==== 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) 28-JAN-91 1L45 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR S.DAOPIN,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8683.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 71.3 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 . 10 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 52.4 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, 0.0 161,-0.0 0.000 360.0 360.0 360.0 145.3 36.9 -23.5 8.9 2 2 A N > - 0 0 69 95,-0.0 4,-2.5 1,-0.0 3,-0.3 -0.851 360.0 -90.9-137.6 170.0 34.8 -21.1 10.9 3 3 A I H > S+ 0 0 22 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.837 122.7 52.8 -52.5 -39.1 34.4 -17.3 11.3 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.941 111.9 43.1 -64.5 -46.0 37.0 -17.2 14.1 5 5 A E H > S+ 0 0 89 -3,-0.3 4,-1.5 1,-0.2 -2,-0.2 0.873 113.4 54.0 -68.5 -35.2 39.7 -19.0 12.1 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.917 112.2 41.9 -62.7 -49.8 38.9 -16.9 9.0 7 7 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 5,-0.4 0.851 108.9 59.0 -68.9 -35.0 39.3 -13.6 10.9 8 8 A R H X S+ 0 0 108 -4,-2.3 4,-1.6 -5,-0.2 -1,-0.2 0.880 107.7 49.0 -60.7 -33.2 42.4 -14.8 12.7 9 9 A I H < S+ 0 0 53 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.977 115.7 41.6 -70.0 -48.0 43.9 -15.4 9.2 10 10 A D H < S+ 0 0 20 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.717 126.3 29.2 -70.4 -30.8 43.0 -12.0 7.9 11 11 A E H < S- 0 0 31 -4,-2.2 19,-0.3 -5,-0.1 -1,-0.2 0.683 90.4-151.9-105.3 -29.5 43.8 -9.8 11.0 12 12 A G < - 0 0 18 -4,-1.6 2,-0.4 -5,-0.4 -1,-0.1 -0.192 24.1 -86.5 79.8-176.5 46.6 -11.7 12.7 13 13 A L + 0 0 41 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.991 42.3 173.7-136.3 125.7 47.3 -11.5 16.4 14 14 A R E -A 28 0A 127 14,-1.2 14,-2.1 -2,-0.4 4,-0.1 -0.999 18.4-165.2-135.2 130.5 49.5 -8.9 18.1 15 15 A L E S+ 0 0 66 -2,-0.4 43,-2.4 12,-0.2 2,-0.3 0.393 75.1 62.2 -96.5 0.7 49.9 -8.5 21.8 16 16 A K E S-C 57 0B 102 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.934 102.1 -87.7-123.6 144.7 51.4 -5.0 21.8 17 17 A I E + 0 0 19 39,-1.7 2,-0.3 -2,-0.3 10,-0.2 -0.216 58.6 172.5 -49.2 140.3 49.6 -1.8 20.4 18 18 A Y E -A 26 0A 28 8,-2.8 8,-2.9 -4,-0.1 2,-0.5 -0.885 34.3-104.3-143.8 171.9 50.2 -1.6 16.7 19 19 A K E -A 25 0A 121 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.911 33.1-139.1-105.5 134.1 49.1 0.5 13.8 20 20 A D > - 0 0 47 4,-3.1 3,-1.6 -2,-0.5 -1,-0.1 0.007 40.4 -81.9 -74.6-174.9 46.7 -1.0 11.3 21 21 A T T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.827 132.4 49.4 -60.9 -33.2 46.8 -0.7 7.6 22 22 A E T 3 S- 0 0 77 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.362 123.7-101.2 -86.4 -1.2 45.1 2.7 7.9 23 23 A G S < S+ 0 0 36 -3,-1.6 2,-0.2 1,-0.3 -2,-0.1 0.458 76.3 138.4 93.9 3.5 47.5 4.0 10.5 24 24 A Y - 0 0 79 1,-0.1 -4,-3.1 -5,-0.1 2,-0.4 -0.586 60.7-104.3 -91.0 151.5 45.2 3.5 13.5 25 25 A Y E +AB 19 34A 31 9,-0.7 8,-3.0 11,-0.4 9,-1.3 -0.523 52.1 162.6 -69.5 119.1 46.1 2.1 16.9 26 26 A T E -AB 18 32A 3 -8,-2.9 -8,-2.8 -2,-0.4 2,-0.3 -0.792 18.4-167.0-132.9 167.0 44.9 -1.5 17.2 27 27 A I E > - B 0 31A 0 4,-1.3 4,-2.0 -2,-0.3 -12,-0.2 -0.954 52.7 -0.9-153.5 161.0 45.7 -4.5 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.1 -14,-1.2 -2,-0.3 2,-0.9 -0.292 123.3 -5.3 63.5-129.6 45.0 -8.2 19.5 29 29 A I T 4 S- 0 0 6 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.674 127.7 -52.0-101.2 76.7 43.0 -9.6 16.6 30 30 A G T 4 S+ 0 0 16 -2,-0.9 2,-1.1 -19,-0.3 -2,-0.2 0.758 83.3 160.0 65.8 26.8 42.0 -6.4 14.7 31 31 A H E < -B 27 0A 33 -4,-2.0 -4,-1.3 1,-0.0 -1,-0.2 -0.709 33.7-143.1 -83.8 101.6 40.6 -4.7 17.7 32 32 A L E -B 26 0A 70 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.443 19.9-177.8 -62.3 127.4 40.6 -0.9 16.8 33 33 A L E - 0 0 14 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.879 59.0 -22.1 -94.0 -52.3 41.4 1.2 19.8 34 34 A T E -B 25 0A 27 -9,-1.3 -9,-0.7 2,-0.1 -1,-0.4 -0.993 35.6-141.0-154.3 157.1 41.2 4.8 18.6 35 35 A K S S+ 0 0 140 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.551 75.6 112.7 -92.7 -9.8 41.3 6.7 15.4 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.240 72.6-132.6 -64.7 140.9 43.3 9.3 17.4 37 37 A P S S+ 0 0 120 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.616 76.2 103.6 -73.4 -6.9 46.9 10.0 16.7 38 38 A S > - 0 0 50 1,-0.2 4,-2.2 2,-0.1 5,-0.2 -0.662 55.7-162.0 -88.3 120.1 47.8 9.8 20.3 39 39 A L H > S+ 0 0 67 -2,-0.7 4,-2.0 1,-0.3 -1,-0.2 0.755 100.2 55.0 -61.2 -24.5 49.5 6.7 21.5 40 40 A N H > S+ 0 0 120 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.905 102.1 51.6 -77.2 -41.1 48.4 7.9 24.8 41 41 A A H > S+ 0 0 32 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.907 112.1 51.5 -58.5 -36.1 44.8 8.1 23.8 42 42 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.896 107.0 50.5 -64.3 -46.3 45.4 4.5 22.7 43 43 A K H X S+ 0 0 48 -4,-2.0 4,-1.8 2,-0.2 11,-0.3 0.850 110.6 49.5 -63.6 -32.1 46.8 3.4 25.9 44 44 A S H X S+ 0 0 75 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.911 111.4 49.1 -72.7 -41.9 43.9 4.8 27.8 45 45 A E H X S+ 0 0 64 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.895 109.4 52.9 -64.5 -42.0 41.4 3.2 25.6 46 46 A L H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 5,-0.3 0.914 109.0 47.2 -60.9 -44.4 43.2 -0.1 25.9 47 47 A D H X>S+ 0 0 35 -4,-1.8 4,-2.5 2,-0.2 5,-0.8 0.848 112.1 51.7 -64.9 -35.4 43.1 -0.0 29.8 48 48 A K H <5S+ 0 0 143 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.902 111.5 47.9 -65.5 -43.7 39.4 0.9 29.6 49 49 A A H <5S+ 0 0 45 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.854 120.8 34.6 -67.9 -37.1 38.8 -2.0 27.3 50 50 A I H <5S- 0 0 36 -4,-2.2 -2,-0.2 2,-0.3 -1,-0.2 0.747 98.8-128.2 -90.7 -31.2 40.7 -4.6 29.5 51 51 A G T <5S+ 0 0 67 -4,-2.5 2,-0.3 1,-0.4 -3,-0.2 0.763 78.3 79.8 87.6 21.3 39.9 -3.3 32.9 52 52 A R S - 0 0 7 -2,-0.8 3,-1.6 -11,-0.3 -1,-0.2 0.658 31.8-147.2-103.7 -22.5 48.2 -2.6 30.5 55 55 A N T 3 S- 0 0 125 1,-0.3 -2,-0.1 -12,-0.2 -11,-0.1 0.927 75.3 -51.5 54.3 47.7 50.8 -0.2 29.6 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.1 2,-0.4 0.518 119.8 95.6 71.3 7.1 50.2 -1.1 25.8 57 57 A V B < +C 16 0B 66 -3,-1.6 2,-0.3 -41,-0.2 -41,-0.2 -0.986 45.8 179.3-135.3 140.1 50.5 -4.8 26.2 58 58 A I - 0 0 4 -43,-2.4 2,-0.1 -2,-0.4 -30,-0.1 -0.851 26.6-110.4-131.1 164.9 47.9 -7.6 26.7 59 59 A T > - 0 0 66 -2,-0.3 4,-2.0 1,-0.1 3,-0.3 -0.438 35.0-104.9 -89.7 169.0 47.9 -11.5 27.1 60 60 A K H > S+ 0 0 109 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.907 122.2 55.1 -56.2 -49.1 46.6 -14.0 24.5 61 61 A D H > S+ 0 0 120 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.815 107.4 48.1 -49.2 -46.0 43.6 -14.6 26.7 62 62 A E H > S+ 0 0 35 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.862 110.1 53.4 -65.8 -41.0 42.7 -10.8 26.7 63 63 A A H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -34,-0.4 0.901 111.3 45.9 -61.7 -44.0 43.2 -10.8 22.9 64 64 A E H X S+ 0 0 77 -4,-2.4 4,-2.9 2,-0.2 -1,-0.2 0.825 107.8 55.9 -69.6 -33.1 40.8 -13.6 22.6 65 65 A K H X S+ 0 0 134 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.971 110.2 45.7 -62.4 -48.4 38.2 -12.1 24.9 66 66 A L H X S+ 0 0 5 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.870 111.0 54.4 -59.0 -38.9 38.1 -9.0 22.8 67 67 A F H X S+ 0 0 12 -4,-1.8 4,-2.5 2,-0.2 5,-0.3 0.966 107.2 49.1 -63.1 -51.3 37.9 -11.1 19.7 68 68 A N H X S+ 0 0 89 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.942 113.1 48.6 -54.2 -45.7 34.9 -12.9 21.1 69 69 A Q H X S+ 0 0 99 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.921 111.7 48.5 -59.6 -45.5 33.3 -9.6 21.9 70 70 A D H X S+ 0 0 38 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.865 111.4 47.5 -63.1 -43.0 33.9 -8.1 18.5 71 71 A V H X S+ 0 0 7 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.923 113.7 49.9 -63.5 -46.0 32.6 -11.1 16.5 72 72 A D H X S+ 0 0 88 -4,-2.2 4,-2.5 -5,-0.3 5,-0.3 0.921 111.8 47.2 -57.0 -47.3 29.5 -11.1 18.7 73 73 A A H X S+ 0 0 43 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.881 109.9 53.6 -64.7 -37.8 29.0 -7.4 18.2 74 74 A A H X S+ 0 0 9 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.929 111.4 45.5 -62.4 -47.6 29.5 -7.8 14.4 75 75 A V H X S+ 0 0 35 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.955 114.9 46.2 -59.2 -52.0 26.8 -10.5 14.2 76 76 A R H X S+ 0 0 112 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.852 110.8 55.6 -60.6 -35.1 24.2 -8.6 16.4 77 77 A G H X S+ 0 0 2 -4,-2.1 4,-0.8 -5,-0.3 3,-0.2 0.941 107.8 46.7 -64.8 -45.0 24.9 -5.5 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.1 3,-0.7 1,-0.2 7,-0.4 0.912 111.7 51.6 -60.5 -43.7 24.1 -7.2 11.2 79 79 A L H 3< S+ 0 0 72 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.771 112.9 45.2 -68.5 -24.6 20.9 -8.7 12.7 80 80 A R H 3< S+ 0 0 173 -4,-1.6 2,-0.5 -3,-0.2 -1,-0.3 0.452 93.6 95.9 -91.2 -14.4 19.7 -5.3 13.9 81 81 A N S+ 0 0 0 -7,-0.2 4,-2.4 -6,-0.2 3,-0.3 0.869 102.3 65.9 -83.0 -43.3 22.2 -5.9 6.3 85 85 A K H X S+ 0 0 78 -4,-2.5 4,-3.1 -7,-0.4 5,-0.2 0.881 99.2 49.9 -49.5 -53.3 19.7 -8.3 7.9 86 86 A P H > S+ 0 0 52 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.889 113.0 49.2 -57.3 -37.9 17.8 -9.2 4.8 87 87 A V H > S+ 0 0 2 -4,-0.5 4,-0.7 -3,-0.3 -2,-0.2 0.948 111.8 47.3 -64.8 -49.0 21.0 -9.9 3.0 88 88 A Y H >< S+ 0 0 35 -4,-2.4 3,-1.4 1,-0.2 -1,-0.2 0.949 110.3 52.6 -58.4 -48.2 22.3 -12.1 5.8 89 89 A D H 3< S+ 0 0 76 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.829 107.5 53.2 -59.5 -31.2 19.1 -14.1 6.0 90 90 A S H 3< S+ 0 0 33 -4,-1.4 -1,-0.3 -5,-0.2 2,-0.2 0.633 96.1 89.9 -79.7 -14.6 19.2 -14.8 2.3 91 91 A L S << S- 0 0 6 -3,-1.4 31,-0.0 -4,-0.7 30,-0.0 -0.584 75.0-116.8 -89.4 157.9 22.7 -16.2 2.3 92 92 A D > - 0 0 54 -2,-0.2 4,-2.3 1,-0.1 -1,-0.1 -0.159 45.5 -93.1 -74.5 168.5 24.1 -19.7 2.8 93 93 A A H > S+ 0 0 74 2,-0.2 4,-1.3 1,-0.2 -1,-0.1 0.830 121.9 45.8 -57.2 -40.5 26.4 -20.4 5.9 94 94 A V H > S+ 0 0 28 62,-0.2 4,-1.5 2,-0.2 3,-0.3 0.934 113.5 48.0 -70.2 -48.2 29.8 -19.7 4.2 95 95 A R H > S+ 0 0 23 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.885 104.5 62.4 -60.1 -37.6 28.7 -16.5 2.5 96 96 A R H X S+ 0 0 78 -4,-2.3 4,-2.2 1,-0.2 -1,-0.3 0.924 101.8 51.2 -51.9 -46.6 27.3 -15.5 5.8 97 97 A C H X S+ 0 0 17 -4,-1.3 4,-2.3 -3,-0.3 -1,-0.2 0.863 104.1 58.2 -60.8 -36.4 30.9 -15.6 7.2 98 98 A A H X S+ 0 0 0 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.922 107.6 46.3 -59.4 -42.3 32.0 -13.4 4.3 99 99 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.896 110.4 52.6 -68.5 -38.0 29.6 -10.7 5.3 100 100 A I H X S+ 0 0 8 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.911 106.5 55.2 -64.0 -36.3 30.6 -10.9 8.9 101 101 A N H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.961 108.6 46.6 -58.6 -52.4 34.2 -10.5 7.8 102 102 A M H X S+ 0 0 2 -4,-2.1 4,-3.0 1,-0.2 5,-0.3 0.896 112.6 50.1 -56.1 -45.9 33.4 -7.2 6.0 103 103 A V H X S+ 0 0 11 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.889 108.3 52.0 -63.5 -37.9 31.4 -5.9 8.9 104 104 A F H < S+ 0 0 31 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.936 118.3 38.4 -63.5 -41.5 34.2 -6.7 11.4 105 105 A Q H < S+ 0 0 58 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.921 132.4 20.2 -74.7 -48.7 36.7 -4.8 9.2 106 106 A M H X S- 0 0 50 -4,-3.0 4,-0.6 -5,-0.2 -3,-0.2 0.421 102.7-117.1-111.9 8.3 34.7 -1.8 8.0 107 107 A G H X - 0 0 34 -4,-1.7 4,-2.1 -5,-0.3 5,-0.2 0.220 34.8 -79.0 69.3 159.4 31.8 -1.5 10.4 108 108 A E H > S+ 0 0 55 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.890 128.9 53.4 -55.1 -49.3 28.0 -1.8 9.7 109 109 A T H > S+ 0 0 124 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.934 108.1 50.2 -56.7 -47.4 27.8 1.6 8.2 110 110 A G H >< S+ 0 0 30 -4,-0.6 3,-0.6 1,-0.2 4,-0.3 0.922 113.7 42.6 -58.1 -51.8 30.5 1.0 5.8 111 111 A V H >< S+ 0 0 0 -4,-2.1 3,-2.4 1,-0.2 -1,-0.2 0.897 108.0 60.4 -64.9 -39.4 29.2 -2.3 4.5 112 112 A A H 3< S+ 0 0 16 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.747 95.0 66.4 -61.3 -19.2 25.6 -0.9 4.3 113 113 A G T << S+ 0 0 54 -4,-1.0 2,-1.7 -3,-0.6 -1,-0.3 0.633 76.5 85.7 -74.1 -15.4 27.1 1.7 1.9 114 114 A F <> + 0 0 42 -3,-2.4 4,-2.3 -4,-0.3 3,-0.4 -0.231 57.0 160.9 -84.6 55.5 27.7 -1.1 -0.6 115 115 A T H > + 0 0 91 -2,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.836 66.6 42.8 -40.4 -58.4 24.2 -0.7 -2.0 116 116 A N H > S+ 0 0 85 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.845 113.6 50.3 -64.6 -39.9 24.6 -2.4 -5.3 117 117 A S H > S+ 0 0 0 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.855 109.2 52.8 -64.9 -42.8 26.7 -5.3 -4.1 118 118 A L H X S+ 0 0 13 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.925 108.4 50.5 -59.5 -45.9 24.2 -6.1 -1.4 119 119 A R H X S+ 0 0 115 -4,-1.8 4,-1.8 -5,-0.3 -2,-0.2 0.918 111.8 47.5 -58.3 -46.4 21.4 -6.1 -3.9 120 120 A M H <>S+ 0 0 27 -4,-2.0 5,-2.5 2,-0.2 4,-0.3 0.841 110.1 51.9 -68.4 -34.3 23.4 -8.5 -6.2 121 121 A L H ><5S+ 0 0 1 -4,-2.1 3,-2.0 1,-0.2 -2,-0.2 0.950 108.8 51.1 -67.9 -42.8 24.2 -10.8 -3.3 122 122 A Q H 3<5S+ 0 0 94 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.865 110.2 49.9 -60.3 -33.6 20.6 -10.9 -2.3 123 123 A Q T 3<5S- 0 0 85 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.503 113.0-122.5 -81.9 -1.7 19.8 -11.8 -5.8 124 124 A K T < 5 + 0 0 96 -3,-2.0 2,-1.1 -4,-0.3 -3,-0.2 0.779 60.8 147.5 63.1 32.3 22.5 -14.5 -5.8 125 125 A R >< + 0 0 119 -5,-2.5 4,-2.8 1,-0.2 5,-0.2 -0.694 19.9 173.9 -98.6 76.3 24.3 -13.0 -8.8 126 126 A W H > + 0 0 49 -2,-1.1 4,-2.0 1,-0.2 -1,-0.2 0.869 69.5 44.9 -52.4 -53.2 27.7 -14.1 -7.6 127 127 A D H > S+ 0 0 105 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.918 115.2 49.4 -63.2 -42.2 29.9 -13.2 -10.4 128 128 A E H > S+ 0 0 97 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.908 110.2 49.0 -65.4 -44.5 28.3 -9.9 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.854 108.0 55.1 -61.0 -39.7 28.6 -9.0 -7.1 130 130 A A H X S+ 0 0 10 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.897 109.0 48.1 -60.9 -42.4 32.4 -10.0 -7.0 131 131 A V H X S+ 0 0 104 -4,-1.8 4,-0.5 2,-0.2 3,-0.3 0.910 113.6 47.3 -66.0 -43.3 33.1 -7.6 -9.8 132 132 A N H >< S+ 0 0 50 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.902 107.7 54.7 -65.2 -42.4 31.1 -4.8 -8.1 133 133 A L H 3< S+ 0 0 2 -4,-2.7 6,-0.4 1,-0.2 -1,-0.2 0.815 101.3 60.8 -59.7 -32.7 32.8 -5.4 -4.8 134 134 A A H 3< S+ 0 0 26 -4,-1.2 2,-1.5 -3,-0.3 -1,-0.2 0.661 86.6 77.9 -70.3 -20.2 36.2 -5.0 -6.4 135 135 A E S << S+ 0 0 155 -3,-1.2 2,-0.3 -4,-0.5 -1,-0.2 -0.558 81.4 94.3 -89.6 67.0 35.4 -1.4 -7.5 136 136 A S S > S- 0 0 20 -2,-1.5 4,-2.0 1,-0.1 3,-0.2 -0.988 85.8-115.1-153.6 158.7 36.0 0.1 -4.1 137 137 A R H > S+ 0 0 141 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.902 115.1 64.4 -60.4 -41.2 38.6 1.7 -2.0 138 138 A W H > S+ 0 0 17 1,-0.2 4,-2.1 2,-0.2 8,-0.2 0.914 105.2 43.1 -45.9 -53.0 38.4 -1.4 0.2 139 139 A Y H 4 S+ 0 0 56 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.898 114.4 49.8 -64.5 -45.4 39.7 -3.5 -2.6 140 140 A N H < S+ 0 0 108 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.872 114.9 43.8 -63.4 -36.9 42.4 -1.0 -3.7 141 141 A Q H < S+ 0 0 104 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.858 131.0 18.8 -78.0 -40.0 43.7 -0.6 -0.1 142 142 A T S X S+ 0 0 22 -4,-2.1 4,-2.6 -5,-0.3 -1,-0.2 -0.563 73.1 163.6-131.1 68.3 43.8 -4.3 1.0 143 143 A P H > + 0 0 52 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.843 69.8 50.1 -58.1 -44.2 43.7 -6.2 -2.2 144 144 A N H > S+ 0 0 113 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.932 117.1 40.0 -65.1 -47.0 44.8 -9.7 -0.9 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.935 115.6 52.4 -63.4 -48.7 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 0.941 109.8 50.8 -53.5 -42.3 39.5 -8.2 -0.2 147 147 A K H X S+ 0 0 90 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.848 106.3 53.0 -63.9 -37.3 40.2 -10.9 -2.8 148 148 A R H X S+ 0 0 52 -4,-1.5 4,-1.6 -3,-0.3 12,-0.2 0.936 114.3 43.3 -63.1 -44.2 39.9 -13.7 -0.3 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.904 112.9 51.2 -66.3 -44.4 36.5 -12.3 0.8 150 150 A I H X S+ 0 0 14 -4,-3.0 4,-2.2 -5,-0.3 -1,-0.2 0.917 109.2 51.5 -60.8 -43.4 35.3 -11.7 -2.7 151 151 A T H X S+ 0 0 34 -4,-2.3 4,-2.5 -5,-0.2 6,-0.4 0.843 106.3 54.1 -60.9 -38.7 36.3 -15.3 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.903 112.0 44.9 -62.4 -39.7 34.3 -16.6 -0.6 153 153 A F H < S+ 0 0 1 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.881 113.9 50.8 -70.1 -39.1 31.2 -14.6 -1.9 154 154 A R H < S+ 0 0 101 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.946 125.7 20.7 -62.6 -52.1 31.8 -15.8 -5.5 155 155 A T H < S- 0 0 46 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.672 85.9-133.6 -94.6 -29.2 32.1 -19.5 -4.8 156 156 A G S < S+ 0 0 16 -4,-2.3 2,-0.2 -5,-0.3 -62,-0.2 0.727 73.9 101.0 76.2 19.5 30.5 -20.1 -1.4 157 157 A T S S- 0 0 49 -6,-0.4 3,-0.4 -5,-0.2 -1,-0.3 -0.800 81.6-116.5-128.2 174.9 33.5 -22.3 -0.4 158 158 A W S >> S+ 0 0 28 -2,-0.2 3,-1.7 1,-0.2 4,-0.7 0.145 71.9 122.5 -98.5 17.1 36.5 -21.8 1.8 159 159 A D G >4 + 0 0 98 1,-0.3 3,-1.3 2,-0.2 4,-0.5 0.842 66.3 58.0 -47.3 -44.5 38.9 -22.2 -1.0 160 160 A A G 34 S+ 0 0 14 -3,-0.4 4,-0.3 1,-0.3 -1,-0.3 0.729 113.2 40.1 -62.4 -21.4 40.6 -18.8 -0.6 161 161 A Y G <4 S+ 0 0 1 -3,-1.7 -1,-0.3 2,-0.1 -2,-0.2 0.402 93.5 81.7-104.7 -3.3 41.6 -19.7 2.9 162 162 A K S << S+ 0 0 138 -3,-1.3 -2,-0.1 -4,-0.7 -1,-0.1 0.623 92.6 53.1 -83.0 -9.1 42.6 -23.3 2.5 163 163 A N 0 0 130 -4,-0.5 -1,-0.2 1,-0.1 -2,-0.1 0.892 360.0 360.0 -73.5 -57.3 45.8 -22.3 1.3 164 164 A L 0 0 116 -4,-0.3 -2,-0.2 0, 0.0 -1,-0.1 0.588 360.0 360.0 -71.8 360.0 46.6 -20.1 4.3