==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 18-JUN-07 2QBM . COMPND 2 MOLECULE: CYTOCHROME P450-CAM; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR K.VON KOENIG,T.M.MAKRIS,S.D.SLIGAR,I.SCHLICHTING . 405 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17086.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 270 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 7.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 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 . 14 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 154 38.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 1 0 4 0 0 2 0 2 2 0 0 1 1 0 1 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 PARALLEL BRIDGES PER LADDER . 1 4 3 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 ANTIPARALLEL BRIDGES PER LADDER . 3 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 10 A N 0 0 193 0, 0.0 2,-0.5 0, 0.0 49,-0.4 0.000 360.0 360.0 360.0-162.0 31.0 45.3 9.8 2 11 A L - 0 0 71 47,-0.1 47,-0.2 48,-0.1 3,-0.1 -0.867 360.0-129.7 -97.9 127.4 27.9 47.0 8.6 3 12 A A - 0 0 25 45,-2.8 49,-0.0 -2,-0.5 46,-0.0 -0.463 40.3 -89.5 -68.4 142.6 27.1 47.0 4.9 4 13 A P - 0 0 122 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.303 49.3-103.6 -56.6 137.2 26.3 50.4 3.4 5 14 A L - 0 0 52 -3,-0.1 6,-0.1 1,-0.1 43,-0.0 -0.468 36.5-123.0 -65.2 120.6 22.6 51.2 3.6 6 15 A P > - 0 0 36 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.360 21.8-113.3 -65.2 147.9 20.9 50.7 0.2 7 16 A P T 3 S+ 0 0 138 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.759 111.4 56.9 -48.7 -36.8 19.0 53.8 -1.2 8 17 A H T 3 S+ 0 0 44 2,-0.1 294,-0.2 1,-0.0 -3,-0.0 0.592 89.3 88.8 -78.4 -8.2 15.5 52.3 -1.1 9 18 A V S < S- 0 0 7 -3,-1.8 2,-0.1 292,-0.1 5,-0.1 -0.829 75.8-133.9 -97.6 120.0 15.8 51.5 2.7 10 19 A P > - 0 0 50 0, 0.0 3,-1.6 0, 0.0 4,-0.3 -0.370 14.5-127.7 -68.4 142.8 14.6 54.3 5.0 11 20 A E G > S+ 0 0 167 1,-0.3 3,-1.1 2,-0.2 35,-0.1 0.759 105.9 66.0 -64.5 -25.5 16.9 55.1 8.0 12 21 A H G 3 S+ 0 0 144 1,-0.2 -1,-0.3 33,-0.0 -3,-0.0 0.583 98.6 53.9 -73.5 -9.4 14.1 54.8 10.5 13 22 A L G < S+ 0 0 12 -3,-1.6 33,-2.6 28,-0.1 2,-0.3 0.419 80.6 113.8-102.1 -4.8 13.8 51.0 9.6 14 23 A V B < +a 46 0A 32 -3,-1.1 2,-0.3 -4,-0.3 33,-0.2 -0.555 29.4 161.6 -75.7 129.3 17.4 50.1 10.3 15 24 A F - 0 0 58 31,-2.9 2,-2.5 -2,-0.3 30,-0.1 -0.855 33.1-142.3-147.2 106.0 18.1 47.8 13.3 16 25 A D + 0 0 62 -2,-0.3 2,-0.4 31,-0.2 31,-0.1 -0.324 34.1 165.5 -81.5 62.6 21.5 46.2 13.1 17 26 A F - 0 0 9 -2,-2.5 2,-0.8 32,-0.1 32,-0.2 -0.625 26.2-150.3 -73.5 129.4 20.7 42.7 14.4 18 27 A D > - 0 0 46 -2,-0.4 3,-1.6 3,-0.2 -2,-0.0 -0.867 5.2-164.4-104.5 102.8 23.4 40.1 13.8 19 28 A M T 3 S+ 0 0 0 -2,-0.8 -1,-0.1 1,-0.3 14,-0.0 0.671 89.4 50.4 -61.1 -17.7 21.8 36.6 13.5 20 29 A Y T 3 S+ 0 0 47 1,-0.2 364,-0.4 365,-0.0 -1,-0.3 0.538 131.4 11.7 -96.2 -7.7 25.1 34.9 14.0 21 30 A N S < S- 0 0 107 -3,-1.6 -1,-0.2 362,-0.1 -2,-0.2 -0.319 79.5-166.1-166.0 68.9 26.1 36.8 17.1 22 31 A P > - 0 0 2 0, 0.0 3,-1.6 0, 0.0 11,-0.1 -0.336 27.2-122.3 -68.7 145.2 23.1 38.7 18.5 23 32 A S T 3 S+ 0 0 126 1,-0.3 3,-0.4 9,-0.1 9,-0.1 0.804 108.1 49.2 -64.7 -29.6 24.1 41.3 21.2 24 33 A N T > S+ 0 0 58 8,-0.2 3,-1.8 1,-0.2 -1,-0.3 0.109 72.3 124.9 -96.7 24.9 21.9 39.9 24.0 25 34 A L G X + 0 0 35 -3,-1.6 3,-1.9 1,-0.3 357,-0.3 0.784 61.9 66.9 -57.1 -33.3 23.1 36.3 23.5 26 35 A S G 3 S+ 0 0 107 -3,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.789 94.7 58.5 -60.1 -26.2 24.2 35.9 27.2 27 36 A A G < S- 0 0 49 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.526 131.2 -75.7 -81.0 -4.2 20.5 36.2 28.3 28 37 A G <> - 0 0 9 -3,-1.9 4,-2.3 -4,-0.2 -1,-0.3 -0.114 42.1 -97.2 115.9 145.2 19.7 33.1 26.1 29 38 A V H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.920 122.3 48.3 -64.0 -44.4 19.3 32.8 22.3 30 39 A Q H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.915 113.3 49.7 -60.1 -44.2 15.5 33.1 22.2 31 40 A E H > S+ 0 0 59 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.892 108.5 53.4 -60.1 -40.2 15.7 36.2 24.5 32 41 A A H >< S+ 0 0 0 -4,-2.3 3,-0.9 1,-0.2 -2,-0.2 0.920 112.0 43.4 -63.3 -43.2 18.4 37.7 22.2 33 42 A W H >< S+ 0 0 0 -4,-2.5 3,-2.2 1,-0.2 -1,-0.2 0.858 102.9 68.7 -67.8 -33.4 16.1 37.3 19.2 34 43 A A H >< S+ 0 0 21 -4,-2.3 3,-2.3 1,-0.3 -1,-0.2 0.654 76.2 82.1 -65.5 -11.0 13.2 38.6 21.1 35 44 A V G X< S+ 0 0 17 -3,-0.9 3,-1.5 -4,-0.5 -1,-0.3 0.827 80.9 67.7 -60.7 -25.2 14.8 42.0 21.3 36 45 A L G < S+ 0 0 0 -3,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.561 96.5 54.1 -66.6 -9.6 13.3 42.4 17.8 37 46 A Q G < S+ 0 0 18 -3,-2.3 -1,-0.3 -4,-0.1 -2,-0.2 0.111 78.7 125.9-113.9 17.2 9.9 42.4 19.5 38 47 A E S X S- 0 0 101 -3,-1.5 3,-2.2 1,-0.1 -3,-0.0 -0.393 77.7-101.2 -74.0 158.5 10.5 45.3 21.9 39 48 A S T 3 S+ 0 0 131 1,-0.3 -1,-0.1 -2,-0.1 -3,-0.0 0.729 119.2 54.4 -58.1 -26.0 8.0 48.2 21.9 40 49 A N T 3 S+ 0 0 115 2,-0.0 -1,-0.3 0, 0.0 -4,-0.0 0.575 89.9 94.0 -81.7 -8.1 10.4 50.5 19.9 41 50 A V S < S- 0 0 10 -3,-2.2 4,-0.1 -6,-0.1 -28,-0.1 -0.742 70.1-129.7-102.0 126.0 10.9 48.0 16.9 42 51 A P - 0 0 48 0, 0.0 3,-0.1 0, 0.0 -4,-0.1 -0.169 27.7-108.2 -64.6 163.7 8.9 48.0 13.7 43 52 A D S S+ 0 0 48 1,-0.2 14,-3.2 256,-0.1 15,-0.5 0.748 110.1 30.1 -61.1 -28.3 7.2 44.8 12.3 44 53 A L E S+ B 0 56A 4 12,-0.2 2,-0.3 13,-0.1 12,-0.2 -0.987 76.9 172.5-140.9 118.8 9.8 44.8 9.5 45 54 A V E - B 0 55A 0 10,-2.2 10,-2.4 -2,-0.4 2,-0.4 -0.802 26.4-128.5-125.4 165.0 13.4 46.2 9.9 46 55 A W E -aB 14 54A 10 -33,-2.6 -31,-2.9 -2,-0.3 2,-0.4 -0.978 18.2-160.2-114.4 128.5 16.6 46.2 7.8 47 56 A T E - B 0 53A 0 6,-2.8 6,-2.0 -2,-0.4 -31,-0.2 -0.914 14.4-154.5-105.4 137.7 19.9 45.1 9.4 48 57 A R > + 0 0 85 -2,-0.4 -45,-2.8 4,-0.2 3,-0.6 0.525 66.7 106.5 -83.6 -4.4 23.2 46.1 7.9 49 58 A C G > S+ 0 0 14 -32,-0.2 3,-1.9 1,-0.2 -2,-0.1 -0.374 77.2 16.1 -69.9 154.9 24.8 43.0 9.4 50 59 A N G 3 S- 0 0 46 -49,-0.4 31,-0.4 1,-0.3 -1,-0.2 0.791 141.5 -45.1 55.5 37.3 25.8 40.0 7.3 51 60 A G G < S- 0 0 62 -3,-0.6 -1,-0.3 -50,-0.3 -2,-0.1 0.157 105.9 -74.5 94.4 -16.5 25.7 41.8 3.9 52 61 A G < + 0 0 4 -3,-1.9 256,-0.3 1,-0.1 2,-0.3 0.414 64.5 161.1 96.7 128.0 22.3 43.6 4.7 53 62 A H E -B 47 0A 0 -6,-2.0 -6,-2.8 254,-0.1 256,-0.2 -0.981 36.8 -97.0-170.4 157.1 18.8 42.1 4.7 54 63 A W E -Bc 46 309A 0 254,-2.7 256,-2.7 -2,-0.3 2,-0.3 -0.421 28.3-158.2 -77.1 157.3 15.3 42.5 5.9 55 64 A I E -Bc 45 310A 0 -10,-2.4 -10,-2.2 254,-0.2 2,-0.5 -0.948 8.9-148.5-137.2 123.6 13.9 40.8 9.1 56 65 A A E -B 44 0A 0 254,-2.2 -12,-0.2 -2,-0.3 259,-0.1 -0.775 14.9-172.7 -83.2 131.0 10.2 40.2 9.7 57 66 A T + 0 0 0 -14,-3.2 2,-0.3 -2,-0.5 -13,-0.1 0.475 55.6 64.5-109.0 -2.1 9.8 40.4 13.5 58 67 A R S > S- 0 0 12 -15,-0.5 4,-2.1 1,-0.1 3,-0.4 -0.939 77.2-123.9-131.6 145.6 6.1 39.3 14.0 59 68 A G H > S+ 0 0 0 -2,-0.3 4,-2.7 256,-0.3 5,-0.3 0.815 106.8 60.2 -61.5 -33.2 4.3 36.1 13.4 60 69 A Q H > S+ 0 0 108 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.948 111.5 38.3 -61.8 -46.6 1.6 37.6 11.1 61 70 A L H > S+ 0 0 0 -3,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.843 114.9 54.6 -70.7 -36.0 4.2 38.9 8.5 62 71 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.953 112.4 43.3 -62.2 -49.2 6.3 35.7 8.9 63 72 A R H X S+ 0 0 55 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.949 113.9 50.6 -59.0 -51.1 3.3 33.5 8.1 64 73 A E H X S+ 0 0 65 -4,-2.3 4,-1.8 -5,-0.3 -2,-0.2 0.902 111.5 48.4 -55.3 -42.5 2.2 35.8 5.2 65 74 A A H < S+ 0 0 1 -4,-2.4 7,-0.2 1,-0.2 -1,-0.2 0.906 109.9 50.5 -69.1 -40.6 5.6 35.7 3.7 66 75 A Y H < S+ 0 0 7 -4,-2.3 279,-0.5 1,-0.2 -1,-0.2 0.773 110.9 51.0 -65.6 -30.2 6.0 31.9 3.9 67 76 A E H < S+ 0 0 110 -4,-1.9 2,-1.6 1,-0.2 -1,-0.2 0.850 99.3 68.7 -70.2 -39.9 2.5 31.6 2.2 68 77 A D X + 0 0 41 -4,-1.8 4,-2.6 -5,-0.2 3,-0.4 -0.530 52.6 159.6 -89.0 75.8 3.4 33.9 -0.7 69 78 A Y T 4 + 0 0 66 -2,-1.6 -1,-0.2 1,-0.2 5,-0.1 0.672 68.1 69.8 -68.1 -17.2 6.1 31.9 -2.6 70 79 A R T 4 S+ 0 0 179 -3,-0.2 -1,-0.2 1,-0.1 3,-0.2 0.933 115.6 21.9 -64.6 -46.9 5.4 34.0 -5.7 71 80 A H T 4 S+ 0 0 50 -3,-0.4 222,-2.0 1,-0.2 2,-0.7 0.786 126.9 51.6 -89.2 -34.3 7.0 37.1 -4.1 72 81 A F E < S-D 292 0A 0 -4,-2.6 220,-0.2 -7,-0.2 -1,-0.2 -0.829 79.9-164.4-111.7 95.8 9.2 35.4 -1.5 73 82 A S E > -D 291 0A 5 218,-2.9 218,-2.0 -2,-0.7 3,-0.5 -0.488 25.8-147.0 -89.0 143.9 11.2 32.7 -3.2 74 83 A S T 3 S+ 0 0 1 216,-0.2 -1,-0.1 1,-0.2 215,-0.1 0.338 77.3 100.4 -81.3 5.2 13.1 29.8 -1.6 75 84 A E T 3 S+ 0 0 139 1,-0.3 -1,-0.2 216,-0.2 215,-0.1 0.845 97.3 23.7 -60.7 -32.5 15.8 30.0 -4.4 76 85 A C S < S+ 0 0 4 -3,-0.5 -1,-0.3 1,-0.1 9,-0.2 -0.775 78.2 156.5-135.3 78.6 18.2 31.9 -2.0 77 86 A P + 0 0 3 0, 0.0 212,-1.8 0, 0.0 2,-0.3 0.469 47.8 71.3 -93.1 -6.7 17.0 30.9 1.5 78 87 A F S S- 0 0 14 210,-0.2 6,-0.6 3,-0.1 7,-0.1 -0.874 76.5-110.0-111.6 147.9 20.1 31.5 3.7 79 88 A I S S+ 0 0 4 -2,-0.3 2,-0.1 4,-0.1 307,-0.1 -0.904 90.7 58.0-104.0 139.7 21.9 34.7 4.8 80 89 A P S >> S- 0 0 27 0, 0.0 4,-2.1 0, 0.0 3,-1.1 0.546 88.3-124.4 -75.0 169.0 24.6 35.7 3.9 81 90 A R H 3> S+ 0 0 82 -31,-0.4 4,-2.9 1,-0.3 5,-0.2 0.800 109.0 56.3 -50.2 -44.2 23.9 36.0 0.1 82 91 A E H 3> S+ 0 0 134 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.845 109.8 46.9 -60.7 -36.5 26.9 33.8 -0.9 83 92 A A H <> S+ 0 0 5 -3,-1.1 4,-1.3 2,-0.2 -2,-0.2 0.924 113.8 47.2 -64.7 -49.8 25.4 31.0 1.4 84 93 A G H < S+ 0 0 0 -4,-2.1 -2,-0.2 -6,-0.6 -3,-0.2 0.858 113.2 49.6 -61.6 -38.7 21.9 31.4 -0.1 85 94 A E H < S+ 0 0 133 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.932 113.4 44.4 -65.8 -45.8 23.3 31.5 -3.6 86 95 A A H < S+ 0 0 20 -4,-1.9 2,-0.3 -5,-0.2 -1,-0.2 0.712 90.7 105.6 -65.4 -23.0 25.4 28.3 -3.1 87 96 A Y < + 0 0 15 -4,-1.3 -9,-0.1 1,-0.1 98,-0.0 -0.461 32.1 150.0 -70.4 118.0 22.4 26.6 -1.4 88 97 A D + 0 0 35 -2,-0.3 -1,-0.1 143,-0.1 147,-0.1 0.156 15.7 144.1-137.8 20.8 20.8 24.1 -3.7 89 98 A F > - 0 0 2 145,-0.1 4,-2.5 143,-0.1 143,-0.3 -0.245 51.1 -92.7 -64.0 151.4 19.3 21.4 -1.5 90 99 A I T 4 S+ 0 0 1 141,-1.4 145,-0.2 1,-0.2 -1,-0.1 -0.968 97.4 1.9-116.6 136.1 16.1 19.7 -2.6 91 100 A P T >4 S+ 0 0 5 0, 0.0 3,-2.0 0, 0.0 -1,-0.2 -0.992 124.5 63.7 -87.1 0.4 13.3 20.4 -2.0 92 101 A T T 34 S+ 0 0 28 1,-0.3 -2,-0.2 140,-0.1 -3,-0.1 0.740 100.0 51.4 -67.7 -27.2 14.2 23.4 0.1 93 102 A S T 3< S+ 0 0 15 -4,-2.5 2,-0.3 -18,-0.1 -1,-0.3 0.436 101.1 83.2 -87.0 4.4 15.8 25.5 -2.6 94 103 A M < - 0 0 12 -3,-2.0 -6,-0.0 -5,-0.1 -5,-0.0 -0.802 64.2-148.1-109.0 150.0 12.8 25.1 -4.8 95 104 A D > - 0 0 35 -2,-0.3 4,-1.8 1,-0.1 3,-0.3 -0.741 42.3 -61.9-100.1 156.9 9.4 26.9 -5.0 96 105 A P T 4 S+ 0 0 7 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.450 113.2 40.4 -59.6 152.1 6.1 25.4 -6.0 97 106 A P T >4 S+ 0 0 117 0, 0.0 3,-1.1 0, 0.0 4,-0.5 -0.939 127.4 35.6 -75.1 -28.3 5.1 24.1 -8.6 98 107 A E T 3> S+ 0 0 109 -3,-0.3 4,-0.6 1,-0.2 3,-0.4 0.792 110.8 63.0 -59.5 -31.3 8.5 22.3 -9.1 99 108 A Q H >X S+ 0 0 0 -4,-1.8 4,-1.5 1,-0.2 3,-0.9 0.843 87.9 70.4 -58.5 -37.6 9.1 21.6 -5.4 100 109 A R H <> S+ 0 0 130 -3,-1.1 4,-1.5 1,-0.3 -1,-0.2 0.848 88.9 57.4 -62.3 -42.9 6.1 19.4 -4.7 101 110 A Q H 3> S+ 0 0 45 -4,-0.5 4,-1.0 -3,-0.4 119,-0.4 0.861 108.6 49.5 -55.9 -36.3 7.1 16.3 -6.7 102 111 A F H X S+ 0 0 3 -4,-1.0 3,-1.1 2,-0.2 4,-0.6 0.957 112.9 47.4 -65.1 -48.9 9.7 11.3 -2.4 106 115 A A H >X S+ 0 0 3 -4,-2.5 4,-1.8 1,-0.3 3,-1.6 0.895 107.0 58.8 -58.9 -41.0 11.4 12.8 0.7 107 116 A N H 3X S+ 0 0 59 -4,-3.0 4,-1.9 1,-0.3 7,-0.3 0.769 95.6 64.5 -57.2 -27.4 8.2 12.0 2.7 108 117 A Q H << S+ 0 0 105 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.744 110.8 35.8 -67.7 -26.9 8.7 8.4 1.8 109 118 A V H << S+ 0 0 1 -3,-1.6 -2,-0.2 -4,-0.6 -1,-0.2 0.763 133.5 20.3-100.0 -26.6 12.0 8.3 3.7 110 119 A V H < S+ 0 0 12 -4,-1.8 243,-0.4 100,-0.1 -3,-0.2 0.414 98.4 105.1-122.9 -1.2 11.3 10.5 6.8 111 120 A G S >X S- 0 0 0 -4,-1.9 4,-1.5 -5,-0.3 3,-0.9 0.053 88.4 -74.7 -79.1-174.3 7.5 10.7 7.0 112 121 A M H 3> S+ 0 0 87 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.832 125.5 56.8 -53.0 -41.7 4.9 9.1 9.4 113 122 A P H 3> S+ 0 0 76 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.865 108.5 47.9 -64.7 -32.2 5.1 5.6 7.9 114 123 A V H <> S+ 0 0 8 -3,-0.9 4,-1.6 -7,-0.3 -2,-0.2 0.788 103.4 60.4 -75.0 -28.6 8.9 5.5 8.5 115 124 A V H X S+ 0 0 2 -4,-1.5 4,-1.1 2,-0.2 -1,-0.2 0.897 106.5 49.5 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18.1 3.5 21.9 126 135 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 -5,-0.2 5,-0.2 0.973 114.0 45.8 -56.5 -50.2 16.6 6.2 24.2 127 136 A C H X S+ 0 0 23 -4,-2.4 4,-2.6 -5,-0.2 5,-0.2 0.913 113.9 47.6 -61.6 -44.5 16.2 3.7 27.1 128 137 A S H X S+ 0 0 63 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.915 112.1 48.7 -68.6 -40.6 19.7 2.2 26.6 129 138 A L H X S+ 0 0 20 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.949 115.2 45.1 -56.7 -48.3 21.5 5.6 26.5 130 139 A I H X S+ 0 0 0 -4,-2.4 4,-3.1 -5,-0.3 -2,-0.2 0.901 110.7 52.0 -68.5 -43.4 19.6 6.8 29.6 131 140 A E H < S+ 0 0 65 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.869 108.1 53.6 -59.3 -38.8 20.2 3.6 31.6 132 141 A S H < S+ 0 0 88 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.882 116.6 37.9 -63.2 -39.7 23.9 3.9 30.8 133 142 A L H >X S+ 0 0 12 -4,-1.7 3,-2.5 -5,-0.1 4,-0.6 0.875 97.0 83.6 -74.7 -39.9 24.0 7.4 32.2 134 143 A R G >< S+ 0 0 43 -4,-3.1 3,-0.8 1,-0.3 -2,-0.1 0.740 90.5 46.0 -41.1 -50.2 21.6 6.9 35.1 135 144 A P G 34 S+ 0 0 70 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.687 99.1 73.5 -70.9 -14.8 24.1 5.5 37.7 136 145 A Q G <4 S- 0 0 112 -3,-2.5 -2,-0.2 -4,-0.2 -3,-0.1 0.792 86.9-143.5 -68.2 -32.8 26.7 8.2 36.9 137 146 A G S << S+ 0 0 8 -3,-0.8 260,-2.5 -4,-0.6 2,-0.3 0.545 75.4 46.1 76.0 8.0 24.9 11.1 38.6 138 147 A Q E +F 396 0B 123 -5,-0.4 2,-0.3 258,-0.3 258,-0.2 -0.960 57.8 172.8-169.2 155.6 26.1 13.4 35.9 139 148 A C E -F 395 0B 7 256,-1.5 256,-2.4 -2,-0.3 2,-0.8 -0.970 41.2-115.3-157.5 166.0 26.5 13.8 32.2 140 149 A N E > -F 394 0B 81 -2,-0.3 4,-2.9 254,-0.2 5,-0.3 -0.920 38.1-161.3 -99.2 96.0 27.4 16.2 29.5 141 150 A F H >>S+ 0 0 0 252,-2.6 5,-2.8 -2,-0.8 4,-1.5 0.795 80.0 53.9 -55.5 -39.2 23.9 16.2 27.9 142 151 A T H 4>S+ 0 0 13 3,-0.2 5,-1.9 1,-0.2 -1,-0.2 0.949 121.7 28.9 -64.0 -49.2 24.9 17.6 24.5 143 152 A E H 45S+ 0 0 120 -3,-0.2 -2,-0.2 3,-0.2 -1,-0.2 0.795 122.8 48.7 -80.1 -28.0 27.5 15.0 23.8 144 153 A D H <5S- 0 0 44 -4,-2.9 -3,-0.2 3,-0.1 -2,-0.2 0.613 135.5 -10.2 -92.5 -15.0 26.1 12.1 25.8 145 154 A Y T X5S+ 0 0 0 -4,-1.5 4,-2.5 -5,-0.3 -3,-0.2 0.440 121.9 63.7-145.5 -54.8 22.5 12.1 24.6 146 155 A A T 4 S+ 0 0 13 0, 0.0 4,-2.4 0, 0.0 5,-0.3 0.788 107.6 59.6 -60.5 -36.5 24.0 10.3 19.8 149 158 A F H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 5,-0.2 0.985 117.7 23.7 -59.1 -68.2 20.2 9.7 20.2 150 159 A P H > S+ 0 0 4 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.859 124.3 54.4 -68.1 -34.1 18.8 11.4 17.0 151 160 A I H X S+ 0 0 2 -4,-2.0 4,-3.0 -5,-0.2 5,-0.2 0.940 108.4 46.5 -68.7 -43.8 22.1 11.1 15.0 152 161 A R H X S+ 0 0 87 -4,-2.4 4,-1.9 -5,-0.3 -1,-0.2 0.858 112.9 51.1 -65.7 -33.3 22.4 7.3 15.5 153 162 A I H X S+ 0 0 8 -4,-1.7 4,-2.5 -5,-0.3 -1,-0.2 0.935 112.4 46.7 -63.8 -46.6 18.8 6.9 14.6 154 163 A F H X S+ 0 0 14 -4,-2.5 4,-2.5 86,-0.2 -2,-0.2 0.911 111.0 50.3 -61.6 -45.6 19.4 9.0 11.5 155 164 A M H X>S+ 0 0 1 -4,-3.0 5,-2.6 2,-0.2 4,-0.6 0.876 111.4 49.8 -65.2 -34.2 22.6 7.1 10.5 156 165 A L H ><5S+ 0 0 83 -4,-1.9 3,-1.0 3,-0.2 -2,-0.2 0.953 111.7 47.7 -62.4 -52.4 20.7 3.8 10.9 157 166 A L H 3<5S+ 0 0 17 -4,-2.5 53,-2.8 1,-0.3 -2,-0.2 0.850 118.1 41.6 -55.8 -39.1 17.9 5.1 8.7 158 167 A A H 3<5S- 0 0 0 -4,-2.5 53,-0.4 51,-0.2 -1,-0.3 0.484 107.8-126.3 -89.2 -4.8 20.4 6.3 6.1 159 168 A G T <<5 + 0 0 32 -3,-1.0 -3,-0.2 -4,-0.6 -4,-0.1 0.906 60.4 141.9 56.9 46.7 22.7 3.2 6.4 160 169 A L < - 0 0 11 -5,-2.6 -1,-0.2 -6,-0.1 -2,-0.1 -0.916 56.5-101.5-116.8 143.8 25.8 5.2 7.1 161 170 A P > - 0 0 61 0, 0.0 3,-2.0 0, 0.0 4,-0.2 -0.380 20.2-130.8 -68.7 141.6 28.5 4.1 9.6 162 171 A E G > S+ 0 0 93 1,-0.3 3,-1.5 2,-0.2 -7,-0.0 0.761 103.9 69.2 -65.8 -24.4 28.6 5.8 13.0 163 172 A E G 3 S+ 0 0 170 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.652 90.9 63.2 -65.4 -14.8 32.3 6.5 12.7 164 173 A D G <> S+ 0 0 38 -3,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.535 79.1 90.8 -82.5 -9.3 31.4 9.1 9.9 165 174 A I H <> S+ 0 0 30 -3,-1.5 4,-3.2 1,-0.2 5,-0.3 0.926 79.5 53.3 -57.7 -50.6 29.4 11.2 12.5 166 175 A P H > S+ 0 0 94 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.911 114.1 43.2 -55.6 -40.5 32.3 13.6 13.6 167 176 A H H > S+ 0 0 98 -4,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.970 117.6 44.2 -66.3 -51.6 33.1 14.6 10.0 168 177 A L H X S+ 0 0 1 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.881 113.2 51.3 -63.3 -39.8 29.4 15.0 8.9 169 178 A K H X S+ 0 0 16 -4,-3.2 4,-2.4 -5,-0.2 -1,-0.2 0.880 108.7 51.9 -65.3 -41.7 28.5 16.9 12.1 170 179 A Y H X S+ 0 0 75 -4,-2.0 4,-1.5 -5,-0.3 -2,-0.2 0.964 112.2 45.9 -54.8 -51.7 31.4 19.3 11.5 171 180 A L H X S+ 0 0 0 -4,-2.4 4,-1.0 1,-0.2 3,-0.3 0.919 112.4 50.3 -60.2 -44.9 30.3 19.9 8.0 172 181 A T H >X S+ 0 0 0 -4,-2.6 4,-1.0 1,-0.2 3,-0.9 0.920 107.3 54.0 -60.3 -44.8 26.6 20.4 9.0 173 182 A D H 3X S+ 0 0 34 -4,-2.4 4,-3.0 1,-0.2 3,-0.4 0.828 102.3 58.7 -59.7 -31.7 27.6 22.9 11.7 174 183 A Q H 3< S+ 0 0 9 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.791 104.4 52.0 -73.0 -22.0 29.5 25.0 9.2 175 184 A M H << S+ 0 0 5 -4,-1.0 -1,-0.2 -3,-0.9 -2,-0.2 0.743 124.5 23.4 -80.4 -25.9 26.3 25.4 7.2 176 185 A T H < S+ 0 0 2 -4,-1.0 210,-2.1 -3,-0.4 211,-0.5 0.728 140.5 15.6-111.6 -36.3 24.1 26.6 10.1 177 186 A R S < S- 0 0 24 -4,-3.0 -2,-0.1 -5,-0.2 -1,-0.1 -0.504 81.2-163.0-137.7 64.2 26.6 28.1 12.7 178 187 A P - 0 0 58 0, 0.0 -4,-0.1 0, 0.0 5,-0.1 -0.195 16.8-160.1 -62.1 141.6 29.9 28.6 10.9 179 188 A D - 0 0 107 3,-0.1 -5,-0.1 0, 0.0 -6,-0.0 0.375 53.1-102.1 -94.3 -2.2 33.1 29.1 13.0 180 189 A G S S+ 0 0 69 2,-0.4 3,-0.1 -6,-0.1 -6,-0.0 0.211 99.8 104.1 102.7 -11.6 34.8 30.7 10.0 181 190 A S S S+ 0 0 70 1,-0.2 2,-0.4 2,-0.0 -7,-0.0 0.793 88.7 26.1 -72.1 -27.9 37.0 27.7 8.9 182 191 A M S S- 0 0 47 -8,-0.1 -2,-0.4 -11,-0.0 -1,-0.2 -0.998 73.4-131.4-135.5 139.2 34.7 27.0 5.9 183 192 A T > - 0 0 77 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.398 39.5-105.3 -70.5 161.7 32.3 29.0 3.8 184 193 A F H > S+ 0 0 15 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.945 123.8 53.6 -50.7 -47.3 28.8 27.5 3.2 185 194 A A H > S+ 0 0 44 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.844 107.9 48.6 -60.1 -38.0 29.9 26.5 -0.3 186 195 A E H > S+ 0 0 91 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.916 113.0 47.2 -67.8 -43.2 33.1 24.7 0.9 187 196 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.913 112.8 50.2 -64.5 -39.9 31.0 22.8 3.5 188 197 A K H X S+ 0 0 37 -4,-2.8 4,-2.7 -5,-0.2 -2,-0.2 0.929 110.1 49.6 -62.2 -45.9 28.4 21.9 0.8 189 198 A E H X S+ 0 0 135 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.861 111.0 49.7 -63.4 -36.6 31.1 20.7 -1.6 190 199 A A H X S+ 0 0 21 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.869 110.2 50.4 -70.5 -36.7 32.6 18.5 1.1 191 200 A L H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.941 113.4 45.5 -64.9 -42.6 29.2 17.1 1.9 192 201 A Y H X S+ 0 0 12 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.881 107.6 58.1 -67.0 -37.9 28.6 16.3 -1.8 193 202 A D H < S+ 0 0 122 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.903 109.5 45.8 -56.5 -41.7 32.2 14.9 -2.0 194 203 A Y H X S+ 0 0 36 -4,-1.8 4,-0.6 1,-0.2 -2,-0.2 0.913 116.7 44.0 -65.0 -45.2 31.1 12.4 0.7 195 204 A L H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 5,-0.3 0.774 93.5 77.9 -76.0 -30.8 27.8 11.6 -0.9 196 205 A I H X S+ 0 0 99 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.915 99.4 38.9 -54.5 -53.4 28.8 11.1 -4.6 197 206 A P H > S+ 0 0 75 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.854 115.9 54.1 -67.5 -29.2 30.4 7.6 -4.3 198 207 A I H X S+ 0 0 23 -4,-0.6 4,-2.3 2,-0.2 -2,-0.2 0.920 108.9 46.8 -67.4 -44.6 27.7 6.4 -1.9 199 208 A I H X S+ 0 0 5 -4,-2.6 4,-1.4 2,-0.2 5,-0.2 0.882 113.3 50.8 -62.9 -42.0 24.8 7.5 -4.3 200 209 A E H >X S+ 0 0 119 -4,-2.0 4,-1.9 -5,-0.3 3,-0.6 0.965 110.8 47.7 -57.3 -56.4 26.7 5.8 -7.2 201 210 A Q H 3X S+ 0 0 120 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.895 113.4 48.1 -49.4 -47.5 27.1 2.5 -5.2 202 211 A R H 3< S+ 0 0 42 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.666 107.7 52.7 -82.4 -13.9 23.5 2.5 -4.1 203 212 A R H << S+ 0 0 82 -4,-1.4 -1,-0.2 -3,-0.6 -2,-0.2 0.806 115.1 43.3 -79.8 -34.3 22.0 3.1 -7.6 204 213 A Q H < S+ 0 0 155 -4,-1.9 -2,-0.2 1,-0.3 -3,-0.2 0.929 134.0 19.4 -73.3 -42.8 24.1 0.2 -8.9 205 214 A K S < S- 0 0 163 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.1 -0.712 86.4-155.8-130.6 80.3 23.2 -2.0 -5.9 206 215 A P - 0 0 75 0, 0.0 2,-0.1 0, 0.0 -3,-0.1 -0.272 12.5-176.2 -62.6 137.7 20.1 -0.7 -4.1 207 216 A G - 0 0 42 -5,-0.1 -48,-0.0 2,-0.1 -5,-0.0 -0.337 41.4 -96.7-108.2-162.4 19.5 -1.5 -0.4 208 217 A T S S+ 0 0 135 -2,-0.1 -49,-0.1 4,-0.1 5,-0.1 0.562 85.3 109.0 -93.2 -10.8 16.6 -0.7 2.0 209 218 A D S > S- 0 0 27 -51,-0.1 4,-2.2 1,-0.1 -51,-0.2 -0.036 83.7-103.2 -69.2 169.0 18.2 2.4 3.6 210 219 A A H > S+ 0 0 5 -53,-2.8 4,-2.4 1,-0.2 5,-0.2 0.846 119.4 53.3 -65.2 -37.0 17.0 6.0 3.0 211 220 A I H > S+ 0 0 4 -53,-0.4 4,-2.9 2,-0.2 -1,-0.2 0.940 110.8 47.4 -64.0 -43.8 19.8 6.9 0.5 212 221 A S H > S+ 0 0 1 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.901 111.6 51.6 -60.5 -43.9 19.0 3.9 -1.6 213 222 A I H < S+ 0 0 50 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.925 115.6 39.7 -60.5 -48.2 15.3 4.8 -1.5 214 223 A V H >< S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.938 114.9 52.0 -64.2 -49.3 15.9 8.4 -2.6 215 224 A A H 3< S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.728 118.5 36.6 -66.1 -24.4 18.6 7.5 -5.2 216 225 A N T 3< S+ 0 0 70 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.155 100.0 117.6-109.2 15.0 16.4 4.9 -6.9 217 226 A G < - 0 0 11 -3,-1.7 7,-2.3 6,-0.1 2,-0.4 -0.146 57.6-128.8 -83.9 172.0 13.2 6.9 -6.4 218 227 A Q E -H 223 0C 125 5,-0.2 2,-0.5 -117,-0.1 -2,-0.1 -0.924 7.2-150.3-115.9 146.5 10.7 8.4 -8.8 219 228 A V E > S-H 222 0C 1 3,-3.3 3,-1.3 -2,-0.4 -117,-0.1 -0.967 81.7 -25.0-119.2 121.6 9.4 11.9 -8.9 220 229 A N T 3 S- 0 0 125 -2,-0.5 -1,-0.2 -119,-0.4 -119,-0.1 0.914 131.0 -44.4 36.2 55.8 5.9 12.3 -10.3 221 230 A G T 3 S+ 0 0 62 1,-0.2 -1,-0.2 -3,-0.0 -3,-0.0 0.444 120.2 97.1 84.2 2.6 6.3 9.0 -12.3 222 231 A R E < S-H 219 0C 83 -3,-1.3 -3,-3.3 1,-0.0 -1,-0.2 -0.923 80.7 -91.3-125.7 151.2 9.8 9.6 -13.7 223 232 A P E -H 218 0C 99 0, 0.0 -5,-0.2 0, 0.0 2,-0.2 -0.279 39.9-120.6 -59.4 135.6 13.3 8.5 -12.5 224 233 A I - 0 0 3 -7,-2.3 2,-0.1 -10,-0.2 -6,-0.0 -0.539 30.8-120.2 -70.3 142.3 15.2 10.8 -10.2 225 234 A T > - 0 0 60 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.448 17.4-114.8 -78.1 159.0 18.6 12.0 -11.6 226 235 A S H > S+ 0 0 52 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.908 119.0 50.0 -53.3 -45.6 21.9 11.3 -9.9 227 236 A D H > S+ 0 0 77 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.918 111.8 47.3 -58.9 -49.1 22.3 15.1 -9.3 228 237 A E H > S+ 0 0 27 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.900 110.5 52.0 -63.6 -44.9 18.8 15.4 -7.8 229 238 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.893 109.7 50.1 -55.9 -45.9 19.4 12.4 -5.6 230 239 A K H X S+ 0 0 36 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.916 108.8 52.5 -58.4 -47.5 22.6 14.0 -4.3 231 240 A R H X S+ 0 0 43 -4,-2.3 -141,-1.4 1,-0.3 4,-1.3 0.812 114.7 38.6 -67.4 -65.8 20.9 17.4 -3.6 232 241 A M H X S+ 0 0 2 -4,-2.0 4,-1.8 -143,-0.3 -1,-0.3 0.726 113.5 55.4 -33.8 -86.8 18.0 15.9 -1.4 233 242 A C H X S+ 0 0 0 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.829 108.1 52.1 -35.3 -35.4 20.4 13.3 0.3 234 243 A G H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 5,-0.2 0.942 108.9 48.8 -57.6 -50.3 22.5 16.4 1.2 235 244 A L H X S+ 0 0 17 -4,-1.3 4,-2.5 -145,-0.2 5,-0.2 0.910 108.4 54.2 -58.5 -44.0 19.4 18.0 2.7 236 245 A L H X S+ 0 0 14 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.866 105.9 51.6 -61.7 -39.0 18.6 14.9 4.6 237 246 A L H X S+ 0 0 2 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.937 111.5 47.4 -61.4 -46.1 22.0 14.7 6.3 238 247 A V H X S+ 0 0 20 -4,-2.0 4,-1.2 1,-0.2 5,-0.4 0.945 114.8 45.8 -59.4 -46.8 21.7 18.4 7.4 239 248 A T H < S+ 0 0 64 -4,-2.5 5,-0.5 1,-0.2 4,-0.4 0.848 113.3 50.4 -67.0 -33.1 18.2 17.8 8.7 240 249 A G H < S+ 0 0 16 -4,-2.3 -1,-0.2 -5,-0.2 -86,-0.2 0.794 115.2 41.2 -75.1 -26.5 19.2 14.6 10.5 241 250 A L H < S+ 0 0 0 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.568 117.5 29.6-103.8 -9.8 22.2 16.0 12.2 242 251 A D S X S+ 0 0 2 -4,-1.2 4,-2.0 -3,-0.2 5,-0.2 0.810 102.3 49.7-119.9 -50.7 21.3 19.5 13.6 243 252 A T H > S+ 0 0 45 -4,-0.4 4,-2.7 -5,-0.4 5,-0.2 0.951 113.2 39.2 -74.4 -49.1 17.8 20.5 14.6 244 253 A V H > S+ 0 0 20 -5,-0.5 4,-2.6 1,-0.2 5,-0.2 0.924 113.8 58.3 -64.4 -40.6 16.6 17.8 16.9 245 254 A V H > S+ 0 0 4 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.910 113.6 37.8 -49.5 -48.3 20.1 17.5 18.5 246 255 A N H X S+ 0 0 5 -4,-2.0 4,-1.7 2,-0.2 3,-0.3 0.903 112.6 55.9 -76.6 -39.2 19.9 21.2 19.5 247 256 A F H X S+ 0 0 6 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.915 102.3 57.2 -60.0 -43.7 16.2 21.3 20.4 248 257 A L H X S+ 0 0 4 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.879 106.2 50.5 -52.0 -42.9 16.7 18.4 22.9 249 258 A S H X S+ 0 0 2 -4,-1.0 4,-2.4 -3,-0.3 -1,-0.2 0.888 108.8 49.9 -66.8 -41.3 19.4 20.5 24.8 250 259 A F H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.908 114.3 47.1 -59.1 -43.5 17.2 23.6 25.0 251 260 A S H X S+ 0 0 2 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.905 114.1 44.7 -66.6 -44.3 14.4 21.4 26.4 252 261 A M H X S+ 0 0 3 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.836 109.5 56.2 -74.5 -32.2 16.5 19.6 28.9 253 262 A E H X S+ 0 0 15 -4,-2.4 4,-1.2 2,-0.2 -2,-0.2 0.936 110.0 46.9 -58.1 -48.3 18.2 22.8 30.0 254 263 A F H X S+ 0 0 33 -4,-2.0 4,-0.6 2,-0.2 3,-0.4 0.907 112.3 48.5 -59.2 -47.7 14.7 24.2 30.8 255 264 A L H >< S+ 0 0 1 -4,-2.1 3,-1.0 1,-0.2 7,-0.3 0.900 108.0 54.7 -63.0 -40.2 13.6 21.1 32.7 256 265 A A H 3< S+ 0 0 5 -4,-2.6 118,-0.4 1,-0.3 -1,-0.2 0.811 113.4 43.5 -60.8 -30.1 16.9 21.0 34.7 257 266 A K H 3< S+ 0 0 113 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.507 110.0 60.9 -92.5 -7.8 16.1 24.6 35.8 258 267 A S XX + 0 0 8 -3,-1.0 4,-2.0 -4,-0.6 3,-0.7 -0.640 49.5 169.9-130.4 76.8 12.4 24.0 36.5 259 268 A P H 3> S+ 0 0 64 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.825 82.6 58.5 -53.5 -35.5 11.6 21.4 39.2 260 269 A E H 3> S+ 0 0 116 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.884 107.6 46.4 -61.9 -41.5 7.9 22.5 39.1 261 270 A H H <> S+ 0 0 26 -3,-0.7 4,-1.5 2,-0.2 -1,-0.2 0.878 111.6 49.8 -71.8 -38.8 7.7 21.6 35.4 262 271 A R H >X S+ 0 0 13 -4,-2.0 4,-2.1 -7,-0.3 3,-0.5 0.972 110.5 52.1 -59.9 -50.5 9.4 18.3 35.8 263 272 A Q H 3X S+ 0 0 108 -4,-2.9 4,-2.5 1,-0.2 5,-0.3 0.860 105.1 56.2 -47.2 -44.2 7.0 17.5 38.7 264 273 A E H 3X S+ 0 0 38 -4,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.890 111.5 41.5 -61.0 -44.0 4.1 18.3 36.4 265 274 A L H << S+ 0 0 2 -4,-1.5 -1,-0.2 -3,-0.5 -2,-0.2 0.724 112.5 53.9 -76.9 -28.3 5.2 15.7 33.8 266 275 A I H < S+ 0 0 76 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.923 117.8 37.0 -68.6 -44.3 6.1 13.1 36.4 267 276 A E H < S+ 0 0 110 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.713 131.2 30.5 -79.6 -28.1 2.6 13.4 38.0 268 277 A R >< + 0 0 103 -4,-1.6 3,-2.4 -5,-0.3 -1,-0.2 -0.502 65.5 164.4-132.6 69.8 0.8 13.8 34.8 269 278 A P G > S+ 0 0 70 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.707 71.0 73.0 -63.7 -21.7 2.7 11.9 32.1 270 279 A E G 3 S+ 0 0 135 1,-0.3 4,-0.3 2,-0.1 -5,-0.1 0.658 88.7 63.3 -62.4 -17.7 -0.3 12.1 29.7 271 280 A R G <> S+ 0 0 81 -3,-2.4 4,-2.7 1,-0.2 -1,-0.3 0.498 73.9 97.7 -83.4 -6.2 0.6 15.8 29.4 272 281 A I H <> S+ 0 0 7 -3,-1.8 4,-3.0 1,-0.2 -1,-0.2 0.888 81.2 50.2 -52.3 -48.1 4.0 15.0 27.8 273 282 A P H > S+ 0 0 68 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.926 113.6 44.9 -56.1 -46.8 2.8 15.5 24.1 274 283 A A H > S+ 0 0 50 -4,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.878 112.8 52.7 -62.5 -38.1 1.3 18.9 25.0 275 284 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.896 105.1 54.8 -63.1 -44.2 4.5 19.7 26.9 276 285 A C H X S+ 0 0 0 -4,-3.0 4,-2.2 -5,-0.2 -2,-0.2 0.926 108.9 48.8 -53.1 -45.8 6.5 18.8 23.8 277 286 A E H X S+ 0 0 45 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.898 110.9 49.3 -63.2 -40.4 4.4 21.3 21.8 278 287 A E H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 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