==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-DEC-07 2VJ8 . COMPND 2 MOLECULE: LTA4H PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.M.G.M.THUNNISSEN,B.ANDERSSON,C.-H.WONG,B.SAMUELSSON, . 610 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23971.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 436 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 93 15.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 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 . 37 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 190 31.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.5 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 0 1 0 1 0 2 5 2 2 0 1 1 0 0 0 1 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 3 1 2 2 0 2 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 2 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 P 0 0 184 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-124.1 -2.4 18.1 67.7 2 2 A E - 0 0 125 12,-0.0 2,-0.2 0, 0.0 12,-0.0 -0.901 360.0-130.1-105.9 120.5 -2.6 21.2 65.7 3 3 A I - 0 0 82 -2,-0.6 2,-0.4 1,-0.0 417,-0.0 -0.501 28.1-149.5 -66.0 129.9 -0.3 24.1 66.5 4 4 A V - 0 0 92 -2,-0.2 2,-1.2 8,-0.1 -1,-0.0 -0.877 12.7-136.8-107.5 135.8 -2.5 27.2 66.8 5 5 A D > - 0 0 21 -2,-0.4 3,-1.4 1,-0.2 305,-0.0 -0.789 21.5-172.8 -89.0 100.4 -1.3 30.7 66.0 6 6 A T T 3 S+ 0 0 30 -2,-1.2 365,-0.5 1,-0.2 -1,-0.2 0.408 77.2 62.7 -76.4 4.6 -2.8 32.4 69.0 7 7 A C T 3 S+ 0 0 1 363,-0.1 2,-0.3 364,-0.1 -1,-0.2 0.480 94.7 72.8-104.8 -1.7 -1.9 35.9 67.6 8 8 A S < - 0 0 19 -3,-1.4 141,-0.1 1,-0.1 75,-0.1 -0.874 51.1-168.9-117.9 147.1 -4.0 35.6 64.5 9 9 A L + 0 0 31 -2,-0.3 -1,-0.1 73,-0.2 138,-0.1 0.354 61.3 106.4-107.3 1.8 -7.8 35.7 63.9 10 10 A A S S- 0 0 13 1,-0.2 44,-0.2 75,-0.1 -2,-0.1 -0.262 88.0 -79.6 -79.0 164.1 -7.5 34.5 60.4 11 11 A S - 0 0 13 42,-2.7 -1,-0.2 1,-0.1 44,-0.1 -0.433 61.1-111.2 -58.6 137.5 -8.4 31.1 59.0 12 12 A P >> - 0 0 70 0, 0.0 3,-2.8 0, 0.0 4,-1.8 -0.306 21.3-105.2 -74.6 161.2 -5.5 28.8 59.9 13 13 A A T 34 S+ 0 0 17 1,-0.3 -2,-0.1 2,-0.2 134,-0.0 0.677 120.2 65.0 -55.1 -23.4 -3.0 27.3 57.4 14 14 A S T 34 S+ 0 0 51 1,-0.1 -1,-0.3 30,-0.0 3,-0.1 0.620 109.5 38.1 -78.7 -9.4 -4.9 24.0 57.8 15 15 A V T <4 S- 0 0 28 -3,-2.8 30,-2.7 1,-0.5 31,-0.5 0.806 132.5 -19.1-103.4 -50.2 -8.0 25.6 56.3 16 16 A C E < -A 44 0A 2 -4,-1.8 -1,-0.5 28,-0.3 2,-0.4 -0.975 56.8-148.0-156.6 160.5 -6.6 27.8 53.5 17 17 A R E -A 43 0A 96 26,-2.1 26,-3.4 -2,-0.3 2,-0.4 -0.996 16.9-128.7-141.7 133.2 -3.4 29.3 52.5 18 18 A T E +A 42 0A 5 -2,-0.4 24,-0.3 24,-0.2 135,-0.1 -0.630 25.9 177.2 -79.1 128.8 -2.5 32.5 50.8 19 19 A K E + 0 0 76 22,-3.4 136,-2.2 -2,-0.4 2,-0.3 0.700 61.4 12.1-105.1 -29.0 -0.1 31.8 47.9 20 20 A H E -Ab 41 155A 46 21,-1.3 21,-2.7 134,-0.3 2,-0.4 -0.996 54.5-155.8-150.8 152.9 0.3 35.2 46.3 21 21 A L E -Ab 40 156A 2 134,-1.4 136,-2.1 -2,-0.3 2,-0.6 -0.998 3.5-166.7-129.5 128.2 -0.5 38.9 46.9 22 22 A H E -Ab 39 157A 57 17,-2.6 17,-3.5 -2,-0.4 2,-0.5 -0.974 16.4-166.1-116.5 116.7 -0.8 41.5 44.2 23 23 A L E +Ab 38 158A 12 134,-2.6 136,-2.5 -2,-0.6 2,-0.4 -0.911 17.5 171.8-111.7 127.5 -0.7 44.9 45.7 24 24 A R E +Ab 37 159A 96 13,-2.1 13,-3.0 -2,-0.5 2,-0.3 -0.987 25.8 139.1-130.8 115.7 -1.7 48.1 43.9 25 25 A C E -Ab 36 160A 12 134,-2.0 136,-1.9 -2,-0.4 2,-0.4 -0.965 40.2-133.1-152.9 168.6 -1.9 51.2 46.2 26 26 A S E -Ab 35 161A 35 9,-3.2 9,-2.3 -2,-0.3 2,-0.6 -0.983 17.4-134.7-132.0 141.4 -1.1 54.8 46.4 27 27 A V E -A 34 0A 0 134,-2.2 2,-0.6 -2,-0.4 7,-0.2 -0.862 18.9-171.4 -98.3 118.2 0.7 56.7 49.2 28 28 A D E >> -A 33 0A 45 5,-3.2 5,-2.1 -2,-0.6 4,-1.0 -0.900 11.1-179.8-116.8 103.0 -1.0 59.9 50.2 29 29 A F T 45S+ 0 0 30 -2,-0.6 -1,-0.1 1,-0.2 101,-0.1 0.731 82.1 62.2 -68.9 -27.9 1.1 62.0 52.7 30 30 A T T 45S+ 0 0 120 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.895 120.2 23.8 -67.9 -37.7 -1.6 64.7 52.8 31 31 A R T 45S- 0 0 157 -3,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.442 103.4-125.9-106.0 1.0 -4.2 62.3 54.2 32 32 A R T <5 + 0 0 90 -4,-1.0 2,-0.3 1,-0.2 -3,-0.2 0.926 66.3 131.7 53.9 49.5 -1.6 59.8 55.8 33 33 A T E < -A 28 0A 10 -5,-2.1 -5,-3.2 77,-0.0 2,-0.5 -0.940 53.4-153.9-131.7 152.8 -3.2 56.9 53.9 34 34 A L E -A 27 0A 4 -2,-0.3 74,-2.2 -7,-0.2 2,-0.4 -0.993 29.2-177.5-118.4 126.4 -2.2 54.0 51.7 35 35 A T E +AC 26 107A 51 -9,-2.3 -9,-3.2 -2,-0.5 2,-0.3 -0.979 24.3 87.8-130.8 143.7 -5.1 53.2 49.5 36 36 A G E -AC 25 106A 16 70,-2.0 70,-2.3 -2,-0.4 2,-0.4 -0.981 66.2 -62.8 168.3-154.9 -5.4 50.4 46.9 37 37 A T E -AC 24 105A 10 -13,-3.0 -13,-2.1 -2,-0.3 2,-0.6 -0.977 25.7-150.5-129.9 144.8 -6.4 46.8 46.4 38 38 A A E -AC 23 104A 0 66,-2.7 66,-2.2 -2,-0.4 2,-0.8 -0.959 11.5-160.7-114.8 112.0 -4.9 43.6 47.8 39 39 A A E -AC 22 103A 20 -17,-3.5 -17,-2.6 -2,-0.6 2,-0.5 -0.857 12.6-170.0 -97.8 104.9 -5.3 40.7 45.3 40 40 A L E -AC 21 102A 2 62,-2.6 62,-2.7 -2,-0.8 2,-0.7 -0.858 15.6-153.5 -99.5 123.5 -4.9 37.5 47.4 41 41 A T E -AC 20 101A 32 -21,-2.7 -22,-3.4 -2,-0.5 -21,-1.3 -0.869 25.2-168.4 -95.7 115.8 -4.6 34.2 45.6 42 42 A V E -AC 18 100A 1 58,-3.1 58,-1.7 -2,-0.7 2,-0.5 -0.922 13.7-153.8-114.2 137.5 -5.9 31.7 48.2 43 43 A Q E -AC 17 99A 30 -26,-3.4 -26,-2.1 -2,-0.4 56,-0.2 -0.906 15.3-135.4-112.3 122.8 -5.7 27.9 48.2 44 44 A S E -A 16 0A 0 54,-2.7 53,-2.2 -2,-0.5 -28,-0.3 -0.406 12.5-168.5 -72.7 153.2 -8.2 25.8 50.1 45 45 A Q S S+ 0 0 36 -30,-2.7 2,-0.3 51,-0.2 51,-0.2 0.251 70.6 48.4-120.5 4.2 -6.9 22.9 52.1 46 46 A E S S- 0 0 69 -31,-0.5 3,-0.5 49,-0.1 2,-0.2 -0.903 88.5 -97.7-139.3 167.0 -10.3 21.3 52.7 47 47 A D S S+ 0 0 86 48,-0.3 48,-0.3 -2,-0.3 47,-0.1 -0.577 100.1 17.8 -85.9 152.4 -13.3 20.3 50.7 48 48 A N S S+ 0 0 88 1,-0.2 2,-0.7 -2,-0.2 47,-0.2 0.870 73.2 177.6 59.6 45.0 -16.3 22.6 50.5 49 49 A L E +H 94 0B 6 45,-3.8 45,-3.0 -3,-0.5 -1,-0.2 -0.719 7.6 167.7 -83.2 118.1 -14.6 25.8 51.7 50 50 A R E + 0 0 141 -2,-0.7 40,-3.1 1,-0.3 2,-0.3 0.583 59.3 7.9-107.0 -15.4 -17.3 28.4 51.5 51 51 A S E -H 89 0B 42 38,-0.2 2,-0.3 43,-0.1 -1,-0.3 -0.989 57.4-157.8-161.8 158.1 -15.8 31.3 53.5 52 52 A L E -H 88 0B 2 36,-1.8 36,-2.9 -2,-0.3 2,-0.4 -0.935 14.8-131.1-139.3 161.8 -12.5 32.4 55.1 53 53 A V E -H 87 0B 30 -2,-0.3 -42,-2.7 34,-0.2 2,-0.3 -0.934 20.4-169.6-115.9 137.5 -11.4 34.9 57.8 54 54 A L E -H 86 0B 2 32,-2.3 32,-2.9 -2,-0.4 2,-0.3 -0.839 24.2-113.4-120.2 161.4 -8.6 37.4 57.3 55 55 A D E +HI 85 146B 0 91,-3.6 91,-1.7 -2,-0.3 2,-0.3 -0.724 38.4 167.1 -91.3 145.4 -6.9 39.6 59.9 56 56 A T E -H 84 0B 2 28,-0.8 28,-2.1 -2,-0.3 2,-0.3 -0.966 18.4-162.9-152.4 154.9 -7.3 43.4 59.7 57 57 A K S S- 0 0 18 84,-1.9 52,-0.3 -2,-0.3 56,-0.1 -0.887 76.0 -23.8-147.1 110.0 -6.5 46.3 62.1 58 58 A D S S+ 0 0 62 -2,-0.3 51,-0.6 1,-0.2 2,-0.4 0.905 92.9 152.7 55.7 42.7 -8.0 49.7 61.7 59 59 A L E -D 108 0A 16 49,-0.2 2,-0.7 25,-0.1 -1,-0.2 -0.861 44.1-139.9-104.9 141.9 -8.6 49.1 58.0 60 60 A T E -D 107 0A 81 47,-3.2 47,-2.0 -2,-0.4 2,-0.6 -0.902 20.2-160.9 -97.5 117.9 -11.3 50.8 56.0 61 61 A I E +D 106 0A 18 -2,-0.7 45,-0.2 45,-0.2 3,-0.1 -0.912 16.1 177.3-104.0 114.6 -12.7 48.1 53.6 62 62 A E E - 0 0 138 43,-2.0 2,-0.3 -2,-0.6 -1,-0.2 0.908 64.1 -34.5 -80.1 -46.6 -14.6 49.5 50.6 63 63 A K E -D 105 0A 50 42,-0.9 42,-2.9 2,-0.0 2,-0.4 -0.985 44.3-130.7-168.9 164.3 -15.4 46.3 48.9 64 64 A V E -D 104 0A 0 7,-0.4 7,-2.9 -2,-0.3 2,-0.4 -0.992 23.6-162.5-129.4 121.2 -14.2 42.7 48.1 65 65 A V E -DE 103 70A 19 38,-3.2 38,-2.9 -2,-0.4 2,-0.4 -0.896 9.6-178.0-108.1 130.2 -14.4 41.5 44.5 66 66 A I E > S-DE 102 69A 2 3,-3.2 3,-2.0 -2,-0.4 36,-0.1 -0.999 77.9 -11.7-125.8 125.9 -14.2 37.9 43.5 67 67 A N T 3 S- 0 0 107 34,-0.5 -1,-0.2 -2,-0.4 3,-0.1 0.952 130.1 -52.2 46.6 65.1 -14.3 37.2 39.7 68 68 A G T 3 S+ 0 0 66 -3,-0.1 2,-0.3 1,-0.1 -1,-0.3 0.340 120.8 100.2 59.7 -7.0 -15.3 40.7 38.8 69 69 A Q E < S-E 66 0A 138 -3,-2.0 -3,-3.2 0, 0.0 2,-0.3 -0.804 74.9-115.2-111.6 155.9 -18.2 40.7 41.2 70 70 A E E -E 65 0A 140 -2,-0.3 -5,-0.2 -5,-0.3 2,-0.2 -0.636 36.2-160.9 -84.7 138.7 -18.6 42.2 44.7 71 71 A V - 0 0 26 -7,-2.9 -7,-0.4 -2,-0.3 2,-0.2 -0.721 22.0 -90.0-118.7 172.8 -19.1 39.7 47.5 72 72 A K + 0 0 141 -2,-0.2 17,-2.5 17,-0.2 2,-0.3 -0.514 46.5 163.2 -81.6 145.6 -20.4 39.6 51.0 73 73 A Y E -J 88 0B 67 15,-0.2 2,-0.3 -2,-0.2 15,-0.2 -0.965 18.5-156.9-160.1 149.7 -18.1 40.2 54.0 74 74 A A E -J 87 0B 48 13,-2.2 13,-2.4 -2,-0.3 2,-0.5 -0.953 10.6-141.3-133.2 150.1 -18.4 41.1 57.6 75 75 A L E -J 86 0B 81 -2,-0.3 11,-0.2 11,-0.2 3,-0.1 -0.954 19.5-145.1-112.4 121.1 -16.1 42.6 60.1 76 76 A G - 0 0 33 9,-3.2 3,-0.1 -2,-0.5 2,-0.1 -0.235 36.3 -79.2 -76.5 175.2 -16.1 41.3 63.6 77 77 A E - 0 0 165 1,-0.1 -1,-0.2 7,-0.1 2,-0.0 -0.375 60.1 -86.3 -72.6 154.5 -15.6 43.5 66.6 78 78 A R - 0 0 102 6,-0.2 2,-0.5 1,-0.1 6,-0.2 -0.313 29.1-154.9 -64.8 140.4 -12.1 44.4 67.5 79 79 A Q > - 0 0 86 4,-3.1 3,-2.3 1,-0.3 4,-0.3 -0.676 43.3-103.8-115.1 72.3 -10.1 42.1 69.7 80 80 A S G > S- 0 0 83 -2,-0.5 3,-1.4 1,-0.3 -1,-0.3 -0.092 97.0 -1.5 48.1-127.2 -7.7 44.5 71.3 81 81 A Y G 3 S+ 0 0 32 1,-0.2 -1,-0.3 -3,-0.1 57,-0.0 0.594 126.7 69.7 -71.2 -10.7 -4.2 44.3 69.8 82 82 A K G < S- 0 0 26 -3,-2.3 -26,-0.3 1,-0.3 -1,-0.2 0.653 95.1-142.6 -80.7 -14.8 -5.3 41.5 67.4 83 83 A G < - 0 0 0 -3,-1.4 -4,-3.1 -4,-0.3 -1,-0.3 -0.514 35.3 -47.0 87.0-157.9 -7.5 43.8 65.3 84 84 A S E -H 56 0B 20 -28,-2.1 -28,-0.8 -6,-0.2 2,-0.2 -0.938 51.4-120.2-120.8 134.8 -10.8 42.7 63.8 85 85 A P E -H 55 0B 23 0, 0.0 -9,-3.2 0, 0.0 2,-0.6 -0.498 20.0-152.1 -73.4 140.8 -11.6 39.5 61.9 86 86 A M E -HJ 54 75B 0 -32,-2.9 -32,-2.3 -11,-0.2 2,-0.5 -0.934 6.9-161.4-118.1 106.7 -12.8 39.9 58.3 87 87 A E E -HJ 53 74B 98 -13,-2.4 -13,-2.2 -2,-0.6 2,-0.4 -0.782 6.9-165.4 -91.6 126.6 -15.0 37.0 57.1 88 88 A I E -HJ 52 73B 0 -36,-2.9 -36,-1.8 -2,-0.5 2,-0.5 -0.944 13.2-138.1-114.6 129.2 -15.4 36.8 53.3 89 89 A S E -H 51 0B 37 -17,-2.5 -38,-0.2 -2,-0.4 -17,-0.2 -0.750 16.4-139.2 -88.8 127.0 -18.1 34.7 51.6 90 90 A L E - 0 0 16 -40,-3.1 12,-0.0 -2,-0.5 3,-0.0 -0.677 6.9-140.5 -85.6 133.8 -16.8 32.7 48.6 91 91 A P E S+ 0 0 73 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.645 90.9 34.5 -68.3 -10.2 -19.3 32.7 45.6 92 92 A I E S- 0 0 105 -43,-0.1 2,-0.4 -42,-0.1 -43,-0.0 -0.999 89.7-111.4-145.0 140.0 -18.3 29.0 45.1 93 93 A A E - 0 0 40 -2,-0.3 2,-0.2 -45,-0.1 -43,-0.2 -0.568 35.5-144.9 -73.9 126.1 -17.3 26.2 47.5 94 94 A L E -H 49 0B 10 -45,-3.0 -45,-3.8 -2,-0.4 2,-0.3 -0.616 8.7-154.7 -91.9 150.6 -13.7 25.3 47.1 95 95 A S > - 0 0 40 -48,-0.3 3,-2.5 -2,-0.2 -48,-0.3 -0.721 49.0 -47.7-115.6 171.1 -12.3 21.8 47.5 96 96 A K T 3 S+ 0 0 109 -2,-0.3 -51,-0.2 1,-0.3 -1,-0.2 -0.061 125.1 0.1 -44.2 131.1 -8.9 20.7 48.5 97 97 A N T 3 S+ 0 0 98 -53,-2.2 -1,-0.3 1,-0.2 2,-0.2 0.359 93.3 135.7 68.7 0.8 -6.1 22.6 46.5 98 98 A Q < - 0 0 95 -3,-2.5 -54,-2.7 -55,-0.1 2,-0.3 -0.564 42.3-147.6 -77.8 142.8 -8.6 24.7 44.5 99 99 A E E +C 43 0A 118 -56,-0.2 2,-0.3 -2,-0.2 -56,-0.2 -0.749 19.2 177.9-113.6 158.7 -7.6 28.4 44.3 100 100 A I E -C 42 0A 16 -58,-1.7 -58,-3.1 -2,-0.3 2,-0.5 -0.974 24.1-129.9-154.4 148.1 -9.5 31.7 44.1 101 101 A V E -C 41 0A 72 -2,-0.3 -34,-0.5 -60,-0.2 2,-0.5 -0.927 18.4-166.0-108.4 130.1 -8.4 35.3 43.9 102 102 A I E -CD 40 66A 1 -62,-2.7 -62,-2.6 -2,-0.5 2,-0.6 -0.960 4.9-158.4-115.2 124.1 -10.0 37.8 46.3 103 103 A E E -CD 39 65A 56 -38,-2.9 -38,-3.2 -2,-0.5 2,-0.5 -0.924 8.4-169.1-108.4 123.1 -9.5 41.4 45.6 104 104 A I E -CD 38 64A 0 -66,-2.2 -66,-2.7 -2,-0.6 2,-0.6 -0.944 12.2-152.3-116.1 125.5 -10.0 43.8 48.6 105 105 A S E +CD 37 63A 9 -42,-2.9 -43,-2.0 -2,-0.5 -42,-0.9 -0.860 35.4 160.4 -93.0 123.1 -10.2 47.5 48.2 106 106 A F E -CD 36 61A 6 -70,-2.3 -70,-2.0 -2,-0.6 2,-0.3 -0.898 34.0-151.2-141.8 172.2 -8.9 49.0 51.4 107 107 A E E -CD 35 60A 79 -47,-2.0 -47,-3.2 -2,-0.3 -72,-0.2 -0.984 22.5-131.1-147.4 130.6 -7.6 52.2 53.0 108 108 A T E - D 0 59A 2 -74,-2.2 -49,-0.2 -2,-0.3 35,-0.1 -0.463 23.6-112.8 -82.2 159.3 -5.2 52.3 56.0 109 109 A S > - 0 0 18 -51,-0.6 3,-2.4 33,-0.3 -1,-0.1 -0.631 17.7-124.7 -88.8 146.7 -5.8 54.5 59.0 110 110 A P T 3 S+ 0 0 50 0, 0.0 7,-0.2 0, 0.0 -1,-0.1 0.834 116.6 55.8 -60.7 -24.8 -3.4 57.4 59.8 111 111 A K T 3 S+ 0 0 147 -53,-0.1 -79,-0.0 5,-0.1 -53,-0.0 0.201 76.4 150.2 -90.4 13.8 -3.0 55.6 63.2 112 112 A S X - 0 0 2 -3,-2.4 3,-0.9 1,-0.2 -54,-0.1 -0.242 45.0-144.0 -45.3 126.9 -2.0 52.3 61.6 113 113 A S T 3 S+ 0 0 13 1,-0.2 485,-0.3 -56,-0.1 -1,-0.2 0.649 97.5 60.2 -73.5 -13.8 0.3 50.6 64.1 114 114 A A T 3 S+ 0 0 0 25,-0.2 20,-1.7 28,-0.2 2,-0.3 0.644 103.3 60.6 -83.0 -18.1 2.4 49.2 61.2 115 115 A L E < -K 133 0C 5 -3,-0.9 2,-0.5 18,-0.2 18,-0.2 -0.825 55.3-162.3-119.1 150.8 3.3 52.7 59.9 116 116 A Q E -K 132 0C 7 16,-2.1 16,-1.4 -2,-0.3 2,-0.6 -0.979 13.3-160.8-127.0 122.8 5.0 55.9 61.0 117 117 A W E -K 131 0C 9 -2,-0.5 2,-0.4 -7,-0.2 14,-0.2 -0.905 11.3-159.0-101.9 119.3 4.2 59.0 58.9 118 118 A L E -K 130 0C 4 12,-3.0 12,-1.7 -2,-0.6 5,-0.0 -0.838 11.1-135.5-104.0 135.5 6.9 61.7 59.4 119 119 A T > - 0 0 51 -2,-0.4 3,-1.8 10,-0.2 4,-0.2 -0.440 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-3,-2.6 -1,-0.2 -366,-0.1 3,-0.0 -0.982 66.9-127.5-119.5 129.9 -0.3 38.4 75.2 373 373 A D >> - 0 0 27 -2,-0.4 3,-1.8 1,-0.2 4,-1.3 -0.631 18.6-140.3 -72.5 121.1 0.6 41.2 72.8 374 374 A P H 3> S+ 0 0 13 0, 0.0 4,-1.7 0, 0.0 3,-0.4 0.881 100.5 59.7 -50.5 -43.2 3.9 40.1 71.1 375 375 A D H 34 S+ 0 0 6 1,-0.2 -2,-0.0 2,-0.2 227,-0.0 0.780 105.2 49.9 -55.3 -29.8 5.3 43.6 71.3 376 376 A V H <4 S+ 0 0 40 -3,-1.8 -1,-0.2 1,-0.2 -3,-0.0 0.816 111.6 47.1 -79.6 -30.4 4.9 43.5 75.1 377 377 A A H < S+ 0 0 16 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.673 82.6 122.0 -84.9 -17.9 6.6 40.1 75.5 378 378 A Y < + 0 0 85 -4,-1.7 2,-0.3 2,-0.1 -16,-0.0 -0.174 33.4 133.3 -51.6 131.1 9.6 41.0 73.3 379 379 A S - 0 0 18 -17,-0.0 4,-0.4 -16,-0.0 -2,-0.0 -0.927 68.4 -86.5-162.5-178.2 13.0 40.7 75.0 380 380 A S S > S+ 0 0 43 -2,-0.3 4,-3.1 1,-0.2 5,-0.4 0.536 99.1 93.1 -78.2 -8.2 16.6 39.4 74.7 381 381 A V H >>S+ 0 0 1 1,-0.2 4,-3.1 2,-0.2 5,-0.9 0.938 83.6 45.6 -57.1 -51.5 15.5 36.0 76.0 382 382 A P H 45S+ 0 0 18 0, 0.0 4,-0.4 0, 0.0 -1,-0.2 0.868 117.4 47.4 -63.1 -27.2 14.8 34.3 72.6 383 383 A Y H >5S+ 0 0 38 -4,-0.4 4,-2.0 3,-0.2 -2,-0.2 0.966 123.7 28.2 -72.6 -52.1 18.0 35.7 71.3 384 384 A E H X5S+ 0 0 17 -4,-3.1 4,-2.3 2,-0.2 -3,-0.2 0.829 121.7 45.7 -89.1 -30.8 20.3 34.8 74.1 385 385 A K H X5S+ 0 0 2 -4,-3.1 4,-2.2 -5,-0.4 -1,-0.2 0.883 117.7 49.4 -76.7 -29.9 18.8 31.8 75.7 386 386 A G H >S+ 0 0 5 -4,-2.2 5,-3.2 1,-0.2 4,-0.5 0.942 112.0 41.0 -56.4 -47.6 27.9 23.0 69.6 395 395 A Q H ><5S+ 0 0 54 -4,-2.1 3,-0.6 1,-0.2 -2,-0.2 0.884 116.3 49.4 -69.8 -37.9 30.3 22.2 72.4 396 396 A L H 3<5S+ 0 0 47 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.864 112.8 47.2 -69.5 -35.8 28.5 19.0 73.4 397 397 A L T 3<5S- 0 0 2 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.392 129.4 -76.5 -92.2 3.8 28.4 17.6 69.9 398 398 A G T < 5S- 0 0 50 -3,-0.6 4,-0.2 -4,-0.5 -3,-0.2 0.526 77.0 -67.4 121.8 -1.1 31.9 18.2 68.8 399 399 A G >< - 0 0 15 -5,-3.2 4,-2.7 -6,-0.2 5,-0.2 -0.336 65.6 -53.9 112.7 169.4 32.6 21.8 67.9 400 400 A P H > S+ 0 0 46 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.834 125.2 54.2 -54.9 -42.0 31.7 24.5 65.4 401 401 A E H > S+ 0 0 172 2,-0.2 4,-1.4 1,-0.2 -2,-0.1 0.951 113.6 42.8 -63.3 -45.0 32.6 22.7 62.3 402 402 A I H > S+ 0 0 64 -4,-0.2 4,-1.3 1,-0.2 3,-0.3 0.941 117.2 45.8 -66.0 -47.4 30.3 19.7 63.2 403 403 A F H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.835 107.8 56.4 -66.8 -33.6 27.5 21.9 64.4 404 404 A L H X S+ 0 0 17 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.2 0.843 101.3 59.2 -65.4 -30.4 27.7 24.2 61.4 405 405 A G H X S+ 0 0 27 -4,-1.4 4,-1.8 -3,-0.3 -1,-0.2 0.914 107.2 46.8 -62.0 -40.9 27.2 21.1 59.3 406 406 A F H X S+ 0 0 0 -4,-1.3 4,-3.0 2,-0.2 -2,-0.2 0.955 109.3 54.3 -64.3 -48.8 23.9 20.5 61.1 407 407 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.884 109.5 46.8 -53.5 -44.9 22.9 24.2 60.7 408 408 A K H X S+ 0 0 81 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.884 113.5 48.5 -68.3 -34.3 23.4 24.0 56.9 409 409 A A H X S+ 0 0 28 -4,-1.8 4,-2.8 -5,-0.2 -2,-0.2 0.886 110.6 52.2 -72.1 -35.2 21.4 20.8 56.8 410 410 A Y H X S+ 0 0 2 -4,-3.0 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61.6 420 420 A T > - 0 0 11 -2,-0.3 4,-2.0 -112,-0.2 3,-0.2 -0.627 38.9 -99.7-110.7 168.5 8.1 24.5 65.3 421 421 A T H > S+ 0 0 2 1,-0.2 4,-3.0 -2,-0.2 5,-0.3 0.883 123.7 56.2 -52.3 -44.0 10.6 23.7 68.1 422 422 A D H > S+ 0 0 84 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.902 104.5 52.2 -60.7 -38.5 9.6 20.0 67.8 423 423 A D H > S+ 0 0 50 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.948 112.8 46.2 -60.5 -43.4 10.5 20.0 64.0 424 424 A W H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.947 116.6 42.3 -63.3 -47.9 13.9 21.5 64.9 425 425 A K H X S+ 0 0 47 -4,-3.0 4,-2.1 2,-0.2 5,-0.2 0.901 112.0 54.2 -69.9 -37.3 14.6 19.0 67.7 426 426 A D H X S+ 0 0 82 -4,-3.3 4,-1.6 -5,-0.3 -1,-0.2 0.914 112.4 45.2 -63.6 -38.5 13.2 16.0 65.7 427 427 A F H X S+ 0 0 25 -4,-2.0 4,-3.6 -5,-0.3 5,-0.3 0.885 106.6 58.3 -72.0 -37.3 15.7 16.9 62.9 428 428 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.934 109.9 44.7 -57.7 -42.5 18.5 17.5 65.3 429 429 A Y H < S+ 0 0 47 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.844 113.3 51.1 -69.9 -31.7 18.1 13.9 66.5 430 430 A S H >< S+ 0 0 76 -4,-1.6 3,-1.0 -5,-0.2 -2,-0.2 0.929 113.4 43.9 -71.1 -43.2 17.8 12.7 62.9 431 431 A Y H 3< S+ 0 0 94 -4,-3.6 3,-0.3 1,-0.3 -2,-0.2 0.912 118.8 43.2 -66.3 -42.6 21.0 14.5 61.9 432 432 A F T >< S+ 0 0 11 -4,-2.5 3,-2.6 -5,-0.3 -1,-0.3 -0.219 70.9 141.2 -97.5 42.6 22.9 13.4 65.0 433 433 A K G X S+ 0 0 139 -3,-1.0 3,-0.7 1,-0.3 -1,-0.2 0.794 70.2 56.1 -56.4 -27.2 21.6 9.9 64.8 434 434 A D G 3 S+ 0 0 135 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.394 110.3 44.0 -88.9 7.7 25.1 8.6 65.8 435 435 A K G X> + 0 0 67 -3,-2.6 4,-2.9 -6,-0.2 3,-0.8 0.042 67.4 126.6-136.1 25.1 25.1 10.7 69.0 436 436 A V H <> S+ 0 0 49 -3,-0.7 4,-2.5 1,-0.3 5,-0.1 0.862 75.8 57.2 -52.4 -39.0 21.6 10.2 70.3 437 437 A D H 34 S+ 0 0 134 2,-0.2 -1,-0.3 1,-0.2 4,-0.2 0.875 109.1 45.1 -61.9 -37.1 23.2 9.1 73.6 438 438 A V H X4 S+ 0 0 37 -3,-0.8 3,-1.8 1,-0.2 4,-0.3 0.922 112.3 50.9 -71.5 -45.7 24.9 12.5 73.8 439 439 A L H >< S+ 0 0 0 -4,-2.9 3,-1.6 1,-0.3 -2,-0.2 0.867 102.9 61.8 -59.4 -32.3 21.7 14.3 72.8 440 440 A N T 3< S+ 0 0 95 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.570 91.0 67.7 -73.9 -2.9 19.9 12.4 75.5 441 441 A Q T < S+ 0 0 124 -3,-1.8 2,-0.3 -4,-0.2 -1,-0.3 0.550 79.2 101.8 -87.7 -10.2 22.2 14.0 78.1 442 442 A V S < S- 0 0 8 -3,-1.6 2,-2.2 -4,-0.3 3,-0.2 -0.591 77.3-132.3 -78.5 134.9 20.6 17.4 77.4 443 443 A D > + 0 0 82 -2,-0.3 4,-2.5 1,-0.2 3,-0.3 -0.551 37.3 171.0 -82.6 77.6 18.0 18.6 79.9 444 444 A W H > + 0 0 27 -2,-2.2 4,-2.8 1,-0.2 5,-0.4 0.866 69.0 57.6 -57.5 -41.5 15.6 19.5 77.1 445 445 A N H > S+ 0 0 102 -3,-0.2 4,-2.1 2,-0.2 5,-0.5 0.905 111.7 41.4 -58.4 -42.0 12.7 20.2 79.5 446 446 A A H > S+ 0 0 13 -3,-0.3 4,-1.8 3,-0.2 -2,-0.2 0.954 116.2 48.3 -72.2 -46.4 14.6 22.8 81.4 447 447 A W H < S+ 0 0 1 -4,-2.5 -82,-0.4 1,-0.2 -2,-0.2 0.905 123.6 30.5 -60.9 -42.8 16.2 24.4 78.3 448 448 A L H < S+ 0 0 2 -4,-2.8 -82,-2.2 -5,-0.2 -83,-0.2 0.857 134.6 19.9 -86.4 -34.6 12.9 24.6 76.4 449 449 A Y H < S+ 0 0 112 -4,-2.1 -3,-0.2 -5,-0.4 -2,-0.2 0.524 95.5 92.2-120.6 -6.3 10.3 25.0 79.0 450 450 A S < - 0 0 40 -4,-1.8 -85,-0.4 -5,-0.5 -84,-0.1 -0.671 66.5-125.4 -93.7 147.9 11.7 26.3 82.2 451 451 A P + 0 0 48 0, 0.0 -87,-0.1 0, 0.0 -92,-0.1 -0.294 67.1 29.5 -80.0 171.7 12.0 29.9 83.2 452 452 A G S S- 0 0 3 -92,-0.4 -93,-0.1 -95,-0.3 -2,-0.0 -0.292 104.3 -8.4 84.7-164.3 15.2 31.6 84.3 453 453 A L S S- 0 0 79 1,-0.1 4,-0.1 -2,-0.1 -68,-0.0 -0.393 85.3 -89.1 -69.7 150.0 18.8 31.0 83.4 454 454 A P - 0 0 12 0, 0.0 -1,-0.1 0, 0.0 -7,-0.1 -0.144 35.7-113.6 -54.5 154.1 19.6 27.9 81.4 455 455 A P S S+ 0 0 65 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.673 100.3 27.8 -66.5 -19.4 20.3 24.7 83.4 456 456 A I S S- 0 0 71 -13,-0.1 -64,-0.1 -9,-0.0 0, 0.0 -0.997 74.8-135.8-144.4 143.4 24.0 24.7 82.2 457 457 A K - 0 0 99 -2,-0.3 3,-0.1 1,-0.1 -68,-0.0 -0.852 25.8-124.6-101.6 133.1 26.3 27.5 81.1 458 458 A P - 0 0 6 0, 0.0 2,-0.4 0, 0.0 -66,-0.1 -0.116 32.0 -99.0 -63.5 174.5 28.5 26.9 78.0 459 459 A N - 0 0 122 -68,-0.1 2,-0.4 -67,-0.1 -64,-0.0 -0.796 42.1-164.2 -95.7 138.7 32.3 27.3 78.2 460 460 A Y - 0 0 29 -2,-0.4 2,-0.1 -3,-0.1 -120,-0.0 -0.981 22.4-121.4-130.8 138.1 33.7 30.6 77.0 461 461 A D - 0 0 62 -2,-0.4 -118,-0.2 -126,-0.1 4,-0.1 -0.478 22.9-160.1 -66.5 147.7 37.2 31.8 76.1 462 462 A M > + 0 0 64 1,-0.1 4,-2.5 -2,-0.1 3,-0.4 0.401 53.0 114.0-114.7 -0.8 38.1 34.7 78.3 463 463 A T T 4 S+ 0 0 71 1,-0.2 4,-0.4 2,-0.2 -1,-0.1 0.844 88.8 27.3 -38.0 -60.4 40.9 36.4 76.4 464 464 A L T 4 S+ 0 0 51 -128,-0.3 4,-0.4 1,-0.2 -1,-0.2 0.687 119.0 58.3 -82.7 -18.9 39.1 39.7 75.6 465 465 A T T >> S+ 0 0 3 -3,-0.4 4,-2.3 1,-0.2 3,-0.7 0.803 86.8 76.2 -79.0 -31.8 36.8 39.7 78.6 466 466 A N H 3X S+ 0 0 93 -4,-2.5 4,-2.6 1,-0.3 5,-0.2 0.875 94.1 49.0 -49.8 -45.3 39.5 39.5 81.3 467 467 A A H 3> S+ 0 0 44 -4,-0.4 4,-1.9 1,-0.2 -1,-0.3 0.830 110.3 52.0 -65.9 -30.3 40.5 43.2 80.9 468 468 A C H <> S+ 0 0 0 -3,-0.7 4,-2.9 -4,-0.4 5,-0.2 0.903 110.8 48.3 -71.4 -39.4 36.8 44.3 81.1 469 469 A I H X S+ 0 0 59 -4,-2.3 4,-2.9 2,-0.2 5,-0.3 0.918 110.2 51.0 -65.7 -46.8 36.4 42.3 84.3 470 470 A A H X S+ 0 0 56 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.925 115.3 41.6 -56.9 -47.0 39.5 43.7 85.9 471 471 A L H X S+ 0 0 8 -4,-1.9 4,-2.0 2,-0.2 5,-0.2 0.928 115.5 48.5 -70.7 -45.3 38.5 47.2 85.2 472 472 A S H X S+ 0 0 2 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.926 111.9 49.4 -60.7 -44.3 34.9 46.8 86.1 473 473 A Q H X S+ 0 0 83 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.913 107.2 56.5 -62.8 -37.7 35.8 45.1 89.4 474 474 A R H < S+ 0 0 106 -4,-2.0 4,-0.4 -5,-0.3 -1,-0.2 0.897 112.4 41.2 -60.0 -40.3 38.2 47.9 90.2 475 475 A W H >< S+ 0 0 0 -4,-2.0 3,-0.8 2,-0.2 -2,-0.2 0.914 112.5 53.5 -71.7 -40.7 35.4 50.4 89.9 476 476 A I H 3< S+ 0 0 30 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.876 120.7 32.8 -63.1 -35.1 32.8 48.4 91.7 477 477 A T T 3< S+ 0 0 82 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.347 90.4 132.7-103.9 6.8 35.1 47.9 94.7 478 478 A A < - 0 0 10 -3,-0.8 2,-0.2 -4,-0.4 -3,-0.1 -0.250 35.0-166.1 -61.2 144.5 36.9 51.2 94.5 479 479 A K >> - 0 0 150 37,-0.0 3,-2.6 1,-0.0 4,-0.8 -0.705 42.6 -82.8-121.9 174.9 37.3 53.2 97.7 480 480 A E G >4 S+ 0 0 151 1,-0.3 3,-0.9 -2,-0.2 4,-0.5 0.848 126.1 56.4 -48.7 -43.0 38.4 56.8 98.3 481 481 A D G 34 S+ 0 0 104 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.504 104.4 54.5 -73.6 1.3 42.1 56.0 98.0 482 482 A D G X> S+ 0 0 63 -3,-2.6 4,-0.9 2,-0.1 3,-0.8 0.629 85.5 81.4-102.9 -17.4 41.7 54.5 94.5 483 483 A L G X< S+ 0 0 33 -3,-0.9 3,-0.7 -4,-0.8 -2,-0.1 0.876 88.6 51.9 -59.3 -40.8 39.9 57.4 92.8 484 484 A N G 34 S+ 0 0 133 -4,-0.5 -1,-0.2 1,-0.2 -2,-0.1 0.714 104.9 58.5 -69.6 -21.0 43.1 59.4 92.0 485 485 A S G <4 S+ 0 0 87 -3,-0.8 -1,-0.2 -4,-0.1 -2,-0.2 0.711 78.9 97.3 -84.3 -21.2 44.8 56.4 90.4 486 486 A F << + 0 0 3 -4,-0.9 2,-0.3 -3,-0.7 3,-0.0 -0.440 57.4 173.5 -65.0 150.1 42.2 55.7 87.7 487 487 A N > - 0 0 77 1,-0.1 3,-3.4 37,-0.0 4,-0.3 -0.986 51.0-104.4-158.9 153.6 43.5 57.4 84.5 488 488 A A G > S+ 0 0 61 1,-0.3 3,-1.8 -2,-0.3 4,-0.2 0.772 114.5 74.2 -52.2 -26.5 42.6 57.7 80.9 489 489 A T G > S+ 0 0 90 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.724 77.1 76.0 -63.4 -17.4 45.5 55.3 80.4 490 490 A D G < S+ 0 0 36 -3,-3.4 -1,-0.3 1,-0.3 3,-0.3 0.738 94.6 50.2 -62.2 -24.2 43.3 52.5 81.7 491 491 A L G X S+ 0 0 31 -3,-1.8 3,-2.2 -4,-0.3 -1,-0.3 0.436 78.9 114.2 -93.3 -1.0 41.5 52.4 78.4 492 492 A K T < S+ 0 0 159 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.1 0.805 85.5 24.1 -40.6 -52.5 44.7 52.2 76.4 493 493 A D T 3 S+ 0 0 129 -3,-0.3 2,-0.5 -4,-0.2 -1,-0.3 0.013 96.6 113.3-111.3 33.7 44.4 48.8 74.9 494 494 A L < - 0 0 31 -3,-2.2 2,-0.1 -27,-0.0 -3,-0.0 -0.886 55.9-141.7-109.7 132.6 40.6 48.5 75.0 495 495 A S > - 0 0 47 -2,-0.5 4,-2.1 1,-0.1 5,-0.2 -0.331 34.8-103.8 -77.1 169.7 38.5 48.3 71.8 496 496 A S H > S+ 0 0 30 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.878 125.5 60.0 -62.7 -33.1 35.1 50.1 71.8 497 497 A H H > S+ 0 0 58 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.894 107.0 45.0 -59.4 -41.6 33.7 46.5 72.2 498 498 A Q H > S+ 0 0 18 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.835 109.1 54.2 -72.7 -33.5 35.6 46.2 75.5 499 499 A L H X S+ 0 0 20 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.904 110.1 49.2 -65.3 -39.9 34.6 49.6 76.7 500 500 A N H X S+ 0 0 35 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.904 112.2 46.9 -64.4 -42.9 31.0 48.6 76.1 501 501 A E H X S+ 0 0 26 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.882 109.2 55.0 -68.0 -38.4 31.5 45.3 78.0 502 502 A F H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.933 111.2 44.9 -57.3 -47.4 33.2 47.1 80.8 503 503 A L H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.887 110.7 53.6 -66.3 -38.3 30.2 49.4 81.2 504 504 A A H X S+ 0 0 6 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.909 111.0 46.3 -64.5 -41.1 27.8 46.5 80.9 505 505 A Q H < S+ 0 0 23 -4,-2.6 4,-0.5 2,-0.2 -2,-0.2 0.919 114.7 47.1 -67.3 -40.4 29.6 44.8 83.7 506 506 A T H >< S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.891 107.6 56.5 -67.6 -38.1 29.7 47.9 85.8 507 507 A L H >< S+ 0 0 22 -4,-3.0 3,-1.9 1,-0.3 -1,-0.2 0.847 95.3 65.8 -64.2 -31.3 26.0 48.6 85.1 508 508 A Q T 3< S+ 0 0 70 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.769 107.0 43.4 -61.2 -20.2 25.0 45.2 86.6 509 509 A R T < S+ 0 0 134 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.168 99.1 172.0-109.3 14.0 26.3 46.5 89.9 510 510 A A < + 0 0 25 -3,-1.9 2,-0.1 2,-0.0 35,-0.1 -0.356 42.1 64.2 -70.3 156.0 24.7 50.0 89.8 511 511 A P - 0 0 86 0, 0.0 34,-0.1 0, 0.0 31,-0.1 0.492 62.9-174.7 -78.8 157.2 24.4 52.3 91.5 512 512 A L - 0 0 9 29,-0.4 -36,-0.1 -2,-0.1 5,-0.1 -0.729 45.4 -80.1-104.7 158.7 28.0 53.2 92.0 513 513 A P >> - 0 0 73 0, 0.0 4,-1.8 0, 0.0 3,-0.6 -0.329 40.5-119.8 -59.2 146.8 28.6 56.1 94.5 514 514 A L H 3> S+ 0 0 64 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.891 113.8 54.2 -56.5 -41.7 28.0 59.5 92.8 515 515 A G H 3> S+ 0 0 40 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.833 105.9 54.1 -62.1 -32.6 31.7 60.6 93.4 516 516 A H H <> S+ 0 0 21 -3,-0.6 4,-2.1 2,-0.2 -1,-0.2 0.923 109.6 46.1 -69.1 -40.8 32.8 57.4 91.6 517 517 A I H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.907 110.5 52.5 -70.7 -37.5 30.8 58.2 88.5 518 518 A K H X S+ 0 0 90 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.928 110.7 49.3 -59.8 -41.7 31.9 61.8 88.5 519 519 A R H X S+ 0 0 43 -4,-1.9 4,-2.6 1,-0.2 5,-0.3 0.888 104.9 58.1 -66.7 -36.2 35.5 60.5 88.6 520 520 A M H X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.2 5,-0.5 0.914 108.1 45.7 -61.2 -40.2 34.8 58.1 85.8 521 521 A Q H X S+ 0 0 33 -4,-1.8 4,-1.9 3,-0.2 -1,-0.2 0.905 110.7 55.2 -68.1 -41.0 33.8 61.0 83.5 522 522 A E H < S+ 0 0 137 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.897 119.8 30.2 -58.9 -44.2 36.8 62.9 84.6 523 523 A V H < S+ 0 0 16 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.815 133.6 27.1 -87.8 -30.5 39.2 60.2 83.7 524 524 A Y H < S- 0 0 14 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.649 82.2-145.4-107.2 -16.2 37.5 58.5 80.7 525 525 A N >< + 0 0 84 -4,-1.9 3,-1.3 -5,-0.5 4,-0.2 0.914 31.9 165.9 53.1 49.4 35.4 61.3 79.2 526 526 A F G > + 0 0 0 1,-0.2 3,-1.5 -6,-0.2 -1,-0.1 0.734 64.7 74.4 -67.1 -20.6 32.6 58.9 78.3 527 527 A N G 3 S+ 0 0 47 1,-0.3 -1,-0.2 -6,-0.1 -2,-0.1 0.814 93.1 56.6 -61.5 -24.9 30.3 61.9 77.7 528 528 A A G < S+ 0 0 57 -3,-1.3 2,-0.4 2,-0.0 -1,-0.3 0.574 83.4 99.6 -83.1 -9.7 32.3 62.5 74.5 529 529 A I < - 0 0 41 -3,-1.5 -4,-0.0 -4,-0.2 -3,-0.0 -0.631 47.7-173.9 -80.6 130.2 31.7 59.0 73.0 530 530 A N + 0 0 133 -2,-0.4 2,-0.2 -246,-0.2 -1,-0.1 0.595 44.2 120.2-100.8 -4.6 28.9 59.0 70.4 531 531 A N > - 0 0 14 1,-0.2 4,-2.8 -247,-0.1 5,-0.2 -0.394 63.4-139.6 -53.9 121.3 28.8 55.2 69.8 532 532 A S H > S+ 0 0 10 -251,-0.6 4,-2.4 1,-0.2 -1,-0.2 0.801 94.6 52.6 -63.7 -33.6 25.2 54.5 70.8 533 533 A E H > S+ 0 0 16 2,-0.2 4,-1.9 -252,-0.2 -1,-0.2 0.907 114.9 41.9 -69.1 -43.9 25.7 51.3 72.7 534 534 A I H > S+ 0 0 2 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.945 115.8 48.5 -69.3 -46.0 28.4 52.8 74.9 535 535 A R H X S+ 0 0 33 -4,-2.8 4,-3.2 1,-0.2 5,-0.3 0.927 109.8 54.0 -60.2 -42.8 26.5 56.1 75.4 536 536 A F H X S+ 0 0 11 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.950 113.0 40.9 -53.0 -55.5 23.4 54.2 76.3 537 537 A R H X S+ 0 0 10 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.894 115.2 51.5 -65.0 -40.9 25.1 52.1 79.0 538 538 A W H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.952 110.8 47.2 -62.2 -47.2 27.1 55.0 80.3 539 539 A L H X S+ 0 0 0 -4,-3.2 4,-2.7 -5,-0.2 5,-0.2 0.916 111.3 52.2 -64.2 -37.9 24.0 57.3 80.6 540 540 A R H X S+ 0 0 57 -4,-2.3 4,-3.0 -5,-0.3 5,-0.3 0.931 109.5 49.3 -59.5 -45.5 22.1 54.5 82.4 541 541 A L H X S+ 0 0 0 -4,-2.4 4,-1.1 1,-0.2 -29,-0.4 0.884 112.3 48.6 -61.3 -37.6 24.9 54.0 84.8 542 542 A C H <>S+ 0 0 0 -4,-2.2 5,-2.4 2,-0.2 -2,-0.2 0.918 114.7 43.6 -68.7 -44.2 24.9 57.8 85.5 543 543 A I H ><5S+ 0 0 1 -4,-2.7 3,-1.9 1,-0.2 -2,-0.2 0.931 114.0 49.9 -68.6 -43.9 21.2 58.0 86.0 544 544 A Q H 3<5S+ 0 0 53 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.771 109.6 53.2 -65.6 -23.6 21.0 54.9 88.1 545 545 A S T 3<5S- 0 0 4 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.295 119.4-113.4 -93.7 9.0 23.9 56.4 90.2 546 546 A K T < 5 + 0 0 100 -3,-1.9 2,-0.9 1,-0.2 -3,-0.2 0.798 56.4 159.0 68.6 35.4 21.9 59.6 90.7 547 547 A W > < - 0 0 24 -5,-2.4 3,-1.3 1,-0.2 4,-0.3 -0.792 24.7-164.5 -91.3 110.7 24.0 62.1 88.8 548 548 A E T > S+ 0 0 102 -2,-0.9 3,-1.6 1,-0.3 -1,-0.2 0.808 83.7 68.5 -65.1 -27.4 21.7 65.0 88.0 549 549 A D T 3> S+ 0 0 107 1,-0.3 4,-0.5 2,-0.1 -1,-0.3 0.794 95.1 57.5 -62.0 -23.3 24.0 66.3 85.4 550 550 A A H <> S+ 0 0 2 -3,-1.3 4,-2.5 1,-0.2 -1,-0.3 0.623 82.6 87.4 -82.7 -10.4 23.3 63.3 83.3 551 551 A I H <> S+ 0 0 13 -3,-1.6 4,-2.7 -4,-0.3 5,-0.3 0.923 90.0 44.1 -57.8 -50.7 19.5 64.0 83.1 552 552 A P H > S+ 0 0 78 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.901 113.5 52.7 -65.1 -33.1 19.5 66.3 80.1 553 553 A L H X S+ 0 0 42 -4,-0.5 4,-2.2 1,-0.2 -2,-0.2 0.903 112.7 44.3 -65.2 -39.7 21.9 63.9 78.3 554 554 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.896 113.0 49.5 -72.4 -39.8 19.6 60.9 78.9 555 555 A L H X S+ 0 0 13 -4,-2.7 4,-1.2 -5,-0.2 -1,-0.2 0.895 111.9 51.4 -64.9 -37.8 16.4 62.8 78.0 556 556 A K H X S+ 0 0 107 -4,-2.2 4,-2.7 -5,-0.3 3,-0.5 0.939 112.0 43.9 -63.3 -49.1 18.1 63.9 74.8 557 557 A M H X S+ 0 0 15 -4,-2.2 4,-0.8 1,-0.2 -2,-0.2 0.905 111.0 55.3 -66.2 -37.9 19.2 60.5 73.8 558 558 A A H < S+ 0 0 3 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.759 119.9 30.6 -66.6 -24.0 15.9 59.0 74.7 559 559 A T H < S+ 0 0 41 -4,-1.2 -2,-0.2 -3,-0.5 -1,-0.2 0.686 108.8 62.8-108.0 -24.9 14.0 61.4 72.4 560 560 A E H < S+ 0 0 122 -4,-2.7 2,-0.3 -5,-0.2 -3,-0.1 0.600 117.6 24.3 -78.6 -13.8 16.4 62.2 69.6 561 561 A Q < - 0 0 19 -4,-0.8 -297,-0.3 -5,-0.2 -282,-0.0 -0.930 67.4-153.5-139.7 162.7 16.4 58.6 68.5 562 562 A G + 0 0 10 -299,-3.5 2,-0.4 -2,-0.3 -298,-0.1 0.140 37.6 141.8-130.5 24.8 13.7 55.9 69.0 563 563 A R >> - 0 0 10 -300,-0.3 4,-3.2 1,-0.2 3,-1.7 -0.531 48.5-141.8 -66.2 121.8 15.4 52.5 69.0 564 564 A M H 3> S+ 0 0 12 -298,-2.4 4,-1.9 -2,-0.4 -1,-0.2 0.812 96.0 68.8 -60.4 -30.8 13.4 50.8 71.8 565 565 A K H 34 S+ 0 0 91 -299,-0.4 -1,-0.3 1,-0.2 -298,-0.1 0.807 118.5 23.4 -54.2 -33.0 16.5 49.0 73.1 566 566 A F H <> S+ 0 0 0 -3,-1.7 4,-2.1 3,-0.1 -2,-0.2 0.831 122.5 51.6 -99.0 -51.0 17.7 52.5 74.2 567 567 A T H X S+ 0 0 1 -4,-3.2 4,-2.2 2,-0.2 5,-0.3 0.896 107.3 50.8 -60.1 -45.7 14.6 54.6 74.5 568 568 A R H X S+ 0 0 42 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.968 114.3 42.1 -61.9 -51.4 12.6 52.3 76.7 569 569 A P H > S+ 0 0 23 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.854 113.1 54.4 -65.1 -31.9 15.4 51.7 79.4 570 570 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.949 111.7 42.8 -65.8 -46.7 16.4 55.4 79.4 571 571 A F H X S+ 0 0 2 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.903 114.3 53.1 -65.4 -38.3 12.8 56.6 80.1 572 572 A K H X S+ 0 0 82 -4,-2.4 4,-1.5 -5,-0.3 -2,-0.2 0.917 110.8 44.7 -65.7 -40.4 12.5 53.8 82.6 573 573 A D H X S+ 0 0 17 -4,-2.8 4,-1.0 2,-0.2 -2,-0.2 0.922 113.3 51.4 -67.1 -41.0 15.7 54.9 84.5 574 574 A L H < S+ 0 0 0 -4,-2.6 3,-0.4 1,-0.2 6,-0.3 0.874 108.8 50.9 -62.7 -36.3 14.7 58.6 84.3 575 575 A A H < S+ 0 0 20 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.838 109.5 51.6 -69.6 -30.7 11.3 57.7 85.8 576 576 A A H < S+ 0 0 73 -4,-1.5 2,-0.6 -5,-0.2 -1,-0.2 0.635 92.5 82.9 -81.2 -15.4 13.0 55.8 88.6 577 577 A F S >X S- 0 0 5 -4,-1.0 4,-1.5 -3,-0.4 3,-1.0 -0.818 74.8-147.5 -90.9 120.1 15.3 58.7 89.5 578 578 A D T 34 S+ 0 0 114 -2,-0.6 4,-0.5 1,-0.3 3,-0.3 0.881 94.8 57.2 -57.1 -39.0 13.3 61.1 91.7 579 579 A K T 34 S+ 0 0 115 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.792 118.1 30.4 -62.6 -32.1 15.1 64.1 90.4 580 580 A S T <> S+ 0 0 0 -3,-1.0 4,-2.6 -6,-0.3 -1,-0.2 0.484 90.5 100.0-107.9 -2.2 14.1 63.4 86.8 581 581 A H H X S+ 0 0 74 -4,-1.5 4,-2.4 -3,-0.3 5,-0.2 0.916 85.6 42.0 -52.0 -56.8 10.7 61.7 87.2 582 582 A D H > S+ 0 0 114 -4,-0.5 4,-2.7 1,-0.2 -1,-0.2 0.907 116.3 50.1 -60.2 -41.5 8.3 64.6 86.4 583 583 A Q H > S+ 0 0 89 -4,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.874 109.1 52.7 -65.1 -36.4 10.5 65.8 83.6 584 584 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 -10,-0.2 -2,-0.2 0.941 112.3 44.4 -63.2 -48.1 10.6 62.2 82.1 585 585 A V H X S+ 0 0 35 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.952 115.2 47.5 -63.6 -47.7 6.8 61.9 82.1 586 586 A R H X S+ 0 0 125 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.2 0.892 110.7 52.4 -61.5 -38.3 6.3 65.4 80.7 587 587 A T H X S+ 0 0 16 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.926 110.9 47.1 -64.9 -43.4 8.9 64.8 78.0 588 588 A Y H X S+ 0 0 10 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.934 111.7 50.2 -63.1 -44.8 7.1 61.6 76.9 589 589 A Q H < S+ 0 0 77 -4,-2.7 4,-0.4 1,-0.2 -2,-0.2 0.907 112.0 48.7 -60.2 -39.6 3.7 63.3 77.0 590 590 A E H < S+ 0 0 133 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.779 120.8 35.8 -70.4 -27.8 5.2 66.1 74.8 591 591 A H H >X S+ 0 0 61 -4,-1.7 3,-1.7 -3,-0.2 4,-0.7 0.617 89.1 90.8-101.6 -14.1 6.7 63.7 72.4 592 592 A K G >< S+ 0 0 63 -4,-2.4 3,-1.1 1,-0.3 8,-0.1 0.836 81.7 58.4 -59.0 -32.9 4.3 60.9 72.1 593 593 A A G 34 S+ 0 0 102 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.779 111.8 42.9 -65.1 -25.0 2.3 62.3 69.2 594 594 A S G <4 S+ 0 0 52 -3,-1.7 -1,-0.3 -4,-0.1 -2,-0.2 0.469 97.8 97.1-100.9 -0.2 5.5 62.4 67.2 595 595 A M S << S- 0 0 33 -3,-1.1 -331,-0.0 -4,-0.7 -36,-0.0 -0.283 89.5 -84.2 -82.8 169.3 6.8 58.9 68.2 596 596 A H > - 0 0 3 -332,-0.2 4,-3.0 1,-0.1 5,-0.2 -0.510 46.1-119.3 -67.7 141.2 6.5 55.6 66.4 597 597 A P H > S+ 0 0 41 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.827 109.8 44.4 -54.6 -38.8 3.1 54.1 67.4 598 598 A V H > S+ 0 0 7 -485,-0.3 4,-2.7 2,-0.2 5,-0.2 0.939 115.1 47.6 -76.0 -42.0 4.5 51.0 69.0 599 599 A T H > S+ 0 0 3 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.934 110.9 52.9 -61.1 -44.4 7.3 52.8 70.9 600 600 A A H X S+ 0 0 14 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.918 111.2 47.1 -58.6 -42.6 4.7 55.4 72.1 601 601 A M H X S+ 0 0 71 -4,-1.6 4,-1.7 -5,-0.2 -2,-0.2 0.947 114.6 44.5 -64.4 -46.1 2.5 52.6 73.4 602 602 A L H X S+ 0 0 2 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.890 113.2 49.1 -68.8 -40.9 5.3 50.7 75.2 603 603 A V H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 -1,-0.2 0.903 110.3 52.7 -66.2 -35.3 6.9 53.7 76.8 604 604 A G H <>S+ 0 0 5 -4,-1.8 5,-2.8 -5,-0.3 4,-0.4 0.876 111.7 45.6 -65.6 -36.3 3.5 54.9 78.0 605 605 A K H ><5S+ 0 0 130 -4,-1.7 3,-0.8 3,-0.2 -2,-0.2 0.936 113.0 50.4 -70.3 -44.7 3.0 51.5 79.6 606 606 A D H 3<5S+ 0 0 36 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.883 115.9 41.6 -59.0 -40.6 6.5 51.6 81.0 607 607 A L T 3<5S- 0 0 14 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.501 109.9-126.8 -83.9 -7.4 5.9 55.1 82.5 608 608 A K T < 5 + 0 0 189 -3,-0.8 2,-0.4 -4,-0.4 -3,-0.2 0.870 49.6 164.0 62.8 39.5 2.4 54.0 83.5 609 609 A V < 0 0 19 -5,-2.8 -1,-0.2 1,-0.2 -2,-0.1 -0.750 360.0 360.0 -92.5 138.1 0.8 56.9 81.8 610 610 A D 0 0 196 -2,-0.4 -1,-0.2 -5,-0.0 -2,-0.1 0.964 360.0 360.0 83.2 360.0 -3.0 56.8 81.1