==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-MAY-04 1WDP . COMPND 2 MOLECULE: BETA-AMYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GLYCINE MAX; . AUTHOR Y.N.KANG,M.ADACHI,S.UTSUMI,B.MIKAMI . 493 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19267.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 331 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 2.6 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 . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 33 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 136 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.0 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 2 2 2 0 1 1 0 1 1 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 RESIDUES PER ALPHA HELIX . 1 0 6 0 1 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 PARALLEL BRIDGES PER LADDER . 4 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 1 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 3 A S > 0 0 102 0, 0.0 4,-4.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 144.8 -11.3 64.1 15.0 2 4 A D H > + 0 0 125 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.960 360.0 40.9 -59.7 -56.9 -10.9 61.4 12.3 3 5 A S H > S+ 0 0 66 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.890 116.7 47.6 -59.7 -40.9 -7.2 61.9 12.1 4 6 A N H 4 S+ 0 0 36 1,-0.2 4,-0.4 2,-0.2 -2,-0.2 0.963 113.2 49.6 -68.5 -38.6 -6.7 62.3 15.8 5 7 A M H >< S+ 0 0 23 -4,-4.2 3,-2.0 1,-0.2 4,-0.3 0.903 107.5 55.7 -61.1 -40.0 -8.7 59.2 16.3 6 8 A L H >< S+ 0 0 35 -4,-2.9 3,-1.9 1,-0.3 -1,-0.2 0.868 99.1 59.6 -61.5 -34.2 -6.5 57.5 13.6 7 9 A L T 3< S+ 0 0 53 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.658 102.2 56.0 -65.2 -9.0 -3.4 58.4 15.6 8 10 A N T < S+ 0 0 0 -3,-2.0 -1,-0.3 -4,-0.4 433,-0.2 0.445 79.9 127.0 -96.2 -2.9 -5.0 56.3 18.4 9 11 A Y < - 0 0 5 -3,-1.9 431,-0.2 -4,-0.3 430,-0.1 -0.312 40.6-166.6 -62.8 132.2 -5.3 53.2 16.2 10 12 A V - 0 0 0 429,-2.2 403,-0.1 426,-0.2 402,-0.1 -0.982 23.6-125.1-117.0 119.5 -3.9 50.0 17.6 11 13 A P - 0 0 0 0, 0.0 403,-1.9 0, 0.0 2,-0.4 -0.309 17.8-145.1 -69.3 151.9 -3.5 47.2 15.1 12 14 A V E -a 414 0A 0 32,-0.2 34,-2.2 401,-0.2 35,-1.3 -0.961 14.6-174.4-120.2 129.5 -5.1 43.8 15.6 13 15 A Y E -ab 415 47A 8 401,-2.7 403,-3.2 -2,-0.4 2,-0.4 -0.848 12.8-145.1-118.7 154.8 -3.6 40.5 14.5 14 16 A V E -ab 416 48A 0 33,-1.7 35,-1.7 -2,-0.3 2,-0.2 -0.989 17.7-125.3-125.4 127.7 -5.1 37.0 14.6 15 17 A M E - b 0 49A 11 401,-2.9 404,-3.1 -2,-0.4 403,-0.3 -0.514 29.3-123.4 -66.2 136.0 -3.0 33.8 15.2 16 18 A L - 0 0 3 33,-3.0 35,-0.1 -2,-0.2 3,-0.1 -0.289 38.1 -82.8 -72.6 161.4 -3.5 31.1 12.6 17 19 A P > - 0 0 34 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.376 54.5 -97.8 -60.9 145.4 -4.7 27.6 13.5 18 20 A L T 3 S+ 0 0 74 1,-0.2 4,-0.1 2,-0.1 32,-0.0 -0.376 106.7 22.7 -62.4 138.2 -2.0 25.3 14.7 19 21 A G T 3 + 0 0 8 2,-0.2 9,-0.3 32,-0.1 -1,-0.2 0.607 65.9 145.1 82.0 16.5 -0.7 23.1 12.0 20 22 A V S < S+ 0 0 20 -3,-1.3 8,-1.0 1,-0.2 2,-0.5 0.880 87.4 36.5 -53.9 -41.1 -1.7 25.1 9.0 21 23 A V B S-J 27 0B 1 6,-0.2 6,-0.2 7,-0.1 -2,-0.2 -0.972 105.8-139.2 -99.3 124.3 1.5 23.7 7.6 22 24 A N > - 0 0 25 4,-2.6 3,-2.4 -2,-0.5 4,-0.2 -0.187 25.5 -91.5 -85.4 177.3 1.7 20.2 9.0 23 25 A V T 3 S+ 0 0 54 1,-0.3 -1,-0.1 2,-0.1 78,-0.0 0.725 125.6 57.6 -61.8 -24.4 4.5 18.1 10.4 24 26 A D T 3 S- 0 0 121 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.330 120.4-107.5 -87.5 8.0 5.2 16.7 7.0 25 27 A N S < S+ 0 0 21 -3,-2.4 2,-0.4 1,-0.3 44,-0.2 0.900 74.9 137.9 65.2 45.0 5.7 20.2 5.5 26 28 A V - 0 0 74 -4,-0.2 -4,-2.6 43,-0.1 2,-1.2 -0.974 56.1-138.3-120.0 128.6 2.4 20.2 3.7 27 29 A F B -J 21 0B 27 -2,-0.4 -6,-0.2 -6,-0.2 -7,-0.1 -0.769 32.5-171.7 -83.1 99.2 0.1 23.2 3.5 28 30 A E + 0 0 126 -2,-1.2 -1,-0.2 -8,-1.0 -7,-0.1 0.847 60.8 19.5 -76.0 -39.3 -2.9 21.0 4.0 29 31 A D > + 0 0 100 -9,-0.5 4,-2.1 1,-0.1 -1,-0.2 -0.569 57.5 157.1-134.5 71.2 -6.0 23.1 3.4 30 32 A P H > S+ 0 0 51 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.875 78.3 54.7 -61.6 -37.2 -5.4 26.3 1.5 31 33 A D H > S+ 0 0 122 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.915 109.5 45.8 -66.6 -38.9 -9.0 26.6 0.4 32 34 A G H > S+ 0 0 17 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.919 113.8 48.9 -68.5 -39.9 -10.4 26.4 3.9 33 35 A L H X S+ 0 0 6 -4,-2.1 4,-3.0 1,-0.2 5,-0.2 0.922 106.5 57.6 -65.0 -42.4 -7.9 28.9 5.2 34 36 A K H X S+ 0 0 98 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.931 104.2 50.7 -51.8 -47.4 -8.6 31.3 2.4 35 37 A E H X S+ 0 0 136 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.925 113.6 46.0 -60.2 -41.4 -12.3 31.5 3.3 36 38 A Q H X S+ 0 0 27 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.929 111.5 51.0 -67.2 -44.5 -11.4 32.2 7.0 37 39 A L H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.881 106.6 54.4 -62.7 -39.4 -8.7 34.8 6.0 38 40 A L H X S+ 0 0 80 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.866 106.2 52.9 -64.9 -34.0 -11.2 36.7 3.8 39 41 A Q H X S+ 0 0 77 -4,-1.5 4,-1.7 -5,-0.2 -2,-0.2 0.910 108.9 49.5 -64.8 -39.9 -13.6 36.9 6.7 40 42 A L H <>S+ 0 0 0 -4,-1.9 5,-2.1 2,-0.2 4,-0.4 0.904 109.5 51.9 -63.5 -41.0 -10.8 38.4 8.8 41 43 A R H ><5S+ 0 0 46 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.942 110.6 47.1 -59.7 -46.7 -10.0 40.9 6.0 42 44 A A H 3<5S+ 0 0 92 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.834 107.1 59.0 -66.9 -29.0 -13.7 42.0 5.8 43 45 A A T 3<5S- 0 0 13 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.485 119.8-109.1 -74.3 -7.9 -13.7 42.3 9.7 44 46 A G T < 5 + 0 0 9 -3,-1.4 -32,-0.2 -4,-0.4 402,-0.2 0.509 59.8 161.2 93.2 5.8 -10.9 44.8 9.5 45 47 A V < - 0 0 0 -5,-2.1 -1,-0.2 1,-0.1 -32,-0.2 -0.330 33.0-148.2 -61.0 139.4 -8.1 42.7 11.0 46 48 A D - 0 0 6 -34,-2.2 37,-1.7 1,-0.2 2,-0.3 0.912 61.7 -38.5 -77.9 -43.0 -4.7 44.1 10.2 47 49 A G E -bc 13 83A 0 -35,-1.3 -33,-1.7 35,-0.3 2,-0.3 -0.902 53.6-105.4-165.6-172.8 -2.7 40.8 9.9 48 50 A V E -bc 14 84A 0 35,-2.6 37,-2.7 -35,-0.3 2,-0.4 -0.849 17.3-138.7-129.0 166.1 -2.1 37.3 11.2 49 51 A M E +bc 15 85A 4 -35,-1.7 -33,-3.0 -2,-0.3 2,-0.3 -0.966 21.3 178.2-127.3 141.4 0.6 35.5 13.2 50 52 A V E - c 0 86A 9 35,-2.3 37,-2.8 -2,-0.4 2,-0.4 -0.999 30.4-119.4-142.9 146.2 2.0 32.0 12.5 51 53 A D E - c 0 87A 21 -2,-0.3 2,-0.8 35,-0.2 37,-0.2 -0.693 17.0-153.9 -73.9 130.0 4.6 29.7 14.0 52 54 A V E - c 0 88A 0 35,-2.6 37,-1.8 -2,-0.4 2,-0.4 -0.879 28.5-142.9-104.1 91.1 7.4 28.9 11.5 53 55 A W E >> - c 0 89A 10 -2,-0.8 4,-2.4 1,-0.2 3,-1.5 -0.417 18.0-155.5 -74.3 121.4 8.3 25.6 13.1 54 56 A W H 3> S+ 0 0 0 35,-2.8 4,-2.3 -2,-0.4 -1,-0.2 0.892 97.0 58.8 -53.1 -45.6 11.9 24.5 13.2 55 57 A G H 34 S+ 0 0 3 34,-0.4 -1,-0.3 36,-0.4 52,-0.2 0.667 110.4 42.7 -65.3 -17.9 10.9 20.9 13.4 56 58 A I H X4 S+ 0 0 3 -3,-1.5 3,-0.9 47,-0.1 -2,-0.2 0.892 119.4 39.5 -82.4 -55.3 9.0 21.2 10.1 57 59 A I H 3< S+ 0 0 3 -4,-2.4 9,-1.5 1,-0.2 3,-0.3 0.870 122.1 33.9 -71.6 -46.2 11.6 23.2 8.1 58 60 A E T 3< S+ 0 0 0 -4,-2.3 -1,-0.2 -5,-0.2 6,-0.2 -0.118 82.7 118.3-104.2 36.2 15.0 21.7 9.1 59 61 A L < + 0 0 73 -3,-0.9 49,-0.4 1,-0.2 -1,-0.2 0.884 62.5 60.9 -72.4 -38.9 13.8 18.2 9.5 60 62 A K S S- 0 0 173 4,-0.5 -1,-0.2 -3,-0.3 5,-0.1 0.872 120.1 -66.1 -60.9 -39.6 15.8 16.4 6.8 61 63 A G S > S- 0 0 5 3,-0.5 3,-2.2 -3,-0.1 -1,-0.2 -0.955 79.3 -27.1 166.4 175.2 19.2 17.3 8.4 62 64 A P T 3 S- 0 0 45 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.289 127.7 -3.5 -54.9 128.5 21.5 20.3 9.2 63 65 A K T 3 S+ 0 0 128 1,-0.2 2,-1.0 -5,-0.1 -5,-0.0 0.573 95.8 127.0 63.5 19.9 21.0 23.2 6.9 64 66 A Q < + 0 0 104 -3,-2.2 -4,-0.5 -6,-0.2 -3,-0.5 -0.768 38.2 174.6-104.2 85.5 18.5 21.2 4.8 65 67 A Y - 0 0 50 -2,-1.0 2,-0.5 -7,-0.1 -7,-0.2 -0.754 23.0-163.9 -95.4 137.9 15.6 23.7 4.8 66 68 A D + 0 0 40 -9,-1.5 4,-0.2 -2,-0.4 3,-0.2 -0.936 17.2 165.3-121.5 107.8 12.4 23.3 2.9 67 69 A W > + 0 0 12 -2,-0.5 4,-2.2 1,-0.1 5,-0.2 0.319 45.3 102.6 -97.0 3.2 10.5 26.6 2.7 68 70 A R H > S+ 0 0 181 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.904 79.9 44.3 -67.8 -46.7 8.1 25.7 -0.0 69 71 A A H > S+ 0 0 10 -44,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.905 114.6 50.6 -63.2 -40.6 4.9 25.1 2.0 70 72 A Y H > S+ 0 0 2 1,-0.2 4,-2.7 -4,-0.2 -1,-0.2 0.876 106.0 56.1 -66.3 -32.2 5.4 28.2 4.0 71 73 A R H X S+ 0 0 76 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.923 106.9 50.0 -60.0 -43.8 6.0 30.2 0.8 72 74 A S H X S+ 0 0 67 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.890 111.0 49.5 -61.8 -39.2 2.5 29.0 -0.3 73 75 A L H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.955 111.5 47.5 -62.0 -49.6 1.1 30.1 3.0 74 76 A L H X S+ 0 0 2 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.886 108.7 55.5 -59.7 -40.0 2.6 33.5 2.8 75 77 A Q H X S+ 0 0 70 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.907 108.9 47.3 -58.8 -44.0 1.4 33.8 -0.8 76 78 A L H X S+ 0 0 12 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.924 109.9 51.9 -65.0 -44.6 -2.1 33.2 0.4 77 79 A V H <>S+ 0 0 0 -4,-2.5 5,-1.9 1,-0.2 -2,-0.2 0.933 111.0 49.4 -56.9 -44.6 -1.9 35.7 3.3 78 80 A Q H ><5S+ 0 0 74 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.942 108.6 52.2 -58.7 -47.7 -0.6 38.3 0.8 79 81 A E H 3<5S+ 0 0 122 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.861 106.3 54.7 -58.5 -34.0 -3.5 37.6 -1.6 80 82 A C T 3<5S- 0 0 5 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.370 116.3-113.4 -87.7 6.7 -6.0 38.0 1.2 81 83 A G T < 5S+ 0 0 36 -3,-2.0 2,-0.3 1,-0.3 -3,-0.2 0.754 72.6 127.6 75.2 29.6 -4.6 41.5 2.1 82 84 A L < - 0 0 4 -5,-1.9 -35,-0.3 -35,-0.0 -1,-0.3 -0.862 52.1-133.2-116.0 148.3 -3.2 40.7 5.5 83 85 A T E -c 47 0A 40 -37,-1.7 -35,-2.6 -2,-0.3 2,-0.4 -0.428 25.7-128.4 -88.7 173.6 0.2 41.3 7.0 84 86 A L E -cd 48 172A 0 87,-2.5 89,-2.6 -37,-0.2 90,-1.0 -0.992 14.5-157.5-134.6 136.0 2.1 38.6 8.9 85 87 A Q E -cd 49 174A 8 -37,-2.7 -35,-2.3 -2,-0.4 2,-0.6 -0.957 26.2-157.2-101.6 112.4 3.9 38.2 12.2 86 88 A A E -cd 50 175A 0 88,-2.5 90,-2.3 -2,-0.6 2,-0.5 -0.892 2.2-153.4-101.5 122.0 6.3 35.3 11.7 87 89 A I E -cd 51 176A 12 -37,-2.8 -35,-2.6 -2,-0.6 2,-1.2 -0.783 13.4-140.7 -94.1 127.7 7.5 33.4 14.8 88 90 A M E -cd 52 177A 0 88,-3.0 90,-1.9 -2,-0.5 2,-1.2 -0.778 29.5-160.8 -80.2 93.3 10.9 31.7 14.5 89 91 A S E +c 53 0A 0 -37,-1.8 -35,-2.8 -2,-1.2 -34,-0.4 -0.690 26.1 167.3 -96.5 91.9 9.6 28.7 16.4 90 92 A F + 0 0 0 -2,-1.2 43,-0.4 -37,-0.2 2,-0.3 -0.043 55.2 78.7 -90.4 33.2 12.6 26.8 17.8 91 93 A H S S- 0 0 7 41,-0.1 -36,-0.4 13,-0.1 2,-0.2 -0.856 85.8 -84.6-139.1 165.8 10.4 24.7 20.1 92 94 A Q - 0 0 49 39,-2.1 2,-0.4 -2,-0.3 90,-0.4 -0.531 30.5-144.3 -76.1 137.9 8.1 21.7 20.1 93 95 A C B -K 103 0C 7 10,-2.2 10,-2.5 -2,-0.2 2,-0.1 -0.877 65.0 -27.8 -94.7 133.1 4.5 21.9 19.2 94 96 A G + 0 0 27 -2,-0.4 8,-0.2 8,-0.2 3,-0.1 -0.383 59.7 153.0 69.0-140.7 2.1 19.6 21.2 95 97 A G + 0 0 44 1,-0.4 2,-0.2 4,-0.1 -1,-0.1 0.289 43.3 113.2 93.1 -8.9 3.5 16.3 22.5 96 98 A N S > S- 0 0 46 1,-0.1 3,-2.2 2,-0.0 -1,-0.4 -0.589 84.2 -77.7 -88.4 158.9 1.0 16.0 25.4 97 99 A V T 3 S+ 0 0 155 1,-0.2 -1,-0.1 -2,-0.2 3,-0.1 -0.326 120.1 14.9 -53.5 129.1 -1.6 13.4 25.6 98 100 A G T 3 S+ 0 0 68 1,-0.3 -1,-0.2 -3,-0.1 2,-0.0 0.192 87.3 140.6 89.9 -15.5 -4.5 14.4 23.4 99 101 A D < - 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0 0 0 -15,-2.3 3,-2.4 -2,-0.4 4,-0.2 -0.190 19.2-120.7 -54.5 143.5 18.8 24.4 27.2 135 137 A V G > S+ 0 0 7 1,-0.3 3,-1.9 2,-0.2 4,-0.3 0.818 109.5 78.3 -48.0 -30.7 20.4 27.8 27.3 136 138 A G G 3 S+ 0 0 14 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.734 94.8 43.8 -56.6 -23.4 23.4 25.8 28.6 137 139 A V G X S+ 0 0 0 -3,-2.4 11,-1.7 -18,-0.2 3,-1.4 0.275 77.7 111.3-107.6 14.1 24.2 24.7 25.0 138 140 A D T < S+ 0 0 3 -3,-1.9 11,-2.4 1,-0.3 12,-0.4 0.867 96.2 21.5 -49.6 -43.4 23.7 28.1 23.3 139 141 A N T 3 S+ 0 0 99 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.027 95.6 113.4-121.5 26.4 27.5 28.3 22.6 140 142 A E < - 0 0 73 -3,-1.4 2,-2.1 6,-0.1 8,-0.4 -0.900 61.2-144.3 -99.0 117.2 28.4 24.6 22.8 141 143 A P + 0 0 78 0, 0.0 4,-0.3 0, 0.0 6,-0.3 -0.341 62.7 119.4 -84.9 63.4 29.5 23.5 19.3 142 144 A I + 0 0 48 -2,-2.1 2,-0.9 4,-0.2 5,-0.2 0.321 41.7 89.0-110.5 2.7 28.0 20.0 19.7 143 145 A F B > S-M 146 0E 0 3,-2.6 3,-2.1 -3,-0.3 -1,-0.1 -0.719 126.6 -54.7-107.3 79.5 25.4 19.9 16.9 144 146 A H T 3 S- 0 0 134 -2,-0.9 -1,-0.1 1,-0.3 -2,-0.1 0.916 116.8 -42.1 47.1 46.6 27.5 18.6 14.0 145 147 A G T 3 S+ 0 0 55 -4,-0.3 2,-0.3 1,-0.3 -1,-0.3 0.265 121.3 105.3 91.8 -16.3 29.9 21.4 14.7 146 148 A R B < -M 143 0E 13 -3,-2.1 -3,-2.6 -6,-0.0 -1,-0.3 -0.734 63.1-131.5 -95.5 151.0 27.3 24.1 15.3 147 149 A T > - 0 0 13 -2,-0.3 4,-2.1 -6,-0.3 -9,-0.2 -0.455 32.3-106.4 -82.8 169.0 26.2 25.7 18.5 148 150 A A H > S+ 0 0 0 -11,-1.7 4,-2.2 -8,-0.4 -10,-0.2 0.927 122.8 51.5 -63.1 -43.0 22.5 26.1 19.3 149 151 A I H > S+ 0 0 8 -11,-2.4 4,-2.9 -12,-0.3 -1,-0.2 0.889 107.2 53.2 -62.0 -37.3 22.7 29.9 18.6 150 152 A E H > S+ 0 0 89 -12,-0.4 4,-2.8 2,-0.2 5,-0.3 0.905 106.5 53.6 -64.5 -40.5 24.4 29.2 15.2 151 153 A I H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.943 112.2 43.9 -56.0 -48.9 21.5 26.8 14.4 152 154 A Y H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.933 114.4 49.8 -66.1 -41.0 19.0 29.6 15.2 153 155 A S H X S+ 0 0 3 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.943 111.4 47.7 -60.1 -50.7 21.1 32.2 13.3 154 156 A D H X S+ 0 0 42 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.882 111.0 52.2 -58.5 -40.6 21.4 30.0 10.2 155 157 A Y H X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.3 -1,-0.2 0.937 110.6 46.9 -64.5 -47.5 17.7 29.3 10.2 156 158 A M H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.888 111.7 50.8 -63.6 -40.3 16.8 33.0 10.4 157 159 A K H X S+ 0 0 84 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.907 110.8 49.2 -62.9 -41.0 19.3 33.9 7.6 158 160 A S H X S+ 0 0 15 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.893 111.4 49.1 -65.7 -41.5 17.8 31.2 5.4 159 161 A F H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.936 110.3 51.4 -58.4 -48.1 14.3 32.5 6.1 160 162 A R H < S+ 0 0 73 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.891 115.7 41.0 -58.4 -43.1 15.4 36.0 5.3 161 163 A E H >< S+ 0 0 129 -4,-2.2 3,-1.4 1,-0.2 4,-0.2 0.944 117.3 45.4 -72.6 -47.0 16.9 34.9 1.9 162 164 A N H 3< S+ 0 0 74 -4,-2.7 3,-0.2 1,-0.3 -2,-0.2 0.748 120.7 39.9 -73.8 -20.9 14.2 32.5 0.9 163 165 A M T 3X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.3 0.053 79.2 121.8-107.8 21.9 11.4 34.9 1.8 164 166 A S H <> S+ 0 0 68 -3,-1.4 4,-2.6 1,-0.2 5,-0.2 0.825 70.8 53.6 -61.8 -34.7 13.2 38.0 0.5 165 167 A D H > S+ 0 0 74 2,-0.2 4,-2.0 -4,-0.2 -1,-0.2 0.934 111.0 45.6 -64.5 -48.1 10.4 38.9 -2.0 166 168 A F H 4>S+ 0 0 2 1,-0.2 5,-2.1 2,-0.2 6,-0.6 0.880 113.8 50.7 -61.8 -38.6 7.7 38.8 0.8 167 169 A L H ><5S+ 0 0 5 -4,-2.5 3,-1.5 1,-0.2 120,-0.3 0.945 110.2 47.5 -64.0 -45.9 10.0 40.8 3.0 168 170 A E H 3<5S+ 0 0 148 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.846 108.6 56.6 -68.4 -29.0 10.7 43.5 0.5 169 171 A S T 3<5S- 0 0 67 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.508 115.2-113.6 -76.6 -5.6 7.0 43.8 -0.3 170 172 A G T < 5S+ 0 0 26 -3,-1.5 -3,-0.2 -4,-0.4 -2,-0.1 0.600 76.2 131.0 84.4 8.2 6.1 44.6 3.3 171 173 A L < + 0 0 9 -5,-2.1 -87,-2.5 -6,-0.2 2,-0.6 0.890 62.4 62.6 -62.2 -38.3 4.2 41.4 3.9 172 174 A I E +d 84 0A 1 -6,-0.6 -87,-0.2 -89,-0.2 3,-0.1 -0.721 56.8 178.5 -96.2 113.3 6.0 40.6 7.2 173 175 A I E + 0 0 19 -89,-2.6 116,-1.9 -2,-0.6 2,-0.3 0.885 67.8 4.8 -85.4 -34.6 5.6 43.2 9.9 174 176 A D E -de 85 289A 6 -90,-1.0 -88,-2.5 114,-0.2 2,-0.6 -0.998 54.4-140.1-152.0 151.2 7.6 41.5 12.6 175 177 A I E -de 86 290A 0 114,-2.5 116,-2.2 -2,-0.3 2,-0.6 -0.977 21.0-156.8-106.6 111.4 9.8 38.5 13.3 176 178 A E E -de 87 291A 8 -90,-2.3 -88,-3.0 -2,-0.6 2,-0.7 -0.863 12.9-143.9 -91.0 117.2 9.1 37.1 16.7 177 179 A V E -d 88 0A 0 114,-3.0 116,-0.5 -2,-0.6 2,-0.2 -0.764 11.1-134.5 -86.9 113.9 12.2 35.2 17.8 178 180 A G + 0 0 0 -90,-1.9 6,-0.2 -2,-0.7 5,-0.1 -0.473 27.9 174.8 -66.6 135.3 11.3 32.1 19.8 179 181 A L - 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