==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 07-JUN-13 4L4A . COMPND 2 MOLECULE: CAMPHOR 5-MONOOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR D.BATABYAL,H.LI,T.L.POULOS . 405 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17179.0 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 . 54 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 153 37.8 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 1 3 0 0 2 0 2 2 0 1 0 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 0 199 0, 0.0 49,-0.4 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 84.3 -5.1 0.7 -19.2 2 11 A L - 0 0 88 47,-0.1 47,-0.2 48,-0.1 3,-0.0 -0.583 360.0-129.0 -93.1 148.5 -2.6 2.6 -17.0 3 12 A A - 0 0 25 45,-2.2 2,-0.1 -2,-0.2 -1,-0.0 -0.694 42.2 -88.7 -88.7 148.0 -2.0 2.3 -13.3 4 13 A P - 0 0 124 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.335 49.2-104.4 -59.9 130.6 -2.1 5.5 -11.2 5 14 A L - 0 0 54 1,-0.1 6,-0.1 -2,-0.1 43,-0.0 -0.373 36.0-122.0 -59.3 118.6 1.4 7.1 -10.9 6 15 A P > - 0 0 32 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.349 22.0-115.5 -61.9 145.7 2.9 6.4 -7.5 7 16 A P T 3 S+ 0 0 141 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.642 110.5 60.7 -59.6 -19.8 3.8 9.6 -5.6 8 17 A H T 3 S+ 0 0 41 2,-0.1 294,-0.2 1,-0.0 -3,-0.0 0.544 86.7 86.2 -86.9 -4.5 7.6 8.8 -5.6 9 18 A V S < S- 0 0 6 -3,-1.9 2,-0.1 292,-0.1 5,-0.1 -0.843 75.3-136.1-103.1 115.5 7.9 8.8 -9.4 10 19 A P > - 0 0 54 0, 0.0 3,-1.6 0, 0.0 4,-0.2 -0.411 19.6-122.2 -68.3 146.9 8.5 12.2 -11.0 11 20 A E G > S+ 0 0 164 1,-0.3 3,-1.4 2,-0.2 35,-0.1 0.742 106.8 66.1 -62.6 -27.5 6.4 12.8 -14.2 12 21 A H G 3 S+ 0 0 143 1,-0.3 -1,-0.3 33,-0.0 -3,-0.0 0.664 96.5 57.3 -72.3 -13.4 9.4 13.4 -16.4 13 22 A L G < S+ 0 0 15 -3,-1.6 33,-2.9 32,-0.1 2,-0.4 0.425 82.0 114.0 -92.5 1.0 10.4 9.7 -15.9 14 23 A V B < +a 46 0A 38 -3,-1.4 2,-0.3 31,-0.2 33,-0.2 -0.583 29.0 157.8 -78.4 127.1 7.1 8.4 -17.2 15 24 A F - 0 0 54 31,-2.5 2,-2.6 -2,-0.4 30,-0.1 -0.810 33.7-143.5-146.9 106.7 7.1 6.4 -20.5 16 25 A D + 0 0 61 -2,-0.3 2,-0.4 31,-0.2 31,-0.1 -0.340 33.7 164.9 -80.8 67.4 4.1 4.2 -20.9 17 26 A F - 0 0 9 -2,-2.6 2,-0.7 32,-0.1 32,-0.3 -0.662 27.1-150.7 -82.5 131.6 5.7 1.2 -22.7 18 27 A D > - 0 0 47 -2,-0.4 3,-1.6 3,-0.2 -2,-0.0 -0.900 3.9-163.9-106.5 104.7 3.7 -2.0 -22.7 19 28 A M T 3 S+ 0 0 0 -2,-0.7 -1,-0.1 1,-0.3 14,-0.0 0.676 89.8 49.8 -64.7 -17.4 6.1 -5.0 -22.8 20 29 A Y T 3 S+ 0 0 42 1,-0.2 364,-0.4 -3,-0.1 -1,-0.3 0.471 129.0 16.8 -99.5 -4.5 3.3 -7.4 -23.9 21 30 A N S < S- 0 0 99 -3,-1.6 -1,-0.2 362,-0.1 -3,-0.2 -0.317 77.2-167.9-162.6 67.2 2.1 -5.2 -26.8 22 31 A P > - 0 0 3 0, 0.0 3,-1.5 0, 0.0 11,-0.1 -0.356 28.3-123.7 -68.0 145.7 4.6 -2.5 -27.8 23 32 A S T 3 S+ 0 0 124 1,-0.3 3,-0.3 9,-0.1 10,-0.1 0.691 106.7 53.2 -60.5 -21.7 3.2 0.2 -30.2 24 33 A N T > + 0 0 73 8,-0.2 3,-1.9 1,-0.2 -1,-0.3 0.191 68.7 122.1-102.4 19.5 5.9 -0.4 -32.8 25 34 A L G X + 0 0 32 -3,-1.5 3,-1.8 1,-0.3 357,-0.4 0.739 63.3 65.5 -60.5 -31.7 5.4 -4.2 -33.2 26 35 A S G 3 S+ 0 0 125 -3,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.804 98.9 56.0 -60.8 -27.7 4.6 -4.1 -37.0 27 36 A A G < S- 0 0 54 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.499 131.8 -73.2 -81.4 -5.0 8.2 -2.9 -37.6 28 37 A G <> - 0 0 7 -3,-1.8 4,-1.6 -4,-0.2 -1,-0.3 -0.174 41.3-101.4 116.2 143.5 9.7 -5.9 -35.7 29 38 A V H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.913 120.7 49.6 -67.8 -41.8 9.8 -6.7 -32.0 30 39 A Q H > S+ 0 0 1 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.926 112.5 49.8 -63.7 -40.3 13.4 -5.6 -31.4 31 40 A E H 4 S+ 0 0 55 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.836 107.4 55.1 -62.2 -33.9 12.6 -2.3 -33.3 32 41 A A H >< S+ 0 0 1 -4,-1.6 3,-0.6 1,-0.2 -1,-0.2 0.875 111.1 43.4 -69.9 -35.4 9.5 -1.9 -31.1 33 42 A W H >< S+ 0 0 0 -4,-2.0 3,-1.9 1,-0.2 -1,-0.2 0.790 101.5 70.5 -78.2 -25.4 11.6 -2.2 -27.9 34 43 A A G >< S+ 0 0 17 -4,-1.7 3,-2.0 1,-0.3 -1,-0.2 0.633 76.4 79.0 -72.6 -11.9 14.3 0.1 -29.4 35 44 A V G X S+ 0 0 29 -3,-0.6 3,-1.3 -4,-0.5 -1,-0.3 0.742 83.6 67.6 -60.9 -19.9 12.0 3.1 -29.1 36 45 A L G < S+ 0 0 0 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.556 97.1 53.9 -75.9 -10.0 13.0 3.0 -25.5 37 46 A Q G < S+ 0 0 16 -3,-2.0 -1,-0.3 -4,-0.1 -2,-0.2 0.089 81.7 114.8-114.3 21.0 16.5 4.0 -26.7 38 47 A E S X S- 0 0 104 -3,-1.3 3,-1.9 1,-0.1 -3,-0.0 -0.493 82.6-103.0 -82.5 166.1 15.5 7.1 -28.6 39 48 A S T 3 S+ 0 0 128 1,-0.3 -1,-0.1 -2,-0.2 -3,-0.0 0.740 116.9 64.6 -67.2 -22.1 16.8 10.5 -27.4 40 49 A N T 3 S+ 0 0 113 2,-0.0 -1,-0.3 1,-0.0 -4,-0.1 0.631 91.1 81.5 -72.8 -11.9 13.4 11.5 -25.9 41 50 A V S < S- 0 0 10 -3,-1.9 -28,-0.1 -6,-0.1 4,-0.1 -0.834 75.8-131.3-106.1 126.0 13.7 8.6 -23.3 42 51 A P - 0 0 47 0, 0.0 3,-0.1 0, 0.0 -4,-0.1 -0.207 31.3-105.9 -61.7 158.7 15.7 8.7 -20.1 43 52 A D S S+ 0 0 57 1,-0.2 14,-2.9 13,-0.1 15,-0.5 0.831 110.9 29.0 -51.3 -37.0 18.1 5.9 -19.1 44 53 A L E S+ B 0 56A 5 12,-0.2 2,-0.3 13,-0.1 12,-0.2 -0.974 79.1 172.8-136.8 117.2 15.6 4.7 -16.5 45 54 A V E - B 0 55A 0 10,-2.3 10,-2.3 -2,-0.4 2,-0.5 -0.803 28.1-128.3-125.3 163.2 11.8 5.2 -16.9 46 55 A W E -aB 14 54A 10 -33,-2.9 -31,-2.5 -2,-0.3 2,-0.4 -0.961 18.7-161.4-111.0 124.4 8.6 4.2 -15.2 47 56 A T E - B 0 53A 0 6,-2.9 6,-2.5 -2,-0.5 -31,-0.2 -0.858 12.8-154.4 -98.6 141.5 5.7 2.7 -17.3 48 57 A R > + 0 0 78 -2,-0.4 -45,-2.2 4,-0.2 3,-0.6 0.466 65.8 106.3 -87.7 -6.8 2.2 2.8 -15.9 49 58 A C G > S+ 0 0 14 -32,-0.3 3,-2.3 1,-0.2 -2,-0.1 -0.290 77.0 17.2 -67.3 157.8 1.4 -0.3 -18.0 50 59 A N G 3 S- 0 0 45 -49,-0.4 31,-0.3 1,-0.3 -1,-0.2 0.789 142.5 -43.1 52.0 39.4 1.0 -3.8 -16.6 51 60 A G G < S- 0 0 61 -3,-0.6 -1,-0.3 29,-0.1 -2,-0.1 0.123 105.9 -74.6 96.2 -18.9 0.5 -2.6 -13.0 52 61 A G < + 0 0 5 -3,-2.3 256,-0.3 1,-0.1 2,-0.3 0.412 66.4 157.1 99.8 124.2 3.3 -0.0 -13.1 53 62 A H E -B 47 0A 0 -6,-2.5 -6,-2.9 254,-0.1 256,-0.2 -0.986 37.1 -94.7-167.8 164.0 7.1 -0.7 -13.1 54 63 A W E -Bc 46 309A 0 254,-2.6 256,-3.1 -2,-0.3 2,-0.3 -0.454 25.4-160.9 -81.6 158.3 10.5 0.6 -14.0 55 64 A I E -Bc 45 310A 0 -10,-2.3 -10,-2.3 254,-0.2 2,-0.4 -0.950 9.3-149.8-136.4 122.2 12.5 -0.2 -17.1 56 65 A A E -B 44 0A 0 254,-2.0 -12,-0.2 -2,-0.3 259,-0.1 -0.784 14.5-174.0 -81.5 133.6 16.2 0.2 -17.4 57 66 A T + 0 0 0 -14,-2.9 2,-0.4 -2,-0.4 -13,-0.1 0.427 53.8 74.5-114.1 -1.5 16.9 1.1 -21.1 58 67 A R S > S- 0 0 9 -15,-0.5 4,-2.2 1,-0.1 3,-0.3 -0.915 75.0-129.3-121.6 141.7 20.7 1.1 -21.2 59 68 A G H > S+ 0 0 0 -2,-0.4 4,-2.6 257,-0.3 5,-0.3 0.870 107.6 56.1 -53.7 -41.9 23.2 -1.8 -21.2 60 69 A Q H > S+ 0 0 121 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.916 111.6 42.1 -59.4 -45.9 25.3 -0.3 -18.4 61 70 A L H > S+ 0 0 0 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.857 113.3 52.9 -67.4 -39.2 22.3 -0.0 -16.0 62 71 A I H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.926 112.2 44.9 -65.4 -45.2 20.9 -3.5 -17.0 63 72 A R H X S+ 0 0 50 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.928 113.2 51.1 -61.6 -48.0 24.3 -5.1 -16.2 64 73 A E H X S+ 0 0 75 -4,-2.1 4,-2.2 -5,-0.3 -2,-0.2 0.920 111.4 46.5 -55.1 -49.3 24.7 -3.2 -13.0 65 74 A A H < S+ 0 0 1 -4,-2.4 7,-0.3 1,-0.2 -1,-0.2 0.893 110.7 52.0 -64.8 -40.8 21.3 -4.2 -11.7 66 75 A Y H < S+ 0 0 6 -4,-2.1 279,-0.5 1,-0.2 -1,-0.2 0.818 112.1 48.0 -66.9 -27.0 21.8 -7.9 -12.6 67 76 A E H < S+ 0 0 114 -4,-1.8 2,-1.6 1,-0.2 -2,-0.2 0.885 101.2 66.6 -77.0 -39.4 25.0 -7.8 -10.7 68 77 A D >X + 0 0 41 -4,-2.2 4,-2.2 1,-0.2 3,-0.9 -0.564 53.5 159.6 -88.5 77.5 23.7 -6.2 -7.6 69 78 A Y T 34 + 0 0 65 -2,-1.6 -1,-0.2 1,-0.2 5,-0.1 0.683 64.6 76.8 -73.9 -16.4 21.3 -8.9 -6.3 70 79 A R T 34 S+ 0 0 166 -3,-0.2 -1,-0.2 1,-0.2 3,-0.1 0.872 113.9 18.8 -58.1 -39.7 21.5 -7.2 -2.9 71 80 A H T <4 S+ 0 0 45 -3,-0.9 222,-2.1 1,-0.2 2,-0.8 0.757 127.1 54.8-100.4 -32.6 19.1 -4.5 -4.1 72 81 A F E < S-D 292 0A 0 -4,-2.2 2,-0.2 -7,-0.3 -1,-0.2 -0.840 78.4-167.3-109.6 94.4 17.6 -6.2 -7.1 73 82 A S E > -D 291 0A 2 218,-2.9 218,-2.0 -2,-0.8 3,-0.6 -0.581 27.2-145.0 -92.9 149.2 16.2 -9.6 -6.0 74 83 A S T 3 S+ 0 0 1 -2,-0.2 -1,-0.1 1,-0.2 20,-0.1 0.424 78.3 99.9 -84.7 -1.4 15.0 -12.5 -8.1 75 84 A E T 3 S+ 0 0 140 1,-0.3 -1,-0.2 216,-0.2 215,-0.1 0.843 99.1 21.7 -54.8 -35.8 12.2 -13.3 -5.7 76 85 A C S < S+ 0 0 5 -3,-0.6 -1,-0.3 1,-0.1 9,-0.2 -0.757 77.5 153.3-134.8 81.9 9.8 -11.5 -7.9 77 86 A P + 0 0 3 0, 0.0 212,-2.3 0, 0.0 2,-0.4 0.422 47.5 75.3-102.7 0.4 11.3 -11.5 -11.4 78 87 A F S S- 0 0 15 210,-0.2 6,-0.6 3,-0.1 7,-0.1 -0.889 75.3-112.4-113.5 144.7 8.3 -11.3 -13.7 79 88 A I S S+ 0 0 3 -2,-0.4 2,-0.2 4,-0.1 307,-0.1 -0.918 89.8 55.9-105.9 140.7 5.9 -8.5 -14.6 80 89 A P S >> S- 0 0 27 0, 0.0 4,-2.1 0, 0.0 3,-1.0 0.580 90.3-121.4 -76.9 172.6 3.0 -8.2 -13.9 81 90 A R H 3> S+ 0 0 82 -31,-0.3 4,-2.8 1,-0.3 5,-0.2 0.817 108.9 56.9 -54.8 -42.1 3.2 -8.5 -10.1 82 91 A E H 3> S+ 0 0 132 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.846 110.3 45.7 -57.7 -37.9 0.9 -11.6 -9.8 83 92 A A H <> S+ 0 0 7 -3,-1.0 4,-1.3 2,-0.2 -1,-0.2 0.921 112.9 49.2 -72.5 -46.0 3.1 -13.5 -12.3 84 93 A G H < S+ 0 0 0 -4,-2.1 -2,-0.2 -6,-0.6 -1,-0.2 0.872 113.7 46.9 -58.7 -39.8 6.3 -12.4 -10.5 85 94 A E H < S+ 0 0 133 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.854 113.1 47.4 -72.2 -36.2 4.8 -13.5 -7.1 86 95 A A H < S+ 0 0 20 -4,-1.7 2,-0.5 -5,-0.2 -1,-0.2 0.719 90.3 103.0 -73.9 -21.0 3.5 -16.8 -8.4 87 96 A Y < + 0 0 12 -4,-1.3 -9,-0.1 1,-0.1 98,-0.0 -0.512 33.4 150.8 -72.8 117.4 6.9 -17.4 -10.0 88 97 A D + 0 0 42 -2,-0.5 -1,-0.1 -12,-0.1 5,-0.1 0.145 16.0 146.7-135.8 19.4 8.9 -19.9 -7.9 89 98 A F > - 0 0 4 3,-0.1 4,-1.9 145,-0.1 143,-0.2 -0.180 50.1 -92.0 -56.1 149.4 11.1 -21.7 -10.4 90 99 A I T 4 S+ 0 0 0 141,-1.2 145,-0.3 1,-0.2 -1,-0.1 -0.940 97.0 0.8-113.1 136.6 14.5 -22.8 -9.1 91 100 A P T >4 S+ 0 0 11 0, 0.0 3,-2.4 0, 0.0 -1,-0.2 -0.999 123.3 63.8 -92.3 -1.9 17.1 -21.4 -9.3 92 101 A T T 34 S+ 0 0 29 1,-0.3 -2,-0.2 140,-0.1 -3,-0.1 0.609 100.0 54.4 -62.2 -19.1 15.8 -18.3 -11.0 93 102 A S T 3< S+ 0 0 18 -4,-1.9 2,-0.3 -5,-0.1 -1,-0.3 0.336 100.1 80.4 -93.7 5.2 13.5 -17.2 -8.1 94 103 A M < - 0 0 9 -3,-2.4 -6,-0.0 -5,-0.1 -5,-0.0 -0.872 68.0-143.6-113.4 145.3 16.5 -17.4 -5.6 95 104 A D > - 0 0 39 -2,-0.3 4,-1.8 1,-0.1 3,-0.5 -0.572 46.1 -54.3 -91.8 162.4 19.3 -14.9 -4.9 96 105 A P T 4 S+ 0 0 26 0, 0.0 -1,-0.1 0, 0.0 249,-0.0 -0.521 116.6 29.0 -63.2 149.4 22.9 -15.8 -4.1 97 106 A P T >4 S+ 0 0 112 0, 0.0 3,-1.2 0, 0.0 4,-0.5 -0.999 123.6 48.4 -90.7 -6.0 24.0 -17.6 -2.1 98 107 A E T 3> S+ 0 0 118 -3,-0.5 4,-0.6 1,-0.3 3,-0.3 0.860 106.6 59.7 -57.9 -38.1 21.0 -19.9 -1.9 99 108 A Q H 3X S+ 0 0 8 -4,-1.8 4,-2.4 1,-0.2 3,-0.4 0.755 88.9 80.7 -60.0 -24.8 20.8 -20.1 -5.8 100 109 A R H <> S+ 0 0 151 -3,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.895 87.9 43.9 -58.9 -59.4 24.3 -21.7 -5.8 101 110 A Q H > S+ 0 0 57 -4,-0.5 4,-0.7 -3,-0.3 -1,-0.2 0.790 117.3 49.3 -61.2 -26.2 23.9 -25.4 -5.0 102 111 A F H >X S+ 0 0 11 -4,-0.6 4,-2.3 -3,-0.4 3,-0.6 0.893 104.4 57.0 -76.9 -41.2 20.9 -25.5 -7.3 103 112 A R H 3X S+ 0 0 75 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.878 103.1 56.3 -55.2 -40.4 22.7 -23.8 -10.2 104 113 A A H 3X S+ 0 0 52 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.814 107.5 47.6 -62.5 -34.1 25.3 -26.6 -10.1 105 114 A L H X S+ 0 0 4 -4,-2.3 4,-2.4 1,-0.2 3,-0.5 0.916 109.1 51.7 -54.3 -44.0 21.1 -27.4 -13.4 107 116 A N H 3X S+ 0 0 80 -4,-2.4 4,-1.7 1,-0.2 7,-0.3 0.888 103.9 57.2 -60.9 -41.5 24.6 -27.3 -15.0 108 117 A Q H 3< S+ 0 0 121 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.829 115.5 36.8 -55.8 -33.6 24.9 -31.1 -14.5 109 118 A V H << S+ 0 0 2 -4,-1.3 -2,-0.2 -3,-0.5 -1,-0.2 0.808 133.6 16.9 -98.8 -31.5 21.8 -31.7 -16.5 110 119 A V H < S+ 0 0 10 -4,-2.4 243,-0.5 -5,-0.1 -3,-0.2 0.245 99.8 110.5-123.8 12.5 21.8 -29.1 -19.3 111 120 A G S >X S- 0 0 0 -4,-1.7 4,-2.1 -5,-0.3 3,-0.7 -0.050 84.7 -73.5 -82.8-175.1 25.5 -28.0 -19.3 112 121 A M H 3> S+ 0 0 98 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.848 124.8 52.1 -45.0 -54.2 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3,-2.5 -3,-0.3 4,-0.6 0.818 97.0 86.9 -80.7 -34.5 11.5 -30.4 -45.9 134 143 A R G >< S+ 0 0 41 -4,-2.8 3,-0.8 1,-0.3 -2,-0.1 0.767 87.7 44.4 -45.0 -49.2 14.0 -29.7 -48.6 135 144 A P G 34 S+ 0 0 75 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.584 97.1 77.2 -80.1 -1.1 12.1 -31.1 -51.7 136 145 A Q G <4 S- 0 0 105 -3,-2.5 -2,-0.2 2,-0.1 3,-0.1 0.834 87.1-144.0 -69.2 -33.1 8.8 -29.4 -50.7 137 146 A G S << S+ 0 0 11 -3,-0.8 260,-2.2 -4,-0.6 2,-0.3 0.669 74.3 46.3 74.8 17.4 10.0 -26.0 -51.9 138 147 A Q E +F 396 0B 122 -5,-0.5 2,-0.3 258,-0.3 258,-0.2 -0.933 57.8 167.8-176.5 155.8 8.2 -24.4 -48.9 139 148 A C E -F 395 0B 10 256,-1.7 256,-2.4 -2,-0.3 2,-0.8 -0.962 41.7-114.9-164.3 161.7 7.5 -24.7 -45.2 140 149 A N E > -F 394 0B 38 -2,-0.3 4,-3.1 254,-0.2 5,-0.3 -0.925 35.5-161.1 -98.7 101.2 6.1 -22.9 -42.2 141 150 A F H >>S+ 0 0 0 252,-2.3 5,-3.5 -2,-0.8 4,-1.9 0.788 80.6 58.3 -58.6 -35.3 9.4 -22.6 -40.4 142 151 A T H 4>S+ 0 0 10 1,-0.2 5,-1.9 3,-0.2 -1,-0.2 0.968 121.7 23.8 -60.7 -53.8 7.9 -22.0 -37.0 143 152 A E H 45S+ 0 0 117 -3,-0.3 -2,-0.2 3,-0.2 -1,-0.2 0.766 125.3 51.9 -84.3 -22.5 5.9 -25.3 -36.9 144 153 A D H <5S- 0 0 51 -4,-3.1 -3,-0.2 3,-0.1 -2,-0.2 0.662 135.5 -13.3 -91.5 -20.3 8.1 -27.3 -39.3 145 154 A Y T X5S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.3 -3,-0.2 0.471 122.8 65.9-143.4 -48.2 11.5 -26.7 -37.8 146 155 A A T 4 S+ 0 0 13 0, 0.0 4,-2.2 0, 0.0 5,-0.4 0.811 108.4 58.7 -63.8 -34.4 10.3 -29.7 -33.4 149 158 A F H X S+ 0 0 0 -4,-2.2 4,-1.4 2,-0.2 5,-0.2 0.990 118.0 27.1 -60.8 -61.4 14.1 -29.4 -33.7 150 159 A P H > S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.896 123.6 52.3 -68.1 -36.7 14.8 -27.8 -30.2 151 160 A I H X S+ 0 0 10 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.922 108.1 48.0 -68.6 -42.1 11.8 -29.3 -28.5 152 161 A R H X S+ 0 0 88 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.875 111.1 52.4 -68.7 -33.7 12.4 -33.0 -29.5 153 162 A I H X S+ 0 0 5 -4,-1.4 4,-2.9 -5,-0.4 -1,-0.2 0.924 111.5 46.8 -63.5 -44.3 16.0 -32.7 -28.4 154 163 A F H X S+ 0 0 9 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.900 112.3 48.3 -63.9 -43.4 14.8 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-87.4 -8.0 3.1 -34.2 -24.7 165 174 A I H <> S+ 0 0 30 -3,-1.4 4,-3.2 -4,-0.3 5,-0.3 0.913 80.1 49.7 -54.0 -53.0 4.6 -31.4 -26.7 166 175 A P H > S+ 0 0 96 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.900 114.1 46.9 -57.5 -41.9 1.5 -29.6 -27.8 167 176 A H H > S+ 0 0 94 -4,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.927 115.4 44.1 -61.3 -49.3 0.2 -29.5 -24.2 168 177 A L H X S+ 0 0 1 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.886 110.1 55.8 -68.2 -39.2 3.4 -28.3 -22.8 169 178 A G H X S+ 0 0 19 -4,-3.2 4,-2.2 -5,-0.2 -1,-0.2 0.881 106.2 52.6 -58.8 -39.3 4.0 -25.8 -25.5 170 179 A Y H X S+ 0 0 99 -4,-1.8 4,-1.9 -5,-0.3 -1,-0.2 0.931 109.7 46.8 -60.7 -48.2 0.6 -24.2 -24.7 171 180 A L H X S+ 0 0 5 -4,-1.7 4,-0.9 1,-0.2 -2,-0.2 0.847 112.6 49.6 -66.4 -36.5 1.4 -23.8 -21.0 172 181 A T H X S+ 0 0 2 -4,-2.1 4,-1.7 2,-0.2 3,-0.5 0.903 107.7 53.6 -69.7 -43.9 4.8 -22.3 -21.7 173 182 A D H X S+ 0 0 67 -4,-2.2 4,-3.1 1,-0.2 -2,-0.2 0.899 106.4 54.5 -51.0 -45.7 3.3 -19.8 -24.2 174 183 A Q H < S+ 0 0 13 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.818 108.6 48.8 -62.5 -29.4 0.9 -18.7 -21.5 175 184 A M H < S+ 0 0 3 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.809 122.7 28.6 -83.2 -30.9 3.8 -18.0 -19.1 176 185 A T H < S+ 0 0 3 -4,-1.7 210,-2.2 1,-0.2 211,-0.6 0.753 137.1 23.7-102.0 -30.8 6.0 -16.0 -21.4 177 186 A R S < S- 0 0 16 -4,-3.1 -1,-0.2 -5,-0.3 -2,-0.2 -0.527 83.8-155.2-134.3 69.2 3.3 -14.4 -23.7 178 187 A P - 0 0 56 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.180 13.5-173.2 -52.8 123.9 0.1 -14.5 -21.7 179 188 A D - 0 0 105 3,-0.1 -5,-0.1 0, 0.0 -6,-0.0 0.693 48.4-109.1 -89.8 -24.8 -2.9 -14.5 -24.0 180 189 A G S S+ 0 0 66 2,-0.4 3,-0.1 -6,-0.1 -6,-0.0 0.300 91.0 110.2 116.2 -7.0 -5.3 -14.1 -21.1 181 190 A S S S+ 0 0 63 1,-0.2 2,-0.3 2,-0.0 -7,-0.0 0.732 90.2 13.1 -69.6 -22.8 -7.0 -17.5 -21.0 182 191 A M S S- 0 0 35 -8,-0.1 -2,-0.4 4,-0.0 -1,-0.2 -0.986 77.3-113.1-157.3 144.2 -5.2 -18.3 -17.7 183 192 A T > - 0 0 81 -2,-0.3 4,-2.2 -3,-0.1 5,-0.2 -0.205 38.5-108.2 -66.2 164.6 -3.2 -16.6 -15.0 184 193 A F H > S+ 0 0 19 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.923 121.0 56.4 -59.8 -44.2 0.5 -17.3 -14.5 185 194 A A H > S+ 0 0 42 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.908 108.2 45.7 -53.4 -49.5 -0.4 -19.2 -11.4 186 195 A E H > S+ 0 0 111 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.920 112.2 51.4 -62.9 -44.2 -2.8 -21.5 -13.2 187 196 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.916 111.7 47.5 -57.9 -44.9 -0.3 -22.1 -16.0 188 197 A K H X S+ 0 0 17 -4,-2.9 4,-2.9 2,-0.2 -1,-0.2 0.918 110.8 51.0 -62.5 -45.0 2.3 -23.0 -13.5 189 198 A E H X S+ 0 0 83 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.870 108.7 51.4 -64.7 -37.8 0.0 -25.4 -11.7 190 199 A A H X S+ 0 0 28 -4,-2.4 4,-1.1 2,-0.2 -1,-0.2 0.918 112.9 46.7 -60.1 -44.4 -1.0 -27.1 -14.9 191 200 A L H X S+ 0 0 1 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.884 113.4 48.0 -66.3 -39.3 2.8 -27.5 -15.6 192 201 A Y H X S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 -1,-0.2 0.871 105.7 57.7 -70.2 -36.2 3.5 -28.8 -12.1 193 202 A D H < S+ 0 0 101 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.792 109.0 47.4 -66.0 -25.4 0.5 -31.2 -12.2 194 203 A Y H X S+ 0 0 35 -4,-1.1 4,-0.8 -5,-0.1 -1,-0.2 0.917 116.0 43.7 -76.1 -46.2 2.2 -32.7 -15.3 195 204 A L H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 5,-0.3 0.857 98.4 73.2 -64.8 -41.1 5.6 -32.9 -13.6 196 205 A I H X S+ 0 0 78 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.838 99.3 40.6 -51.8 -51.4 4.6 -34.2 -10.2 197 206 A P H > S+ 0 0 66 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.916 115.7 52.5 -65.6 -40.6 3.8 -37.9 -11.1 198 207 A I H X S+ 0 0 19 -4,-0.8 4,-1.9 1,-0.2 -2,-0.2 0.927 109.6 48.1 -58.4 -49.1 6.8 -38.1 -13.4 199 208 A I H X S+ 0 0 3 -4,-2.7 4,-1.3 2,-0.2 -1,-0.2 0.907 111.9 49.9 -58.4 -44.7 9.2 -36.9 -10.7 200 209 A E H >X S+ 0 0 110 -4,-1.9 4,-1.5 -5,-0.3 3,-0.8 0.950 110.1 49.8 -59.9 -49.6 7.8 -39.3 -8.2 201 210 A Q H 3X S+ 0 0 120 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.839 112.7 49.1 -55.8 -34.1 8.1 -42.2 -10.6 202 211 A R H 3< S+ 0 0 43 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.647 103.8 56.7 -88.4 -16.5 11.7 -41.2 -11.2 203 212 A R H << S+ 0 0 88 -4,-1.3 -1,-0.2 -3,-0.8 -2,-0.2 0.775 112.3 44.8 -78.1 -29.5 12.7 -40.9 -7.6 204 213 A Q H < S+ 0 0 149 -4,-1.5 -2,-0.2 1,-0.3 -3,-0.1 0.936 130.6 20.8 -78.5 -51.0 11.6 -44.5 -7.1 205 214 A K S < S- 0 0 181 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.1 -0.804 89.0-147.2-120.7 88.7 13.3 -45.9 -10.2 206 215 A P - 0 0 84 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.165 15.1-170.4 -55.3 139.2 16.0 -43.5 -11.4 207 216 A G - 0 0 33 -5,-0.2 -48,-0.0 2,-0.2 -5,-0.0 -0.407 35.5-109.7-110.4-166.0 16.8 -43.1 -15.1 208 217 A T S S+ 0 0 138 -2,-0.2 -49,-0.1 4,-0.1 2,-0.0 0.357 80.9 112.0-107.6 0.9 19.6 -41.3 -16.8 209 218 A D S > S- 0 0 23 -51,-0.1 4,-2.2 1,-0.1 -51,-0.2 -0.249 84.8-103.5 -70.3 162.6 17.4 -38.5 -18.2 210 219 A A H > S+ 0 0 7 -53,-2.3 4,-2.3 1,-0.2 -52,-0.2 0.811 120.4 52.9 -57.4 -34.5 17.7 -34.9 -16.9 211 220 A I H > S+ 0 0 4 -53,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.896 108.1 49.3 -73.4 -39.7 14.6 -35.3 -14.8 212 221 A S H > S+ 0 0 2 -3,-0.2 4,-0.8 2,-0.2 -2,-0.2 0.912 111.9 50.5 -59.3 -44.5 15.9 -38.4 -13.0 213 222 A I H >< S+ 0 0 58 -4,-2.2 3,-0.6 2,-0.2 4,-0.5 0.930 114.3 42.6 -63.3 -47.4 19.2 -36.6 -12.4 214 223 A V H >< S+ 0 0 0 -4,-2.3 3,-1.7 1,-0.2 -2,-0.2 0.972 113.7 51.0 -60.6 -55.1 17.5 -33.5 -10.9 215 224 A A H 3< S+ 0 0 1 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.571 119.7 37.3 -63.2 -9.5 15.0 -35.4 -8.8 216 225 A N T << S+ 0 0 72 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.328 94.3 111.4-121.9 3.6 17.8 -37.6 -7.4 217 226 A G < - 0 0 11 -3,-1.7 7,-1.9 -4,-0.5 2,-0.4 -0.101 63.2-118.9 -71.0 174.4 20.5 -34.9 -7.1 218 227 A Q E -H 223 0C 120 5,-0.2 2,-0.4 -117,-0.1 3,-0.1 -0.953 24.4-178.5-120.5 140.5 21.8 -33.5 -3.8 219 228 A V E > S-H 222 0C 2 3,-2.3 3,-1.3 -2,-0.4 -117,-0.1 -0.993 71.3 -3.3-136.8 130.6 21.8 -29.9 -2.4 220 229 A N T 3 S- 0 0 124 -2,-0.4 -1,-0.1 1,-0.2 -119,-0.0 0.947 127.2 -56.7 53.8 54.8 23.3 -28.8 0.9 221 230 A G T 3 S+ 0 0 71 1,-0.1 -1,-0.2 -3,-0.1 -3,-0.0 0.336 123.6 84.4 69.2 -7.2 24.4 -32.2 2.0 222 231 A R E < S-H 219 0C 79 -3,-1.3 -3,-2.3 1,-0.1 -1,-0.1 -0.734 87.5 -84.6-125.2 165.8 20.9 -33.6 1.7 223 232 A P E -H 218 0C 83 0, 0.0 -5,-0.2 0, 0.0 -6,-0.1 -0.463 48.1-106.8 -69.8 145.2 18.5 -35.0 -1.0 224 233 A I - 0 0 1 -7,-1.9 2,-0.1 -10,-0.2 -4,-0.0 -0.386 40.3-116.1 -61.1 144.5 16.6 -32.6 -3.1 225 234 A T > - 0 0 56 1,-0.1 4,-2.5 -3,-0.1 5,-0.2 -0.437 17.1-114.5 -80.5 162.8 12.9 -32.5 -2.2 226 235 A S H > S+ 0 0 37 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.828 120.0 51.7 -62.4 -33.3 10.1 -33.6 -4.5 227 236 A D H > S+ 0 0 72 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.901 110.2 46.3 -68.9 -44.5 8.9 -30.0 -4.5 228 237 A E H > S+ 0 0 19 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.904 110.2 53.0 -65.0 -43.9 12.3 -28.5 -5.3 229 238 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.879 110.5 49.8 -58.2 -36.7 12.9 -31.0 -8.1 230 239 A K H X S+ 0 0 24 -4,-1.2 4,-2.0 2,-0.2 -2,-0.2 0.915 109.7 48.9 -69.7 -44.3 9.5 -29.9 -9.5 231 240 A R H X S+ 0 0 45 -4,-2.2 -141,-1.2 1,-0.2 4,-1.0 0.845 116.1 44.6 -64.9 -33.7 10.3 -26.2 -9.3 232 241 A M H X S+ 0 0 0 -4,-2.5 4,-2.0 -143,-0.2 -2,-0.2 0.914 112.3 49.5 -76.6 -43.1 13.6 -26.9 -11.1 233 242 A C H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.832 105.6 59.5 -65.3 -30.8 12.2 -29.2 -13.8 234 243 A G H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.894 106.2 46.9 -63.7 -41.4 9.5 -26.6 -14.5 235 244 A L H X S+ 0 0 35 -4,-1.0 4,-3.1 -145,-0.3 5,-0.3 0.922 109.5 53.3 -66.0 -45.4 12.1 -24.0 -15.4 236 245 A L H X S+ 0 0 22 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.889 108.4 51.3 -55.9 -42.3 14.0 -26.5 -17.6 237 246 A L H X S+ 0 0 1 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.950 110.7 47.5 -58.4 -51.6 10.8 -27.2 -19.4 238 247 A V H X S+ 0 0 20 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.952 116.1 43.9 -57.2 -51.5 10.2 -23.5 -20.0 239 248 A G H < S+ 0 0 31 -4,-3.1 5,-0.5 1,-0.2 4,-0.4 0.880 115.3 49.6 -59.4 -40.8 13.8 -22.9 -21.2 240 249 A G H < S+ 0 0 15 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.846 119.6 35.0 -68.1 -33.5 13.7 -26.1 -23.3 241 250 A L H < S+ 0 0 7 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.684 122.3 32.9 -99.1 -21.3 10.4 -25.2 -25.0 242 251 A D S < S+ 0 0 4 -4,-2.1 -1,-0.1 -5,-0.2 -2,-0.1 -0.051 105.0 55.0-136.7 35.1 10.3 -21.5 -25.5 243 252 A T S > S+ 0 0 44 -4,-0.4 4,-2.5 -3,-0.2 3,-0.5 0.525 109.8 30.2-124.4 -74.0 13.6 -19.9 -26.1 244 253 A V H > S+ 0 0 10 -5,-0.5 4,-3.0 1,-0.2 5,-0.2 0.865 115.4 64.1 -56.9 -39.7 15.6 -21.3 -29.0 245 254 A V H > S+ 0 0 9 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.930 110.4 36.6 -49.0 -50.5 12.3 -22.2 -30.7 246 255 A N H > S+ 0 0 15 -3,-0.5 4,-1.5 1,-0.2 -2,-0.2 0.874 114.9 54.6 -76.0 -36.0 11.5 -18.4 -31.0 247 256 A F H X S+ 0 0 3 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.882 101.3 58.9 -63.8 -38.6 15.1 -17.3 -31.6 248 257 A L H X S+ 0 0 4 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.890 103.5 53.3 -59.0 -37.0 15.5 -19.6 -34.6 249 258 A S H X S+ 0 0 2 -4,-0.9 4,-2.2 -5,-0.2 -1,-0.2 0.929 107.7 49.5 -67.3 -43.0 12.5 -18.0 -36.3 250 259 A F H X S+ 0 0 1 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.927 114.7 45.1 -56.1 -46.6 14.0 -14.5 -35.9 251 260 A S H X S+ 0 0 3 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.928 114.1 47.1 -66.7 -44.6 17.3 -15.6 -37.4 252 261 A M H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.858 109.5 54.6 -67.9 -33.9 15.8 -17.6 -40.3 253 262 A E H X S+ 0 0 17 -4,-2.2 4,-0.5 -5,-0.2 -1,-0.2 0.915 110.7 46.8 -64.7 -44.3 13.5 -14.7 -41.1 254 263 A F H >X S+ 0 0 32 -4,-1.9 3,-1.8 -5,-0.2 4,-0.5 0.945 111.3 49.9 -59.1 -50.9 16.6 -12.5 -41.3 255 264 A L H >< S+ 0 0 0 -4,-2.7 3,-1.1 1,-0.3 7,-0.2 0.855 101.2 63.2 -63.0 -33.3 18.5 -15.0 -43.4 256 265 A A H 3< S+ 0 0 7 -4,-2.4 118,-0.3 1,-0.2 -1,-0.3 0.749 107.9 45.7 -55.0 -24.7 15.5 -15.3 -45.8 257 266 A K H << S+ 0 0 127 -3,-1.8 -1,-0.2 -4,-0.5 -2,-0.2 0.469 108.7 55.4-102.5 -5.3 16.2 -11.6 -46.5 258 267 A S XX + 0 0 14 -3,-1.1 4,-1.8 -4,-0.5 3,-0.5 -0.688 46.9 174.0-137.2 89.8 19.9 -11.5 -47.0 259 268 A P H 3> S+ 0 0 57 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.832 85.0 58.8 -54.4 -37.1 21.6 -13.8 -49.6 260 269 A E H 3> S+ 0 0 131 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.867 104.7 48.9 -67.6 -36.3 25.0 -12.2 -48.9 261 270 A H H <> S+ 0 0 24 -3,-0.5 4,-1.3 2,-0.2 -1,-0.2 0.892 111.1 51.6 -66.7 -40.4 24.9 -13.1 -45.2 262 271 A R H >X S+ 0 0 5 -4,-1.8 4,-2.3 -7,-0.2 3,-0.9 0.980 109.8 47.8 -56.0 -57.6 24.0 -16.7 -46.2 263 272 A Q H 3X S+ 0 0 76 -4,-2.8 4,-2.6 1,-0.3 5,-0.3 0.806 103.8 62.4 -58.0 -31.7 26.9 -16.9 -48.7 264 273 A E H 3X S+ 0 0 58 -4,-1.7 4,-1.8 1,-0.2 -1,-0.3 0.916 110.9 38.5 -57.9 -42.9 29.3 -15.6 -46.0 265 274 A L H << S+ 0 0 2 -4,-1.3 -2,-0.2 -3,-0.9 -1,-0.2 0.847 114.2 54.0 -79.0 -35.1 28.5 -18.6 -43.9 266 275 A I H < S+ 0 0 55 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.892 114.9 40.8 -64.3 -39.7 28.4 -21.0 -46.7 267 276 A E H < S+ 0 0 125 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.864 129.9 25.6 -80.4 -37.7 31.8 -20.0 -47.9 268 277 A R >< + 0 0 132 -4,-1.8 3,-2.0 -5,-0.3 -1,-0.3 -0.724 64.6 174.6-128.0 84.0 33.5 -19.7 -44.5 269 278 A P G > S+ 0 0 54 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.674 74.4 74.5 -62.0 -20.2 31.7 -22.0 -42.0 270 279 A E G 3 S+ 0 0 131 1,-0.3 4,-0.4 2,-0.2 -5,-0.1 0.661 89.2 61.1 -68.3 -13.4 34.3 -21.1 -39.4 271 280 A R G <> S+ 0 0 94 -3,-2.0 4,-2.5 -7,-0.2 -1,-0.3 0.557 80.1 90.1 -82.7 -11.8 32.6 -17.7 -39.2 272 281 A I H <> S+ 0 0 5 -3,-1.7 4,-2.8 1,-0.2 -1,-0.2 0.875 81.6 52.7 -58.4 -43.5 29.3 -19.5 -38.1 273 282 A P H > S+ 0 0 64 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.929 113.1 44.3 -59.4 -43.6 30.0 -19.3 -34.3 274 283 A A H > S+ 0 0 50 -4,-0.4 4,-2.1 1,-0.2 -2,-0.2 0.880 112.7 52.4 -64.9 -39.6 30.7 -15.5 -34.5 275 284 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.888 104.6 56.6 -61.9 -41.0 27.6 -15.1 -36.7 276 285 A C H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.935 108.0 48.2 -52.6 -50.2 25.6 -17.0 -34.1 277 286 A E H X S+ 0 0 41 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.909 111.2 49.7 -55.4 -46.5 26.7 -14.4 -31.5 278 287 A E H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.894 111.9 46.9 -66.4 -38.8 25.8 -11.5 -33.7 279 288 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.869 109.0 55.6 -69.6 -36.8 22.3 -12.9 -34.5 280 289 A L H < S+ 0 0 4 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.871 112.5 44.5 -59.3 -37.5 21.9 -13.6 -30.8 281 290 A R H >< S+ 0 0 0 -4,-1.9 3,-1.2 2,-0.2 -2,-0.2 0.964 117.6 40.5 -68.8 -57.2 22.6 -9.8 -30.3 282 291 A R H 3< S+ 0 0 19 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.831 126.4 35.7 -65.5 -34.5 20.5 -8.4 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19.4-162.8 -75.4 125.9 13.7 -3.8 -5.0 293 302 A T S S- 0 0 55 -222,-2.1 2,-0.3 -2,-0.4 -1,-0.1 0.586 73.3 -7.2 -83.8 -13.2 14.6 -5.2 -1.6 294 303 A S S S- 0 0 44 -223,-0.4 2,-0.2 10,-0.1 -1,-0.1 -0.970 94.9 -62.0-164.4 172.0 14.7 -1.8 -0.1 295 304 A D + 0 0 96 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.528 63.8 170.6 -63.4 133.1 14.6 2.0 -0.9 296 305 A Y E -J 303 0E 59 7,-2.2 7,-2.7 -2,-0.2 2,-0.6 -0.986 35.8-137.2-153.3 133.3 17.5 2.6 -3.1 297 306 A E E -J 302 0E 118 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.863 27.8-176.8 -94.2 119.8 18.8 5.5 -5.2 298 307 A F E > -J 301 0E 3 3,-2.5 3,-1.6 -2,-0.6 -2,-0.0 -0.957 66.7 -23.9-126.7 112.4 20.0 4.2 -8.5 299 308 A H T 3 S- 0 0 80 -2,-0.5 -1,-0.2 1,-0.3 -255,-0.1 0.934 127.6 -48.7 47.7 51.7 21.6 6.6 -11.1 300 309 A G T 3 S+ 0 0 63 1,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.416 114.6 116.0 79.3 -1.7 19.8 9.5 -9.6 301 310 A V E < -J 298 0E 15 -3,-1.6 -3,-2.5 -292,-0.0 2,-0.7 -0.887 65.2-129.1-106.7 129.2 16.4 7.9 -9.5 302 311 A Q E -J 297 0E 98 -2,-0.5 2,-0.4 -5,-0.2 -5,-0.2 -0.649 26.8-169.1 -76.4 109.8 14.6 7.1 -6.2 303 312 A L E -J 296 0E 0 -7,-2.7 -7,-2.2 -2,-0.7 2,-0.3 -0.830 9.9-143.5 -98.4 140.1 13.5 3.5 -6.2 304 313 A K > - 0 0 101 -2,-0.4 3,-2.7 -9,-0.2 -12,-0.3 -0.809 28.6 -90.7-107.5 147.3 11.1 2.3 -3.5 305 314 A K T 3 S+ 0 0 151 -2,-0.3 -12,-0.2 1,-0.3 3,-0.1 -0.201 114.9 21.7 -50.9 133.1 11.0 -1.1 -1.7 306 315 A G T 3 S+ 0 0 22 -14,-2.6 -1,-0.3 1,-0.3 2,-0.2 0.339 88.0 138.1 86.2 -8.5 8.8 -3.5 -3.6 307 316 A D < - 0 0 14 -3,-2.7 -15,-2.6 -13,-0.1 -1,-0.3 -0.508 48.9-135.9 -63.2 135.2 9.1 -1.6 -6.9 308 317 A Q E - E 0 291A 5 -256,-0.3 -254,-2.6 -17,-0.2 2,-0.4 -0.720 17.1-162.7 -89.7 148.7 9.5 -4.0 -9.8 309 318 A I E -cE 54 290A 0 -19,-2.7 -19,-2.2 -2,-0.3 2,-0.4 -0.978 11.8-143.7-135.7 122.6 12.1 -3.2 -12.5 310 319 A L E -cE 55 289A 0 -256,-3.1 -254,-2.0 -2,-0.4 -21,-0.3 -0.706 13.5-172.4 -81.2 130.1 12.2 -4.7 -15.9 311 320 A L - 0 0 0 -23,-2.4 -23,-0.5 -2,-0.4 2,-0.4 -0.751 17.7-149.2-125.7 78.6 15.8 -5.2 -17.0 312 321 A P >> - 0 0 0 0, 0.0 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