72.1 103.4 67.4 21.3 36.4 -2.3 -1.1 157 157 A T S S- 0 0 47 -6,-0.4 3,-0.4 -5,-0.1 -1,-0.2 -0.804 80.7-119.3-123.2 173.0 40.0 -2.8 -0.1 158 158 A W S >> S+ 0 0 41 -2,-0.2 3,-2.7 1,-0.2 4,-0.7 0.185 72.7 122.4 -93.0 14.7 42.3 -0.8 2.2 159 159 A D G >4 + 0 0 95 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.843 65.6 58.5 -47.3 -41.0 44.8 -0.1 -0.6 160 160 A A G 34 S+ 0 0 35 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.579 109.3 47.2 -66.9 -11.6 44.6 3.7 -0.3 161 161 A Y G <4 0 0 18 -3,-2.7 -1,-0.3 -13,-0.1 -2,-0.2 0.507 360.0 360.0-110.2 -1.7 45.7 3.5 3.2 162 162 A K << 0 0 182 -3,-1.4 -2,-0.2 -4,-0.7 -3,-0.1 0.922 360.0 360.0 -90.0 360.0 48.6 1.1 2.8