==== 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,ELECTRON TRANSPORT 24-OCT-06 2NNJ . COMPND 2 MOLECULE: CYTOCHROME P450 2C8; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.A.SCHOCH,J.K.YANO,C.D.STOUT,E.F.JOHNSON . 463 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21120.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 317 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 7.1 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 . 2 0.4 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 . 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 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 189 40.8 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 0 1 0 2 1 0 0 1 1 0 3 1 2 2 1 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 4 3 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 0 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 K 0 0 154 0, 0.0 352,-2.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 75.4 58.6 21.3 3.2 2 29 A L - 0 0 53 350,-0.2 352,-0.1 1,-0.1 37,-0.1 -0.367 360.0 -86.5 -70.5 152.0 56.0 20.7 0.4 3 30 A P - 0 0 4 0, 0.0 36,-0.3 0, 0.0 -1,-0.1 -0.230 54.5 -96.5 -58.1 149.6 53.1 23.2 0.2 4 31 A P + 0 0 70 0, 0.0 35,-2.0 0, 0.0 30,-0.1 -0.093 55.3 149.9 -62.7 168.4 50.1 22.4 2.5 5 32 A G - 0 0 23 33,-0.2 35,-0.1 -3,-0.1 2,-0.1 -0.967 49.5 -41.5-177.9-176.6 47.0 20.5 1.1 6 33 A P - 0 0 4 0, 0.0 35,-0.1 0, 0.0 8,-0.1 -0.402 69.9 -98.6 -67.2 143.8 44.2 18.2 2.1 7 34 A T - 0 0 121 1,-0.1 2,-0.2 -2,-0.1 33,-0.0 -0.446 43.7-133.5 -63.1 122.9 45.3 15.3 4.4 8 35 A P - 0 0 51 0, 0.0 6,-0.2 0, 0.0 -1,-0.1 -0.512 9.0-121.9 -82.5 150.3 45.9 12.2 2.3 9 36 A L B > -A 13 0A 92 4,-1.9 4,-1.7 -2,-0.2 6,-0.1 -0.660 39.3 -99.0 -85.0 146.3 44.6 8.8 3.1 10 37 A P T 4 S+ 0 0 112 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.678 106.6 8.4 -32.6 -48.5 47.3 6.1 3.4 11 38 A I T 4 S+ 0 0 120 2,-0.1 -2,-0.0 33,-0.0 0, 0.0 0.799 133.4 39.3-111.5 -42.6 47.2 4.3 -0.0 12 39 A I T >4 S- 0 0 52 1,-0.3 3,-1.9 31,-0.1 31,-1.3 0.374 86.3-156.3 -92.6 5.0 44.9 6.3 -2.4 13 40 A G B 3< -AB 9 42A 2 -4,-1.7 -4,-1.9 1,-0.2 3,-0.3 -0.308 65.7 -25.5 57.8-132.9 46.0 9.8 -1.2 14 41 A N T >> S+ 0 0 2 27,-2.6 3,-2.0 -6,-0.2 4,-0.7 0.239 101.2 118.8 -96.7 12.8 43.3 12.4 -1.9 15 42 A M G X4 S+ 0 0 20 -3,-1.9 3,-0.6 26,-0.3 -1,-0.2 0.787 72.6 51.5 -47.3 -39.9 41.8 10.4 -4.8 16 43 A L G 34 S+ 0 0 141 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.641 106.1 57.1 -75.8 -14.3 38.4 10.1 -3.1 17 44 A Q G <4 S+ 0 0 99 -3,-2.0 2,-0.4 2,-0.0 -1,-0.2 0.600 99.7 70.1 -89.8 -14.9 38.3 13.8 -2.5 18 45 A I S << S- 0 0 13 -4,-0.7 2,-0.8 -3,-0.6 5,-0.1 -0.839 78.7-127.6-110.8 144.1 38.7 14.7 -6.2 19 46 A D > - 0 0 38 -2,-0.4 3,-1.2 3,-0.3 7,-0.3 -0.785 14.2-158.8 -87.2 111.7 36.3 14.3 -9.1 20 47 A V T 3 S+ 0 0 38 -2,-0.8 3,-0.4 1,-0.3 -1,-0.1 0.661 91.3 58.5 -64.5 -15.3 38.2 12.5 -11.9 21 48 A K T 3 S+ 0 0 135 1,-0.2 426,-0.7 2,-0.1 -1,-0.3 0.662 124.7 16.1 -86.9 -19.9 35.7 13.8 -14.4 22 49 A D X> + 0 0 40 -3,-1.2 4,-1.3 424,-0.1 3,-0.8 -0.458 69.0 163.9-153.4 68.4 36.5 17.5 -13.6 23 50 A I H 3> S+ 0 0 12 424,-0.5 4,-2.7 -3,-0.4 5,-0.2 0.821 75.5 61.3 -60.5 -34.0 39.7 17.6 -11.7 24 51 A C H 3> S+ 0 0 8 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.842 100.8 54.0 -62.9 -34.7 40.1 21.4 -12.3 25 52 A K H <> S+ 0 0 90 -3,-0.8 4,-1.9 2,-0.2 -1,-0.2 0.907 110.5 46.6 -65.0 -41.8 36.9 22.0 -10.4 26 53 A S H X S+ 0 0 9 -4,-1.3 4,-1.8 -7,-0.3 -2,-0.2 0.911 113.2 48.8 -66.6 -41.5 38.3 20.0 -7.5 27 54 A F H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.880 109.6 51.8 -64.9 -39.8 41.6 21.9 -7.7 28 55 A T H X S+ 0 0 42 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.873 109.4 50.2 -64.3 -39.0 39.8 25.3 -7.9 29 56 A N H < S+ 0 0 82 -4,-1.9 3,-0.4 1,-0.2 4,-0.3 0.875 109.1 52.3 -67.3 -35.3 37.8 24.3 -4.8 30 57 A F H >X S+ 0 0 24 -4,-1.8 4,-3.1 1,-0.2 3,-1.2 0.827 101.8 59.4 -68.6 -33.3 41.0 23.4 -3.0 31 58 A S H 3X S+ 0 0 18 -4,-1.8 4,-1.2 1,-0.3 -1,-0.2 0.767 97.9 60.7 -67.0 -24.8 42.6 26.8 -3.9 32 59 A K H 3< S+ 0 0 162 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.659 116.8 31.2 -75.0 -15.3 39.7 28.4 -1.9 33 60 A V H <4 S+ 0 0 105 -3,-1.2 -2,-0.2 -4,-0.3 -3,-0.1 0.801 132.5 26.2-106.1 -46.3 40.9 26.6 1.2 34 61 A Y H < S- 0 0 85 -4,-3.1 3,-0.3 1,-0.3 -3,-0.2 0.525 101.7-121.9-100.7 -8.0 44.7 26.3 0.8 35 62 A G < - 0 0 24 -4,-1.2 -1,-0.3 -5,-0.4 -2,-0.2 -0.541 51.4 -36.9 102.4-169.4 45.7 29.2 -1.4 36 63 A P S S+ 0 0 67 0, 0.0 15,-3.2 0, 0.0 2,-0.4 0.676 125.5 42.4 -68.5 -24.4 47.5 29.5 -4.8 37 64 A V E S+ C 0 50A 3 -3,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.980 72.1 151.5-131.9 119.9 50.0 26.7 -4.3 38 65 A F E - C 0 49A 0 11,-1.9 11,-3.4 -2,-0.4 2,-0.4 -0.966 36.0-123.4-147.0 161.3 49.0 23.3 -2.7 39 66 A T E + C 0 48A 5 -35,-2.0 2,-0.3 -36,-0.3 9,-0.2 -0.887 24.4 176.8-110.1 135.4 49.9 19.7 -2.7 40 67 A V E - C 0 47A 0 7,-2.3 7,-2.1 -2,-0.4 2,-0.5 -0.944 21.5-134.6-130.8 152.3 47.5 16.8 -3.5 41 68 A Y E - C 0 46A 68 -2,-0.3 -27,-2.6 5,-0.2 2,-0.8 -0.943 9.6-165.8-115.5 128.6 48.3 13.1 -3.6 42 69 A F E > S-BC 13 45A 4 3,-2.5 3,-1.8 -2,-0.5 2,-0.3 -0.915 79.1 -47.2-108.9 98.0 47.2 10.7 -6.4 43 70 A G T 3 S- 0 0 2 -31,-1.3 -29,-0.2 -2,-0.8 149,-0.1 -0.596 123.9 -25.1 72.2-132.2 47.9 7.4 -4.7 44 71 A M T 3 S+ 0 0 130 147,-0.4 -1,-0.3 -2,-0.3 -32,-0.1 0.502 117.2 105.1 -88.8 -4.5 51.4 7.8 -3.3 45 72 A N E < -C 42 0A 70 -3,-1.8 -3,-2.5 146,-0.1 2,-0.2 -0.660 62.0-145.7 -86.3 116.7 52.3 10.5 -5.9 46 73 A P E -C 41 0A 33 0, 0.0 313,-0.9 0, 0.0 2,-0.4 -0.503 15.2-172.6 -77.6 148.1 52.5 14.1 -4.7 47 74 A I E -Cd 40 359A 11 -7,-2.1 -7,-2.3 -2,-0.2 2,-0.6 -0.973 13.8-149.2-140.4 121.8 51.5 16.8 -7.1 48 75 A V E -Cd 39 360A 0 311,-2.2 313,-2.1 -2,-0.4 2,-0.4 -0.856 18.6-153.1 -96.6 125.0 52.0 20.5 -6.4 49 76 A V E -Cd 38 361A 0 -11,-3.4 -11,-1.9 -2,-0.6 2,-0.6 -0.823 6.6-155.7-101.7 135.3 49.3 22.6 -8.0 50 77 A F E -Cd 37 362A 0 311,-2.9 313,-2.6 -2,-0.4 2,-0.4 -0.952 14.5-175.7-113.7 116.9 49.6 26.2 -9.1 51 78 A H + 0 0 39 -15,-3.2 4,-0.3 -2,-0.6 313,-0.1 -0.951 45.7 23.9-116.6 129.1 46.4 28.1 -9.3 52 79 A G S > S- 0 0 17 311,-0.5 4,-2.7 -2,-0.4 5,-0.2 0.075 87.9 -82.9 98.9 149.2 46.2 31.7 -10.5 53 80 A Y H > S+ 0 0 25 313,-0.4 4,-3.2 1,-0.2 5,-0.3 0.883 123.0 52.8 -52.3 -51.6 48.3 33.9 -12.7 54 81 A E H > S+ 0 0 122 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.911 115.2 40.9 -55.3 -46.3 50.8 35.0 -10.1 55 82 A A H > S+ 0 0 1 -4,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.915 117.3 47.5 -69.6 -43.5 51.6 31.4 -9.1 56 83 A V H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 5,-0.4 0.918 114.7 46.3 -64.1 -44.0 51.6 30.1 -12.6 57 84 A K H X>S+ 0 0 69 -4,-3.2 4,-2.3 -5,-0.2 5,-1.8 0.943 110.6 51.7 -64.1 -49.7 53.8 32.9 -13.9 58 85 A E H <5S+ 0 0 54 -4,-2.2 5,-0.3 -5,-0.3 -1,-0.2 0.864 118.5 39.0 -57.4 -36.4 56.3 32.6 -11.0 59 86 A A H X5S+ 0 0 0 -4,-1.8 4,-0.9 3,-0.2 8,-0.3 0.988 123.9 32.5 -77.1 -68.2 56.7 28.9 -11.6 60 87 A L H <5S+ 0 0 3 -4,-2.2 345,-0.7 -5,-0.2 -3,-0.2 0.783 135.7 20.6 -62.6 -31.4 56.7 28.5 -15.4 61 88 A I T ><5S+ 0 0 80 -4,-2.3 3,-1.4 -5,-0.4 -3,-0.2 0.881 125.4 41.4-105.1 -57.6 58.4 31.8 -16.3 62 89 A D T 344 S+ 0 0 71 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 0.949 111.8 45.3 -63.2 -49.3 64.5 26.2 -15.9 66 93 A E T 34 S+ 0 0 59 -3,-0.3 278,-2.1 1,-0.3 3,-0.5 0.833 117.3 45.7 -63.3 -33.7 63.5 24.4 -12.7 67 94 A F T 3< S+ 0 0 2 -4,-1.9 -1,-0.3 -8,-0.3 -2,-0.2 0.193 86.0 94.8 -97.0 18.6 59.9 24.0 -14.0 68 95 A S < + 0 0 4 -3,-1.4 -1,-0.2 -5,-0.2 -2,-0.1 0.443 56.8 110.2 -88.6 -0.1 60.9 22.8 -17.5 69 96 A G E -E 342 0A 3 273,-0.8 273,-1.4 -3,-0.5 2,-0.5 -0.406 69.5-122.2 -76.4 152.3 60.7 19.1 -16.8 70 97 A R E -E 341 0A 27 271,-0.3 2,-0.7 18,-0.2 271,-0.3 -0.835 21.2-128.6 -94.1 126.3 57.9 16.9 -18.2 71 98 A G - 0 0 9 269,-2.1 2,-0.2 -2,-0.5 271,-0.1 -0.660 36.0-159.9 -74.2 114.1 55.9 15.1 -15.6 72 99 A N - 0 0 49 -2,-0.7 3,-0.0 4,-0.0 287,-0.0 -0.555 12.5-163.9 -99.2 166.4 56.0 11.5 -16.8 73 100 A S > - 0 0 25 -2,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.919 36.8-103.4-140.8 162.9 53.8 8.5 -16.1 74 101 A P H > S+ 0 0 45 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.902 121.8 49.2 -55.2 -43.8 54.0 4.7 -16.5 75 102 A I H > S+ 0 0 31 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.875 109.7 51.1 -64.7 -39.8 51.7 4.8 -19.6 76 103 A S H >>S+ 0 0 38 1,-0.2 4,-2.7 2,-0.2 5,-0.6 0.934 110.3 48.4 -63.9 -46.7 53.7 7.6 -21.2 77 104 A Q H X5S+ 0 0 89 -4,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.767 112.0 51.3 -64.5 -26.1 57.0 5.8 -20.8 78 105 A R H <5S+ 0 0 123 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.825 115.5 39.3 -80.7 -33.9 55.4 2.6 -22.3 79 106 A I H <5S+ 0 0 38 -4,-1.8 -2,-0.2 -3,-0.1 -3,-0.2 0.912 133.1 21.8 -81.1 -46.4 54.0 4.4 -25.4 80 107 A T H ><5S- 0 0 21 -4,-2.7 3,-1.3 -5,-0.2 -3,-0.2 0.750 84.2-143.1 -93.9 -29.0 57.0 6.7 -26.2 81 108 A K T 3< + 0 0 22 -3,-1.3 4,-0.5 -6,-0.1 -1,-0.3 -0.458 47.1 19.6 -88.9 161.4 61.8 9.1 -27.2 84 111 A G T 4 S- 0 0 0 -2,-0.1 179,-0.2 1,-0.1 12,-0.2 -0.562 97.2 -64.7 90.1-146.8 60.7 12.3 -29.1 85 112 A I T 4 S+ 0 0 11 177,-0.3 3,-0.4 -2,-0.2 -1,-0.1 0.742 115.6 57.3-117.5 -43.7 59.8 15.7 -27.7 86 113 A I T 4 S+ 0 0 47 1,-0.2 -2,-0.1 -3,-0.1 177,-0.0 0.927 119.5 27.1 -60.2 -48.6 56.6 15.4 -25.6 87 114 A S S < S+ 0 0 6 -4,-0.5 -1,-0.2 -11,-0.1 2,-0.2 0.323 100.5 100.4-100.3 6.6 57.8 12.8 -23.1 88 115 A S - 0 0 2 -3,-0.4 2,-0.2 4,-0.1 -18,-0.2 -0.496 46.3-174.1 -92.2 162.7 61.6 13.4 -23.1 89 116 A N >> + 0 0 62 -7,-0.2 4,-1.4 -2,-0.2 3,-0.7 -0.810 43.1 17.7-141.2 179.9 63.7 15.3 -20.6 90 117 A G H 3> S- 0 0 27 -2,-0.2 4,-2.1 1,-0.2 3,-0.3 -0.071 120.5 -12.5 54.7-148.0 67.2 16.5 -20.1 91 118 A K H 3> S+ 0 0 131 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.818 135.4 55.9 -54.6 -38.6 69.7 16.8 -22.9 92 119 A R H <> S+ 0 0 81 -3,-0.7 4,-2.3 2,-0.2 5,-0.3 0.917 108.7 47.6 -63.9 -43.1 67.5 14.8 -25.3 93 120 A W H X S+ 0 0 14 -4,-1.4 4,-2.8 -3,-0.3 5,-0.3 0.965 111.0 50.3 -61.5 -54.4 64.6 17.1 -24.9 94 121 A K H X S+ 0 0 100 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.877 115.0 42.7 -52.6 -44.8 66.7 20.3 -25.3 95 122 A E H X S+ 0 0 79 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.931 116.0 45.2 -71.3 -46.7 68.3 19.1 -28.6 96 123 A I H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.895 117.4 46.0 -64.4 -40.0 65.2 17.6 -30.2 97 124 A R H X S+ 0 0 30 -4,-2.8 4,-3.0 -5,-0.3 5,-0.2 0.918 110.0 52.4 -68.6 -45.4 63.1 20.6 -29.3 98 125 A R H X S+ 0 0 198 -4,-2.1 4,-1.6 -5,-0.3 -2,-0.2 0.906 115.6 42.3 -57.1 -44.2 65.7 23.2 -30.4 99 126 A F H X S+ 0 0 18 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.936 113.7 52.1 -66.9 -48.7 65.9 21.4 -33.8 100 127 A S H X S+ 0 0 0 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.869 108.9 50.5 -55.6 -43.5 62.1 21.0 -34.0 101 128 A L H < S+ 0 0 72 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.904 111.0 47.4 -63.8 -44.2 61.4 24.7 -33.3 102 129 A T H >< S+ 0 0 75 -4,-1.6 3,-1.0 1,-0.2 -2,-0.2 0.881 114.1 45.9 -68.5 -37.4 63.9 25.9 -36.0 103 130 A T H 3< S+ 0 0 5 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.695 106.7 59.8 -79.0 -17.1 62.5 23.5 -38.7 104 131 A L T 3< S+ 0 0 27 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.280 79.7 116.6 -90.9 9.7 58.9 24.4 -37.8 105 132 A R S X S- 0 0 175 -3,-1.0 3,-2.5 1,-0.1 4,-0.2 -0.417 88.9 -98.0 -72.0 156.6 59.6 28.0 -38.7 106 133 A N T 3 S+ 0 0 55 1,-0.3 8,-2.1 2,-0.1 9,-0.2 0.842 124.6 20.0 -45.4 -43.2 57.5 29.3 -41.6 107 134 A F T > S+ 0 0 138 6,-0.2 3,-0.6 1,-0.1 -1,-0.3 -0.094 92.8 115.5-118.4 32.7 60.5 28.8 -44.0 108 135 A G T < S+ 0 0 25 -3,-2.5 -1,-0.1 1,-0.2 -2,-0.1 0.373 75.1 45.1 -84.9 5.0 62.4 26.3 -41.9 109 136 A M T 3 S- 0 0 2 1,-0.4 3,-0.3 3,-0.2 -1,-0.2 -0.131 116.2 -68.1-142.3 45.3 62.1 23.3 -44.2 110 137 A G S < S- 0 0 26 -3,-0.6 -1,-0.4 1,-0.2 124,-0.1 -0.649 78.9 -35.3 111.3-166.6 62.8 24.5 -47.8 111 138 A K S S+ 0 0 172 122,-0.3 2,-0.6 -2,-0.2 -1,-0.2 0.796 113.4 75.9 -68.8 -33.8 61.4 26.7 -50.5 112 139 A R S S- 0 0 77 -3,-0.3 -3,-0.2 122,-0.1 -1,-0.0 -0.745 80.4-139.1 -86.5 119.7 57.7 25.8 -49.7 113 140 A S > - 0 0 16 -2,-0.6 4,-1.0 1,-0.1 -6,-0.2 -0.245 16.7-120.9 -72.0 162.9 56.6 27.7 -46.6 114 141 A I H > S+ 0 0 4 -8,-2.1 4,-2.1 1,-0.2 3,-0.5 0.892 113.6 61.3 -70.6 -38.0 54.4 26.0 -43.9 115 142 A E H > S+ 0 0 28 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.873 100.0 53.5 -54.3 -42.1 51.8 28.8 -44.6 116 143 A D H > 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73.3-168.9-125.3 79.0 66.3 21.0 -51.4 233 260 A P - 0 0 31 0, 0.0 -122,-0.3 0, 0.0 3,-0.1 -0.467 2.8-172.6 -66.5 132.8 64.6 19.9 -48.1 234 261 A R - 0 0 72 -2,-0.2 2,-0.2 1,-0.2 -125,-0.1 0.789 57.8 -21.6 -95.1 -35.1 61.0 19.0 -48.7 235 262 A D S > S- 0 0 0 -80,-0.1 4,-2.0 -79,-0.1 -80,-0.2 -0.832 81.9 -62.9-157.2-168.4 59.7 18.5 -45.2 236 263 A F H > S+ 0 0 0 -82,-2.2 4,-2.0 -2,-0.2 -81,-0.2 0.859 125.0 52.9 -59.2 -41.9 60.4 17.7 -41.5 237 264 A I H > S+ 0 0 0 -82,-1.0 4,-2.5 2,-0.2 -1,-0.2 0.879 107.4 50.8 -65.1 -40.5 61.8 14.3 -42.2 238 265 A D H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.928 110.3 50.5 -62.4 -45.5 64.3 15.6 -44.8 239 266 A C H X S+ 0 0 16 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.879 111.8 46.7 -60.4 -40.5 65.5 18.1 -42.3 240 267 A F H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.914 111.7 51.5 -68.3 -43.2 66.0 15.5 -39.6 241 268 A L H X S+ 0 0 13 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.828 109.6 50.2 -61.9 -33.5 67.8 13.2 -42.0 242 269 A I H X S+ 0 0 28 -4,-2.1 4,-1.5 2,-0.2 3,-0.3 0.894 110.2 49.5 -71.3 -40.9 70.1 16.0 -43.0 243 270 A K H X S+ 0 0 62 -4,-1.9 4,-0.7 1,-0.2 -2,-0.2 0.835 105.9 58.2 -65.5 -34.3 70.9 16.8 -39.3 244 271 A M H < S+ 0 0 42 -4,-2.0 3,-0.3 1,-0.2 -1,-0.2 0.828 103.3 52.7 -64.6 -33.8 71.6 13.1 -38.8 245 272 A E H >< S+ 0 0 129 -4,-1.0 3,-1.5 -3,-0.3 4,-0.2 0.904 105.7 52.8 -68.7 -42.5 74.3 13.2 -41.5 246 273 A Q H 3< S+ 0 0 125 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.646 114.4 43.7 -67.8 -15.5 76.1 16.1 -39.8 247 274 A E T 3< S+ 0 0 54 -4,-0.7 3,-0.4 -3,-0.3 -1,-0.3 0.200 79.0 113.8-113.4 12.7 76.1 14.1 -36.6 248 275 A K S < S+ 0 0 148 -3,-1.5 -2,-0.1 1,-0.2 -1,-0.1 0.777 75.0 51.9 -54.3 -34.8 77.2 10.8 -38.2 249 276 A D S S+ 0 0 157 -4,-0.2 2,-0.5 -3,-0.2 -1,-0.2 0.856 95.0 76.5 -74.5 -37.7 80.6 10.8 -36.4 250 277 A N - 0 0 87 -3,-0.4 3,-0.5 1,-0.1 -3,-0.0 -0.651 59.5-168.4 -79.6 124.2 79.2 11.3 -32.9 251 278 A Q S S+ 0 0 184 -2,-0.5 -1,-0.1 1,-0.2 -3,-0.0 0.580 82.8 64.4 -88.3 -12.1 77.7 8.1 -31.4 252 279 A K S S+ 0 0 163 2,-0.0 2,-0.4 3,-0.0 -1,-0.2 -0.204 78.2 137.4-101.9 39.8 76.0 9.8 -28.5 253 280 A S - 0 0 16 -3,-0.5 -161,-0.0 -6,-0.1 -6,-0.0 -0.755 51.1-153.3 -94.2 132.2 73.8 11.8 -30.8 254 281 A E S S+ 0 0 21 -2,-0.4 2,-1.5 1,-0.1 5,-0.3 0.711 79.3 89.1 -71.5 -21.8 70.1 12.3 -30.1 255 282 A F + 0 0 13 -12,-0.1 2,-0.3 4,-0.1 -1,-0.1 -0.636 60.6 124.6 -84.8 89.3 69.5 12.6 -33.9 256 283 A N S > S- 0 0 52 -2,-1.5 4,-1.5 1,-0.0 3,-0.2 -0.840 77.7 -95.2-136.4 170.6 68.9 9.0 -34.9 257 284 A I H > S+ 0 0 64 -2,-0.3 4,-1.8 1,-0.2 5,-0.2 0.780 120.4 61.0 -62.3 -25.8 66.0 7.1 -36.6 258 285 A E H > S+ 0 0 92 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.940 108.3 39.5 -68.0 -48.3 64.6 6.2 -33.2 259 286 A N H > S+ 0 0 1 -5,-0.3 4,-1.9 -3,-0.2 -1,-0.2 0.725 111.4 60.7 -73.6 -22.2 64.0 9.8 -32.1 260 287 A L H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.924 105.9 44.8 -70.0 -46.0 62.8 10.8 -35.6 261 288 A V H X S+ 0 0 2 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.921 115.2 48.9 -63.3 -44.7 59.9 8.4 -35.6 262 289 A G H X S+ 0 0 12 -4,-1.6 4,-2.2 1,-0.2 -177,-0.3 0.858 110.9 49.8 -64.1 -37.7 59.0 9.4 -32.1 263 290 A T H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.889 110.6 49.0 -69.5 -40.5 59.1 13.1 -32.9 264 291 A V H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 3,-0.2 0.950 112.6 48.3 -63.3 -48.4 56.9 12.7 -36.0 265 292 A A H X S+ 0 0 23 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.911 109.5 54.2 -57.9 -43.0 54.4 10.7 -34.0 266 293 A D H X S+ 0 0 10 -4,-2.2 4,-3.1 1,-0.2 5,-0.3 0.856 104.2 53.8 -60.2 -37.8 54.5 13.4 -31.3 267 294 A L H X S+ 0 0 20 -4,-1.8 4,-1.9 -3,-0.2 -1,-0.2 0.908 111.7 45.9 -65.4 -39.5 53.7 16.2 -33.8 268 295 A F H X S+ 0 0 3 -4,-1.8 4,-1.8 2,-0.2 5,-0.4 0.916 115.5 46.6 -65.8 -45.3 50.6 14.2 -34.9 269 296 A V H < S+ 0 0 80 -4,-2.6 4,-0.4 1,-0.2 5,-0.3 0.942 121.4 34.8 -63.8 -50.4 49.6 13.5 -31.3 270 297 A A H < S+ 0 0 53 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.723 125.8 40.4 -79.1 -21.9 50.0 17.1 -30.1 271 298 A G H < S+ 0 0 15 -4,-1.9 4,-0.4 -5,-0.3 -2,-0.2 0.594 107.2 54.1-106.8 -10.3 48.9 18.8 -33.2 272 299 A T S X S+ 0 0 7 -4,-1.8 4,-2.3 -5,-0.1 5,-0.2 0.957 111.5 31.5 -87.4 -68.2 46.0 16.9 -34.6 273 300 A E H > S+ 0 0 26 -5,-0.4 4,-1.9 -4,-0.4 5,-0.1 0.766 116.9 56.3 -65.6 -27.3 43.3 16.6 -32.0 274 301 A T H > S+ 0 0 38 -5,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.934 112.8 39.3 -69.9 -46.6 44.0 19.8 -30.2 275 302 A T H > S+ 0 0 8 -4,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.909 114.9 55.0 -68.3 -43.0 43.6 22.0 -33.3 276 303 A S H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.909 108.9 47.4 -55.9 -45.7 40.6 19.9 -34.5 277 304 A T H X S+ 0 0 1 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.878 112.0 48.9 -64.8 -41.7 38.8 20.5 -31.2 278 305 A T H X S+ 0 0 5 -4,-1.7 4,-2.8 1,-0.2 -2,-0.2 0.889 110.4 52.1 -68.1 -36.9 39.5 24.2 -31.2 279 306 A L H X S+ 0 0 2 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.905 112.5 45.4 -62.5 -42.6 38.2 24.4 -34.8 280 307 A R H X S+ 0 0 20 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.913 115.0 46.7 -66.6 -46.0 35.0 22.6 -33.8 281 308 A Y H X S+ 0 0 5 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.909 110.7 54.1 -63.2 -41.5 34.5 24.7 -30.7 282 309 A G H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.938 109.2 46.0 -57.9 -50.7 35.2 27.8 -32.8 283 310 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.863 111.6 53.8 -62.1 -35.6 32.5 27.0 -35.3 284 311 A L H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.924 111.4 44.3 -63.2 -45.5 30.1 26.2 -32.5 285 312 A L H X S+ 0 0 0 -4,-2.5 4,-1.1 2,-0.2 -2,-0.2 0.795 114.5 49.4 -69.8 -28.9 30.7 29.6 -30.9 286 313 A L H < S+ 0 0 3 -4,-2.1 7,-0.4 -5,-0.2 -2,-0.2 0.854 110.8 50.4 -76.4 -34.8 30.5 31.3 -34.3 287 314 A L H < S+ 0 0 5 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.920 114.1 44.8 -64.4 -46.4 27.2 29.4 -34.9 288 315 A K H < S+ 0 0 55 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.694 114.3 51.1 -71.4 -24.9 25.9 30.5 -31.5 289 316 A H X + 0 0 37 -4,-1.1 4,-2.0 1,-0.1 3,-0.4 -0.728 60.1 168.8-120.6 81.6 27.0 34.1 -31.9 290 317 A P H > S+ 0 0 64 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.829 78.3 58.0 -59.2 -36.9 25.8 35.4 -35.4 291 318 A E H > S+ 0 0 99 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.880 108.0 46.3 -62.6 -39.6 26.7 39.0 -34.5 292 319 A V H > S+ 0 0 4 -3,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.918 111.9 50.4 -69.1 -45.1 30.3 38.0 -34.0 293 320 A T H X S+ 0 0 8 -4,-2.0 4,-2.5 -7,-0.4 -2,-0.2 0.898 108.0 54.6 -60.3 -41.0 30.4 35.9 -37.2 294 321 A A H X S+ 0 0 52 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.916 107.2 48.3 -59.1 -48.9 29.0 38.9 -39.2 295 322 A K H X S+ 0 0 106 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.858 111.7 51.3 -62.6 -36.0 31.7 41.3 -38.0 296 323 A V H X S+ 0 0 4 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.945 110.6 47.0 -65.5 -48.8 34.4 38.8 -38.9 297 324 A Q H X S+ 0 0 39 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.763 111.9 52.7 -63.0 -27.1 33.0 38.2 -42.4 298 325 A E H X S+ 0 0 131 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.898 109.1 47.7 -74.1 -43.7 32.8 42.0 -42.8 299 326 A E H X S+ 0 0 23 -4,-2.3 4,-2.6 1,-0.2 5,-0.4 0.902 111.8 51.6 -63.8 -39.6 36.4 42.4 -41.8 300 327 A I H X>S+ 0 0 3 -4,-2.6 4,-2.6 1,-0.2 5,-2.1 0.931 108.7 50.5 -62.2 -45.4 37.3 39.6 -44.3 301 328 A D H <5S+ 0 0 69 -4,-2.0 -2,-0.2 3,-0.2 -1,-0.2 0.915 114.4 44.9 -58.7 -43.2 35.4 41.4 -47.1 302 329 A H H <5S+ 0 0 153 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.916 125.1 27.8 -67.6 -49.4 37.2 44.6 -46.4 303 330 A V H <5S+ 0 0 33 -4,-2.6 -3,-0.2 -5,-0.1 -2,-0.2 0.841 137.6 19.2 -86.4 -36.0 40.8 43.3 -46.0 304 331 A I T <5S- 0 0 14 -4,-2.6 4,-0.3 -5,-0.4 3,-0.3 0.803 86.1-161.8-106.5 -38.5 40.8 40.2 -48.2 305 332 A G < - 0 0 21 -5,-2.1 -1,-0.1 1,-0.2 -3,-0.1 -0.468 38.5 -70.0 88.5-160.2 37.8 40.4 -50.6 306 333 A R S S+ 0 0 181 -2,-0.1 -1,-0.2 -5,-0.1 -5,-0.1 0.508 119.9 54.6-115.1 -9.8 36.1 37.6 -52.5 307 334 A H S S+ 0 0 189 -3,-0.3 2,-0.4 1,-0.1 -2,-0.1 0.429 98.5 66.0-106.6 1.1 38.7 36.7 -55.2 308 335 A R S S- 0 0 119 -4,-0.3 -1,-0.1 0, 0.0 -4,-0.0 -0.977 76.9-123.5-129.9 138.4 41.7 36.0 -52.9 309 336 A S - 0 0 66 -2,-0.4 -190,-0.0 1,-0.1 -3,-0.0 -0.498 42.2-105.0 -72.3 139.4 42.4 33.3 -50.3 310 337 A P - 0 0 1 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.198 39.2-171.5 -65.4 161.3 43.3 34.7 -46.9 311 338 A C > - 0 0 26 108,-0.0 3,-1.0 1,-0.0 4,-0.5 -0.927 39.2 -97.6-146.5 167.7 46.9 34.7 -45.6 312 339 A M G > S+ 0 0 29 -2,-0.3 3,-0.7 1,-0.3 4,-0.5 0.722 115.4 67.2 -63.2 -24.9 48.7 35.5 -42.4 313 340 A Q G > S+ 0 0 150 1,-0.2 3,-1.1 2,-0.2 4,-0.4 0.865 94.0 61.1 -63.2 -34.8 49.7 39.0 -43.5 314 341 A D G X S+ 0 0 7 -3,-1.0 3,-1.5 1,-0.2 4,-0.2 0.764 87.3 72.7 -61.9 -29.2 46.0 39.9 -43.3 315 342 A R G X S+ 0 0 52 -3,-0.7 3,-1.1 -4,-0.5 -1,-0.2 0.797 88.3 61.4 -58.5 -31.7 45.8 39.1 -39.6 316 343 A S G < S+ 0 0 101 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.763 109.8 41.8 -67.1 -23.7 47.7 42.3 -38.8 317 344 A H G < S+ 0 0 114 -3,-1.5 -1,-0.2 -4,-0.4 -2,-0.2 0.306 104.4 70.7-105.4 7.8 44.9 44.3 -40.4 318 345 A M <> + 0 0 0 -3,-1.1 4,-2.1 -4,-0.2 5,-0.2 -0.570 50.5 159.6-124.5 68.1 42.1 42.2 -38.9 319 346 A P H > S+ 0 0 31 0, 0.0 4,-2.2 0, 0.0 -1,-0.1 0.816 75.2 53.0 -58.5 -35.4 42.0 43.1 -35.1 320 347 A Y H > S+ 0 0 34 2,-0.2 4,-2.1 1,-0.2 -24,-0.1 0.928 110.5 45.6 -68.0 -45.8 38.5 41.9 -34.6 321 348 A T H > S+ 0 0 3 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.881 112.8 51.7 -63.9 -38.4 39.1 38.4 -36.1 322 349 A D H X S+ 0 0 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