==== 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 20-JUN-01 1JFC . COMPND 2 MOLECULE: NITRIC-OXIDE REDUCTASE CYTOCHROME P450 55A1; . SOURCE 2 ORGANISM_SCIENTIFIC: FUSARIUM OXYSPORUM; . AUTHOR H.SHIMIZU,S.ADACHI,S.Y.PARK,Y.SHIRO,RIKEN STRUCTURAL . 399 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18754.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 267 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 155 38.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.5 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 2 0 2 0 2 2 0 2 1 0 0 0 0 0 1 0 0 0 0 0 1 1 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 . 0 4 2 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 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 5 A A 0 0 92 0, 0.0 29,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 116.8 32.4 -11.1 21.7 2 6 A P - 0 0 71 0, 0.0 29,-2.7 0, 0.0 2,-0.1 -0.387 360.0 -96.7 -75.6 152.7 35.6 -11.3 19.6 3 7 A S B -a 31 0A 92 27,-0.2 29,-0.2 -2,-0.1 30,-0.0 -0.424 49.1-121.8 -66.2 139.8 39.0 -11.1 21.1 4 8 A F S S+ 0 0 10 27,-2.3 29,-0.3 -2,-0.1 2,-0.2 -0.987 83.2 56.9-134.1 141.2 40.7 -7.6 20.9 5 9 A P S S- 0 0 52 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 0.318 82.0-143.6 -66.7 152.9 43.2 -6.3 19.8 6 10 A F - 0 0 15 -2,-0.2 2,-0.3 1,-0.1 -2,-0.1 -0.553 14.3-113.6 -81.9 154.7 42.5 -7.5 16.2 7 11 A S - 0 0 60 -2,-0.2 9,-0.5 1,-0.1 10,-0.3 -0.704 35.1-101.9 -92.1 145.3 45.3 -8.5 13.9 8 12 A R - 0 0 12 378,-2.9 3,-0.1 -2,-0.3 -1,-0.1 -0.290 26.5-123.2 -60.6 148.2 46.0 -6.4 10.8 9 13 A A S S- 0 0 55 5,-1.6 2,-0.3 1,-0.2 -1,-0.1 0.820 87.1 -21.2 -65.8 -31.4 44.6 -7.9 7.6 10 14 A S S > S- 0 0 38 3,-0.4 3,-1.6 4,-0.1 -1,-0.2 -0.907 91.9 -67.0-162.4 175.2 48.2 -7.8 6.1 11 15 A G T 3 S+ 0 0 13 1,-0.3 380,-0.3 -2,-0.3 373,-0.2 0.822 130.4 23.5 -37.3 -60.2 51.4 -5.9 6.7 12 16 A P T 3 S+ 0 0 34 0, 0.0 -1,-0.3 0, 0.0 378,-0.1 0.357 108.2 92.6 -93.9 3.0 50.3 -2.4 5.7 13 17 A E S < S- 0 0 92 -3,-1.6 -3,-0.4 1,-0.1 -4,-0.1 -0.711 72.6-116.1-104.0 153.5 46.5 -2.8 6.2 14 18 A P - 0 0 25 0, 0.0 -5,-1.6 0, 0.0 -1,-0.1 -0.241 55.5 -74.2 -64.5 164.5 44.2 -2.1 9.2 15 19 A P > - 0 0 18 0, 0.0 3,-0.9 0, 0.0 4,-0.4 -0.414 41.1-131.8 -53.4 138.7 42.3 -5.0 10.8 16 20 A A T 3> S+ 0 0 50 -9,-0.5 4,-0.9 1,-0.2 3,-0.3 0.703 96.4 75.6 -70.3 -20.3 39.5 -6.2 8.5 17 21 A E H 3> S+ 0 0 74 -10,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.837 82.2 66.8 -61.0 -35.3 37.0 -6.1 11.3 18 22 A F H <> S+ 0 0 9 -3,-0.9 4,-2.9 1,-0.2 5,-0.2 0.891 96.3 50.3 -65.9 -40.2 36.6 -2.4 11.5 19 23 A A H > S+ 0 0 41 -4,-0.4 4,-1.7 -3,-0.3 -1,-0.2 0.906 112.3 49.6 -63.0 -38.8 34.9 -1.7 8.1 20 24 A K H X S+ 0 0 143 -4,-0.9 4,-2.2 2,-0.2 5,-0.4 0.901 112.1 47.6 -63.7 -44.1 32.4 -4.4 8.9 21 25 A L H X S+ 0 0 24 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.927 108.1 54.0 -64.9 -43.6 31.7 -2.9 12.3 22 26 A R H < S+ 0 0 17 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.892 114.8 43.2 -58.1 -38.1 31.3 0.6 10.9 23 27 A A H < S+ 0 0 81 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.847 136.0 5.8 -74.9 -38.6 28.7 -0.8 8.5 24 28 A T H < S+ 0 0 116 -4,-2.2 -3,-0.2 1,-0.1 -2,-0.2 0.543 136.5 22.3-126.6 -14.7 26.7 -3.0 10.7 25 29 A N < + 0 0 63 -4,-2.5 -2,-0.1 -5,-0.4 -3,-0.1 -0.427 59.3 167.3-157.9 59.8 27.7 -2.8 14.4 26 30 A P S S+ 0 0 38 0, 0.0 16,-1.6 0, 0.0 2,-0.4 0.714 75.8 36.7 -68.2 -22.8 29.5 0.5 15.1 27 31 A V E S+ B 0 41A 1 14,-0.2 2,-0.3 15,-0.1 14,-0.2 -0.986 85.1 143.8-126.0 113.1 29.4 0.3 18.9 28 32 A S E - B 0 40A 8 12,-1.9 12,-3.6 -2,-0.4 2,-0.3 -0.956 47.6 -98.3-151.1 161.5 29.9 -3.2 20.1 29 33 A Q E - B 0 39A 66 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.689 31.9-173.9 -90.4 141.8 31.5 -5.3 22.9 30 34 A V E - B 0 38A 1 8,-2.8 8,-2.0 -2,-0.3 2,-0.5 -0.867 23.4-120.2-123.6 158.6 34.9 -7.1 22.5 31 35 A K E -aB 3 37A 84 -29,-2.7 -27,-2.3 -2,-0.3 6,-0.2 -0.889 24.2-147.3-104.8 130.0 36.7 -9.5 24.9 32 36 A L > - 0 0 6 4,-2.9 3,-2.5 -2,-0.5 36,-0.1 -0.348 35.7 -90.7 -91.5 172.8 40.1 -8.6 26.2 33 37 A F T 3 S+ 0 0 99 -29,-0.3 35,-0.1 1,-0.3 -1,-0.1 0.779 126.0 50.9 -57.5 -28.6 42.9 -11.0 27.1 34 38 A D T 3 S- 0 0 73 33,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.386 120.7-103.8 -93.5 6.1 41.7 -11.3 30.7 35 39 A G S < S+ 0 0 34 -3,-2.5 -2,-0.1 1,-0.3 2,-0.0 0.336 81.2 127.7 88.3 -5.1 38.1 -12.2 29.7 36 40 A S - 0 0 45 -5,-0.1 -4,-2.9 1,-0.1 -1,-0.3 -0.292 53.9-122.1 -75.5 165.1 36.8 -8.7 30.6 37 41 A L E -B 31 0A 70 -6,-0.2 269,-0.5 -3,-0.1 2,-0.3 -0.787 24.5-177.9-107.4 158.5 34.7 -6.8 28.1 38 42 A A E -Bc 30 306A 1 -8,-2.0 -8,-2.8 -2,-0.3 2,-0.5 -0.988 30.2-113.8-147.8 151.8 35.1 -3.4 26.5 39 43 A W E -Bc 29 307A 23 267,-2.9 269,-3.1 -2,-0.3 2,-0.5 -0.776 27.6-151.3 -83.2 128.2 33.0 -1.3 24.1 40 44 A L E -Bc 28 308A 0 -12,-3.6 -12,-1.9 -2,-0.5 2,-0.4 -0.904 7.7-161.7-103.4 122.8 34.7 -0.8 20.8 41 45 A V E +Bc 27 309A 0 267,-2.5 269,-2.7 -2,-0.5 -14,-0.2 -0.902 16.1 169.0-111.1 128.5 33.8 2.4 19.0 42 46 A T + 0 0 0 -16,-1.6 2,-0.3 -2,-0.4 -20,-0.1 0.580 43.3 88.3-121.2 -19.5 34.5 2.6 15.3 43 47 A K S > S- 0 0 32 -17,-0.4 4,-2.6 1,-0.1 3,-0.4 -0.692 74.3-125.1 -91.4 144.0 32.9 5.7 13.7 44 48 A H H > S+ 0 0 6 -2,-0.3 4,-2.5 270,-0.3 5,-0.2 0.902 109.1 51.7 -53.1 -46.9 34.6 9.0 13.5 45 49 A K H > S+ 0 0 159 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.897 112.9 45.5 -60.2 -39.4 31.8 10.9 15.2 46 50 A D H > S+ 0 0 32 -3,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.863 109.6 54.1 -75.6 -34.5 31.7 8.5 18.1 47 51 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.924 109.0 49.7 -63.0 -42.6 35.5 8.4 18.5 48 52 A C H X S+ 0 0 11 -4,-2.5 4,-1.3 -5,-0.2 -2,-0.2 0.902 109.8 51.5 -60.7 -42.0 35.4 12.2 18.9 49 53 A F H >X S+ 0 0 81 -4,-1.7 4,-2.0 -5,-0.2 3,-0.5 0.928 111.1 47.1 -59.4 -48.7 32.6 11.9 21.5 50 54 A V H 3< S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.917 110.2 53.6 -59.1 -44.4 34.7 9.4 23.5 51 55 A A H 3< S+ 0 0 7 -4,-2.4 295,-0.4 1,-0.2 294,-0.3 0.752 120.0 31.1 -63.4 -26.0 37.8 11.5 23.3 52 56 A T H << S+ 0 0 73 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.569 84.0 117.3-112.3 -12.7 36.0 14.6 24.7 53 57 A S >< - 0 0 20 -4,-2.0 3,-1.5 -5,-0.2 -4,-0.0 -0.382 50.2-153.9 -67.3 129.6 33.3 13.4 27.1 54 58 A E T 3 S+ 0 0 169 1,-0.3 -1,-0.2 -2,-0.2 -4,-0.0 0.536 92.1 71.0 -78.2 -3.5 33.8 14.5 30.7 55 59 A K T 3 S+ 0 0 90 236,-0.0 236,-2.9 235,-0.0 237,-0.7 0.456 90.8 75.6 -86.4 0.4 31.8 11.5 31.8 56 60 A L E < -D 290 0A 8 -3,-1.5 2,-0.3 234,-0.2 234,-0.2 -0.862 67.7-154.6-117.6 147.3 34.7 9.3 30.8 57 61 A S E -D 289 0A 0 232,-2.6 232,-1.9 -2,-0.3 29,-0.1 -0.923 22.1-159.3-124.9 146.3 38.0 8.8 32.6 58 62 A K + 0 0 16 -2,-0.3 2,-0.3 230,-0.2 -1,-0.1 0.372 54.9 125.6 -93.4 -1.3 41.6 7.8 31.7 59 63 A V > - 0 0 41 1,-0.2 3,-1.3 230,-0.1 26,-0.1 -0.451 50.2-155.4 -69.7 126.0 42.5 6.8 35.3 60 64 A R T 3 S+ 0 0 55 -2,-0.3 -1,-0.2 24,-0.3 5,-0.1 0.589 84.7 69.4 -84.0 -8.9 43.8 3.2 35.1 61 65 A T T 3 S+ 0 0 121 2,-0.1 2,-0.5 3,-0.1 -1,-0.3 0.451 76.2 106.9 -83.8 -2.3 42.9 2.3 38.7 62 66 A R S X S- 0 0 90 -3,-1.3 3,-2.0 1,-0.1 2,-0.1 -0.642 81.0-117.6 -77.3 127.2 39.3 2.4 37.8 63 67 A Q T 3 S+ 0 0 171 -2,-0.5 -2,-0.1 1,-0.3 -1,-0.1 -0.404 102.3 40.2 -61.3 133.2 37.8 -1.0 37.6 64 68 A G T 3 S+ 0 0 28 1,-0.3 -1,-0.3 -2,-0.1 224,-0.1 0.225 76.2 145.5 105.9 -10.7 36.6 -1.6 34.0 65 69 A F < - 0 0 19 -3,-2.0 2,-2.1 -5,-0.1 -1,-0.3 -0.392 55.9-120.7 -61.2 133.5 39.7 0.1 32.4 66 70 A P + 0 0 0 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.433 35.8 179.2 -84.3 80.5 40.5 -1.7 29.2 67 71 A E - 0 0 7 -2,-2.1 -33,-0.3 1,-0.1 -34,-0.2 -0.610 13.3-159.6 -72.6 134.2 44.0 -3.0 29.7 68 72 A L + 0 0 22 -2,-0.3 2,-0.3 -36,-0.1 -35,-0.2 0.515 64.0 23.8 -99.8 -8.5 44.9 -4.9 26.5 69 73 A S S > S- 0 0 50 1,-0.1 4,-1.8 -37,-0.1 3,-0.3 -0.973 78.6-107.3-150.3 163.0 47.8 -7.0 27.8 70 74 A A H > S+ 0 0 68 -2,-0.3 4,-1.7 1,-0.2 5,-0.2 0.882 120.5 54.1 -59.9 -40.2 49.3 -8.5 31.0 71 75 A S H > S+ 0 0 89 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.876 104.7 54.3 -65.2 -31.5 52.1 -5.9 30.8 72 76 A G H > S+ 0 0 12 -3,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.915 105.3 54.1 -67.1 -43.0 49.6 -3.1 30.6 73 77 A K H < S+ 0 0 107 -4,-1.8 4,-0.3 1,-0.2 -1,-0.2 0.910 110.1 44.9 -61.4 -39.4 48.0 -4.3 33.7 74 78 A Q H >< S+ 0 0 136 -4,-1.7 3,-1.6 1,-0.2 4,-0.2 0.921 109.7 56.3 -72.6 -35.5 51.3 -4.3 35.7 75 79 A A H >< S+ 0 0 57 -4,-2.1 3,-1.4 1,-0.3 -1,-0.2 0.784 93.8 69.0 -64.1 -27.1 52.1 -0.8 34.3 76 80 A A T 3< S+ 0 0 17 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.644 85.5 72.5 -67.2 -13.9 48.9 0.6 35.7 77 81 A K T < S+ 0 0 178 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.674 81.2 89.6 -78.1 -20.9 50.2 0.1 39.2 78 82 A A S < S- 0 0 70 -3,-1.4 -3,-0.0 -4,-0.2 0, 0.0 -0.305 95.7 -80.2 -80.0 167.3 52.7 3.0 39.1 79 83 A K - 0 0 145 1,-0.1 -1,-0.1 -2,-0.0 -2,-0.1 -0.388 60.1-118.8 -59.2 125.7 52.3 6.6 39.9 80 84 A P - 0 0 65 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.360 21.0-154.0 -75.7 150.9 50.5 8.1 36.9 81 85 A T > - 0 0 23 146,-0.1 3,-2.0 -2,-0.1 4,-0.2 -0.517 48.3 -78.2-102.4 179.2 51.9 10.9 34.6 82 86 A F G > S+ 0 0 10 1,-0.3 3,-1.6 2,-0.2 12,-0.1 0.758 121.6 72.6 -64.4 -25.7 49.6 13.2 32.7 83 87 A V G 3 S+ 0 0 49 1,-0.3 -1,-0.3 11,-0.0 7,-0.0 0.834 107.5 36.8 -52.5 -32.6 48.9 10.7 29.9 84 88 A D G < S+ 0 0 26 -3,-2.0 -24,-0.3 2,-0.1 -1,-0.3 0.209 101.4 102.9-108.5 13.8 46.7 8.8 32.4 85 89 A M < - 0 0 30 -3,-1.6 -4,-0.0 -4,-0.2 -3,-0.0 -0.674 53.7-149.7 -99.1 154.0 45.2 11.8 34.2 86 90 A D >> - 0 0 20 -2,-0.2 4,-2.1 1,-0.1 3,-0.5 -0.645 48.8 -34.7-101.9 170.0 41.8 13.6 34.1 87 91 A P T 34 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.377 120.1 17.7 -62.6 149.6 41.2 17.2 34.8 88 92 A P T 3> S+ 0 0 99 0, 0.0 4,-1.8 0, 0.0 5,-0.1 -0.995 128.5 47.3 -90.2 -3.2 42.4 19.2 36.6 89 93 A E H <> S+ 0 0 109 -3,-0.5 4,-2.0 1,-0.2 5,-0.3 0.867 104.9 64.8 -60.8 -37.2 45.5 17.1 37.2 90 94 A H H X S+ 0 0 3 -4,-2.1 4,-3.0 1,-0.2 3,-0.3 0.942 110.6 31.1 -53.0 -63.7 46.0 16.5 33.5 91 95 A M H > S+ 0 0 67 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.805 110.4 67.0 -73.9 -25.2 46.7 20.0 32.4 92 96 A H H < S+ 0 0 123 -4,-1.8 -1,-0.2 1,-0.2 4,-0.2 0.929 116.7 28.1 -55.5 -43.6 48.3 21.0 35.6 93 97 A Q H >< S+ 0 0 18 -4,-2.0 3,-1.6 -3,-0.3 4,-0.5 0.902 119.1 54.2 -84.4 -44.9 51.1 18.6 34.7 94 98 A R H >X S+ 0 0 26 -4,-3.0 3,-1.8 -5,-0.3 4,-1.6 0.890 102.1 60.2 -59.7 -36.6 50.9 18.7 30.9 95 99 A S T 3< S+ 0 0 58 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.718 90.2 71.5 -66.2 -17.2 51.3 22.5 30.9 96 100 A M T <4 S+ 0 0 15 -3,-1.6 -1,-0.3 -4,-0.2 -2,-0.2 0.770 115.0 22.6 -64.1 -28.0 54.7 22.1 32.6 97 101 A V T X4 S+ 0 0 6 -3,-1.8 3,-0.9 -4,-0.5 4,-0.3 0.483 96.0 95.2-122.1 -7.2 56.1 20.8 29.4 98 102 A E G >< + 0 0 58 -4,-1.6 3,-2.9 1,-0.2 4,-0.4 0.827 66.1 78.8 -47.7 -44.2 53.8 22.1 26.6 99 103 A P G > S+ 0 0 76 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.754 89.7 52.8 -44.0 -40.0 55.9 25.2 25.8 100 104 A T G < S+ 0 0 31 -3,-0.9 -2,-0.1 1,-0.2 106,-0.0 0.714 111.7 48.6 -65.9 -22.6 58.4 23.4 23.7 101 105 A F G < S+ 0 0 6 -3,-2.9 251,-0.3 -4,-0.3 252,-0.3 0.298 78.4 121.6-105.8 1.0 55.6 21.9 21.6 102 106 A T S <> S- 0 0 54 -3,-1.1 4,-2.7 -4,-0.4 5,-0.3 -0.226 75.9-108.6 -65.5 158.9 53.4 24.8 20.7 103 107 A P H > S+ 0 0 62 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.921 120.9 46.0 -52.5 -43.7 52.8 25.7 17.0 104 108 A E H > S+ 0 0 114 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.909 111.1 51.3 -69.3 -42.8 55.0 28.8 17.3 105 109 A A H > S+ 0 0 24 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.919 111.4 48.5 -59.4 -42.1 57.8 27.0 19.2 106 110 A V H X S+ 0 0 8 -4,-2.7 4,-0.6 2,-0.2 -2,-0.2 0.892 107.4 54.7 -68.0 -36.4 57.8 24.3 16.5 107 111 A K H >< S+ 0 0 142 -4,-2.2 3,-1.0 -5,-0.3 -1,-0.2 0.920 109.8 48.2 -58.1 -42.8 57.9 26.9 13.7 108 112 A N H 3< S+ 0 0 115 -4,-2.2 4,-0.3 1,-0.3 -1,-0.2 0.757 108.1 55.7 -72.2 -20.4 61.0 28.3 15.5 109 113 A L H >X S+ 0 0 33 -4,-1.3 4,-2.5 1,-0.2 3,-0.6 0.542 79.7 97.9 -81.8 -10.0 62.5 24.8 15.7 110 114 A Q H S+ 0 0 79 0, 0.0 4,-2.4 0, 0.0 -1,-0.3 0.896 112.2 48.1 -60.2 -38.4 65.9 25.2 11.1 112 116 A Y H <> S+ 0 0 47 -3,-0.6 4,-2.4 -4,-0.3 -2,-0.2 0.908 111.6 49.5 -64.0 -44.2 67.1 22.8 13.8 113 117 A I H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.942 112.5 48.7 -59.5 -45.8 64.8 20.0 12.5 114 118 A Q H X S+ 0 0 50 -4,-2.9 4,-3.0 -5,-0.2 -2,-0.2 0.914 110.6 49.6 -60.2 -45.3 66.1 20.6 9.0 115 119 A R H X S+ 0 0 134 -4,-2.4 4,-2.7 -5,-0.2 -1,-0.2 0.906 110.1 51.3 -62.7 -39.4 69.7 20.6 10.1 116 120 A T H X S+ 0 0 16 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.937 113.5 43.9 -63.8 -45.1 69.2 17.3 11.9 117 121 A V H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.937 113.7 51.2 -62.3 -46.9 67.6 15.7 8.9 118 122 A D H X S+ 0 0 69 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.910 110.2 49.2 -57.0 -45.1 70.3 17.1 6.6 119 123 A D H X S+ 0 0 93 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.917 111.7 47.2 -65.3 -43.1 73.1 15.8 8.7 120 124 A L H X S+ 0 0 20 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.886 112.1 51.1 -67.2 -38.5 71.7 12.3 9.0 121 125 A L H X S+ 0 0 1 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.884 109.2 51.1 -61.5 -42.7 71.1 12.2 5.2 122 126 A E H X S+ 0 0 63 -4,-2.4 4,-3.1 2,-0.2 5,-0.2 0.880 107.9 52.0 -66.6 -37.5 74.7 13.3 4.6 123 127 A Q H X S+ 0 0 112 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.919 109.2 50.7 -61.3 -44.2 76.0 10.6 6.8 124 128 A M H X S+ 0 0 2 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.942 111.5 47.8 -54.6 -48.1 73.9 8.1 4.8 125 129 A K H < S+ 0 0 112 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.942 110.6 50.1 -61.1 -49.1 75.4 9.5 1.6 126 130 A Q H < S+ 0 0 126 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.923 112.9 47.9 -55.7 -43.1 79.0 9.4 2.9 127 131 A K H < S+ 0 0 126 -4,-2.7 3,-0.3 -5,-0.2 -1,-0.2 0.960 97.5 179.4 -56.6 -50.3 78.4 5.7 4.0 128 132 A G < - 0 0 19 -4,-2.6 -2,-0.1 -5,-0.3 -1,-0.1 -0.164 39.3-102.9 75.7-168.9 76.9 5.0 0.6 129 133 A C S > S+ 0 0 31 270,-0.1 3,-1.4 -4,-0.1 -1,-0.2 -0.014 70.5 127.5-144.5 32.1 75.5 1.7 -0.7 130 134 A A T 3 S+ 0 0 97 -3,-0.3 -2,-0.1 1,-0.3 -3,-0.0 0.758 80.4 43.5 -70.1 -25.8 78.3 0.6 -3.0 131 135 A N T 3 S- 0 0 172 1,-0.4 -1,-0.3 2,-0.0 -3,-0.0 0.401 131.7 -66.6-101.8 5.5 78.5 -2.8 -1.4 132 136 A G S < S- 0 0 29 -3,-1.4 -1,-0.4 265,-0.0 265,-0.1 -0.730 77.6 -28.7 133.0-179.8 74.6 -3.3 -1.3 133 137 A P - 0 0 73 0, 0.0 2,-0.3 0, 0.0 265,-0.2 -0.085 48.6-147.4 -63.9 163.5 71.6 -1.8 0.4 134 138 A V E -F 397 0B 18 263,-2.2 263,-2.7 261,-0.1 2,-0.8 -0.869 28.1-100.6-125.0 161.6 71.5 -0.2 3.8 135 139 A D E > -F 396 0B 43 -2,-0.3 4,-2.6 261,-0.2 5,-0.2 -0.726 23.3-160.1 -89.6 111.1 68.6 -0.2 6.3 136 140 A L H >>S+ 0 0 0 259,-2.8 5,-2.5 -2,-0.8 4,-1.3 0.810 90.4 57.5 -61.9 -28.6 66.7 3.1 6.1 137 141 A V H >4>S+ 0 0 13 3,-0.2 5,-2.9 4,-0.2 3,-0.6 0.994 112.8 36.2 -64.4 -61.2 65.3 2.4 9.6 138 142 A K H 345S+ 0 0 131 1,-0.2 -2,-0.2 3,-0.2 -1,-0.2 0.899 124.4 42.7 -58.1 -40.9 68.7 2.1 11.4 139 143 A E H 3<5S- 0 0 42 -4,-2.6 -1,-0.2 3,-0.1 -2,-0.2 0.668 137.9 -10.3 -81.9 -15.8 70.4 4.8 9.3 140 144 A F T S+ 0 0 6 0, 0.0 4,-3.0 0, 0.0 5,-0.4 0.837 101.8 68.3 -68.8 -29.6 67.9 8.6 14.6 144 148 A V H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 5,-0.1 0.981 111.8 28.7 -54.9 -60.7 65.8 11.5 13.2 145 149 A P H > S+ 0 0 3 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.883 121.9 54.5 -67.2 -35.9 63.1 11.4 16.0 146 150 A S H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 5,-0.3 0.947 108.8 45.4 -63.7 -49.2 65.5 10.1 18.6 147 151 A Y H X S+ 0 0 43 -4,-3.0 4,-2.2 -5,-0.2 5,-0.2 0.911 114.5 50.5 -62.5 -39.9 68.1 12.7 18.2 148 152 A I H X S+ 0 0 0 -4,-1.7 4,-2.6 -5,-0.4 -2,-0.2 0.966 113.4 41.5 -64.8 -52.1 65.5 15.5 18.2 149 153 A I H X S+ 0 0 13 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.927 116.3 49.5 -68.0 -39.7 63.6 14.4 21.4 150 154 A Y H X>S+ 0 0 2 -4,-2.5 5,-2.6 -5,-0.3 4,-1.9 0.920 112.4 48.5 -61.5 -40.9 66.8 13.6 23.3 151 155 A T H <5S+ 0 0 48 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.939 111.2 49.1 -64.3 -43.1 68.3 16.9 22.3 152 156 A L H <5S+ 0 0 24 -4,-2.6 54,-2.5 1,-0.2 -1,-0.2 0.896 110.4 52.1 -62.6 -38.5 65.2 18.8 23.4 153 157 A L H <5S- 0 0 0 -4,-2.4 54,-2.1 52,-0.2 55,-0.3 0.843 126.5 -99.5 -65.2 -37.6 65.2 16.9 26.7 154 158 A G T <5 + 0 0 5 -4,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.442 66.9 150.4 130.1 7.7 68.8 17.9 27.3 155 159 A V < - 0 0 5 -5,-2.6 -1,-0.2 -6,-0.2 2,-0.1 -0.496 49.2-115.4 -67.6 134.0 71.0 14.9 26.4 156 160 A P > - 0 0 60 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.374 24.6-111.0 -71.5 152.7 74.4 16.0 25.1 157 161 A F G > S+ 0 0 155 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.833 111.4 59.6 -54.0 -42.0 75.3 15.3 21.6 158 162 A N G 3 S+ 0 0 156 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.663 104.9 52.2 -68.9 -10.5 78.0 12.6 22.2 159 163 A D G <> S+ 0 0 59 -3,-1.9 4,-2.1 1,-0.1 -1,-0.2 0.522 84.1 90.1 -99.5 -3.6 75.5 10.4 24.0 160 164 A L H <> S+ 0 0 3 -3,-1.5 4,-2.3 -4,-0.4 5,-0.2 0.891 82.7 51.3 -62.3 -44.0 72.8 10.4 21.3 161 165 A E H > S+ 0 0 145 -4,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.954 114.3 42.1 -63.8 -47.6 74.0 7.3 19.3 162 166 A Y H > S+ 0 0 111 -4,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.952 116.3 47.8 -64.6 -45.7 74.2 5.0 22.3 163 167 A L H X S+ 0 0 4 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.836 108.2 56.1 -67.9 -30.4 71.0 6.2 23.9 164 168 A T H X S+ 0 0 8 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.926 109.3 47.1 -62.6 -45.6 69.1 6.0 20.5 165 169 A Q H X S+ 0 0 105 -4,-2.0 4,-1.8 -5,-0.2 -2,-0.2 0.919 111.6 50.0 -59.5 -46.2 70.2 2.3 20.4 166 170 A Q H X S+ 0 0 21 -4,-2.3 4,-1.0 1,-0.2 -2,-0.2 0.909 108.9 50.7 -68.0 -38.5 69.1 1.6 24.0 167 171 A N H >X S+ 0 0 3 -4,-2.4 4,-0.7 1,-0.2 3,-0.5 0.902 108.3 53.9 -64.4 -36.4 65.6 3.2 23.5 168 172 A A H >X S+ 0 0 10 -4,-1.9 4,-1.9 1,-0.2 3,-1.3 0.893 100.1 61.1 -61.9 -39.3 65.1 1.1 20.4 169 173 A I H 3< S+ 0 0 41 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.836 94.1 65.6 -58.2 -32.0 65.9 -2.1 22.4 170 174 A R H << S+ 0 0 54 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.844 118.4 21.4 -53.4 -39.5 62.9 -1.3 24.6 171 175 A T H << S+ 0 0 75 -3,-1.3 -2,-0.2 -4,-0.7 -1,-0.2 0.458 88.5 123.5-113.7 -5.6 60.5 -1.8 21.7 172 176 A N >< - 0 0 72 -4,-1.9 3,-1.6 1,-0.2 8,-0.1 -0.351 60.4-136.5 -59.7 132.8 62.5 -4.0 19.3 173 177 A G T 3 S+ 0 0 80 1,-0.3 -1,-0.2 -2,-0.1 -4,-0.0 0.793 102.3 57.4 -60.8 -23.8 60.5 -7.2 18.6 174 178 A S T 3 S+ 0 0 107 2,-0.1 -1,-0.3 0, 0.0 2,-0.1 0.607 82.3 103.8 -86.2 -10.3 63.7 -9.2 18.9 175 179 A S S < S- 0 0 25 -3,-1.6 2,-0.1 -6,-0.1 -5,-0.0 -0.451 71.4-125.3 -67.6 142.2 64.6 -8.0 22.4 176 180 A T > - 0 0 75 -2,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.431 29.4-105.9 -74.1 163.6 64.0 -10.5 25.2 177 181 A A H > S+ 0 0 86 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.930 123.3 51.6 -55.7 -43.1 61.8 -9.3 28.1 178 182 A R H > S+ 0 0 215 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.928 109.9 48.6 -61.0 -45.0 65.0 -9.0 30.2 179 183 A E H > S+ 0 0 103 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.926 113.1 46.9 -61.9 -46.9 66.8 -6.9 27.6 180 184 A A H X S+ 0 0 23 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.935 114.3 46.8 -64.1 -44.0 63.8 -4.5 27.1 181 185 A S H X S+ 0 0 81 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.898 111.6 50.9 -66.2 -40.5 63.3 -4.1 30.9 182 186 A A H X S+ 0 0 59 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.908 110.6 49.5 -64.3 -39.3 67.1 -3.5 31.5 183 187 A A H X S+ 0 0 3 -4,-2.1 4,-2.4 -5,-0.2 5,-0.2 0.923 109.4 52.5 -65.8 -42.8 67.1 -0.9 28.7 184 188 A N H X S+ 0 0 49 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.958 113.0 43.1 -54.3 -50.5 64.0 0.8 30.3 185 189 A Q H X S+ 0 0 94 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.863 109.8 57.5 -69.6 -34.8 65.7 1.0 33.7 186 190 A E H X S+ 0 0 66 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.924 108.1 47.1 -58.9 -44.8 69.0 2.2 32.1 187 191 A L H X S+ 0 0 3 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.899 111.2 50.7 -65.7 -43.3 67.3 5.1 30.5 188 192 A L H X S+ 0 0 15 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.901 110.1 49.9 -59.3 -41.7 65.5 6.0 33.7 189 193 A D H X S+ 0 0 91 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.908 111.3 50.2 -64.6 -40.8 68.8 5.9 35.6 190 194 A Y H X S+ 0 0 52 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.932 109.7 49.0 -58.6 -53.5 70.4 8.1 33.0 191 195 A L H X S+ 0 0 2 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.869 106.1 58.1 -60.2 -32.4 67.6 10.7 33.1 192 196 A A H X S+ 0 0 34 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.891 106.0 49.8 -62.0 -41.5 67.9 10.7 36.9 193 197 A I H X S+ 0 0 91 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.892 110.2 50.3 -55.9 -49.5 71.5 11.8 36.5 194 198 A L H X S+ 0 0 3 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.905 107.9 52.4 -63.2 -40.8 70.6 14.5 34.2 195 199 A V H X S+ 0 0 2 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.938 109.4 50.0 -58.3 -45.8 67.9 15.8 36.5 196 200 A E H X S+ 0 0 89 -4,-2.1 4,-1.2 1,-0.2 -2,-0.2 0.917 113.9 46.2 -59.7 -41.3 70.5 16.0 39.3 197 201 A Q H X S+ 0 0 104 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.914 112.2 47.8 -67.4 -44.1 72.9 17.9 37.0 198 202 A R H < S+ 0 0 11 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.730 105.0 60.6 -74.8 -21.2 70.3 20.3 35.7 199 203 A L H < S+ 0 0 22 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.877 113.2 38.0 -67.7 -37.0 69.1 21.1 39.2 200 204 A V H < S+ 0 0 130 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.1 0.894 139.0 12.0 -79.9 -40.0 72.6 22.3 40.1 201 205 A E S < S- 0 0 136 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 -0.754 79.9-153.3-140.4 90.6 73.3 24.0 36.6 202 206 A P - 0 0 60 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.305 11.0-170.7 -64.8 151.2 70.3 24.4 34.4 203 207 A K - 0 0 113 2,-0.1 2,-1.6 0, 0.0 6,-0.0 -0.633 44.2 -79.4-123.3-171.8 70.8 24.6 30.6 204 208 A D S S+ 0 0 151 -2,-0.2 2,-0.3 4,-0.1 -50,-0.1 -0.507 90.9 98.9-103.6 78.1 68.3 25.4 27.9 205 209 A D S > S- 0 0 15 -2,-1.6 4,-1.8 -52,-0.1 -52,-0.2 -0.904 85.2 -95.9-149.3 170.1 66.3 22.1 27.6 206 210 A I H > S+ 0 0 6 -54,-2.5 4,-2.5 -2,-0.3 5,-0.2 0.900 119.4 53.8 -65.3 -44.0 63.1 20.6 28.9 207 211 A I H > S+ 0 0 0 -54,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.923 108.2 51.2 -59.8 -42.0 64.7 18.8 31.9 208 212 A S H > S+ 0 0 2 -55,-0.3 4,-2.9 1,-0.2 5,-0.3 0.896 108.2 51.2 -64.3 -38.5 66.2 22.1 33.1 209 213 A K H X S+ 0 0 67 -4,-1.8 4,-2.8 2,-0.2 5,-0.5 0.926 110.5 49.1 -62.8 -44.2 62.8 23.9 32.8 210 214 A L H X>S+ 0 0 1 -4,-2.5 5,-2.3 1,-0.2 4,-1.9 0.922 113.5 48.3 -56.5 -46.6 61.2 21.1 34.9 211 215 A C H <>S+ 0 0 0 -4,-2.6 5,-2.8 3,-0.2 -2,-0.2 0.940 120.5 33.9 -60.6 -51.4 64.0 21.4 37.5 212 216 A T H <5S+ 0 0 65 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.907 127.3 36.0 -73.9 -41.9 63.9 25.2 37.8 213 217 A E H <5S+ 0 0 95 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.735 135.5 12.9 -88.8 -22.2 60.2 25.8 37.3 214 218 A Q T <>S+ 0 0 29 -4,-1.9 5,-1.9 -5,-0.5 6,-1.6 0.731 125.1 43.6-124.6 -44.4 58.7 22.7 39.1 215 219 A V T > - 0 0 80 -2,-0.3 4,-1.9 -3,-0.1 3,-0.3 -0.510 34.0-101.0 -99.7 171.2 59.8 16.0 43.0 222 226 A K H > S+ 0 0 90 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.862 123.0 55.1 -55.2 -41.5 62.9 14.9 41.2 223 227 A S H > S+ 0 0 71 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.878 106.1 51.2 -64.0 -39.2 61.4 11.5 40.6 224 228 A D H > S+ 0 0 22 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.894 107.1 53.3 -62.3 -42.3 58.4 13.1 38.9 225 229 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.911 109.3 50.2 -60.1 -42.0 60.7 15.2 36.6 226 230 A V H X S+ 0 0 12 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.938 111.3 47.6 -60.1 -46.9 62.4 11.9 35.6 227 231 A Q H X S+ 0 0 79 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.874 111.6 49.7 -68.3 -33.7 59.0 10.3 34.8 228 232 A I H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.941 112.8 47.1 -67.5 -46.6 57.7 13.3 32.8 229 233 A A H X S+ 0 0 0 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.905 112.2 51.1 -58.2 -43.6 60.9 13.4 30.8 230 234 A F H X S+ 0 0 18 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.915 107.1 52.7 -62.2 -42.9 60.7 9.6 30.2 231 235 A L H X S+ 0 0 26 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.919 108.1 51.5 -57.3 -45.6 57.1 9.8 29.1 232 236 A L H X S+ 0 0 17 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.882 114.1 45.1 -63.0 -36.9 58.2 12.5 26.5 233 237 A L H X S+ 0 0 1 -4,-1.9 4,-0.8 -5,-0.2 -2,-0.2 0.951 122.2 32.1 -65.6 -52.5 60.9 10.2 25.2 234 238 A V H < S+ 0 0 31 -4,-2.9 4,-0.3 1,-0.2 -2,-0.2 0.689 100.8 76.4 -89.1 -17.6 59.0 6.9 25.0 235 239 A A H < S+ 0 0 68 -4,-2.4 -1,-0.2 -5,-0.3 4,-0.1 0.943 115.7 5.2 -59.6 -50.0 55.5 8.0 24.1 236 240 A G H X S+ 0 0 34 -4,-0.5 4,-2.5 -5,-0.2 -1,-0.2 0.469 99.4 94.7-116.6 -7.0 56.0 8.8 20.5 237 241 A N H X S+ 0 0 8 -4,-0.8 4,-2.2 1,-0.2 5,-0.2 0.950 91.0 43.0 -65.8 -51.2 59.5 7.8 19.4 238 242 A A H > S+ 0 0 34 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.832 113.7 55.3 -62.5 -32.8 58.9 4.3 18.0 239 243 A T H > S+ 0 0 43 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.920 106.6 49.5 -64.5 -44.8 55.7 5.7 16.4 240 244 A M H X S+ 0 0 18 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.904 109.4 52.3 -57.6 -44.1 57.7 8.4 14.5 241 245 A V H X S+ 0 0 12 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.950 111.4 46.7 -57.9 -49.8 60.2 5.8 13.3 242 246 A N H X S+ 0 0 29 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.872 109.5 53.9 -60.5 -40.5 57.4 3.7 11.9 243 247 A M H X S+ 0 0 12 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.902 109.1 48.1 -64.8 -40.4 55.7 6.7 10.3 244 248 A I H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.957 115.3 44.6 -61.1 -51.3 58.9 7.7 8.4 245 249 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.926 113.5 50.4 -60.6 -45.5 59.4 4.1 7.2 246 250 A L H X S+ 0 0 1 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.859 108.2 53.5 -61.2 -36.2 55.7 3.7 6.3 247 251 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.926 109.5 47.2 -63.6 -46.3 55.9 6.9 4.3 248 252 A V H X S+ 0 0 1 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.937 114.7 47.0 -59.1 -47.5 58.9 5.7 2.3 249 253 A A H X S+ 0 0 2 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.918 110.3 52.7 -60.7 -41.9 57.2 2.4 1.6 250 254 A T H X S+ 0 0 4 -4,-2.6 4,-1.4 2,-0.2 -1,-0.2 0.899 107.6 51.0 -64.0 -39.8 53.9 4.1 0.7 251 255 A L H < S+ 0 0 0 -4,-2.2 7,-0.5 1,-0.2 -1,-0.2 0.892 111.7 48.4 -65.1 -35.5 55.7 6.3 -1.9 252 256 A A H < S+ 0 0 34 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.878 109.9 52.3 -68.3 -41.7 57.3 3.2 -3.4 253 257 A Q H < S+ 0 0 70 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.766 116.2 40.2 -61.8 -28.7 53.9 1.4 -3.4 254 258 A H S >X S- 0 0 69 -4,-1.4 4,-1.5 -3,-0.2 3,-1.2 -0.782 71.5-176.6-128.4 78.0 52.3 4.4 -5.4 255 259 A P H 3> S+ 0 0 94 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.796 79.8 55.5 -54.1 -33.7 54.8 5.6 -8.0 256 260 A D H 3> S+ 0 0 103 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.855 104.1 54.5 -73.1 -25.3 52.8 8.4 -9.3 257 261 A Q H <> S+ 0 0 23 -3,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.930 110.4 47.5 -66.3 -42.0 52.5 9.9 -5.7 258 262 A L H X S+ 0 0 23 -4,-1.5 4,-2.6 -7,-0.5 5,-0.3 0.917 108.5 54.3 -62.8 -44.2 56.3 9.8 -5.5 259 263 A A H X S+ 0 0 52 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.928 110.1 47.6 -55.7 -44.5 56.6 11.4 -8.9 260 264 A Q H X S+ 0 0 57 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.928 111.9 48.7 -62.0 -44.5 54.4 14.2 -7.7 261 265 A L H < S+ 0 0 3 -4,-2.4 6,-0.2 1,-0.2 -2,-0.2 0.877 110.6 50.9 -66.5 -36.7 56.3 14.7 -4.5 262 266 A K H < S+ 0 0 89 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.888 111.7 47.9 -66.2 -39.7 59.7 14.7 -6.3 263 267 A A H < S+ 0 0 89 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.798 129.4 21.2 -72.9 -23.8 58.4 17.3 -8.7 264 268 A N >< - 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