==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 11-DEC-10 3PY4 . COMPND 2 MOLECULE: LACTOPEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR N.PANDEY,R.P.SING,A.K.SINGH,M.SINHA,P.KAUR,S.SHARMA,T.P.SING . 595 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25439.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 360 60.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 1 0.2 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 . 36 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 162 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.0 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 6 0 2 4 4 1 0 2 0 0 1 0 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 13 3 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 ANTIPARALLEL BRIDGES PER LADDER . 5 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 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 1 A S 0 0 162 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 131.0 5.2 -33.2 35.4 2 2 A W - 0 0 226 1,-0.1 2,-0.1 2,-0.0 0, 0.0 0.978 360.0-150.4 63.7 63.9 4.2 -30.0 33.5 3 3 A E - 0 0 154 1,-0.1 2,-2.3 2,-0.0 -1,-0.1 -0.443 31.3-103.5 -62.3 132.5 0.3 -30.4 33.3 4 4 A V S S- 0 0 159 -2,-0.1 -1,-0.1 1,-0.1 -2,-0.0 -0.332 76.8 -14.7 -75.2 70.7 -0.8 -28.6 30.1 5 5 A G - 0 0 65 -2,-2.3 2,-0.4 2,-0.0 -1,-0.1 0.478 32.6-139.7 117.9 122.9 -2.3 -25.3 31.2 6 6 A a + 0 0 68 1,-0.1 160,-0.0 -3,-0.0 161,-0.0 -0.860 36.3 167.2 -86.5 136.5 -3.7 -22.8 33.7 7 7 A G + 0 0 41 -2,-0.4 -1,-0.1 2,-0.1 34,-0.0 -0.052 28.8 120.8-153.8 40.6 -6.6 -21.2 31.8 8 8 A A S S+ 0 0 72 1,-0.1 -1,-0.0 3,-0.0 159,-0.0 0.870 80.3 49.3 -71.8 -40.1 -8.8 -19.2 34.2 9 9 A P S S+ 0 0 49 0, 0.0 -2,-0.1 0, 0.0 32,-0.1 0.996 112.1 41.3 -65.9 -66.6 -8.3 -15.9 32.3 10 10 A V S S+ 0 0 25 1,-0.2 25,-0.0 30,-0.2 30,-0.0 -0.700 70.6 146.0 -85.0 96.9 -8.9 -16.8 28.6 11 11 A P + 0 0 101 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.895 43.0 79.5 -98.0 -52.1 -12.0 -19.1 28.9 12 12 A L + 0 0 143 1,-0.0 2,-0.3 2,-0.0 0, 0.0 -0.362 49.5 170.3 -64.0 130.3 -14.0 -18.5 25.8 13 13 A V + 0 0 83 -2,-0.1 2,-0.4 14,-0.0 22,-0.0 -0.830 12.3 146.3-146.4 100.2 -12.8 -20.3 22.7 14 14 A K - 0 0 167 -2,-0.3 2,-0.6 20,-0.1 13,-0.0 -0.965 22.5-169.7-138.8 117.1 -15.0 -20.2 19.6 15 15 A b - 0 0 37 -2,-0.4 2,-0.5 16,-0.0 13,-0.0 -0.917 18.0-148.2-120.2 114.9 -13.6 -20.1 16.2 16 16 A D - 0 0 111 -2,-0.6 -2,-0.0 1,-0.2 0, 0.0 -0.631 21.3-152.9 -70.6 125.2 -15.5 -19.5 13.0 17 17 A E S S+ 0 0 95 -2,-0.5 -1,-0.2 1,-0.2 14,-0.0 0.975 80.1 52.1 -70.7 -54.4 -13.5 -21.6 10.6 18 18 A N S S+ 0 0 153 2,-0.0 -1,-0.2 0, 0.0 -2,-0.0 0.828 75.8 138.2 -52.8 -29.3 -14.0 -19.9 7.2 19 19 A S - 0 0 37 1,-0.1 4,-0.1 3,-0.0 -4,-0.0 0.473 40.3-162.2 -36.3 134.2 -13.0 -16.3 8.2 20 20 A P S S+ 0 0 75 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.369 71.2 68.4 -94.6 2.0 -10.9 -14.2 5.9 21 21 A Y S S- 0 0 32 276,-0.0 274,-0.1 1,-0.0 2,-0.0 -0.897 84.2-110.8-126.2 151.7 -9.9 -11.7 8.6 22 22 A R - 0 0 33 -2,-0.3 2,-0.1 272,-0.1 6,-0.1 -0.376 38.3-115.8 -69.7 156.4 -7.8 -11.8 11.8 23 23 A T - 0 0 49 4,-0.5 -1,-0.1 1,-0.1 6,-0.0 -0.463 20.7-118.9 -85.7 168.5 -9.8 -11.6 15.0 24 24 A I S S+ 0 0 25 1,-0.2 160,-0.2 -2,-0.1 -1,-0.1 0.908 114.4 46.9 -73.7 -41.3 -9.1 -8.5 17.2 25 25 A T S S- 0 0 31 13,-0.1 14,-2.4 1,-0.1 -1,-0.2 0.600 112.2-118.2 -76.7 -10.6 -7.9 -10.6 20.1 26 26 A G > + 0 0 4 1,-0.3 3,-1.1 12,-0.2 12,-0.1 0.334 65.9 143.0 90.5 -9.8 -5.6 -12.7 17.9 27 27 A D T 3 + 0 0 28 1,-0.2 -4,-0.5 2,-0.1 -1,-0.3 -0.143 57.6 27.1 -59.8 160.8 -7.5 -15.9 18.7 28 28 A b T 3 S+ 0 0 14 6,-1.9 -1,-0.2 2,-0.2 7,-0.1 0.414 80.4 116.9 66.9 -0.6 -8.1 -18.6 16.0 29 29 A N S < S+ 0 0 4 -3,-1.1 2,-0.7 5,-0.5 -2,-0.1 0.962 78.2 47.2 -59.8 -49.2 -5.0 -17.6 14.0 30 30 A N S S- 0 0 5 3,-0.3 -2,-0.2 6,-0.3 6,-0.2 -0.844 75.9-163.2 -95.9 114.6 -3.5 -21.0 14.7 31 31 A R S S+ 0 0 114 -2,-0.7 -1,-0.1 1,-0.2 -2,-0.1 0.787 87.3 49.5 -69.5 -29.5 -6.2 -23.6 14.0 32 32 A R S S+ 0 0 213 1,-0.3 -1,-0.2 301,-0.1 -2,-0.0 0.908 131.5 18.0 -75.1 -41.9 -4.5 -26.5 15.9 33 33 A S S > S- 0 0 53 1,-0.1 3,-1.3 3,-0.1 -3,-0.3 -0.839 76.4-173.0-131.3 89.4 -4.0 -24.4 19.0 34 34 A P T 3 S+ 0 0 35 0, 0.0 -6,-1.9 0, 0.0 -5,-0.5 0.604 76.9 58.2 -60.2 -20.0 -6.4 -21.3 18.7 35 35 A A T > S+ 0 0 15 -8,-0.2 3,-1.7 -7,-0.1 2,-0.6 0.542 73.9 117.2 -92.8 -3.4 -5.1 -19.3 21.7 36 36 A L T < S+ 0 0 43 -3,-1.3 -6,-0.3 1,-0.3 -7,-0.1 -0.500 87.7 6.9 -68.0 111.7 -1.5 -19.1 20.5 37 37 A G T 3 S+ 0 0 2 -2,-0.6 148,-2.0 1,-0.3 149,-0.6 0.421 94.2 136.1 98.3 -0.1 -0.6 -15.4 20.0 38 38 A A X - 0 0 4 -3,-1.7 3,-0.5 146,-0.2 -1,-0.3 -0.475 59.6-103.2 -79.4 152.9 -3.9 -14.0 21.4 39 39 A A T 3 S+ 0 0 3 -14,-2.4 143,-0.3 1,-0.2 145,-0.1 -0.205 99.9 38.5 -69.6 165.7 -3.7 -11.0 23.8 40 40 A N T 3 S+ 0 0 59 141,-2.0 2,-0.3 1,-0.2 -1,-0.2 0.745 90.2 112.4 64.7 25.7 -4.2 -11.5 27.5 41 41 A R E < S-A 181 0A 66 140,-1.0 140,-2.9 -3,-0.5 -1,-0.2 -0.802 78.0 -78.2-119.9 165.5 -2.3 -14.7 27.7 42 42 A A E -A 180 0A 32 -2,-0.3 138,-0.3 138,-0.2 137,-0.1 -0.319 48.5-107.7 -64.7 145.1 1.1 -15.4 29.4 43 43 A L - 0 0 6 136,-3.1 297,-0.2 1,-0.1 -1,-0.1 -0.410 46.1 -99.9 -66.3 148.8 4.2 -14.3 27.6 44 44 A A B -b 340 0B 0 295,-2.1 297,-2.5 -3,-0.1 2,-0.6 -0.418 27.8-137.3 -72.2 148.8 6.1 -17.3 26.2 45 45 A R + 0 0 48 295,-0.2 -1,-0.0 1,-0.1 295,-0.0 -0.936 20.8 179.3-108.3 115.8 9.1 -18.6 28.2 46 46 A W S S+ 0 0 45 -2,-0.6 -1,-0.1 1,-0.3 -2,-0.0 0.737 82.3 18.1 -82.8 -24.4 12.1 -19.5 26.0 47 47 A L S S- 0 0 45 -3,-0.1 -1,-0.3 400,-0.0 3,-0.1 -0.973 104.3 -83.9-141.7 149.3 14.0 -20.5 29.1 48 48 A P - 0 0 100 0, 0.0 -2,-0.1 0, 0.0 2,-0.0 -0.180 54.2-101.8 -54.1 145.0 12.7 -21.3 32.6 49 49 A A - 0 0 20 5,-0.1 2,-0.5 397,-0.1 397,-0.2 -0.319 27.8-142.5 -69.9 153.5 12.1 -18.3 34.8 50 50 A E + 0 0 68 395,-2.6 9,-0.3 394,-0.1 2,-0.3 -0.913 27.1 166.6-125.1 105.2 14.6 -17.4 37.5 51 51 A Y > - 0 0 9 -2,-0.5 3,-1.6 7,-0.1 6,-0.1 -0.839 47.6-115.3-115.6 153.7 13.2 -16.0 40.8 52 52 A E T 3 S+ 0 0 19 5,-2.0 -1,-0.1 -2,-0.3 14,-0.1 0.867 124.5 29.0 -52.3 -40.7 14.9 -15.5 44.1 53 53 A D T 3 S- 0 0 59 4,-0.6 -1,-0.3 -3,-0.0 -3,-0.0 0.205 114.8-115.6-104.6 12.4 12.6 -18.2 45.6 54 54 A G S < S+ 0 0 45 -3,-1.6 -2,-0.1 3,-0.3 -5,-0.1 0.457 102.3 59.1 68.9 -0.1 12.3 -20.0 42.3 55 55 A L S S- 0 0 57 2,-0.1 122,-3.1 121,-0.1 -1,-0.1 0.724 122.2 -32.3-122.3 -57.8 8.5 -19.1 42.1 56 56 A A S S+ 0 0 18 120,-0.2 389,-0.1 1,-0.1 -4,-0.1 0.579 94.2 101.4-142.2 -33.7 7.6 -15.4 42.2 57 57 A L - 0 0 48 -6,-0.1 -5,-2.0 1,-0.1 -4,-0.6 -0.405 65.5-129.0 -66.6 132.5 9.9 -13.2 44.2 58 58 A P > - 0 0 0 0, 0.0 3,-1.4 0, 0.0 4,-0.3 -0.421 28.4 -94.7 -79.4 155.8 12.4 -11.2 42.1 59 59 A F T 3 S+ 0 0 25 -9,-0.3 7,-0.1 383,-0.3 386,-0.1 -0.530 115.2 41.3 -68.1 132.5 16.1 -11.1 42.7 60 60 A G T 3 S+ 0 0 31 2,-0.3 -1,-0.3 5,-0.3 3,-0.1 0.401 88.1 100.7 106.8 2.2 16.8 -8.0 44.8 61 61 A W S < S+ 0 0 34 -3,-1.4 2,-0.6 1,-0.2 -2,-0.1 0.959 78.1 43.0 -82.5 -59.7 13.8 -8.6 47.0 62 62 A T S > S- 0 0 25 -4,-0.3 3,-1.0 1,-0.2 -2,-0.3 -0.810 75.6-147.0 -93.4 122.3 15.3 -10.1 50.1 63 63 A Q T 3 S+ 0 0 128 -2,-0.6 -1,-0.2 1,-0.2 -2,-0.0 0.919 95.5 47.8 -50.7 -54.0 18.5 -8.4 51.2 64 64 A R T 3 S+ 0 0 185 7,-0.1 2,-0.5 2,-0.0 -1,-0.2 0.640 93.0 90.5 -68.1 -15.9 20.2 -11.5 52.6 65 65 A K < - 0 0 86 -3,-1.0 -5,-0.3 4,-0.0 2,-0.2 -0.731 63.5-161.1 -88.3 125.1 19.4 -13.7 49.5 66 66 A T - 0 0 66 -2,-0.5 2,-0.6 5,-0.1 5,-0.2 -0.503 19.3-125.0 -99.5 167.7 22.1 -13.6 46.8 67 67 A R B > S-C 70 0C 7 3,-3.5 3,-1.1 -2,-0.2 422,-0.1 -0.965 94.6 -21.0-112.4 114.9 22.2 -14.5 43.2 68 68 A N T 3 S- 0 0 105 -2,-0.6 -1,-0.1 1,-0.3 3,-0.1 0.769 133.4 -46.5 57.5 25.3 24.9 -17.0 42.5 69 69 A G T 3 S+ 0 0 48 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.610 122.2 89.4 94.8 13.5 26.6 -15.9 45.7 70 70 A F B < S-C 67 0C 87 -3,-1.1 -3,-3.5 416,-0.0 -1,-0.3 -0.977 74.8-111.9-143.3 154.2 26.3 -12.1 45.2 71 71 A R - 0 0 172 -2,-0.3 -5,-0.1 -5,-0.2 -8,-0.1 -0.548 36.5-122.5 -78.9 148.6 24.0 -9.3 46.0 72 72 A V - 0 0 24 -2,-0.2 412,-0.1 1,-0.0 3,-0.1 -0.805 30.4-114.0 -93.1 136.0 22.5 -7.7 42.9 73 73 A P - 0 0 15 0, 0.0 410,-0.0 0, 0.0 -1,-0.0 -0.336 38.4 -91.5 -66.5 152.3 23.2 -4.0 42.6 74 74 A L > - 0 0 67 1,-0.1 4,-2.0 2,-0.0 5,-0.2 -0.313 32.1-122.8 -61.1 143.9 20.3 -1.5 42.9 75 75 A A H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.918 110.7 51.4 -55.9 -45.3 18.7 -0.7 39.6 76 76 A R H > S+ 0 0 3 67,-0.4 4,-3.2 2,-0.2 -1,-0.2 0.842 106.7 52.8 -64.1 -34.9 19.4 3.1 40.1 77 77 A E H > S+ 0 0 51 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.957 109.6 47.8 -66.5 -47.7 23.1 2.6 40.8 78 78 A V H X>S+ 0 0 0 -4,-2.0 4,-1.6 1,-0.2 5,-1.0 0.897 113.6 51.6 -57.0 -38.2 23.6 0.6 37.6 79 79 A S H X>S+ 0 0 0 -4,-2.1 5,-1.7 -5,-0.2 4,-1.1 0.977 112.7 42.4 -62.0 -55.4 21.7 3.4 36.0 80 80 A N H <5S+ 0 0 47 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.856 118.6 43.6 -60.5 -39.8 23.9 6.2 37.5 81 81 A K H <5S+ 0 0 112 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.744 133.2 10.6 -82.8 -22.3 27.2 4.4 36.9 82 82 A I H <5S+ 0 0 7 -4,-1.6 330,-0.4 -5,-0.3 -3,-0.2 0.725 123.9 48.8-123.5 -41.1 26.8 3.1 33.4 83 83 A V T < + 0 0 51 -2,-0.8 3,-0.7 2,-0.1 2,-0.2 0.287 50.0 113.9 -84.4 8.9 24.6 15.4 24.2 89 89 A E T 3 S+ 0 0 144 1,-0.2 -2,-0.0 2,-0.1 0, 0.0 -0.619 83.6 4.4 -81.9 144.9 27.2 16.5 21.5 90 90 A G T 3 S+ 0 0 69 -2,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.587 95.2 114.0 62.5 13.5 28.2 14.0 18.8 91 91 A V < + 0 0 4 -3,-0.7 315,-2.5 2,-0.1 -2,-0.1 0.673 46.9 109.0 -87.4 -16.3 25.7 11.5 20.2 92 92 A L E S-D 405 0D 70 313,-0.2 2,-1.0 -4,-0.2 313,-0.2 -0.284 75.7-116.7 -68.0 142.5 23.5 11.6 17.0 93 93 A D E > - 0 0 5 311,-2.8 3,-1.5 3,-0.2 311,-0.4 -0.681 19.4-157.7 -80.4 101.8 23.3 8.7 14.5 94 94 A Q E 3 S+ 0 0 130 -2,-1.0 -1,-0.2 1,-0.3 3,-0.1 0.562 89.5 38.9 -57.6 -6.8 24.7 10.2 11.3 95 95 A N E 3 S+ 0 0 77 1,-0.1 2,-0.4 473,-0.1 -1,-0.3 0.213 99.8 69.4-137.2 23.0 22.8 7.5 9.4 96 96 A R E < - 0 0 14 -3,-1.5 308,-2.1 472,-0.3 472,-0.3 -0.979 69.9-135.0-140.8 123.0 19.4 6.8 11.0 97 97 A S E >> -D 403 0D 0 470,-1.9 3,-1.1 -2,-0.4 4,-0.7 -0.226 31.5-107.0 -68.3 168.7 16.5 9.3 10.8 98 98 A L H 3> S+ 0 0 6 304,-2.4 4,-2.0 301,-0.5 302,-0.2 0.702 120.0 71.5 -70.9 -16.1 14.5 10.0 13.9 99 99 A L H 3> S+ 0 0 3 300,-1.4 4,-2.9 303,-0.4 -1,-0.3 0.822 87.9 64.9 -65.4 -29.8 11.8 8.0 12.1 100 100 A F H <> S+ 0 0 0 -3,-1.1 4,-1.4 299,-0.2 -1,-0.2 0.936 104.7 41.3 -56.5 -55.6 14.0 5.0 12.8 101 101 A M H X S+ 0 0 16 -4,-0.7 4,-1.5 1,-0.2 3,-0.3 0.945 115.7 52.0 -59.3 -48.5 13.7 5.2 16.5 102 102 A Q H X S+ 0 0 1 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.860 105.4 52.7 -60.6 -39.2 9.9 6.0 16.2 103 103 A W H X S+ 0 0 4 -4,-2.9 4,-2.7 1,-0.2 5,-0.3 0.877 104.8 58.5 -65.1 -35.5 9.1 3.1 14.0 104 104 A G H X S+ 0 0 6 -4,-1.4 4,-2.3 -3,-0.3 -1,-0.2 0.931 107.1 45.1 -59.6 -44.0 10.8 0.8 16.6 105 105 A Q H X S+ 0 0 43 -4,-1.5 4,-3.0 2,-0.2 5,-0.2 0.928 112.6 53.1 -66.8 -38.8 8.4 2.0 19.4 106 106 A I H X S+ 0 0 1 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.946 112.8 41.4 -58.6 -56.0 5.4 1.6 17.1 107 107 A V H X S+ 0 0 0 -4,-2.7 4,-1.7 2,-0.2 3,-0.5 0.914 113.8 56.0 -58.4 -41.0 6.2 -2.0 16.1 108 108 A D H X S+ 0 0 23 -4,-2.3 4,-2.3 -5,-0.3 3,-0.5 0.942 105.3 49.3 -61.5 -43.9 7.1 -2.7 19.7 109 109 A H H < S+ 0 0 14 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.730 107.7 56.0 -70.3 -24.5 3.7 -1.5 20.9 110 110 A D H < S+ 0 0 0 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.871 113.8 41.5 -66.4 -36.6 2.0 -3.7 18.3 111 111 A L H < S+ 0 0 0 -4,-1.7 2,-0.3 -3,-0.5 -2,-0.2 0.867 118.0 11.8 -86.4 -40.3 3.8 -6.8 19.7 112 112 A D < + 0 0 7 -4,-2.3 2,-0.3 70,-0.1 -1,-0.2 -0.997 40.0 167.2-151.1 148.2 3.8 -6.6 23.5 113 113 A F - 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0 0 78 -8,-2.7 3,-0.2 26,-0.1 -8,-0.1 -0.743 66.5 -23.4 -86.7 104.0 9.0 26.4 12.9 369 369 A G S > S- 0 0 43 -2,-1.0 3,-0.6 1,-0.2 -9,-0.1 -0.132 92.4 -67.8 84.1 173.4 8.4 29.3 15.3 370 370 A P T 3 S+ 0 0 129 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.707 133.8 42.9 -78.9 -17.9 10.8 30.7 17.9 371 371 A E T 3 S+ 0 0 116 -3,-0.2 -2,-0.1 1,-0.1 -3,-0.0 -0.482 70.4 139.7-120.9 57.4 10.6 27.5 20.1 372 372 A A < + 0 0 9 -3,-0.6 -12,-0.9 -2,-0.1 2,-0.5 0.857 62.0 59.0 -69.1 -35.6 10.9 25.0 17.3 373 373 A E E S-N 359 0M 118 -14,-0.2 -14,-0.2 -3,-0.2 -1,-0.1 -0.854 70.4-177.0-101.4 127.3 13.2 22.7 19.3 374 374 A L E -N 358 0M 13 -16,-3.1 -16,-2.4 -2,-0.5 2,-0.1 -0.926 31.4-105.3-125.8 146.7 11.9 21.3 22.6 375 375 A P E > -N 357 0M 56 0, 0.0 3,-1.5 0, 0.0 -18,-0.3 -0.441 34.3-120.4 -66.9 140.7 13.5 19.2 25.3 376 376 A L G > S+ 0 0 5 -20,-3.3 3,-1.7 1,-0.3 -19,-0.1 0.839 107.1 61.0 -53.2 -38.8 12.3 15.6 25.2 377 377 A H G > S+ 0 0 39 -21,-0.3 3,-0.9 1,-0.3 -1,-0.3 0.716 93.1 64.2 -66.1 -20.4 10.8 15.7 28.8 378 378 A T G < S+ 0 0 50 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.430 100.4 56.8 -81.3 5.7 8.4 18.5 28.0 379 379 A L G X + 0 0 1 -3,-1.7 3,-1.3 -4,-0.2 -119,-1.3 0.303 67.5 120.4-119.3 8.5 6.7 16.1 25.6 380 380 A F B < S-M 259 0L 2 -3,-0.9 -121,-0.3 1,-0.3 -122,-0.2 -0.630 99.3 -7.0 -73.9 129.1 5.7 13.1 27.7 381 381 A F T 3 S+ 0 0 24 -123,-1.2 2,-0.8 -124,-0.6 -1,-0.3 0.830 97.7 150.3 51.8 38.3 1.9 12.9 27.5 382 382 A N < + 0 0 5 -3,-1.3 -1,-0.2 -125,-0.3 -119,-0.1 -0.862 10.2 149.9-105.3 102.9 1.8 16.2 25.6 383 383 A T >> + 0 0 0 -2,-0.8 4,-1.9 -137,-0.4 3,-0.8 0.592 65.7 68.6-103.6 -15.7 -1.1 16.3 23.2 384 384 A W H 3> S+ 0 0 47 1,-0.2 4,-2.3 -138,-0.2 -1,-0.1 0.777 86.9 65.6 -74.9 -27.6 -1.6 20.1 23.4 385 385 A R H 34 S+ 0 0 47 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.667 112.3 38.3 -67.1 -14.9 1.7 20.8 21.6 386 386 A I H <4>S+ 0 0 0 -3,-0.8 5,-1.8 4,-0.1 4,-0.3 0.766 123.9 37.6 -97.8 -40.6 -0.1 19.1 18.7 387 387 A I H <5S+ 0 0 36 -4,-1.9 3,-0.4 1,-0.2 -3,-0.2 0.976 129.0 28.9 -80.6 -51.5 -3.5 20.5 19.1 388 388 A K T <5S+ 0 0 138 -4,-2.3 -1,-0.2 1,-0.2 -3,-0.1 0.042 124.9 44.9 -97.1 26.9 -2.8 24.0 20.2 389 389 A D T 5S- 0 0 43 -3,-0.3 -1,-0.2 -5,-0.0 -2,-0.1 0.176 123.9 -45.2-163.1 34.6 0.5 24.5 18.4 390 390 A G T 5 - 0 0 24 -3,-0.4 3,-0.3 -4,-0.3 -3,-0.1 0.549 67.9-110.2 125.9 13.2 0.7 23.3 14.7 391 391 A G < - 0 0 4 -5,-1.8 4,-0.3 1,-0.2 -127,-0.1 -0.143 56.9 -63.5 53.6-166.9 -0.8 19.8 14.0 392 392 A I S > S+ 0 0 0 1,-0.1 4,-2.9 2,-0.1 3,-0.3 0.629 112.3 85.4 -94.0 -12.7 1.5 17.0 13.1 393 393 A D H > S+ 0 0 16 -3,-0.3 4,-1.9 1,-0.2 5,-0.2 0.903 90.7 50.8 -54.4 -46.4 3.1 18.1 9.8 394 394 A P H > S+ 0 0 6 0, 0.0 -33,-1.6 0, 0.0 4,-1.5 0.858 114.7 45.3 -61.1 -33.8 5.8 20.1 11.6 395 395 A L H > S+ 0 0 3 -3,-0.3 4,-2.5 -4,-0.3 -2,-0.2 0.881 107.7 55.1 -77.3 -39.8 6.6 17.0 13.7 396 396 A V H X S+ 0 0 0 -4,-2.9 4,-1.0 2,-0.2 -1,-0.2 0.809 107.1 53.1 -62.9 -33.5 6.5 14.6 10.8 397 397 A R H >X S+ 0 0 8 -4,-1.9 4,-3.0 -5,-0.2 3,-0.7 0.937 107.1 50.9 -63.6 -42.8 9.1 16.9 9.1 398 398 A G H 3X S+ 0 0 2 -4,-1.5 4,-2.8 -39,-0.3 -300,-0.4 0.923 105.8 55.9 -59.7 -42.7 11.3 16.6 12.2 399 399 A L H 3< S+ 0 0 3 -4,-2.5 -300,-1.4 1,-0.2 -301,-0.5 0.809 114.9 39.6 -57.6 -31.8 11.0 12.8 12.1 400 400 A L H << S+ 0 0 1 -4,-1.0 170,-0.6 -3,-0.7 -2,-0.2 0.891 123.0 36.3 -85.7 -44.4 12.3 12.9 8.5 401 401 A A H < S+ 0 0 18 -4,-3.0 -2,-0.2 168,-0.1 -3,-0.2 0.705 105.8 75.9 -85.1 -21.5 15.0 15.5 8.8 402 402 A K S < S- 0 0 83 -4,-2.8 -304,-2.4 -5,-0.4 -303,-0.4 -0.487 74.2-122.3 -93.1 164.8 16.3 14.8 12.3 403 403 A K E -D 97 0D 33 -306,-0.3 -306,-0.2 -305,-0.1 -305,-0.2 -0.713 14.8-123.9-105.0 153.9 18.5 11.9 13.5 404 404 A S E - 0 0 0 -308,-2.1 -311,-2.8 -311,-0.4 2,-0.4 -0.337 42.5 -93.9 -81.4 171.7 18.0 9.3 16.2 405 405 A K E -D 92 0D 1 -52,-3.0 2,-0.3 -313,-0.2 -313,-0.2 -0.765 38.2-129.4 -87.7 134.6 20.6 9.0 19.0 406 406 A L - 0 0 53 -315,-2.5 2,-0.1 -2,-0.4 100,-0.0 -0.688 28.3-110.2 -81.3 136.7 23.2 6.5 18.1 407 407 A M - 0 0 19 -2,-0.3 2,-0.3 99,-0.1 5,-0.2 -0.459 42.7-175.5 -66.9 144.9 23.7 4.0 20.9 408 408 A N B > -P 411 0O 51 3,-0.6 3,-1.0 4,-0.1 -317,-0.0 -0.982 31.6-134.6-147.0 129.5 27.1 4.6 22.6 409 409 A Q T 3 S+ 0 0 35 -2,-0.3 3,-0.2 1,-0.3 -1,-0.1 0.709 110.5 38.9 -57.9 -24.5 28.8 2.6 25.4 410 410 A D T 3 S+ 0 0 96 1,-0.2 -1,-0.3 2,-0.1 2,-0.2 0.520 125.3 39.3-102.0 -10.0 29.8 5.8 27.3 411 411 A K B < S+P 408 0O 45 -3,-1.0 -3,-0.6 1,-0.1 -1,-0.2 -0.693 70.9 150.1-139.5 81.6 26.5 7.6 26.5 412 412 A M + 0 0 0 -329,-0.6 2,-0.5 -330,-0.4 -328,-0.2 0.979 61.9 17.5 -82.6 -62.7 23.6 5.1 26.7 413 413 A V S S- 0 0 2 -330,-2.1 -1,-0.2 -334,-0.1 -328,-0.2 -0.971 77.0-121.7-122.1 124.8 20.4 6.8 27.8 414 414 A T >> - 0 0 1 -60,-0.5 4,-2.6 -2,-0.5 3,-1.8 -0.217 23.1-120.5 -58.9 145.3 19.7 10.5 27.7 415 415 A S H 3>>S+ 0 0 29 -330,-0.4 4,-2.5 1,-0.3 5,-1.6 0.684 107.9 76.2 -63.2 -16.6 18.8 12.2 30.9 416 416 A E H 345S+ 0 0 18 3,-0.2 -1,-0.3 1,-0.2 -2,-0.0 0.860 114.9 22.0 -61.2 -32.7 15.5 13.3 29.4 417 417 A L H <>5S+ 0 0 7 -3,-1.8 16,-2.1 -63,-0.1 4,-0.5 0.779 125.7 52.4 -99.6 -39.2 14.5 9.7 30.0 418 418 A R H <5S+ 0 0 20 -4,-2.6 -3,-0.2 14,-0.3 17,-0.2 0.775 131.3 9.5 -72.4 -29.3 16.9 8.6 32.7 419 419 A N T <5S+ 0 0 36 -4,-2.5 -3,-0.2 -5,-0.2 -1,-0.1 0.560 131.5 45.3-124.6 -17.8 16.2 11.5 35.1 420 420 A K T 4< + 0 0 80 -5,-1.6 12,-0.2 10,-0.2 10,-0.2 0.108 69.0 138.5-120.5 25.9 13.2 13.3 33.8 421 421 A L B < -Q 431 0P 7 10,-2.2 10,-2.7 -4,-0.5 9,-0.6 -0.453 41.7-143.1 -71.6 141.4 10.6 10.6 32.8 422 422 A F - 0 0 4 7,-0.2 7,-0.1 8,-0.2 -41,-0.1 -0.884 13.5-166.6-106.4 136.4 7.0 11.3 33.7 423 423 A Q > - 0 0 47 5,-0.5 3,-1.6 -2,-0.4 5,-0.1 -0.976 31.9 -99.1-123.7 132.5 4.7 8.5 34.8 424 424 A P T 3 S+ 0 0 47 0, 0.0 3,-0.1 0, 0.0 -189,-0.0 -0.197 105.5 12.7 -51.2 141.2 0.9 8.8 35.1 425 425 A T T 3 S+ 0 0 96 1,-0.3 2,-0.3 2,-0.0 -190,-0.0 0.174 108.2 96.1 73.4 -14.5 -0.6 9.5 38.6 426 426 A H S < S- 0 0 17 -3,-1.6 -1,-0.3 1,-0.1 -4,-0.0 -0.607 71.5-147.1 -94.8 154.4 2.9 10.3 39.8 427 427 A K + 0 0 129 -2,-0.3 2,-0.4 -3,-0.1 -1,-0.1 0.495 59.2 79.9-110.1 -5.6 3.4 14.0 39.7 428 428 A I - 0 0 81 -5,-0.1 2,-2.1 -7,-0.1 -5,-0.5 -0.849 66.7-136.3-116.1 146.3 7.1 14.7 38.8 429 429 A H S S+ 0 0 69 -2,-0.4 -7,-0.2 1,-0.2 -8,-0.1 -0.520 82.5 103.3 -84.8 65.1 9.2 14.7 35.7 430 430 A G + 0 0 2 -2,-2.1 -1,-0.2 -9,-0.6 -10,-0.2 0.196 43.7 117.4-137.3 21.2 11.7 12.9 37.8 431 431 A F B -Q 421 0P 6 -10,-2.7 -10,-2.2 -3,-0.3 2,-0.5 -0.418 53.3-132.1 -90.3 168.2 11.7 9.2 36.9 432 432 A D > - 0 0 0 -12,-0.2 4,-2.3 -13,-0.1 -14,-0.3 -0.903 11.0-170.5-123.8 103.3 14.4 6.9 35.4 433 433 A L H > S+ 0 0 25 -16,-2.1 4,-2.2 -2,-0.5 -15,-0.2 0.834 90.3 54.4 -59.9 -34.1 13.5 4.6 32.4 434 434 A A H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.931 109.4 46.1 -65.9 -47.0 16.9 2.8 32.7 435 435 A A H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.907 112.7 51.4 -61.8 -42.3 16.3 1.9 36.4 436 436 A I H X S+ 0 0 10 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.901 105.7 54.6 -63.8 -39.9 12.8 0.8 35.6 437 437 A N H X S+ 0 0 1 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.926 111.8 45.7 -59.0 -42.3 14.0 -1.5 32.8 438 438 A L H X S+ 0 0 0 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.947 113.4 46.3 -66.3 -50.8 16.3 -3.2 35.2 439 439 A Q H X S+ 0 0 11 -4,-2.7 4,-2.3 1,-0.2 3,-0.3 0.918 113.0 52.4 -57.2 -43.7 13.8 -3.6 38.0 440 440 A R H X S+ 0 0 24 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.838 103.0 57.1 -60.3 -38.6 11.3 -4.9 35.5 441 441 A C H <>S+ 0 0 2 -4,-1.7 5,-2.1 1,-0.2 -1,-0.2 0.862 112.0 42.4 -63.4 -36.5 13.7 -7.5 34.2 442 442 A R H ><5S+ 0 0 7 -4,-1.6 3,-1.7 -3,-0.3 -383,-0.3 0.849 108.4 58.7 -76.4 -35.6 14.0 -8.8 37.7 443 443 A D H 3<5S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.854 106.1 50.8 -61.2 -33.4 10.2 -8.5 38.2 444 444 A H T 3<5S- 0 0 0 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.372 115.2-115.6 -86.4 5.1 9.8 -10.8 35.2 445 445 A G T < 5 - 0 0 1 -3,-1.7 -395,-2.6 1,-0.2 -3,-0.2 0.900 46.9-174.1 63.0 42.2 12.2 -13.5 36.5 446 446 A M < - 0 0 6 -5,-2.1 -1,-0.2 -397,-0.2 -397,-0.1 -0.452 22.9-120.0 -73.5 138.0 14.7 -13.0 33.7 447 447 A P - 0 0 2 0, 0.0 45,-0.5 0, 0.0 -1,-0.1 -0.350 41.6 -91.0 -70.3 158.7 17.8 -15.3 33.4 448 448 A G B > -R 491 0Q 1 40,-0.2 4,-1.2 43,-0.1 3,-0.2 0.037 40.9 -92.2 -63.8 177.5 21.2 -13.6 33.7 449 449 A Y H > S+ 0 0 1 41,-1.3 4,-1.5 38,-0.4 3,-0.2 0.889 123.1 49.3 -58.6 -44.8 23.3 -12.3 30.8 450 450 A N H > S+ 0 0 0 37,-0.6 4,-2.9 2,-0.2 -1,-0.2 0.781 101.3 60.6 -70.1 -29.5 25.3 -15.6 30.3 451 451 A S H > S+ 0 0 48 -3,-0.2 4,-2.1 37,-0.2 -1,-0.2 0.904 111.0 43.6 -62.7 -38.3 22.2 -17.9 30.3 452 452 A W H X S+ 0 0 3 -4,-1.2 4,-2.0 2,-0.2 -2,-0.2 0.809 110.1 53.5 -75.8 -34.0 21.1 -15.9 27.2 453 453 A R H <>S+ 0 0 15 -4,-1.5 5,-3.1 2,-0.2 4,-0.2 0.938 112.8 46.6 -64.1 -44.9 24.6 -15.9 25.6 454 454 A G H ><5S+ 0 0 32 -4,-2.9 3,-1.5 1,-0.2 -2,-0.2 0.914 108.6 54.7 -61.3 -43.4 24.5 -19.6 26.1 455 455 A F H 3<5S+ 0 0 53 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.866 111.4 45.6 -57.5 -38.4 21.0 -19.7 24.6 456 456 A f T 3<5S- 0 0 16 -4,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.342 118.7-108.4 -89.1 4.9 22.3 -17.9 21.5 457 457 A G T < 5S+ 0 0 67 -3,-1.5 2,-0.3 1,-0.3 -3,-0.2 0.825 75.8 129.6 73.2 33.1 25.4 -20.1 21.1 458 458 A L < - 0 0 54 -5,-3.1 -1,-0.3 -6,-0.1 -2,-0.1 -0.802 64.0 -82.3-118.7 159.5 27.8 -17.4 22.2 459 459 A S - 0 0 74 -2,-0.3 -1,-0.1 1,-0.1 -5,-0.0 -0.148 31.9-138.4 -59.3 151.5 30.7 -17.4 24.7 460 460 A Q - 0 0 91 -7,-0.1 -1,-0.1 -6,-0.1 7,-0.1 -0.829 17.4-147.9-115.9 91.7 30.0 -16.9 28.4 461 461 A P + 0 0 10 0, 0.0 -11,-0.1 0, 0.0 3,-0.0 -0.286 19.1 178.3 -58.7 142.6 32.6 -14.7 29.9 462 462 A K + 0 0 99 25,-0.1 2,-0.3 24,-0.1 26,-0.1 0.420 59.0 49.5-123.5 -7.2 33.4 -15.4 33.6 463 463 A T S > S- 0 0 83 1,-0.2 4,-2.9 23,-0.1 5,-0.2 -0.816 85.7-106.2-130.5 165.1 36.2 -12.9 34.3 464 464 A L H > S+ 0 0 64 -2,-0.3 4,-2.4 2,-0.2 3,-0.4 0.993 126.0 46.3 -45.8 -67.6 36.9 -9.2 34.0 465 465 A K H > S+ 0 0 139 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.800 111.4 56.5 -50.8 -28.0 39.3 -10.0 31.2 466 466 A G H > S+ 0 0 17 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.965 109.0 42.3 -68.1 -50.4 36.6 -12.2 29.8 467 467 A L H X S+ 0 0 0 -4,-2.9 4,-3.5 -3,-0.4 5,-0.3 0.837 108.5 59.3 -64.8 -38.1 34.0 -9.5 29.7 468 468 A Q H X>S+ 0 0 27 -4,-2.4 4,-2.2 1,-0.2 5,-1.1 0.940 104.9 51.1 -57.8 -45.5 36.4 -6.8 28.3 469 469 A T H <5S+ 0 0 89 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.827 115.4 41.2 -61.2 -37.7 37.0 -9.0 25.3 470 470 A V H <5S+ 0 0 23 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.937 122.4 38.3 -77.7 -48.0 33.3 -9.5 24.6 471 471 A L H <5S- 0 0 2 -4,-3.5 -2,-0.2 28,-0.1 -3,-0.2 0.678 98.1-139.2 -75.6 -14.5 32.2 -5.9 25.3 472 472 A K T <5S+ 0 0 158 -4,-2.2 2,-0.2 -5,-0.3 -3,-0.2 0.918 73.8 98.4 55.3 44.6 35.4 -4.7 23.6 473 473 A N >< - 0 0 27 -5,-1.1 4,-1.8 -6,-0.2 5,-0.1 -0.740 54.6-167.1-165.0 108.5 35.6 -2.1 26.4 474 474 A K H > S+ 0 0 148 -2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.965 89.3 49.1 -62.5 -56.0 37.8 -2.3 29.6 475 475 A I H > S+ 0 0 96 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.823 113.0 46.0 -55.9 -39.4 36.2 0.5 31.5 476 476 A L H > S+ 0 0 5 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.919 112.6 51.2 -71.2 -43.1 32.6 -0.6 31.0 477 477 A A H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.892 110.7 49.1 -59.3 -41.6 33.5 -4.2 31.8 478 478 A K H X S+ 0 0 107 -4,-2.5 4,-3.1 2,-0.2 -1,-0.2 0.923 110.2 49.7 -64.6 -47.2 35.2 -3.1 35.1 479 479 A K H X S+ 0 0 85 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.896 114.0 46.8 -58.4 -42.6 32.2 -0.9 36.1 480 480 A L H X S+ 0 0 1 -4,-2.4 4,-3.4 2,-0.2 5,-0.4 0.873 112.8 47.8 -68.3 -40.6 29.9 -3.9 35.5 481 481 A M H X S+ 0 0 29 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.934 109.5 53.8 -66.4 -43.2 32.1 -6.4 37.3 482 482 A D H < S+ 0 0 96 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.849 119.1 35.9 -58.0 -34.6 32.4 -4.0 40.3 483 483 A L H < S+ 0 0 14 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.892 131.9 26.0 -84.8 -39.7 28.6 -3.8 40.4 484 484 A Y H < S- 0 0 0 -4,-3.4 -3,-0.2 -5,-0.1 -2,-0.2 0.766 78.6-153.8-100.0 -29.5 27.7 -7.4 39.5 485 485 A K S < S+ 0 0 115 -4,-2.9 -4,-0.1 -5,-0.4 -3,-0.1 0.375 80.3 44.0 64.0 -2.9 30.8 -9.3 40.6 486 486 A T S >> S- 0 0 18 -6,-0.3 3,-2.2 -23,-0.0 4,-0.6 -0.851 75.9-135.8-159.7 136.3 29.9 -12.0 38.0 487 487 A P T 34 S+ 0 0 0 0, 0.0 -37,-0.6 0, 0.0 -38,-0.4 0.718 104.2 75.0 -60.1 -14.7 28.8 -11.7 34.4 488 488 A D T 34 S+ 0 0 45 1,-0.2 -37,-0.2 -39,-0.2 -40,-0.2 0.737 97.9 44.3 -68.4 -23.0 26.3 -14.4 35.4 489 489 A N T <4 S+ 0 0 0 -3,-2.2 -1,-0.2 -41,-0.2 2,-0.2 0.559 78.6 120.7 -98.8 -12.3 24.3 -11.7 37.2 490 490 A I S < S- 0 0 1 -4,-0.6 -41,-1.3 -3,-0.3 -40,-0.1 -0.361 73.2-113.0 -57.9 120.1 24.3 -8.9 34.7 491 491 A D B >> -R 448 0Q 4 -2,-0.2 4,-2.6 -43,-0.2 3,-0.6 -0.328 21.8-124.2 -56.8 130.4 20.7 -8.1 33.9 492 492 A I H 3> S+ 0 0 2 -45,-0.5 4,-2.6 1,-0.2 5,-0.3 0.804 105.5 61.9 -48.1 -36.2 20.0 -9.1 30.2 493 493 A W H 3> S+ 0 0 1 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.951 114.8 30.5 -57.6 -52.2 18.7 -5.6 29.4 494 494 A I H <> S+ 0 0 0 -3,-0.6 4,-0.9 2,-0.2 -2,-0.2 0.855 120.2 52.5 -76.7 -36.8 22.0 -3.8 30.1 495 495 A G H X S+ 0 0 2 -4,-2.6 4,-0.5 1,-0.2 3,-0.5 0.918 111.2 47.5 -65.9 -41.9 24.3 -6.7 29.2 496 496 A G H >< S+ 0 0 0 -4,-2.6 3,-0.7 -5,-0.3 12,-0.4 0.890 113.3 47.3 -66.4 -38.5 22.7 -7.1 25.8 497 497 A N H 3< S+ 0 0 5 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.577 101.3 66.4 -80.5 -8.6 22.9 -3.4 25.1 498 498 A A H 3< S+ 0 0 0 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.657 78.5 100.8 -86.0 -14.9 26.5 -3.1 26.1 499 499 A E S << S- 0 0 1 -3,-0.7 9,-0.2 -4,-0.5 -28,-0.1 -0.417 84.4-103.4 -71.8 143.5 27.7 -5.2 23.3 500 500 A P - 0 0 37 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.288 47.3 -92.3 -63.3 153.6 29.2 -3.5 20.3 501 501 A M - 0 0 53 7,-0.2 7,-0.3 -94,-0.1 3,-0.1 -0.480 37.0-116.0 -73.7 134.5 27.0 -3.3 17.2 502 502 A V > - 0 0 18 5,-2.3 3,-2.0 -2,-0.2 5,-0.1 -0.225 52.9 -73.5 -61.2 154.6 27.2 -5.9 14.5 503 503 A E T 3 S+ 0 0 121 1,-0.3 -184,-2.1 -185,-0.1 -183,-0.3 -0.226 117.7 0.9 -50.8 138.1 28.4 -4.8 11.1 504 504 A R T 3 S+ 0 0 150 -186,-0.2 -186,-0.4 1,-0.2 -1,-0.3 0.375 118.1 89.9 63.0 -2.7 25.6 -2.7 9.4 505 505 A G S < S- 0 0 1 -3,-2.0 -188,-0.2 -188,-0.3 -189,-0.2 -0.419 74.0-128.6-112.3-168.9 23.2 -3.0 12.3 506 506 A R S S+ 0 0 38 -190,-2.7 2,-0.3 -2,-0.1 -189,-0.1 0.221 82.9 58.0-132.0 22.4 22.3 -1.2 15.5 507 507 A V S S- 0 0 2 -191,-0.7 -5,-2.3 -5,-0.1 -2,-0.1 -0.943 80.8-104.9-144.2 161.4 22.4 -4.0 18.1 508 508 A G > - 0 0 1 -12,-0.4 4,-2.6 -2,-0.3 -7,-0.2 -0.052 43.0 -91.3 -76.3-175.1 25.0 -6.4 19.4 509 509 A P H > S+ 0 0 47 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.891 122.4 52.8 -68.9 -39.7 25.2 -10.2 18.6 510 510 A L H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.969 115.5 39.6 -60.0 -53.4 23.2 -11.3 21.7 511 511 A L H > S+ 0 0 1 -15,-0.4 4,-3.9 2,-0.2 5,-0.5 0.911 110.1 59.7 -63.2 -41.5 20.3 -9.0 20.8 512 512 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.899 110.2 44.5 -53.2 -43.1 20.6 -9.7 17.1 513 513 A f H X S+ 0 0 3 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.920 116.4 44.6 -66.5 -46.7 19.9 -13.3 17.9 514 514 A L H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.933 119.9 40.3 -66.3 -47.4 17.1 -12.6 20.4 515 515 A L H X S+ 0 0 2 -4,-3.9 4,-2.4 1,-0.2 5,-0.3 0.949 113.8 56.9 -65.4 -47.5 15.4 -10.1 18.1 516 516 A G H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.5 -2,-0.2 0.913 107.9 44.7 -49.0 -54.8 16.1 -12.2 15.1 517 517 A R H X S+ 0 0 85 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.966 112.2 51.6 -55.6 -57.1 14.4 -15.3 16.4 518 518 A Q H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 5,-0.3 0.910 112.4 44.0 -47.8 -55.4 11.3 -13.5 17.6 519 519 A F H X S+ 0 0 3 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.867 111.7 54.4 -62.0 -35.6 10.6 -11.7 14.3 520 520 A Q H X S+ 0 0 39 -4,-2.1 4,-2.5 -5,-0.3 5,-0.2 0.907 112.6 45.7 -62.7 -38.5 11.3 -14.9 12.4 521 521 A Q H X S+ 0 0 19 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.841 108.4 51.0 -76.0 -35.3 8.7 -16.6 14.6 522 522 A I H < S+ 0 0 0 -4,-2.4 -335,-0.2 -5,-0.2 -1,-0.2 0.803 118.0 43.7 -73.5 -23.0 5.9 -13.9 14.5 523 523 A R H >< S+ 0 0 16 -4,-1.5 3,-2.2 -5,-0.3 -2,-0.2 0.971 117.4 39.4 -79.6 -66.1 6.3 -14.1 10.7 524 524 A D H 3< S+ 0 0 25 -4,-2.5 -192,-2.8 1,-0.3 -189,-0.2 0.744 118.0 51.8 -56.8 -25.6 6.6 -17.8 10.0 525 525 A G T 3< S+ 0 0 0 -4,-1.5 2,-0.6 -5,-0.2 -1,-0.3 0.370 86.5 99.8 -95.9 6.8 3.9 -18.5 12.6 526 526 A D X - 0 0 0 -3,-2.2 3,-1.4 1,-0.1 6,-0.1 -0.832 52.7-164.1-100.9 116.5 1.3 -16.1 11.3 527 527 A R T 3 S+ 0 0 39 -2,-0.6 -1,-0.1 1,-0.3 -196,-0.1 0.751 92.9 49.2 -66.3 -24.4 -1.5 -17.5 9.2 528 528 A F T 3 S+ 0 0 22 7,-0.0 -1,-0.3 3,-0.0 -506,-0.1 0.122 73.0 145.8-103.7 21.5 -2.4 -14.1 8.0 529 529 A W X - 0 0 5 -3,-1.4 3,-2.0 -6,-0.2 6,-0.2 -0.377 56.5-124.9 -56.9 132.8 1.1 -12.9 6.9 530 530 A W T 3 S+ 0 0 16 1,-0.3 6,-0.4 -229,-0.1 5,-0.2 0.838 108.0 45.8 -50.8 -41.0 0.5 -10.7 3.9 531 531 A E T 3 S+ 0 0 78 4,-0.1 -1,-0.3 -229,-0.1 -2,-0.1 0.462 85.8 115.8 -85.7 0.6 2.9 -12.7 1.6 532 532 A N S X S- 0 0 19 -3,-2.0 3,-2.1 1,-0.1 4,-0.5 -0.562 81.3 -97.6 -73.6 126.7 1.5 -16.0 2.7 533 533 A P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -202,-0.1 -0.051 106.5 18.6 -42.0 134.4 -0.2 -17.8 -0.2 534 534 A G T 3 S+ 0 0 76 2,-0.4 3,-0.1 -3,-0.1 -3,-0.1 0.326 97.9 94.0 86.0 -8.4 -4.0 -17.3 -0.1 535 535 A V S < S+ 0 0 18 -3,-2.1 2,-0.2 -6,-0.2 -5,-0.1 0.932 98.3 9.6 -81.7 -49.8 -4.2 -14.2 2.1 536 536 A F S S- 0 0 11 -4,-0.5 -2,-0.4 -6,-0.4 2,-0.2 -0.653 93.2 -94.6-117.0 176.4 -4.2 -11.6 -0.7 537 537 A T > - 0 0 67 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.600 36.1-109.5 -90.3 158.4 -4.5 -12.1 -4.4 538 538 A E H > S+ 0 0 141 1,-0.2 4,-0.6 -2,-0.2 -1,-0.1 0.881 121.2 46.6 -53.1 -38.5 -1.4 -12.4 -6.6 539 539 A K H >> S+ 0 0 153 2,-0.2 4,-1.1 1,-0.2 3,-0.6 0.852 107.4 53.4 -74.8 -36.9 -2.3 -9.0 -8.0 540 540 A Q H >> S+ 0 0 20 1,-0.2 4,-2.1 49,-0.2 3,-0.6 0.916 104.9 59.5 -62.7 -39.3 -3.0 -7.3 -4.7 541 541 A R H 3X S+ 0 0 36 -4,-2.4 4,-1.3 1,-0.3 -1,-0.2 0.733 101.8 50.9 -60.6 -28.1 0.4 -8.5 -3.6 542 542 A D H << S+ 0 0 111 -4,-0.6 -1,-0.3 -3,-0.6 -2,-0.2 0.774 109.8 51.8 -80.6 -25.7 2.2 -6.7 -6.4 543 543 A S H X< S+ 0 0 9 -4,-1.1 3,-1.1 -3,-0.6 43,-0.3 0.864 109.0 49.2 -74.6 -38.9 0.4 -3.5 -5.4 544 544 A L H >< S+ 0 0 1 -4,-2.1 3,-2.5 1,-0.2 -2,-0.2 0.879 94.5 74.2 -66.2 -39.1 1.4 -3.8 -1.8 545 545 A Q T 3< S+ 0 0 96 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.644 91.4 61.5 -48.4 -15.9 5.0 -4.3 -2.9 546 546 A K T < S+ 0 0 101 -3,-1.1 -1,-0.3 -4,-0.1 -2,-0.2 0.523 72.9 120.3 -96.1 -6.0 5.0 -0.6 -3.6 547 547 A V < + 0 0 8 -3,-2.5 2,-0.3 -4,-0.1 37,-0.1 -0.267 34.1 176.5 -58.7 146.6 4.3 0.9 -0.1 548 548 A S > - 0 0 23 35,-0.2 4,-1.7 1,-0.1 5,-0.1 -0.960 41.9-123.9-147.1 153.2 6.8 3.2 1.3 549 549 A F H > S+ 0 0 10 -2,-0.3 4,-1.7 2,-0.2 5,-0.1 0.858 115.6 60.4 -68.4 -31.3 6.7 5.2 4.5 550 550 A S H >> S+ 0 0 3 14,-0.3 4,-2.2 1,-0.2 3,-0.7 0.970 103.8 47.8 -55.0 -56.5 7.3 8.2 2.2 551 551 A R H 3> S+ 0 0 22 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.873 106.3 57.7 -52.6 -44.0 4.0 7.5 0.4 552 552 A L H 3X S+ 0 0 4 -4,-1.7 4,-1.1 1,-0.2 -1,-0.3 0.876 108.8 46.5 -56.8 -38.4 2.1 7.1 3.7 553 553 A I H < S+ 0 0 16 -4,-2.2 3,-0.6 1,-0.2 -2,-0.2 0.913 113.9 46.2 -58.9 -45.4 2.3 12.1 1.3 555 555 A D H 3< S+ 0 0 38 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.731 121.8 36.5 -71.6 -21.6 -1.1 10.5 1.4 556 556 A N H 3< S+ 0 0 9 -4,-1.1 2,-0.3 -5,-0.2 -1,-0.2 0.127 115.1 33.4-125.7 24.1 -1.8 11.5 5.0 557 557 A T S << S- 0 0 10 -3,-0.6 -4,-0.0 -4,-0.6 0, 0.0 -0.872 84.1 -98.7-149.5-169.0 -0.3 15.0 5.7 558 558 A H S S+ 0 0 100 -2,-0.3 2,-0.4 -334,-0.0 -4,-0.1 -0.253 80.5 117.4-114.8 44.2 0.2 18.2 3.8 559 559 A I + 0 0 6 -6,-0.4 -2,-0.2 -5,-0.1 3,-0.1 -0.892 31.4 170.9-109.9 140.5 3.9 17.5 3.0 560 560 A T + 0 0 83 -2,-0.4 19,-2.1 1,-0.1 2,-0.6 0.344 62.1 75.8-129.8 -1.3 5.0 17.1 -0.6 561 561 A K E +S 578 0R 82 17,-0.2 17,-0.2 18,-0.1 -1,-0.1 -0.929 61.5 147.8-116.6 104.7 8.7 17.0 -0.1 562 562 A V E -S 577 0R 0 15,-2.3 15,-2.3 -2,-0.6 -12,-0.0 -0.961 44.0-109.7-138.7 155.5 9.9 13.6 1.2 563 563 A P E -S 576 0R 0 0, 0.0 3,-0.2 0, 0.0 13,-0.2 -0.250 21.8-129.2 -75.5 170.8 12.9 11.3 1.0 564 564 A L S S+ 0 0 97 11,-0.5 2,-0.6 1,-0.3 -14,-0.3 0.803 102.9 42.1 -88.3 -33.4 12.8 8.0 -0.9 565 565 A H S > S- 0 0 126 10,-0.2 3,-1.3 1,-0.1 -1,-0.3 -0.828 72.3-171.7-118.9 89.8 14.3 6.0 2.0 566 566 A A T 3 S+ 0 0 8 -2,-0.6 -467,-0.3 -3,-0.2 -466,-0.2 0.743 76.5 55.3 -52.5 -36.1 12.7 7.3 5.2 567 567 A F T 3 S+ 0 0 11 -468,-0.1 -470,-1.9 -471,-0.1 -1,-0.2 0.634 92.5 79.5 -80.5 -13.0 14.8 5.4 7.8 568 568 A Q S < S- 0 0 76 -3,-1.3 -472,-0.3 -472,-0.3 -473,-0.1 -0.638 100.5 -83.6 -93.5 154.6 18.2 6.7 6.7 569 569 A A - 0 0 12 -2,-0.2 2,-0.4 -472,-0.1 -1,-0.1 -0.337 56.3-173.6 -54.0 125.4 19.6 10.1 7.6 570 570 A N - 0 0 5 -170,-0.6 2,-0.4 -168,-0.2 -1,-0.0 -0.991 11.8-159.0-133.0 132.8 18.1 12.6 5.0 571 571 A N > - 0 0 89 -2,-0.4 4,-2.9 5,-0.0 5,-0.3 -0.888 28.5 -90.5-114.2 140.2 18.8 16.2 4.5 572 572 A Y T 4 S+ 0 0 64 -2,-0.4 -208,-0.0 1,-0.2 -2,-0.0 -0.707 95.6 3.7 -93.5 145.3 16.7 18.9 2.7 573 573 A P T >4 S+ 0 0 88 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 -0.997 126.8 53.9 -89.5 -7.0 16.5 19.8 -0.0 574 574 A H T 34 S+ 0 0 161 1,-0.3 -2,-0.2 -11,-0.0 -4,-0.0 0.883 113.1 37.1 -50.6 -57.9 19.1 17.3 -1.5 575 575 A D T 3< S+ 0 0 49 -4,-2.9 -11,-0.5 -12,-0.0 2,-0.3 0.337 104.1 94.7 -82.4 10.2 17.7 14.0 -0.3 576 576 A F E < +S 563 0R 18 -3,-1.4 2,-0.3 -5,-0.3 -15,-0.1 -0.763 48.6 178.5-106.4 149.7 14.1 15.1 -0.8 577 577 A V E -S 562 0R 43 -15,-2.3 -15,-2.3 -2,-0.3 2,-0.4 -0.848 37.4 -82.7-137.4 172.7 11.7 14.7 -3.8 578 578 A D E > -S 561 0R 86 -2,-0.3 3,-3.0 -17,-0.2 -17,-0.2 -0.659 35.5-124.6 -84.6 133.3 8.2 15.5 -4.8 579 579 A g G > S+ 0 0 8 -19,-2.1 3,-1.1 -2,-0.4 -1,-0.1 0.688 107.5 68.9 -44.5 -26.4 5.5 13.1 -3.6 580 580 A S G 3 S+ 0 0 102 1,-0.3 -1,-0.3 -20,-0.2 4,-0.1 0.735 91.3 58.5 -69.5 -24.8 4.4 12.7 -7.3 581 581 A T G < S+ 0 0 93 -3,-3.0 2,-0.4 2,-0.1 -1,-0.3 0.022 94.1 97.5 -92.2 27.2 7.7 10.9 -8.1 582 582 A V S < S- 0 0 12 -3,-1.1 -34,-0.0 -32,-0.0 -18,-0.0 -0.969 84.5-107.0-126.1 124.9 6.7 8.4 -5.4 583 583 A D - 0 0 98 -2,-0.4 -35,-0.2 1,-0.1 -32,-0.1 -0.168 36.3-155.2 -48.1 124.3 4.9 5.0 -5.9 584 584 A K - 0 0 141 -4,-0.1 2,-0.8 -37,-0.1 -1,-0.1 -0.372 27.0 -98.4 -91.5 176.6 1.3 5.2 -4.8 585 585 A L - 0 0 13 -2,-0.1 2,-0.7 -34,-0.1 -41,-0.1 -0.888 33.9-147.4-101.4 109.0 -0.7 2.2 -3.7 586 586 A D - 0 0 79 -2,-0.8 -40,-0.1 -43,-0.3 -43,-0.1 -0.696 15.6-175.6 -78.6 115.7 -2.8 1.1 -6.6 587 587 A L > + 0 0 2 -2,-0.7 3,-2.5 1,-0.2 4,-0.3 0.370 52.3 106.9 -94.2 0.4 -6.1 -0.3 -5.2 588 588 A S G > S+ 0 0 66 1,-0.3 3,-2.8 2,-0.2 -1,-0.2 0.888 70.4 64.9 -43.8 -46.2 -7.6 -1.5 -8.4 589 589 A P G 3 S+ 0 0 36 0, 0.0 -1,-0.3 0, 0.0 -49,-0.2 0.573 93.1 63.7 -66.2 0.8 -7.0 -5.1 -7.5 590 590 A W G < S+ 0 0 4 -3,-2.5 -2,-0.2 -50,-0.1 2,-0.1 0.581 74.7 109.8 -93.6 -10.1 -9.5 -4.7 -4.6 591 591 A A < - 0 0 53 -3,-2.8 2,-0.4 -4,-0.3 -307,-0.1 -0.414 59.0-153.5 -62.9 138.7 -12.4 -4.0 -7.0 592 592 A S - 0 0 42 -309,-0.3 2,-0.6 -2,-0.1 -1,-0.1 -0.707 14.1-177.0-125.9 85.8 -14.7 -7.0 -6.9 593 593 A R + 0 0 218 -2,-0.4 -309,-0.0 1,-0.1 -2,-0.0 -0.672 14.7 158.8 -83.1 118.3 -16.9 -7.7 -10.0 594 594 A E 0 0 172 -2,-0.6 -1,-0.1 0, 0.0 -2,-0.0 0.020 360.0 360.0-127.8 28.0 -19.2 -10.7 -9.5 595 595 A N 0 0 184 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.398 360.0 360.0-150.5 360.0 -21.9 -10.0 -12.2