==== 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) 05-FEB-88 1L03 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR S.DAO-PIN,K.WILSON,T.ALBER,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8696.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.0 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 . 11 6.7 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 76 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 154.2 36.9 -23.5 9.0 2 2 A N > - 0 0 69 95,-0.0 4,-2.5 1,-0.0 3,-0.2 -0.872 360.0 -87.3-144.7 171.2 34.8 -21.0 10.9 3 3 A I H > S+ 0 0 21 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.842 123.7 51.3 -51.4 -41.9 34.4 -17.2 11.3 4 4 A F H > S+ 0 0 74 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.933 112.0 43.8 -65.6 -44.6 37.0 -17.2 14.1 5 5 A E H > S+ 0 0 92 -3,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.872 113.9 53.0 -67.2 -37.7 39.7 -19.0 12.2 6 6 A M H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 3,-0.4 0.959 112.4 42.8 -61.4 -54.6 38.9 -17.0 9.1 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 5,-0.4 0.833 108.9 58.4 -63.8 -32.2 39.3 -13.7 10.9 8 8 A R H X S+ 0 0 109 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.2 0.882 107.4 48.7 -65.2 -32.2 42.4 -14.9 12.8 9 9 A I H < S+ 0 0 51 -4,-1.5 -2,-0.2 -3,-0.4 -1,-0.2 0.951 115.4 44.0 -70.7 -44.3 44.0 -15.5 9.4 10 10 A D H < S+ 0 0 19 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.785 124.1 30.0 -69.0 -35.3 43.0 -12.0 8.1 11 11 A E H < S- 0 0 33 -4,-2.1 19,-0.3 -5,-0.2 -1,-0.2 0.662 90.8-150.5-101.7 -25.3 43.9 -9.9 11.1 12 12 A G < - 0 0 19 -4,-1.6 2,-0.4 -5,-0.4 -1,-0.1 -0.249 24.7 -87.5 79.2-179.3 46.8 -11.7 12.7 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.969 42.6 174.4-135.7 122.9 47.5 -11.6 16.5 14 14 A R E -A 28 0A 131 14,-1.8 14,-2.2 -2,-0.4 4,-0.1 -1.000 17.9-165.6-131.6 127.5 49.6 -8.9 18.1 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.2 12,-0.2 2,-0.3 0.431 74.1 62.8 -91.8 -0.9 50.0 -8.5 21.8 16 16 A K E S-C 57 0B 107 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.911 101.5 -87.6-123.4 146.7 51.5 -5.0 21.8 17 17 A I E + 0 0 21 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.308 59.1 171.4 -52.1 138.0 49.8 -1.8 20.5 18 18 A Y E -A 26 0A 29 8,-2.5 8,-2.7 -4,-0.1 2,-0.5 -0.875 34.9-105.0-141.5 170.2 50.4 -1.5 16.8 19 19 A K E -A 25 0A 124 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.873 33.9-136.7-102.8 134.9 49.2 0.6 13.8 20 20 A D > - 0 0 47 4,-2.8 3,-2.2 -2,-0.5 -1,-0.1 -0.093 39.7 -82.3 -76.6-175.7 46.8 -1.0 11.4 21 21 A T T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.834 133.8 49.1 -59.0 -29.8 47.0 -0.7 7.6 22 22 A E T 3 S- 0 0 78 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.376 124.5-102.6 -89.3 1.5 45.3 2.7 7.9 23 23 A G S < S+ 0 0 37 -3,-2.2 2,-0.3 1,-0.3 -2,-0.1 0.534 74.9 141.4 89.5 14.0 47.7 3.9 10.5 24 24 A Y - 0 0 81 1,-0.1 -4,-2.8 -5,-0.0 2,-0.3 -0.668 59.8-103.4 -95.1 148.5 45.3 3.4 13.5 25 25 A Y E +AB 19 34A 30 9,-0.7 8,-3.3 11,-0.4 9,-1.3 -0.472 54.3 158.1 -66.5 119.9 46.2 2.2 16.9 26 26 A T E -AB 18 32A 3 -8,-2.7 -8,-2.5 -2,-0.3 2,-0.3 -0.837 19.6-169.9-136.1 165.6 45.0 -1.5 17.3 27 27 A I E > + B 0 31A 0 4,-1.3 4,-1.9 -2,-0.3 -12,-0.2 -0.960 52.7 5.2-153.6 164.5 45.9 -4.4 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.2 -14,-1.8 -2,-0.3 2,-0.8 -0.367 123.2 -6.8 68.1-130.3 45.0 -8.2 19.5 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.678 127.1 -53.0-102.4 73.6 43.1 -9.6 16.6 30 30 A G T 4 S+ 0 0 15 -2,-0.8 2,-1.0 -19,-0.3 -2,-0.2 0.760 83.1 160.5 66.3 28.0 42.2 -6.4 14.7 31 31 A H E < -B 27 0A 34 -4,-1.9 -4,-1.3 1,-0.0 -1,-0.2 -0.685 33.4-142.5 -83.2 102.7 40.7 -4.6 17.7 32 32 A L E -B 26 0A 69 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.375 19.6-177.1 -61.9 130.5 40.7 -0.9 16.8 33 33 A L E - 0 0 14 -8,-3.3 2,-0.3 1,-0.4 -7,-0.2 0.887 59.5 -24.3 -95.8 -47.8 41.5 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 -0.979 35.6-139.5-160.0 151.2 41.2 4.8 18.5 35 35 A K S S+ 0 0 140 -2,-0.3 -1,-0.0 -11,-0.1 7,-0.0 0.435 75.8 111.8 -90.7 -2.4 41.5 6.7 15.2 36 36 A S S S- 0 0 43 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.422 73.1-130.7 -73.3 146.8 43.3 9.4 17.3 37 37 A P S S+ 0 0 121 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.604 76.1 101.6 -73.8 -9.5 47.0 10.1 16.7 38 38 A S > - 0 0 49 1,-0.2 4,-1.9 2,-0.0 3,-0.2 -0.698 56.1-160.5 -89.6 121.8 47.9 9.9 20.3 39 39 A L H > S+ 0 0 67 -2,-0.6 4,-2.3 1,-0.3 -1,-0.2 0.766 100.0 57.9 -62.6 -24.1 49.6 6.8 21.6 40 40 A N H > S+ 0 0 117 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.926 101.7 49.5 -72.8 -42.9 48.4 8.1 24.9 41 41 A A H > S+ 0 0 33 1,-0.2 4,-1.8 -3,-0.2 -2,-0.2 0.855 113.3 50.7 -61.8 -35.6 44.8 8.2 23.8 42 42 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.864 106.9 51.5 -69.6 -42.2 45.3 4.6 22.7 43 43 A K H X S+ 0 0 51 -4,-2.3 4,-1.9 1,-0.2 11,-0.3 0.854 111.0 50.2 -65.6 -29.6 46.9 3.4 25.9 44 44 A S H X S+ 0 0 72 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.916 108.9 49.0 -73.5 -42.8 44.0 4.9 27.7 45 45 A E H X S+ 0 0 67 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.930 110.4 54.4 -61.2 -44.0 41.4 3.2 25.5 46 46 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 5,-0.3 0.915 107.4 47.1 -57.0 -46.9 43.2 -0.0 26.0 47 47 A D H X>S+ 0 0 38 -4,-1.9 4,-2.1 1,-0.2 5,-0.7 0.872 112.7 51.2 -64.9 -33.3 43.1 0.2 29.8 48 48 A K H <5S+ 0 0 143 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.878 110.9 48.7 -68.9 -37.7 39.4 1.0 29.6 49 49 A A H <5S+ 0 0 45 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.865 121.0 33.5 -71.0 -35.0 38.8 -2.0 27.4 50 50 A I H <5S- 0 0 38 -4,-2.1 -2,-0.2 2,-0.3 -1,-0.2 0.742 99.2-127.5 -93.2 -29.1 40.7 -4.5 29.5 51 51 A G T <5S+ 0 0 69 -4,-2.1 2,-0.3 1,-0.4 -3,-0.2 0.739 77.7 78.1 83.8 25.5 39.9 -3.1 32.9 52 52 A R S - 0 0 8 -2,-0.9 3,-1.3 -11,-0.3 -1,-0.2 0.730 31.7-144.7 -97.6 -21.2 48.2 -2.6 30.7 55 55 A N T 3 S- 0 0 129 1,-0.3 -2,-0.1 -12,-0.1 3,-0.1 0.891 74.8 -53.9 58.9 41.6 50.9 -0.3 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.1 2,-0.4 0.555 119.1 97.4 74.9 6.3 50.3 -1.1 26.0 57 57 A V B < -C 16 0B 61 -3,-1.3 2,-0.3 -41,-0.2 -41,-0.2 -0.990 45.7-179.9-133.4 143.2 50.6 -4.8 26.4 58 58 A I - 0 0 5 -43,-2.2 2,-0.1 -2,-0.4 -30,-0.1 -0.837 25.2-112.5-132.3 164.9 48.0 -7.6 26.8 59 59 A T > - 0 0 67 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.447 34.6-104.7 -90.1 167.8 48.0 -11.5 27.2 60 60 A K H > S+ 0 0 113 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.920 122.2 54.1 -56.1 -48.4 46.7 -14.1 24.7 61 61 A D H > S+ 0 0 120 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.839 108.1 48.3 -51.8 -47.4 43.6 -14.6 26.8 62 62 A E H > S+ 0 0 36 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.883 110.0 52.8 -64.1 -43.0 42.8 -10.8 26.8 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -34,-0.4 0.906 110.4 47.7 -59.8 -43.2 43.2 -10.7 23.1 64 64 A E H X S+ 0 0 75 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.819 108.0 54.8 -69.7 -31.1 40.8 -13.6 22.7 65 65 A K H X S+ 0 0 138 -4,-1.6 4,-2.3 -5,-0.2 -2,-0.2 0.970 109.0 46.7 -65.9 -47.6 38.3 -12.1 24.9 66 66 A L H X S+ 0 0 3 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.869 111.1 54.5 -56.6 -40.7 38.2 -8.8 22.9 67 67 A F H X S+ 0 0 12 -4,-1.9 4,-2.3 -5,-0.2 5,-0.3 0.948 106.0 50.2 -63.4 -46.9 38.0 -11.0 19.7 68 68 A N H X S+ 0 0 90 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.941 112.3 48.6 -55.8 -46.4 34.9 -12.8 21.1 69 69 A Q H X S+ 0 0 96 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.890 111.8 49.1 -61.7 -42.6 33.2 -9.5 21.9 70 70 A D H X S+ 0 0 36 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.835 110.6 47.4 -64.5 -40.9 34.0 -8.1 18.5 71 71 A V H X S+ 0 0 7 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.928 114.3 49.4 -64.8 -45.1 32.7 -11.0 16.5 72 72 A D H X S+ 0 0 86 -4,-2.2 4,-2.4 -5,-0.3 5,-0.3 0.916 111.8 47.7 -58.7 -46.5 29.5 -11.0 18.6 73 73 A A H X S+ 0 0 43 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.878 109.7 53.2 -65.1 -38.3 29.0 -7.3 18.2 74 74 A A H X S+ 0 0 9 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.949 111.6 45.8 -62.5 -50.1 29.6 -7.6 14.4 75 75 A V H X S+ 0 0 32 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.952 114.0 47.7 -55.2 -52.7 26.9 -10.3 14.1 76 76 A R H X S+ 0 0 110 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.884 110.0 54.5 -59.4 -36.7 24.3 -8.3 16.3 77 77 A G H X S+ 0 0 2 -4,-2.2 4,-0.7 -5,-0.3 -1,-0.2 0.922 107.5 47.8 -66.8 -40.0 25.0 -5.3 14.3 78 78 A I H >< S+ 0 0 0 -4,-1.9 3,-1.0 1,-0.2 7,-0.4 0.936 111.4 52.0 -62.3 -43.7 24.2 -7.1 11.1 79 79 A L H 3< S+ 0 0 69 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.771 112.6 45.7 -64.5 -26.5 21.0 -8.4 12.6 80 80 A R H 3< S+ 0 0 173 -4,-1.7 2,-0.5 -5,-0.1 -1,-0.3 0.424 93.0 94.5 -92.3 -10.1 20.0 -4.9 13.8 81 81 A N S+ 0 0 0 -7,-0.2 4,-2.6 -6,-0.2 3,-0.2 0.854 101.0 66.3 -85.1 -39.3 22.2 -5.8 6.2 85 85 A K H X S+ 0 0 78 -4,-2.5 4,-3.0 -7,-0.4 5,-0.2 0.878 99.2 51.3 -51.0 -49.1 19.8 -8.3 7.9 86 86 A P H > S+ 0 0 53 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.885 112.5 47.5 -61.5 -38.8 17.9 -9.2 4.7 87 87 A V H > S+ 0 0 2 -4,-0.5 4,-0.8 -3,-0.2 3,-0.4 0.956 112.2 48.0 -65.0 -51.3 21.1 -10.0 2.9 88 88 A Y H >< S+ 0 0 36 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.932 110.1 52.7 -54.7 -47.0 22.5 -12.0 5.8 89 89 A D H 3< S+ 0 0 76 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.814 106.8 53.9 -61.6 -28.8 19.2 -14.0 6.1 90 90 A S H 3< S+ 0 0 34 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.638 96.1 91.3 -80.2 -13.6 19.3 -14.8 2.4 91 91 A L S << S- 0 0 6 -3,-1.4 31,-0.0 -4,-0.8 30,-0.0 -0.552 73.8-118.9 -88.8 155.7 22.8 -16.2 2.5 92 92 A D > - 0 0 55 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.158 44.5 -93.7 -73.2 171.4 24.2 -19.8 3.0 93 93 A A H > S+ 0 0 76 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.873 121.8 47.4 -60.4 -40.7 26.5 -20.4 6.0 94 94 A V H >> S+ 0 0 27 62,-0.2 4,-1.3 2,-0.2 3,-0.5 0.949 112.8 47.4 -66.8 -49.3 29.8 -19.8 4.3 95 95 A R H 3> S+ 0 0 23 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.869 103.8 62.7 -62.2 -32.3 28.8 -16.6 2.6 96 96 A R H 3X S+ 0 0 79 -4,-2.1 4,-2.4 1,-0.2 -1,-0.3 0.917 100.1 54.4 -58.2 -39.2 27.4 -15.4 5.9 97 97 A C H S+ 0 0 58 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.865 127.7 52.5 -50.8 -48.9 28.2 -1.7 9.6 109 109 A T H > S+ 0 0 122 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.934 107.6 50.9 -60.9 -47.3 27.9 1.7 8.1 110 110 A G H < S+ 0 0 33 -4,-0.5 3,-0.4 1,-0.2 -1,-0.2 0.904 114.6 41.4 -58.5 -48.3 30.7 1.1 5.7 111 111 A V H >< S+ 0 0 0 -4,-2.0 3,-2.7 1,-0.2 -2,-0.2 0.912 107.0 62.0 -68.9 -39.2 29.3 -2.2 4.4 112 112 A A H 3< S+ 0 0 14 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.764 94.9 66.1 -57.1 -22.8 25.8 -0.9 4.3 113 113 A G T 3< S+ 0 0 55 -4,-1.1 2,-1.2 -3,-0.4 -1,-0.3 0.604 75.9 85.8 -72.8 -14.3 27.1 1.7 1.8 114 114 A F <> + 0 0 40 -3,-2.7 4,-2.4 1,-0.2 3,-0.5 -0.190 56.4 159.1 -84.0 49.9 27.8 -1.1 -0.7 115 115 A T H > + 0 0 92 -2,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.828 66.7 44.0 -35.8 -60.4 24.2 -0.8 -2.0 116 116 A N H > S+ 0 0 85 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.879 113.9 47.9 -61.3 -45.7 24.7 -2.4 -5.4 117 117 A S H > S+ 0 0 1 -3,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.883 110.5 54.1 -62.4 -41.9 26.9 -5.3 -4.3 118 118 A L H X S+ 0 0 14 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.883 108.1 49.4 -58.2 -44.6 24.4 -6.1 -1.5 119 119 A R H X S+ 0 0 114 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.921 111.5 49.3 -61.6 -48.7 21.5 -6.2 -4.0 120 120 A M H <>S+ 0 0 26 -4,-2.0 5,-2.2 2,-0.2 4,-0.4 0.924 109.9 50.3 -61.1 -42.7 23.5 -8.6 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.4 3,-2.2 1,-0.2 -2,-0.2 0.962 109.6 51.4 -61.4 -45.4 24.3 -10.9 -3.4 122 122 A Q H 3<5S+ 0 0 94 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.834 110.4 49.0 -57.8 -35.5 20.7 -11.0 -2.3 123 123 A Q T 3<5S- 0 0 90 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.485 113.8-122.6 -81.8 -1.4 19.8 -11.9 -5.8 124 124 A K T < 5 + 0 0 97 -3,-2.2 2,-1.3 -4,-0.4 -3,-0.2 0.767 60.2 147.9 62.4 32.2 22.5 -14.6 -5.8 125 125 A R >< + 0 0 119 -5,-2.2 4,-2.6 1,-0.2 -1,-0.2 -0.735 20.2 175.0 -96.7 80.6 24.4 -13.2 -8.8 126 126 A W H > S+ 0 0 50 -2,-1.3 4,-1.8 1,-0.2 -1,-0.2 0.898 70.8 44.8 -57.7 -49.9 27.8 -14.4 -7.5 127 127 A D H > S+ 0 0 108 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.878 115.0 48.9 -65.0 -40.4 30.0 -13.4 -10.4 128 128 A E H > S+ 0 0 95 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.904 111.1 48.9 -69.2 -41.6 28.4 -10.1 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.834 107.9 54.5 -63.9 -35.6 28.7 -9.2 -7.2 130 130 A A H X S+ 0 0 10 -4,-1.8 4,-1.0 2,-0.2 -2,-0.2 0.922 110.1 48.1 -65.2 -42.1 32.4 -10.3 -7.1 131 131 A V H >X S+ 0 0 88 -4,-1.8 3,-0.6 1,-0.2 4,-0.6 0.949 113.3 46.5 -62.8 -50.3 33.1 -7.9 -10.0 132 132 A N H >< S+ 0 0 42 -4,-2.3 3,-1.1 1,-0.2 -2,-0.2 0.896 108.0 55.3 -61.0 -42.4 31.2 -5.0 -8.4 133 133 A L H 3< S+ 0 0 2 -4,-2.4 6,-0.3 1,-0.2 -1,-0.2 0.793 99.8 62.5 -58.9 -31.5 32.8 -5.5 -4.9 134 134 A A H << S+ 0 0 28 -4,-1.0 2,-1.6 -3,-0.6 -1,-0.2 0.631 86.1 78.6 -70.1 -18.5 36.4 -5.2 -6.5 135 135 A K S << S+ 0 0 152 -3,-1.1 2,-0.3 -4,-0.6 -1,-0.2 -0.513 80.1 93.1 -91.6 67.8 35.5 -1.6 -7.6 136 136 A S S > S- 0 0 20 -2,-1.6 4,-1.9 1,-0.1 3,-0.4 -0.991 85.7-113.5-153.1 159.3 36.1 -0.1 -4.2 137 137 A R H > S+ 0 0 143 -2,-0.3 4,-3.2 1,-0.2 5,-0.4 0.913 115.6 64.7 -60.1 -40.1 38.8 1.6 -2.1 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.911 105.0 42.0 -45.6 -50.6 38.6 -1.5 0.1 139 139 A Y H 4 S+ 0 0 57 -3,-0.4 -1,-0.2 -6,-0.3 -2,-0.2 0.890 115.4 49.3 -68.7 -43.2 39.9 -3.7 -2.7 140 140 A N H < S+ 0 0 108 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.882 115.5 43.8 -66.0 -38.6 42.5 -1.2 -3.8 141 141 A Q H < S+ 0 0 107 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.861 131.4 17.8 -75.7 -40.9 43.9 -0.7 -0.3 142 142 A T S X S+ 0 0 21 -4,-2.2 4,-2.3 -5,-0.4 -1,-0.2 -0.553 73.3 163.5-131.8 68.9 43.9 -4.4 1.0 143 143 A P H > + 0 0 50 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.828 69.1 52.5 -58.0 -41.1 43.8 -6.4 -2.2 144 144 A N H > S+ 0 0 111 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.947 115.8 40.1 -65.5 -46.7 44.9 -9.8 -0.8 145 145 A R H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.911 114.9 52.6 -64.4 -45.7 42.4 -9.9 2.0 146 146 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.925 108.6 51.9 -57.2 -42.8 39.6 -8.4 -0.3 147 147 A K H X S+ 0 0 91 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.855 107.5 52.0 -61.1 -37.9 40.3 -11.2 -2.9 148 148 A R H X S+ 0 0 52 -4,-1.4 4,-1.7 2,-0.2 12,-0.2 0.954 114.2 42.5 -62.6 -49.1 40.0 -13.8 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.907 114.0 51.1 -63.2 -44.9 36.6 -12.5 0.9 150 150 A I H X S+ 0 0 13 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.911 108.6 51.6 -61.2 -43.4 35.4 -11.9 -2.6 151 151 A T H X S+ 0 0 34 -4,-2.3 4,-2.4 -5,-0.2 6,-0.3 0.850 106.3 55.4 -62.9 -36.2 36.3 -15.5 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.893 110.6 44.0 -63.8 -40.6 34.4 -16.7 -0.6 153 153 A F H < S+ 0 0 2 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.847 114.1 52.5 -71.2 -36.0 31.2 -14.9 -1.9 154 154 A R H < S+ 0 0 98 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.928 125.0 20.2 -65.5 -48.5 31.9 -16.1 -5.4 155 155 A T H < S- 0 0 43 -4,-2.4 -2,-0.2 2,-0.2 -3,-0.2 0.689 83.1-136.7 -99.9 -24.8 32.2 -19.7 -4.6 156 156 A G S < S+ 0 0 16 -4,-2.1 2,-0.3 -5,-0.3 -62,-0.2 0.721 73.8 101.4 72.7 20.0 30.5 -20.3 -1.3 157 157 A C S S- 0 0 62 -6,-0.3 3,-0.3 -5,-0.2 -1,-0.3 -0.827 79.3-118.4-129.7 166.2 33.5 -22.6 -0.4 158 158 A W S >> S+ 0 0 29 -2,-0.3 3,-1.5 1,-0.2 4,-0.7 0.113 70.7 120.1 -95.8 18.2 36.6 -22.0 1.8 159 159 A D G >4 + 0 0 95 1,-0.2 3,-1.2 2,-0.2 4,-0.4 0.825 65.4 61.8 -49.7 -43.1 39.2 -22.5 -0.8 160 160 A A G 34 S+ 0 0 15 -3,-0.3 4,-0.3 1,-0.3 -1,-0.2 0.720 113.3 38.5 -59.0 -22.4 40.8 -19.0 -0.5 161 161 A Y G <4 S+ 0 0 1 -3,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.473 96.0 78.1-108.4 -5.5 41.7 -19.8 3.1 162 162 A K S << S+ 0 0 133 -3,-1.2 -2,-0.1 -4,-0.7 -1,-0.1 0.413 93.9 55.1 -88.9 2.1 42.7 -23.5 2.8 163 163 A N 0 0 125 -4,-0.4 -1,-0.2 -3,-0.1 -2,-0.1 0.837 360.0 360.0 -78.4 -56.9 45.9 -22.4 1.4 164 164 A L 0 0 119 -4,-0.3 -2,-0.2 0, 0.0 -3,-0.1 0.569 360.0 360.0 -68.5 360.0 46.7 -20.1 4.4