==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (O-GLYCOSYL) 01-MAY-89 1L29 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.A.BELL,S.DAO-PIN,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8731.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 124 75.6 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 7.3 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 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 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 1 1 0 0 1 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 91 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 151.9 36.9 -23.4 9.1 2 2 A N > - 0 0 72 95,-0.0 4,-2.6 92,-0.0 3,-0.3 -0.836 360.0 -82.4-142.8 176.8 34.6 -20.9 11.0 3 3 A I H > S+ 0 0 20 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.818 124.8 51.3 -51.9 -42.2 34.3 -17.2 11.4 4 4 A F H > S+ 0 0 73 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.915 111.8 44.5 -67.9 -41.7 36.9 -17.1 14.1 5 5 A E H > S+ 0 0 90 -3,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.875 113.7 52.2 -67.1 -40.8 39.6 -19.0 12.2 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.936 112.5 43.4 -61.4 -50.4 38.8 -17.0 9.1 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 5,-0.3 0.799 108.2 57.4 -68.6 -30.5 39.2 -13.6 10.9 8 8 A R H X S+ 0 0 95 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.875 106.4 50.9 -73.3 -23.7 42.3 -14.6 12.7 9 9 A I H < S+ 0 0 58 -4,-1.6 -2,-0.2 -3,-0.2 -1,-0.2 0.923 116.1 42.0 -67.6 -47.3 43.9 -15.4 9.3 10 10 A D H < S+ 0 0 20 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.839 125.9 30.8 -73.6 -32.6 42.9 -12.0 8.0 11 11 A E H < S- 0 0 37 -4,-2.3 19,-0.3 -5,-0.1 -3,-0.2 0.749 90.9-153.9 -99.2 -33.4 43.8 -9.9 11.1 12 12 A G < - 0 0 18 -4,-2.0 2,-0.4 -5,-0.3 -1,-0.1 -0.174 25.2 -84.1 81.7-173.9 46.7 -11.8 12.8 13 13 A L + 0 0 43 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.989 43.8 171.6-134.1 124.1 47.5 -11.7 16.5 14 14 A R E -A 28 0A 126 14,-1.2 14,-2.5 -2,-0.4 4,-0.1 -0.997 19.2-164.9-137.8 127.7 49.6 -8.9 18.2 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.6 12,-0.2 2,-0.3 0.454 73.4 63.6 -92.6 -0.1 50.0 -8.5 21.9 16 16 A K E S-C 57 0B 121 41,-0.2 41,-0.2 12,-0.1 12,-0.2 -0.898 100.0 -87.9-126.3 143.2 51.4 -5.0 21.7 17 17 A I E + 0 0 21 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.261 59.7 167.9 -50.9 136.8 49.7 -1.8 20.5 18 18 A Y E -A 26 0A 35 8,-2.8 8,-3.0 -4,-0.1 2,-0.4 -0.859 33.8 -98.0-143.7 173.3 50.3 -1.5 16.8 19 19 A K E -A 25 0A 128 -2,-0.3 6,-0.2 6,-0.2 13,-0.0 -0.915 32.2-122.4-105.7 140.6 49.0 0.6 13.8 20 20 A D > - 0 0 56 4,-2.7 3,-1.9 -2,-0.4 -1,-0.1 0.095 39.6 -96.4 -45.9 172.2 46.3 -0.5 11.2 21 21 A T T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.768 134.8 55.0 -67.6 -21.8 47.0 -0.7 7.6 22 22 A E T 3 S- 0 0 85 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.473 126.0-104.6 -86.8 -0.7 45.4 2.7 8.0 23 23 A G S < S+ 0 0 35 -3,-1.9 2,-0.2 1,-0.3 -2,-0.1 0.507 74.1 143.4 80.7 12.4 47.8 3.9 10.6 24 24 A Y - 0 0 71 1,-0.1 -4,-2.7 9,-0.0 2,-0.4 -0.593 58.8-103.9 -90.4 153.6 45.3 3.4 13.5 25 25 A Y E +AB 19 34A 34 9,-1.0 8,-3.6 11,-0.3 9,-1.3 -0.563 55.2 157.0 -69.4 121.0 46.1 2.2 16.9 26 26 A T E -AB 18 32A 3 -8,-3.0 -8,-2.8 -2,-0.4 2,-0.3 -0.900 20.5-170.4-140.0 162.3 45.0 -1.5 17.4 27 27 A I E > + B 0 31A 0 4,-1.6 4,-1.5 -2,-0.3 2,-0.2 -0.993 51.8 5.3-150.1 163.7 45.8 -4.4 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.5 -14,-1.2 -2,-0.3 2,-1.0 -0.435 122.1 -6.9 75.4-138.0 45.0 -8.2 19.6 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.619 126.5 -53.0 -97.7 72.0 43.1 -9.6 16.8 30 30 A G T 4 S+ 0 0 16 -2,-1.0 2,-1.1 -19,-0.3 -2,-0.2 0.742 84.2 156.3 71.5 23.2 42.1 -6.5 14.8 31 31 A H E < -B 27 0A 35 -4,-1.5 -4,-1.6 32,-0.0 -1,-0.2 -0.662 35.2-144.6 -85.2 99.1 40.6 -4.6 17.7 32 32 A L E -B 26 0A 69 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.332 16.6-173.7 -61.2 135.9 40.8 -0.9 16.8 33 33 A L E - 0 0 14 -8,-3.6 2,-0.3 1,-0.4 -7,-0.2 0.876 59.9 -22.9 -97.3 -45.0 41.5 1.2 19.8 34 34 A T E -B 25 0A 29 -9,-1.3 -9,-1.0 2,-0.1 -1,-0.4 -0.964 38.6-138.6-161.8 150.5 41.2 4.8 18.6 35 35 A K S S+ 0 0 139 -2,-0.3 -1,-0.0 -11,-0.2 -3,-0.0 0.407 75.8 108.3 -91.6 -2.3 41.5 6.7 15.3 36 36 A S S S- 0 0 38 2,-0.1 -11,-0.3 1,-0.1 6,-0.1 -0.434 76.0-125.3 -74.1 145.0 43.4 9.4 17.2 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.604 77.1 97.7 -75.9 -4.2 47.1 10.0 16.8 38 38 A S > - 0 0 53 1,-0.2 4,-2.2 2,-0.0 3,-0.2 -0.760 55.7-158.6 -97.2 130.5 48.1 9.7 20.4 39 39 A L H > S+ 0 0 69 -2,-0.6 4,-1.9 1,-0.3 -1,-0.2 0.583 100.2 61.2 -62.5 -20.1 49.5 6.6 21.7 40 40 A N H > S+ 0 0 124 2,-0.2 4,-1.8 3,-0.1 -1,-0.3 0.942 101.9 45.9 -79.6 -42.1 48.5 8.0 24.9 41 41 A A H > S+ 0 0 37 -3,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.909 114.6 52.9 -57.8 -40.5 44.8 8.2 23.9 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.881 107.1 49.8 -64.6 -42.4 45.3 4.6 22.7 43 43 A K H X S+ 0 0 46 -4,-1.9 4,-1.8 1,-0.2 11,-0.3 0.845 109.2 52.3 -66.0 -35.4 46.7 3.4 25.9 44 44 A S H X S+ 0 0 73 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.910 109.3 48.6 -66.6 -43.8 43.9 4.9 27.8 45 45 A E H X S+ 0 0 68 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.894 109.0 55.6 -63.8 -38.2 41.4 3.2 25.6 46 46 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 5,-0.3 0.928 108.4 44.5 -61.1 -45.9 43.2 -0.1 26.1 47 47 A D H X>S+ 0 0 36 -4,-1.8 4,-2.2 1,-0.2 5,-0.8 0.858 112.9 53.3 -67.6 -34.3 43.1 0.0 29.9 48 48 A K H <5S+ 0 0 146 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.910 111.1 47.1 -61.8 -45.5 39.5 1.0 29.7 49 49 A A H <5S+ 0 0 46 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.861 122.0 33.3 -65.2 -37.5 38.8 -2.0 27.4 50 50 A I H <5S- 0 0 39 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.740 99.7-126.2 -96.6 -28.5 40.6 -4.5 29.6 51 51 A G T <5S+ 0 0 67 -4,-2.2 2,-0.3 1,-0.4 -3,-0.2 0.759 77.8 71.8 86.5 26.2 40.0 -3.2 33.1 52 52 A R S - 0 0 4 -2,-0.9 3,-1.1 -11,-0.3 -1,-0.2 0.767 29.5-146.4 -94.5 -25.8 48.1 -2.6 30.7 55 55 A N T 3 S- 0 0 123 1,-0.3 3,-0.1 -12,-0.2 -2,-0.1 0.840 74.8 -53.7 59.8 38.3 50.9 -0.3 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.2 2,-0.4 0.577 120.1 91.0 81.7 3.9 50.3 -1.1 26.1 57 57 A V B < -C 16 0B 59 -3,-1.1 2,-0.3 -41,-0.2 -41,-0.2 -0.989 48.1-175.9-140.3 142.8 50.5 -4.8 26.3 58 58 A I - 0 0 6 -43,-2.6 2,-0.2 -2,-0.4 -30,-0.1 -0.837 26.4-108.6-128.5 167.3 47.9 -7.7 26.8 59 59 A T >> - 0 0 65 -2,-0.3 4,-1.9 1,-0.1 3,-0.5 -0.518 35.1-108.1 -88.5 164.4 47.9 -11.5 27.2 60 60 A K H 3> S+ 0 0 108 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.861 121.2 58.3 -53.7 -48.0 46.6 -13.9 24.6 61 61 A D H 3> S+ 0 0 108 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.855 105.1 47.2 -45.2 -49.4 43.7 -14.5 26.8 62 62 A E H <> S+ 0 0 32 -3,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.885 109.8 54.9 -70.0 -35.2 42.7 -10.8 26.8 63 63 A A H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -34,-0.4 0.835 107.8 48.6 -65.8 -37.1 43.1 -10.7 23.1 64 64 A E H X S+ 0 0 82 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.797 108.0 55.1 -72.7 -28.3 40.7 -13.6 22.7 65 65 A K H X S+ 0 0 117 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.947 109.9 45.1 -67.6 -47.0 38.2 -11.9 25.0 66 66 A L H X S+ 0 0 4 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.891 112.5 53.8 -60.8 -41.9 38.2 -8.8 22.9 67 67 A F H X S+ 0 0 13 -4,-2.0 4,-2.5 1,-0.2 5,-0.3 0.913 106.1 50.9 -62.9 -43.1 37.9 -10.9 19.8 68 68 A N H X S+ 0 0 92 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.936 112.8 46.9 -61.5 -43.5 34.9 -12.8 21.1 69 69 A Q H X S+ 0 0 101 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.869 111.4 51.3 -61.3 -40.3 33.1 -9.5 21.9 70 70 A D H X S+ 0 0 37 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.869 110.6 47.1 -66.4 -42.5 34.0 -8.0 18.5 71 71 A V H X S+ 0 0 7 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.961 113.1 49.8 -62.4 -47.4 32.6 -11.0 16.6 72 72 A D H X S+ 0 0 78 -4,-2.3 4,-2.4 -5,-0.3 5,-0.2 0.935 111.7 48.2 -56.4 -44.8 29.4 -10.9 18.7 73 73 A A H X S+ 0 0 45 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.900 109.4 53.4 -65.2 -39.7 29.0 -7.2 18.1 74 74 A A H X S+ 0 0 9 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.957 111.5 44.5 -57.7 -54.8 29.6 -7.7 14.3 75 75 A V H X S+ 0 0 35 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.918 114.8 49.7 -56.7 -44.5 26.8 -10.3 14.1 76 76 A R H X S+ 0 0 131 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.874 108.4 53.3 -64.7 -36.1 24.5 -8.2 16.2 77 77 A G H X S+ 0 0 3 -4,-2.5 4,-0.8 -5,-0.2 3,-0.4 0.927 107.6 49.2 -66.3 -48.4 25.1 -5.2 14.1 78 78 A I H >< S+ 0 0 0 -4,-2.2 3,-0.8 1,-0.2 7,-0.5 0.922 110.8 52.0 -49.9 -49.8 24.2 -7.1 11.0 79 79 A L H 3< S+ 0 0 67 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.722 110.9 47.4 -65.5 -24.5 21.0 -8.3 12.7 80 80 A R H 3< S+ 0 0 181 -4,-1.5 2,-0.8 -3,-0.4 -1,-0.3 0.460 94.2 86.4 -92.6 -14.7 19.9 -4.8 13.7 81 81 A N S+ 0 0 62 -2,-0.8 4,-1.7 1,-0.2 -1,-0.2 0.906 96.7 45.1 -40.6 -61.5 17.6 -3.5 8.0 83 83 A K H > S+ 0 0 146 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.970 119.2 43.0 -50.0 -56.4 19.7 -3.5 4.9 84 84 A L H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.875 108.2 55.3 -62.0 -50.0 22.2 -6.0 6.3 85 85 A K H X S+ 0 0 68 -4,-3.3 4,-2.8 -7,-0.5 5,-0.3 0.879 104.0 56.7 -56.8 -42.2 19.8 -8.5 7.9 86 86 A H H X S+ 0 0 120 -4,-1.7 4,-0.9 -5,-0.4 -1,-0.2 0.937 111.5 40.4 -58.7 -44.6 18.0 -9.0 4.7 87 87 A V H >X S+ 0 0 4 -4,-1.3 4,-0.8 2,-0.2 3,-0.5 0.952 114.7 53.9 -68.1 -45.2 21.1 -10.0 2.8 88 88 A Y H >< S+ 0 0 35 -4,-2.7 3,-1.3 1,-0.3 -2,-0.2 0.906 107.2 49.3 -51.0 -52.8 22.4 -12.1 5.7 89 89 A D H 3< S+ 0 0 79 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.750 108.5 56.2 -64.2 -24.5 19.2 -14.1 6.0 90 90 A S H << S+ 0 0 32 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.642 95.9 86.2 -81.1 -14.9 19.3 -14.8 2.3 91 91 A L S << S- 0 0 6 -3,-1.3 31,-0.0 -4,-0.8 30,-0.0 -0.551 75.5-116.0 -93.9 159.3 22.8 -16.3 2.3 92 92 A D > - 0 0 56 -2,-0.2 4,-2.0 1,-0.1 -1,-0.1 -0.159 44.8 -92.8 -74.3 173.7 24.2 -19.8 3.0 93 93 A A H > S+ 0 0 75 1,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.835 121.6 46.7 -64.3 -39.4 26.6 -20.5 6.0 94 94 A V H >> S+ 0 0 28 62,-0.2 4,-1.1 2,-0.2 3,-0.7 0.947 113.3 47.7 -68.3 -48.6 29.9 -19.9 4.2 95 95 A R H 3> S+ 0 0 24 1,-0.2 4,-1.8 2,-0.2 3,-0.2 0.852 103.2 62.5 -61.3 -34.7 28.8 -16.6 2.6 96 96 A R H 3X S+ 0 0 81 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.885 100.2 55.6 -58.0 -36.0 27.4 -15.4 5.8 97 97 A C H S+ 0 0 55 1,-0.2 4,-2.7 2,-0.2 -1,-0.1 0.837 129.0 50.7 -48.2 -51.2 28.0 -1.7 9.7 109 109 A T H > S+ 0 0 116 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.953 108.4 50.5 -60.0 -50.4 27.9 1.6 8.2 110 110 A G H >< S+ 0 0 30 -4,-0.6 3,-0.9 1,-0.2 -2,-0.2 0.909 113.5 43.8 -54.6 -53.1 30.7 1.0 5.8 111 111 A V H >< S+ 0 0 0 -4,-2.3 3,-2.8 1,-0.3 -1,-0.2 0.912 105.1 62.3 -66.4 -37.8 29.3 -2.2 4.5 112 112 A A H 3< S+ 0 0 19 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.782 93.5 67.2 -61.4 -17.9 25.8 -0.9 4.2 113 113 A G T << S+ 0 0 56 -4,-1.0 2,-0.9 -3,-0.9 -1,-0.3 0.524 76.8 83.8 -75.7 -5.3 27.3 1.6 1.7 114 114 A F <> + 0 0 37 -3,-2.8 4,-2.2 1,-0.2 3,-0.3 -0.213 57.3 156.1 -89.6 51.9 27.9 -1.2 -0.8 115 115 A T H > + 0 0 89 -2,-0.9 4,-1.4 1,-0.2 -1,-0.2 0.816 65.1 45.1 -42.5 -53.5 24.3 -0.9 -1.9 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.889 114.5 46.4 -65.6 -44.8 24.7 -2.4 -5.4 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.840 109.4 55.3 -65.2 -39.6 26.8 -5.4 -4.4 118 118 A L H X S+ 0 0 14 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.861 108.4 50.1 -57.6 -39.7 24.5 -6.2 -1.5 119 119 A R H X S+ 0 0 114 -4,-1.4 4,-1.7 -5,-0.3 -2,-0.2 0.934 111.5 47.4 -63.9 -47.8 21.6 -6.3 -4.1 120 120 A M H <>S+ 0 0 25 -4,-2.2 5,-2.7 2,-0.2 4,-0.2 0.872 110.4 51.0 -63.8 -40.4 23.5 -8.6 -6.3 121 121 A L H ><5S+ 0 0 2 -4,-2.1 3,-1.7 1,-0.2 -2,-0.2 0.922 109.4 53.2 -65.9 -42.1 24.5 -10.9 -3.4 122 122 A Q H 3<5S+ 0 0 86 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.901 108.9 47.8 -56.9 -37.5 20.8 -11.0 -2.5 123 123 A Q T 3<5S- 0 0 98 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.429 113.9-120.5 -82.1 -3.0 19.9 -12.0 -6.0 124 124 A K T < 5 + 0 0 96 -3,-1.7 2,-1.4 -4,-0.2 -3,-0.2 0.730 62.6 147.0 66.0 32.3 22.6 -14.6 -5.9 125 125 A R >< + 0 0 125 -5,-2.7 4,-2.1 1,-0.2 -1,-0.2 -0.720 19.6 173.1 -96.5 80.4 24.4 -13.2 -8.8 126 126 A W H > + 0 0 50 -2,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.879 69.4 46.2 -58.6 -47.7 27.8 -14.3 -7.5 127 127 A D H > S+ 0 0 112 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.927 114.3 48.2 -66.3 -43.9 30.0 -13.4 -10.4 128 128 A E H > S+ 0 0 94 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.868 111.1 50.2 -62.5 -41.9 28.5 -10.0 -10.9 129 129 A A H X S+ 0 0 1 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.826 106.9 54.2 -67.8 -33.2 28.8 -9.2 -7.3 130 130 A A H X S+ 0 0 10 -4,-1.6 4,-0.9 2,-0.2 -2,-0.2 0.876 109.5 48.1 -68.0 -38.9 32.4 -10.2 -7.1 131 131 A V H X S+ 0 0 92 -4,-1.9 4,-0.5 1,-0.2 3,-0.5 0.954 113.0 48.4 -65.0 -44.7 33.2 -7.9 -10.0 132 132 A N H >< S+ 0 0 43 -4,-2.2 3,-0.8 1,-0.2 -2,-0.2 0.849 107.7 54.1 -63.4 -38.6 31.2 -5.0 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.2 6,-0.4 1,-0.2 -1,-0.2 0.797 100.5 62.5 -65.9 -28.8 32.9 -5.5 -4.8 134 134 A A H 3< S+ 0 0 26 -4,-0.9 2,-1.7 -3,-0.5 -1,-0.2 0.705 85.4 77.4 -73.8 -17.4 36.4 -5.1 -6.4 135 135 A K S << S+ 0 0 144 -3,-0.8 2,-0.3 -4,-0.5 -1,-0.2 -0.430 81.5 98.4 -87.3 61.7 35.6 -1.6 -7.5 136 136 A S S > S- 0 0 20 -2,-1.7 4,-1.9 1,-0.1 5,-0.1 -0.977 83.8-117.6-146.6 160.5 36.1 -0.2 -4.1 137 137 A R H > S+ 0 0 141 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.899 115.2 63.1 -57.4 -43.2 38.7 1.6 -2.0 138 138 A W H > S+ 0 0 12 1,-0.2 4,-2.3 2,-0.2 8,-0.2 0.900 105.9 42.3 -47.8 -52.3 38.5 -1.5 0.2 139 139 A Y H 4 S+ 0 0 57 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.871 114.9 49.3 -69.3 -41.1 39.9 -3.7 -2.6 140 140 A N H < S+ 0 0 109 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.850 115.9 43.5 -65.5 -32.7 42.5 -1.2 -3.7 141 141 A Q H < S+ 0 0 98 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.859 132.4 18.0 -83.3 -39.7 43.8 -0.7 -0.1 142 142 A T S X S+ 0 0 23 -4,-2.3 4,-2.6 -5,-0.3 5,-0.3 -0.543 74.5 162.9-130.4 65.3 43.8 -4.3 1.1 143 143 A P H > + 0 0 52 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.826 69.6 50.8 -53.0 -45.6 43.7 -6.3 -2.1 144 144 A N H > S+ 0 0 112 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.937 117.6 40.3 -66.1 -41.7 44.9 -9.8 -0.8 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.1 1,-0.2 3,-0.4 0.936 114.6 51.3 -65.5 -54.7 42.3 -9.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.924 110.3 53.3 -51.9 -40.8 39.5 -8.3 -0.2 147 147 A K H X S+ 0 0 80 -4,-2.4 4,-2.0 -5,-0.3 -1,-0.2 0.893 105.0 50.3 -70.4 -26.1 40.2 -10.9 -2.6 148 148 A R H X S+ 0 0 49 -4,-1.3 4,-1.7 -3,-0.4 12,-0.2 0.915 114.6 46.3 -68.6 -41.0 39.9 -13.8 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.938 111.9 51.5 -66.8 -44.4 36.5 -12.4 1.0 150 150 A I H X S+ 0 0 10 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.887 108.1 48.8 -58.8 -47.2 35.5 -11.9 -2.5 151 151 A T H X S+ 0 0 35 -4,-2.0 4,-2.9 1,-0.2 5,-0.4 0.853 108.6 58.1 -63.4 -33.0 36.3 -15.5 -3.7 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.909 109.8 40.8 -61.9 -45.2 34.4 -16.6 -0.6 153 153 A F H < S+ 0 0 1 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.863 116.3 51.9 -70.0 -38.3 31.3 -14.8 -1.8 154 154 A R H < S+ 0 0 86 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.940 124.6 21.7 -62.5 -47.8 31.9 -15.9 -5.4 155 155 A T H < S- 0 0 50 -4,-2.9 -3,-0.2 2,-0.2 -2,-0.2 0.667 84.6-135.9 -97.2 -26.6 32.2 -19.7 -4.6 156 156 A G S < S+ 0 0 17 -4,-2.1 2,-0.3 -5,-0.4 -62,-0.2 0.752 72.3 102.2 72.4 17.1 30.6 -20.3 -1.4 157 157 A T S S- 0 0 50 -6,-0.4 3,-0.4 -5,-0.2 -1,-0.3 -0.823 79.8-116.8-126.5 174.8 33.5 -22.5 -0.3 158 158 A W S > S+ 0 0 38 -2,-0.3 3,-1.8 1,-0.2 4,-0.4 0.298 73.4 117.8 -94.6 14.1 36.6 -22.0 1.9 159 159 A D T >> + 0 0 93 1,-0.3 3,-1.1 2,-0.2 4,-0.5 0.722 65.7 61.3 -51.2 -36.5 39.2 -22.5 -0.8 160 160 A A H 3> S+ 0 0 15 -3,-0.4 4,-0.5 1,-0.2 -1,-0.3 0.710 109.4 44.9 -63.9 -21.6 40.7 -18.9 -0.4 161 161 A Y H <4 S+ 0 0 3 -3,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.369 95.0 76.6-104.3 -1.0 41.7 -19.8 3.1 162 162 A K H <4 S+ 0 0 137 -3,-1.1 -2,-0.1 -4,-0.4 -1,-0.1 0.623 94.4 51.6 -78.8 -27.5 43.0 -23.3 2.5 163 163 A N H < 0 0 119 -4,-0.5 -2,-0.2 1,-0.2 -3,-0.1 0.948 360.0 360.0 -63.9 -69.0 46.0 -22.0 1.1 164 164 A L < 0 0 115 -4,-0.5 -1,-0.2 0, 0.0 -2,-0.1 0.002 360.0 360.0 -52.8 360.0 46.5 -19.8 4.1