==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-SEP-00 1FT7 . COMPND 2 MOLECULE: BACTERIAL LEUCYL AMINOPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO PROTEOLYTICUS; . AUTHOR C.STAMPER,B.BENNETT,R.HOLZ,G.PETSKO,D.RINGE . 291 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10420.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 196 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 8.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 5.5 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 . 0 0.0 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 . 1 0.3 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 . 14 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 31.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.4 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 0 1 1 0 0 0 0 2 0 1 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 0 1 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 PARALLEL BRIDGES PER LADDER . 0 1 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 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 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 0 101 0, 0.0 200,-0.0 0, 0.0 285,-0.0 0.000 360.0 360.0 360.0 149.2 32.4 22.1 32.3 2 2 A P - 0 0 29 0, 0.0 2,-0.1 0, 0.0 287,-0.0 -0.371 360.0 -96.1 -80.8 160.5 31.7 23.2 28.8 3 3 A P - 0 0 95 0, 0.0 2,-0.5 0, 0.0 0, 0.0 -0.449 41.9-101.3 -75.4 148.2 28.2 23.5 27.2 4 4 A I + 0 0 30 1,-0.2 3,-0.1 -2,-0.1 281,-0.0 -0.577 60.2 146.4 -70.2 119.4 26.9 20.6 25.0 5 5 A T + 0 0 84 -2,-0.5 3,-0.3 2,-0.0 -1,-0.2 0.353 45.7 81.6-138.7 4.3 27.4 21.8 21.4 6 6 A Q > + 0 0 46 1,-0.2 4,-2.8 2,-0.1 5,-0.3 -0.043 46.6 134.0-103.6 31.1 28.2 18.7 19.4 7 7 A Q H > S+ 0 0 68 1,-0.2 4,-1.9 2,-0.2 5,-0.3 0.861 72.2 53.0 -45.9 -44.2 24.5 17.6 18.9 8 8 A A H > S+ 0 0 76 -3,-0.3 4,-1.1 1,-0.2 -1,-0.2 0.960 114.2 39.5 -58.3 -55.1 25.1 17.0 15.2 9 9 A T H > S+ 0 0 36 2,-0.2 4,-1.4 3,-0.1 5,-0.2 0.935 119.6 44.2 -61.8 -51.9 28.2 14.7 15.7 10 10 A V H >X S+ 0 0 0 -4,-2.8 4,-4.0 1,-0.2 3,-1.0 0.973 112.1 48.9 -59.6 -60.3 26.9 12.8 18.8 11 11 A T H 3< S+ 0 0 78 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.755 115.4 47.5 -53.5 -26.7 23.3 12.1 17.6 12 12 A A H 3< S+ 0 0 54 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.737 120.9 34.7 -88.1 -24.6 24.7 10.9 14.3 13 13 A W H X< S+ 0 0 39 -4,-1.4 3,-3.3 -3,-1.0 4,-0.5 0.815 101.2 72.6 -97.1 -38.6 27.3 8.6 15.8 14 14 A L G >< S+ 0 0 12 -4,-4.0 3,-1.7 1,-0.3 -3,-0.1 0.853 93.1 59.7 -43.4 -43.6 25.5 7.4 18.9 15 15 A P G 3 S+ 0 0 95 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.625 94.3 66.3 -63.4 -13.3 23.3 5.2 16.7 16 16 A Q G < + 0 0 73 -3,-3.3 2,-0.2 2,-0.1 -2,-0.2 0.630 68.9 114.5 -84.5 -13.7 26.5 3.5 15.4 17 17 A V < - 0 0 7 -3,-1.7 2,-0.6 -4,-0.5 111,-0.1 -0.409 56.9-154.7 -59.9 121.4 27.2 1.9 18.8 18 18 A D >> - 0 0 64 -2,-0.2 4,-1.4 1,-0.1 3,-0.6 -0.911 17.9-163.7-108.6 120.7 26.7 -1.9 18.2 19 19 A A H 3> S+ 0 0 20 -2,-0.6 4,-2.0 1,-0.2 5,-0.2 0.721 92.2 61.1 -71.5 -23.1 25.8 -4.1 21.1 20 20 A S H 3> S+ 0 0 75 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.738 103.7 51.0 -76.2 -20.9 26.8 -7.2 19.1 21 21 A Q H <> S+ 0 0 84 -3,-0.6 4,-1.9 2,-0.2 -2,-0.2 0.890 108.9 51.1 -78.9 -41.4 30.3 -5.7 19.0 22 22 A I H X S+ 0 0 0 -4,-1.4 4,-2.3 1,-0.2 -2,-0.2 0.906 113.2 43.1 -62.3 -45.3 30.3 -5.2 22.7 23 23 A T H X S+ 0 0 22 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.788 108.1 61.5 -72.8 -26.3 29.3 -8.8 23.5 24 24 A G H X S+ 0 0 32 -4,-0.9 4,-1.3 -5,-0.2 -2,-0.2 0.940 109.9 41.0 -62.7 -43.0 31.7 -10.0 20.9 25 25 A T H X S+ 0 0 17 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.916 114.0 51.3 -70.0 -45.8 34.5 -8.5 23.0 26 26 A I H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.918 110.3 48.9 -59.3 -45.0 33.2 -9.6 26.3 27 27 A S H X S+ 0 0 48 -4,-2.4 4,-0.7 1,-0.2 -1,-0.2 0.854 111.8 50.4 -63.8 -35.3 32.8 -13.2 25.2 28 28 A S H < S+ 0 0 48 -4,-1.3 3,-0.3 -5,-0.2 -1,-0.2 0.893 112.5 46.3 -69.6 -40.4 36.4 -13.1 23.8 29 29 A L H >< S+ 0 0 1 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.894 109.1 53.3 -69.9 -41.2 37.8 -11.7 27.1 30 30 A E H 3< S+ 0 0 51 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.682 93.4 73.1 -69.2 -16.7 35.9 -14.1 29.3 31 31 A S T 3< S+ 0 0 92 -4,-0.7 2,-0.3 -3,-0.3 -1,-0.3 0.585 75.2 97.0 -73.6 -9.3 37.3 -17.0 27.3 32 32 A F S < S- 0 0 32 -3,-1.5 80,-0.2 81,-0.2 3,-0.1 -0.663 87.9-125.0 -76.6 134.1 40.7 -16.3 29.0 33 33 A T S S- 0 0 68 -2,-0.3 79,-2.5 1,-0.2 2,-0.3 0.930 83.2 -33.5 -44.5 -51.9 41.0 -18.7 32.0 34 34 A N - 0 0 0 77,-0.2 -1,-0.2 74,-0.1 11,-0.2 -0.947 46.2-137.5-161.0 166.7 41.6 -15.6 34.1 35 35 A R + 0 0 0 77,-0.4 65,-0.4 -2,-0.3 2,-0.1 -0.206 44.1 157.5-126.6 39.5 43.2 -12.2 33.7 36 36 A F > - 0 0 18 63,-0.2 3,-1.6 71,-0.2 6,-0.2 -0.381 50.8-118.4 -66.4 144.5 44.9 -12.1 37.1 37 37 A Y T 3 S+ 0 0 35 1,-0.3 38,-1.1 63,-0.2 37,-0.4 0.654 109.0 41.3 -62.0 -18.8 47.9 -9.7 37.2 38 38 A T T 3 S+ 0 0 73 35,-0.2 -1,-0.3 36,-0.1 2,-0.3 0.206 98.1 90.3-114.7 15.8 50.5 -12.4 38.0 39 39 A T S <> S- 0 0 6 -3,-1.6 4,-1.5 68,-0.1 5,-0.1 -0.722 80.6-118.9-109.2 160.9 49.4 -15.2 35.6 40 40 A T H > S+ 0 0 79 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.854 117.1 50.2 -66.8 -33.9 50.3 -15.9 32.0 41 41 A S H > S+ 0 0 8 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.782 105.6 58.9 -73.6 -24.4 46.7 -15.5 30.8 42 42 A G H > S+ 0 0 0 -6,-0.2 4,-0.9 2,-0.2 -2,-0.2 0.872 110.7 41.2 -68.6 -36.4 46.7 -12.2 32.7 43 43 A A H X S+ 0 0 22 -4,-1.5 4,-1.6 2,-0.2 33,-0.2 0.868 112.9 53.0 -77.7 -38.7 49.6 -11.0 30.6 44 44 A Q H X S+ 0 0 106 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.847 102.9 59.4 -65.2 -34.8 48.2 -12.4 27.4 45 45 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.906 104.1 50.2 -60.5 -41.2 45.0 -10.6 28.0 46 46 A S H X S+ 0 0 1 -4,-0.9 4,-2.3 1,-0.2 -1,-0.2 0.902 111.1 49.4 -63.2 -40.4 46.8 -7.3 28.0 47 47 A D H X S+ 0 0 80 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.878 108.7 53.5 -65.9 -38.9 48.5 -8.3 24.7 48 48 A W H X S+ 0 0 67 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.942 110.4 45.4 -62.2 -48.7 45.1 -9.2 23.2 49 49 A I H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.913 111.1 52.6 -61.9 -44.6 43.6 -5.8 24.0 50 50 A A H X S+ 0 0 10 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.898 110.6 49.2 -58.0 -40.3 46.7 -3.9 22.7 51 51 A S H X S+ 0 0 77 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.864 110.8 49.7 -66.4 -38.5 46.3 -5.9 19.5 52 52 A E H X S+ 0 0 69 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.939 113.4 44.7 -66.3 -49.7 42.6 -5.1 19.2 53 53 A W H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.826 110.4 55.8 -66.2 -32.3 43.1 -1.4 19.8 54 54 A Q H X S+ 0 0 98 -4,-1.9 4,-1.1 -5,-0.3 -1,-0.2 0.952 107.4 47.9 -64.8 -47.9 46.0 -1.3 17.4 55 55 A A H < S+ 0 0 68 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.788 116.1 46.8 -61.8 -26.6 44.0 -2.8 14.6 56 56 A L H >X S+ 0 0 33 -4,-1.2 3,-0.9 1,-0.2 4,-0.6 0.842 110.6 49.9 -82.5 -39.0 41.3 -0.2 15.4 57 57 A S H 3< S+ 0 0 5 -4,-2.7 6,-0.3 1,-0.2 -2,-0.2 0.552 81.9 93.0 -79.1 -9.6 43.7 2.8 15.6 58 58 A A T 3< S+ 0 0 75 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.1 0.745 93.1 43.1 -56.4 -22.5 45.3 2.0 12.3 59 59 A S T <4 S+ 0 0 61 -3,-0.9 -1,-0.2 -4,-0.1 -2,-0.2 0.942 94.7 87.3 -85.4 -61.7 42.7 4.4 10.8 60 60 A L S < S- 0 0 10 -4,-0.6 3,-0.5 1,-0.1 2,-0.4 0.133 79.6-116.1 -39.8 150.1 42.7 7.3 13.3 61 61 A P S S+ 0 0 43 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.787 92.7 6.8 -95.6 136.0 45.2 10.2 12.8 62 62 A N S S+ 0 0 87 -2,-0.4 21,-1.5 1,-0.2 2,-0.3 0.657 95.4 141.0 69.3 16.9 47.8 10.8 15.5 63 63 A A E +A 82 0A 26 -3,-0.5 2,-0.3 -6,-0.3 -1,-0.2 -0.702 24.2 173.9 -95.2 144.0 46.8 7.6 17.3 64 64 A S E -A 81 0A 49 17,-1.9 17,-2.4 -2,-0.3 2,-0.5 -0.995 18.7-146.2-148.6 143.2 49.3 5.2 19.0 65 65 A V E +A 80 0A 29 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.938 25.1 163.2-114.9 130.5 48.9 2.1 21.1 66 66 A K E -A 79 0A 89 13,-2.5 13,-2.9 -2,-0.5 2,-0.5 -0.964 31.5-134.1-143.1 160.5 51.3 1.1 23.9 67 67 A Q E -A 78 0A 66 -2,-0.3 2,-0.4 11,-0.2 11,-0.2 -0.970 22.0-143.5-116.8 126.3 51.6 -1.1 26.9 68 68 A V E -A 77 0A 27 9,-2.6 9,-1.6 -2,-0.5 2,-0.3 -0.753 15.3-132.7 -91.8 133.7 53.1 0.4 30.1 69 69 A S - 0 0 88 -2,-0.4 2,-0.3 7,-0.2 7,-0.1 -0.618 19.4-160.1 -86.9 144.8 55.3 -1.8 32.2 70 70 A H > - 0 0 17 3,-0.5 3,-0.6 -2,-0.3 2,-0.4 -0.909 20.8-111.4-123.9 152.9 54.7 -2.0 36.0 71 71 A S T 3 S+ 0 0 116 -2,-0.3 3,-0.1 1,-0.2 0, 0.0 -0.667 96.2 25.4 -84.7 133.3 57.0 -3.2 38.8 72 72 A G T 3 S+ 0 0 73 -2,-0.4 2,-0.3 1,-0.1 -1,-0.2 0.103 116.8 42.9 107.3 -23.0 56.1 -6.4 40.6 73 73 A Y < - 0 0 15 -3,-0.6 -3,-0.5 2,-0.1 -35,-0.2 -0.979 69.7-126.2-153.0 161.4 54.1 -8.2 37.9 74 74 A N S S+ 0 0 131 -37,-0.4 2,-0.4 -2,-0.3 -36,-0.1 0.498 73.9 107.0 -89.1 -7.8 54.0 -9.0 34.1 75 75 A Q - 0 0 1 -38,-1.1 2,-0.3 -6,-0.0 -5,-0.2 -0.624 59.1-151.7 -76.2 127.0 50.6 -7.6 33.3 76 76 A K - 0 0 76 -2,-0.4 2,-0.2 -33,-0.2 -7,-0.2 -0.757 12.2-122.5-103.3 145.3 50.8 -4.4 31.4 77 77 A S E -A 68 0A 0 -9,-1.6 -9,-2.6 -2,-0.3 2,-0.4 -0.603 28.4-136.1 -79.4 142.9 48.4 -1.5 31.3 78 78 A V E -AB 67 147A 0 69,-2.6 69,-2.8 -2,-0.2 2,-0.4 -0.874 24.1-179.7-104.5 135.5 47.2 -0.7 27.8 79 79 A V E -AB 66 146A 5 -13,-2.9 -13,-2.5 -2,-0.4 2,-0.4 -0.972 10.2-174.6-139.2 121.9 47.0 2.9 26.6 80 80 A M E -AB 65 145A 0 65,-2.4 65,-3.1 -2,-0.4 2,-0.3 -0.949 14.8-167.5-112.5 134.8 45.9 4.3 23.3 81 81 A T E -AB 64 144A 15 -17,-2.4 -17,-1.9 -2,-0.4 2,-0.5 -0.931 17.4-161.6-126.0 149.6 46.3 8.0 22.7 82 82 A I E -AB 63 143A 0 61,-2.2 61,-2.4 -2,-0.3 2,-0.3 -0.984 26.9-131.1-126.9 115.4 45.0 10.4 20.0 83 83 A T - 0 0 64 -21,-1.5 59,-0.1 -2,-0.5 58,-0.1 -0.502 25.5-119.2 -70.3 128.2 46.9 13.7 19.9 84 84 A G - 0 0 8 -2,-0.3 56,-0.3 4,-0.2 57,-0.2 -0.300 8.6-146.9 -68.1 150.5 44.7 16.7 19.9 85 85 A S S S+ 0 0 66 54,-2.2 55,-0.2 56,-0.2 56,-0.1 0.729 93.6 19.5 -89.0 -24.8 44.7 19.2 17.0 86 86 A E S S+ 0 0 122 54,-1.6 55,-0.2 53,-0.2 3,-0.1 0.809 138.1 19.1-109.3 -57.6 44.0 22.3 19.0 87 87 A A E > +c 141 0A 7 53,-2.5 3,-1.2 1,-0.1 55,-0.9 -0.697 64.5 160.9-119.7 77.1 44.8 21.8 22.7 88 88 A P E 3 S+ 0 0 53 0, 0.0 -4,-0.2 0, 0.0 -1,-0.1 0.750 73.3 62.8 -66.7 -25.7 47.2 18.7 22.7 89 89 A D E 3 S+ 0 0 104 -3,-0.1 82,-1.2 -6,-0.1 2,-0.5 0.551 89.6 81.9 -77.5 -9.5 48.4 19.6 26.2 90 90 A E E < S- d 0 171A 23 -3,-1.2 52,-2.0 80,-0.1 2,-0.4 -0.872 72.2-152.7-100.9 127.4 44.9 19.1 27.6 91 91 A W E -cd 142 172A 26 80,-4.3 82,-3.3 -2,-0.5 83,-0.9 -0.852 17.3-168.0-113.8 139.6 43.9 15.5 28.3 92 92 A I E -cd 143 174A 0 50,-1.9 52,-2.7 -2,-0.4 2,-0.4 -0.977 19.7-159.7-117.1 124.9 40.6 13.6 28.4 93 93 A V E +cd 144 175A 0 81,-2.7 83,-2.6 -2,-0.5 2,-0.3 -0.877 17.7 167.4-115.1 142.2 40.8 10.1 30.0 94 94 A I E +cd 145 176A 0 50,-2.0 52,-2.7 -2,-0.4 2,-0.3 -0.981 23.0 113.1-148.0 135.1 38.5 7.1 29.7 95 95 A G E -cd 146 177A 0 81,-1.6 83,-2.4 -2,-0.3 2,-0.3 -0.984 35.5-145.3-176.4-172.9 39.1 3.5 30.8 96 96 A G E -c 147 0A 0 50,-1.6 52,-2.3 -2,-0.3 2,-0.4 -0.902 40.9 -81.0-160.0 179.0 38.5 0.5 33.0 97 97 A H E -c 148 0A 0 81,-0.4 25,-0.2 -2,-0.3 52,-0.2 -0.791 23.0-158.4-101.2 142.2 40.5 -2.4 34.4 98 98 A L + 0 0 2 50,-2.8 51,-0.2 -2,-0.4 -1,-0.1 0.597 62.9 89.6 -90.4 -13.9 41.5 -5.4 32.4 99 99 A D - 0 0 0 49,-0.7 2,-0.3 19,-0.1 -63,-0.2 -0.345 52.9-165.4 -84.3 164.8 42.2 -7.9 35.2 100 100 A S - 0 0 0 -65,-0.4 2,-0.3 -2,-0.1 -63,-0.2 -0.893 6.5-178.4-139.6 168.4 39.8 -10.3 36.9 101 101 A T - 0 0 13 16,-0.3 155,-0.3 -2,-0.3 13,-0.1 -0.988 30.5-160.3-164.6 161.8 39.9 -12.4 40.1 102 102 A I S S- 0 0 34 1,-0.5 2,-0.3 -2,-0.3 156,-0.1 0.254 78.9 -44.6-128.5 3.1 38.1 -14.9 42.2 103 103 A G S > S- 0 0 22 1,-0.1 3,-0.8 154,-0.1 -1,-0.5 -0.861 70.6 -67.6 152.0 174.0 40.0 -14.2 45.4 104 104 A S T 3 S+ 0 0 130 1,-0.3 2,-0.2 -2,-0.3 -1,-0.1 0.721 125.6 64.5 -63.7 -19.8 43.4 -13.6 46.9 105 105 A H T 3 S+ 0 0 133 -3,-0.1 2,-0.5 2,-0.0 -1,-0.3 -0.244 72.0 136.9 -98.7 43.8 44.0 -17.3 46.1 106 106 A T < + 0 0 11 -3,-0.8 2,-0.2 -2,-0.2 -72,-0.0 -0.809 24.7 161.0 -95.1 126.2 43.8 -16.8 42.3 107 107 A N > - 0 0 81 -2,-0.5 3,-1.0 -68,-0.0 -71,-0.2 -0.614 54.0 -66.2-129.4-169.2 46.5 -18.7 40.3 108 108 A E T 3 S+ 0 0 76 1,-0.3 -67,-0.1 -2,-0.2 -74,-0.1 0.822 130.9 38.0 -50.1 -43.4 47.2 -19.9 36.8 109 109 A Q T 3 S+ 0 0 145 2,-0.1 -1,-0.3 -76,-0.1 -3,-0.0 0.555 87.3 121.7 -89.4 -8.8 44.4 -22.5 36.7 110 110 A S < - 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0 0 55 88,-0.1 2,-1.2 -67,-0.1 69,-0.2 -0.899 60.4-154.0-138.1 108.5 24.1 -6.1 34.9 184 184 A K + 0 0 94 -2,-0.4 62,-0.1 81,-0.3 5,-0.1 -0.678 29.4 157.0 -83.3 97.5 21.0 -4.1 35.7 185 185 A G + 0 0 26 -2,-1.2 2,-0.3 60,-0.4 -1,-0.2 0.531 60.3 47.3 -97.0 -7.8 20.4 -4.8 39.4 186 186 A S S S- 0 0 12 59,-0.4 5,-0.0 2,-0.4 0, 0.0 -0.816 87.5-108.3-129.4 169.2 18.4 -1.7 40.0 187 187 A A S S+ 0 0 82 -2,-0.3 30,-0.2 31,-0.0 -1,-0.1 0.853 98.1 78.8 -63.9 -38.1 15.4 0.2 38.5 188 188 A Q S S- 0 0 52 1,-0.1 -2,-0.4 28,-0.1 30,-0.2 -0.361 74.4-143.4 -71.4 154.1 17.7 3.0 37.3 189 189 A D S S+ 0 0 21 28,-2.1 2,-0.4 1,-0.3 29,-0.2 0.850 84.4 22.8 -85.5 -38.6 19.8 2.5 34.2 190 190 A V E -f 218 0B 0 27,-1.9 29,-2.2 84,-0.1 2,-0.5 -0.989 63.1-165.5-132.9 139.4 22.9 4.4 35.4 191 191 A V E -fG 219 244B 0 53,-2.3 53,-3.8 -2,-0.4 2,-0.5 -0.979 13.6-146.6-127.5 118.8 24.1 5.1 38.9 192 192 A F E -fG 220 243B 0 27,-2.6 29,-2.1 -2,-0.5 2,-0.5 -0.714 13.9-134.2 -87.2 129.3 26.7 7.7 39.5 193 193 A I E -f 221 0B 0 49,-1.9 49,-0.4 -2,-0.5 29,-0.2 -0.710 16.1-166.0 -82.0 127.7 29.1 7.1 42.4 194 194 A T > + 0 0 70 27,-3.1 3,-0.6 -2,-0.5 2,-0.3 0.578 59.7 81.3 -94.6 -11.1 29.5 10.3 44.4 195 195 A D T 3 S+ 0 0 29 26,-0.4 3,-0.1 1,-0.2 30,-0.1 -0.765 101.1 12.0 -96.9 145.7 32.6 9.5 46.5 196 196 A Y T 3 S+ 0 0 86 -2,-0.3 2,-0.3 1,-0.3 38,-0.2 0.725 113.7 97.2 64.0 24.0 36.1 9.8 45.1 197 197 A T S < S- 0 0 13 -3,-0.6 2,-0.4 37,-0.1 -1,-0.3 -0.914 81.1-103.6-136.7 162.1 34.6 11.6 42.2 198 198 A D > - 0 0 51 42,-3.2 4,-2.3 -2,-0.3 5,-0.2 -0.756 18.2-150.7 -90.7 129.2 34.1 15.3 41.2 199 199 A S H > S+ 0 0 89 -2,-0.4 4,-2.5 2,-0.2 5,-0.2 0.804 96.2 51.7 -69.1 -30.7 30.6 16.7 41.6 200 200 A N H > S+ 0 0 109 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.937 114.5 41.8 -71.3 -46.9 30.9 19.2 38.7 201 201 A F H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.885 116.7 50.3 -66.7 -38.6 32.1 16.5 36.3 202 202 A T H X S+ 0 0 3 -4,-2.3 4,-1.5 2,-0.2 3,-0.3 0.959 111.3 45.9 -64.7 -51.4 29.5 14.1 37.6 203 203 A Q H X S+ 0 0 93 -4,-2.5 4,-1.0 1,-0.3 -1,-0.2 0.845 109.9 56.7 -60.5 -32.3 26.6 16.5 37.3 204 204 A Y H X S+ 0 0 2 -4,-1.7 4,-1.3 1,-0.2 3,-0.3 0.875 102.9 54.7 -66.4 -36.5 27.9 17.4 33.8 205 205 A L H X S+ 0 0 0 -4,-1.6 4,-1.1 -3,-0.3 -1,-0.2 0.847 103.7 54.1 -66.5 -33.6 27.6 13.7 32.9 206 206 A T H X S+ 0 0 4 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.775 104.2 56.4 -71.3 -23.6 24.0 13.7 33.9 207 207 A Q H X S+ 0 0 95 -4,-1.0 4,-2.1 -3,-0.3 -1,-0.2 0.840 102.8 53.8 -73.0 -34.0 23.4 16.6 31.6 208 208 A L H X>S+ 0 0 0 -4,-1.3 4,-2.5 1,-0.2 5,-0.5 0.809 109.5 49.9 -67.8 -29.5 24.9 14.5 28.7 209 209 A M H X5S+ 0 0 1 -4,-1.1 4,-1.5 3,-0.2 7,-0.2 0.897 107.6 52.3 -74.3 -41.8 22.3 12.0 29.7 210 210 A D H <5S+ 0 0 90 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.905 120.5 34.2 -59.0 -44.3 19.4 14.5 29.7 211 211 A E H <5S+ 0 0 94 -4,-2.1 -2,-0.2 2,-0.1 -1,-0.2 0.884 133.5 23.4 -80.9 -41.7 20.4 15.7 26.2 212 212 A Y H <5S+ 0 0 19 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.798 131.3 30.7 -99.6 -32.2 21.6 12.4 24.6 213 213 A L ><< + 0 0 14 -4,-1.5 3,-1.2 -5,-0.5 -1,-0.2 -0.469 68.2 155.7-127.5 62.0 20.0 9.5 26.5 214 214 A P T 3 + 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.788 68.9 57.0 -55.8 -40.1 16.6 11.1 27.6 215 215 A S T 3 S+ 0 0 110 2,-0.1 2,-0.2 -6,-0.0 -5,-0.1 0.628 92.6 90.6 -72.4 -12.6 14.6 7.8 28.0 216 216 A L < - 0 0 29 -3,-1.2 2,-0.4 -7,-0.2 -3,-0.1 -0.548 67.7-142.7 -86.2 151.6 17.2 6.5 30.5 217 217 A T - 0 0 67 -2,-0.2 -28,-2.1 -30,-0.2 -27,-1.9 -0.875 16.2-169.8-113.8 143.8 17.0 7.0 34.2 218 218 A Y E +f 190 0B 68 -2,-0.4 -27,-0.2 -29,-0.2 2,-0.2 -0.933 6.7 178.8-133.8 158.2 19.9 7.6 36.6 219 219 A G E -f 191 0B 7 -29,-2.2 -27,-2.6 -2,-0.3 2,-0.3 -0.697 22.5-113.0-138.3-168.8 20.5 7.8 40.3 220 220 A F E +f 192 0B 73 -29,-0.2 2,-0.3 -2,-0.2 -27,-0.2 -0.952 34.1 147.6-136.5 153.4 23.4 8.3 42.8 221 221 A D E -f 193 0B 42 -29,-2.1 -27,-3.1 -2,-0.3 -26,-0.4 -0.963 30.3-121.5-167.6 178.1 25.2 6.3 45.3 222 222 A T - 0 0 61 -2,-0.3 26,-0.2 -29,-0.2 -29,-0.0 -0.902 7.5-148.0-132.7 161.6 28.5 5.7 47.1 223 223 A a - 0 0 14 -2,-0.3 -1,-0.1 2,-0.2 3,-0.1 0.825 37.4-132.0 -92.4 -43.5 30.9 2.8 47.5 224 224 A G S S+ 0 0 63 1,-0.3 2,-0.3 0, 0.0 -2,-0.0 0.404 80.6 33.1 102.8 2.3 32.1 3.9 50.9 225 225 A Y S S- 0 0 119 -30,-0.1 2,-2.0 3,-0.0 -1,-0.3 -0.958 111.1 -63.6-170.6 171.9 35.7 3.5 49.9 226 226 A A + 0 0 32 -2,-0.3 -30,-0.1 1,-0.2 3,-0.0 -0.530 62.4 167.1 -72.1 88.1 38.1 3.9 47.0 227 227 A a + 0 0 17 -2,-2.0 2,-0.3 -72,-0.0 -1,-0.2 0.478 51.7 8.1 -87.0 -7.6 36.3 1.1 45.0 228 228 A S S > S- 0 0 0 -3,-0.1 3,-1.8 -74,-0.0 4,-0.3 -0.951 91.1 -73.8-159.4-179.7 37.8 1.5 41.5 229 229 A D T >> S+ 0 0 0 -2,-0.3 3,-1.3 1,-0.3 4,-1.1 0.624 111.2 76.8 -58.8 -18.4 40.4 3.3 39.4 230 230 A H H 3> S+ 0 0 1 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.821 88.1 63.3 -61.6 -28.5 38.6 6.7 39.4 231 231 A A H <> S+ 0 0 0 -3,-1.8 4,-2.6 1,-0.2 -1,-0.3 0.735 96.6 56.6 -67.1 -24.7 40.0 7.0 43.0 232 232 A S H <> S+ 0 0 9 -3,-1.3 4,-0.8 -4,-0.3 -1,-0.2 0.885 111.0 41.7 -73.5 -41.3 43.5 7.0 41.6 233 233 A W H <>S+ 0 0 2 -4,-1.1 5,-2.6 2,-0.2 4,-0.3 0.868 116.4 51.5 -71.9 -36.3 42.8 10.0 39.3 234 234 A H H ><5S+ 0 0 66 -4,-2.4 3,-1.7 -38,-0.2 -2,-0.2 0.944 109.1 47.5 -65.1 -50.5 40.9 11.6 42.1 235 235 A N H 3<5S+ 0 0 113 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.708 106.3 59.7 -65.7 -19.5 43.6 11.2 44.7 236 236 A A T 3<5S- 0 0 7 -4,-0.8 -1,-0.3 2,-0.1 -2,-0.2 0.564 125.5-104.5 -83.4 -9.7 46.1 12.6 42.2 237 237 A G T < 5S+ 0 0 62 -3,-1.7 -3,-0.2 1,-0.3 -2,-0.2 0.692 78.6 126.3 96.8 20.3 44.0 15.7 42.1 238 238 A Y < - 0 0 27 -5,-2.6 2,-0.4 -6,-0.1 -1,-0.3 -0.811 69.1 -97.1-110.6 152.6 42.1 15.3 38.8 239 239 A P + 0 0 36 0, 0.0 -64,-2.1 0, 0.0 2,-0.3 -0.538 51.4 179.7 -69.0 122.0 38.4 15.4 38.2 240 240 A A E +e 175 0A 0 -2,-0.4 -42,-3.2 -66,-0.2 2,-0.3 -0.886 12.1 178.4-125.8 156.5 37.1 11.9 38.1 241 241 A A E -e 176 0A 0 -66,-2.0 -64,-2.3 -2,-0.3 -47,-0.1 -0.979 10.4-160.5-151.2 159.0 33.7 10.2 37.7 242 242 A M - 0 0 4 -49,-0.4 -49,-1.9 -2,-0.3 2,-0.6 -0.794 8.4-156.0-151.1 106.6 32.2 6.7 37.5 243 243 A P E -G 192 0B 1 0, 0.0 -64,-0.4 0, 0.0 2,-0.3 -0.714 27.1-157.7 -79.6 124.0 28.8 5.6 36.0 244 244 A F E -G 191 0B 9 -53,-3.8 -53,-2.3 -2,-0.6 -63,-0.1 -0.742 23.8-118.1-106.1 153.3 28.0 2.4 37.8 245 245 A E S S- 0 0 0 -65,-1.1 -59,-0.4 -66,-0.3 -60,-0.4 0.676 84.3 -26.2 -60.9 -23.6 25.7 -0.5 36.6 246 246 A S S S- 0 0 0 -55,-0.2 5,-0.1 -62,-0.1 -55,-0.1 -0.955 91.4 -44.7-171.2-175.5 23.3 -0.2 39.6 247 247 A K > - 0 0 62 -2,-0.3 3,-2.2 1,-0.1 4,-0.4 -0.398 62.5-110.3 -65.1 150.4 22.9 0.9 43.2 248 248 A F G > S+ 0 0 46 1,-0.3 3,-0.7 2,-0.2 -1,-0.1 0.816 118.5 52.8 -54.1 -32.6 25.8 -0.4 45.3 249 249 A N G 3 S+ 0 0 148 1,-0.2 -1,-0.3 -64,-0.0 -2,-0.1 0.515 109.3 48.4 -83.9 -3.9 23.5 -2.9 47.0 250 250 A D G < S+ 0 0 70 -3,-2.2 -1,-0.2 2,-0.0 -2,-0.2 0.262 80.1 128.2-118.6 12.3 22.1 -4.4 43.8 251 251 A Y S < S- 0 0 73 -3,-0.7 -67,-0.1 -4,-0.4 -71,-0.0 -0.223 76.7 -54.6 -73.0 161.3 25.3 -5.1 41.8 252 252 A N > - 0 0 0 -69,-0.2 3,-1.1 1,-0.2 -1,-0.2 -0.000 43.5-157.9 -33.9 110.5 26.2 -8.4 40.1 253 253 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.2 0, 0.0 7,-0.1 0.578 86.7 64.2 -71.6 -9.1 26.1 -11.1 42.9 254 254 A R T > + 0 0 95 10,-0.1 3,-1.1 5,-0.1 5,-0.3 0.453 68.4 122.1 -91.1 -11.8 28.4 -13.2 40.7 255 255 A I T < S+ 0 0 29 -3,-1.1 3,-0.1 1,-0.2 -153,-0.1 -0.281 74.2 23.4 -59.1 146.1 31.5 -11.1 40.6 256 256 A H T 3 S+ 0 0 70 1,-0.3 2,-0.3 -155,-0.3 -1,-0.2 0.709 107.5 94.0 71.9 22.3 34.7 -12.8 41.8 257 257 A T S X S- 0 0 55 -3,-1.1 3,-1.5 -156,-0.1 -143,-0.4 -0.853 93.2-103.0-133.5 168.4 33.3 -16.3 41.2 258 258 A T T 3 S+ 0 0 71 -2,-0.3 -3,-0.1 1,-0.3 -146,-0.1 0.580 116.8 67.2 -70.5 -6.0 33.6 -18.6 38.2 259 259 A Q T 3 + 0 0 106 -5,-0.3 2,-2.6 1,-0.1 -1,-0.3 0.343 60.0 111.7 -96.9 5.1 30.1 -17.6 37.4 260 260 A D < + 0 0 2 -3,-1.5 -145,-2.9 -6,-0.3 2,-0.2 -0.513 54.7 145.0 -78.4 77.4 30.8 -13.9 36.5 261 261 A T > - 0 0 28 -2,-2.6 3,-0.8 -147,-0.2 4,-0.2 -0.690 67.8-108.5-115.7 167.7 30.0 -14.7 32.8 262 262 A L G >> S+ 0 0 19 1,-0.2 3,-0.9 -2,-0.2 4,-0.8 0.814 118.5 57.5 -63.0 -30.3 28.4 -12.9 29.9 263 263 A A G 34 S+ 0 0 69 1,-0.2 -1,-0.2 2,-0.1 5,-0.1 0.759 104.1 51.4 -72.7 -25.9 25.3 -15.1 30.3 264 264 A N G <4 S+ 0 0 47 -3,-0.8 -1,-0.2 -5,-0.2 -2,-0.2 0.338 115.7 40.5 -94.4 7.3 24.8 -14.1 33.9 265 265 A S T <4 S- 0 0 20 -3,-0.9 -81,-0.3 -4,-0.2 -2,-0.1 0.657 130.4 -49.2-110.7 -84.2 24.8 -10.4 33.2 266 266 A D >< - 0 0 31 -4,-0.8 3,-1.4 -83,-0.1 6,-0.2 -0.687 43.9-164.1-162.4 98.5 23.0 -9.5 30.0 267 267 A P T 3 S+ 0 0 78 0, 0.0 -4,-0.1 0, 0.0 -5,-0.1 0.615 90.3 60.4 -64.5 -13.1 23.9 -11.5 26.9 268 268 A T T 3 S- 0 0 82 -6,-0.1 -245,-0.2 -5,-0.1 -5,-0.1 0.687 99.0-136.3 -86.8 -19.0 22.3 -9.0 24.7 269 269 A G <> + 0 0 0 -3,-1.4 4,-1.6 -7,-0.2 -247,-0.1 0.661 60.7 135.3 72.7 16.5 24.6 -6.2 25.8 270 270 A S H > S+ 0 0 63 2,-0.2 4,-0.7 1,-0.2 -1,-0.0 0.876 72.1 44.2 -63.6 -42.0 21.7 -3.8 26.1 271 271 A H H >> S+ 0 0 3 1,-0.2 3,-1.5 2,-0.2 4,-1.0 0.958 112.1 51.4 -68.7 -50.5 22.8 -2.4 29.5 272 272 A A H 3> S+ 0 0 0 1,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.810 101.6 64.1 -55.7 -32.6 26.5 -2.1 28.5 273 273 A K H 3X S+ 0 0 74 -4,-1.6 4,-2.1 1,-0.2 -1,-0.3 0.802 95.9 57.6 -63.1 -30.8 25.4 -0.2 25.4 274 274 A K H