==== 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 OXIDOREDUCTASE 28-SEP-09 3K1O . COMPND 2 MOLECULE: STEROL 14 ALPHA-DEMETHYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA CRUZI; . AUTHOR G.I LEPESHEVA,T.Y.HARGROVE,S.ANDERSON,Z.WAWRZAK,M.R.WATERMAN . 442 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20453.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 297 67.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 8.1 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 19 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 174 39.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 3 0 3 1 0 0 0 2 2 1 0 0 1 1 1 0 0 0 0 0 0 0 1 0 0 0 1 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 2 1 1 2 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 . 2 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 30 A K 0 0 177 0, 0.0 339,-1.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 20.3 -66.7 3.5 -32.7 2 31 A T - 0 0 70 337,-0.2 339,-0.1 1,-0.1 3,-0.1 -0.740 360.0 -84.2 -98.8 152.7 -64.5 4.1 -29.6 3 32 A P - 0 0 1 0, 0.0 36,-0.2 0, 0.0 -1,-0.1 -0.152 56.2 -87.0 -59.1 148.7 -62.4 1.3 -28.1 4 33 A P - 0 0 38 0, 0.0 36,-1.9 0, 0.0 2,-0.1 -0.330 41.4-135.7 -61.9 126.3 -64.1 -1.1 -25.6 5 34 A V B -a 40 0A 76 34,-0.2 36,-0.2 -3,-0.1 3,-0.0 -0.414 16.9-119.4 -77.2 157.1 -64.0 0.1 -22.0 6 35 A Y - 0 0 34 34,-1.4 36,-0.2 -2,-0.1 9,-0.1 -0.873 39.7 -91.8-101.8 132.7 -63.1 -2.3 -19.2 7 36 A P - 0 0 83 0, 0.0 35,-0.1 0, 0.0 -1,-0.1 -0.017 37.9-165.3 -41.8 136.8 -65.8 -3.0 -16.4 8 37 A V + 0 0 43 33,-0.1 5,-0.1 1,-0.1 34,-0.0 0.887 15.1 173.8 -95.2 -57.0 -65.4 -0.6 -13.5 9 38 A T S S+ 0 0 127 1,-0.1 5,-0.1 2,-0.0 -1,-0.1 0.473 74.1 57.2 63.8 -7.1 -67.3 -1.9 -10.5 10 39 A V > + 0 0 38 1,-0.1 3,-0.8 2,-0.0 -1,-0.1 -0.415 56.7 177.7-155.0 82.0 -65.9 0.9 -8.4 11 40 A P T 3 S+ 0 0 107 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.823 82.2 62.7 -59.3 -33.6 -66.4 4.4 -9.6 12 41 A F T 3 S+ 0 0 203 1,-0.2 2,-0.5 32,-0.1 -2,-0.0 0.944 119.8 23.0 -58.7 -43.7 -64.7 5.9 -6.6 13 42 A L S < S- 0 0 100 -3,-0.8 -1,-0.2 1,-0.1 30,-0.1 -0.975 78.4-151.8-125.3 127.3 -61.5 4.1 -7.8 14 43 A G - 0 0 2 -2,-0.5 3,-0.5 -3,-0.2 29,-0.3 0.464 61.7 -54.8 -67.1-143.6 -60.9 3.0 -11.3 15 44 A H S > S+ 0 0 7 27,-2.3 4,-2.6 1,-0.2 5,-0.3 0.225 100.5 121.4 -80.9 15.5 -58.7 0.1 -12.2 16 45 A I H > S+ 0 0 59 26,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.857 70.7 41.8 -49.0 -51.1 -56.0 1.8 -10.2 17 46 A V H > S+ 0 0 74 -3,-0.5 4,-2.1 2,-0.2 5,-0.2 0.943 114.6 49.7 -66.7 -49.7 -55.3 -0.9 -7.6 18 47 A Q H > S+ 0 0 79 1,-0.2 4,-1.5 -4,-0.2 8,-0.2 0.895 114.3 46.7 -54.3 -43.7 -55.4 -3.8 -10.0 19 48 A F H < S+ 0 0 30 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.837 110.3 53.5 -68.8 -34.8 -53.0 -2.0 -12.3 20 49 A G H < S+ 0 0 23 -4,-1.8 -2,-0.2 -5,-0.3 -1,-0.2 0.883 109.2 45.1 -70.8 -41.9 -50.6 -1.0 -9.4 21 50 A K H < S- 0 0 142 -4,-2.1 403,-0.3 1,-0.3 -2,-0.2 0.967 140.9 -6.6 -67.3 -56.2 -50.1 -4.5 -8.0 22 51 A N X + 0 0 48 -4,-1.5 4,-0.9 -5,-0.2 -1,-0.3 -0.851 62.0 173.0-142.5 107.4 -49.5 -6.1 -11.4 23 52 A P H > S+ 0 0 1 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.703 81.2 56.4 -84.1 -22.2 -50.1 -4.0 -14.5 24 53 A L H > S+ 0 0 14 2,-0.2 4,-2.6 3,-0.2 5,-0.3 0.976 111.7 40.1 -70.3 -57.0 -48.8 -6.7 -16.9 25 54 A E H > S+ 0 0 80 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.857 119.6 49.5 -57.8 -36.7 -51.2 -9.5 -15.7 26 55 A F H X S+ 0 0 1 -4,-0.9 4,-2.0 -8,-0.2 -1,-0.2 0.932 112.3 44.4 -69.9 -48.5 -53.9 -6.8 -15.6 27 56 A M H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.922 111.8 52.2 -65.2 -46.0 -53.3 -5.3 -19.0 28 57 A Q H X S+ 0 0 76 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.866 107.6 55.0 -56.5 -37.2 -53.0 -8.7 -20.7 29 58 A R H X S+ 0 0 68 -4,-1.3 4,-3.8 -5,-0.3 5,-0.3 0.957 109.2 45.5 -60.4 -53.8 -56.3 -9.6 -19.1 30 59 A C H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.3 6,-0.3 0.960 114.3 47.4 -51.9 -58.0 -58.1 -6.6 -20.6 31 60 A K H <>S+ 0 0 43 -4,-2.7 5,-0.8 1,-0.2 -1,-0.3 0.757 118.4 45.2 -56.6 -25.4 -56.6 -7.2 -24.0 32 61 A R H ><5S+ 0 0 187 -4,-1.3 3,-0.6 -5,-0.3 -2,-0.2 0.899 112.9 45.9 -86.2 -45.4 -57.6 -10.8 -23.6 33 62 A D H 3<5S+ 0 0 85 -4,-3.8 -2,-0.2 1,-0.2 -3,-0.2 0.829 117.1 43.3 -69.7 -33.6 -61.1 -10.4 -22.3 34 63 A L T 3<5S- 0 0 41 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.1 0.427 100.4-130.5 -94.9 1.0 -62.2 -7.8 -24.8 35 64 A K T < 5S+ 0 0 197 -3,-0.6 2,-0.3 -5,-0.2 -3,-0.2 0.859 73.5 108.5 53.6 37.9 -60.6 -9.5 -27.8 36 65 A S < - 0 0 13 -5,-0.8 -2,-0.2 -6,-0.3 -1,-0.2 -0.960 63.5-153.2-150.6 127.6 -58.9 -6.2 -28.7 37 66 A G S S+ 0 0 12 -2,-0.3 15,-1.9 1,-0.1 2,-0.5 0.685 91.8 64.5 -69.2 -17.9 -55.4 -4.9 -28.5 38 67 A V E S+ B 0 51A 6 13,-0.2 2,-0.3 14,-0.2 13,-0.2 -0.941 70.1 145.5-112.3 120.2 -56.9 -1.4 -28.2 39 68 A F E - B 0 50A 0 11,-1.6 11,-3.0 -2,-0.5 2,-0.4 -0.982 38.4-125.5-153.0 159.9 -58.9 -0.7 -25.1 40 69 A T E -aB 5 49A 0 -36,-1.9 -34,-1.4 -2,-0.3 2,-0.2 -0.898 20.3-172.8-115.1 137.2 -59.8 1.9 -22.5 41 70 A I E - B 0 48A 5 7,-2.7 7,-2.6 -2,-0.4 2,-0.5 -0.742 22.4-123.4-116.6 169.6 -59.5 1.8 -18.8 42 71 A S E - B 0 47A 15 -2,-0.2 -27,-2.3 5,-0.2 2,-0.7 -0.937 20.8-175.8-120.0 109.9 -60.6 4.2 -16.0 43 72 A I E > S- B 0 46A 2 3,-2.1 3,-0.6 -2,-0.5 -30,-0.1 -0.914 82.5 -25.7-102.3 111.7 -58.1 5.6 -13.6 44 73 A G T 3 S- 0 0 37 -2,-0.7 -1,-0.2 1,-0.2 -31,-0.1 0.922 127.6 -49.3 48.2 50.4 -59.9 7.7 -11.0 45 74 A G T 3 S+ 0 0 65 -3,-0.2 2,-0.5 1,-0.2 -1,-0.2 0.769 113.7 120.4 64.4 28.0 -62.7 8.4 -13.5 46 75 A Q E < -B 43 0A 55 -3,-0.6 -3,-2.1 2,-0.0 2,-0.4 -0.961 65.8-125.7-127.2 114.9 -60.3 9.4 -16.2 47 76 A R E -B 42 0A 83 -2,-0.5 299,-2.0 -5,-0.2 2,-0.6 -0.404 25.9-172.2 -63.8 112.7 -60.4 7.4 -19.5 48 77 A V E -Bc 41 346A 1 -7,-2.6 -7,-2.7 -2,-0.4 2,-0.5 -0.940 10.2-154.7-106.7 114.8 -56.9 6.2 -20.3 49 78 A T E -Bc 40 347A 0 297,-1.2 299,-3.0 -2,-0.6 2,-0.6 -0.801 5.8-156.1 -97.2 126.2 -56.8 4.6 -23.7 50 79 A I E -Bc 39 348A 0 -11,-3.0 -11,-1.6 -2,-0.5 2,-1.4 -0.881 13.0-152.1-110.4 115.1 -54.1 2.0 -24.3 51 80 A V E +Bc 38 349A 0 297,-2.5 299,-0.5 -2,-0.6 -13,-0.2 -0.691 31.7 161.4 -78.7 93.5 -52.8 1.2 -27.8 52 81 A G + 0 0 0 -15,-1.9 -14,-0.2 -2,-1.4 -1,-0.2 0.325 43.5 90.7-101.5 6.2 -51.8 -2.4 -26.9 53 82 A D > - 0 0 45 1,-0.1 3,-3.3 -16,-0.1 284,-0.1 -0.899 65.7-152.4-107.0 106.1 -51.6 -3.7 -30.5 54 83 A P G > S+ 0 0 3 0, 0.0 3,-2.0 0, 0.0 4,-0.3 0.767 92.9 67.1 -49.4 -34.8 -48.1 -3.3 -31.8 55 84 A H G 3 S+ 0 0 96 1,-0.3 3,-0.3 2,-0.1 4,-0.1 0.785 103.0 49.9 -54.6 -25.0 -49.3 -3.1 -35.4 56 85 A E G X S+ 0 0 43 -3,-3.3 3,-0.7 1,-0.2 4,-0.3 0.137 74.4 107.0-105.7 17.1 -50.9 0.2 -34.3 57 86 A H T X> S+ 0 0 8 -3,-2.0 3,-2.8 1,-0.2 4,-2.3 0.907 72.9 62.2 -60.9 -42.6 -47.9 1.8 -32.7 58 87 A S H 3> S+ 0 0 67 -3,-0.3 4,-1.6 -4,-0.3 -1,-0.2 0.761 94.1 63.3 -57.0 -26.9 -47.4 4.3 -35.5 59 88 A R H <4 S+ 0 0 125 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.644 113.2 35.7 -71.4 -13.9 -50.8 5.7 -34.8 60 89 A F H <4 S+ 0 0 0 -3,-2.8 -2,-0.2 -4,-0.3 -1,-0.2 0.798 123.2 37.6-106.5 -43.2 -49.4 6.7 -31.4 61 90 A F H < S+ 0 0 9 -4,-2.3 325,-1.1 1,-0.1 326,-0.3 0.610 113.1 57.2 -88.6 -13.3 -45.8 7.7 -32.1 62 91 A S S < S+ 0 0 78 -4,-1.6 -3,-0.1 -5,-0.3 -1,-0.1 0.894 78.4 96.2 -85.5 -43.6 -46.4 9.4 -35.5 63 92 A P S S- 0 0 32 0, 0.0 323,-0.2 0, 0.0 2,-0.1 -0.193 75.8-120.1 -53.7 138.5 -49.0 12.1 -34.6 64 93 A R >> - 0 0 181 1,-0.1 4,-2.5 322,-0.0 3,-1.8 -0.296 28.6 -97.5 -78.3 165.8 -47.5 15.5 -34.0 65 94 A N T 34 S+ 0 0 20 1,-0.3 266,-0.2 2,-0.2 -1,-0.1 0.841 118.3 67.2 -57.1 -38.5 -47.8 17.4 -30.8 66 95 A E T 34 S+ 0 0 124 1,-0.2 -1,-0.3 265,-0.1 3,-0.1 0.854 117.5 25.7 -49.9 -37.0 -50.7 19.5 -32.0 67 96 A I T <4 S+ 0 0 63 -3,-1.8 264,-2.3 1,-0.3 265,-1.0 0.897 133.9 31.5 -91.5 -55.2 -52.8 16.3 -32.1 68 97 A L E < S-D 330 0A 1 -4,-2.5 -1,-0.3 262,-0.2 262,-0.2 -0.929 77.0-173.4-110.0 121.2 -51.1 14.2 -29.5 69 98 A S E -D 329 0A 0 260,-2.5 260,-4.4 -2,-0.6 4,-0.3 -0.948 26.7-175.5-122.9 135.5 -49.5 16.0 -26.6 70 99 A P S > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 3,-0.5 0.714 71.9 85.8 -89.2 -25.2 -47.3 14.9 -23.8 71 100 A R T 4 S+ 0 0 53 1,-0.3 3,-0.2 2,-0.2 4,-0.1 0.868 92.7 40.8 -48.1 -56.0 -47.1 18.3 -22.0 72 101 A E T >4 S+ 0 0 73 1,-0.2 3,-0.6 2,-0.2 -1,-0.3 0.836 118.2 48.9 -64.2 -32.7 -50.3 18.0 -20.0 73 102 A V T 34 S+ 0 0 3 -3,-0.5 3,-0.4 -4,-0.3 -1,-0.2 0.789 112.3 46.7 -77.9 -28.5 -49.6 14.4 -19.1 74 103 A Y T >X S+ 0 0 34 -4,-2.4 3,-1.7 -3,-0.2 4,-0.6 0.150 73.1 118.9-101.8 18.4 -46.0 14.9 -18.0 75 104 A T G X4 + 0 0 70 -3,-0.6 3,-1.5 1,-0.3 -1,-0.2 0.826 61.4 72.6 -49.4 -37.1 -46.7 18.0 -15.9 76 105 A I G 34 S+ 0 0 17 -3,-0.4 4,-0.4 1,-0.3 -1,-0.3 0.774 90.8 57.5 -57.3 -29.6 -45.4 16.1 -12.8 77 106 A M G X> S+ 0 0 20 -3,-1.7 4,-2.2 1,-0.2 3,-2.1 0.837 83.3 84.3 -68.1 -33.2 -41.8 16.4 -14.0 78 107 A T H < - 0 0 4 -4,-2.8 3,-1.3 -5,-0.4 -1,-0.2 -0.543 31.1 -86.9 137.9 154.0 -37.9 23.3 -13.9 83 112 A E T 3 S+ 0 0 89 1,-0.3 -1,-0.1 -2,-0.2 -5,-0.1 0.565 126.2 31.8 -67.7 -8.0 -40.9 25.7 -14.4 84 113 A G T 3 S+ 0 0 20 -6,-0.2 -1,-0.3 162,-0.1 2,-0.2 0.057 96.5 104.6-138.7 28.1 -39.8 26.3 -18.0 85 114 A V S X S- 0 0 0 -3,-1.3 3,-3.6 1,-0.2 4,-0.4 -0.546 83.1 -39.7-108.2-180.0 -38.1 23.2 -19.2 86 115 A A T 3 S+ 0 0 7 1,-0.3 -1,-0.2 2,-0.2 -5,-0.1 0.024 135.6 16.0 -51.1 130.0 -39.2 20.4 -21.6 87 116 A Y T 3 S+ 0 0 52 2,-0.5 -1,-0.3 -3,-0.1 -9,-0.1 0.271 127.3 60.9 86.7 -3.4 -42.8 19.6 -21.0 88 117 A A S < S+ 0 0 27 -3,-3.6 -2,-0.2 2,-0.1 3,-0.0 0.252 99.5 69.9-124.3 1.0 -43.0 22.8 -19.2 89 118 A A S S- 0 0 3 -4,-0.4 -2,-0.5 -5,-0.1 6,-0.1 -0.918 98.8 -88.1-124.5 150.7 -42.0 24.8 -22.3 90 119 A P >> - 0 0 81 0, 0.0 4,-3.2 0, 0.0 3,-0.7 -0.242 49.8-112.1 -57.9 144.6 -43.7 25.5 -25.5 91 120 A Y H 3> S+ 0 0 35 1,-0.3 4,-4.0 2,-0.2 5,-0.4 0.823 116.4 59.9 -57.0 -36.0 -42.9 22.6 -27.7 92 121 A P H 3> S+ 0 0 88 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.954 114.0 36.0 -60.5 -46.4 -40.8 24.8 -30.0 93 122 A R H <> S+ 0 0 21 -3,-0.7 4,-4.0 2,-0.2 -2,-0.2 0.960 118.1 53.4 -65.2 -50.0 -38.6 25.7 -27.1 94 123 A M H X S+ 0 0 0 -4,-3.2 4,-2.9 2,-0.2 5,-0.3 0.957 113.3 41.2 -45.2 -66.3 -38.9 22.2 -25.7 95 124 A R H X S+ 0 0 71 -4,-4.0 4,-2.0 1,-0.2 -1,-0.2 0.923 115.1 54.0 -47.4 -49.2 -37.9 20.5 -28.9 96 125 A E H X S+ 0 0 43 -4,-2.3 4,-1.6 -5,-0.4 3,-0.2 0.936 111.3 44.2 -52.2 -52.3 -35.2 23.2 -29.2 97 126 A Q H X S+ 0 0 0 -4,-4.0 4,-1.9 1,-0.2 3,-0.4 0.950 110.0 53.8 -58.4 -54.6 -33.8 22.4 -25.8 98 127 A L H X S+ 0 0 27 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.802 105.4 57.2 -52.7 -31.9 -33.9 18.7 -26.2 99 128 A N H X S+ 0 0 82 -4,-2.0 4,-2.5 -5,-0.3 -1,-0.2 0.929 100.9 53.7 -67.0 -47.0 -31.9 19.1 -29.4 100 129 A F H < S+ 0 0 28 -4,-1.6 4,-0.5 -3,-0.4 3,-0.2 0.952 110.3 50.0 -47.9 -52.7 -29.0 20.9 -27.6 101 130 A L H >< S+ 0 0 20 -4,-1.9 3,-2.8 1,-0.2 4,-0.3 0.950 108.1 51.5 -49.7 -55.7 -28.9 17.9 -25.3 102 131 A A H >< S+ 0 0 30 -4,-2.3 3,-2.0 1,-0.3 -1,-0.2 0.837 102.3 60.2 -53.5 -36.3 -28.8 15.5 -28.3 103 132 A E G >< S+ 0 0 125 -4,-2.5 3,-0.7 1,-0.3 -1,-0.3 0.602 94.5 65.7 -69.2 -9.7 -25.9 17.5 -29.7 104 133 A E G < S+ 0 0 17 -3,-2.8 -1,-0.3 -4,-0.5 -2,-0.2 0.533 98.8 52.5 -85.7 -8.2 -24.1 16.6 -26.5 105 134 A L G < + 0 0 28 -3,-2.0 -1,-0.2 -4,-0.3 -2,-0.2 -0.139 67.2 139.6-114.8 34.1 -24.3 13.0 -27.6 106 135 A T < - 0 0 65 -3,-0.7 -1,-0.1 1,-0.2 -2,-0.1 0.653 64.7-130.9 -52.1 -16.9 -22.7 13.7 -31.0 107 136 A I S S+ 0 0 44 -3,-0.2 -1,-0.2 1,-0.1 4,-0.1 0.602 101.2 95.5 62.7 4.6 -20.8 10.5 -30.6 108 137 A A S S+ 0 0 68 2,-0.1 3,-0.1 1,-0.1 -1,-0.1 0.577 89.7 46.6 -79.3 -17.2 -18.1 13.0 -31.6 109 138 A K S > S+ 0 0 62 1,-0.2 3,-1.9 2,-0.1 4,-0.3 0.787 89.2 75.5 -94.3 -35.1 -18.1 12.8 -27.8 110 139 A F G >> S+ 0 0 0 1,-0.3 3,-1.7 2,-0.2 4,-0.9 0.696 71.5 93.3 -54.6 -17.5 -18.1 9.1 -27.1 111 140 A Q G 34 S+ 0 0 98 1,-0.3 188,-0.4 -3,-0.1 -1,-0.3 0.797 97.2 29.9 -47.0 -33.4 -14.5 9.1 -28.1 112 141 A N G <> S+ 0 0 126 -3,-1.9 4,-1.1 2,-0.1 -1,-0.3 0.393 100.5 84.0-109.8 2.2 -13.6 9.5 -24.4 113 142 A F H <> S+ 0 0 12 -3,-1.7 4,-4.1 -4,-0.3 5,-0.3 0.926 82.9 56.8 -74.3 -45.3 -16.5 7.8 -22.7 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225 A Q H 3> S+ 0 0 64 2,-0.2 4,-1.4 1,-0.2 -15,-0.3 0.869 100.1 51.2 -64.5 -39.8 -41.2 15.4 -0.5 194 226 A S H X> S+ 0 0 25 -3,-1.5 4,-1.8 2,-0.2 3,-0.5 0.970 108.2 50.6 -61.9 -55.4 -41.9 18.6 -2.4 195 227 A A H 3X S+ 0 0 30 -4,-1.5 4,-2.0 1,-0.3 3,-0.3 0.929 109.2 50.5 -48.2 -56.2 -39.9 20.8 -0.1 196 228 A R H 3X S+ 0 0 101 -4,-2.0 4,-2.3 1,-0.2 -1,-0.3 0.853 107.7 56.8 -50.2 -37.9 -36.8 18.5 -0.3 197 229 A C H X S+ 0 0 147 -4,-3.3 4,-1.6 1,-0.2 3,-0.6 0.900 113.5 48.2 -38.1 -59.0 -26.4 27.6 -6.6 207 239 A I H >X S+ 0 0 12 -4,-2.4 4,-2.3 1,-0.3 3,-1.0 0.948 107.4 52.1 -52.0 -60.0 -23.4 25.4 -7.4 208 240 A L H 3X S+ 0 0 2 -4,-2.6 4,-1.9 1,-0.3 -1,-0.3 0.801 108.7 55.6 -49.9 -29.1 -23.8 25.4 -11.1 209 241 A G H - 0 0 18 1,-0.0 4,-2.1 4,-0.0 -72,-0.2 -0.067 37.3 -81.0 -83.6-172.8 -18.2 18.9 -20.9 228 261 A L H > S+ 0 0 3 -74,-2.7 4,-2.5 2,-0.2 5,-0.2 0.932 127.1 48.7 -57.0 -53.3 -22.1 18.8 -21.0 229 262 A L H > S+ 0 0 1 -75,-0.5 4,-3.1 1,-0.2 5,-0.2 0.948 110.0 51.2 -53.1 -55.0 -22.7 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