==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-NOV-08 3F8V . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR B.H.M MOOERS,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8851.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 73.2 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 . 10 6.1 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 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 51.8 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 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 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 69 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 149.8 43.0 -1.6 8.8 2 2 A N > - 0 0 66 156,-0.0 4,-2.5 95,-0.0 5,-0.2 -0.898 360.0 -79.9-158.2 178.8 39.8 -0.7 10.6 3 3 A I H > S+ 0 0 20 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.830 126.9 51.9 -61.6 -36.3 37.8 2.5 11.2 4 4 A F H > S+ 0 0 73 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.952 112.4 43.8 -67.7 -46.6 40.1 3.7 14.0 5 5 A E H > S+ 0 0 100 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.874 114.8 52.2 -62.6 -37.4 43.2 3.3 12.0 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.947 113.3 40.8 -63.5 -52.1 41.5 4.9 8.9 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.836 109.0 60.4 -71.5 -28.8 40.4 8.0 10.7 8 8 A R H X S+ 0 0 110 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.918 109.0 45.4 -61.8 -39.4 43.7 8.3 12.6 9 9 A I H < S+ 0 0 54 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.943 117.9 42.7 -63.7 -47.2 45.4 8.6 9.2 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.787 125.7 31.0 -73.7 -29.5 42.8 11.1 7.9 11 11 A E H < S- 0 0 40 -4,-2.7 19,-0.4 1,-0.1 -1,-0.2 0.646 90.7-152.5-103.4 -22.6 42.5 13.2 11.1 12 12 A G < - 0 0 23 -4,-2.0 2,-0.4 -5,-0.3 -1,-0.1 -0.174 23.6 -89.5 74.9-173.2 46.0 13.0 12.7 13 13 A L + 0 0 45 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.942 44.4 166.4-142.3 120.9 46.6 13.4 16.4 14 14 A R E -A 28 0A 149 14,-1.8 14,-2.4 -2,-0.4 4,-0.1 -1.000 22.2-159.7-134.7 134.4 47.3 16.8 18.1 15 15 A L E S+ 0 0 65 -2,-0.4 43,-2.7 12,-0.2 2,-0.3 0.477 74.7 63.2 -97.3 -0.7 47.1 17.3 21.8 16 16 A K E S-C 57 0B 145 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.906 101.3 -86.4-121.4 147.2 46.7 21.1 21.8 17 17 A I E + 0 0 32 39,-1.9 2,-0.3 -2,-0.3 10,-0.2 -0.316 57.9 167.2 -53.0 133.0 43.7 23.0 20.4 18 18 A Y E -A 26 0A 25 8,-2.7 8,-2.8 6,-0.1 2,-0.5 -0.861 37.9-100.1-137.5 170.8 44.2 23.6 16.6 19 19 A K E -A 25 0A 121 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.857 35.0-137.4 -99.2 133.5 42.1 24.7 13.7 20 20 A D > - 0 0 42 4,-2.7 3,-2.0 -2,-0.5 -1,-0.1 0.012 42.6 -78.3 -73.0-173.7 40.7 22.1 11.4 21 21 A T T 3 S+ 0 0 109 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.712 134.1 50.3 -66.7 -19.1 40.6 22.4 7.6 22 22 A E T 3 S- 0 0 72 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.378 122.8-103.5 -94.1 -0.3 37.5 24.6 7.9 23 23 A G S < S+ 0 0 39 -3,-2.0 2,-0.4 1,-0.3 -2,-0.1 0.588 76.1 138.7 86.5 16.8 39.2 26.9 10.4 24 24 A Y - 0 0 73 1,-0.1 -4,-2.7 9,-0.0 -1,-0.3 -0.754 61.5-100.9-103.3 139.1 37.3 25.5 13.4 25 25 A Y E +A 19 0A 36 11,-0.4 8,-2.7 9,-0.4 9,-1.2 -0.356 54.5 159.9 -61.1 129.7 38.7 24.7 16.8 26 26 A T E -AB 18 32A 3 -8,-2.8 -8,-2.7 6,-0.3 2,-0.3 -0.869 19.2-166.9-143.9 162.1 39.5 21.0 17.2 27 27 A I E > + B 0 31A 0 4,-1.8 4,-2.4 -2,-0.3 2,-0.2 -0.978 51.7 4.7-150.3 166.2 41.6 18.8 19.3 28 28 A G E 4 S-A 14 0A 0 -14,-2.4 -14,-1.8 -2,-0.3 2,-0.9 -0.444 123.4 -7.4 71.0-130.1 42.8 15.2 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.732 129.2 -51.4-105.2 74.8 41.9 13.0 16.5 30 30 A G T 4 S+ 0 0 12 -2,-0.9 2,-1.1 -19,-0.4 -2,-0.2 0.796 82.2 163.0 62.9 32.6 39.6 15.3 14.7 31 31 A H E < -B 27 0A 32 -4,-2.4 -4,-1.8 -20,-0.1 2,-0.2 -0.695 31.3-144.7 -82.7 101.4 37.4 16.1 17.7 32 32 A L E -B 26 0A 75 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.462 17.6-174.7 -63.1 128.3 35.5 19.3 16.7 33 33 A L - 0 0 13 -8,-2.7 2,-0.3 1,-0.4 -7,-0.2 0.884 57.5 -34.1 -91.1 -45.2 35.1 21.6 19.7 34 34 A T - 0 0 30 -9,-1.2 -9,-0.4 2,-0.1 -1,-0.4 -0.947 35.2-129.7-170.7 155.3 32.9 24.4 18.3 35 35 A K S S+ 0 0 138 -2,-0.3 -1,-0.0 -11,-0.1 7,-0.0 0.400 75.5 116.8 -91.2 -3.9 32.3 26.5 15.2 36 36 A S - 0 0 37 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.378 68.4-138.2 -63.5 141.8 32.7 29.6 17.4 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.536 76.4 104.7 -76.3 -1.0 35.6 31.9 16.5 38 38 A S > - 0 0 48 1,-0.2 4,-2.1 2,-0.0 5,-0.2 -0.654 57.8-161.6 -87.8 115.7 36.1 32.3 20.2 39 39 A L H > S+ 0 0 68 -2,-0.7 4,-2.7 1,-0.2 5,-0.2 0.909 95.9 56.0 -59.0 -36.1 39.1 30.4 21.6 40 40 A N H > S+ 0 0 116 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.907 104.7 50.9 -68.2 -36.5 37.6 30.7 25.0 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.904 111.4 49.6 -61.5 -39.5 34.3 29.1 23.8 42 42 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.907 108.7 52.1 -65.8 -40.8 36.5 26.2 22.4 43 43 A K H X S+ 0 0 54 -4,-2.7 4,-2.4 1,-0.2 11,-0.3 0.887 108.7 51.1 -63.5 -38.2 38.3 25.9 25.7 44 44 A S H X S+ 0 0 68 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.917 108.8 50.1 -62.9 -45.7 35.1 25.7 27.5 45 45 A E H X S+ 0 0 66 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.896 110.1 52.3 -59.4 -39.3 33.8 23.0 25.2 46 46 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 5,-0.3 0.944 108.8 48.1 -62.1 -47.5 37.0 21.1 25.8 47 47 A D H X>S+ 0 0 33 -4,-2.4 4,-2.8 1,-0.2 5,-0.9 0.890 111.8 50.8 -63.1 -40.5 36.8 21.2 29.6 48 48 A K H <5S+ 0 0 145 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.867 111.7 48.4 -61.5 -42.9 33.1 20.0 29.4 49 49 A A H <5S+ 0 0 41 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.855 121.0 33.8 -67.5 -37.3 34.1 17.1 27.1 50 50 A I H <5S- 0 0 38 -4,-2.2 -2,-0.2 2,-0.3 -3,-0.2 0.758 101.7-124.7 -91.6 -30.8 37.0 16.0 29.3 51 51 A G T <5S+ 0 0 67 -4,-2.8 2,-0.3 1,-0.3 -3,-0.2 0.706 78.4 72.2 87.6 25.8 35.7 16.8 32.7 52 52 A R S - 0 0 9 -2,-0.9 3,-1.4 -11,-0.3 -1,-0.2 0.585 31.9-143.3 -94.7 -18.8 42.4 21.5 30.5 55 55 A N T 3 S- 0 0 109 1,-0.3 3,-0.1 -12,-0.1 -2,-0.1 0.865 73.6 -53.0 45.0 47.0 43.5 24.9 29.4 56 56 A G T 3 S+ 0 0 6 -13,-0.2 -39,-1.9 1,-0.1 2,-0.4 0.549 118.9 98.3 79.0 6.3 43.6 23.8 25.7 57 57 A V B < +C 16 0B 64 -3,-1.4 2,-0.3 -41,-0.2 -41,-0.2 -0.989 43.5 175.5-134.4 130.9 45.8 20.7 26.2 58 58 A I - 0 0 5 -43,-2.7 2,-0.2 -2,-0.4 -30,-0.1 -0.842 28.1-109.6-127.2 171.1 44.9 17.0 26.6 59 59 A T > - 0 0 68 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.522 32.5-108.7 -91.9 164.1 46.8 13.7 26.9 60 60 A K H > S+ 0 0 115 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.909 120.7 53.2 -56.9 -43.1 46.9 10.9 24.3 61 61 A D H > S+ 0 0 125 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.925 109.7 48.4 -59.8 -41.8 44.7 8.7 26.4 62 62 A E H > S+ 0 0 39 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.908 110.5 51.1 -65.5 -41.3 42.2 11.5 26.6 63 63 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -34,-0.4 0.917 110.7 48.6 -57.7 -43.6 42.3 12.1 22.8 64 64 A E H X S+ 0 0 89 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.849 108.7 54.7 -67.0 -32.7 41.8 8.4 22.3 65 65 A K H X S+ 0 0 135 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.947 110.5 44.2 -65.8 -47.2 38.8 8.4 24.7 66 66 A L H X S+ 0 0 4 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.895 112.1 55.2 -61.3 -38.7 37.1 11.2 22.8 67 67 A F H X S+ 0 0 12 -4,-2.3 4,-2.6 1,-0.2 5,-0.3 0.933 107.7 47.2 -63.4 -43.5 37.9 9.5 19.5 68 68 A N H X S+ 0 0 80 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.924 112.7 50.1 -65.1 -39.4 36.2 6.3 20.6 69 69 A Q H X S+ 0 0 94 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.912 110.6 50.0 -58.9 -43.7 33.2 8.2 21.7 70 70 A D H X S+ 0 0 39 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.909 113.6 43.8 -66.9 -40.3 33.1 10.1 18.5 71 71 A V H X S+ 0 0 6 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.939 114.8 50.0 -65.7 -47.1 33.2 6.9 16.3 72 72 A D H X S+ 0 0 90 -4,-2.6 4,-2.8 -5,-0.3 5,-0.3 0.957 113.6 45.6 -57.0 -50.8 30.7 5.1 18.6 73 73 A A H X S+ 0 0 59 -4,-2.8 4,-2.4 -5,-0.3 -1,-0.2 0.886 109.5 55.6 -62.7 -36.3 28.3 8.0 18.4 74 74 A A H X S+ 0 0 12 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.917 111.2 44.5 -61.5 -45.8 28.8 8.3 14.6 75 75 A V H X S+ 0 0 36 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.944 113.1 49.4 -64.2 -49.9 27.8 4.7 14.1 76 76 A R H X S+ 0 0 120 -4,-2.8 4,-0.8 1,-0.2 -2,-0.2 0.893 111.8 51.0 -57.1 -38.8 24.8 4.9 16.5 77 77 A G H >X S+ 0 0 10 -4,-2.4 3,-0.9 -5,-0.3 4,-0.6 0.933 106.3 52.7 -66.1 -43.0 23.7 8.0 14.7 78 78 A I H >< S+ 0 0 0 -4,-2.3 3,-1.3 1,-0.3 7,-0.3 0.920 108.4 52.0 -54.8 -45.3 23.9 6.4 11.3 79 79 A L H 3< S+ 0 0 62 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.688 110.4 47.8 -69.5 -18.8 21.7 3.6 12.5 80 80 A R H << S+ 0 0 178 -3,-0.9 2,-0.6 -4,-0.8 -1,-0.3 0.414 92.8 93.6 -96.2 -2.8 19.1 6.1 13.8 81 81 A N XX - 0 0 27 -3,-1.3 4,-3.0 -4,-0.6 3,-1.2 -0.838 62.5-155.3-100.9 119.2 19.0 8.1 10.6 82 82 A A T 34 S+ 0 0 89 -2,-0.6 -1,-0.1 1,-0.3 -4,-0.0 0.713 95.4 52.0 -63.4 -24.9 16.3 7.0 8.1 83 83 A K T 34 S+ 0 0 148 2,-0.1 -1,-0.3 1,-0.1 4,-0.2 0.637 120.9 30.4 -82.3 -21.3 18.4 8.4 5.2 84 84 A L T <> S+ 0 0 0 -3,-1.2 4,-2.7 -6,-0.3 5,-0.2 0.709 101.4 73.3-110.1 -33.4 21.6 6.6 6.1 85 85 A K H X S+ 0 0 87 -4,-3.0 4,-3.2 -7,-0.3 5,-0.2 0.909 96.5 50.3 -59.0 -46.4 20.6 3.3 7.8 86 86 A P H > S+ 0 0 58 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.942 113.8 44.3 -61.2 -41.1 19.4 1.5 4.6 87 87 A V H >> S+ 0 0 0 2,-0.2 4,-0.8 1,-0.2 3,-0.6 0.960 114.7 50.4 -66.7 -45.2 22.5 2.3 2.6 88 88 A Y H >< S+ 0 0 24 -4,-2.7 3,-1.5 1,-0.3 -1,-0.2 0.946 108.7 51.5 -55.5 -47.1 24.7 1.3 5.6 89 89 A D H 3< S+ 0 0 88 -4,-3.2 -1,-0.3 1,-0.3 -2,-0.2 0.757 106.1 56.2 -61.8 -25.3 22.9 -2.0 6.1 90 90 A S H << S+ 0 0 38 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.627 96.4 86.1 -79.0 -16.8 23.4 -2.8 2.4 91 91 A L S << S- 0 0 13 -3,-1.5 2,-0.1 -4,-0.8 31,-0.0 -0.486 76.7-115.8 -91.4 156.3 27.2 -2.4 2.6 92 92 A D > - 0 0 55 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.347 42.7 -96.9 -72.1 164.5 30.0 -4.7 3.6 93 93 A A H > S+ 0 0 75 2,-0.2 4,-1.0 1,-0.2 -1,-0.1 0.763 122.4 53.2 -63.6 -30.6 32.2 -3.9 6.6 94 94 A V H >> S+ 0 0 33 2,-0.2 4,-1.1 1,-0.2 3,-0.7 0.952 111.4 45.5 -70.1 -47.2 34.9 -2.1 4.7 95 95 A R H 3> S+ 0 0 25 1,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.834 103.0 65.6 -67.1 -28.0 32.4 0.2 3.0 96 96 A H H 3X S+ 0 0 39 -4,-2.4 4,-2.6 1,-0.2 -1,-0.3 0.907 99.0 54.7 -49.5 -44.9 30.8 0.8 6.4 97 97 A C H S+ 0 0 63 1,-0.2 4,-2.5 2,-0.2 -1,-0.1 0.867 127.6 51.4 -61.5 -43.1 24.9 13.2 9.5 109 109 A T H > S+ 0 0 123 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.929 109.9 51.0 -61.8 -42.7 23.0 15.9 7.9 110 110 A G H >< S+ 0 0 32 -4,-0.5 3,-0.9 1,-0.2 4,-0.3 0.929 114.0 43.0 -60.7 -48.3 25.8 16.7 5.5 111 111 A V H >< S+ 0 0 0 -4,-2.4 3,-2.0 1,-0.3 -1,-0.2 0.890 107.8 58.9 -67.0 -37.3 26.2 13.0 4.5 112 112 A A H 3< S+ 0 0 6 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.734 95.1 66.7 -65.0 -19.0 22.4 12.5 4.2 113 113 A G T << S+ 0 0 60 -4,-1.0 2,-0.9 -3,-0.9 3,-0.3 0.519 78.4 82.4 -76.1 -12.2 22.4 15.3 1.6 114 114 A F <> + 0 0 38 -3,-2.0 4,-2.9 -4,-0.3 5,-0.3 -0.174 57.8 150.4 -79.9 43.6 24.5 13.0 -0.7 115 115 A T H > + 0 0 71 -2,-0.9 4,-2.0 1,-0.2 -1,-0.2 0.862 65.6 45.1 -50.5 -48.7 21.1 11.5 -1.7 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.910 114.2 47.5 -68.2 -39.9 22.1 10.5 -5.2 117 117 A S H > S+ 0 0 1 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.903 110.2 53.3 -66.3 -40.4 25.5 9.0 -4.3 118 118 A L H X S+ 0 0 12 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.889 107.4 51.7 -62.1 -39.9 23.9 7.1 -1.4 119 119 A R H X S+ 0 0 122 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.923 109.2 49.7 -61.2 -45.4 21.4 5.6 -3.9 120 120 A M H <>S+ 0 0 42 -4,-2.0 5,-2.6 1,-0.2 4,-0.3 0.888 111.3 49.8 -63.8 -37.2 24.2 4.5 -6.2 121 121 A L H ><5S+ 0 0 1 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.929 109.0 51.3 -62.9 -45.9 26.0 2.9 -3.3 122 122 A Q H 3<5S+ 0 0 97 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.848 110.7 49.7 -57.4 -36.1 22.8 1.1 -2.2 123 123 A Q T 3<5S- 0 0 93 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.470 112.0-124.0 -78.3 -8.2 22.6 -0.2 -5.8 124 124 A K T < 5 + 0 0 97 -3,-1.6 2,-1.3 -4,-0.3 -3,-0.2 0.808 62.0 146.3 61.3 35.0 26.2 -1.3 -5.7 125 125 A R >< + 0 0 126 -5,-2.6 4,-2.8 1,-0.2 5,-0.2 -0.709 22.4 173.1 -94.6 74.0 27.0 0.8 -8.8 126 126 A W H > + 0 0 49 -2,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.867 67.2 44.1 -66.6 -42.4 30.4 1.5 -7.4 127 127 A D H > S+ 0 0 109 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.905 116.4 49.3 -71.4 -38.0 32.2 3.3 -10.2 128 128 A E H > S+ 0 0 105 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.925 111.0 49.5 -63.8 -42.5 29.1 5.5 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.919 108.7 53.5 -61.6 -41.8 28.9 6.3 -7.1 130 130 A A H X S+ 0 0 12 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.897 109.4 47.9 -61.2 -44.2 32.6 7.2 -7.0 131 131 A V H < S+ 0 0 88 -4,-2.1 4,-0.5 1,-0.2 3,-0.3 0.925 114.2 46.9 -61.3 -44.2 32.1 9.7 -9.9 132 132 A N H >< S+ 0 0 37 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.901 105.6 57.9 -68.3 -38.4 29.0 11.2 -8.2 133 133 A L H 3< S+ 0 0 1 -4,-2.8 6,-0.4 1,-0.3 -1,-0.2 0.824 100.8 58.7 -59.4 -32.6 30.7 11.5 -4.8 134 134 A A T 3< S+ 0 0 26 -4,-1.2 2,-1.9 -3,-0.3 -1,-0.3 0.636 83.7 83.3 -74.2 -17.2 33.5 13.6 -6.3 135 135 A K S < S+ 0 0 157 -3,-1.4 2,-0.3 -4,-0.5 -1,-0.2 -0.523 81.1 97.0 -84.9 69.1 30.9 16.2 -7.5 136 136 A S S > S- 0 0 17 -2,-1.9 4,-1.9 1,-0.1 5,-0.2 -0.999 86.2-116.3-156.3 152.1 30.9 17.9 -4.2 137 137 A R H > S+ 0 0 147 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.910 115.4 62.4 -55.1 -43.0 32.3 20.7 -2.0 138 138 A W H > S+ 0 0 11 1,-0.2 4,-2.5 2,-0.2 8,-0.2 0.915 104.7 43.1 -48.3 -53.8 33.8 17.9 0.1 139 139 A Y H 4 S+ 0 0 62 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.867 115.1 50.3 -65.6 -37.7 36.0 16.6 -2.7 140 140 A N H < S+ 0 0 112 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.901 116.7 39.2 -67.5 -40.1 37.0 20.1 -3.8 141 141 A Q H < S+ 0 0 109 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.840 133.6 20.8 -84.8 -32.3 38.0 21.2 -0.3 142 142 A T S X S+ 0 0 18 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.2 -0.595 74.8 160.1-130.5 69.8 39.7 18.0 0.9 143 143 A P H > + 0 0 48 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.861 70.0 50.5 -66.7 -39.1 40.5 16.2 -2.3 144 144 A N H > S+ 0 0 107 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.942 115.7 41.7 -68.8 -43.5 43.2 13.8 -1.0 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.934 114.9 51.3 -64.8 -44.5 41.0 12.5 1.8 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.907 107.3 54.3 -59.9 -41.1 37.9 12.4 -0.3 147 147 A K H X S+ 0 0 99 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.898 108.7 48.6 -60.3 -39.1 39.8 10.4 -2.9 148 148 A R H X S+ 0 0 55 -4,-1.7 4,-1.8 2,-0.2 12,-0.2 0.919 114.2 44.7 -64.8 -45.7 40.8 7.8 -0.3 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.920 114.0 50.2 -62.5 -45.2 37.3 7.5 1.0 150 150 A I H X S+ 0 0 14 -4,-3.1 4,-2.7 -5,-0.2 -2,-0.2 0.916 108.5 52.2 -63.3 -41.9 35.9 7.3 -2.5 151 151 A T H X S+ 0 0 37 -4,-2.6 4,-2.6 -5,-0.2 6,-0.4 0.876 107.6 53.5 -59.5 -37.5 38.4 4.6 -3.4 152 152 A T H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.938 112.0 43.5 -64.4 -42.9 37.3 2.6 -0.4 153 153 A F H < S+ 0 0 1 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.869 115.5 50.2 -64.9 -39.0 33.7 2.9 -1.6 154 154 A R H < S+ 0 0 106 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.919 126.3 21.3 -67.4 -41.8 34.7 2.0 -5.1 155 155 A T H < S- 0 0 40 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.674 84.7-134.9-104.8 -21.6 36.8 -1.0 -4.4 156 156 A G S < S+ 0 0 17 -4,-2.4 2,-0.3 -5,-0.4 -62,-0.2 0.733 74.3 106.3 62.6 22.5 35.7 -2.3 -1.0 157 157 A T S S- 0 0 47 -6,-0.4 3,-0.3 -5,-0.2 -1,-0.3 -0.787 80.0-122.1-122.3 170.2 39.4 -2.7 -0.2 158 158 A W >> + 0 0 29 -2,-0.3 4,-2.4 1,-0.2 3,-2.2 0.113 69.7 123.5 -95.2 20.6 41.8 -0.8 1.9 159 159 A D T 34 + 0 0 101 1,-0.3 -1,-0.2 2,-0.2 -7,-0.1 0.827 69.3 55.7 -56.4 -32.7 44.2 -0.0 -1.0 160 160 A A T 34 S+ 0 0 26 -3,-0.3 -1,-0.3 -12,-0.2 -2,-0.1 0.623 120.1 30.6 -76.9 -10.5 44.0 3.8 -0.4 161 161 A Y T X4 S+ 0 0 2 -3,-2.2 3,-1.9 1,-0.1 2,-0.8 0.604 92.8 92.7-118.5 -22.5 45.2 3.4 3.2 162 162 A K T 3< S+ 0 0 95 -4,-2.4 -1,-0.1 1,-0.3 0, 0.0 -0.816 90.8 39.4 -81.3 108.9 47.4 0.3 3.2 163 163 A N T 3 0 0 164 -2,-0.8 -1,-0.3 1,-0.2 -4,-0.1 0.034 360.0 360.0 125.6 -0.9 50.8 2.0 2.7 164 164 A L < 0 0 143 -3,-1.9 -1,-0.2 0, 0.0 -155,-0.0 -0.854 360.0 360.0-105.8 360.0 50.1 5.0 4.9