==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 18-APR-11 3RKE . COMPND 2 MOLECULE: LACTOPEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CAPRA HIRCUS; . AUTHOR D.DUBE,R.P.SINGH,M.SINHA,A.K.SINGH,P.KAUR,S.SHARMA,T.P.SINGH . 595 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25054.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 345 58.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 28 4.7 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 . 159 26.7 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 1 3 2 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 . 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 0 PARALLEL BRIDGES PER LADDER . 10 4 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 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 0 164 0, 0.0 2,-0.4 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -15.8 4.0 -30.5 35.0 2 2 A W - 0 0 193 1,-0.2 4,-0.1 2,-0.1 0, 0.0 -0.813 360.0 -2.6-101.7 137.7 1.7 -28.4 37.3 3 3 A E > - 0 0 112 -2,-0.4 3,-0.9 2,-0.1 -1,-0.2 0.964 65.5-177.8 43.7 74.2 -1.4 -26.7 36.0 4 4 A V T 3 S+ 0 0 138 -3,-0.3 2,-0.1 1,-0.3 -1,-0.1 0.773 84.5 31.0 -67.5 -29.5 -1.1 -27.6 32.3 5 5 A G T 3 S+ 0 0 70 2,-0.0 -1,-0.3 0, 0.0 2,-0.3 -0.537 88.2 152.3-127.6 66.5 -4.2 -25.5 31.6 6 6 A a < + 0 0 51 -3,-0.9 2,-0.2 -4,-0.1 161,-0.1 -0.673 16.6 96.5 -94.3 152.4 -4.1 -22.7 34.2 7 7 A G - 0 0 38 -2,-0.3 34,-0.1 159,-0.1 159,-0.0 -0.507 61.3-125.3 147.9 149.6 -5.7 -19.3 33.9 8 8 A A + 0 0 72 -2,-0.2 -2,-0.0 159,-0.1 -1,-0.0 -0.806 62.9 164.6-109.3 83.0 -8.5 -16.8 34.5 9 9 A P - 0 0 56 0, 0.0 3,-0.1 0, 0.0 32,-0.1 0.082 56.0 -72.9 -93.4-170.8 -8.7 -15.9 30.8 10 10 A V - 0 0 42 29,-0.2 3,-0.3 1,-0.2 15,-0.0 -0.814 68.1-169.5 -83.1 94.6 -11.0 -14.3 28.2 11 11 A P + 0 0 100 0, 0.0 2,-2.8 0, 0.0 -1,-0.2 0.933 57.0 54.7 -70.1 -70.1 -13.2 -17.3 28.5 12 12 A L + 0 0 170 -3,-0.1 2,-0.7 1,-0.0 -2,-0.0 -0.281 69.7 140.1 -72.9 61.0 -16.1 -17.8 26.0 13 13 A V + 0 0 52 -2,-2.8 2,-0.2 -3,-0.3 15,-0.1 -0.902 20.2 167.9-110.2 107.3 -14.0 -17.5 22.8 14 14 A T - 0 0 122 -2,-0.7 2,-0.3 13,-0.1 13,-0.0 -0.582 26.2-115.6-108.0 178.4 -14.9 -19.9 20.0 15 15 A b - 0 0 55 -2,-0.2 2,-0.5 16,-0.0 13,-0.1 -0.881 2.7-136.6-128.4 143.3 -13.8 -19.8 16.4 16 16 A D > - 0 0 122 -2,-0.3 3,-0.6 1,-0.1 0, 0.0 -0.869 23.1-148.2 -90.5 129.9 -15.0 -19.3 12.8 17 17 A E T 3 S+ 0 0 155 -2,-0.5 -1,-0.1 1,-0.2 14,-0.0 0.882 90.5 23.0 -73.0 -40.9 -13.3 -21.9 10.7 18 18 A Q T 3 S+ 0 0 160 2,-0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.049 81.6 146.4-119.3 29.9 -13.1 -19.9 7.4 19 19 A S < - 0 0 43 -3,-0.6 -3,-0.0 1,-0.1 0, 0.0 -0.554 41.2-149.2 -68.2 127.9 -13.2 -16.3 8.7 20 20 A P S S+ 0 0 70 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.333 73.1 67.4 -83.8 6.7 -11.0 -14.1 6.4 21 21 A Y S S- 0 0 34 276,-0.0 2,-0.1 277,-0.0 -2,-0.1 -0.920 82.2-113.6-128.8 152.2 -10.1 -11.7 9.3 22 22 A R - 0 0 32 -2,-0.3 2,-0.2 272,-0.1 6,-0.1 -0.393 37.6-110.3 -70.6 156.4 -8.1 -11.9 12.5 23 23 A T - 0 0 45 4,-0.7 3,-0.4 1,-0.1 -1,-0.1 -0.511 22.6-120.1 -75.7 160.9 -9.9 -11.6 15.8 24 24 A I S S+ 0 0 24 1,-0.2 160,-0.2 -2,-0.2 -1,-0.1 0.914 116.4 50.0 -61.4 -43.7 -9.3 -8.5 17.8 25 25 A T S S- 0 0 13 1,-0.1 14,-2.3 13,-0.1 -1,-0.2 0.523 114.2-117.6 -79.4 -3.8 -8.0 -10.6 20.6 26 26 A G > + 0 0 3 -3,-0.4 3,-0.7 1,-0.3 -1,-0.1 0.385 67.8 144.3 80.6 -3.3 -5.7 -12.5 18.3 27 27 A D T 3 + 0 0 9 1,-0.2 -4,-0.7 2,-0.1 -1,-0.3 -0.138 52.1 30.6 -58.3 157.6 -7.6 -15.7 19.2 28 28 A b T 3 S+ 0 0 11 6,-2.0 -1,-0.2 2,-0.2 7,-0.1 0.691 80.4 117.4 65.8 20.8 -8.2 -18.5 16.6 29 29 A N S < S+ 0 0 3 -3,-0.7 2,-0.3 5,-0.5 -2,-0.1 0.950 74.2 46.5 -77.9 -60.0 -5.0 -17.8 14.7 30 30 A N S S- 0 0 5 6,-0.5 -2,-0.2 3,-0.3 6,-0.1 -0.676 75.6-158.8 -80.0 135.8 -3.5 -21.2 15.5 31 31 A R S S+ 0 0 144 -2,-0.3 -1,-0.1 2,-0.1 -3,-0.0 0.886 88.6 46.5 -86.4 -40.6 -6.1 -23.9 14.8 32 32 A R S S+ 0 0 212 1,-0.3 -1,-0.1 301,-0.1 -2,-0.0 0.805 134.2 18.4 -69.9 -28.8 -4.7 -26.8 17.0 33 33 A S S > S- 0 0 50 3,-0.1 3,-2.0 1,-0.1 -3,-0.3 -0.609 73.2-178.7-142.5 80.4 -4.2 -24.3 19.9 34 34 A P T 3 S+ 0 0 53 0, 0.0 -6,-2.0 0, 0.0 -5,-0.5 0.478 75.9 62.9 -69.9 -5.8 -6.3 -21.2 19.3 35 35 A A T > S+ 0 0 31 -8,-0.2 3,-1.3 -7,-0.1 2,-0.5 0.451 75.5 114.5 -92.0 -2.8 -5.2 -19.3 22.5 36 36 A L T < S+ 0 0 37 -3,-2.0 -6,-0.5 1,-0.3 -7,-0.3 -0.582 87.0 8.4 -77.4 118.3 -1.6 -19.1 21.2 37 37 A G T 3 S+ 0 0 0 -2,-0.5 148,-2.6 1,-0.3 149,-0.5 0.248 98.5 138.2 96.9 -8.1 -0.6 -15.5 20.5 38 38 A A X - 0 0 6 -3,-1.3 3,-0.6 146,-0.2 -1,-0.3 -0.384 57.6-104.4 -76.5 144.2 -3.8 -14.1 22.1 39 39 A A T 3 S+ 0 0 2 -14,-2.3 143,-0.2 1,-0.2 -29,-0.2 -0.197 98.4 33.3 -61.0 155.1 -3.9 -11.1 24.3 40 40 A N T 3 S+ 0 0 50 141,-2.5 -1,-0.2 1,-0.3 2,-0.2 0.714 91.5 108.9 63.9 30.4 -4.3 -11.5 28.1 41 41 A R E < S-A 181 0A 66 140,-0.8 140,-2.8 -3,-0.6 -1,-0.3 -0.648 78.4 -71.1-113.6 178.9 -2.4 -14.8 28.5 42 42 A A E -A 180 0A 28 138,-0.2 138,-0.2 -2,-0.2 2,-0.1 -0.372 50.5-106.9 -67.9 147.2 1.0 -15.5 30.1 43 43 A L - 0 0 6 136,-2.9 297,-0.2 1,-0.1 2,-0.2 -0.494 46.1-100.3 -65.7 143.4 4.1 -14.3 28.4 44 44 A A B -b 340 0B 1 295,-2.0 297,-2.5 -2,-0.1 2,-0.8 -0.481 29.1-139.4 -67.4 137.7 6.0 -17.3 26.9 45 45 A R + 0 0 59 295,-0.2 -1,-0.1 1,-0.2 295,-0.1 -0.879 21.6 178.8-102.1 104.2 8.9 -18.6 29.0 46 46 A W S S+ 0 0 44 -2,-0.8 -1,-0.2 1,-0.1 -2,-0.0 0.774 81.4 21.0 -65.9 -30.0 11.9 -19.5 26.7 47 47 A L S S- 0 0 44 -3,-0.1 -1,-0.1 400,-0.0 3,-0.1 -0.973 102.2 -84.7-135.4 152.7 13.7 -20.3 30.0 48 48 A P - 0 0 107 0, 0.0 -2,-0.0 0, 0.0 397,-0.0 -0.349 53.2-109.0 -58.0 130.2 12.5 -21.2 33.5 49 49 A A - 0 0 16 1,-0.1 2,-0.5 128,-0.1 397,-0.2 -0.169 25.9-143.8 -52.6 147.6 11.9 -18.1 35.6 50 50 A E + 0 0 69 395,-2.4 9,-0.3 394,-0.1 2,-0.3 -0.939 26.1 168.5-122.1 108.4 14.3 -17.4 38.4 51 51 A Y > - 0 0 7 -2,-0.5 3,-2.1 7,-0.1 6,-0.1 -0.794 49.0-108.7-112.4 159.4 12.9 -15.9 41.5 52 52 A E T 3 S+ 0 0 22 5,-2.7 -1,-0.1 -2,-0.3 7,-0.1 0.887 125.3 29.1 -49.2 -45.0 14.5 -15.4 44.9 53 53 A D T 3 S- 0 0 79 4,-0.5 -1,-0.3 -3,-0.0 -3,-0.0 0.001 114.7-111.4-106.0 22.9 12.2 -18.2 46.2 54 54 A G S < S+ 0 0 44 -3,-2.1 122,-0.1 3,-0.2 -2,-0.1 0.314 105.6 59.0 63.9 -7.5 12.0 -20.1 42.9 55 55 A L S S- 0 0 72 121,-0.1 122,-3.9 2,-0.1 -1,-0.2 0.814 122.8 -37.0-117.5 -62.8 8.2 -19.1 42.7 56 56 A A S S+ 0 0 10 120,-0.2 389,-0.1 117,-0.1 -4,-0.1 0.532 91.2 109.7-146.2 -23.0 7.4 -15.3 42.7 57 57 A V - 0 0 32 1,-0.1 -5,-2.7 -6,-0.1 -4,-0.5 -0.479 65.3-124.5 -73.9 129.6 9.6 -13.2 45.0 58 58 A P > - 0 0 0 0, 0.0 3,-2.1 0, 0.0 4,-0.3 -0.388 25.9 -99.5 -77.5 152.3 12.0 -11.0 43.0 59 59 A F T 3 S+ 0 0 24 383,-0.4 7,-0.1 -9,-0.3 383,-0.1 -0.541 116.3 33.4 -67.4 130.1 15.8 -11.1 43.4 60 60 A G T 3 S+ 0 0 37 5,-0.3 -1,-0.3 2,-0.3 3,-0.1 0.278 88.1 106.8 99.5 -7.5 16.6 -8.1 45.6 61 61 A W S < S+ 0 0 50 -3,-2.1 2,-0.5 1,-0.2 -2,-0.1 0.924 78.9 45.3 -66.0 -43.1 13.4 -8.6 47.5 62 62 A T S > S- 0 0 32 -4,-0.3 3,-1.3 1,-0.1 -2,-0.3 -0.914 73.6-146.5-111.2 119.6 15.2 -10.0 50.6 63 63 A Q T 3 S+ 0 0 159 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.908 98.5 42.8 -39.1 -67.4 18.4 -8.4 52.0 64 64 A R T 3 S+ 0 0 179 7,-0.1 2,-0.6 2,-0.1 -1,-0.2 0.551 94.0 97.9 -64.4 -13.0 20.1 -11.6 53.3 65 65 A K < - 0 0 100 -3,-1.3 -5,-0.3 4,-0.0 2,-0.2 -0.720 59.2-162.9 -91.2 117.7 19.2 -13.5 50.1 66 66 A T - 0 0 67 -2,-0.6 2,-0.6 5,-0.1 5,-0.3 -0.590 19.8-132.1 -98.1 157.2 22.0 -13.7 47.5 67 67 A R B > S-C 70 0C 8 3,-3.6 3,-0.6 -2,-0.2 422,-0.1 -0.948 94.8 -19.2-106.1 114.1 22.0 -14.5 43.8 68 68 A N T 3 S- 0 0 106 -2,-0.6 -1,-0.2 1,-0.2 3,-0.1 0.835 134.2 -46.4 52.5 36.8 24.9 -17.0 43.3 69 69 A G T 3 S+ 0 0 50 1,-0.2 2,-0.3 -3,-0.0 -1,-0.2 0.691 122.1 93.1 86.6 18.6 26.5 -15.9 46.5 70 70 A F B < S-C 67 0C 80 -3,-0.6 -3,-3.6 416,-0.0 2,-0.2 -0.998 74.6-115.2-144.0 142.6 26.1 -12.1 46.1 71 71 A R - 0 0 178 -2,-0.3 -5,-0.1 -5,-0.3 -8,-0.1 -0.539 38.5-121.6 -63.5 133.7 23.7 -9.3 46.9 72 72 A V - 0 0 23 -2,-0.2 412,-0.1 1,-0.1 3,-0.1 -0.659 32.3-112.6 -78.3 139.5 22.3 -7.9 43.7 73 73 A P - 0 0 15 0, 0.0 -1,-0.1 0, 0.0 410,-0.0 -0.349 37.7 -88.7 -71.9 155.2 23.0 -4.1 43.4 74 74 A L > - 0 0 72 1,-0.1 4,-2.1 2,-0.1 3,-0.4 -0.345 32.5-128.4 -59.7 139.7 20.2 -1.5 43.7 75 75 A A H > S+ 0 0 2 1,-0.2 4,-2.9 2,-0.2 -1,-0.1 0.921 108.7 51.9 -56.5 -48.2 18.7 -0.7 40.3 76 76 A R H > S+ 0 0 3 67,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.758 108.2 54.0 -63.0 -24.0 19.1 3.1 40.7 77 77 A E H > S+ 0 0 51 -3,-0.4 4,-2.9 2,-0.2 5,-0.3 0.929 107.9 46.8 -76.7 -45.9 22.8 2.5 41.5 78 78 A V H X>S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 5,-1.1 0.957 113.6 53.3 -53.0 -46.3 23.3 0.5 38.3 79 79 A S H X>S+ 0 0 0 -4,-2.9 5,-1.4 3,-0.2 4,-1.2 0.941 114.5 38.5 -50.4 -55.9 21.5 3.4 36.7 80 80 A N H <5S+ 0 0 45 -4,-2.6 -1,-0.2 1,-0.2 4,-0.2 0.875 120.4 42.2 -66.6 -45.5 23.8 6.1 38.2 81 81 A K H <5S+ 0 0 118 -4,-2.9 -1,-0.2 -5,-0.1 -2,-0.2 0.742 134.3 11.2 -77.8 -24.1 27.1 4.4 37.9 82 82 A I H <5S+ 0 0 9 -4,-2.1 330,-0.4 -5,-0.3 -3,-0.2 0.761 122.7 47.3-120.3 -48.0 26.6 2.9 34.5 83 83 A V T < + 0 0 53 -2,-0.7 3,-0.6 2,-0.1 2,-0.3 0.283 54.7 104.2 -93.0 6.4 24.5 15.4 24.8 89 89 A E T 3 S+ 0 0 149 1,-0.2 -2,-0.1 2,-0.1 0, 0.0 -0.717 86.4 17.4 -83.3 140.7 27.0 16.6 22.2 90 90 A G T 3 S+ 0 0 57 -2,-0.3 -1,-0.2 1,-0.1 -2,-0.1 0.424 95.6 105.0 81.9 0.6 28.3 13.8 20.0 91 91 A V < + 0 0 3 -3,-0.6 315,-3.6 2,-0.1 2,-0.1 0.499 47.7 111.2 -92.3 -7.3 25.5 11.4 20.9 92 92 A L E S-D 405 0D 68 313,-0.2 2,-0.9 -4,-0.2 313,-0.2 -0.416 72.2-117.5 -79.5 145.7 23.5 11.6 17.7 93 93 A D E > - 0 0 4 311,-3.1 3,-1.5 3,-0.2 311,-0.3 -0.710 19.1-155.8 -87.8 113.0 23.2 8.7 15.3 94 94 A Q E 3 S+ 0 0 144 -2,-0.9 -1,-0.2 1,-0.3 -2,-0.0 0.607 90.5 31.5 -65.1 -17.5 24.8 9.8 12.0 95 95 A N E 3 S+ 0 0 79 473,-0.1 2,-0.3 1,-0.1 -1,-0.3 0.006 104.9 76.8-135.7 31.1 22.9 7.3 9.9 96 96 A R E < - 0 0 10 -3,-1.5 308,-1.7 472,-0.3 472,-0.3 -0.959 66.5-138.6-136.7 125.3 19.5 6.8 11.8 97 97 A S E >> -D 403 0D 0 470,-2.4 3,-0.9 -2,-0.3 4,-0.8 -0.277 29.2-111.2 -69.7 162.6 16.5 9.2 11.7 98 98 A L H 3> S+ 0 0 7 304,-1.7 4,-2.0 301,-0.5 302,-0.1 0.740 119.7 68.0 -62.7 -24.6 14.5 9.9 14.9 99 99 A L H 3> S+ 0 0 0 300,-1.5 4,-2.6 303,-0.3 5,-0.3 0.850 88.4 65.0 -63.5 -33.3 11.8 8.0 13.1 100 100 A F H <> S+ 0 0 0 -3,-0.9 4,-1.5 467,-0.3 -1,-0.2 0.922 104.8 44.6 -51.5 -50.5 14.0 4.9 13.6 101 101 A M H X S+ 0 0 14 -4,-0.8 4,-1.4 1,-0.2 -1,-0.2 0.956 112.6 53.5 -55.2 -49.4 13.5 5.3 17.3 102 102 A Q H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.818 104.4 50.8 -65.0 -36.2 9.8 5.9 16.8 103 103 A W H X S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.2 5,-0.4 0.931 105.0 59.6 -67.1 -43.3 9.0 2.8 14.7 104 104 A G H X S+ 0 0 7 -4,-1.5 4,-2.7 -5,-0.3 -1,-0.2 0.903 107.2 45.4 -43.4 -51.9 10.7 0.7 17.3 105 105 A Q H X S+ 0 0 38 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.865 114.2 49.0 -65.8 -41.9 8.3 1.9 20.0 106 106 A I H X S+ 0 0 1 -4,-1.9 4,-2.2 2,-0.2 5,-0.2 0.978 113.0 45.3 -57.3 -60.3 5.3 1.4 17.7 107 107 A V H X S+ 0 0 0 -4,-3.3 4,-1.3 1,-0.3 3,-0.3 0.935 114.2 51.0 -50.1 -50.1 6.2 -2.1 16.7 108 108 A D H >X S+ 0 0 20 -4,-2.7 4,-2.5 -5,-0.4 3,-0.9 0.915 107.9 51.2 -56.3 -45.9 7.0 -2.9 20.4 109 109 A H H 3< S+ 0 0 19 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.818 107.0 53.8 -68.6 -28.5 3.6 -1.5 21.5 110 110 A D H 3< S+ 0 0 0 -4,-2.2 -1,-0.3 -3,-0.3 78,-0.2 0.757 115.8 41.8 -68.0 -25.7 1.8 -3.7 18.9 111 111 A L H << S+ 0 0 0 -4,-1.3 2,-0.3 -3,-0.9 228,-0.2 0.891 117.5 11.0 -93.6 -43.7 3.6 -6.8 20.3 112 112 A D < + 0 0 8 -4,-2.5 2,-0.2 -5,-0.1 -1,-0.2 -0.962 40.4 165.5-146.5 152.2 3.6 -6.5 24.1 113 113 A F - 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0 0 0 -60,-0.5 4,-3.2 -2,-0.5 3,-1.3 -0.233 20.7-118.3 -69.4 154.9 19.6 10.3 28.5 415 415 A S H 3>>S+ 0 0 24 -330,-0.4 4,-2.0 1,-0.3 5,-2.0 0.698 108.3 73.3 -65.5 -20.2 18.6 12.2 31.6 416 416 A E H 345S+ 0 0 18 1,-0.2 -1,-0.3 3,-0.2 -60,-0.0 0.902 118.8 20.4 -62.2 -33.9 15.3 13.2 30.2 417 417 A L H <45S+ 0 0 5 -3,-1.3 16,-2.5 -63,-0.1 4,-0.4 0.764 124.3 55.6 -96.3 -36.6 14.4 9.6 30.8 418 418 A R H <5S+ 0 0 22 -4,-3.2 -3,-0.2 14,-0.3 17,-0.2 0.681 134.0 2.0 -76.8 -15.8 17.0 8.6 33.3 419 419 A N T <5S+ 0 0 32 -4,-2.0 -3,-0.2 -5,-0.2 -1,-0.1 0.544 130.8 50.2-136.0 -30.1 16.0 11.4 35.7 420 420 A K < + 0 0 80 -5,-2.0 2,-0.3 10,-0.2 10,-0.2 -0.057 67.6 140.5-116.7 30.0 13.1 13.3 34.4 421 421 A L B -O 431 0N 9 10,-1.8 10,-2.2 -4,-0.4 9,-1.1 -0.570 41.2-144.3 -75.7 131.0 10.5 10.7 33.4 422 422 A F - 0 0 2 -2,-0.3 7,-0.1 7,-0.2 -41,-0.1 -0.850 13.7-166.6 -91.7 131.3 6.9 11.5 34.1 423 423 A Q > - 0 0 53 -2,-0.5 3,-0.7 5,-0.5 7,-0.1 -0.975 26.8-116.6-114.9 143.5 4.6 8.7 35.2 424 424 A P T 3 S+ 0 0 64 0, 0.0 -1,-0.1 0, 0.0 -185,-0.1 0.653 105.5 35.8 -46.4 -47.3 0.7 9.0 35.3 425 425 A T T 3 S+ 0 0 67 -189,-0.0 0, 0.0 2,-0.0 0, 0.0 0.783 110.9 70.1 -83.5 -25.6 -0.2 8.6 39.1 426 426 A H S < S- 0 0 6 -3,-0.7 3,-0.0 1,-0.1 -4,-0.0 0.073 72.8-140.6 -87.4-171.6 2.8 10.4 40.4 427 427 A K + 0 0 118 1,-0.1 2,-0.2 -5,-0.0 -1,-0.1 0.742 62.0 77.0-126.7 -36.5 3.6 14.0 40.2 428 428 A V S S- 0 0 78 1,-0.1 2,-2.2 -274,-0.0 -5,-0.5 -0.535 71.5-126.0 -88.3 144.2 7.2 14.9 39.5 429 429 A H S S+ 0 0 67 -2,-0.2 -7,-0.2 1,-0.2 -8,-0.1 -0.641 86.0 109.2 -75.5 77.2 9.1 14.9 36.2 430 430 A G + 0 0 1 -2,-2.2 -10,-0.2 -9,-1.1 -1,-0.2 0.316 37.1 110.2-148.0 10.8 11.4 12.8 38.4 431 431 A F B -O 421 0N 6 -10,-2.2 -10,-1.8 -3,-0.3 2,-0.5 -0.354 55.3-127.7 -96.0 176.2 11.6 9.1 37.6 432 432 A D > - 0 0 0 -12,-0.2 4,-2.2 1,-0.1 -14,-0.3 -0.901 9.8-167.8-130.8 99.8 14.3 6.9 36.1 433 433 A L H > S+ 0 0 25 -16,-2.5 4,-2.2 -2,-0.5 -15,-0.2 0.790 91.7 53.9 -56.8 -29.4 13.3 4.7 33.1 434 434 A A H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.941 107.7 48.1 -72.8 -48.0 16.6 2.7 33.5 435 435 A A H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.895 112.9 50.8 -53.7 -44.0 16.1 1.9 37.2 436 436 A I H X S+ 0 0 10 -4,-2.2 4,-3.2 1,-0.2 -2,-0.2 0.930 105.9 53.7 -62.4 -50.6 12.6 0.8 36.2 437 437 A N H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.837 113.0 44.6 -49.7 -40.4 13.8 -1.5 33.4 438 438 A L H X S+ 0 0 0 -4,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.851 111.9 50.3 -78.8 -35.4 16.1 -3.2 35.9 439 439 A Q H X S+ 0 0 13 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.905 110.9 52.5 -68.1 -38.1 13.5 -3.5 38.7 440 440 A R H X S+ 0 0 24 -4,-3.2 4,-2.6 2,-0.2 -2,-0.2 0.882 101.7 57.8 -63.3 -41.3 11.2 -5.0 36.1 441 441 A C H <>S+ 0 0 1 -4,-1.7 5,-2.4 2,-0.2 -1,-0.2 0.916 113.7 40.9 -51.1 -45.7 13.8 -7.6 35.0 442 442 A R H ><5S+ 0 0 7 -4,-1.4 3,-1.9 1,-0.2 -383,-0.4 0.927 111.6 53.7 -74.2 -46.6 13.8 -8.8 38.5 443 443 A D H 3<5S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.846 109.8 51.3 -48.2 -41.8 10.0 -8.5 39.0 444 444 A H T 3<5S- 0 0 0 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.384 115.4-116.2 -82.5 3.6 9.6 -10.7 35.9 445 445 A G T < 5 - 0 0 0 -3,-1.9 -395,-2.4 1,-0.2 -3,-0.2 0.893 46.8-173.8 62.3 42.0 12.0 -13.4 37.2 446 446 A M < - 0 0 7 -5,-2.4 -1,-0.2 -397,-0.2 2,-0.1 -0.399 24.1-121.2 -70.8 136.1 14.6 -12.9 34.4 447 447 A P - 0 0 1 0, 0.0 45,-0.4 0, 0.0 -1,-0.1 -0.470 39.9-102.0 -63.2 153.0 17.5 -15.2 34.1 448 448 A G > - 0 0 1 40,-0.2 4,-1.4 43,-0.1 3,-0.5 -0.145 39.2 -86.3 -74.2 173.7 20.8 -13.3 34.3 449 449 A Y H > S+ 0 0 1 41,-2.7 4,-2.1 38,-0.5 39,-0.2 0.786 122.9 50.8 -53.6 -40.4 23.1 -12.4 31.4 450 450 A N H > S+ 0 0 2 37,-0.4 4,-3.6 2,-0.2 -1,-0.2 0.878 103.0 58.0 -75.8 -32.8 25.1 -15.6 31.2 451 451 A S H > S+ 0 0 47 -3,-0.5 4,-3.2 37,-0.3 -1,-0.2 0.931 111.8 44.7 -50.9 -47.2 22.0 -17.8 31.0 452 452 A W H X S+ 0 0 5 -4,-1.4 4,-1.2 2,-0.2 -2,-0.2 0.843 110.9 50.8 -74.7 -34.2 21.0 -15.8 28.0 453 453 A R H ><>S+ 0 0 13 -4,-2.1 5,-2.3 2,-0.2 3,-0.7 0.951 112.6 49.3 -61.6 -48.1 24.5 -15.9 26.5 454 454 A G H ><5S+ 0 0 31 -4,-3.6 3,-2.1 1,-0.2 -2,-0.2 0.957 108.6 52.6 -46.9 -59.5 24.2 -19.7 27.1 455 455 A F H 3<5S+ 0 0 54 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.736 110.5 48.7 -48.6 -30.5 20.8 -19.7 25.4 456 456 A f T <<5S- 0 0 10 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.259 115.5-108.2-105.3 8.3 22.2 -18.0 22.3 457 457 A G T < 5S+ 0 0 72 -3,-2.1 2,-0.3 -4,-0.3 -3,-0.2 0.884 76.2 131.2 69.1 37.3 25.3 -20.1 21.7 458 458 A L < - 0 0 46 -5,-2.3 -1,-0.3 -8,-0.1 -2,-0.1 -0.898 64.9 -85.5-121.1 154.5 27.7 -17.5 22.9 459 459 A S - 0 0 73 -2,-0.3 -1,-0.1 -3,-0.1 -3,-0.1 -0.116 35.0-137.6 -54.9 149.7 30.6 -17.5 25.3 460 460 A Q - 0 0 92 -7,-0.1 -1,-0.1 -6,-0.0 -10,-0.1 -0.877 16.1-144.9-117.7 96.6 29.8 -17.0 29.0 461 461 A P + 0 0 11 0, 0.0 27,-0.2 0, 0.0 -8,-0.1 -0.293 23.0 173.5 -60.2 140.3 32.3 -14.7 30.8 462 462 A K + 0 0 105 25,-0.1 2,-0.2 24,-0.1 26,-0.1 0.516 60.3 49.9-122.0 -16.0 33.2 -15.5 34.4 463 463 A T S > S- 0 0 87 23,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.698 87.0-105.5-121.9 169.7 36.0 -13.0 35.1 464 464 A L H > S+ 0 0 62 -2,-0.2 4,-3.1 1,-0.2 5,-0.1 0.954 121.5 47.4 -56.9 -50.2 36.6 -9.3 34.7 465 465 A K H > S+ 0 0 145 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.866 108.9 55.0 -66.4 -36.3 39.0 -9.9 31.8 466 466 A G H > S+ 0 0 24 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.964 111.4 43.9 -57.7 -54.0 36.5 -12.2 30.2 467 467 A L H X S+ 0 0 1 -4,-2.2 4,-3.2 1,-0.2 5,-0.3 0.899 110.2 56.6 -56.5 -44.5 33.8 -9.5 30.4 468 468 A Q H X>S+ 0 0 28 -4,-3.1 5,-1.2 1,-0.2 4,-1.1 0.922 109.0 46.6 -50.1 -49.2 36.4 -7.0 29.2 469 469 A A H <5S+ 0 0 63 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.881 115.7 44.9 -66.9 -38.1 37.0 -9.1 26.0 470 470 A V H <5S+ 0 0 31 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.928 120.8 37.4 -70.9 -44.9 33.3 -9.6 25.3 471 471 A L H <5S- 0 0 2 -4,-3.2 -1,-0.2 -5,-0.2 -2,-0.2 0.597 98.9-136.2 -78.2 -11.7 32.2 -5.9 25.9 472 472 A K T <5S+ 0 0 166 -4,-1.1 2,-0.2 -5,-0.3 -3,-0.2 0.908 73.9 101.6 47.1 47.9 35.4 -4.7 24.3 473 473 A N >< - 0 0 26 -5,-1.2 4,-1.9 -6,-0.2 5,-0.2 -0.780 53.2-167.9-161.8 110.1 35.6 -2.2 27.2 474 474 A K H > S+ 0 0 139 -2,-0.2 4,-2.4 2,-0.2 5,-0.1 0.943 91.5 45.5 -61.4 -51.3 37.7 -2.3 30.3 475 475 A V H > S+ 0 0 80 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.962 114.6 45.6 -66.9 -50.8 36.0 0.4 32.3 476 476 A L H > S+ 0 0 7 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.955 114.8 49.4 -50.3 -53.5 32.4 -0.6 31.6 477 477 A A H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.879 111.3 50.8 -55.6 -39.2 33.4 -4.3 32.4 478 478 A K H X S+ 0 0 95 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.917 108.7 48.9 -66.2 -46.4 35.0 -3.1 35.6 479 479 A K H X S+ 0 0 93 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.876 113.3 49.2 -64.1 -37.9 32.1 -1.0 36.8 480 480 A L H X>S+ 0 0 1 -4,-2.3 4,-3.5 -5,-0.2 5,-0.5 0.924 110.7 46.9 -66.9 -46.9 29.8 -4.0 36.2 481 481 A L H X5S+ 0 0 28 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.889 111.2 54.6 -66.7 -30.1 31.9 -6.5 38.0 482 482 A D H <5S+ 0 0 88 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.839 118.2 34.7 -64.7 -36.4 32.2 -4.0 40.8 483 483 A L H <5S+ 0 0 12 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.906 133.2 25.5 -81.9 -49.0 28.4 -3.8 41.0 484 484 A Y H <5S- 0 0 0 -4,-3.5 -3,-0.2 -5,-0.1 5,-0.2 0.577 82.0-150.9 -98.5 -20.4 27.4 -7.4 40.1 485 485 A K S < S- 0 0 16 -6,-0.3 3,-1.4 1,-0.1 4,-0.4 -0.777 78.5-129.8-173.5 136.2 29.9 -12.0 38.6 487 487 A P G > S+ 0 0 0 0, 0.0 3,-1.9 0, 0.0 -38,-0.5 0.868 104.3 73.7 -59.3 -34.5 28.5 -11.7 35.1 488 488 A D G 3 S+ 0 0 47 1,-0.3 -37,-0.3 -27,-0.2 -40,-0.2 0.804 100.0 46.5 -45.5 -32.6 26.0 -14.5 35.9 489 489 A N G < S+ 0 0 0 -3,-1.4 -1,-0.3 -5,-0.2 2,-0.1 0.600 82.0 118.1 -87.6 -15.7 24.2 -11.9 38.1 490 490 A I S < S- 0 0 2 -3,-1.9 -41,-2.7 -4,-0.4 -40,-0.1 -0.380 73.3-112.7 -60.8 126.5 24.1 -9.0 35.5 491 491 A D > - 0 0 5 -43,-0.2 4,-3.0 1,-0.1 5,-0.2 -0.301 21.1-126.5 -57.2 134.8 20.5 -8.1 34.6 492 492 A I H > S+ 0 0 2 -45,-0.4 4,-2.9 1,-0.2 5,-0.4 0.846 104.4 60.4 -58.6 -36.4 19.8 -8.9 31.0 493 493 A W H > S+ 0 0 3 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.963 116.2 31.7 -58.7 -53.3 18.5 -5.4 30.1 494 494 A I H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.957 119.5 55.4 -66.8 -45.7 21.9 -3.8 31.0 495 495 A G H < S+ 0 0 2 -4,-3.0 4,-0.4 1,-0.2 -2,-0.2 0.857 111.0 41.3 -55.4 -46.4 23.9 -6.9 29.9 496 496 A G H >< S+ 0 0 0 -4,-2.9 3,-0.8 1,-0.2 12,-0.4 0.862 116.2 50.4 -72.1 -34.2 22.5 -7.1 26.4 497 497 A N H 3< S+ 0 0 9 -4,-1.3 -2,-0.2 -5,-0.4 -1,-0.2 0.715 101.0 63.4 -78.8 -23.6 22.7 -3.4 25.9 498 498 A A T 3< S+ 0 0 0 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.590 82.1 99.1 -71.5 -16.1 26.3 -3.1 27.1 499 499 A E S < S- 0 0 6 -3,-0.8 9,-0.2 -4,-0.4 -28,-0.1 -0.540 84.8-104.1 -81.7 139.6 27.5 -5.3 24.2 500 500 A P - 0 0 39 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.223 45.5 -92.0 -62.0 153.2 29.0 -3.5 21.2 501 501 A M - 0 0 57 7,-0.2 7,-0.3 -94,-0.1 3,-0.1 -0.427 37.6-118.2 -68.1 134.0 26.9 -3.2 18.0 502 502 A V > - 0 0 16 5,-2.1 3,-2.1 -2,-0.2 5,-0.1 -0.296 49.8 -74.2 -62.1 150.5 27.1 -5.9 15.3 503 503 A E T 3 S+ 0 0 151 1,-0.3 -184,-2.2 -185,-0.1 -183,-0.2 -0.224 117.0 2.1 -50.5 132.3 28.3 -4.8 11.8 504 504 A R T 3 S+ 0 0 161 -186,-0.2 -186,-0.3 1,-0.2 -1,-0.3 0.397 120.2 78.6 71.4 4.1 25.5 -2.9 10.0 505 505 A G S < S- 0 0 1 -3,-2.1 -188,-0.2 -188,-0.2 -1,-0.2 -0.391 75.7-123.5-124.9-158.9 23.0 -3.0 12.9 506 506 A R S S+ 0 0 44 -190,-2.4 2,-0.3 -2,-0.1 -189,-0.1 0.219 82.1 64.0-143.6 8.3 22.2 -1.3 16.2 507 507 A V S S- 0 0 4 -191,-0.8 -5,-2.1 -5,-0.1 -2,-0.1 -0.921 78.6-110.5-129.7 161.5 22.2 -4.1 18.8 508 508 A G > - 0 0 2 -12,-0.4 4,-2.3 -2,-0.3 5,-0.2 -0.205 43.2 -87.8 -81.2 176.0 24.9 -6.5 20.0 509 509 A P H > S+ 0 0 37 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.861 122.8 49.8 -52.9 -45.1 25.1 -10.3 19.4 510 510 A L H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 3,-0.4 0.966 114.1 43.7 -66.5 -50.2 23.0 -11.4 22.3 511 511 A L H > S+ 0 0 3 -15,-0.3 4,-3.5 1,-0.3 5,-0.5 0.868 110.0 55.5 -63.5 -36.7 20.1 -9.1 21.6 512 512 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -1,-0.3 0.855 109.5 49.2 -67.3 -30.5 20.2 -9.8 17.9 513 513 A f H X S+ 0 0 1 -4,-1.8 4,-2.8 -3,-0.4 -2,-0.2 0.983 116.4 40.6 -65.9 -57.9 19.8 -13.4 18.9 514 514 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.960 122.2 40.3 -56.0 -57.6 16.8 -12.7 21.2 515 515 A L H X S+ 0 0 2 -4,-3.5 4,-2.4 1,-0.2 5,-0.3 0.944 114.6 55.7 -56.1 -49.1 15.2 -10.2 19.0 516 516 A G H X S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.5 -2,-0.2 0.910 109.0 43.8 -52.4 -55.2 16.0 -12.3 15.9 517 517 A R H X S+ 0 0 66 -4,-2.8 4,-3.3 1,-0.2 5,-0.2 0.952 113.2 52.5 -52.3 -56.4 14.3 -15.5 17.2 518 518 A Q H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.873 111.4 44.0 -51.0 -50.0 11.2 -13.6 18.4 519 519 A F H X S+ 0 0 1 -4,-2.4 4,-1.7 2,-0.2 5,-0.2 0.935 113.2 51.7 -66.3 -46.9 10.5 -11.8 15.2 520 520 A Q H X S+ 0 0 51 -4,-2.4 4,-2.9 -5,-0.3 3,-0.4 0.945 112.0 48.4 -44.7 -55.9 11.1 -15.0 13.1 521 521 A Q H X S+ 0 0 42 -4,-3.3 4,-1.6 1,-0.2 -2,-0.2 0.859 109.1 51.5 -58.6 -38.4 8.7 -16.8 15.4 522 522 A I H < S+ 0 0 2 -4,-2.2 -335,-0.2 -5,-0.2 -1,-0.2 0.806 116.7 40.2 -75.2 -24.6 5.9 -14.1 15.1 523 523 A R H >< S+ 0 0 17 -4,-1.7 3,-1.4 -3,-0.4 6,-0.2 0.925 118.4 44.6 -83.3 -49.4 6.1 -14.1 11.4 524 524 A D H 3< S+ 0 0 29 -4,-2.9 -192,-2.7 1,-0.3 -189,-0.2 0.757 114.5 52.1 -64.5 -24.9 6.4 -17.9 10.9 525 525 A G T 3< S+ 0 0 0 -4,-1.6 2,-0.7 -5,-0.3 -1,-0.3 0.254 86.0 99.8 -97.7 11.5 3.7 -18.5 13.4 526 526 A D X - 0 0 0 -3,-1.4 3,-2.2 1,-0.1 6,-0.1 -0.862 52.6-163.2-114.1 107.5 1.0 -16.2 12.0 527 527 A R T 3 S+ 0 0 32 -2,-0.7 -1,-0.1 1,-0.3 -196,-0.1 0.650 95.2 49.4 -57.8 -16.0 -1.8 -17.8 9.9 528 528 A F T 3 S+ 0 0 21 -5,-0.0 -1,-0.3 7,-0.0 -506,-0.1 0.139 73.0 144.7-114.3 17.6 -2.5 -14.3 8.6 529 529 A W X - 0 0 4 -3,-2.2 3,-1.5 -6,-0.2 6,-0.2 -0.330 59.4-119.5 -57.4 136.3 1.0 -13.1 7.6 530 530 A W T 3 S+ 0 0 16 1,-0.3 6,-0.4 -229,-0.1 -1,-0.1 0.788 111.5 44.2 -53.0 -34.1 0.6 -10.9 4.5 531 531 A E T 3 S+ 0 0 70 4,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.577 81.8 115.8 -89.7 -13.7 2.8 -13.1 2.3 532 532 A N S X> S- 0 0 27 -3,-1.5 3,-2.1 -6,-0.1 4,-0.5 -0.449 82.9-101.1 -56.1 120.7 1.2 -16.4 3.5 533 533 A P B 34 S+p 536 0O 88 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.146 105.3 21.4 -50.7 134.3 -0.4 -17.8 0.4 534 534 A G T 34 S+ 0 0 76 2,-0.8 3,-0.1 -3,-0.1 -2,-0.1 0.323 97.3 94.6 88.9 -9.1 -4.2 -17.2 0.2 535 535 A V T <4 S+ 0 0 18 -3,-2.1 2,-0.3 1,-0.2 -4,-0.1 0.937 101.4 10.8 -69.8 -54.6 -4.1 -14.3 2.7 536 536 A F B < S-p 533 0O 8 -4,-0.5 -2,-0.8 -6,-0.4 -1,-0.2 -0.854 88.2-105.5-116.4 158.9 -3.9 -11.9 -0.2 537 537 A T > - 0 0 65 -2,-0.3 4,-3.0 1,-0.1 5,-0.2 -0.509 35.0-115.5 -70.6 150.1 -4.4 -12.3 -4.0 538 538 A E H > S+ 0 0 142 1,-0.2 4,-0.6 2,-0.2 5,-0.1 0.897 122.3 53.1 -56.5 -39.0 -1.0 -12.3 -5.9 539 539 A K H >> S+ 0 0 153 2,-0.2 4,-1.1 1,-0.2 3,-0.9 0.912 109.9 46.7 -56.3 -47.7 -2.4 -9.1 -7.5 540 540 A Q H 3> S+ 0 0 24 1,-0.2 4,-1.5 49,-0.2 3,-0.3 0.874 108.9 56.9 -61.0 -39.8 -3.1 -7.7 -4.0 541 541 A R H 3X S+ 0 0 55 -4,-3.0 4,-0.8 1,-0.2 -1,-0.2 0.557 102.2 54.2 -72.7 -11.5 0.4 -8.7 -3.0 542 542 A D H << S+ 0 0 78 -3,-0.9 4,-0.2 -4,-0.6 -1,-0.2 0.737 108.5 47.8 -91.3 -28.6 2.1 -6.7 -5.8 543 543 A S H >< S+ 0 0 13 -4,-1.1 3,-0.7 -3,-0.3 43,-0.2 0.792 110.5 55.5 -73.2 -31.9 0.3 -3.5 -4.8 544 544 A L H >< S+ 0 0 1 -4,-1.5 3,-1.7 1,-0.2 -2,-0.2 0.881 94.4 65.1 -67.8 -40.4 1.4 -4.3 -1.2 545 545 A Q T 3< S+ 0 0 94 -4,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.654 96.4 60.8 -58.3 -14.8 5.1 -4.6 -2.0 546 546 A K T < S+ 0 0 112 -3,-0.7 -1,-0.3 -4,-0.2 -2,-0.1 0.365 73.5 118.6-102.4 3.3 5.2 -0.9 -2.9 547 547 A V < + 0 0 7 -3,-1.7 2,-0.3 -4,-0.1 37,-0.1 -0.300 37.7 179.5 -64.7 153.9 4.2 0.8 0.4 548 548 A S > - 0 0 20 35,-0.1 4,-2.0 1,-0.1 5,-0.1 -0.983 41.7-122.1-150.6 157.4 6.6 3.2 2.1 549 549 A F H > S+ 0 0 5 -2,-0.3 4,-2.3 2,-0.2 5,-0.1 0.854 116.6 57.7 -68.8 -30.7 6.7 5.3 5.2 550 550 A S H > S+ 0 0 3 14,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.969 106.9 46.6 -59.7 -51.0 7.3 8.2 2.9 551 551 A R H > S+ 0 0 25 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.852 108.4 56.0 -60.3 -38.2 4.1 7.4 1.1 552 552 A L H X S+ 0 0 2 -4,-2.0 4,-0.8 2,-0.2 -1,-0.2 0.922 110.3 46.5 -58.5 -44.3 2.3 7.1 4.4 553 553 A I H >X S+ 0 0 1 -4,-2.3 3,-0.9 2,-0.2 4,-0.5 0.953 113.6 47.4 -60.1 -51.2 3.5 10.6 5.2 554 554 A g H >< S+ 0 0 18 -4,-2.7 3,-0.6 1,-0.3 -2,-0.2 0.889 114.3 46.0 -60.4 -45.2 2.5 12.0 1.8 555 555 A D H 3< S+ 0 0 35 -4,-2.9 -1,-0.3 1,-0.2 -2,-0.2 0.627 122.2 37.1 -69.2 -15.7 -1.0 10.4 1.9 556 556 A N H << S+ 0 0 4 -3,-0.9 -1,-0.2 -4,-0.8 2,-0.2 0.138 117.8 30.2-132.1 16.1 -1.7 11.5 5.5 557 557 A T S << S- 0 0 7 -3,-0.6 -3,-0.0 -4,-0.5 -336,-0.0 -0.600 82.8-103.2-144.4-155.5 -0.2 15.0 6.0 558 558 A H S S+ 0 0 91 -2,-0.2 2,-0.4 0, 0.0 -4,-0.1 -0.240 74.9 126.1-133.3 42.1 0.5 18.0 3.9 559 559 A I + 0 0 5 -6,-0.4 -2,-0.2 1,-0.1 3,-0.1 -0.862 32.2 177.7-101.3 134.3 4.2 17.3 3.6 560 560 A T + 0 0 62 -2,-0.4 19,-1.5 1,-0.2 2,-0.4 0.375 62.1 64.9-125.4 -0.1 5.4 17.2 -0.0 561 561 A K E +Q 578 0P 61 17,-0.2 17,-0.2 18,-0.1 -1,-0.2 -0.960 63.0 155.6-128.5 116.5 9.1 16.6 0.4 562 562 A V E -Q 577 0P 0 15,-2.0 15,-2.1 -2,-0.4 2,-0.1 -0.874 42.1-101.8-133.7 158.5 10.2 13.2 1.9 563 563 A P - 0 0 0 0, 0.0 3,-0.2 0, 0.0 13,-0.2 -0.377 22.0-132.3 -73.6 166.2 13.2 10.9 1.9 564 564 A L S S+ 0 0 102 11,-0.4 2,-0.6 1,-0.3 -14,-0.3 0.847 105.0 35.9 -77.9 -38.9 13.1 7.8 -0.2 565 565 A H S S- 0 0 121 1,-0.1 3,-0.5 -16,-0.1 -1,-0.3 -0.930 74.7-170.4-120.4 104.0 14.4 5.8 2.8 566 566 A A S S+ 0 0 9 -2,-0.6 -467,-0.3 1,-0.2 -466,-0.2 0.657 76.7 54.9 -78.1 -18.9 12.9 7.2 6.0 567 567 A F S S+ 0 0 13 -468,-0.1 -470,-2.4 -471,-0.1 -467,-0.3 0.730 93.5 76.6 -89.8 -22.3 14.9 5.3 8.6 568 568 A Q S S- 0 0 70 -3,-0.5 2,-0.3 -472,-0.3 -472,-0.3 -0.425 102.9 -78.4 -81.5 163.3 18.4 6.3 7.5 569 569 A A - 0 0 13 -472,-0.1 2,-0.4 -2,-0.1 -1,-0.1 -0.490 55.0-171.9 -65.1 120.9 19.8 9.8 8.2 570 570 A N - 0 0 8 -170,-0.6 2,-0.4 -2,-0.3 6,-0.0 -0.959 9.2-157.7-123.7 133.8 18.3 12.3 5.7 571 571 A N > - 0 0 107 -2,-0.4 4,-2.5 2,-0.0 5,-0.2 -0.925 29.4 -89.7-119.2 133.7 19.3 15.9 5.2 572 572 A Y T 4 S- 0 0 61 -2,-0.4 -208,-0.0 1,-0.3 -2,-0.0 -0.671 96.2 -3.7 -97.0 140.5 17.2 18.7 3.6 573 573 A P T >4 S+ 0 0 93 0, 0.0 3,-1.0 0, 0.0 -1,-0.3 -0.969 125.8 64.0 -93.7 11.4 16.9 19.6 0.9 574 574 A H T 34 S+ 0 0 158 1,-0.2 -2,-0.2 3,-0.0 -4,-0.0 0.956 109.7 32.8 -53.5 -66.0 19.5 17.2 -0.5 575 575 A D T 3< S+ 0 0 54 -4,-2.5 -11,-0.4 2,-0.0 2,-0.3 0.074 101.5 102.7 -87.0 25.6 18.0 13.8 0.3 576 576 A F < - 0 0 19 -3,-1.0 2,-0.3 -5,-0.2 -15,-0.0 -0.863 45.1-177.4-117.3 145.1 14.4 14.9 -0.3 577 577 A V E -Q 562 0P 46 -15,-2.1 -15,-2.0 -2,-0.3 2,-0.2 -0.907 35.9 -91.4-136.5 157.8 12.1 14.4 -3.2 578 578 A D E > -Q 561 0P 85 -2,-0.3 3,-2.3 -17,-0.2 -17,-0.2 -0.505 40.8-114.6 -74.6 147.7 8.6 15.5 -4.2 579 579 A g G > S+ 0 0 11 -19,-1.5 3,-1.7 1,-0.3 -1,-0.1 0.730 110.4 66.4 -53.0 -30.3 5.9 13.1 -3.1 580 580 A S G 3 S+ 0 0 105 1,-0.3 -1,-0.3 -20,-0.2 4,-0.1 0.568 86.4 69.5 -77.6 -6.7 4.9 12.2 -6.7 581 581 A A G < S+ 0 0 75 -3,-2.3 2,-0.4 2,-0.1 -1,-0.3 0.497 90.7 92.1 -74.5 -3.4 8.3 10.6 -7.3 582 582 A V S < S- 0 0 17 -3,-1.7 -34,-0.1 -4,-0.1 -18,-0.0 -0.802 81.5-115.2-112.6 129.4 6.9 7.9 -4.9 583 583 A D - 0 0 87 -2,-0.4 2,-0.2 1,-0.1 -35,-0.1 -0.171 35.2-147.7 -49.9 143.2 5.1 4.6 -5.5 584 584 A K - 0 0 120 -37,-0.1 2,-1.3 -4,-0.1 -38,-0.1 -0.599 24.6 -96.7-107.7 173.8 1.5 4.5 -4.1 585 585 A L - 0 0 10 -2,-0.2 2,-0.2 -34,-0.1 -41,-0.1 -0.747 41.2-157.3 -89.3 87.4 -0.7 1.9 -2.7 586 586 A D - 0 0 85 -2,-1.3 -40,-0.1 -43,-0.2 -43,-0.0 -0.498 9.8-170.7 -62.0 130.7 -2.7 1.0 -5.7 587 587 A L >> + 0 0 14 -2,-0.2 3,-1.9 1,-0.1 4,-0.5 0.207 52.6 111.1-112.6 13.1 -6.0 -0.6 -4.5 588 588 A S G >4 S+ 0 0 73 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.901 71.9 61.1 -52.1 -45.7 -7.2 -1.8 -7.9 589 589 A P G 34 S+ 0 0 24 0, 0.0 -1,-0.3 0, 0.0 -49,-0.2 0.538 97.9 60.5 -61.8 -5.6 -6.7 -5.5 -6.9 590 590 A W G <4 S+ 0 0 4 -3,-1.9 2,-0.4 -51,-0.1 -2,-0.2 0.590 72.9 109.0-100.1 -16.6 -9.3 -5.0 -4.0 591 591 A A << - 0 0 41 -3,-1.6 2,-0.5 -4,-0.5 -307,-0.1 -0.511 46.9-175.1 -57.5 117.9 -12.2 -4.1 -6.2 592 592 A S - 0 0 64 -2,-0.4 -1,-0.1 -309,-0.1 -2,-0.0 -0.828 9.5-163.2-120.2 89.7 -14.5 -7.1 -6.0 593 593 A R - 0 0 203 -2,-0.5 -309,-0.0 1,-0.1 -310,-0.0 -0.281 33.7-100.3 -69.1 157.3 -17.4 -6.4 -8.4 594 594 A E 0 0 161 1,-0.2 -1,-0.1 -2,-0.0 -2,-0.0 0.811 360.0 360.0 -45.6 -45.4 -20.7 -8.4 -8.3 595 595 A N 0 0 191 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.426 360.0 360.0-116.6 360.0 -19.8 -10.8 -11.2