==== 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 1JFB . 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) . 18513.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 268 67.2 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 . 18 4.5 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 88 0, 0.0 29,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 135.0 32.3 -11.0 21.7 2 6 A P - 0 0 70 0, 0.0 29,-2.5 0, 0.0 2,-0.1 -0.439 360.0 -96.5 -79.1 154.0 35.5 -11.3 19.7 3 7 A S B -a 31 0A 83 27,-0.2 29,-0.2 -2,-0.1 30,-0.0 -0.382 49.4-120.9 -66.2 141.3 38.9 -11.0 21.2 4 8 A F S S+ 0 0 11 27,-2.2 29,-0.3 -2,-0.1 2,-0.2 -0.990 82.7 54.9-137.1 146.9 40.6 -7.6 20.9 5 9 A P S S- 0 0 49 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 0.345 81.9-143.9 -61.8 153.7 43.0 -6.2 19.9 6 10 A F - 0 0 14 -2,-0.2 2,-0.3 1,-0.1 -2,-0.1 -0.477 13.2-112.2 -82.6 158.2 42.4 -7.5 16.4 7 11 A S - 0 0 60 -2,-0.2 9,-0.5 1,-0.1 10,-0.3 -0.725 35.8-101.7 -92.5 147.3 45.2 -8.4 14.0 8 12 A R - 0 0 9 378,-2.7 3,-0.1 -2,-0.3 -1,-0.1 -0.268 26.1-123.4 -65.3 147.6 45.9 -6.4 10.9 9 13 A A S S- 0 0 54 5,-1.4 2,-0.3 1,-0.2 -1,-0.1 0.843 87.3 -22.5 -64.0 -30.9 44.5 -7.9 7.7 10 14 A S S > S- 0 0 38 3,-0.4 3,-1.5 4,-0.1 -1,-0.2 -0.910 91.5 -65.9-164.6 177.4 48.0 -7.8 6.2 11 15 A G T 3 S+ 0 0 13 -2,-0.3 380,-0.4 1,-0.3 373,-0.2 0.839 130.1 22.8 -39.4 -58.6 51.3 -5.9 6.7 12 16 A P T 3 S+ 0 0 30 0, 0.0 -1,-0.3 0, 0.0 378,-0.1 0.392 108.4 92.0 -97.4 7.3 50.1 -2.4 5.7 13 17 A E S < S- 0 0 93 -3,-1.5 -3,-0.4 1,-0.1 -4,-0.2 -0.682 73.1-115.8-106.2 152.9 46.4 -2.8 6.3 14 18 A P - 0 0 22 0, 0.0 -5,-1.4 0, 0.0 -4,-0.1 -0.298 55.4 -73.4 -66.4 166.0 44.1 -2.1 9.2 15 19 A P > - 0 0 10 0, 0.0 3,-0.8 0, 0.0 4,-0.4 -0.375 41.5-132.1 -54.3 138.7 42.2 -5.0 10.9 16 20 A A T 3> S+ 0 0 51 -9,-0.5 4,-0.9 1,-0.2 3,-0.4 0.708 96.1 75.9 -69.0 -21.3 39.4 -6.1 8.6 17 21 A E H 3> S+ 0 0 73 -10,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.835 82.9 65.2 -61.9 -37.1 36.9 -6.1 11.4 18 22 A F H <> S+ 0 0 6 -3,-0.8 4,-3.0 1,-0.2 -1,-0.2 0.889 96.4 51.2 -64.5 -41.5 36.5 -2.4 11.6 19 23 A A H > S+ 0 0 39 -4,-0.4 4,-1.6 -3,-0.4 -1,-0.2 0.903 112.7 48.3 -62.9 -39.1 34.9 -1.7 8.2 20 24 A K H X S+ 0 0 145 -4,-0.9 4,-2.0 2,-0.2 5,-0.3 0.910 111.9 49.1 -65.2 -41.9 32.3 -4.4 8.9 21 25 A L H X S+ 0 0 26 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.917 108.6 52.8 -65.1 -43.7 31.6 -2.9 12.4 22 26 A R H < S+ 0 0 17 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.892 113.9 44.6 -59.9 -39.4 31.2 0.6 11.0 23 27 A A H < S+ 0 0 80 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.838 136.4 3.3 -71.8 -38.0 28.7 -0.8 8.5 24 28 A T H < S+ 0 0 118 -4,-2.0 -3,-0.2 -5,-0.1 -2,-0.2 0.543 136.2 24.6-131.8 -10.4 26.6 -2.9 10.8 25 29 A N < + 0 0 62 -4,-2.5 -2,-0.1 -5,-0.3 -3,-0.1 -0.470 59.2 166.2-158.5 61.9 27.6 -2.8 14.5 26 30 A P S S+ 0 0 37 0, 0.0 16,-1.5 0, 0.0 2,-0.5 0.760 75.0 37.3 -70.3 -21.1 29.4 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 -0.982 85.4 144.5-125.3 111.0 29.3 0.3 18.9 28 32 A S E - B 0 40A 8 12,-1.9 12,-3.4 -2,-0.5 2,-0.3 -0.940 47.2 -97.8-148.5 162.7 29.9 -3.2 20.1 29 33 A Q E - B 0 39A 71 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.699 31.9-174.3 -90.1 141.6 31.4 -5.3 22.8 30 34 A V E - B 0 38A 1 8,-2.8 8,-2.2 -2,-0.3 2,-0.5 -0.886 24.3-119.3-125.2 158.4 34.8 -7.0 22.5 31 35 A K E -aB 3 37A 98 -29,-2.5 -27,-2.2 -2,-0.3 6,-0.2 -0.882 24.6-148.8-102.9 126.9 36.6 -9.5 24.9 32 36 A L > - 0 0 4 4,-2.8 3,-2.6 -2,-0.5 36,-0.1 -0.355 36.1 -91.7 -89.5 172.9 39.9 -8.5 26.4 33 37 A F T 3 S+ 0 0 100 -29,-0.3 35,-0.1 1,-0.3 -1,-0.1 0.759 125.7 53.0 -59.3 -28.6 42.8 -10.9 27.3 34 38 A D T 3 S- 0 0 66 33,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.365 120.7-104.8 -88.2 1.6 41.5 -11.2 30.8 35 39 A G S < S+ 0 0 39 -3,-2.6 -2,-0.1 1,-0.3 2,-0.0 0.282 81.5 127.1 88.0 -6.9 37.9 -12.2 29.7 36 40 A S - 0 0 46 -5,-0.1 -4,-2.8 1,-0.1 -1,-0.3 -0.270 53.6-118.5 -72.2 172.0 36.5 -8.7 30.6 37 41 A L E +B 31 0A 80 -6,-0.2 269,-0.6 -3,-0.1 2,-0.3 -0.780 25.7 179.9-114.5 163.3 34.6 -6.7 28.2 38 42 A A E -Bc 30 306A 1 -8,-2.2 -8,-2.8 -2,-0.3 2,-0.5 -0.990 30.3-113.8-152.3 154.7 34.9 -3.5 26.6 39 43 A W E -Bc 29 307A 21 267,-2.9 269,-3.1 -2,-0.3 2,-0.6 -0.748 26.3-155.7 -85.4 129.6 32.9 -1.3 24.2 40 44 A L E -Bc 28 308A 0 -12,-3.4 -12,-1.9 -2,-0.5 2,-0.4 -0.922 6.5-164.3-105.6 115.9 34.6 -0.8 20.8 41 45 A V E +Bc 27 309A 0 267,-2.5 269,-2.6 -2,-0.6 -14,-0.2 -0.908 13.5 171.9-103.4 141.8 33.5 2.4 19.0 42 46 A T + 0 0 0 -16,-1.5 2,-0.3 -2,-0.4 -20,-0.1 0.501 43.5 91.5-127.0 -19.8 34.4 2.6 15.3 43 47 A K S > S- 0 0 21 -17,-0.4 4,-2.6 1,-0.1 3,-0.4 -0.693 73.7-125.6 -91.1 142.9 32.7 5.7 13.7 44 48 A H H > S+ 0 0 7 -2,-0.3 4,-2.5 270,-0.3 5,-0.2 0.902 109.5 51.9 -50.1 -48.9 34.5 9.1 13.6 45 49 A K H > S+ 0 0 123 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.892 113.0 44.9 -59.4 -39.5 31.7 10.9 15.3 46 50 A D H > S+ 0 0 18 -3,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.859 109.4 54.5 -76.3 -34.4 31.6 8.4 18.2 47 51 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.927 109.0 49.5 -62.4 -42.7 35.4 8.4 18.6 48 52 A C H X S+ 0 0 19 -4,-2.5 4,-1.2 -5,-0.2 -2,-0.2 0.911 109.9 51.9 -63.0 -39.8 35.3 12.2 18.9 49 53 A F H >X S+ 0 0 82 -4,-1.7 4,-2.2 -5,-0.2 3,-0.6 0.932 111.1 46.8 -59.2 -48.6 32.6 11.9 21.5 50 54 A V H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.909 110.2 53.7 -59.7 -42.5 34.6 9.3 23.5 51 55 A A H 3< S+ 0 0 7 -4,-2.4 295,-0.4 1,-0.2 294,-0.3 0.743 120.3 30.6 -65.7 -25.3 37.7 11.5 23.3 52 56 A T H << S+ 0 0 72 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.601 84.0 117.1-111.5 -16.0 35.9 14.6 24.7 53 57 A S >< - 0 0 19 -4,-2.2 3,-1.4 -5,-0.2 -4,-0.0 -0.354 50.4-153.2 -65.2 131.9 33.2 13.4 27.1 54 58 A E T 3 S+ 0 0 168 1,-0.3 -1,-0.2 -2,-0.2 -4,-0.0 0.531 92.5 70.7 -78.1 -4.8 33.6 14.5 30.7 55 59 A K T 3 S+ 0 0 97 236,-0.0 236,-2.9 235,-0.0 237,-0.7 0.442 91.2 74.9 -86.1 -1.3 31.7 11.5 31.8 56 60 A L E < -D 290 0A 6 -3,-1.4 2,-0.3 234,-0.2 234,-0.2 -0.872 68.3-153.3-118.0 148.1 34.6 9.3 30.8 57 61 A S E -D 289 0A 0 232,-2.7 232,-2.0 -2,-0.3 29,-0.1 -0.919 23.1-160.4-126.6 145.0 37.9 8.8 32.6 58 62 A K + 0 0 16 -2,-0.3 2,-0.3 230,-0.2 -1,-0.1 0.390 55.8 124.4 -92.9 -2.4 41.5 7.9 31.7 59 63 A V > - 0 0 41 1,-0.2 3,-1.2 230,-0.1 26,-0.1 -0.432 50.7-155.8 -71.0 124.7 42.4 6.9 35.3 60 64 A R T 3 S+ 0 0 54 -2,-0.3 5,-0.2 24,-0.3 -1,-0.2 0.597 84.4 71.5 -84.2 -3.0 43.7 3.4 35.3 61 65 A T T 3 S+ 0 0 121 2,-0.1 2,-0.6 3,-0.1 -1,-0.3 0.332 76.1 104.4 -90.2 3.3 42.8 2.6 38.9 62 66 A R S X S- 0 0 89 -3,-1.2 3,-2.1 -5,-0.0 2,-0.1 -0.784 81.4-120.1 -86.4 126.5 39.2 2.6 37.9 63 67 A Q T 3 S+ 0 0 176 -2,-0.6 -2,-0.1 1,-0.3 -1,-0.0 -0.412 101.3 40.8 -63.1 135.4 37.8 -0.9 37.6 64 68 A G T 3 S+ 0 0 27 1,-0.4 -1,-0.3 -2,-0.1 224,-0.1 0.221 75.0 144.1 107.1 -11.4 36.7 -1.4 34.1 65 69 A F < - 0 0 22 -3,-2.1 2,-2.0 -5,-0.2 -1,-0.4 -0.395 57.7-119.9 -63.3 133.8 39.6 0.3 32.5 66 70 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.456 35.4-179.0 -83.8 81.0 40.3 -1.6 29.3 67 71 A E - 0 0 10 -2,-2.0 -33,-0.3 1,-0.1 -34,-0.2 -0.631 12.3-160.0 -71.9 133.2 43.9 -2.9 29.8 68 72 A L + 0 0 25 -2,-0.3 2,-0.3 -36,-0.1 -35,-0.2 0.521 66.3 25.2 -97.9 -8.1 44.8 -4.9 26.6 69 73 A S S > S- 0 0 49 1,-0.1 4,-1.5 -37,-0.1 3,-0.3 -0.969 80.2-108.3-148.9 161.2 47.7 -7.0 27.9 70 74 A A H > S+ 0 0 65 -2,-0.3 4,-1.6 1,-0.2 5,-0.1 0.863 119.5 56.7 -57.9 -39.5 49.0 -8.4 31.2 71 75 A S H > S+ 0 0 89 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.871 102.1 55.1 -64.9 -34.8 51.8 -5.9 31.0 72 76 A G H > S+ 0 0 10 -3,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.905 104.1 53.6 -63.7 -40.5 49.3 -3.0 30.9 73 77 A K H < S+ 0 0 104 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.899 110.4 48.2 -59.7 -38.8 47.7 -4.2 34.0 74 78 A Q H >< S+ 0 0 114 -4,-1.6 3,-1.7 1,-0.2 4,-0.2 0.928 108.4 53.6 -60.9 -46.8 51.1 -4.1 35.7 75 79 A A H >< S+ 0 0 56 -4,-2.2 3,-1.4 1,-0.3 -1,-0.2 0.774 94.5 70.0 -63.7 -28.9 51.9 -0.7 34.5 76 80 A A T 3< S+ 0 0 17 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.526 85.1 71.8 -68.3 -8.5 48.7 0.8 35.9 77 81 A K T < S+ 0 0 151 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.680 81.2 90.3 -78.6 -22.2 50.0 0.3 39.4 78 82 A A S < S- 0 0 70 -3,-1.4 -3,-0.0 -4,-0.2 0, 0.0 -0.310 95.7 -83.3 -77.1 166.4 52.5 3.1 39.2 79 83 A K - 0 0 142 1,-0.1 -1,-0.1 -2,-0.1 2,-0.1 -0.391 60.0-118.5 -62.7 125.9 52.1 6.7 40.0 80 84 A P - 0 0 63 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.409 19.9-152.4 -74.7 153.7 50.5 8.3 36.9 81 85 A T > - 0 0 22 -2,-0.1 3,-2.1 146,-0.1 4,-0.1 -0.499 49.2 -78.7-104.9 179.0 51.8 11.0 34.6 82 86 A F G > S+ 0 0 9 1,-0.3 3,-1.7 2,-0.2 12,-0.1 0.735 121.1 73.5 -63.2 -25.1 49.5 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 0.839 107.3 36.7 -52.5 -31.8 48.8 10.7 29.9 84 88 A D G < S+ 0 0 27 -3,-2.1 -24,-0.3 2,-0.1 2,-0.3 0.156 101.1 102.9-111.1 18.7 46.6 8.8 32.4 85 89 A M < - 0 0 28 -3,-1.7 -4,-0.0 -4,-0.1 -3,-0.0 -0.725 53.7-149.7-101.5 153.6 45.1 11.8 34.3 86 90 A D >> - 0 0 15 -2,-0.3 4,-2.2 1,-0.1 3,-0.6 -0.658 48.8 -35.2-101.1 170.5 41.7 13.6 34.1 87 91 A P T 34 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.373 120.7 18.4 -62.6 149.1 41.1 17.3 34.8 88 92 A P T 3> S+ 0 0 98 0, 0.0 4,-1.8 0, 0.0 5,-0.1 -0.996 128.7 46.9 -87.8 -6.4 42.3 19.2 36.6 89 93 A E H <> S+ 0 0 106 -3,-0.6 4,-2.1 1,-0.2 5,-0.3 0.879 105.2 64.8 -60.0 -37.4 45.5 17.1 37.2 90 94 A H H X S+ 0 0 2 -4,-2.2 4,-3.0 1,-0.2 3,-0.2 0.938 110.8 30.5 -51.6 -64.9 45.9 16.5 33.5 91 95 A M H > S+ 0 0 77 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.815 110.8 67.0 -73.6 -25.8 46.5 20.0 32.4 92 96 A H H < S+ 0 0 118 -4,-1.8 4,-0.2 1,-0.2 -1,-0.2 0.927 116.7 28.2 -55.6 -44.2 48.2 21.0 35.6 93 97 A Q H >< S+ 0 0 18 -4,-2.1 3,-1.5 -3,-0.2 4,-0.5 0.900 119.1 54.0 -83.0 -45.3 51.0 18.6 34.7 94 98 A R H >X S+ 0 0 17 -4,-3.0 3,-1.8 -5,-0.3 4,-1.5 0.895 101.7 60.7 -58.7 -37.7 50.8 18.7 30.9 95 99 A S T 3< S+ 0 0 65 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.744 90.3 71.1 -64.0 -19.2 51.1 22.5 30.9 96 100 A M T <4 S+ 0 0 10 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.770 115.4 21.7 -61.6 -29.8 54.5 22.1 32.6 97 101 A V T X4 S+ 0 0 4 -3,-1.8 3,-0.8 -4,-0.5 4,-0.3 0.480 94.6 93.5-120.8 -9.0 55.9 20.8 29.3 98 102 A E G >< + 0 0 52 -4,-1.5 3,-1.5 1,-0.2 4,-0.5 0.721 66.9 82.6 -65.0 -17.7 53.6 22.0 26.5 99 103 A P G > S+ 0 0 79 0, 0.0 3,-1.0 0, 0.0 -1,-0.2 0.861 89.6 51.5 -52.5 -41.4 55.8 25.2 25.7 100 104 A T G < S+ 0 0 34 -3,-0.8 -2,-0.1 1,-0.2 -3,-0.0 0.703 112.2 48.2 -62.4 -22.5 58.3 23.4 23.6 101 105 A F G < S+ 0 0 4 -3,-1.5 251,-0.3 -4,-0.3 252,-0.2 0.309 78.1 121.1-106.5 1.1 55.5 21.9 21.5 102 106 A T S <> S- 0 0 53 -3,-1.0 4,-2.7 -4,-0.5 5,-0.3 -0.260 76.3-108.7 -64.9 159.8 53.3 24.9 20.6 103 107 A P H > S+ 0 0 61 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.912 121.0 46.8 -51.7 -46.3 52.7 25.7 16.9 104 108 A E H > S+ 0 0 140 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.914 110.9 50.4 -67.0 -43.8 54.9 28.8 17.3 105 109 A A H > S+ 0 0 30 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.917 111.6 49.0 -59.8 -40.2 57.6 27.0 19.1 106 110 A V H X S+ 0 0 8 -4,-2.7 4,-0.6 2,-0.2 -1,-0.2 0.892 107.6 53.8 -68.5 -39.0 57.6 24.3 16.5 107 111 A K H >< S+ 0 0 153 -4,-2.2 3,-1.1 -5,-0.3 -1,-0.2 0.926 110.2 48.3 -58.3 -41.0 57.8 26.8 13.6 108 112 A N H 3< S+ 0 0 122 -4,-2.3 4,-0.3 1,-0.3 -1,-0.2 0.750 108.1 55.7 -73.1 -19.7 60.8 28.3 15.4 109 113 A L H >X S+ 0 0 33 -4,-1.3 4,-2.4 1,-0.2 3,-0.6 0.552 79.8 97.8 -82.2 -8.9 62.3 24.8 15.7 110 114 A Q H S+ 0 0 78 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.896 112.1 47.9 -59.4 -38.7 65.7 25.2 11.1 112 116 A Y H <> S+ 0 0 44 -3,-0.6 4,-2.3 -4,-0.3 -2,-0.2 0.910 111.5 49.5 -65.4 -43.9 66.9 22.7 13.8 113 117 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.944 112.7 48.7 -59.6 -45.9 64.6 20.0 12.5 114 118 A Q H X S+ 0 0 49 -4,-2.8 4,-3.0 -5,-0.2 -2,-0.2 0.913 110.5 50.1 -59.7 -45.3 65.9 20.6 8.9 115 119 A R H X S+ 0 0 131 -4,-2.3 4,-2.6 -5,-0.2 -1,-0.2 0.898 109.8 51.3 -62.7 -39.4 69.5 20.5 10.0 116 120 A T H X S+ 0 0 15 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.924 113.7 43.6 -63.6 -46.5 69.0 17.3 11.9 117 121 A V H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.927 114.0 51.3 -61.1 -47.3 67.4 15.6 8.9 118 122 A D H X S+ 0 0 68 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.912 109.9 49.2 -57.9 -44.6 70.1 17.1 6.5 119 123 A D H X S+ 0 0 94 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.916 111.4 47.9 -66.5 -42.7 72.9 15.8 8.7 120 124 A L H X S+ 0 0 19 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.900 112.4 49.8 -67.9 -36.6 71.5 12.3 8.9 121 125 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.884 108.9 52.7 -64.8 -40.5 70.9 12.2 5.1 122 126 A E H X S+ 0 0 54 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.900 108.7 50.1 -67.0 -37.8 74.5 13.4 4.4 123 127 A Q H X S+ 0 0 117 -4,-2.1 4,-3.4 1,-0.2 5,-0.3 0.987 109.0 50.7 -58.1 -53.3 75.9 10.6 6.6 124 128 A M H X S+ 0 0 4 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.866 111.1 49.6 -54.6 -36.5 73.8 8.2 4.7 125 129 A K H < S+ 0 0 119 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.898 112.5 48.0 -63.8 -45.8 75.3 9.7 1.4 126 130 A Q H < S+ 0 0 125 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.893 111.8 48.0 -65.4 -42.0 78.8 9.4 2.7 127 131 A K H < S- 0 0 135 -4,-3.4 3,-0.3 -5,-0.2 -1,-0.2 0.874 98.1-177.2 -62.2 -37.2 78.2 5.8 3.9 128 132 A G < - 0 0 20 -4,-1.6 -2,-0.1 -5,-0.3 -1,-0.1 0.099 37.2-105.4 64.1-176.1 76.8 5.0 0.5 129 133 A C S > S+ 0 0 29 270,-0.2 3,-1.7 -4,-0.1 -1,-0.2 -0.011 71.2 126.9-135.9 30.8 75.2 1.8 -0.8 130 134 A A T 3 S+ 0 0 101 1,-0.3 -2,-0.1 -3,-0.3 -1,-0.1 0.722 79.1 45.5 -63.0 -24.6 78.1 0.6 -3.1 131 135 A N T 3 S- 0 0 173 1,-0.4 -1,-0.3 -3,-0.1 -2,-0.0 0.326 130.5 -75.4-102.9 7.5 78.2 -2.8 -1.4 132 136 A G S < S- 0 0 27 -3,-1.7 -1,-0.4 265,-0.0 265,-0.1 -0.689 76.8 -17.8 125.9-174.6 74.4 -3.2 -1.4 133 137 A P - 0 0 76 0, 0.0 2,-0.3 0, 0.0 265,-0.2 -0.071 48.9-151.0 -63.2 158.2 71.3 -1.8 0.4 134 138 A V E -F 397 0B 18 263,-2.4 263,-2.8 261,-0.1 2,-0.8 -0.868 28.8-101.7-120.9 161.4 71.3 -0.2 3.7 135 139 A D E > -F 396 0B 44 -2,-0.3 4,-2.6 261,-0.2 5,-0.3 -0.715 23.0-160.1 -89.0 110.5 68.4 -0.2 6.3 136 140 A L H >>S+ 0 0 0 259,-2.8 5,-2.6 -2,-0.8 4,-1.3 0.804 90.2 58.5 -59.6 -28.9 66.6 3.1 6.1 137 141 A V H >4>S+ 0 0 13 3,-0.2 5,-2.8 4,-0.2 3,-0.6 0.995 112.1 36.1 -63.1 -61.6 65.2 2.4 9.6 138 142 A K H 345S+ 0 0 122 1,-0.2 -2,-0.2 3,-0.2 -1,-0.2 0.886 124.2 43.2 -57.9 -41.6 68.5 2.2 11.3 139 143 A E H 3<5S- 0 0 47 -4,-2.6 -1,-0.2 3,-0.1 -15,-0.2 0.652 137.7 -11.2 -82.4 -15.5 70.2 4.9 9.2 140 144 A F T S+ 0 0 6 0, 0.0 4,-3.0 0, 0.0 5,-0.4 0.826 102.2 68.3 -69.7 -27.7 67.7 8.6 14.5 144 148 A V H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 5,-0.2 0.976 111.9 28.7 -56.7 -60.3 65.6 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 0.889 121.9 54.3 -67.6 -36.2 62.9 11.4 15.9 146 150 A S H X S+ 0 0 0 -4,-1.6 4,-2.6 1,-0.2 5,-0.3 0.945 109.0 45.7 -65.2 -47.2 65.3 10.0 18.5 147 151 A Y H X S+ 0 0 46 -4,-3.0 4,-2.2 -5,-0.2 -1,-0.2 0.904 114.1 50.6 -63.3 -39.4 67.9 12.7 18.1 148 152 A I H X S+ 0 0 0 -4,-1.7 4,-2.7 -5,-0.4 5,-0.2 0.960 113.8 40.9 -64.8 -53.1 65.3 15.4 18.2 149 153 A I H X S+ 0 0 12 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.935 116.5 49.5 -69.0 -37.3 63.4 14.4 21.3 150 154 A Y H X>S+ 0 0 3 -4,-2.6 5,-2.6 -5,-0.3 4,-1.9 0.921 112.6 48.3 -61.2 -43.1 66.7 13.5 23.2 151 155 A T H <5S+ 0 0 49 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.933 111.7 48.7 -63.1 -45.4 68.1 16.9 22.3 152 156 A L H <5S+ 0 0 24 -4,-2.7 54,-2.6 1,-0.2 55,-0.2 0.890 110.7 51.7 -61.7 -36.8 65.0 18.8 23.3 153 157 A L H <5S- 0 0 0 -4,-2.4 54,-2.0 52,-0.2 55,-0.3 0.850 126.9 -98.5 -66.9 -37.7 65.0 16.9 26.6 154 158 A G T <5 + 0 0 5 -4,-1.9 -3,-0.2 1,-0.3 -2,-0.1 0.459 67.7 149.4 130.6 9.6 68.6 17.8 27.3 155 159 A V < - 0 0 5 -5,-2.6 -1,-0.3 -6,-0.2 2,-0.1 -0.511 48.3-117.8 -67.7 132.4 70.8 14.9 26.3 156 160 A P > - 0 0 57 0, 0.0 3,-2.0 0, 0.0 4,-0.4 -0.371 24.6-109.2 -75.7 154.9 74.2 16.0 25.0 157 161 A F G > S+ 0 0 163 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.825 111.7 58.4 -53.3 -41.2 75.2 15.2 21.5 158 162 A N G 3 S+ 0 0 155 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.647 105.1 53.0 -73.0 -8.2 77.8 12.5 22.2 159 163 A D G <> S+ 0 0 60 -3,-2.0 4,-2.1 1,-0.1 -1,-0.3 0.487 84.4 90.3 -98.9 -3.2 75.3 10.4 24.0 160 164 A L H <> S+ 0 0 4 -3,-1.5 4,-2.3 -4,-0.4 5,-0.2 0.894 82.8 49.8 -63.5 -42.9 72.7 10.3 21.3 161 165 A E H > S+ 0 0 143 -4,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.960 114.3 43.4 -64.7 -48.3 73.7 7.3 19.3 162 166 A Y H > S+ 0 0 113 -4,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.961 116.5 46.6 -62.7 -46.2 74.0 5.0 22.3 163 167 A L H X S+ 0 0 3 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.839 109.0 55.9 -68.5 -29.3 70.7 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 0.928 109.7 46.7 -63.5 -45.7 68.9 5.9 20.5 165 169 A Q H X S+ 0 0 95 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.918 112.2 49.9 -61.3 -44.2 70.0 2.3 20.3 166 170 A Q H X S+ 0 0 21 -4,-2.4 4,-1.2 1,-0.2 -2,-0.2 0.908 109.4 50.2 -67.6 -40.7 68.9 1.6 23.9 167 171 A N H X S+ 0 0 2 -4,-2.4 4,-0.6 1,-0.2 3,-0.4 0.906 107.7 54.5 -63.7 -34.7 65.4 3.2 23.5 168 172 A A H >X S+ 0 0 10 -4,-1.9 4,-1.7 1,-0.2 3,-1.2 0.886 101.1 60.2 -63.2 -36.8 64.9 1.1 20.3 169 173 A I H 3< S+ 0 0 40 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.847 93.5 66.3 -61.0 -31.2 65.7 -2.1 22.4 170 174 A R H 3< S+ 0 0 54 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.846 118.5 20.3 -53.8 -39.5 62.7 -1.2 24.6 171 175 A T H << S+ 0 0 58 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.439 88.4 124.3-113.4 -5.3 60.3 -1.8 21.8 172 176 A N >< - 0 0 71 -4,-1.7 3,-1.6 1,-0.2 8,-0.1 -0.372 61.1-135.2 -60.0 133.2 62.2 -4.0 19.3 173 177 A G T 3 S+ 0 0 75 1,-0.3 -1,-0.2 -2,-0.1 -4,-0.0 0.786 102.7 57.1 -57.8 -28.3 60.3 -7.1 18.6 174 178 A S T 3 S+ 0 0 108 2,-0.0 -1,-0.3 0, 0.0 2,-0.2 0.530 82.1 104.0 -84.9 -7.5 63.5 -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 -0.552 71.7-125.0 -67.1 142.2 64.4 -8.0 22.4 176 180 A T > - 0 0 76 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.440 29.5-104.9 -73.6 166.1 63.7 -10.4 25.2 177 181 A A H > S+ 0 0 85 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.907 123.5 50.6 -57.8 -42.3 61.6 -9.3 28.1 178 182 A R H > S+ 0 0 217 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.914 110.3 48.6 -63.5 -44.7 64.7 -8.9 30.2 179 183 A E H > S+ 0 0 102 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.908 113.2 46.9 -62.2 -44.0 66.5 -6.9 27.6 180 184 A A H X S+ 0 0 23 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.928 114.8 46.3 -64.5 -42.8 63.6 -4.5 27.1 181 185 A S H X S+ 0 0 61 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.898 111.6 51.3 -69.0 -38.7 63.1 -4.1 30.9 182 186 A A H X S+ 0 0 50 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.894 110.4 49.3 -64.9 -40.1 66.8 -3.5 31.4 183 187 A A H X S+ 0 0 2 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.926 109.7 51.6 -65.2 -41.3 66.8 -0.8 28.7 184 188 A N H X S+ 0 0 47 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.944 113.6 43.9 -57.1 -50.5 63.8 0.8 30.2 185 189 A Q H X S+ 0 0 112 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.883 110.7 55.7 -60.8 -41.4 65.5 1.0 33.7 186 190 A E H X S+ 0 0 64 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.902 108.6 47.2 -61.4 -44.0 68.8 2.1 32.1 187 191 A L H X S+ 0 0 3 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.909 111.6 50.6 -67.4 -42.3 67.1 5.1 30.5 188 192 A L H X S+ 0 0 31 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.905 110.2 49.6 -59.0 -41.1 65.3 6.0 33.7 189 193 A D H X S+ 0 0 110 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.902 111.2 50.1 -66.4 -39.0 68.6 5.9 35.6 190 194 A Y H X S+ 0 0 52 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.927 110.1 48.9 -60.6 -51.7 70.2 8.1 32.9 191 195 A L H X S+ 0 0 3 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.863 105.6 59.3 -60.2 -36.2 67.4 10.7 33.1 192 196 A A H X S+ 0 0 37 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.897 106.0 48.1 -62.0 -39.1 67.7 10.7 36.9 193 197 A I H X S+ 0 0 99 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.910 109.6 52.4 -65.4 -41.3 71.3 11.8 36.6 194 198 A L H X S+ 0 0 4 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.901 108.1 51.3 -62.7 -41.0 70.4 14.5 34.1 195 199 A V H X S+ 0 0 2 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.936 109.6 50.0 -60.4 -44.5 67.7 15.8 36.5 196 200 A E H X S+ 0 0 90 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.916 114.3 45.9 -58.6 -41.6 70.3 15.9 39.3 197 201 A Q H X S+ 0 0 104 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.916 112.3 47.8 -68.6 -44.6 72.7 17.8 37.0 198 202 A R H < S+ 0 0 16 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.729 104.8 61.2 -73.7 -21.4 70.2 20.3 35.6 199 203 A L H < S+ 0 0 22 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.873 113.4 37.3 -66.2 -39.8 69.0 21.1 39.2 200 204 A V H < S+ 0 0 129 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.865 139.0 12.2 -76.2 -41.7 72.5 22.2 40.0 201 205 A E S < S- 0 0 132 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 -0.737 79.9-154.2-139.8 86.3 73.2 23.9 36.6 202 206 A P - 0 0 59 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.339 15.7-178.8 -66.0 149.8 70.2 24.3 34.4 203 207 A K - 0 0 120 2,-0.1 2,-1.7 0, 0.0 6,-0.0 -0.646 43.9 -62.2-124.8-165.2 70.6 24.5 30.6 204 208 A D S S+ 0 0 144 -2,-0.2 2,-0.3 4,-0.1 -50,-0.1 -0.537 93.0 89.7 -93.0 78.7 68.4 25.0 27.4 205 209 A D S > S- 0 0 10 -2,-1.7 4,-1.8 1,-0.1 -52,-0.2 -0.982 85.1 -98.1-165.3 170.1 66.2 22.0 27.6 206 210 A I H > S+ 0 0 5 -54,-2.6 4,-2.5 -2,-0.3 5,-0.2 0.908 116.9 54.2 -68.0 -41.9 63.0 20.6 28.8 207 211 A I H > S+ 0 0 0 -54,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.924 107.4 52.0 -60.4 -41.2 64.5 18.8 31.9 208 212 A S H > S+ 0 0 2 -55,-0.3 4,-3.0 1,-0.2 5,-0.3 0.894 108.3 50.8 -61.7 -42.1 66.0 22.1 33.0 209 213 A K H X S+ 0 0 71 -4,-1.8 4,-2.7 2,-0.2 5,-0.5 0.926 110.2 49.3 -62.6 -41.4 62.7 23.8 32.8 210 214 A L H X>S+ 0 0 1 -4,-2.5 5,-2.4 3,-0.2 4,-1.9 0.925 113.8 47.8 -57.5 -45.4 61.1 21.1 34.9 211 215 A C H <>S+ 0 0 0 -4,-2.5 5,-2.8 3,-0.2 -2,-0.2 0.951 120.3 34.6 -63.0 -51.9 63.8 21.4 37.4 212 216 A T H <5S+ 0 0 65 -4,-3.0 -2,-0.2 3,-0.2 -3,-0.2 0.926 127.2 35.6 -73.1 -41.3 63.7 25.2 37.7 213 217 A E H <5S+ 0 0 92 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.740 135.6 12.6 -89.3 -23.1 60.0 25.8 37.3 214 218 A Q T <>S+ 0 0 29 -4,-1.9 5,-1.8 -5,-0.5 6,-1.4 0.760 124.2 45.0-125.3 -44.1 58.6 22.7 39.0 215 219 A V T > - 0 0 76 -2,-0.3 4,-1.9 -3,-0.1 3,-0.2 -0.502 34.3 -99.9 -99.5 174.1 59.6 16.0 43.0 222 226 A K H > S+ 0 0 87 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.868 122.8 55.0 -59.4 -42.1 62.7 14.9 41.1 223 227 A S H > S+ 0 0 65 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.876 106.3 52.0 -60.0 -39.1 61.2 11.5 40.5 224 228 A D H > S+ 0 0 22 -3,-0.2 4,-2.6 2,-0.2 5,-0.2 0.913 106.6 53.1 -62.5 -40.7 58.2 13.1 38.9 225 229 A A H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.910 109.1 50.4 -60.4 -43.7 60.5 15.2 36.6 226 230 A V H X S+ 0 0 11 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.933 111.5 47.3 -57.8 -48.4 62.2 11.9 35.5 227 231 A Q H X S+ 0 0 86 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.873 111.5 49.7 -69.4 -32.1 58.9 10.3 34.7 228 232 A I H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.933 112.8 47.3 -68.5 -46.2 57.6 13.3 32.8 229 233 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.920 112.5 50.5 -56.5 -44.9 60.8 13.4 30.7 230 234 A F H X S+ 0 0 17 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.913 107.0 53.3 -62.8 -42.6 60.5 9.6 30.2 231 235 A L H X S+ 0 0 23 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.923 107.8 51.7 -55.6 -47.4 56.9 9.9 29.0 232 236 A L H X S+ 0 0 18 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.875 113.7 45.2 -60.8 -37.6 58.0 12.5 26.4 233 237 A L H X S+ 0 0 1 -4,-1.9 4,-0.9 -5,-0.2 3,-0.3 0.954 122.3 32.5 -65.3 -54.3 60.7 10.2 25.2 234 238 A V H < S+ 0 0 32 -4,-2.9 4,-0.4 1,-0.2 -2,-0.2 0.706 101.2 74.5 -86.0 -19.4 58.7 7.0 25.0 235 239 A A H < S+ 0 0 66 -4,-2.6 -1,-0.2 -5,-0.3 -3,-0.1 0.896 116.3 8.3 -61.8 -42.8 55.2 8.1 24.1 236 240 A G H X S+ 0 0 33 -4,-0.5 4,-2.6 -3,-0.3 -1,-0.2 0.499 99.4 92.0-117.6 -10.4 55.9 8.9 20.5 237 241 A N H X S+ 0 0 7 -4,-0.9 4,-2.3 1,-0.2 5,-0.2 0.951 91.4 43.1 -67.3 -50.3 59.3 7.8 19.3 238 242 A A H > S+ 0 0 33 -4,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.852 114.3 54.3 -62.9 -32.8 58.6 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 0.927 107.2 50.0 -65.4 -44.3 55.5 5.7 16.3 240 244 A M H X S+ 0 0 17 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.909 109.4 51.4 -56.9 -45.8 57.5 8.4 14.5 241 245 A V H X S+ 0 0 12 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.944 112.0 47.0 -58.4 -49.3 60.0 5.8 13.3 242 246 A N H X S+ 0 0 28 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.872 109.2 53.8 -59.1 -41.7 57.1 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 0.908 109.2 48.1 -63.9 -40.8 55.5 6.7 10.3 244 248 A I H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.958 115.3 44.6 -60.7 -51.3 58.7 7.6 8.4 245 249 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.926 113.4 50.3 -61.0 -45.6 59.2 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 0.854 107.6 54.7 -61.7 -35.5 55.6 3.7 6.2 247 251 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.925 108.8 46.9 -62.9 -44.7 55.7 6.9 4.3 248 252 A V H X S+ 0 0 1 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.935 114.6 47.5 -60.9 -45.8 58.6 5.7 2.2 249 253 A A H X S+ 0 0 1 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.911 110.4 52.3 -60.8 -43.9 56.9 2.4 1.6 250 254 A T H X S+ 0 0 1 -4,-2.6 4,-0.8 1,-0.2 -1,-0.2 0.893 107.5 51.3 -62.1 -41.2 53.7 4.1 0.7 251 255 A L H >< S+ 0 0 1 -4,-2.2 3,-0.8 1,-0.2 7,-0.5 0.913 110.2 49.4 -61.7 -40.9 55.4 6.3 -1.9 252 256 A A H 3< S+ 0 0 32 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.877 108.4 54.3 -65.3 -33.7 57.0 3.3 -3.5 253 257 A Q H 3< S+ 0 0 51 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.652 115.5 39.9 -70.8 -18.2 53.5 1.6 -3.6 254 258 A H S XX S- 0 0 62 -3,-0.8 4,-1.7 -4,-0.8 3,-1.2 -0.705 71.9-179.5-137.2 72.7 52.1 4.5 -5.5 255 259 A P H 3> S+ 0 0 93 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.801 76.8 57.0 -52.8 -35.8 54.6 5.6 -8.0 256 260 A D H 3> S+ 0 0 109 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.846 106.4 50.3 -68.7 -33.6 52.7 8.5 -9.5 257 261 A Q H <> S+ 0 0 25 -3,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.898 109.7 51.2 -69.2 -37.1 52.3 10.2 -6.1 258 262 A L H X S+ 0 0 26 -4,-1.7 4,-2.8 -7,-0.5 -2,-0.2 0.909 108.9 52.0 -60.2 -43.8 56.1 9.8 -5.5 259 263 A A H X S+ 0 0 48 -4,-2.5 4,-1.7 -5,-0.2 -2,-0.2 0.922 109.9 48.8 -58.4 -41.3 56.6 11.4 -8.9 260 264 A Q H X S+ 0 0 55 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.924 113.0 46.3 -63.1 -44.5 54.4 14.3 -7.9 261 265 A L H < S+ 0 0 3 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.877 110.9 53.0 -65.8 -38.6 56.2 14.7 -4.5 262 266 A K H < S+ 0 0 95 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.791 113.2 44.3 -62.5 -36.1 59.5 14.5 -6.3 263 267 A A H < S+ 0 0 88 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.657 129.4 24.0 -80.7 -22.5 58.3 17.3 -8.7 264 268 A N >< - 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