==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-DEC-12 3ZG2 . COMPND 2 MOLECULE: STEROL 14-ALPHA DEMETHYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA CRUZI; . AUTHOR T.Y.HARGROVE,Z.WAWRZAK,M.KEENAN,E.CHATELAIN,G.I.LEPESHEVA . 449 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21327.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 303 67.5 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 8.0 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 0.4 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 . 17 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 175 39.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 1 0 0 0 2 1 1 0 1 1 2 0 0 0 0 0 1 0 0 0 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 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 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 28 A A 0 0 69 0, 0.0 3,-0.2 0, 0.0 343,-0.1 0.000 360.0 360.0 360.0 23.3 -0.9 -5.9 -4.4 2 29 A K + 0 0 201 1,-0.3 2,-0.3 341,-0.2 342,-0.1 0.804 360.0 53.9 53.5 24.7 1.5 -8.6 -3.4 3 30 A K S S- 0 0 126 344,-0.0 342,-1.7 343,-0.0 -1,-0.3 -0.957 103.1 -53.5-170.2 175.7 1.9 -7.8 -7.0 4 31 A T - 0 0 18 -2,-0.3 342,-0.2 340,-0.2 3,-0.1 -0.234 60.0 -91.0 -69.6 155.9 2.5 -5.2 -9.7 5 32 A P - 0 0 1 0, 0.0 36,-0.2 0, 0.0 -1,-0.1 -0.012 65.5 -65.4 -51.0 165.5 0.5 -2.0 -10.2 6 33 A P - 0 0 32 0, 0.0 36,-3.0 0, 0.0 2,-0.3 -0.269 54.4-133.4 -56.3 145.9 -2.6 -2.0 -12.6 7 34 A V B -a 42 0A 80 34,-0.2 36,-0.2 -3,-0.1 44,-0.0 -0.752 13.4-123.5-101.5 153.4 -1.7 -2.7 -16.2 8 35 A Y - 0 0 31 34,-1.0 36,-0.4 -2,-0.3 24,-0.0 -0.853 30.5-106.4-104.1 127.6 -3.1 -0.6 -19.1 9 36 A P - 0 0 96 0, 0.0 2,-0.7 0, 0.0 -1,-0.0 -0.215 26.0-149.2 -53.8 124.6 -5.0 -2.4 -22.0 10 37 A V + 0 0 59 1,-0.2 7,-0.1 33,-0.0 4,-0.0 -0.874 18.4 176.6 -96.4 114.3 -3.2 -2.7 -25.3 11 38 A T S S+ 0 0 119 -2,-0.7 -1,-0.2 1,-0.3 6,-0.1 0.881 82.2 34.5 -78.1 -43.6 -5.5 -2.6 -28.3 12 39 A V S >> S- 0 0 81 4,-0.4 4,-0.9 2,-0.0 3,-0.8 -0.837 90.3-151.5-117.0 92.9 -2.7 -2.8 -30.9 13 40 A P T 34 S+ 0 0 88 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.069 70.6 37.5 -63.7 170.3 0.1 -4.9 -29.6 14 41 A F T 34 S+ 0 0 166 1,-0.2 31,-0.0 -4,-0.0 -4,-0.0 0.317 117.5 57.3 64.5 -6.8 3.9 -4.8 -30.3 15 42 A L T X4 S- 0 0 78 -3,-0.8 31,-0.8 1,-0.2 3,-0.6 0.640 85.8-171.2-103.9 -38.7 3.5 -1.0 -30.4 16 43 A G B 3< -B 45 0A 10 -4,-0.9 -4,-0.4 29,-0.3 29,-0.3 -0.741 66.3 -31.2 79.2-125.6 2.1 -0.8 -26.9 17 44 A H T 3> S+ 0 0 3 27,-1.8 4,-1.4 -2,-0.5 -1,-0.2 0.046 101.0 124.2-113.7 23.5 0.8 2.8 -26.2 18 45 A I H <> + 0 0 65 -3,-0.6 4,-1.2 1,-0.2 -1,-0.1 0.610 68.1 48.0 -61.6 -19.9 3.4 4.3 -28.5 19 46 A V H > S+ 0 0 80 -3,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.935 111.7 39.2 -97.7 -54.6 1.0 6.2 -30.7 20 47 A Q H > S+ 0 0 71 2,-0.2 4,-1.7 1,-0.2 8,-0.3 0.799 117.9 58.3 -61.8 -25.5 -1.5 8.1 -28.6 21 48 A F H < S+ 0 0 35 -4,-1.4 -2,-0.2 2,-0.2 7,-0.2 0.990 101.5 48.8 -66.6 -63.1 1.5 8.8 -26.4 22 49 A G H < S+ 0 0 43 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.824 110.3 55.2 -44.5 -39.2 3.7 10.5 -29.0 23 50 A K H < S- 0 0 154 -4,-1.5 406,-0.3 1,-0.3 -1,-0.2 0.989 134.4 -8.2 -62.6 -63.9 0.8 12.7 -30.0 24 51 A N X - 0 0 51 -4,-1.7 4,-2.1 1,-0.1 -1,-0.3 -0.866 59.1-174.9-136.7 102.0 0.0 14.1 -26.5 25 52 A P H > S+ 0 0 8 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.857 90.0 48.2 -62.2 -31.1 2.0 12.5 -23.7 26 53 A L H > S+ 0 0 8 2,-0.2 4,-2.6 3,-0.2 5,-0.3 0.966 110.9 45.8 -75.3 -55.4 -0.1 14.6 -21.3 27 54 A E H > S+ 0 0 117 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.907 119.6 44.9 -48.8 -48.3 -3.6 14.0 -22.6 28 55 A F H X S+ 0 0 2 -4,-2.1 4,-1.8 -8,-0.3 3,-0.3 0.962 112.0 48.5 -61.9 -55.5 -2.7 10.3 -22.8 29 56 A M H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.3 5,-0.2 0.899 110.5 51.6 -59.1 -43.3 -1.0 9.9 -19.4 30 57 A Q H X S+ 0 0 58 -4,-2.6 4,-1.9 1,-0.2 -1,-0.3 0.864 105.7 56.4 -60.8 -39.6 -3.9 11.7 -17.5 31 58 A R H X S+ 0 0 70 -4,-1.4 4,-3.1 -3,-0.3 5,-0.3 0.958 109.1 45.4 -55.9 -54.3 -6.4 9.4 -19.1 32 59 A C H X S+ 0 0 0 -4,-1.8 4,-4.5 1,-0.2 6,-0.4 0.933 110.6 52.1 -55.7 -52.3 -4.7 6.3 -17.8 33 60 A K H <>S+ 0 0 39 -4,-2.1 5,-0.8 2,-0.2 -1,-0.2 0.861 117.2 39.0 -58.4 -40.7 -4.2 7.5 -14.3 34 61 A R H ><5S+ 0 0 149 -4,-1.9 3,-1.2 3,-0.2 -2,-0.2 0.968 120.2 44.2 -70.4 -55.7 -7.8 8.5 -13.9 35 62 A D H 3<5S+ 0 0 93 -4,-3.1 -2,-0.2 1,-0.3 -3,-0.2 0.879 112.2 51.8 -59.2 -43.6 -9.2 5.5 -15.8 36 63 A L T 3<5S- 0 0 33 -4,-4.5 -1,-0.3 -5,-0.3 -2,-0.2 0.712 104.8-137.6 -63.0 -17.7 -6.9 3.2 -13.9 37 64 A K T < 5S+ 0 0 198 -3,-1.2 2,-0.4 -5,-0.4 -3,-0.2 0.657 76.1 96.6 67.8 11.7 -8.3 4.9 -10.9 38 65 A S < - 0 0 16 -5,-0.8 -2,-0.2 -6,-0.4 -1,-0.2 -0.987 68.9-151.2-141.2 128.0 -4.7 4.8 -9.8 39 66 A G S S+ 0 0 15 -2,-0.4 15,-1.2 -3,-0.1 2,-0.4 0.693 92.1 62.7 -68.9 -20.2 -1.9 7.4 -10.1 40 67 A V E S+ C 0 53A 7 13,-0.2 2,-0.3 14,-0.2 13,-0.2 -0.909 71.7 140.5-105.4 137.0 0.6 4.6 -10.3 41 68 A F E - C 0 52A 0 11,-1.4 11,-2.5 -2,-0.4 2,-0.3 -0.969 44.7-113.8-171.7 152.4 0.3 2.2 -13.3 42 69 A T E -aC 7 51A 0 -36,-3.0 -34,-1.0 -2,-0.3 2,-0.4 -0.747 25.3-165.9 -95.3 140.4 2.2 0.1 -15.9 43 70 A I E - C 0 50A 2 7,-4.2 7,-3.0 -2,-0.3 2,-0.4 -0.964 19.7-124.6-120.3 147.8 2.1 0.8 -19.6 44 71 A S E + C 0 49A 29 -2,-0.4 -27,-1.8 -36,-0.4 2,-0.3 -0.736 29.0 173.1 -86.3 132.8 3.2 -1.4 -22.4 45 72 A I E > S-BC 16 48A 8 3,-1.8 3,-1.5 -2,-0.4 -29,-0.3 -0.883 77.3 -24.0-139.1 109.0 5.7 -0.0 -24.8 46 73 A G T 3 S- 0 0 36 -31,-0.8 -30,-0.1 -2,-0.3 3,-0.1 0.823 124.7 -52.9 59.3 36.9 7.1 -2.5 -27.4 47 74 A G T 3 S+ 0 0 65 1,-0.2 2,-0.6 0, 0.0 -1,-0.3 0.520 115.3 126.2 74.9 5.6 6.2 -5.5 -25.1 48 75 A Q E < -C 45 0A 56 -3,-1.5 -3,-1.8 139,-0.1 -1,-0.2 -0.876 63.5-127.7-102.8 117.5 8.2 -3.6 -22.4 49 76 A R E -C 44 0A 64 -2,-0.6 302,-1.4 -5,-0.2 2,-0.4 -0.441 27.0-174.1 -59.6 125.8 6.5 -2.9 -19.1 50 77 A V E -Cd 43 351A 4 -7,-3.0 -7,-4.2 -2,-0.2 2,-0.7 -0.933 5.8-165.4-127.6 107.9 6.7 0.7 -18.2 51 78 A T E -Cd 42 352A 1 300,-2.6 302,-3.3 -2,-0.4 2,-0.5 -0.849 8.2-156.8 -96.0 116.6 5.4 1.7 -14.8 52 79 A I E -Cd 41 353A 0 -11,-2.5 -11,-1.4 -2,-0.7 2,-0.8 -0.802 9.3-143.6 -93.3 126.5 4.9 5.4 -14.4 53 80 A V E +Cd 40 354A 1 300,-3.0 302,-0.7 -2,-0.5 -13,-0.2 -0.827 37.1 154.3 -90.9 107.0 4.9 6.9 -10.9 54 81 A G + 0 0 0 -15,-1.2 -14,-0.2 -2,-0.8 -1,-0.1 0.299 37.8 94.0-125.9 5.3 2.3 9.7 -11.1 55 82 A D > - 0 0 46 1,-0.1 3,-3.0 307,-0.0 4,-0.2 -0.923 67.5-146.7 -97.8 109.9 0.9 10.1 -7.6 56 83 A P G > S+ 0 0 3 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.789 93.8 69.8 -51.5 -31.7 3.1 13.0 -6.2 57 84 A H G 3 S+ 0 0 90 1,-0.3 3,-0.2 2,-0.1 285,-0.1 0.620 100.3 50.0 -58.9 -12.1 2.9 11.5 -2.7 58 85 A E G X> S+ 0 0 33 -3,-3.0 3,-2.0 1,-0.1 4,-0.8 0.386 70.1 106.8-113.6 4.2 5.1 8.7 -4.0 59 86 A H H X> S+ 0 0 8 -3,-1.6 4,-2.4 1,-0.3 3,-1.2 0.868 75.2 64.6 -52.1 -38.3 8.0 10.5 -5.7 60 87 A S H 3> S+ 0 0 70 -4,-0.3 4,-1.6 1,-0.3 -1,-0.3 0.811 94.8 59.5 -54.6 -32.0 10.3 9.6 -2.8 61 88 A R H <4 S+ 0 0 135 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.858 112.5 39.0 -66.6 -33.6 9.8 5.9 -3.8 62 89 A F H << S+ 0 0 1 -3,-1.2 -2,-0.2 -4,-0.8 -1,-0.2 0.901 121.6 38.2 -79.1 -47.5 11.3 6.7 -7.2 63 90 A F H < S+ 0 0 5 -4,-2.4 328,-2.3 1,-0.2 329,-0.4 0.600 107.6 60.3 -89.8 -13.3 14.1 9.2 -6.4 64 91 A S S < S+ 0 0 76 -4,-1.6 -1,-0.2 -5,-0.3 -3,-0.1 0.821 76.1 92.6 -88.2 -34.5 15.5 7.8 -3.1 65 92 A P S S- 0 0 33 0, 0.0 326,-0.2 0, 0.0 274,-0.0 -0.242 79.3-102.6 -68.9 155.8 16.8 4.3 -3.8 66 93 A R >> - 0 0 179 1,-0.1 4,-2.7 5,-0.0 3,-1.1 -0.114 33.4-101.7 -67.4 170.1 20.4 3.7 -4.8 67 94 A N T 34 S+ 0 0 17 1,-0.2 269,-0.2 2,-0.2 6,-0.1 0.787 119.6 62.6 -64.8 -27.3 21.6 3.0 -8.4 68 95 A E T 34 S+ 0 0 108 1,-0.1 -1,-0.2 2,-0.1 3,-0.2 0.694 113.7 33.9 -71.5 -22.5 21.9 -0.7 -7.6 69 96 A I T <4 S+ 0 0 56 -3,-1.1 268,-1.3 1,-0.3 267,-1.1 0.828 134.6 25.2 -97.0 -49.6 18.2 -0.9 -6.9 70 97 A L E < S-E 335 0A 2 -4,-2.7 -1,-0.3 265,-0.2 265,-0.2 -0.903 83.9-162.8-115.9 102.8 17.0 1.7 -9.5 71 98 A S E -E 334 0A 0 263,-2.2 263,-3.4 -2,-0.6 4,-0.3 -0.694 19.7-174.5 -90.1 128.4 19.6 1.9 -12.2 72 99 A P S >> S+ 0 0 0 0, 0.0 4,-1.1 0, 0.0 3,-0.5 0.722 70.9 85.6 -87.2 -24.6 19.6 4.9 -14.6 73 100 A R T 34 S+ 0 0 58 1,-0.2 3,-0.2 2,-0.2 16,-0.1 0.794 86.7 50.3 -39.8 -45.9 22.4 3.4 -16.8 74 101 A E T >4 S+ 0 0 72 1,-0.2 3,-1.0 2,-0.2 -1,-0.2 0.859 107.1 47.4 -75.8 -42.0 20.1 1.3 -19.0 75 102 A V T <4 S+ 0 0 6 -3,-0.5 3,-0.4 -4,-0.3 -1,-0.2 0.718 111.8 56.5 -71.2 -17.1 17.4 3.9 -20.1 76 103 A Y T >< + 0 0 50 -4,-1.1 3,-0.8 1,-0.2 -1,-0.2 -0.030 65.7 112.0-108.8 26.9 20.3 6.2 -20.9 77 104 A T G X + 0 0 48 -3,-1.0 3,-1.7 1,-0.3 -1,-0.2 0.788 64.9 76.1 -66.3 -25.6 22.2 4.0 -23.3 78 105 A I G 3 S+ 0 0 31 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.259 92.5 55.9 -73.6 14.0 21.3 6.5 -26.0 79 106 A M G X> S+ 0 0 20 -3,-0.8 4,-1.4 2,-0.1 3,-1.0 0.571 76.6 89.5-120.3 -16.7 23.9 8.8 -24.6 80 107 A T H <> S+ 0 0 35 -3,-1.7 4,-4.1 1,-0.3 3,-0.2 0.837 87.9 49.4 -61.9 -35.4 27.1 6.8 -24.7 81 108 A P H 34 S+ 0 0 62 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.738 110.6 52.2 -78.3 -18.3 28.3 7.8 -28.2 82 109 A V H <4 S+ 0 0 3 -3,-1.0 -2,-0.2 1,-0.1 177,-0.1 0.726 126.3 24.2 -79.5 -25.8 27.7 11.4 -27.3 83 110 A F H < S- 0 0 16 -4,-1.4 172,-0.2 -3,-0.2 -3,-0.2 0.700 113.0-107.4-112.0 -29.2 29.8 11.1 -24.2 84 111 A G >< - 0 0 5 -4,-4.1 3,-1.8 -5,-0.3 7,-0.2 0.151 40.8 -70.5 104.9 135.6 32.1 8.2 -24.8 85 112 A E T 3 S+ 0 0 151 1,-0.3 3,-0.1 5,-0.1 6,-0.0 -0.358 125.0 27.7 -54.2 132.0 32.1 4.6 -23.4 86 113 A G T 3 S+ 0 0 18 1,-0.3 2,-0.4 5,-0.0 -1,-0.3 0.566 99.8 107.4 86.4 9.5 33.2 4.9 -19.7 87 114 A V S X S- 0 0 1 -3,-1.8 3,-1.3 4,-0.1 4,-0.4 -0.960 88.6 -28.6-117.9 139.9 31.8 8.4 -19.3 88 115 A A T 3 S- 0 0 12 -2,-0.4 11,-0.1 1,-0.3 8,-0.1 -0.367 136.6 -1.1 57.1-126.3 28.6 9.2 -17.4 89 116 A Y T 3 S+ 0 0 54 1,-0.3 -1,-0.3 -13,-0.2 7,-0.1 0.872 132.9 58.0 -65.8 -39.5 26.3 6.2 -17.5 90 117 A A S < S+ 0 0 21 -3,-1.3 -1,-0.3 -6,-0.2 -2,-0.2 0.916 97.7 78.9 -57.1 -41.4 28.6 4.1 -19.6 91 118 A A S S- 0 0 0 -4,-0.4 -4,-0.1 -7,-0.2 2,-0.1 -0.383 101.4 -99.6 -61.2 147.1 31.1 4.6 -16.8 92 119 A P >> - 0 0 63 0, 0.0 4,-3.5 0, 0.0 3,-0.7 -0.385 37.8-101.9 -67.2 150.4 30.4 2.4 -13.8 93 120 A Y H 3> S+ 0 0 29 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.753 118.7 53.7 -51.0 -41.0 28.6 4.0 -10.8 94 121 A P H 3> S+ 0 0 92 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.962 120.7 32.7 -57.5 -49.1 31.6 4.6 -8.6 95 122 A R H <> S+ 0 0 71 -3,-0.7 4,-3.0 2,-0.2 -2,-0.2 0.848 115.7 56.4 -78.2 -36.3 33.4 6.5 -11.4 96 123 A M H X S+ 0 0 3 -4,-3.5 4,-2.6 2,-0.2 5,-0.2 0.971 111.6 45.7 -52.3 -53.6 30.2 8.0 -12.9 97 124 A R H X S+ 0 0 92 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.943 111.2 52.3 -53.1 -52.0 29.5 9.4 -9.4 98 125 A E H X S+ 0 0 26 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.2 0.908 109.9 50.0 -51.2 -46.8 33.1 10.6 -9.2 99 126 A Q H >X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 3,-0.6 0.944 106.9 51.9 -60.2 -54.1 32.8 12.3 -12.6 100 127 A L H 3X S+ 0 0 44 -4,-2.6 4,-3.2 1,-0.3 -1,-0.2 0.863 106.9 55.8 -52.8 -38.2 29.6 14.2 -11.7 101 128 A N H 3X S+ 0 0 60 -4,-2.1 4,-2.9 2,-0.2 -1,-0.3 0.879 104.6 53.0 -61.3 -40.4 31.3 15.4 -8.5 102 129 A F H X S+ 0 0 11 -4,-2.0 4,-1.4 1,-0.2 3,-0.7 0.890 113.7 56.2 -53.8 -44.6 31.6 18.8 -12.8 104 131 A A H >X S+ 0 0 29 -4,-3.2 3,-0.7 1,-0.3 4,-0.6 0.919 103.5 52.4 -53.0 -49.8 29.5 19.6 -9.7 105 132 A E H 3< S+ 0 0 116 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.741 108.6 53.3 -64.6 -20.0 32.5 21.3 -8.0 106 133 A E H << S+ 0 0 22 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.790 110.2 45.6 -80.1 -31.2 32.9 23.4 -11.2 107 134 A L H << S+ 0 0 14 -4,-1.4 -2,-0.2 -3,-0.7 -1,-0.2 0.346 85.9 123.3 -97.0 5.0 29.3 24.6 -11.1 108 135 A T S >< S- 0 0 42 -4,-0.6 3,-1.7 -3,-0.2 4,-0.2 -0.251 80.1-105.3 -67.3 156.1 29.2 25.4 -7.4 109 136 A I G > S+ 0 0 72 1,-0.3 3,-0.5 2,-0.2 -1,-0.1 0.557 115.2 75.2 -58.3 -8.0 28.3 28.9 -6.2 110 137 A A G > S+ 0 0 68 1,-0.2 3,-0.6 -5,-0.1 -1,-0.3 0.926 98.0 43.1 -65.2 -43.6 32.0 29.4 -5.5 111 138 A K G < S+ 0 0 87 -3,-1.7 3,-0.4 1,-0.2 -1,-0.2 0.331 94.1 86.0 -87.7 7.6 32.8 29.8 -9.2 112 139 A F G <> + 0 0 0 -3,-0.5 4,-0.8 -4,-0.2 -1,-0.2 0.284 57.0 95.1 -94.2 7.5 29.8 32.1 -9.9 113 140 A Q T <4 S+ 0 0 107 -3,-0.6 191,-0.3 1,-0.2 -1,-0.2 0.887 93.2 36.1 -71.7 -38.2 31.4 35.4 -9.0 114 141 A N T > S+ 0 0 132 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.569 103.8 81.5 -85.2 -9.4 32.5 36.4 -12.5 115 142 A F H > S+ 0 0 17 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.873 82.5 53.7 -70.7 -44.1 29.4 34.8 -13.9 116 143 A V H X S+ 0 0 0 -4,-0.8 4,-1.9 1,-0.2 186,-0.2 0.888 116.4 38.8 -64.9 -41.5 26.7 37.5 -13.5 117 144 A P H > S+ 0 0 47 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.891 113.4 56.6 -71.2 -39.1 28.8 40.2 -15.2 118 145 A A H X S+ 0 0 20 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.854 110.5 45.6 -56.5 -38.8 30.0 37.6 -17.8 119 146 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.948 108.5 54.1 -71.3 -50.1 26.4 36.9 -18.7 120 147 A Q H X S+ 0 0 2 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.899 110.8 47.4 -50.9 -46.8 25.2 40.5 -18.8 121 148 A H H X S+ 0 0 82 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.913 112.7 48.1 -60.6 -45.9 28.0 41.4 -21.3 122 149 A E H X S+ 0 0 12 -4,-1.4 4,-1.3 -5,-0.2 -1,-0.2 0.779 114.2 44.7 -74.5 -28.1 27.3 38.4 -23.6 123 150 A V H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.920 112.0 53.9 -72.2 -46.2 23.5 38.9 -23.7 124 151 A R H X S+ 0 0 43 -4,-2.3 4,-1.5 -5,-0.3 -2,-0.2 0.804 106.2 52.6 -63.3 -34.5 24.0 42.6 -24.3 125 152 A K H >X S+ 0 0 112 -4,-2.1 4,-1.3 2,-0.2 3,-0.8 0.998 107.5 51.0 -53.7 -66.1 26.3 42.0 -27.2 126 153 A F H 3X>S+ 0 0 14 -4,-1.3 4,-2.2 1,-0.3 5,-0.6 0.784 106.6 54.7 -47.6 -40.5 23.7 39.7 -28.9 127 154 A M H 3X5S+ 0 0 2 -4,-2.0 4,-1.8 1,-0.2 -1,-0.3 0.940 107.1 49.3 -61.9 -47.8 20.9 42.3 -28.6 128 155 A A H <<5S+ 0 0 70 -4,-1.5 -1,-0.2 -3,-0.8 -2,-0.2 0.735 114.5 47.7 -63.3 -23.5 23.0 45.0 -30.4 129 156 A E H <5S+ 0 0 125 -4,-1.3 3,-0.2 -3,-0.3 -2,-0.2 0.838 130.4 13.4 -86.1 -36.4 23.8 42.5 -33.2 130 157 A N H <5S+ 0 0 65 -4,-2.2 2,-1.1 1,-0.2 3,-0.3 0.729 124.8 53.7-114.4 -35.7 20.3 41.1 -33.9 131 158 A W S < -G 442 0B 24 -2,-0.3 4,-2.2 303,-0.2 3,-0.4 -0.878 25.0-158.2 -93.3 117.7 11.9 33.9 -33.3 140 167 A L H > S+ 0 0 0 301,-1.9 4,-3.0 -2,-0.7 5,-0.3 0.881 87.4 56.9 -69.4 -41.9 12.4 33.7 -29.6 141 168 A L H > S+ 0 0 35 297,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.830 114.5 41.6 -56.9 -32.5 13.1 29.9 -29.4 142 169 A E H > S+ 0 0 120 -3,-0.4 4,-1.3 2,-0.2 -2,-0.2 0.859 114.3 49.4 -84.2 -37.2 16.0 30.5 -31.7 143 170 A D H X S+ 0 0 24 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.859 113.8 46.5 -70.7 -37.4 17.3 33.7 -30.1 144 171 A C H X S+ 0 0 0 -4,-3.0 4,-3.0 2,-0.2 5,-0.3 0.936 106.6 58.9 -65.1 -48.4 17.2 32.2 -26.7 145 172 A G H X S+ 0 0 16 -4,-1.3 4,-1.5 -5,-0.3 -2,-0.2 0.852 112.1 41.3 -47.7 -38.2 18.9 29.1 -28.0 146 173 A A H X S+ 0 0 33 -4,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.871 112.9 50.8 -82.0 -40.5 21.8 31.3 -29.1 147 174 A M H X S+ 0 0 1 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.856 110.2 53.0 -62.4 -35.7 21.9 33.5 -26.0 148 175 A I H X S+ 0 0 2 -4,-3.0 4,-2.1 2,-0.2 5,-0.2 0.972 111.4 42.4 -66.4 -52.7 22.0 30.4 -23.9 149 176 A I H X S+ 0 0 5 -4,-1.5 4,-1.8 -5,-0.3 5,-0.2 0.865 115.4 53.7 -61.8 -34.5 25.0 28.8 -25.6 150 177 A N H X S+ 0 0 32 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.972 111.6 39.8 -64.2 -56.9 26.7 32.2 -25.8 151 178 A T H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.831 113.2 55.5 -66.4 -34.6 26.6 33.1 -22.1 152 179 A A H X S+ 0 0 8 -4,-2.1 4,-3.3 -5,-0.3 5,-0.3 0.946 111.1 43.8 -62.2 -49.7 27.4 29.6 -20.9 153 180 A C H X S+ 0 0 4 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.924 110.5 56.0 -58.7 -45.1 30.6 29.5 -23.0 154 181 A Q H < S+ 0 0 36 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.849 116.2 39.2 -55.0 -34.7 31.3 33.0 -21.7 155 182 A C H < S+ 0 0 15 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.922 127.9 26.4 -79.5 -49.7 31.0 31.6 -18.2 156 183 A L H < S+ 0 0 11 -4,-3.3 77,-1.3 76,-0.1 78,-0.6 0.434 103.8 81.6-105.8 -0.9 32.7 28.2 -18.5 157 184 A F S < S- 0 0 12 -4,-2.5 2,-0.2 -5,-0.3 0, 0.0 -0.893 74.5-124.4-111.3 137.0 35.1 28.5 -21.3 158 185 A G >> - 0 0 3 -2,-0.4 4,-2.6 1,-0.1 3,-0.8 -0.473 28.3-108.7 -79.3 150.4 38.6 30.1 -21.0 159 186 A E H 3> S+ 0 0 109 1,-0.3 4,-0.8 2,-0.2 5,-0.1 0.810 119.5 50.5 -49.5 -42.2 39.6 33.0 -23.2 160 187 A D H 3> S+ 0 0 46 2,-0.2 4,-2.1 1,-0.2 3,-0.4 0.916 112.9 45.7 -62.2 -44.0 42.0 30.9 -25.1 161 188 A L H <4 S+ 0 0 2 -3,-0.8 -2,-0.2 1,-0.2 -1,-0.2 0.927 110.7 52.5 -65.7 -46.7 39.4 28.2 -25.8 162 189 A R H < S+ 0 0 64 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.644 109.3 52.0 -61.5 -18.8 36.7 30.7 -26.7 163 190 A K H < S+ 0 0 155 -4,-0.8 -2,-0.2 -3,-0.4 -1,-0.2 0.923 113.3 41.0 -81.0 -51.3 39.2 32.2 -29.2 164 191 A R S < S+ 0 0 108 -4,-2.1 2,-0.3 -5,-0.1 -2,-0.2 0.127 131.9 26.4 -83.5 20.0 40.0 28.8 -30.9 165 192 A L S S- 0 0 6 -3,-0.1 2,-0.3 -5,-0.1 -1,-0.1 -0.833 75.0-155.1-167.2 141.7 36.3 28.0 -30.7 166 193 A N > - 0 0 63 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.839 31.7-107.5-119.5 168.6 33.3 30.2 -30.6 167 194 A A H > S+ 0 0 14 -2,-0.3 4,-3.3 1,-0.2 5,-0.2 0.950 117.9 49.7 -52.3 -54.3 29.8 29.7 -29.2 168 195 A R H > S+ 0 0 170 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.868 112.0 46.9 -57.9 -41.5 28.2 29.4 -32.6 169 196 A H H > S+ 0 0 56 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.907 114.9 47.2 -66.7 -40.3 30.7 26.8 -33.9 170 197 A F H >X S+ 0 0 1 -4,-2.5 4,-1.9 2,-0.2 3,-0.9 0.910 109.2 52.8 -68.2 -43.6 30.4 24.8 -30.7 171 198 A A H 3X S+ 0 0 19 -4,-3.3 4,-2.7 1,-0.3 5,-0.2 0.908 105.7 55.8 -55.6 -42.2 26.6 24.9 -30.8 172 199 A Q H 3X S+ 0 0 110 -4,-1.9 4,-1.2 -5,-0.2 -1,-0.3 0.717 107.9 48.7 -63.9 -22.7 26.8 23.6 -34.4 173 200 A L H < S+ 0 0 33 -4,-2.5 3,-3.6 1,-0.2 -1,-0.2 0.876 86.5 84.4 -80.1 -38.5 23.2 15.0 -30.8 179 206 A S T 3< S+ 0 0 70 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.569 72.8 81.0 -58.9 -3.0 21.0 14.7 -33.8 180 207 A S T 3 S+ 0 0 17 -3,-0.4 2,-0.5 -4,-0.2 -1,-0.3 0.686 74.4 108.1 -65.4 -14.8 21.8 11.0 -33.7 181 208 A L < + 0 0 32 -3,-3.6 251,-0.1 16,-0.1 3,-0.1 -0.524 44.0 177.0 -75.3 116.8 19.1 10.9 -31.0 182 209 A I - 0 0 102 -2,-0.5 4,-0.3 1,-0.2 3,-0.2 -0.975 29.0-138.3-105.1 130.5 15.7 9.4 -31.7 183 210 A P S > S+ 0 0 63 0, 0.0 2,-2.7 0, 0.0 3,-1.3 0.961 99.5 60.1 -50.0 -54.9 13.5 9.4 -28.7 184 211 A A T 3 S+ 0 0 63 1,-0.2 -166,-0.0 2,-0.1 248,-0.0 -0.435 82.1 86.0 -77.8 70.5 12.2 5.9 -29.4 185 212 A A T > S+ 0 0 22 -2,-2.7 3,-1.2 -3,-0.2 -1,-0.2 0.436 73.3 68.2-129.1 -28.1 15.7 4.3 -29.1 186 213 A V T < S+ 0 0 22 -3,-1.3 -2,-0.1 1,-0.3 -109,-0.1 0.384 93.6 60.9 -80.8 -1.2 15.7 3.8 -25.4 187 214 A F T 3 S+ 0 0 51 1,-0.2 -1,-0.3 -4,-0.1 -139,-0.1 0.111 98.6 52.2-122.5 19.6 13.0 1.1 -25.6 188 215 A M X - 0 0 88 -3,-1.2 3,-2.0 -140,-0.0 -1,-0.2 -0.680 60.9-163.1-150.3 101.4 14.7 -1.5 -27.7 189 216 A P T 3 S+ 0 0 99 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 0.200 89.9 64.5 -70.4 17.2 18.1 -2.7 -26.6 190 217 A W T > S+ 0 0 177 2,-0.1 3,-1.6 3,-0.1 0, 0.0 0.611 84.4 71.9-101.2 -27.3 18.7 -4.1 -30.1 191 218 A L T < + 0 0 98 -3,-2.0 -1,-0.1 1,-0.3 -5,-0.0 0.409 68.6 90.4 -72.4 2.5 18.5 -0.7 -31.8 192 219 A L T 3 0 0 102 -4,-0.1 -1,-0.3 -7,-0.0 -2,-0.1 0.554 360.0 360.0 -64.7 -8.9 22.0 -0.1 -30.2 193 220 A R < 0 0 201 -3,-1.6 -2,-0.2 2,-0.0 -3,-0.1 0.241 360.0 360.0-130.5 360.0 22.7 -1.6 -33.6 194 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 195 223 A L > 0 0 111 0, 0.0 4,-1.1 0, 0.0 -15,-0.0 0.000 360.0 360.0 360.0 156.8 24.8 4.3 -38.0 196 224 A P T 4 + 0 0 124 0, 0.0 -16,-0.0 0, 0.0 0, 0.0 0.610 360.0 26.8 -68.7 4.6 23.6 6.7 -40.6 197 225 A Q T >> S+ 0 0 24 -17,-0.1 4,-1.4 3,-0.1 3,-1.4 0.552 99.5 75.3-137.2 -17.1 24.6 9.1 -37.8 198 226 A S H >> S+ 0 0 34 1,-0.3 4,-3.0 2,-0.2 3,-1.3 0.966 93.7 65.1 -59.3 -43.9 27.3 7.8 -35.6 199 227 A A H 3< S+ 0 0 73 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.0 0.004 107.9 37.7 -78.8 30.1 29.5 8.6 -38.5 200 228 A R H <> S+ 0 0 105 -3,-1.4 4,-1.5 -2,-0.7 -1,-0.3 0.188 114.8 55.7-130.4 -16.9 28.8 12.2 -38.0 201 229 A C H S+ 0 0 114 -5,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.918 109.2 45.5 -69.9 -42.5 33.5 13.1 -36.4 204 232 A A H X S+ 0 0 0 -4,-1.5 4,-1.5 2,-0.2 -2,-0.2 0.785 117.0 46.5 -71.0 -28.6 32.1 16.1 -34.5 205 233 A R H X S+ 0 0 14 -4,-1.8 4,-4.1 2,-0.2 5,-0.2 0.946 113.5 45.9 -74.5 -52.5 33.5 14.6 -31.2 206 234 A A H X S+ 0 0 58 -4,-2.8 4,-1.4 2,-0.2 -2,-0.2 0.757 111.6 53.4 -66.4 -26.5 36.9 13.8 -32.6 207 235 A E H X S+ 0 0 76 -4,-1.8 4,-2.2 -5,-0.2 -1,-0.2 0.961 116.4 39.7 -65.3 -51.9 37.1 17.2 -34.2 208 236 A L H X S+ 0 0 2 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.902 113.2 53.5 -62.7 -45.4 36.3 18.7 -30.8 209 237 A Q H X S+ 0 0 39 -4,-4.1 4,-2.1 2,-0.2 -1,-0.2 0.845 110.2 47.8 -66.2 -33.2 38.5 16.3 -28.8 210 238 A K H X S+ 0 0 137 -4,-1.4 4,-2.7 -5,-0.2 5,-0.3 0.983 109.1 53.7 -66.3 -53.8 41.5 17.1 -30.9 211 239 A I H X S+ 0 0 20 -4,-2.2 4,-1.7 1,-0.3 -2,-0.2 0.806 111.4 45.8 -49.2 -38.5 40.9 20.9 -30.7 212 240 A L H X S+ 0 0 5 -4,-2.0 4,-1.7 2,-0.2 -1,-0.3 0.918 108.9 55.4 -72.3 -44.6 40.8 20.6 -26.9 213 241 A G H >X S+ 0 0 16 -4,-2.1 4,-1.8 1,-0.2 3,-0.5 0.931 108.9 48.2 -47.9 -50.7 44.0 18.4 -26.9 214 242 A E H 3X S+ 0 0 78 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.904 107.2 55.9 -57.9 -45.3 45.7 21.2 -28.8 215 243 A I H 3X S+ 0 0 6 -4,-1.7 4,-1.6 -5,-0.3 -1,-0.2 0.783 106.3 51.5 -57.0 -31.8 44.4 23.7 -26.3 216 244 A I H < S+ 0 0 32 -4,-1.8 3,-0.7 1,-0.2 -2,-0.2 0.939 104.9 50.6 -48.5 -66.9 49.2 25.4 -25.0 219 247 A R H >< S+ 0 0 44 -4,-1.6 3,-0.7 1,-0.3 -1,-0.2 0.693 109.3 51.2 -55.4 -30.6 48.4 25.8 -21.3 220 248 A E H >X S+ 0 0 141 -4,-1.4 3,-1.7 -3,-0.4 4,-0.8 0.889 107.4 51.4 -71.3 -47.5 51.3 23.6 -20.1 221 249 A K T << S+ 0 0 151 -4,-1.4 -1,-0.2 -3,-0.7 -2,-0.2 -0.005 115.0 46.9 -81.9 25.0 53.9 25.4 -22.2 222 250 A E T <>>S+ 0 0 63 -3,-0.7 5,-1.0 -5,-0.1 4,-0.8 0.165 92.6 80.3-136.7 6.0 52.5 28.5 -20.5 223 251 A E T <45S+ 0 0 113 -3,-1.7 3,-0.4 2,-0.2 -2,-0.2 0.945 96.4 41.1 -80.7 -50.7 52.5 27.2 -17.0 224 252 A A T <5S+ 0 0 100 -4,-0.8 -1,-0.1 1,-0.2 -3,-0.1 0.839 114.9 56.1 -60.7 -33.2 56.2 27.7 -16.2 225 253 A S T 45S- 0 0 80 -5,-0.2 -1,-0.2 1,-0.0 -2,-0.2 0.781 93.2-154.5 -66.5 -31.3 55.7 31.0 -18.1 226 254 A K T <5 + 0 0 119 -4,-0.8 -3,-0.2 -3,-0.4 -2,-0.1 0.874 33.8 156.4 52.7 46.6 52.9 32.0 -15.7 227 255 A D < - 0 0 104 -5,-1.0 2,-0.3 1,-0.1 -4,-0.1 0.897 63.7 -8.0 -62.5 -42.9 51.2 34.4 -18.2 228 256 A N - 0 0 130 -6,-0.3 2,-0.4 2,-0.0 -1,-0.1 -0.867 57.3-120.1-145.3 172.8 47.8 34.0 -16.4 229 257 A N + 0 0 150 -2,-0.3 2,-0.3 -3,-0.1 0, 0.0 -0.991 38.3 164.1-120.3 120.8 45.6 32.4 -13.9 230 258 A T + 0 0 83 -2,-0.4 -72,-0.0 2,-0.0 -2,-0.0 -0.989 21.6 179.5-133.4 145.0 42.5 30.6 -15.2 231 259 A S + 0 0 80 -2,-0.3 2,-0.0 -120,-0.1 -2,-0.0 -0.402 26.8 154.0-139.7 63.5 40.1 28.1 -13.6 232 260 A D > - 0 0 11 1,-0.1 4,-3.1 4,-0.0 5,-0.2 -0.196 62.8 -87.9 -78.5 176.8 37.5 27.3 -16.3 233 261 A L H > S+ 0 0 5 -77,-1.3 4,-2.2 2,-0.2 5,-0.1 0.905 128.5 47.7 -53.6 -46.2 35.5 24.1 -16.5 234 262 A L H >> S+ 0 0 5 -78,-0.6 4,-1.6 2,-0.2 3,-0.5 0.990 113.9 44.8 -56.9 -63.0 38.1 22.4 -18.7 235 263 A G H 3> S+ 0 0 11 1,-0.3 4,-1.8 2,-0.2 3,-0.2 0.861 111.2 56.1 -52.1 -41.6 41.1 23.4 -16.4 236 264 A G H 3< S+ 0 0 10 -4,-3.1 -1,-0.3 1,-0.2 -2,-0.2 0.930 108.1 47.2 -51.7 -49.8 39.0 22.4 -13.4 237 265 A L H << S+ 0 0 1 -4,-2.2 11,-0.4 -3,-0.5 3,-0.3 0.709 106.3 57.9 -70.8 -23.3 38.6 18.9 -14.9 238 266 A L H < S+ 0 0 56 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.926 103.6 51.4 -70.8 -47.2 42.3 18.5 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A S > - 0 0 57 -2,-0.4 4,-2.7 1,-0.1 5,-0.2 -0.303 33.0-101.0 -66.8 160.9 41.8 10.9 -20.2 250 278 A L H > S+ 0 0 62 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.873 125.5 55.9 -50.4 -36.9 41.3 13.5 -23.0 251 279 A H H > S+ 0 0 68 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.924 108.3 43.4 -66.5 -46.8 38.3 11.4 -24.0 252 280 A E H > S+ 0 0 26 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.944 116.0 49.8 -60.8 -47.4 36.6 11.4 -20.6 253 281 A V H X S+ 0 0 2 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.931 110.0 49.7 -59.3 -48.8 37.3 15.1 -20.3 254 282 A C H X S+ 0 0 0 -4,-3.0 4,-2.4 -5,-0.2 -1,-0.2 0.946 111.9 48.9 -53.1 -52.3 35.9 15.9 -23.7 255 283 A G H X S+ 0 0 0 -4,-2.3 4,-4.1 -172,-0.2 -2,-0.2 0.885 108.6 52.7 -56.0 -45.4 32.7 13.9 -23.0 256 284 A M H X S+ 0 0 4 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.868 109.9 48.1 -59.2 -41.0 32.2 15.6 -19.6 257 285 A I H X S+ 0 0 4 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.904 114.9 46.5 -67.9 -40.9 32.4 19.0 -21.3 258 286 A V H X S+ 0 0 1 -4,-2.4 4,-3.4 -5,-0.2 5,-0.4 0.965 113.0 49.4 -59.8 -54.7 30.0 17.8 -23.9 259 287 A A H X S+ 0 0 14 -4,-4.1 4,-2.4 1,-0.2 -2,-0.2 0.912 111.8 47.8 -51.9 -49.5 27.7 16.3 -21.3 260 288 A A H X S+ 0 0 18 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.906 117.4 44.0 -54.9 -41.5 27.7 19.6 -19.2 261 289 A M H X S+ 0 0 9 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.876 115.3 43.2 -82.0 -42.0 27.0 21.6 -22.4 262 290 A F H X S+ 0 0 28 -4,-3.4 4,-0.7 2,-0.2 5,-0.4 0.925 109.5 62.9 -62.9 -44.7 24.3 19.4 -24.0 263 291 A A H < S+ 0 0 54 -4,-2.4 4,-0.5 -5,-0.4 -2,-0.2 0.891 114.6 29.4 -45.3 -50.8 22.8 19.1 -20.5 264 292 A G H X S+ 0 0 25 -4,-1.5 4,-1.7 -5,-0.1 5,-0.5 0.686 102.4 85.3 -87.5 -19.0 22.1 22.8 -20.2 265 293 A Q H X S+ 0 0 21 -4,-1.4 4,-1.2 -3,-0.2 -2,-0.1 0.935 103.0 15.9 -54.7 -70.3 21.6 23.7 -23.9 266 294 A H H X S+ 0 0 57 -4,-0.7 4,-3.1 2,-0.2 5,-0.3 0.915 120.5 62.5 -71.6 -43.5 18.0 22.9 -24.7 267 295 A T H > S+ 0 0 37 -4,-0.5 4,-2.3 -5,-0.4 -2,-0.2 0.919 111.9 34.3 -53.2 -53.3 16.6 22.8 -21.1 268 296 A S H X S+ 0 0 1 -4,-1.7 4,-3.2 2,-0.2 -1,-0.2 0.842 115.2 55.4 -77.2 -30.5 17.4 26.4 -20.2 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41.7 -15.5 289 317 A D H X S+ 0 0 94 -4,-3.8 4,-2.2 2,-0.2 3,-0.3 0.935 110.7 45.0 -56.8 -50.7 4.7 44.7 -13.3 290 318 A K H < S+ 0 0 96 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.808 110.0 57.9 -64.7 -27.5 5.8 42.9 -10.2 291 319 A L H X S+ 0 0 0 -4,-2.1 4,-1.5 1,-0.2 3,-0.3 0.828 107.8 46.9 -68.8 -32.3 8.9 41.8 -12.2 292 320 A H H X S+ 0 0 15 -4,-1.6 4,-0.9 -3,-0.3 -2,-0.2 0.898 102.7 58.8 -79.0 -40.8 9.7 45.5 -12.8 293 321 A K H < S+ 0 0 137 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.546 112.1 47.4 -64.9 -4.1 9.3 46.6 -9.2 294 322 A E H 4 S+ 0 0 35 -3,-0.3 3,-0.3 -4,-0.2 -1,-0.2 0.778 119.2 33.2-100.5 -40.9 12.0 44.1 -8.7 295 323 A I H < S+ 0 0 6 -4,-1.5 3,-0.2 1,-0.2 -2,-0.2 0.186 96.1 93.1-101.0 17.3 14.5 44.9 -11.4 296 324 A D S < S+ 0 0 84 -4,-0.9 -1,-0.2 1,-0.2 -3,-0.1 0.807 86.9 37.9 -86.3 -32.6 13.8 48.7 -11.4 297 325 A E S S+ 0 0 198 -3,-0.3 -1,-0.2 -4,-0.1 -2,-0.1 0.193 89.7 112.9-108.2 14.1 16.5 50.1 -9.0 298 326 A F S S- 0 0 23 -3,-0.2 2,-0.2 1,-0.1 4,-0.1 -0.615 70.4-118.5 -72.8 145.0 19.2 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