==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 15-JUL-12 4G3R . COMPND 2 MOLECULE: CAMPHOR 5-MONOOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR Y.MADRONA,S.M.TRIPATHI,H.LI,T.L.POULOS . 812 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33824.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 549 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 64 7.9 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 . 4 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 . 34 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 109 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 299 36.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.0 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 1 8 0 0 4 1 5 2 0 2 1 3 0 1 0 0 2 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 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 . 2 8 4 4 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 . 6 2 0 0 2 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 8 A N > 0 0 151 0, 0.0 3,-1.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 160.3 4.6 -15.1 69.3 2 9 A A T 3 + 0 0 99 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.590 360.0 69.7 -79.0 -10.9 8.0 -16.9 69.1 3 10 A N T 3 S+ 0 0 121 2,-0.1 2,-0.6 1,-0.0 49,-0.4 0.321 82.2 91.2 -87.8 8.0 9.4 -14.4 66.5 4 11 A L S < S- 0 0 43 -3,-1.0 47,-0.2 47,-0.1 3,-0.1 -0.910 71.5-139.1-114.3 113.3 9.5 -11.6 69.1 5 12 A A - 0 0 31 45,-2.6 -2,-0.1 -2,-0.6 49,-0.0 -0.408 41.0 -92.5 -63.6 141.5 12.6 -11.0 71.2 6 13 A P - 0 0 120 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.316 48.4-102.0 -58.5 135.7 11.8 -10.2 74.8 7 14 A L - 0 0 46 -3,-0.1 6,-0.1 1,-0.1 43,-0.0 -0.415 37.2-119.4 -63.6 125.2 11.5 -6.4 75.4 8 15 A P > - 0 0 34 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 -0.285 21.6-114.9 -59.9 150.9 14.7 -5.0 77.0 9 16 A P T 3 S+ 0 0 138 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.829 113.2 54.7 -54.3 -36.2 14.2 -3.3 80.4 10 17 A H T 3 S+ 0 0 61 2,-0.1 294,-0.2 1,-0.0 -3,-0.0 0.585 87.9 89.7 -83.5 -8.4 15.1 0.1 79.0 11 18 A V S < S- 0 0 1 -3,-1.2 5,-0.1 292,-0.1 294,-0.0 -0.800 81.6-120.0 -95.5 120.2 12.6 0.2 76.2 12 19 A P > - 0 0 39 0, 0.0 3,-1.3 0, 0.0 4,-0.1 -0.290 12.9-136.0 -60.1 134.7 9.1 1.7 77.1 13 20 A E G > S+ 0 0 143 1,-0.3 3,-1.5 2,-0.2 35,-0.1 0.841 101.4 58.9 -60.2 -39.6 6.2 -0.6 76.6 14 21 A H G 3 S+ 0 0 152 1,-0.3 -1,-0.3 33,-0.0 -3,-0.0 0.614 98.5 61.5 -69.1 -12.0 4.0 1.9 74.9 15 22 A L G < S+ 0 0 13 -3,-1.3 33,-2.7 32,-0.1 -1,-0.3 0.401 75.8 118.6 -95.1 0.9 6.6 2.4 72.1 16 23 A V B < +a 48 0A 40 -3,-1.5 2,-0.3 31,-0.2 33,-0.2 -0.508 27.1 160.5 -73.4 131.7 6.4 -1.2 71.0 17 24 A F - 0 0 63 31,-2.8 2,-2.3 -2,-0.3 30,-0.1 -0.805 33.6-141.8-150.3 104.3 5.2 -1.7 67.4 18 25 A D + 0 0 65 -2,-0.3 2,-0.4 31,-0.2 31,-0.1 -0.426 33.0 167.1 -78.1 76.0 6.2 -5.1 66.0 19 26 A F - 0 0 8 -2,-2.3 2,-0.6 32,-0.1 32,-0.3 -0.738 23.4-154.0 -86.3 135.2 7.1 -4.2 62.4 20 27 A D > - 0 0 42 -2,-0.4 3,-1.0 1,-0.1 -2,-0.0 -0.911 3.0-163.9-112.1 105.7 9.0 -6.9 60.5 21 28 A M T 3 S+ 0 0 0 -2,-0.6 -1,-0.1 1,-0.3 14,-0.0 0.693 89.0 48.3 -64.8 -19.7 11.1 -5.3 57.7 22 29 A Y T 3 S+ 0 0 45 1,-0.2 364,-0.6 365,-0.0 -1,-0.3 0.638 130.8 15.6 -96.6 -15.8 11.5 -8.6 55.8 23 30 A N S < S- 0 0 106 -3,-1.0 -1,-0.2 362,-0.1 -2,-0.2 -0.409 79.1-170.4-154.2 74.1 7.9 -9.6 55.9 24 31 A P > - 0 0 2 0, 0.0 3,-1.6 0, 0.0 11,-0.1 -0.402 28.4-122.5 -72.1 143.6 5.6 -6.7 56.8 25 32 A S T 3 S+ 0 0 121 1,-0.3 3,-0.4 2,-0.1 9,-0.1 0.803 107.2 49.0 -57.8 -38.2 1.9 -7.4 57.5 26 33 A N T > S+ 0 0 58 8,-0.3 3,-1.9 1,-0.2 -1,-0.3 0.131 72.2 126.3 -92.9 24.9 0.4 -5.2 54.8 27 34 A L G X + 0 0 32 -3,-1.6 3,-2.0 1,-0.3 357,-0.2 0.793 62.1 64.6 -52.0 -37.1 2.6 -6.4 52.0 28 35 A S G 3 S+ 0 0 117 -3,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.725 95.4 58.8 -63.7 -23.1 -0.2 -7.3 49.7 29 36 A A G < S- 0 0 49 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.491 131.5 -72.4 -82.6 -3.1 -1.3 -3.7 49.4 30 37 A G <> - 0 0 8 -3,-2.0 4,-2.2 -4,-0.2 -1,-0.3 -0.130 41.0-101.6 115.4 142.3 2.2 -2.8 48.0 31 38 A V H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.881 122.4 48.5 -66.7 -39.2 5.5 -2.7 49.8 32 39 A Q H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.938 114.2 47.7 -63.8 -45.3 5.6 1.1 50.1 33 40 A E H > S+ 0 0 57 1,-0.2 4,-0.5 2,-0.2 -2,-0.2 0.839 108.9 55.8 -59.9 -36.2 2.0 1.0 51.4 34 41 A A H >< S+ 0 0 0 -4,-2.2 3,-0.6 1,-0.2 -8,-0.3 0.878 111.2 41.7 -65.8 -40.1 3.1 -1.8 53.8 35 42 A W H >< S+ 0 0 0 -4,-2.0 3,-1.9 1,-0.2 -1,-0.2 0.778 102.6 71.4 -75.7 -26.9 5.9 0.4 55.3 36 43 A A H >< S+ 0 0 21 -4,-1.8 3,-2.2 1,-0.3 -1,-0.2 0.665 76.5 78.4 -66.2 -17.1 3.5 3.4 55.3 37 44 A V G X< S+ 0 0 15 -3,-0.6 3,-1.0 -4,-0.5 -1,-0.3 0.710 82.2 68.9 -63.1 -17.4 1.5 1.8 58.1 38 45 A L G < S+ 0 0 0 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.579 99.8 48.6 -74.6 -10.1 4.4 3.1 60.3 39 46 A Q G < S+ 0 0 22 -3,-2.2 -1,-0.2 -4,-0.1 -2,-0.2 0.204 84.2 120.4-115.7 13.4 3.1 6.6 59.6 40 47 A E S X S- 0 0 113 -3,-1.0 3,-1.5 1,-0.2 -3,-0.0 -0.239 78.0 -72.7 -69.7 167.0 -0.6 6.0 60.3 41 48 A S T 3 S+ 0 0 99 1,-0.2 -1,-0.2 0, 0.0 -2,-0.0 -0.270 119.2 24.6 -61.2 148.2 -2.3 8.1 63.0 42 49 A N T 3 S+ 0 0 167 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.426 90.5 121.5 73.8 1.4 -1.4 7.2 66.6 43 50 A V < - 0 0 20 -3,-1.5 -1,-0.2 1,-0.0 -28,-0.1 -0.870 61.9-125.5 -96.3 125.1 2.0 5.8 65.6 44 51 A P - 0 0 48 0, 0.0 3,-0.2 0, 0.0 15,-0.1 -0.028 17.3-111.1 -65.3 167.0 4.9 7.6 67.3 45 52 A D S S+ 0 0 48 1,-0.2 14,-2.5 13,-0.1 15,-0.7 0.765 108.3 28.8 -67.1 -27.6 8.0 9.2 65.7 46 53 A L E S+ B 0 58A 6 12,-0.2 -1,-0.2 13,-0.1 2,-0.2 -0.957 76.2 173.1-142.7 114.7 10.2 6.5 67.1 47 54 A V E - B 0 57A 0 10,-2.3 10,-2.5 -2,-0.4 2,-0.5 -0.700 25.9-128.3-118.3 170.0 9.1 3.0 67.9 48 55 A W E -aB 16 56A 11 -33,-2.7 -31,-2.8 8,-0.2 2,-0.4 -0.985 17.2-160.9-118.2 126.7 10.6 -0.3 69.0 49 56 A T E - B 0 55A 0 6,-2.7 6,-2.0 -2,-0.5 -31,-0.2 -0.862 13.1-156.5-102.3 142.3 10.0 -3.6 67.1 50 57 A R > + 0 0 76 -2,-0.4 -45,-2.6 4,-0.2 3,-0.6 0.460 66.0 104.5 -91.7 -3.3 10.6 -6.9 68.8 51 58 A C G > S+ 0 0 13 -32,-0.3 3,-2.2 1,-0.2 -47,-0.1 -0.352 77.5 18.2 -72.7 156.9 11.0 -8.5 65.3 52 59 A N G 3 S- 0 0 48 -49,-0.4 31,-0.3 1,-0.3 -1,-0.2 0.797 141.7 -45.6 54.6 36.2 14.4 -9.5 63.9 53 60 A G G < S- 0 0 58 -3,-0.6 -1,-0.3 -50,-0.3 -2,-0.2 0.233 104.8 -73.1 94.4 -13.5 16.2 -9.4 67.2 54 61 A G < + 0 0 5 -3,-2.2 256,-0.3 1,-0.1 2,-0.3 0.556 64.6 161.3 94.4 121.1 14.7 -6.2 68.4 55 62 A H E -B 49 0A 1 -6,-2.0 -6,-2.7 -4,-0.1 256,-0.2 -0.991 36.9 -98.1-163.2 159.8 15.5 -2.6 67.2 56 63 A W E -Bc 48 311A 0 254,-2.7 256,-3.1 -2,-0.3 2,-0.4 -0.489 29.3-160.0 -77.8 153.1 14.4 1.0 67.0 57 64 A I E -Bc 47 312A 0 -10,-2.5 -10,-2.3 254,-0.2 2,-0.6 -0.963 10.6-148.0-134.4 123.2 12.7 2.4 63.9 58 65 A A E -B 46 0A 0 254,-2.1 -12,-0.2 -2,-0.4 259,-0.1 -0.795 15.1-172.1 -84.2 123.4 12.4 6.1 63.1 59 66 A T + 0 0 0 -14,-2.5 2,-0.3 -2,-0.6 -13,-0.1 0.520 56.9 62.8 -99.3 -8.0 9.1 6.5 61.2 60 67 A R S > S- 0 0 8 -15,-0.7 4,-2.2 1,-0.1 3,-0.4 -0.906 78.6-122.7-125.1 150.6 9.3 10.1 60.1 61 68 A G H > S+ 0 0 0 257,-0.3 4,-2.7 -2,-0.3 5,-0.3 0.819 107.2 63.5 -55.5 -37.3 11.6 12.1 57.8 62 69 A Q H > S+ 0 0 100 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.932 111.7 34.3 -54.9 -51.7 12.6 14.5 60.5 63 70 A L H > S+ 0 0 0 -3,-0.4 4,-2.5 2,-0.2 5,-0.3 0.866 115.3 56.6 -72.8 -40.1 14.2 11.9 62.7 64 71 A I H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.920 111.6 44.2 -57.2 -44.4 15.6 9.8 59.8 65 72 A R H X S+ 0 0 57 -4,-2.7 4,-1.2 -5,-0.2 -2,-0.2 0.916 113.1 49.8 -67.7 -45.5 17.4 12.9 58.5 66 73 A E H X S+ 0 0 69 -4,-1.8 4,-1.4 -5,-0.3 3,-0.2 0.898 111.0 48.8 -61.7 -43.5 18.8 14.0 61.9 67 74 A A H < S+ 0 0 0 -4,-2.5 3,-0.4 1,-0.2 7,-0.3 0.921 107.7 53.9 -65.7 -43.4 20.1 10.6 62.8 68 75 A Y H < S+ 0 0 7 -4,-1.7 279,-0.5 -5,-0.3 -1,-0.2 0.788 110.0 49.6 -61.6 -26.7 21.9 10.2 59.4 69 76 A E H < S+ 0 0 109 -4,-1.2 2,-1.3 -3,-0.2 -1,-0.2 0.778 99.4 70.4 -78.9 -30.0 23.6 13.5 60.0 70 77 A D >X + 0 0 42 -4,-1.4 4,-2.6 -3,-0.4 3,-0.6 -0.580 52.7 158.5 -93.4 75.7 24.7 12.6 63.5 71 78 A Y T 34 + 0 0 57 -2,-1.3 -1,-0.2 1,-0.2 5,-0.1 0.727 67.2 67.3 -70.9 -20.9 27.4 9.9 62.9 72 79 A R T 34 S+ 0 0 139 -3,-0.2 -1,-0.2 1,-0.2 3,-0.2 0.855 116.9 24.8 -68.7 -33.4 29.0 10.4 66.3 73 80 A H T <4 S+ 0 0 46 -3,-0.6 222,-1.9 1,-0.2 2,-0.7 0.781 126.4 49.9 -95.1 -36.1 25.9 9.0 68.0 74 81 A F E < S-D 294 0A 1 -4,-2.6 220,-0.2 -7,-0.3 -1,-0.2 -0.839 80.6-161.5-111.5 96.7 24.6 6.8 65.1 75 82 A S E > -D 293 0A 4 218,-3.1 218,-2.4 -2,-0.7 3,-0.5 -0.493 23.9-150.6 -85.2 145.2 27.5 4.7 63.7 76 83 A S T 3 S+ 0 0 1 216,-0.2 -1,-0.1 1,-0.2 20,-0.1 0.428 78.2 98.8 -85.3 -2.7 27.6 3.0 60.3 77 84 A E T 3 S+ 0 0 113 1,-0.3 -1,-0.2 216,-0.2 18,-0.1 0.834 96.4 24.9 -55.2 -37.2 29.8 0.3 61.8 78 85 A C S < S+ 0 0 8 -3,-0.5 -1,-0.3 1,-0.1 8,-0.2 -0.738 78.1 154.7-129.6 81.4 26.8 -2.0 62.2 79 86 A P + 0 0 2 0, 0.0 212,-2.1 0, 0.0 2,-0.4 0.482 44.1 79.5 -94.3 -7.2 24.3 -0.8 59.6 80 87 A F S S- 0 0 18 210,-0.2 6,-0.8 3,-0.1 7,-0.1 -0.863 74.6-111.3-110.9 139.4 22.2 -3.9 58.9 81 88 A I S S+ 0 0 4 -2,-0.4 2,-0.2 4,-0.1 307,-0.1 -0.896 92.4 53.4 -92.8 134.4 19.3 -5.5 60.7 82 89 A P S >> S- 0 0 29 0, 0.0 4,-2.1 0, 0.0 3,-0.6 0.533 89.3-123.4 -80.3 176.7 19.6 -8.2 62.1 83 90 A R H 3> S+ 0 0 84 -31,-0.3 4,-2.4 1,-0.2 5,-0.2 0.851 108.8 55.7 -55.9 -43.0 22.6 -7.8 64.4 84 91 A E H 3> S+ 0 0 129 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.863 109.8 47.8 -60.2 -38.3 24.6 -10.7 63.0 85 92 A A H <> S+ 0 0 9 -3,-0.6 4,-1.9 2,-0.2 -1,-0.2 0.937 111.0 50.3 -64.7 -48.9 24.3 -9.2 59.6 86 93 A G H < S+ 0 0 0 -4,-2.1 -2,-0.2 -6,-0.8 -1,-0.2 0.843 110.4 50.1 -60.8 -35.4 25.3 -5.8 60.8 87 94 A E H < S+ 0 0 132 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.849 112.2 45.7 -72.9 -35.5 28.4 -7.2 62.6 88 95 A A H < S+ 0 0 21 -4,-1.5 2,-0.4 -5,-0.2 -2,-0.2 0.780 89.6 103.2 -75.2 -28.5 29.6 -9.2 59.5 89 96 A Y < + 0 0 11 -4,-1.9 -9,-0.1 1,-0.2 98,-0.0 -0.405 33.2 149.7 -60.6 113.3 29.0 -6.1 57.3 90 97 A D + 0 0 40 -2,-0.4 -1,-0.2 -12,-0.1 143,-0.1 0.158 17.1 148.7-133.7 19.4 32.4 -4.6 56.6 91 98 A F > - 0 0 4 1,-0.1 4,-2.4 3,-0.1 143,-0.2 -0.131 49.0 -90.8 -54.7 150.2 31.9 -3.1 53.2 92 99 A I T 4 S- 0 0 0 141,-1.6 145,-0.2 1,-0.2 -1,-0.1 -0.950 96.6 -2.8-117.5 133.4 33.9 0.1 52.4 93 100 A P T >4 S+ 0 0 6 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 -0.978 124.3 65.7 -94.9 7.2 33.2 2.9 52.8 94 101 A T T 34 S+ 0 0 27 1,-0.3 -2,-0.2 140,-0.1 -3,-0.1 0.783 98.1 53.4 -63.8 -33.0 29.7 2.2 54.1 95 102 A S T 3< S+ 0 0 14 -4,-2.4 2,-0.3 -18,-0.1 -1,-0.3 0.332 101.3 80.6 -84.8 9.4 30.7 0.4 57.3 96 103 A M < - 0 0 9 -3,-1.8 -6,-0.0 -5,-0.1 -5,-0.0 -0.893 65.7-146.9-118.9 146.9 32.9 3.4 58.3 97 104 A D > - 0 0 30 -2,-0.3 4,-1.3 1,-0.1 3,-0.4 -0.689 42.2 -61.8 -98.1 158.3 32.2 6.8 59.8 98 105 A P T 4 S+ 0 0 5 0, 0.0 -1,-0.1 0, 0.0 249,-0.0 -0.455 112.0 38.9 -61.4 153.2 34.0 10.0 59.1 99 106 A P T >4 S+ 0 0 96 0, 0.0 3,-0.7 0, 0.0 4,-0.5 -0.969 128.3 36.9 -78.3 -21.1 36.8 11.0 59.4 100 107 A E T 34 S+ 0 0 39 -3,-0.4 4,-0.4 1,-0.2 3,-0.2 0.708 111.0 64.1 -67.4 -20.7 38.2 7.6 58.4 101 108 A Q T >X S+ 0 0 1 -4,-1.3 4,-1.3 1,-0.2 3,-1.1 0.889 87.1 69.0 -66.1 -42.2 35.4 7.0 55.8 102 109 A R H <> S+ 0 0 129 -3,-0.7 4,-1.9 1,-0.3 5,-0.2 0.801 88.7 58.0 -59.0 -43.9 36.2 9.9 53.4 103 110 A Q H 3> S+ 0 0 35 -4,-0.5 4,-0.8 1,-0.2 119,-0.3 0.835 111.9 44.1 -56.4 -34.3 39.5 8.8 51.9 104 111 A F H <> S+ 0 0 0 -3,-1.1 4,-2.0 -4,-0.4 -1,-0.2 0.805 107.3 59.4 -80.7 -29.7 37.9 5.6 50.6 105 112 A R H X S+ 0 0 59 -4,-1.3 4,-2.6 1,-0.2 -2,-0.2 0.854 101.1 54.7 -68.5 -35.5 34.8 7.4 49.4 106 113 A A H X S+ 0 0 54 -4,-1.9 4,-1.0 2,-0.2 -1,-0.2 0.868 108.3 49.5 -65.1 -36.7 36.8 9.6 47.0 107 114 A L H X S+ 0 0 5 -4,-0.8 4,-0.8 -5,-0.2 3,-0.3 0.909 113.3 45.2 -69.1 -42.7 38.3 6.4 45.5 108 115 A A H >X S+ 0 0 2 -4,-2.0 4,-1.2 1,-0.2 3,-0.8 0.882 107.7 58.2 -67.8 -38.0 34.9 4.8 45.0 109 116 A N H 3X S+ 0 0 73 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.787 100.0 60.7 -62.6 -26.0 33.4 8.1 43.6 110 117 A Q H 3< S+ 0 0 127 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.2 0.841 106.4 44.1 -68.1 -33.8 36.1 8.0 40.9 111 118 A V H << S+ 0 0 7 -3,-0.8 -2,-0.2 -4,-0.8 -1,-0.2 0.670 129.7 20.1 -92.3 -17.3 34.9 4.6 39.5 112 119 A V H < S+ 0 0 10 -4,-1.2 243,-0.3 100,-0.1 -2,-0.2 0.335 97.5 114.3-129.3 5.6 31.1 5.2 39.4 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27.6 -2.7 35.6 157 164 A M H <>S+ 0 0 1 -4,-2.7 5,-2.6 1,-0.2 4,-0.4 0.804 109.0 50.7 -61.9 -29.5 29.4 -5.9 34.5 158 165 A L H ><5S+ 0 0 74 -4,-1.6 3,-0.8 -5,-0.2 -1,-0.2 0.927 110.9 47.7 -68.7 -48.5 30.7 -3.9 31.6 159 166 A L H 3<5S+ 0 0 19 -4,-2.0 53,-2.5 1,-0.2 -2,-0.2 0.889 115.4 45.1 -56.7 -42.2 31.9 -1.1 33.9 160 167 A A T 3<5S- 0 0 2 -4,-2.8 53,-0.3 51,-0.2 -1,-0.2 0.487 108.9-121.8 -85.9 -4.8 33.5 -3.7 36.3 161 168 A G T < 5 + 0 0 32 -3,-0.8 -3,-0.2 -4,-0.4 -4,-0.1 0.844 63.8 142.0 66.3 36.0 35.1 -5.7 33.5 162 169 A L < - 0 0 12 -5,-2.6 -1,-0.2 -6,-0.2 2,-0.1 -0.866 56.1-105.1-113.9 144.6 33.3 -8.9 34.5 163 170 A P > - 0 0 62 0, 0.0 3,-1.8 0, 0.0 4,-0.2 -0.433 20.7-135.5 -67.1 135.7 31.8 -11.7 32.3 164 171 A E G > S+ 0 0 106 1,-0.3 3,-1.4 2,-0.2 -6,-0.0 0.701 100.0 72.4 -67.1 -21.1 28.0 -11.7 32.1 165 172 A E G 3 S+ 0 0 167 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.666 90.3 61.6 -68.8 -14.9 27.9 -15.5 32.6 166 173 A D G X> S+ 0 0 45 -3,-1.8 4,-2.2 1,-0.2 3,-0.7 0.644 79.1 91.3 -80.8 -17.9 28.8 -14.7 36.2 167 174 A I H <> S+ 0 0 28 -3,-1.4 4,-3.4 -4,-0.2 5,-0.3 0.869 78.5 55.7 -47.8 -50.7 25.6 -12.7 36.7 168 175 A P H 3> S+ 0 0 94 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.887 113.2 42.2 -55.5 -39.9 23.4 -15.6 38.0 169 176 A H H <> S+ 0 0 105 -3,-0.7 4,-1.9 -4,-0.3 -2,-0.2 0.965 119.0 42.7 -67.1 -53.5 25.9 -16.5 40.8 170 177 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.879 112.3 53.8 -62.9 -41.8 26.6 -12.9 41.8 171 178 A K H X S+ 0 0 18 -4,-3.4 4,-2.1 -5,-0.3 -1,-0.2 0.901 107.9 50.5 -59.9 -44.2 22.9 -11.8 41.6 172 179 A Y H X S+ 0 0 84 -4,-1.5 4,-1.1 -5,-0.3 -1,-0.2 0.900 110.2 51.1 -59.9 -42.3 21.9 -14.7 43.9 173 180 A L H X S+ 0 0 1 -4,-1.9 4,-0.6 1,-0.2 3,-0.4 0.922 110.2 47.1 -62.7 -46.2 24.6 -13.6 46.4 174 181 A T H >X S+ 0 0 0 -4,-2.4 3,-1.0 1,-0.2 4,-0.9 0.891 108.6 55.7 -64.0 -39.4 23.6 -10.0 46.5 175 182 A D H 3X S+ 0 0 26 -4,-2.1 4,-2.7 1,-0.3 -1,-0.2 0.766 101.7 57.4 -66.3 -25.7 19.9 -10.9 46.9 176 183 A Q H 3< S+ 0 0 11 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.699 105.2 52.2 -75.3 -18.8 20.8 -13.0 50.0 177 184 A M H << S+ 0 0 5 -3,-1.0 -2,-0.2 -4,-0.6 -1,-0.2 0.689 123.2 27.1 -86.7 -20.2 22.3 -9.9 51.6 178 185 A T H < S+ 0 0 3 -4,-0.9 210,-1.9 -3,-0.1 211,-0.3 0.784 140.8 10.7-111.9 -43.6 19.1 -7.8 51.0 179 186 A R S < S- 0 0 24 -4,-2.7 -2,-0.1 208,-0.2 -1,-0.1 -0.499 79.7-161.3-136.9 67.7 16.2 -10.2 50.9 180 187 A P - 0 0 57 0, 0.0 -4,-0.1 0, 0.0 5,-0.1 -0.215 13.2-156.5 -58.7 134.3 17.5 -13.6 52.2 181 188 A D - 0 0 110 3,-0.0 -5,-0.1 0, 0.0 -6,-0.0 0.576 52.5 -99.9 -84.2 -12.7 15.3 -16.6 51.3 182 189 A G S S+ 0 0 67 2,-0.4 3,-0.1 -6,-0.1 -6,-0.0 0.045 103.4 98.7 118.9 -23.2 16.8 -18.5 54.2 183 190 A S S S+ 0 0 71 1,-0.1 2,-0.4 2,-0.0 -7,-0.0 0.730 89.6 31.8 -68.3 -21.6 19.4 -20.6 52.4 184 191 A M - 0 0 48 -8,-0.1 -2,-0.4 4,-0.0 -1,-0.1 -0.996 69.4-137.9-143.8 136.4 22.2 -18.3 53.2 185 192 A T > - 0 0 74 -2,-0.4 4,-2.1 1,-0.1 5,-0.2 -0.370 36.5-108.6 -77.1 165.6 23.2 -15.9 56.1 186 193 A F H > S+ 0 0 17 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.890 120.7 55.4 -60.3 -39.3 24.7 -12.5 55.3 187 194 A A H > S+ 0 0 47 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.902 108.8 45.3 -62.3 -43.2 28.0 -13.8 56.5 188 195 A E H > S+ 0 0 96 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.897 113.7 49.5 -68.7 -39.8 28.0 -16.7 54.1 189 196 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.906 112.7 47.1 -65.5 -43.2 26.9 -14.6 51.2 190 197 A K H X S+ 0 0 30 -4,-2.6 4,-3.2 2,-0.2 5,-0.2 0.928 110.4 51.5 -63.6 -48.4 29.6 -11.9 51.9 191 198 A E H X S+ 0 0 138 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.869 111.8 48.0 -57.2 -39.1 32.4 -14.5 52.3 192 199 A A H X S+ 0 0 21 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.843 111.0 50.5 -70.4 -36.1 31.4 -16.1 48.9 193 200 A L H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.922 112.9 46.2 -66.5 -44.2 31.3 -12.6 47.3 194 201 A Y H X S+ 0 0 13 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.881 108.2 57.1 -62.9 -38.1 34.8 -12.0 48.7 195 202 A D H < S+ 0 0 118 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.847 107.1 49.6 -61.8 -34.9 35.8 -15.5 47.5 196 203 A Y H X S+ 0 0 33 -4,-1.5 4,-0.5 1,-0.2 -1,-0.2 0.913 114.1 44.2 -66.7 -44.4 34.8 -14.4 44.0 197 204 A L H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 3,-0.5 0.814 93.3 79.6 -74.8 -34.4 36.8 -11.2 44.1 198 205 A I H X S+ 0 0 91 -4,-2.2 4,-1.9 1,-0.3 -1,-0.2 0.854 98.1 37.0 -49.2 -54.0 40.1 -12.3 45.6 199 206 A P H > S+ 0 0 80 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.796 116.8 54.4 -75.1 -21.7 41.9 -13.8 42.7 200 207 A I H X S+ 0 0 20 -4,-0.5 4,-1.4 -3,-0.5 -2,-0.2 0.883 109.0 48.2 -72.2 -39.1 40.4 -11.2 40.3 201 208 A I H < S+ 0 0 3 -4,-2.7 4,-0.4 2,-0.2 -1,-0.2 0.885 112.5 48.6 -67.4 -38.9 41.8 -8.4 42.5 202 209 A E H >X S+ 0 0 91 -4,-1.9 3,-1.0 -5,-0.3 4,-0.6 0.927 111.9 47.8 -67.0 -45.4 45.2 -10.1 42.7 203 210 A Q H 3X S+ 0 0 108 -4,-2.0 4,-2.2 1,-0.2 3,-0.2 0.782 111.4 51.1 -68.3 -26.9 45.5 -10.6 38.9 204 211 A R H 3< S+ 0 0 35 -4,-1.4 5,-0.3 1,-0.2 -1,-0.2 0.453 103.4 58.8 -92.9 -0.3 44.4 -7.0 38.2 205 212 A R H <4 S+ 0 0 78 -3,-1.0 -1,-0.2 -4,-0.4 -2,-0.2 0.519 112.6 40.7 -93.9 -13.2 47.1 -5.7 40.6 206 213 A Q H < S+ 0 0 127 -4,-0.6 -2,-0.2 -3,-0.2 -3,-0.1 0.821 131.0 25.3 -96.4 -47.4 49.7 -7.5 38.4 207 214 A K S < S- 0 0 176 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.1 -0.814 88.9-156.1-116.9 87.8 48.2 -6.6 35.1 208 215 A P - 0 0 85 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.268 13.2-176.3 -64.5 148.0 46.1 -3.4 35.6 209 216 A G - 0 0 34 -5,-0.3 -48,-0.0 2,-0.2 -5,-0.0 -0.390 38.5-104.1-123.2-158.2 43.2 -2.5 33.3 210 217 A T S S+ 0 0 128 -2,-0.2 2,-0.1 4,-0.1 -49,-0.1 0.340 80.7 110.6-116.0 1.7 40.8 0.4 32.9 211 218 A D S > S- 0 0 27 -51,-0.1 4,-2.1 1,-0.1 3,-0.5 -0.367 85.0-103.7 -74.7 158.8 37.8 -1.4 34.5 212 219 A A H > S+ 0 0 8 -53,-2.5 4,-2.0 1,-0.2 5,-0.2 0.790 120.9 54.4 -53.8 -34.2 36.4 -0.3 37.8 213 220 A I H > S+ 0 0 7 -53,-0.3 4,-2.5 -54,-0.2 -1,-0.2 0.909 108.9 47.1 -70.2 -41.2 38.0 -3.3 39.6 214 221 A S H > S+ 0 0 1 -3,-0.5 4,-1.6 1,-0.2 -2,-0.2 0.882 111.4 52.8 -63.9 -38.8 41.4 -2.4 38.3 215 222 A I H < S+ 0 0 64 -4,-2.1 4,-0.4 2,-0.2 -2,-0.2 0.887 113.9 40.9 -67.7 -40.8 41.0 1.2 39.3 216 223 A V H >< S+ 0 0 0 -4,-2.0 3,-1.3 -5,-0.2 -2,-0.2 0.961 114.3 51.9 -68.5 -52.0 40.0 0.4 42.9 217 224 A A H 3< S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.756 119.4 35.0 -59.2 -29.1 42.6 -2.4 43.3 218 225 A N T 3< S+ 0 0 67 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.377 99.0 110.8-105.7 2.7 45.5 -0.1 42.1 219 226 A G < - 0 0 13 -3,-1.3 7,-2.0 -4,-0.4 2,-0.4 0.027 59.8-125.8 -73.5 178.9 44.2 3.1 43.6 220 227 A Q E -H 225 0C 122 5,-0.2 2,-0.6 -117,-0.1 -1,-0.1 -0.962 5.9-146.1-126.4 146.8 45.5 5.2 46.5 221 228 A V E > S-H 224 0C 0 3,-3.0 3,-1.6 -2,-0.4 -117,-0.1 -0.944 83.8 -25.8-114.6 113.7 43.8 6.5 49.6 222 229 A N T 3 S- 0 0 142 -2,-0.6 -1,-0.1 -119,-0.3 -118,-0.1 0.814 130.1 -46.5 51.4 34.2 45.0 10.0 50.7 223 230 A G T 3 S+ 0 0 59 1,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.324 118.7 100.1 98.9 -7.3 48.3 9.3 49.0 224 231 A R E < S-H 221 0C 68 -3,-1.6 -3,-3.0 1,-0.0 -1,-0.2 -0.904 79.6 -97.1-116.0 144.4 49.0 5.7 50.2 225 232 A P E -H 220 0C 99 0, 0.0 -5,-0.2 0, 0.0 2,-0.1 -0.261 38.1-117.9 -62.4 135.9 48.5 2.5 48.3 226 233 A I - 0 0 4 -7,-2.0 2,-0.0 -10,-0.2 582,-0.0 -0.462 29.8-125.4 -72.7 142.0 45.2 0.6 49.0 227 234 A T > - 0 0 59 -2,-0.1 4,-1.7 1,-0.1 5,-0.1 -0.243 20.4-108.3 -80.6 174.4 45.7 -2.9 50.4 228 235 A S H > S+ 0 0 49 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.940 118.7 48.8 -66.8 -49.2 44.2 -6.1 48.9 229 236 A D H > S+ 0 0 102 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.905 110.6 51.1 -56.4 -46.7 41.7 -6.5 51.8 230 237 A E H > S+ 0 0 6 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.917 109.9 48.9 -58.8 -46.3 40.5 -2.9 51.4 231 238 A A H X S+ 0 0 0 -4,-1.7 4,-2.9 1,-0.2 -1,-0.2 0.873 110.6 51.9 -62.8 -38.8 40.0 -3.2 47.7 232 239 A K H X S+ 0 0 33 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.912 109.2 49.4 -61.8 -45.4 38.0 -6.4 48.2 233 240 A R H X S+ 0 0 22 -4,-2.3 -141,-1.6 1,-0.2 4,-0.7 0.788 115.5 44.2 -67.7 -29.7 35.8 -4.8 50.8 234 241 A M H X S+ 0 0 1 -4,-1.7 4,-1.6 -143,-0.2 3,-0.3 0.904 112.5 49.6 -80.1 -45.2 35.1 -1.8 48.4 235 242 A C H X S+ 0 0 5 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.883 105.0 59.1 -61.3 -40.3 34.6 -3.9 45.2 236 243 A G H X S+ 0 0 0 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.859 105.4 49.1 -56.5 -38.5 32.1 -6.2 47.0 237 244 A L H X S+ 0 0 33 -4,-0.7 4,-2.7 -3,-0.3 5,-0.2 0.892 105.9 56.8 -69.1 -40.2 29.9 -3.2 47.8 238 245 A L H X S+ 0 0 27 -4,-1.6 4,-1.9 1,-0.2 -2,-0.2 0.877 104.7 52.4 -59.7 -39.4 30.0 -2.0 44.2 239 246 A L H X S+ 0 0 3 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.885 110.3 48.6 -62.9 -40.0 28.6 -5.3 43.0 240 247 A V H X S+ 0 0 22 -4,-1.3 4,-2.0 2,-0.2 -2,-0.2 0.952 112.1 47.2 -66.0 -49.2 25.7 -5.0 45.5 241 248 A G H < S+ 0 0 36 -4,-2.7 5,-0.5 1,-0.2 -1,-0.2 0.836 117.2 44.8 -59.0 -34.0 24.9 -1.4 44.4 242 249 A G H < S+ 0 0 14 -4,-1.9 -86,-0.2 -5,-0.2 -1,-0.2 0.758 118.7 39.0 -83.7 -25.4 25.1 -2.4 40.8 243 250 A L H < S+ 0 0 0 -4,-1.7 -2,-0.2 -3,-0.2 -3,-0.2 0.683 122.4 30.7-101.6 -20.8 23.1 -5.7 41.0 244 251 A D S < S+ 0 0 1 -4,-2.0 -1,-0.1 -5,-0.2 -2,-0.1 -0.169 107.8 57.5-138.2 43.7 20.2 -5.1 43.4 245 252 A T S >> S+ 0 0 47 -4,-0.2 4,-1.9 -3,-0.2 3,-0.7 0.463 108.5 28.4-129.2 -78.2 19.2 -1.4 43.3 246 253 A V H 3> S+ 0 0 10 -5,-0.5 4,-2.6 1,-0.2 5,-0.2 0.866 114.6 67.6 -56.2 -38.3 18.1 0.0 39.9 247 254 A V H 3> S+ 0 0 4 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.888 107.4 37.3 -47.6 -47.6 17.0 -3.5 39.0 248 255 A N H <> S+ 0 0 8 -3,-0.7 4,-1.4 1,-0.2 3,-0.3 0.880 113.1 55.5 -77.7 -40.0 14.2 -3.4 41.6 249 256 A F H X S+ 0 0 6 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.859 100.6 59.0 -64.2 -37.6 13.3 0.3 41.1 250 257 A L H X S+ 0 0 4 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.894 104.2 51.9 -58.6 -39.1 12.6 -0.1 37.4 251 258 A S H X S+ 0 0 3 -4,-0.8 4,-2.1 -3,-0.3 -1,-0.2 0.876 107.2 52.1 -67.2 -38.8 9.9 -2.8 38.1 252 259 A F H X S+ 0 0 0 -4,-1.4 4,-1.9 2,-0.2 -1,-0.2 0.924 112.7 45.5 -59.9 -46.1 8.1 -0.5 40.6 253 260 A S H X S+ 0 0 3 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.925 115.3 45.4 -64.6 -46.6 8.0 2.3 38.0 254 261 A M H X S+ 0 0 3 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.787 108.8 55.8 -72.4 -28.8 6.9 0.1 35.1 255 262 A E H X S+ 0 0 13 -4,-2.1 4,-1.1 -5,-0.2 -1,-0.2 0.932 111.6 45.8 -63.5 -45.4 4.3 -1.6 37.3 256 263 A F H >X S+ 0 0 27 -4,-1.9 3,-0.6 1,-0.2 4,-0.5 0.925 112.0 50.0 -59.8 -48.6 2.8 1.8 38.0 257 264 A L H >< S+ 0 0 0 -4,-2.5 3,-0.6 1,-0.3 7,-0.3 0.839 107.8 53.5 -65.5 -33.8 3.0 2.9 34.4 258 265 A A H 3< S+ 0 0 5 -4,-2.0 118,-0.4 1,-0.2 -1,-0.3 0.769 113.3 44.2 -69.0 -26.6 1.2 -0.2 33.2 259 266 A K H << S+ 0 0 131 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.422 111.2 58.9 -97.5 -0.6 -1.6 0.5 35.6 260 267 A S S+ 0 0 55 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.797 80.7 61.9 -62.1 -32.2 -2.6 5.1 31.2 262 269 A E H > S+ 0 0 140 1,-0.2 4,-1.3 2,-0.2 -5,-0.1 0.859 105.9 46.1 -62.7 -36.7 -3.1 8.7 32.1 263 270 A H H > S+ 0 0 33 -3,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.899 110.2 51.4 -75.6 -42.1 0.5 9.0 33.3 264 271 A R H X S+ 0 0 10 -4,-1.7 4,-1.8 -7,-0.3 3,-0.4 0.921 109.9 51.9 -55.3 -45.2 2.0 7.2 30.3 265 272 A Q H X S+ 0 0 85 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.850 103.9 57.3 -62.0 -37.2 0.0 9.7 28.1 266 273 A E H X S+ 0 0 45 -4,-1.3 4,-1.2 1,-0.2 -1,-0.2 0.851 111.9 40.8 -63.3 -36.5 1.4 12.6 30.0 267 274 A L H < S+ 0 0 3 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.709 113.4 54.1 -87.3 -22.9 5.0 11.6 29.2 268 275 A I H < S+ 0 0 59 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.2 0.942 115.4 38.5 -71.1 -49.9 4.1 10.6 25.6 269 276 A E H < S+ 0 0 130 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.790 132.2 29.2 -71.0 -29.8 2.6 14.0 24.8 270 277 A R >< + 0 0 143 -4,-1.2 3,-1.4 -5,-0.3 -1,-0.3 -0.652 64.5 168.9-134.4 80.0 5.3 15.8 26.9 271 278 A P G > S+ 0 0 68 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.702 70.9 74.4 -63.2 -22.8 8.6 13.8 26.9 272 279 A E G 3 S+ 0 0 115 1,-0.3 4,-0.3 2,-0.1 -5,-0.1 0.434 85.5 66.3 -74.1 1.8 10.5 16.7 28.4 273 280 A R G <> S+ 0 0 99 -3,-1.4 4,-2.7 -6,-0.2 -1,-0.3 0.452 72.5 97.5 -95.3 -3.5 8.9 15.9 31.7 274 281 A I H <> S+ 0 0 4 -3,-1.8 4,-1.9 1,-0.2 -2,-0.1 0.855 79.6 50.9 -59.1 -40.8 10.7 12.6 32.0 275 282 A P H > S+ 0 0 70 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.943 113.9 45.2 -61.2 -44.5 13.5 13.8 34.3 276 283 A A H > S+ 0 0 53 -4,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.885 111.9 52.1 -64.5 -39.7 10.9 15.3 36.7 277 284 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.856 104.7 58.5 -62.8 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48.3 288 295 A V B +I 389 0D 36 101,-0.2 28,-1.7 54,-0.2 101,-0.2 -0.794 35.0 171.5-103.6 142.0 16.0 1.1 50.6 289 296 A A + 0 0 0 99,-3.0 2,-0.2 -2,-0.4 23,-0.0 -0.725 17.0 134.5-149.5 98.2 16.0 0.8 54.4 290 297 A D E - E 0 313A 17 23,-0.5 23,-2.3 -2,-0.2 2,-0.2 -0.549 24.9-173.5-121.4-162.5 19.2 0.4 56.5 291 298 A G E - E 0 312A 3 -212,-2.1 2,-0.3 21,-0.3 21,-0.2 -0.759 15.9 -90.0-164.1-155.9 20.4 2.0 59.7 292 299 A R E - E 0 311A 12 19,-2.2 19,-2.7 -2,-0.2 2,-0.4 -0.828 22.2-122.9-138.2 170.8 23.0 2.7 62.4 293 300 A I E -DE 75 310A 23 -218,-2.4 -218,-3.1 -2,-0.3 2,-0.3 -0.968 32.7-109.7-122.5 140.4 24.2 1.6 65.8 294 301 A L E -D 74 0A 4 15,-2.5 14,-2.1 -2,-0.4 -220,-0.2 -0.497 19.1-163.8 -70.0 128.4 24.4 3.7 68.9 295 302 A T S S- 0 0 41 -222,-1.9 2,-0.3 -2,-0.3 -1,-0.1 0.755 73.8 -4.2 -81.2 -27.2 28.0 4.5 70.0 296 303 A S S S- 0 0 47 -223,-0.4 -1,-0.2 10,-0.1 2,-0.1 -0.948 95.1 -64.7-154.8 171.2 26.8 5.6 73.5 297 304 A D + 0 0 95 -2,-0.3 2,-0.3 9,-0.1 9,-0.2 -0.448 62.5 169.9 -63.8 136.3 23.8 6.1 75.7 298 305 A Y E -J 305 0E 66 7,-2.8 7,-2.6 -2,-0.1 2,-0.6 -0.949 36.3-134.5-160.0 126.3 21.8 9.0 74.2 299 306 A E E -J 304 0E 113 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.771 29.7-177.2 -86.6 119.9 18.4 10.6 74.6 300 307 A F E > -J 303 0E 7 3,-3.3 3,-1.3 -2,-0.6 -2,-0.0 -0.965 64.7 -21.9-126.8 115.1 16.9 11.1 71.2 301 308 A H T 3 S- 0 0 76 -2,-0.5 -1,-0.2 1,-0.3 -255,-0.1 0.931 128.5 -46.9 50.1 53.2 13.5 12.9 70.8 302 309 A G T 3 S+ 0 0 64 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.502 118.6 113.4 73.3 4.6 12.4 12.1 74.4 303 310 A V E < -J 300 0E 14 -3,-1.3 -3,-3.3 -292,-0.0 2,-0.8 -0.917 65.5-131.6-114.7 135.4 13.6 8.5 74.0 304 311 A Q E -J 299 0E 104 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.729 23.8-168.6 -86.5 108.0 16.4 6.8 75.9 305 312 A L E -J 298 0E 2 -7,-2.6 -7,-2.8 -2,-0.8 2,-0.3 -0.809 10.5-144.5 -97.4 135.6 18.7 4.9 73.5 306 313 A K > - 0 0 102 -2,-0.4 3,-2.2 -9,-0.2 -12,-0.3 -0.712 29.9 -88.8-100.0 151.4 21.3 2.6 75.0 307 314 A K T 3 S+ 0 0 127 -2,-0.3 -12,-0.2 1,-0.3 3,-0.1 -0.299 116.1 23.5 -52.4 132.4 24.8 1.9 73.7 308 315 A G T 3 S+ 0 0 23 -14,-2.1 -1,-0.3 1,-0.3 2,-0.1 0.238 87.6 136.9 91.1 -15.1 24.7 -1.0 71.2 309 316 A D < - 0 0 15 -3,-2.2 -15,-2.5 -16,-0.1 -1,-0.3 -0.423 49.4-135.2 -60.6 136.7 21.0 -0.5 70.4 310 317 A Q E - E 0 293A 6 -256,-0.3 -254,-2.7 -17,-0.2 2,-0.4 -0.757 17.6-164.6 -91.9 145.7 20.3 -0.7 66.6 311 318 A I E -cE 56 292A 1 -19,-2.7 -19,-2.2 -2,-0.3 2,-0.4 -0.962 12.1-144.7-133.5 119.1 18.1 1.8 64.9 312 319 A L E -cE 57 291A 0 -256,-3.1 -254,-2.1 -2,-0.4 -21,-0.3 -0.646 12.2-170.1 -75.7 131.6 16.6 1.3 61.4 313 320 A L E - E 0 290A 0 -23,-2.3 2,-0.6 -2,-0.4 -23,-0.5 -0.759 16.5-148.7-124.0 82.8 16.4 4.6 59.5 314 321 A P >> - 0 0 0 0, 0.0 3,-1.2 0, 0.0 4,-0.8 -0.369 13.2-165.2 -69.8 105.0 14.3 3.8 56.5 315 322 A Q H 3> S+ 0 0 13 -2,-0.6 26,-0.7 1,-0.3 4,-0.6 0.825 90.5 62.0 -49.8 -34.2 15.4 6.0 53.5 316 323 A M H 3> S+ 0 0 0 -28,-1.7 4,-0.6 1,-0.2 3,-0.3 0.864 95.9 58.2 -58.4 -41.1 12.1 4.9 51.9 317 324 A L H <> S+ 0 0 0 -3,-1.2 4,-0.8 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-96.7 11.6 29.1 7.8 105.4 449 50 B V S < S- 0 0 9 -3,-2.2 -28,-0.1 16,-0.0 4,-0.1 -0.925 75.7-120.6-114.4 130.8 32.7 6.8 105.9 450 51 B P - 0 0 49 0, 0.0 3,-0.2 0, 0.0 -4,-0.1 -0.197 22.0-119.5 -59.8 155.2 35.1 8.3 108.5 451 52 B D S S+ 0 0 59 1,-0.2 14,-2.9 13,-0.1 15,-0.6 0.803 106.8 33.8 -66.3 -30.0 38.3 10.0 107.3 452 53 B L E S+ M 0 464G 6 12,-0.2 -1,-0.2 13,-0.1 2,-0.2 -0.955 79.2 168.7-132.7 114.9 40.3 7.4 109.3 453 54 B V E - M 0 463G 0 10,-2.2 10,-2.2 -2,-0.4 2,-0.5 -0.726 29.1-127.4-120.8 167.1 39.0 3.9 109.7 454 55 B W E -lM 422 462G 10 -33,-3.9 -31,-2.1 -2,-0.2 2,-0.4 -0.971 18.5-162.8-117.8 122.0 40.2 0.5 111.0 455 56 B T E - M 0 461G 0 6,-2.3 6,-1.9 -2,-0.5 -31,-0.2 -0.806 12.6-156.9 -98.9 146.1 39.9 -2.6 108.8 456 57 B R > + 0 0 82 -2,-0.4 -45,-3.5 4,-0.2 3,-0.6 0.450 64.6 102.7 -97.8 -4.2 40.2 -6.1 110.4 457 58 B C G > S+ 0 0 10 -47,-0.2 3,-2.0 1,-0.2 -47,-0.1 -0.388 79.9 21.1 -72.0 156.4 41.3 -7.7 107.1 458 59 B N G 3 S- 0 0 41 -49,-0.4 31,-0.3 1,-0.3 -1,-0.2 0.807 141.6 -48.1 58.0 36.7 45.0 -8.5 106.5 459 60 B G G < S- 0 0 61 -3,-0.6 -1,-0.3 -50,-0.3 -2,-0.1 0.279 103.2 -75.9 88.8 -10.8 45.9 -8.6 110.2 460 61 B G < + 0 0 5 -3,-2.0 256,-0.3 1,-0.1 2,-0.3 0.524 62.8 165.8 91.2 126.6 44.2 -5.3 111.0 461 62 B H E -M 455 0G 0 -6,-1.9 -6,-2.3 -4,-0.1 256,-0.2 -0.978 35.5 -97.9-166.8 154.1 45.4 -1.8 110.2 462 63 B W E -Mn 454 717G 0 254,-2.4 256,-3.4 -2,-0.3 2,-0.3 -0.369 31.5-160.8 -73.1 156.9 44.3 1.9 109.9 463 64 B I E -Mn 453 718G 0 -10,-2.2 -10,-2.2 254,-0.2 2,-0.4 -0.945 11.2-147.5-143.0 120.4 43.4 3.5 106.6 464 65 B A E -M 452 0G 0 254,-2.0 -12,-0.2 -2,-0.3 259,-0.1 -0.725 12.4-172.0 -79.6 135.8 43.2 7.2 105.8 465 66 B T + 0 0 0 -14,-2.9 2,-0.3 -2,-0.4 -13,-0.1 0.481 60.6 63.5-109.6 -5.8 40.4 7.7 103.2 466 67 B R S > S- 0 0 9 -15,-0.6 4,-2.1 1,-0.1 3,-0.4 -0.923 77.0-127.9-125.1 147.9 41.0 11.4 102.4 467 68 B G H > S+ 0 0 0 -2,-0.3 4,-2.8 256,-0.3 5,-0.2 0.738 104.9 65.4 -64.9 -25.7 44.0 13.1 100.7 468 69 B Q H > S+ 0 0 115 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.940 109.9 36.7 -61.7 -48.1 44.3 15.7 103.5 469 70 B L H > S+ 0 0 4 -3,-0.4 4,-2.6 2,-0.2 5,-0.2 0.891 115.1 55.2 -71.2 -43.2 45.2 13.0 106.0 470 71 B I H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.946 111.7 44.9 -53.3 -50.4 47.3 11.0 103.5 471 72 B R H X S+ 0 0 51 -4,-2.8 4,-1.1 1,-0.2 -2,-0.2 0.899 112.6 50.2 -63.0 -44.6 49.4 14.1 102.7 472 73 B E H X S+ 0 0 67 -4,-1.9 4,-1.7 -5,-0.2 3,-0.5 0.932 111.6 47.6 -59.7 -48.7 49.8 15.1 106.4 473 74 B A H < S+ 0 0 1 -4,-2.6 7,-0.2 1,-0.2 -1,-0.2 0.892 107.4 54.6 -63.1 -43.7 51.0 11.6 107.4 474 75 B Y H < S+ 0 0 6 -4,-2.0 279,-0.5 -5,-0.2 -1,-0.2 0.769 110.7 48.6 -62.2 -25.6 53.5 11.2 104.6 475 76 B E H < S+ 0 0 109 -4,-1.1 2,-1.5 -3,-0.5 -1,-0.2 0.839 99.5 69.0 -80.3 -36.1 55.1 14.5 105.7 476 77 B D >X + 0 0 38 -4,-1.7 4,-2.2 1,-0.2 3,-0.5 -0.590 53.1 160.3 -89.7 80.5 55.3 13.6 109.4 477 78 B Y T 34 + 0 0 66 -2,-1.5 -1,-0.2 1,-0.2 5,-0.1 0.549 64.7 74.5 -79.2 -7.5 58.0 10.9 109.3 478 79 B R T 34 S+ 0 0 181 -3,-0.1 -1,-0.2 1,-0.1 3,-0.2 0.925 115.5 19.9 -64.9 -45.2 58.6 11.4 113.1 479 80 B H T <4 S+ 0 0 52 -3,-0.5 222,-1.9 1,-0.2 2,-0.8 0.759 126.7 54.7 -94.6 -31.4 55.4 9.6 113.8 480 81 B F E < S-O 700 0G 0 -4,-2.2 220,-0.2 -7,-0.2 -1,-0.2 -0.794 75.8-171.8-112.4 90.8 54.9 7.7 110.6 481 82 B S E -O 699 0G 8 218,-2.9 218,-2.6 -2,-0.8 3,-0.4 -0.465 26.1-145.0 -86.4 152.4 58.0 5.7 109.8 482 83 B S S S+ 0 0 2 216,-0.2 -1,-0.1 1,-0.2 4,-0.1 0.289 77.3 99.6 -97.2 6.9 58.8 3.8 106.6 483 84 B E S S+ 0 0 132 1,-0.3 -1,-0.2 216,-0.1 18,-0.1 0.839 98.1 27.7 -61.5 -32.3 60.6 1.0 108.4 484 85 B C S S+ 0 0 5 -3,-0.4 -1,-0.3 1,-0.1 8,-0.2 -0.713 76.4 148.5-130.0 78.5 57.4 -1.1 108.1 485 86 B P + 0 0 2 0, 0.0 212,-2.5 0, 0.0 2,-0.3 0.529 48.6 76.1 -96.7 -7.6 55.6 0.3 105.0 486 87 B F S S- 0 0 17 210,-0.2 6,-0.5 3,-0.1 7,-0.1 -0.706 75.2-108.4-105.5 157.3 53.8 -2.8 103.7 487 88 B I S S+ 0 0 3 -2,-0.3 2,-0.2 4,-0.1 307,-0.1 -0.992 90.8 51.5-121.7 134.1 50.7 -4.7 104.8 488 89 B P S >> S- 0 0 35 0, 0.0 4,-1.9 0, 0.0 3,-1.1 0.458 90.7-119.4 -76.7 178.1 50.5 -7.4 106.1 489 90 B R H 3> S+ 0 0 87 -31,-0.3 4,-2.2 1,-0.3 5,-0.2 0.793 110.7 58.3 -58.8 -36.1 52.9 -6.9 109.0 490 91 B E H 3> S+ 0 0 128 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.829 108.4 47.7 -64.3 -32.7 55.3 -9.7 108.0 491 92 B A H <> S+ 0 0 4 -3,-1.1 4,-2.6 2,-0.2 -2,-0.2 0.930 110.7 49.2 -73.0 -47.8 55.8 -7.9 104.7 492 93 B G H < S+ 0 0 0 -4,-1.9 -2,-0.2 -6,-0.5 -1,-0.2 0.854 113.9 48.4 -59.8 -35.7 56.4 -4.5 106.2 493 94 B E H < S+ 0 0 134 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.944 114.5 43.3 -67.4 -50.4 58.9 -6.2 108.6 494 95 B A H < S+ 0 0 20 -4,-2.1 2,-0.3 -5,-0.2 -2,-0.2 0.787 91.0 103.2 -67.2 -28.9 60.8 -8.0 105.9 495 96 B Y < + 0 0 12 -4,-2.6 -9,-0.1 1,-0.2 98,-0.0 -0.406 31.9 147.9 -61.3 114.4 60.7 -5.0 103.6 496 97 B D + 0 0 41 -2,-0.3 -1,-0.2 -12,-0.1 143,-0.1 0.083 17.5 147.6-137.5 22.6 64.2 -3.4 103.8 497 98 B F > - 0 0 2 1,-0.1 4,-2.1 145,-0.1 143,-0.2 -0.181 51.5 -85.1 -55.3 153.1 64.5 -1.9 100.3 498 99 B I T 4 S- 0 0 0 141,-1.8 145,-0.2 1,-0.3 -1,-0.1 -0.946 97.5 -6.1-117.8 135.2 66.6 1.2 100.0 499 100 B P T >4 S+ 0 0 6 0, 0.0 3,-1.7 0, 0.0 -1,-0.3 -0.956 122.4 68.2 -99.2 14.9 65.8 4.0 100.4 500 101 B T T 34 S+ 0 0 26 1,-0.3 -2,-0.2 140,-0.1 7,-0.1 0.828 99.8 52.6 -62.1 -34.0 62.0 3.4 100.8 501 102 B S T 3< S+ 0 0 17 -4,-2.1 2,-0.4 -18,-0.1 -1,-0.3 0.304 99.1 83.6 -86.7 10.3 62.5 1.6 104.2 502 103 B M < - 0 0 13 -3,-1.7 -6,-0.0 -5,-0.1 -5,-0.0 -0.913 66.2-145.0-115.7 141.0 64.5 4.5 105.6 503 104 B D > - 0 0 36 -2,-0.4 4,-1.2 1,-0.1 3,-0.4 -0.652 43.9 -60.1 -91.1 156.4 63.3 7.7 107.2 504 105 B P T 4 S+ 0 0 9 0, 0.0 -1,-0.1 0, 0.0 249,-0.0 -0.409 111.4 32.2 -60.3 152.2 65.2 11.0 106.8 505 106 B P T >> S+ 0 0 108 0, 0.0 3,-0.6 0, 0.0 4,-0.5 -0.991 126.3 42.3 -87.6 -13.3 67.9 12.1 107.4 506 107 B E T 34 S+ 0 0 110 -3,-0.4 3,-0.4 1,-0.2 4,-0.4 0.771 111.9 59.2 -61.6 -27.2 69.6 8.7 106.8 507 108 B Q T >X S+ 0 0 0 -4,-1.2 3,-1.7 1,-0.2 4,-0.6 0.878 88.4 70.9 -69.4 -39.3 67.4 8.1 103.7 508 109 B R H X> S+ 0 0 130 -3,-0.6 4,-0.9 1,-0.3 3,-0.7 0.742 87.9 61.5 -59.5 -32.1 68.5 11.2 101.7 509 110 B Q H 3X S+ 0 0 40 -4,-0.5 4,-0.8 -3,-0.4 119,-0.3 0.814 103.8 51.3 -64.1 -29.8 72.0 10.0 100.9 510 111 B F H <> S+ 0 0 1 -3,-1.7 4,-1.4 -4,-0.4 -1,-0.2 0.624 98.3 65.4 -85.2 -14.0 70.7 7.0 99.0 511 112 B R H X S+ 0 0 3 -4,-1.4 4,-1.3 1,-0.2 3,-0.8 0.814 104.5 59.0 -71.1 -29.4 69.2 6.1 92.9 515 116 B N H 3X S+ 0 0 72 -4,-2.1 4,-1.7 1,-0.2 7,-0.3 0.793 95.4 66.1 -65.0 -28.6 68.7 9.3 90.9 516 117 B Q H 3< S+ 0 0 114 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.741 108.9 35.0 -66.4 -24.4 71.8 8.4 89.0 517 118 B V H <4 S+ 0 0 3 -3,-0.8 -1,-0.2 -4,-0.4 -2,-0.2 0.703 134.0 18.2-107.1 -22.9 70.3 5.3 87.4 518 119 B V H < S+ 0 0 11 -4,-1.3 243,-0.4 100,-0.1 -3,-0.2 0.346 98.1 107.4-129.3 4.2 66.6 6.2 86.9 519 120 B G S >X S- 0 0 0 -4,-1.7 4,-1.7 -5,-0.2 3,-1.0 -0.051 87.9 -78.4 -78.4-177.4 66.5 10.0 87.0 520 121 B M H 3> S+ 0 0 78 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.799 126.2 57.1 -54.5 -39.2 66.1 12.6 84.2 521 122 B P H 3> S+ 0 0 91 0, 0.0 4,-1.2 0, 0.0 -1,-0.3 0.853 109.3 48.6 -63.7 -29.7 69.7 12.4 82.9 522 123 B V H <> S+ 0 0 5 -3,-1.0 4,-2.2 -7,-0.3 -2,-0.2 0.862 106.5 55.8 -71.7 -39.6 69.1 8.7 82.4 523 124 B V H < S+ 0 0 0 -4,-1.7 4,-0.5 1,-0.2 -1,-0.2 0.893 105.3 53.2 -59.1 -40.1 65.8 9.3 80.6 524 125 B D H >< S+ 0 0 85 -4,-2.0 3,-0.7 1,-0.2 4,-0.4 0.896 108.9 48.4 -63.3 -42.1 67.6 11.5 78.1 525 126 B K H 3< S+ 0 0 151 -4,-1.2 3,-0.4 1,-0.2 4,-0.3 0.904 114.8 45.3 -61.7 -42.3 70.1 8.8 77.3 526 127 B L T 3X S+ 0 0 17 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.446 84.4 103.4 -82.6 -1.3 67.3 6.3 76.8 527 128 B E H <> S+ 0 0 96 -3,-0.7 4,-2.4 -4,-0.5 5,-0.2 0.900 81.3 44.6 -49.9 -55.4 65.2 8.7 74.8 528 129 B N H > S+ 0 0 129 -3,-0.4 4,-2.7 -4,-0.4 -1,-0.2 0.909 114.5 48.2 -55.3 -49.0 66.0 7.1 71.4 529 130 B R H > S+ 0 0 125 -4,-0.3 4,-2.4 2,-0.2 5,-0.2 0.839 111.6 49.9 -66.3 -34.2 65.5 3.5 72.6 530 131 B I H X S+ 0 0 1 -4,-2.5 4,-2.0 2,-0.2 5,-0.2 0.948 113.5 45.6 -68.3 -48.1 62.2 4.3 74.3 531 132 B Q H X S+ 0 0 74 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.921 116.0 46.7 -57.6 -46.0 60.8 6.0 71.2 532 133 B E H X S+ 0 0 103 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.917 110.5 49.5 -70.0 -44.9 62.0 3.2 68.9 533 134 B L H X S+ 0 0 28 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.933 112.1 49.7 -59.9 -46.4 60.8 0.3 70.9 534 135 B A H X S+ 0 0 0 -4,-2.0 4,-2.1 -5,-0.2 5,-0.2 0.949 112.9 45.4 -56.9 -52.7 57.3 1.8 71.2 535 136 B C H X S+ 0 0 23 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.893 114.3 50.6 -58.7 -39.7 57.0 2.5 67.5 536 137 B S H X S+ 0 0 61 -4,-2.5 4,-1.3 2,-0.2 -1,-0.2 0.880 110.3 47.0 -69.0 -41.5 58.3 -1.0 66.7 537 138 B L H X S+ 0 0 25 -4,-2.6 4,-1.2 -5,-0.2 -1,-0.2 0.918 114.7 47.0 -65.7 -43.1 55.9 -2.8 68.9 538 139 B I H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.885 108.2 53.3 -69.9 -40.7 52.9 -0.9 67.7 539 140 B E H < S+ 0 0 67 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.847 107.1 53.9 -63.4 -33.0 53.7 -1.2 64.0 540 141 B S H < S+ 0 0 77 -4,-1.3 4,-0.2 1,-0.2 -1,-0.2 0.845 114.2 40.9 -68.8 -33.7 53.9 -5.0 64.4 541 142 B L H >X>S+ 0 0 14 -4,-1.2 3,-1.3 -3,-0.2 4,-0.6 0.786 95.9 84.6 -81.9 -30.7 50.5 -5.1 66.0 542 143 B R G ><5S+ 0 0 41 -4,-2.2 3,-1.0 1,-0.3 -2,-0.1 0.812 89.3 44.2 -46.0 -51.4 48.8 -2.6 63.6 543 144 B P G 345S+ 0 0 73 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.748 100.2 72.6 -71.1 -19.0 47.9 -4.8 60.7 544 145 B Q G <45S- 0 0 106 -3,-1.3 -2,-0.2 -4,-0.2 261,-0.1 0.714 88.8-142.9 -69.0 -22.7 46.5 -7.6 63.0 545 146 B G T <<5S+ 0 0 10 -3,-1.0 260,-2.2 -4,-0.6 2,-0.3 0.665 74.1 52.2 66.9 17.0 43.4 -5.5 63.9 546 147 B Q E < +Q 804 0H 111 -5,-0.6 2,-0.3 258,-0.3 258,-0.2 -0.956 56.0 173.6-172.5 155.1 43.7 -6.9 67.4 547 148 B C E -Q 803 0H 4 256,-1.8 256,-2.5 -2,-0.3 2,-1.0 -0.978 38.9-121.3-162.0 156.6 46.0 -7.5 70.4 548 149 B N E >> -Q 802 0H 73 -2,-0.3 4,-2.3 254,-0.2 3,-0.9 -0.809 37.9-162.3 -96.5 88.0 46.1 -8.7 74.0 549 150 B F H 3>>S+ 0 0 0 252,-2.0 5,-2.9 -2,-1.0 4,-1.8 0.685 76.5 57.8 -52.3 -32.8 47.4 -5.3 75.2 550 151 B T H 34>S+ 0 0 14 3,-0.2 5,-1.9 1,-0.2 -1,-0.3 0.941 121.8 24.1 -66.3 -46.9 48.8 -6.4 78.6 551 152 B E H <45S+ 0 0 119 -3,-0.9 -2,-0.2 3,-0.2 -1,-0.2 0.637 124.3 53.3 -94.0 -15.5 51.2 -9.1 77.3 552 153 B D H <5S- 0 0 46 -4,-2.3 -3,-0.2 3,-0.1 -2,-0.2 0.756 136.0 -15.5 -89.3 -27.2 51.6 -7.6 73.8 553 154 B Y T X5S+ 0 0 0 -4,-1.8 4,-2.1 -5,-0.3 -3,-0.2 0.557 122.8 64.7-140.2 -53.8 52.6 -4.0 74.9 554 155 B A T 4 S+ 0 0 16 0, 0.0 4,-2.6 0, 0.0 5,-0.3 0.841 107.7 60.2 -58.9 -36.5 57.2 -5.9 77.1 557 158 B F H X S+ 0 0 0 -4,-2.1 4,-1.1 1,-0.2 -3,-0.1 0.948 115.6 26.5 -61.7 -56.2 57.6 -2.1 76.4 558 159 B P H > S+ 0 0 2 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.814 122.4 54.2 -80.9 -21.5 58.6 -0.8 79.8 559 160 B I H X S+ 0 0 1 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.922 107.2 49.1 -73.6 -43.0 60.2 -4.1 81.0 560 161 B R H X S+ 0 0 90 -4,-2.6 4,-2.0 -5,-0.3 -1,-0.2 0.844 110.6 52.5 -64.2 -32.6 62.5 -4.4 78.0 561 162 B I H X S+ 0 0 4 -4,-1.1 4,-2.7 -5,-0.3 -1,-0.2 0.917 111.1 46.0 -67.0 -42.8 63.6 -0.8 78.6 562 163 B F H X S+ 0 0 9 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.895 111.7 50.7 -68.7 -39.1 64.4 -1.5 82.2 563 164 B M H X>S+ 0 0 1 -4,-2.7 5,-2.6 2,-0.2 4,-0.7 0.884 111.7 48.5 -64.4 -38.7 66.3 -4.7 81.4 564 165 B L H ><5S+ 0 0 71 -4,-2.0 3,-0.9 -5,-0.2 -2,-0.2 0.949 113.2 48.3 -60.1 -49.5 68.3 -2.8 78.8 565 166 B L H 3<5S+ 0 0 18 -4,-2.7 53,-2.4 1,-0.2 -2,-0.2 0.820 116.0 42.9 -58.4 -35.6 68.9 -0.1 81.4 566 167 B A H 3<5S- 0 0 2 -4,-2.2 53,-0.4 51,-0.2 -1,-0.2 0.458 108.4-121.9 -95.6 -2.2 69.9 -2.7 84.0 567 168 B G T <<5 + 0 0 33 -3,-0.9 -3,-0.2 -4,-0.7 -4,-0.1 0.925 62.4 144.5 61.7 45.7 72.1 -4.7 81.6 568 169 B L < - 0 0 11 -5,-2.6 -1,-0.2 -6,-0.1 -2,-0.1 -0.929 55.4-102.9-119.7 142.9 70.0 -7.9 82.2 569 170 B P > - 0 0 60 0, 0.0 3,-1.9 0, 0.0 4,-0.2 -0.363 22.3-133.2 -63.2 136.4 69.1 -10.7 79.7 570 171 B E G > S+ 0 0 108 1,-0.3 3,-1.6 2,-0.2 -7,-0.0 0.715 102.5 71.6 -64.6 -20.6 65.5 -10.5 78.4 571 172 B E G 3 S+ 0 0 163 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.587 88.5 63.5 -71.3 -9.4 65.2 -14.3 79.1 572 173 B D G <> S+ 0 0 41 -3,-1.9 4,-2.3 1,-0.2 -1,-0.3 0.514 77.3 94.9 -88.7 -6.0 65.2 -13.4 82.8 573 174 B I H <> S+ 0 0 30 -3,-1.6 4,-3.1 1,-0.2 5,-0.3 0.892 79.1 49.6 -56.5 -50.9 61.9 -11.5 82.5 574 175 B P H > S+ 0 0 97 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.908 114.0 46.9 -58.5 -42.4 59.4 -14.2 83.4 575 176 B H H > S+ 0 0 98 -4,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.950 117.6 41.4 -60.2 -50.9 61.3 -15.1 86.6 576 177 B L H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.868 112.6 53.4 -69.0 -39.0 61.7 -11.5 87.7 577 178 B K H X S+ 0 0 18 -4,-3.1 4,-2.0 -5,-0.2 -1,-0.2 0.895 108.4 51.0 -62.8 -41.4 58.2 -10.4 86.8 578 179 B Y H X S+ 0 0 86 -4,-1.8 4,-1.5 -5,-0.3 -2,-0.2 0.931 110.8 48.3 -60.7 -47.2 56.7 -13.2 88.8 579 180 B L H X S+ 0 0 2 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.902 111.2 49.5 -61.4 -43.0 58.8 -12.3 91.9 580 181 B T H >X S+ 0 0 0 -4,-2.3 4,-0.7 1,-0.2 3,-0.6 0.873 109.1 53.7 -65.2 -36.0 57.9 -8.6 91.6 581 182 B D H 3X S+ 0 0 29 -4,-2.0 4,-3.7 1,-0.2 3,-0.4 0.805 101.2 58.2 -68.8 -31.4 54.2 -9.5 91.3 582 183 B Q H 3< S+ 0 0 11 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.712 105.0 52.0 -72.8 -19.7 54.2 -11.6 94.5 583 184 B M H << S+ 0 0 5 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.663 123.8 27.0 -87.0 -19.2 55.4 -8.6 96.4 584 185 B T H < S+ 0 0 4 -4,-0.7 210,-1.9 -3,-0.4 211,-0.5 0.745 141.7 11.0-110.6 -37.9 52.5 -6.4 95.1 585 186 B R S < S- 0 0 26 -4,-3.7 -2,-0.2 208,-0.2 -3,-0.1 -0.453 79.4-163.9-142.4 65.5 49.7 -8.8 94.3 586 187 B P - 0 0 54 0, 0.0 -4,-0.1 0, 0.0 5,-0.0 -0.216 14.8-157.0 -60.8 137.0 50.6 -12.2 95.8 587 188 B D - 0 0 110 3,-0.0 -5,-0.1 0, 0.0 -6,-0.0 0.532 52.3-100.6 -88.7 -8.7 48.6 -15.2 94.5 588 189 B G S S+ 0 0 64 2,-0.4 3,-0.0 -6,-0.1 -6,-0.0 0.072 102.0 102.5 112.4 -21.9 49.4 -17.2 97.7 589 190 B S S S+ 0 0 68 1,-0.1 2,-0.3 2,-0.0 -7,-0.0 0.827 88.7 27.6 -61.7 -32.4 52.2 -19.3 96.3 590 191 B M S S- 0 0 54 -8,-0.1 -2,-0.4 4,-0.0 2,-0.1 -0.968 72.0-131.0-134.2 146.0 54.8 -17.2 98.0 591 192 B T > - 0 0 77 -2,-0.3 4,-1.9 1,-0.1 5,-0.2 -0.432 36.3-109.5 -79.2 166.8 55.1 -14.9 101.0 592 193 B F H > S+ 0 0 21 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.902 118.4 53.2 -64.5 -41.5 56.6 -11.4 100.6 593 194 B A H > S+ 0 0 41 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.850 107.6 51.1 -65.5 -35.7 59.8 -12.4 102.4 594 195 B E H > S+ 0 0 103 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.944 111.4 46.8 -65.5 -47.3 60.3 -15.4 100.2 595 196 B A H X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.874 111.1 53.2 -62.8 -37.5 60.0 -13.3 97.0 596 197 B K H X S+ 0 0 20 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.928 109.8 48.1 -61.0 -45.3 62.3 -10.7 98.5 597 198 B E H X S+ 0 0 105 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.852 109.3 51.7 -66.7 -37.0 65.0 -13.4 99.1 598 199 B A H X S+ 0 0 24 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.866 110.6 49.4 -66.6 -37.3 64.7 -14.9 95.6 599 200 B L H X S+ 0 0 0 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.881 113.2 46.3 -67.9 -40.4 65.2 -11.4 94.1 600 201 B Y H X S+ 0 0 1 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.881 109.4 55.2 -66.8 -40.6 68.2 -10.8 96.4 601 202 B D H < S+ 0 0 117 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.867 107.8 49.9 -59.6 -39.0 69.5 -14.3 95.5 602 203 B Y H < S+ 0 0 32 -4,-1.7 4,-0.5 1,-0.2 -1,-0.2 0.905 115.1 43.9 -63.3 -41.8 69.3 -13.3 91.8 603 204 B L H X S+ 0 0 0 -4,-1.6 4,-2.5 1,-0.2 3,-0.2 0.772 93.6 77.6 -80.0 -30.4 71.2 -10.0 92.4 604 205 B I H X S+ 0 0 88 -4,-2.2 4,-2.0 1,-0.2 5,-0.2 0.884 98.0 40.5 -55.0 -50.9 74.0 -11.1 94.7 605 206 B P H > S+ 0 0 81 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.827 115.4 54.2 -68.9 -27.5 76.4 -12.7 92.2 606 207 B I H > S+ 0 0 24 -4,-0.5 4,-2.2 -3,-0.2 -2,-0.2 0.901 108.8 47.7 -68.5 -42.5 75.6 -9.9 89.7 607 208 B I H X S+ 0 0 4 -4,-2.5 4,-0.6 2,-0.2 -1,-0.2 0.907 111.2 49.0 -68.3 -43.0 76.6 -7.2 92.1 608 209 B E H >X S+ 0 0 87 -4,-2.0 4,-0.9 -5,-0.2 3,-0.7 0.905 112.2 50.6 -62.6 -40.6 79.9 -8.8 93.2 609 210 B Q H >X S+ 0 0 99 -4,-1.7 4,-2.3 1,-0.2 3,-0.8 0.932 109.9 48.1 -61.3 -47.5 80.8 -9.3 89.6 610 211 B R H 3< S+ 0 0 34 -4,-2.2 5,-0.3 1,-0.3 -1,-0.2 0.473 104.9 60.2 -81.0 -1.5 80.1 -5.7 88.6 611 212 B R H << S+ 0 0 72 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.678 111.2 40.2 -90.1 -24.0 82.1 -4.4 91.6 612 213 B Q H << S+ 0 0 131 -4,-0.9 -2,-0.2 -3,-0.8 -3,-0.1 0.816 131.4 28.0 -87.6 -36.5 85.2 -6.2 90.2 613 214 B K S < S- 0 0 141 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.1 -0.737 87.8-157.0-124.4 80.7 84.5 -5.2 86.6 614 215 B P + 0 0 84 0, 0.0 2,-0.1 0, 0.0 -3,-0.1 -0.306 17.3 178.2 -61.4 138.3 82.5 -2.0 86.7 615 216 B G - 0 0 36 -5,-0.3 -5,-0.0 2,-0.2 0, 0.0 -0.365 42.2 -95.4-122.7-157.6 80.3 -1.3 83.7 616 217 B T S S+ 0 0 134 -2,-0.1 -49,-0.1 4,-0.1 5,-0.0 0.544 82.8 108.1-102.3 -12.1 77.8 1.3 82.4 617 218 B D S > S- 0 0 24 -51,-0.1 4,-2.1 1,-0.1 3,-0.3 -0.183 82.9-105.3 -72.5 161.9 74.6 -0.5 83.5 618 219 B A H > S+ 0 0 5 -53,-2.4 4,-1.9 1,-0.2 -52,-0.2 0.816 118.7 51.2 -56.5 -37.3 72.3 0.6 86.3 619 220 B I H > S+ 0 0 7 -53,-0.4 4,-3.0 2,-0.2 -1,-0.2 0.893 108.7 50.3 -71.1 -39.2 73.5 -2.2 88.6 620 221 B S H > S+ 0 0 2 -3,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.899 109.7 52.3 -63.2 -41.3 77.2 -1.3 88.2 621 222 B I H < S+ 0 0 56 -4,-2.1 4,-0.3 2,-0.2 -2,-0.2 0.935 115.1 40.4 -60.3 -47.6 76.5 2.3 88.9 622 223 B V H >< S+ 0 0 0 -4,-1.9 3,-1.3 1,-0.2 -2,-0.2 0.959 115.8 50.1 -66.0 -49.8 74.7 1.5 92.1 623 224 B A H 3< S+ 0 0 0 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.776 119.3 35.9 -63.5 -30.7 77.1 -1.2 93.2 624 225 B N T 3< S+ 0 0 60 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.283 100.5 110.4-103.7 9.1 80.2 0.9 92.7 625 226 B G < - 0 0 12 -3,-1.3 7,-2.1 -4,-0.3 2,-0.3 -0.010 59.2-127.6 -79.3-178.0 78.6 4.1 93.8 626 227 B Q E -S 631 0I 121 5,-0.2 2,-0.5 -117,-0.1 -1,-0.1 -0.948 4.0-147.2-131.3 152.7 79.1 6.3 96.9 627 228 B V E > S-S 630 0I 0 3,-3.0 3,-1.2 -2,-0.3 -117,-0.1 -0.929 82.0 -26.8-125.3 106.9 76.7 7.8 99.4 628 229 B N T 3 S- 0 0 133 -2,-0.5 -1,-0.1 -119,-0.3 -118,-0.1 0.889 129.0 -44.4 51.9 44.7 77.6 11.2 100.8 629 230 B G T 3 S+ 0 0 62 1,-0.2 -1,-0.2 0, 0.0 0, 0.0 -0.063 119.5 94.0 101.9 -33.3 81.3 10.6 100.2 630 231 B R E < S-S 627 0I 89 -3,-1.2 -3,-3.0 1,-0.1 -1,-0.2 -0.691 81.1 -99.2 -97.7 149.1 81.8 7.0 101.4 631 232 B P E -S 626 0I 97 0, 0.0 -5,-0.2 0, 0.0 2,-0.1 -0.331 37.3-115.0 -65.7 143.5 81.6 3.8 99.3 632 233 B I - 0 0 4 -7,-2.1 2,-0.1 -10,-0.2 -6,-0.0 -0.474 30.3-121.6 -74.8 147.3 78.3 1.8 99.3 633 234 B T > - 0 0 63 -2,-0.1 4,-2.3 1,-0.1 5,-0.1 -0.454 20.4-111.6 -86.3 164.7 78.4 -1.7 100.7 634 235 B S H > S+ 0 0 47 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.885 118.3 48.3 -61.6 -40.3 77.5 -4.8 98.8 635 236 B D H > S+ 0 0 77 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.892 110.2 50.4 -70.6 -41.2 74.4 -5.4 101.0 636 237 B E H > S+ 0 0 25 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.922 109.8 52.0 -58.5 -45.2 73.2 -1.8 100.6 637 238 B A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.895 108.6 51.0 -58.0 -43.1 73.7 -2.1 96.8 638 239 B K H X S+ 0 0 25 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.894 108.6 50.6 -61.1 -43.3 71.6 -5.3 96.8 639 240 B R H X S+ 0 0 45 -4,-2.0 -141,-1.8 1,-0.2 4,-0.8 0.752 113.1 46.5 -71.6 -24.5 68.8 -3.6 98.8 640 241 B M H X S+ 0 0 2 -4,-1.5 4,-1.9 -143,-0.2 -2,-0.2 0.897 111.6 49.3 -81.1 -43.2 68.7 -0.7 96.3 641 242 B C H X S+ 0 0 4 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.856 105.4 58.3 -65.0 -36.9 68.8 -2.8 93.2 642 243 B G H X S+ 0 0 0 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.916 107.7 46.7 -57.8 -46.0 65.9 -5.0 94.4 643 244 B L H X S+ 0 0 36 -4,-0.8 4,-2.4 1,-0.2 3,-0.3 0.909 108.0 56.6 -61.0 -45.1 63.7 -2.0 94.7 644 245 B L H X S+ 0 0 26 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.886 104.5 52.4 -56.6 -42.7 64.7 -0.7 91.3 645 246 B L H X S+ 0 0 3 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.861 108.9 50.5 -60.5 -37.7 63.6 -4.0 89.7 646 247 B V H X S+ 0 0 21 -4,-1.3 4,-2.0 -3,-0.3 -2,-0.2 0.944 111.6 46.9 -67.6 -47.5 60.2 -3.7 91.4 647 248 B G H <>S+ 0 0 33 -4,-2.4 5,-0.5 1,-0.2 4,-0.3 0.902 115.7 46.8 -57.1 -43.2 59.7 -0.1 90.1 648 249 B G H <5S+ 0 0 11 -4,-2.4 -1,-0.2 -5,-0.2 -86,-0.2 0.805 119.1 37.9 -69.9 -30.1 60.8 -1.2 86.6 649 250 B L H <5S+ 0 0 0 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.677 122.3 29.1-101.7 -20.3 58.6 -4.3 86.4 650 251 B D T <5S+ 0 0 1 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.1 -0.166 105.9 56.0-143.9 46.8 55.3 -3.5 88.0 651 252 B T T >>5S+ 0 0 47 -4,-0.3 4,-1.9 -3,-0.2 3,-1.3 0.388 108.9 31.0-130.7 -78.4 54.3 0.1 87.9 652 253 B V H 3> S+ 0 0 3 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.829 107.3 35.1 -46.0 -42.9 53.1 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265 B A H 3< S+ 0 0 6 -4,-2.0 118,-0.5 1,-0.2 -1,-0.3 0.746 111.7 45.6 -68.0 -22.1 39.2 2.1 74.1 665 266 B K H << S+ 0 0 115 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.520 109.8 57.7 -96.3 -7.7 36.0 3.0 75.8 666 267 B S XX + 0 0 18 -4,-0.7 4,-1.5 -3,-0.7 3,-0.7 -0.746 49.7 176.8-134.3 89.8 35.9 6.7 75.0 667 268 B P H 3> S+ 0 0 69 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.787 84.8 60.9 -55.1 -33.5 36.0 7.8 71.3 668 269 B E H 3> S+ 0 0 138 1,-0.2 4,-1.6 2,-0.2 -5,-0.1 0.874 104.7 46.9 -63.7 -40.4 35.6 11.4 72.4 669 270 B H H <> S+ 0 0 22 -3,-0.7 4,-1.6 2,-0.2 -1,-0.2 0.815 110.1 52.2 -74.9 -32.2 38.9 11.3 74.3 670 271 B R H X S+ 0 0 10 -4,-1.5 4,-2.0 -7,-0.3 -2,-0.2 0.953 109.0 51.2 -63.0 -48.6 40.8 9.7 71.5 671 272 B Q H X S+ 0 0 58 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.869 106.1 56.1 -55.6 -42.0 39.6 12.4 69.1 672 273 B E H X S+ 0 0 40 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.935 111.9 40.0 -56.8 -53.2 40.8 15.1 71.5 673 274 B L H < S+ 0 0 2 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.747 114.9 55.1 -71.1 -24.7 44.3 13.8 71.6 674 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