==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 30-JUN-00 1F8N . COMPND 2 MOLECULE: LIPOXYGENASE-1; . SOURCE 2 ORGANISM_SCIENTIFIC: GLYCINE MAX; . AUTHOR D.R.TOMCHICK,W.MINOR,T.HOLMAN . 818 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33294.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 525 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 98 12.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 43 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 102 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 219 26.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.8 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 4 2 4 2 1 2 1 3 0 2 1 0 0 0 0 1 0 0 0 1 0 1 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 . 5 6 3 1 1 0 3 2 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 . 2 1 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 6 A H 0 0 76 0, 0.0 70,-2.1 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -42.1 75.1 33.6 5.1 2 7 A K E -A 70 0A 168 68,-0.2 2,-0.6 66,-0.0 68,-0.2 -0.939 360.0-152.8-116.6 138.6 72.5 35.7 3.3 3 8 A I E -A 69 0A 27 66,-2.2 66,-2.0 -2,-0.4 2,-0.4 -0.946 14.4-138.4-115.0 116.3 68.8 35.1 3.3 4 9 A K E +A 68 0A 82 -2,-0.6 95,-2.4 95,-0.5 2,-0.3 -0.578 31.1 176.6 -73.7 125.9 66.8 36.3 0.3 5 10 A G E -AB 67 98A 1 62,-2.8 62,-1.6 -2,-0.4 2,-0.4 -0.893 22.7-149.3-130.5 161.2 63.5 37.9 1.3 6 11 A T E -AB 66 97A 21 91,-1.8 91,-1.6 -2,-0.3 2,-0.5 -0.992 9.1-160.5-133.7 125.2 60.6 39.7 -0.3 7 12 A V E -AB 65 96A 2 58,-2.7 58,-2.5 -2,-0.4 2,-0.5 -0.913 2.9-164.1-108.7 128.5 58.5 42.4 1.3 8 13 A V E +AB 64 95A 15 87,-2.3 86,-2.5 -2,-0.5 87,-1.7 -0.951 21.8 156.4-112.7 127.9 55.1 43.3 0.0 9 14 A L E -AB 63 93A 1 54,-2.2 54,-2.1 -2,-0.5 84,-0.2 -0.935 34.6-132.4-144.9 166.4 53.5 46.6 1.1 10 15 A M E - B 0 92A 28 82,-2.7 82,-2.9 -2,-0.3 52,-0.1 -0.982 22.9-131.2-126.9 119.0 50.9 49.2 0.1 11 16 A P E - B 0 91A 47 0, 0.0 2,-2.8 0, 0.0 80,-0.2 -0.358 36.7-100.1 -64.9 149.5 51.6 52.9 0.2 12 17 A K 0 0 107 78,-0.7 78,-0.1 1,-0.0 79,-0.1 -0.150 360.0 360.0 -67.1 48.1 49.0 55.1 1.9 13 18 A N 0 0 145 -2,-2.8 -1,-0.0 48,-0.1 78,-0.0 -0.389 360.0 360.0-165.0 360.0 47.3 56.2 -1.3 14 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 15 31 A N > 0 0 178 0, 0.0 3,-3.9 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 179.8 56.9 56.7 -5.3 16 32 A L G > + 0 0 51 1,-0.3 3,-3.3 2,-0.2 4,-0.3 0.658 360.0 62.6 -16.2 -62.2 58.5 53.3 -4.7 17 33 A N G > S+ 0 0 118 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.720 90.3 69.1 -47.3 -26.2 62.0 54.5 -4.7 18 34 A A G < S+ 0 0 52 -3,-3.9 -1,-0.3 1,-0.3 -2,-0.2 0.694 91.3 61.4 -68.6 -17.2 61.3 56.7 -1.6 19 35 A F G < >S+ 0 0 17 -3,-3.3 5,-0.5 -4,-0.3 29,-0.3 0.574 96.2 77.4 -83.9 -10.2 61.0 53.4 0.4 20 36 A L T X 5S+ 0 0 32 -3,-1.5 3,-1.6 -4,-0.3 29,-0.1 0.138 73.7 45.8 -82.3-159.0 64.6 52.6 -0.4 21 37 A G T 3 5S- 0 0 54 27,-0.2 3,-0.3 1,-0.2 27,-0.1 -0.375 129.3 -29.9 61.1-135.8 67.7 54.1 1.2 22 38 A R T 3 5S+ 0 0 188 1,-0.2 -1,-0.2 25,-0.1 3,-0.1 -0.055 107.8 108.3-106.2 33.9 67.3 54.1 5.0 23 39 A S T < 5S+ 0 0 27 -3,-1.6 63,-3.2 1,-0.2 64,-0.6 0.884 81.7 24.1 -75.9 -42.0 63.5 54.5 5.0 24 40 A V E < -E 85 0B 2 -5,-0.5 24,-1.2 -3,-0.3 2,-0.4 -0.986 65.7-175.5-133.0 126.5 62.5 51.1 6.2 25 41 A S E -EF 84 47B 0 59,-2.0 59,-2.4 -2,-0.4 2,-0.3 -0.942 3.6-166.8-123.8 145.5 64.5 48.5 8.3 26 42 A L E -EF 83 46B 0 20,-2.7 20,-2.5 -2,-0.4 2,-0.4 -0.924 4.3-160.9-125.6 151.2 63.7 45.0 9.4 27 43 A Q E -E 82 0B 34 55,-2.2 55,-2.6 -2,-0.3 18,-0.1 -0.968 17.0-135.8-135.6 118.2 65.4 42.7 11.9 28 44 A L E -E 81 0B 2 -2,-0.4 15,-2.7 16,-0.3 2,-0.4 -0.400 15.7-150.6 -71.9 148.2 64.9 38.9 11.9 29 45 A I E -EG 80 42B 0 51,-3.1 50,-2.5 13,-0.2 51,-1.3 -0.975 13.8-125.6-122.7 134.4 64.3 37.1 15.3 30 46 A S E -E 78 0B 0 11,-2.5 46,-0.1 -2,-0.4 10,-0.1 -0.584 16.2-170.2 -82.8 141.2 65.4 33.6 16.0 31 47 A A E S+ 0 0 10 46,-2.6 108,-0.3 -2,-0.3 -1,-0.1 0.560 89.5 33.7-102.4 -12.1 62.9 31.0 17.2 32 48 A T E S+ 0 0 83 45,-0.5 2,-0.6 43,-0.3 44,-0.1 0.635 109.7 61.5-115.8 -23.2 65.5 28.3 18.0 33 49 A K E - 0 0 101 42,-0.5 8,-2.6 44,-0.2 2,-0.2 -0.937 66.7-173.6-114.2 119.5 68.6 30.2 19.1 34 50 A A E - G 0 40B 32 -2,-0.6 6,-0.3 6,-0.3 -3,-0.1 -0.715 19.2-121.0-112.7 161.1 68.3 32.4 22.3 35 51 A D > - 0 0 68 4,-3.1 3,-1.8 -2,-0.2 -1,-0.1 -0.054 52.7 -76.6 -82.5-170.7 70.5 34.9 24.1 36 52 A A T 3 S+ 0 0 108 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.482 131.9 56.4 -69.1 -0.7 71.7 34.7 27.8 37 53 A H T 3 S- 0 0 165 2,-0.3 -1,-0.3 0, 0.0 3,-0.1 0.203 117.5-106.5-116.0 13.9 68.1 35.8 28.7 38 54 A G S < S+ 0 0 43 -3,-1.8 2,-0.3 1,-0.3 102,-0.2 0.434 81.4 125.8 76.8 -1.4 66.2 33.0 27.0 39 55 A K S S- 0 0 54 1,-0.1 -4,-3.1 100,-0.1 -1,-0.3 -0.707 70.6 -97.8 -93.0 141.5 65.0 35.4 24.3 40 56 A G E -G 34 0B 0 98,-2.5 -6,-0.3 -2,-0.3 -9,-0.1 -0.248 46.1-103.1 -56.7 139.3 65.5 34.7 20.6 41 57 A K E - 0 0 72 -8,-2.6 -11,-2.5 34,-0.2 2,-0.4 -0.309 32.7-138.4 -64.8 145.8 68.6 36.4 19.1 42 58 A V E -G 29 0B 53 -13,-0.2 -13,-0.2 -3,-0.1 -1,-0.1 -0.893 11.4-141.4-111.8 135.4 68.0 39.5 16.9 43 59 A G - 0 0 13 -15,-2.7 2,-0.1 -2,-0.4 28,-0.1 -0.012 35.6 -68.8 -80.1-171.3 69.8 40.2 13.6 44 60 A K - 0 0 135 26,-0.3 2,-0.4 1,-0.1 -16,-0.3 -0.419 55.4 -91.1 -79.9 154.0 71.1 43.5 12.1 45 61 A D - 0 0 72 -18,-0.1 2,-0.5 -2,-0.1 -18,-0.2 -0.512 50.0-167.9 -65.2 120.4 68.9 46.4 10.9 46 62 A T E -F 26 0B 22 -20,-2.5 -20,-2.7 -2,-0.4 2,-0.2 -0.957 4.9-151.7-118.5 130.1 68.4 45.6 7.2 47 63 A F E -F 25 0B 34 -2,-0.5 21,-0.3 -22,-0.2 -22,-0.2 -0.630 30.6 -91.2-100.8 157.1 66.9 48.1 4.8 48 64 A L - 0 0 5 -24,-1.2 -27,-0.2 -29,-0.3 19,-0.2 -0.380 36.9-169.8 -60.9 139.5 64.9 47.6 1.6 49 65 A E - 0 0 111 17,-2.4 2,-0.3 1,-0.3 18,-0.2 0.654 52.8 -18.4-110.0 -18.6 67.4 47.4 -1.4 50 66 A G E -C 66 0A 16 16,-1.0 16,-2.7 -31,-0.1 2,-0.7 -0.976 66.0 -83.1-178.7 165.0 65.1 47.5 -4.5 51 67 A I E -C 65 0A 53 -2,-0.3 2,-0.5 14,-0.2 14,-0.3 -0.716 39.7-148.1 -85.1 115.3 61.8 47.2 -6.2 52 68 A N E +C 64 0A 22 12,-1.9 12,-0.6 -2,-0.7 -2,-0.0 -0.704 23.5 169.7 -85.2 128.6 61.1 43.6 -7.1 53 69 A T + 0 0 129 -2,-0.5 -1,-0.1 10,-0.1 -2,-0.0 -0.454 40.2 104.8-136.9 62.7 59.0 43.2 -10.3 54 70 A S + 0 0 101 1,-0.2 -1,-0.1 2,-0.0 -2,-0.0 0.851 61.7 57.7-107.5 -58.4 59.1 39.5 -11.1 55 71 A L - 0 0 122 1,-0.1 -1,-0.2 2,-0.1 -3,-0.0 -0.660 59.8-150.5 -88.1 132.6 55.9 37.6 -10.3 56 72 A P S S+ 0 0 115 0, 0.0 2,-2.4 0, 0.0 -1,-0.1 0.876 79.8 91.0 -62.1 -41.3 52.5 38.6 -11.8 57 73 A T + 0 0 121 1,-0.1 2,-0.2 2,-0.0 -2,-0.1 -0.343 64.2 99.1 -60.4 79.8 50.6 37.4 -8.8 58 74 A L + 0 0 62 -2,-2.4 3,-0.1 4,-0.0 2,-0.1 -0.592 41.9 132.5-169.3 98.0 50.8 40.8 -7.1 59 75 A G > + 0 0 43 -2,-0.2 3,-2.1 1,-0.1 -2,-0.0 -0.120 27.2 90.5-124.0-139.3 47.8 43.2 -7.3 60 76 A A T 3 S- 0 0 39 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 0.856 119.2 -64.3 43.1 50.7 45.8 45.4 -4.9 61 77 A G T 3 S+ 0 0 62 1,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.827 99.1 152.1 45.6 34.6 48.1 48.4 -5.4 62 78 A E < - 0 0 46 -3,-2.1 2,-0.4 -52,-0.1 -52,-0.2 -0.575 32.1-157.6 -93.7 158.0 50.8 46.3 -3.8 63 79 A S E -A 9 0A 22 -54,-2.1 -54,-2.2 -2,-0.2 2,-0.4 -1.000 7.4-142.5-138.7 136.5 54.5 46.6 -4.3 64 80 A A E -AC 8 52A 9 -12,-0.6 -12,-1.9 -2,-0.4 2,-0.4 -0.787 14.7-165.7-100.7 141.1 57.3 44.0 -3.7 65 81 A F E -AC 7 51A 0 -58,-2.5 -58,-2.7 -2,-0.4 -14,-0.2 -0.984 15.2-130.9-129.0 137.1 60.7 44.9 -2.4 66 82 A N E +AC 6 50A 38 -16,-2.7 -17,-2.4 -2,-0.4 -16,-1.0 -0.581 31.1 166.6 -84.7 147.8 63.9 42.8 -2.4 67 83 A I E -A 5 0A 0 -62,-1.6 -62,-2.8 -2,-0.2 2,-0.4 -0.953 20.7-153.7-161.2 139.4 66.0 42.5 0.8 68 84 A H E -A 4 0A 67 -21,-0.3 2,-0.4 -2,-0.3 -64,-0.2 -0.974 11.0-153.3-122.2 130.5 68.8 40.3 2.0 69 85 A F E -A 3 0A 5 -66,-2.0 -66,-2.2 -2,-0.4 2,-1.2 -0.831 19.0-127.5-106.1 139.3 69.6 39.4 5.7 70 86 A E E +A 2 0A 131 -2,-0.4 2,-0.4 -68,-0.2 -26,-0.3 -0.700 50.0 153.5 -80.9 99.8 72.9 38.5 7.2 71 87 A W - 0 0 11 -70,-2.1 2,-0.2 -2,-1.2 -2,-0.1 -0.892 27.8-160.3-139.2 106.9 71.9 35.2 8.9 72 88 A D > - 0 0 96 -2,-0.4 3,-2.9 1,-0.1 4,-0.3 -0.503 35.6-110.7 -82.1 153.0 74.4 32.4 9.6 73 89 A G G > S+ 0 0 67 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.768 117.0 69.5 -53.0 -23.9 73.2 28.9 10.3 74 90 A S G 3 S+ 0 0 72 1,-0.3 -1,-0.3 -41,-0.0 3,-0.1 0.693 86.6 65.6 -68.4 -18.7 74.4 29.5 13.8 75 91 A M G < S- 0 0 37 -3,-2.9 -42,-0.5 1,-0.3 -43,-0.3 0.507 101.8-139.5 -81.4 -5.0 71.5 32.0 14.3 76 92 A G < - 0 0 20 -3,-1.4 -1,-0.3 -4,-0.3 -46,-0.0 -0.505 41.8 -31.1 85.8-152.2 69.0 29.2 14.0 77 93 A I - 0 0 103 -2,-0.2 -46,-2.6 -3,-0.1 -45,-0.5 -0.937 63.9-120.9-111.0 124.5 65.7 29.4 12.1 78 94 A P E +E 30 0B 8 0, 0.0 -48,-0.3 0, 0.0 3,-0.1 -0.388 35.3 167.5 -64.9 137.0 63.9 32.8 12.0 79 95 A G E + 0 0 6 -50,-2.5 47,-2.5 1,-0.3 2,-0.3 0.368 63.2 7.6-129.1 -0.1 60.4 32.8 13.5 80 96 A A E -EH 29 125B 0 -51,-1.3 -51,-3.1 45,-0.3 2,-0.3 -0.964 60.6-147.9-167.7 172.9 59.6 36.5 13.8 81 97 A F E -EH 28 124B 0 43,-2.2 43,-2.4 -2,-0.3 2,-0.3 -0.994 10.6-134.9-158.4 151.4 60.9 40.0 12.9 82 98 A Y E -EH 27 123B 52 -55,-2.6 -55,-2.2 -2,-0.3 2,-0.3 -0.730 23.2-167.5 -99.7 152.5 61.0 43.7 14.0 83 99 A I E -EH 26 122B 4 39,-1.7 39,-0.7 -2,-0.3 2,-0.4 -0.992 7.8-168.2-147.0 136.7 60.3 46.5 11.6 84 100 A K E -E 25 0B 37 -59,-2.4 -59,-2.0 -2,-0.3 2,-0.7 -0.992 10.5-152.2-127.8 130.7 60.8 50.3 11.8 85 101 A N E +Ei 24 114B 0 28,-0.6 30,-2.7 -2,-0.4 31,-0.2 -0.894 13.3 178.2-102.1 112.0 59.3 52.9 9.5 86 102 A Y + 0 0 91 -63,-3.2 -62,-0.2 -2,-0.7 -1,-0.1 0.515 53.1 99.2 -91.1 -6.0 61.6 56.0 9.3 87 103 A M S S- 0 0 37 -64,-0.6 28,-0.2 2,-0.2 -2,-0.1 -0.334 79.9-123.7 -75.5 161.8 59.4 57.8 6.8 88 104 A Q S S+ 0 0 149 26,-0.1 26,-0.4 -2,-0.1 2,-0.3 0.903 91.8 62.9 -74.5 -39.8 56.8 60.4 7.9 89 105 A V S S- 0 0 86 24,-0.1 -2,-0.2 1,-0.1 -77,-0.0 -0.673 85.2-119.8 -93.1 139.2 53.8 58.7 6.4 90 106 A E - 0 0 17 -2,-0.3 -78,-0.7 -78,-0.1 2,-0.3 -0.290 26.0-160.6 -71.5 156.1 52.5 55.3 7.4 91 107 A F E -BD 11 112A 2 21,-1.4 21,-2.7 -80,-0.2 2,-0.7 -0.922 22.4-110.7-135.0 161.7 52.3 52.3 5.0 92 108 A F E -BD 10 111A 34 -82,-2.9 -82,-2.7 -2,-0.3 2,-0.5 -0.850 27.3-148.9 -99.4 113.1 50.4 49.0 5.0 93 109 A L E +BD 9 110A 1 17,-2.6 17,-2.0 -2,-0.7 -84,-0.2 -0.680 19.6 175.0 -82.5 121.5 52.6 46.0 5.5 94 110 A K E - 0 0 43 -86,-2.5 14,-2.1 -2,-0.5 15,-1.2 0.924 52.3 -38.2 -89.9 -56.0 51.2 42.9 3.7 95 111 A S E -BD 8 107A 24 -87,-1.7 -87,-2.3 12,-0.2 2,-0.4 -0.991 33.6-136.1-165.2 170.4 53.9 40.2 4.1 96 112 A L E -BD 7 106A 1 10,-1.6 10,-2.2 -2,-0.3 2,-0.4 -0.993 19.9-169.0-135.6 135.1 57.5 39.0 4.3 97 113 A T E -BD 6 105A 29 -91,-1.6 -91,-1.8 -2,-0.4 2,-0.6 -0.992 6.7-159.6-131.6 123.5 58.7 35.8 2.6 98 114 A L E -BD 5 104A 4 6,-2.7 6,-2.4 -2,-0.4 2,-0.5 -0.919 16.2-145.5-104.7 120.1 62.1 34.2 3.2 99 115 A E 0 0 76 -95,-2.4 -95,-0.5 -2,-0.6 4,-0.1 -0.766 360.0 360.0 -94.8 123.2 63.1 31.8 0.4 100 116 A A 0 0 122 -2,-0.5 -1,-0.2 -97,-0.1 3,-0.1 0.986 360.0 360.0 70.1 360.0 65.2 28.7 1.2 101 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 102 121 A G 0 0 101 0, 0.0 -4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-117.7 62.0 25.6 3.1 103 122 A T - 0 0 72 -3,-0.1 2,-0.5 1,-0.1 -4,-0.2 -0.052 360.0-151.6 -49.0 139.8 60.1 28.8 2.6 104 123 A I E -D 98 0A 22 -6,-2.4 -6,-2.7 2,-0.0 2,-0.4 -0.979 14.4-160.3-118.5 121.7 59.2 30.8 5.7 105 124 A R E -D 97 0A 84 -2,-0.5 22,-2.6 -8,-0.2 2,-0.4 -0.839 11.9-168.4-110.5 142.5 56.0 33.0 5.4 106 125 A F E -D 96 0A 2 -10,-2.2 -10,-1.6 -2,-0.4 2,-0.7 -0.987 5.8-162.1-127.3 118.9 54.8 35.9 7.5 107 126 A V E +D 95 0A 44 -2,-0.4 -12,-0.2 18,-0.4 18,-0.2 -0.904 25.1 156.7-101.8 110.9 51.3 37.2 7.0 108 127 A C E + 0 0 15 -14,-2.1 -14,-0.2 -2,-0.7 -13,-0.2 0.897 14.4 174.3-100.9 -56.4 51.2 40.7 8.5 109 128 A N E + 0 0 37 -15,-1.2 2,-0.3 -16,-0.2 -15,-0.2 0.902 41.6 128.5 41.2 63.0 48.4 42.9 7.1 110 129 A S E -D 93 0A 2 -17,-2.0 -17,-2.6 2,-0.0 2,-0.3 -0.999 62.2-114.1-148.6 142.8 49.1 45.8 9.4 111 130 A W E -D 92 0A 33 -2,-0.3 2,-0.6 -19,-0.2 -19,-0.2 -0.544 25.5-158.3 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180.0-106.2 139.3 15.7 63.6 -9.5 306 325 A L E -MN 278 300F 4 -28,-1.9 -28,-2.6 -2,-0.4 2,-0.5 -1.000 12.6-171.6-126.0 126.6 16.6 60.8 -7.0 307 326 A K E - N 0 299F 78 -8,-2.3 -8,-2.5 -2,-0.4 -33,-0.2 -0.984 10.6-148.1-123.7 124.4 15.4 57.3 -7.8 308 327 A F - 0 0 4 -35,-2.7 -10,-0.1 -2,-0.5 2,-0.1 -0.480 31.3 -97.2 -82.7 159.2 15.7 54.3 -5.4 309 328 A P - 0 0 47 0, 0.0 -1,-0.1 0, 0.0 -34,-0.1 -0.442 44.6 -97.2 -76.3 152.0 16.3 50.7 -6.6 310 329 A Q - 0 0 95 -36,-0.2 5,-0.1 -2,-0.1 374,-0.1 -0.539 42.8-122.6 -69.8 119.1 13.2 48.5 -6.9 311 330 A P > - 0 0 0 0, 0.0 3,-1.9 0, 0.0 4,-0.5 -0.350 14.3-122.8 -63.0 143.3 13.0 46.3 -3.7 312 331 A H G > S+ 0 0 36 1,-0.3 3,-1.4 2,-0.2 4,-0.4 0.836 106.9 68.1 -52.5 -37.3 13.0 42.5 -4.3 313 332 A V G 3 S+ 0 0 1 367,-2.2 4,-0.3 1,-0.3 -1,-0.3 0.694 108.2 36.1 -62.3 -19.0 9.6 42.2 -2.5 314 333 A V G < S+ 0 0 5 -3,-1.9 -1,-0.3 366,-0.2 -2,-0.2 0.342 85.2 102.9-113.4 6.6 7.8 44.0 -5.3 315 334 A Q S < S+ 0 0 95 -3,-1.4 -2,-0.1 -4,-0.5 3,-0.1 0.754 98.9 19.7 -63.4 -25.7 9.7 42.7 -8.3 316 335 A V S S+ 0 0 101 478,-0.4 2,-0.4 -4,-0.4 -1,-0.2 0.759 140.3 13.9-108.2 -43.1 7.0 40.2 -9.3 317 336 A S - 0 0 32 477,-0.3 -1,-0.3 -4,-0.3 4,-0.3 -0.976 54.6-163.5-137.9 120.6 3.9 41.6 -7.5 318 337 A Q S S+ 0 0 84 -2,-0.4 3,-0.1 1,-0.2 -1,-0.1 0.599 93.7 44.8 -79.5 -9.1 3.7 45.1 -6.0 319 338 A S S > S+ 0 0 70 1,-0.1 3,-1.8 2,-0.1 4,-0.2 0.542 83.2 91.8-108.3 -11.4 0.6 44.1 -4.0 320 339 A A G > S+ 0 0 3 1,-0.3 3,-1.8 -3,-0.2 6,-0.4 0.738 72.4 72.3 -59.8 -25.3 1.5 40.7 -2.6 321 340 A W G 3 S+ 0 0 14 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.796 91.3 61.6 -58.1 -27.3 3.0 42.2 0.6 322 341 A M G < S+ 0 0 58 -3,-1.8 -1,-0.3 4,-0.1 -2,-0.2 0.541 81.9 104.5 -77.4 -10.7 -0.6 42.9 1.7 323 342 A T S <> S- 0 0 43 -3,-1.8 4,-2.1 -4,-0.2 5,-0.1 -0.431 74.6-131.8 -75.2 148.6 -1.7 39.3 1.7 324 343 A D H > S+ 0 0 30 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.851 108.6 60.6 -63.5 -34.1 -2.2 37.4 5.0 325 344 A E H > S+ 0 0 91 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.918 107.3 42.4 -60.5 -45.1 -0.1 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5,-2.1 -5,-0.2 -2,-0.2 0.933 125.8 31.6 -66.8 -44.6 16.5 46.3 14.6 477 496 A L H <>S+ 0 0 2 -4,-2.6 5,-1.8 -5,-0.2 -3,-0.2 0.854 135.3 16.9 -83.9 -33.4 17.4 46.7 18.2 478 497 A M I <>S+ 0 0 3 -4,-2.2 5,-2.8 -5,-0.4 -3,-0.2 0.882 125.6 40.0-108.1 -61.8 17.4 43.1 19.4 479 498 A S I XS+ 0 0 4 -5,-2.6 4,-1.4 -6,-0.3 5,-1.0 0.917 132.1 29.7 -94.2 -69.9 20.2 42.6 14.8 481 500 A W I 4XS+ 0 0 8 -5,-2.1 5,-3.0 -6,-0.3 6,-0.4 0.963 127.7 33.3 -61.9 -57.3 21.9 45.2 17.0 482 501 A L I 4XS+ 0 0 0 -5,-1.8 5,-1.7 1,-0.2 -4,-0.2 0.969 122.2 43.6 -65.3 -52.1 21.9 43.4 20.4 483 502 A N T 4X S+ 0 0 1 -4,-2.1 4,-1.5 1,-0.2 3,-1.0 0.829 90.9 74.8 -80.9 -32.3 30.0 39.9 19.6 489 508 A E H 3X S+ 0 0 2 -4,-1.2 4,-2.3 1,-0.3 3,-0.3 0.862 90.4 57.2 -52.2 -43.2 32.3 42.9 20.5 490 509 A P H 3> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.3 0.876 107.3 49.5 -57.0 -37.4 33.3 41.6 23.9 491 510 A F H <> S+ 0 0 0 -3,-1.0 4,-2.0 -4,-0.4 -2,-0.2 0.843 108.4 53.0 -70.3 -33.3 34.6 38.4 22.4 492 511 A V H X S+ 0 0 0 -4,-1.5 4,-1.9 -3,-0.3 5,-0.2 0.958 112.2 45.1 -64.1 -49.8 36.6 40.4 19.8 493 512 A I H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.948 113.5 48.8 -59.2 -50.6 38.3 42.5 22.6 494 513 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 5,-0.3 0.874 108.5 55.4 -58.0 -40.3 39.0 39.4 24.8 495 514 A T H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.933 111.3 41.2 -60.9 -48.3 40.5 37.5 21.9 496 515 A H H < S+ 0 0 18 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.833 116.3 52.0 -70.9 -30.1 43.1 40.2 21.0 497 516 A R H < S+ 0 0 27 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.796 127.5 15.0 -74.7 -30.1 43.8 40.8 24.7 498 517 A H H < S+ 0 0 24 -4,-2.0 2,-0.6 -5,-0.2 131,-0.2 0.582 108.7 71.2-126.3 -12.9 44.5 37.2 25.6 499 518 A L S < S- 0 0 1 -4,-2.3 -1,-0.1 -5,-0.3 127,-0.0 -0.944 75.3-132.5-110.6 120.2 45.1 34.9 22.6 500 519 A S > - 0 0 4 -2,-0.6 3,-1.7 1,-0.1 6,-0.3 -0.255 24.6-111.3 -64.2 155.3 48.4 35.4 20.8 501 520 A V T 3 S+ 0 0 59 1,-0.3 -1,-0.1 -358,-0.1 6,-0.0 0.700 121.3 59.8 -58.9 -18.0 48.3 35.7 17.0 502 521 A L T 3 S+ 0 0 4 -373,-0.1 -372,-2.2 4,-0.1 -1,-0.3 0.676 81.7 108.5 -82.3 -20.0 50.1 32.3 17.2 503 522 A H <> - 0 0 0 -3,-1.7 4,-2.1 -374,-0.2 5,-0.2 -0.320 69.7-137.0 -65.0 135.0 47.2 30.6 19.0 504 523 A P H > S+ 0 0 0 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.852 106.0 50.2 -60.8 -33.8 45.1 28.1 17.1 505 524 A I H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.828 106.2 55.8 -75.7 -29.3 41.9 29.5 18.5 506 525 A Y H > S+ 0 0 39 -6,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.945 110.4 45.8 -64.0 -46.0 42.9 33.0 17.5 507 526 A K H < S+ 0 0 17 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.822 112.9 50.8 -65.3 -32.1 43.3 31.8 13.9 508 527 A L H < S+ 0 0 0 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.913 121.6 30.1 -71.7 -42.9 40.0 29.9 14.1 509 528 A L H >< S+ 0 0 0 -4,-2.5 3,-1.6 1,-0.1 -2,-0.2 0.830 99.0 74.8 -90.3 -35.3 38.0 32.9 15.3 510 529 A T G >< S+ 0 0 33 -4,-2.6 3,-2.1 1,-0.3 4,-0.4 0.768 87.0 62.9 -56.4 -31.9 39.5 36.2 14.1 511 530 A P G > S+ 0 0 27 0, 0.0 3,-1.0 0, 0.0 -1,-0.3 0.848 99.0 60.3 -60.6 -28.8 38.3 35.9 10.5 512 531 A H G < S+ 0 0 4 -3,-1.6 306,-0.5 1,-0.2 -2,-0.2 0.346 99.1 56.5 -79.4 6.4 34.8 36.1 12.0 513 532 A Y G X S+ 0 0 2 -3,-2.1 3,-2.1 304,-0.2 4,-0.5 0.430 71.0 143.3-113.3 -3.4 35.5 39.5 13.6 514 533 A R T < S- 0 0 61 -3,-1.0 303,-0.1 -4,-0.4 -289,-0.1 -0.134 80.9 -10.7 -46.9 120.3 36.4 41.4 10.4 515 534 A N T 3> S+ 0 0 7 -290,-0.1 4,-2.6 1,-0.1 -1,-0.3 0.341 99.9 119.1 70.2 0.2 35.1 45.1 10.5 516 535 A N H <> S+ 0 0 0 -3,-2.1 4,-2.1 1,-0.2 5,-0.2 0.937 75.8 41.5 -63.5 -52.7 33.0 44.5 13.6 517 536 A M H > S+ 0 0 4 -4,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.885 115.6 53.9 -62.7 -35.4 34.6 47.0 16.0 518 537 A N H > S+ 0 0 9 -293,-0.4 4,-2.2 2,-0.2 5,-0.2 0.958 110.8 42.5 -63.1 -54.1 34.8 49.5 13.1 519 538 A I H X S+ 0 0 9 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.868 114.3 54.1 -63.4 -33.9 31.1 49.4 12.2 520 539 A N H X S+ 0 0 0 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.902 108.1 47.6 -67.1 -42.5 30.1 49.4 15.9 521 540 A A H X S+ 0 0 2 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.911 112.3 49.1 -65.3 -41.9 32.2 52.5 16.7 522 541 A L H X S+ 0 0 27 -4,-2.2 4,-2.1 1,-0.2 5,-0.4 0.841 110.7 53.4 -65.8 -30.5 30.6 54.3 13.6 523 542 A A H X>S+ 0 0 6 -4,-1.7 5,-2.6 -5,-0.2 4,-1.9 0.907 104.5 52.2 -69.9 -43.1 27.2 53.1 15.0 524 543 A R H <5S+ 0 0 3 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.846 115.0 45.6 -60.7 -31.0 27.8 54.6 18.4 525 544 A Q H <5S+ 0 0 19 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.871 135.9 1.5 -80.3 -38.1 28.6 57.9 16.7 526 545 A S H <5S+ 0 0 3 -4,-2.1 7,-2.1 -5,-0.1 -3,-0.2 0.592 127.3 46.0-129.2 -15.8 25.8 58.1 14.1 527 546 A L T <5S+ 0 0 19 -4,-1.9 7,-2.2 -5,-0.4 8,-0.5 0.874 123.4 19.1 -98.3 -51.0 23.3 55.2 14.3 528 547 A I S S- 0 0 30 -6,-0.4 3,-2.4 1,-0.1 6,-0.4 -0.301 85.4 -71.8 -80.1 167.1 23.5 58.1 19.4 530 549 A A T 3 S+ 0 0 9 -357,-2.8 -1,-0.1 1,-0.3 -348,-0.1 -0.452 125.4 4.2 -61.9 123.9 21.1 60.7 20.9 531 550 A N T 3 S+ 0 0 98 -2,-0.2 -1,-0.3 1,-0.1 -3,-0.1 0.658 105.6 137.8 69.5 18.8 19.3 62.2 17.8 532 551 A G S <> S- 0 0 0 -3,-2.4 4,-1.9 -8,-0.1 -5,-0.2 -0.032 71.9 -75.8 -79.9-171.0 21.0 59.7 15.6 533 552 A I H > S+ 0 0 0 -7,-2.1 4,-0.9 1,-0.2 5,-0.2 0.919 127.5 43.0 -57.1 -52.8 19.5 57.7 12.7 534 553 A I H >> S+ 0 0 5 -7,-2.2 4,-2.7 1,-0.2 3,-0.9 0.935 113.5 50.7 -64.4 -44.7 17.6 55.1 14.8 535 554 A E H 34 S+ 0 0 12 -8,-0.5 -1,-0.2 -6,-0.4 -2,-0.2 0.856 114.4 45.6 -61.4 -33.5 16.2 57.5 17.3 536 555 A T H 3< S+ 0 0 49 -4,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.571 123.3 31.9 -89.5 -4.4 14.9 59.8 14.5 537 556 A T H << S+ 0 0 4 -3,-0.9 2,-0.3 -4,-0.9 -2,-0.2 0.626 104.6 71.9-123.5 -19.8 13.3 57.1 12.4 538 557 A F S >< S- 0 0 21 -4,-2.7 3,-1.6 -5,-0.2 153,-0.2 -0.724 83.8-108.8-104.3 152.4 12.1 54.3 14.7 539 558 A L T 3 S+ 0 0 5 151,-2.3 152,-0.1 -2,-0.3 4,-0.1 0.809 107.6 56.0 -40.3 -53.8 9.1 54.3 17.1 540 559 A P T > S- 0 0 0 0, 0.0 3,-2.6 0, 0.0 -1,-0.2 0.596 76.2-178.2 -66.4 -11.0 10.8 54.4 20.6 541 560 A S G X S+ 0 0 43 -3,-1.6 3,-2.1 -7,-0.3 4,-0.3 -0.212 72.7 6.4 51.5-128.7 12.8 57.6 19.9 542 561 A K G 3 S+ 0 0 89 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.562 131.2 59.7 -62.5 -8.8 15.0 58.4 22.9 543 562 A Y G <> S+ 0 0 47 -3,-2.6 4,-1.8 1,-0.1 -1,-0.3 0.472 78.1 98.0 -97.7 -0.4 14.0 55.1 24.6 544 563 A S H <> S+ 0 0 0 -3,-2.1 4,-1.0 1,-0.2 3,-0.2 0.927 84.2 38.0 -55.2 -59.4 15.3 52.8 21.8 545 564 A V H >> S+ 0 0 10 -4,-0.3 4,-1.1 1,-0.2 3,-0.6 0.905 112.9 55.7 -66.4 -38.3 18.7 51.8 23.1 546 565 A E H >> S+ 0 0 32 -4,-0.3 4,-1.9 1,-0.2 3,-0.5 0.868 99.9 62.1 -63.0 -30.8 17.6 51.4 26.7 547 566 A M H 3X S+ 0 0 7 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.893 100.3 54.1 -58.4 -36.8 14.9 49.0 25.5 548 567 A S H < S+ 0 0 35 -4,-1.9 3,-0.6 1,-0.2 4,-0.3 0.912 110.9 47.4 -60.3 -42.8 16.0 45.5 29.2 551 570 A V H >< S+ 0 0 30 -4,-1.9 3,-2.0 1,-0.2 -1,-0.2 0.868 102.1 64.7 -65.9 -35.7 16.0 42.6 26.7 552 571 A Y H >< S+ 0 0 0 -4,-1.8 3,-2.2 1,-0.3 -1,-0.2 0.790 83.3 76.8 -58.6 -28.7 19.7 41.9 27.5 553 572 A K T << S+ 0 0 100 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.770 104.1 37.8 -51.7 -27.8 18.6 40.9 31.1 554 573 A N T < S+ 0 0 133 -3,-2.0 2,-0.3 -4,-0.3 -1,-0.3 0.204 84.6 126.1-112.7 17.5 17.4 37.7 29.5 555 574 A W < - 0 0 10 -3,-2.2 2,-0.5 -4,-0.1 -3,-0.0 -0.591 39.7-166.1 -75.5 133.4 20.1 37.1 26.9 556 575 A V > - 0 0 19 -2,-0.3 3,-1.1 1,-0.1 4,-0.4 -0.968 16.7-151.1-128.4 117.6 21.6 33.5 27.2 557 576 A F G > S+ 0 0 0 -2,-0.5 3,-1.6 1,-0.3 4,-0.2 0.902 97.4 48.5 -51.7 -49.6 24.8 32.6 25.5 558 577 A T G > S+ 0 0 32 1,-0.3 3,-0.8 2,-0.2 -1,-0.3 0.694 102.2 63.5 -70.0 -16.2 24.0 28.9 25.1 559 578 A D G < S+ 0 0 41 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.474 85.7 74.9 -84.8 -0.8 20.5 29.7 23.7 560 579 A Q G < S+ 0 0 28 -3,-1.6 -1,-0.2 -4,-0.4 -2,-0.2 0.632 70.8 103.5 -81.8 -15.4 22.2 31.4 20.7 561 580 A A S <> S- 0 0 11 -3,-0.8 4,-2.5 -4,-0.2 5,-0.2 -0.486 82.7-125.1 -63.8 135.9 23.0 27.9 19.4 562 581 A L H > S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.921 105.5 47.0 -55.3 -50.5 20.5 27.1 16.6 563 582 A P H > S+ 0 0 27 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.935 114.7 47.8 -57.5 -45.5 19.2 23.8 17.9 564 583 A A H > S+ 0 0 31 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.884 110.9 51.8 -61.5 -39.0 18.8 25.2 21.4 565 584 A D H X S+ 0 0 32 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.933 110.5 47.7 -63.4 -46.2 17.0 28.3 20.0 566 585 A L H <>S+ 0 0 0 -4,-2.5 5,-2.2 -5,-0.2 6,-0.8 0.906 115.2 45.2 -62.6 -43.3 14.5 26.2 18.0 567 586 A I H ><5S+ 0 0 71 -4,-2.4 3,-1.4 -5,-0.2 -2,-0.2 0.934 111.7 52.0 -67.0 -43.8 13.8 24.0 21.0 568 587 A K H 3<5S+ 0 0 94 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.875 110.4 48.8 -60.7 -38.4 13.5 27.0 23.4 569 588 A R T 3<5S- 0 0 11 -4,-2.2 -227,-2.6 -5,-0.2 -1,-0.3 0.468 112.6-119.3 -81.9 0.3 11.0 28.7 21.1 570 589 A G T < 5S+ 0 0 14 -3,-1.4 -3,-0.2 -4,-0.3 -2,-0.1 0.790 83.8 113.6 70.1 26.4 8.9 25.5 20.7 571 590 A V S - 0 0 37 6,-2.3 3,-2.1 -2,-0.1 6,-0.3 -0.689 22.4-167.7-154.3 94.3 14.9 13.8 18.4 576 595 A P T 3 S+ 0 0 110 0, 0.0 6,-0.1 0, 0.0 5,-0.1 0.682 85.3 69.2 -56.0 -21.6 18.1 11.7 18.5 577 596 A S T 3 S+ 0 0 103 4,-0.1 5,-0.0 3,-0.0 3,-0.0 0.547 87.9 82.9 -77.9 -5.1 16.9 9.7 15.5 578 597 A T S X S- 0 0 38 -3,-2.1 3,-0.8 1,-0.1 -3,-0.1 -0.685 86.6-118.3-100.9 154.9 17.4 12.7 13.2 579 598 A P T 3 S+ 0 0 130 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.885 115.8 36.7 -54.0 -44.9 20.6 13.9 11.4 580 599 A H T 3 S- 0 0 59 2,-0.3 3,-0.1 -5,-0.0 -3,-0.0 0.494 110.8-116.9 -90.4 -3.8 20.5 17.3 13.2 581 600 A G S < S+ 0 0 22 -3,-0.8 -6,-2.3 -6,-0.3 2,-0.3 0.522 86.9 81.2 82.4 2.3 19.2 15.9 16.5 582 601 A V E -S 574 0H 12 -8,-0.3 2,-0.5 -6,-0.1 -2,-0.3 -0.988 66.6-141.7-141.5 149.6 15.9 17.9 16.3 583 602 A R E -S 573 0H 141 -10,-2.9 -10,-2.3 -2,-0.3 2,-0.2 -0.962 25.4-131.3-112.1 122.4 12.6 17.5 14.5 584 603 A L E -S 572 0H 30 -2,-0.5 -12,-0.3 -12,-0.2 3,-0.1 -0.505 4.9-152.9 -74.5 139.0 11.1 20.7 13.2 585 604 A L S S+ 0 0 22 -14,-2.9 2,-0.5 1,-0.2 -13,-0.2 0.597 95.8 48.5 -86.2 -12.7 7.4 21.4 14.0 586 605 A I S > S- 0 0 0 -15,-0.6 3,-0.6 1,-0.1 -1,-0.2 -0.955 81.3-161.0-122.0 101.5 7.1 23.5 10.8 587 606 A E T 3 S+ 0 0 178 -2,-0.5 2,-0.8 1,-0.3 -1,-0.1 0.895 85.3 43.1 -52.8 -48.2 8.7 21.1 8.2 588 607 A D T 3 S+ 0 0 26 -166,-0.3 -1,-0.3 -3,-0.1 3,-0.1 -0.619 70.9 144.5-102.2 67.9 9.3 23.8 5.5 589 608 A Y <> - 0 0 0 -2,-0.8 4,-3.2 -3,-0.6 5,-0.3 -0.904 36.1-159.8-104.6 96.1 10.6 26.7 7.9 590 609 A P H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 5,-0.5 0.883 83.1 46.9 -50.3 -53.2 13.2 28.1 5.4 591 610 A Y H > S+ 0 0 3 -259,-1.9 4,-2.4 1,-0.2 5,-0.1 0.946 119.0 41.1 -55.5 -49.8 15.4 29.9 7.9 592 611 A A H > S+ 0 0 0 -260,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.905 115.9 47.8 -67.8 -43.7 15.6 27.0 10.3 593 612 A A H X S+ 0 0 17 -4,-3.2 4,-1.0 2,-0.2 -1,-0.2 0.910 119.1 38.8 -66.6 -42.3 15.9 24.2 7.6 594 613 A D H X S+ 0 0 0 -4,-2.5 4,-1.7 -5,-0.3 3,-0.4 0.903 114.4 57.1 -73.0 -38.6 18.7 26.0 5.7 595 614 A G H X S+ 0 0 0 -4,-2.4 4,-3.0 -5,-0.5 -2,-0.2 0.874 100.5 55.6 -58.2 -41.1 20.2 27.2 9.0 596 615 A L H X S+ 0 0 7 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.853 105.2 53.8 -63.4 -33.2 20.6 23.6 10.3 597 616 A E H X S+ 0 0 24 -4,-1.0 4,-1.7 -3,-0.4 -1,-0.2 0.925 112.6 42.4 -65.6 -44.5 22.6 22.7 7.2 598 617 A I H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 5,-0.2 0.920 113.2 53.3 -67.1 -43.4 25.0 25.7 7.7 599 618 A W H X S+ 0 0 19 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.926 109.1 49.0 -55.2 -48.4 25.2 25.0 11.5 600 619 A A H X S+ 0 0 29 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.875 109.9 51.8 -61.5 -39.4 26.1 21.3 10.8 601 620 A A H X S+ 0 0 2 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.918 111.5 45.7 -64.9 -43.5 28.9 22.4 8.4 602 621 A I H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.921 111.2 54.1 -65.0 -42.0 30.4 24.8 10.9 603 622 A K H X S+ 0 0 86 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.921 107.4 49.4 -58.8 -45.6 30.2 22.1 13.6 604 623 A T H X S+ 0 0 82 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.891 111.5 50.5 -60.4 -40.1 32.1 19.5 11.5 605 624 A W H >X S+ 0 0 5 -4,-1.7 4,-2.1 2,-0.2 3,-0.6 0.954 113.0 43.9 -64.7 -50.2 34.8 22.1 10.8 606 625 A V H 3X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.908 112.4 53.6 -62.2 -41.4 35.3 23.0 14.4 607 626 A Q H 3< S+ 0 0 95 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.726 113.3 43.5 -65.6 -23.3 35.2 19.4 15.5 608 627 A E H << S+ 0 0 59 -4,-1.2 4,-0.4 -3,-0.6 -1,-0.2 0.770 115.1 48.3 -91.7 -29.1 37.9 18.6 13.0 609 628 A Y H >< S+ 0 0 1 -4,-2.1 3,-1.4 -5,-0.2 4,-0.4 0.947 105.1 55.6 -75.4 -51.1 40.1 21.6 13.8 610 629 A V G >X S+ 0 0 2 -4,-2.5 3,-2.3 1,-0.3 4,-1.7 0.888 100.5 56.9 -51.0 -49.4 40.1 21.4 17.6 611 630 A P G 34 S+ 0 0 79 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.723 95.0 69.8 -57.2 -21.9 41.5 17.8 17.9 612 631 A L G <4 S+ 0 0 64 -3,-1.4 -2,-0.2 -4,-0.4 3,-0.1 0.695 115.9 21.8 -69.4 -18.4 44.5 19.0 15.8 613 632 A Y T <4 S+ 0 0 38 -3,-2.3 2,-0.4 -4,-0.4 -1,-0.2 0.516 123.2 51.7-125.9 -13.1 45.7 21.1 18.8 614 633 A Y < + 0 0 4 -4,-1.7 -1,-0.2 1,-0.1 3,-0.1 -0.942 51.0 178.6-133.3 110.6 44.1 19.5 21.8 615 634 A A + 0 0 77 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.860 69.5 10.3 -78.5 -37.7 44.4 15.8 22.5 616 635 A R S >> S- 0 0 187 1,-0.0 3,-1.0 36,-0.0 4,-0.7 -0.885 79.5 -99.6-138.6 169.1 42.5 15.6 25.8 617 636 A D H >> S+ 0 0 72 -2,-0.3 4,-1.9 1,-0.3 3,-0.7 0.800 118.5 61.4 -59.0 -31.0 40.3 17.6 28.1 618 637 A D H 3> S+ 0 0 104 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.833 95.2 60.7 -67.0 -30.5 43.3 18.3 30.3 619 638 A D H <4 S+ 0 0 70 -3,-1.0 -1,-0.2 2,-0.2 -2,-0.2 0.758 106.9 46.7 -66.8 -25.5 45.0 20.1 27.4 620 639 A V H X< S+ 0 0 0 -4,-0.7 3,-1.2 -3,-0.7 -2,-0.2 0.890 111.6 49.6 -81.9 -43.2 42.1 22.6 27.3 621 640 A K H 3< S+ 0 0 116 -4,-1.9 -2,-0.2 30,-0.4 -3,-0.1 0.853 112.2 49.6 -63.6 -33.6 42.1 23.1 31.1 622 641 A N T 3< S+ 0 0 121 -4,-2.2 2,-1.0 -5,-0.1 -1,-0.2 0.361 79.1 109.1 -89.1 3.7 45.9 23.7 31.1 623 642 A D <> - 0 0 7 -3,-1.2 4,-2.4 1,-0.2 5,-0.2 -0.738 52.1-165.4 -83.8 107.1 45.9 26.3 28.3 624 643 A S H > S+ 0 0 68 -2,-1.0 4,-1.9 2,-0.2 -1,-0.2 0.867 84.5 46.7 -60.8 -43.3 46.7 29.5 30.2 625 644 A E H > S+ 0 0 16 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.930 112.7 50.4 -66.3 -45.0 45.8 31.9 27.4 626 645 A L H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.913 111.8 47.5 -59.6 -45.3 42.5 30.1 26.7 627 646 A Q H X S+ 0 0 42 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.881 113.6 46.8 -66.3 -38.5 41.5 30.2 30.4 628 647 A H H X S+ 0 0 97 -4,-1.9 4,-1.8 -5,-0.2 -1,-0.2 0.875 111.0 54.2 -69.2 -36.9 42.3 33.9 30.8 629 648 A W H X S+ 0 0 0 -4,-2.4 4,-2.5 -131,-0.2 -2,-0.2 0.956 112.6 41.0 -59.9 -55.4 40.5 34.6 27.5 630 649 A W H X S+ 0 0 14 -4,-2.3 4,-2.1 1,-0.2 5,-0.3 0.888 112.4 54.4 -64.4 -41.7 37.2 33.0 28.6 631 650 A K H X S+ 0 0 115 -4,-1.9 4,-2.5 -5,-0.2 5,-0.2 0.894 114.5 41.2 -60.5 -39.6 37.3 34.3 32.2 632 651 A E H X>S+ 0 0 28 -4,-1.8 4,-2.5 2,-0.2 5,-2.2 0.894 109.2 57.4 -76.3 -39.3 37.7 37.9 30.9 633 652 A A H <>S+ 0 0 0 -4,-2.5 5,-1.8 3,-0.2 -2,-0.2 0.921 120.0 31.8 -57.1 -43.3 35.1 37.5 28.1 634 653 A V H <5S+ 0 0 14 -4,-2.1 7,-0.3 3,-0.2 -2,-0.2 0.945 124.4 41.3 -79.4 -53.0 32.5 36.5 30.7 635 654 A E H <5S+ 0 0 82 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.732 136.1 13.1 -71.8 -23.7 33.6 38.4 33.8 636 655 A K T ><5S+ 0 0 121 -4,-2.5 3,-1.4 -5,-0.2 4,-0.2 0.741 127.4 47.3-114.3 -56.8 34.4 41.7 32.1 637 656 A G T 3 S- 0 0 41 -32,-0.1 4,-1.9 -33,-0.1 5,-0.1 -0.939 83.4-117.0-140.3 160.3 36.8 20.1 28.2 653 672 A L H > S+ 0 0 45 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 0.818 116.6 58.5 -64.1 -31.0 37.1 19.6 24.5 654 673 A E H > S+ 0 0 151 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.926 105.8 46.5 -64.3 -47.8 33.3 19.5 24.3 655 674 A D H > S+ 0 0 27 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.871 110.1 53.2 -64.7 -38.6 33.1 23.0 25.9 656 675 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.927 110.8 46.5 -63.9 -43.4 35.7 24.5 23.6 657 676 A V H X S+ 0 0 21 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.942 113.1 50.9 -62.2 -48.0 33.9 23.2 20.5 658 677 A E H X S+ 0 0 69 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.938 111.0 46.5 -56.5 -51.2 30.6 24.5 21.8 659 678 A V H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.917 116.2 44.2 -61.0 -44.9 31.9 28.0 22.6 660 679 A C H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.2 5,-0.2 0.889 111.3 53.7 -67.6 -41.3 33.7 28.4 19.2 661 680 A L H X S+ 0 0 8 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.926 110.5 46.8 -59.4 -45.4 30.7 27.0 17.2 662 681 A I H X S+ 0 0 2 -4,-2.2 4,-2.5 -5,-0.2 5,-0.2 0.926 111.8 50.6 -64.4 -44.6 28.3 29.5 18.8 663 682 A I H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.937 113.1 45.3 -59.1 -47.6 30.7 32.4 18.2 664 683 A I H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 5,-0.3 0.887 112.0 52.6 -64.4 -38.5 31.1 31.5 14.5 665 684 A W H <>S+ 0 0 2 -4,-2.3 5,-2.4 -5,-0.2 6,-0.4 0.949 110.3 46.9 -62.3 -49.1 27.4 31.0 14.1 666 685 A I H <>S+ 0 0 1 -4,-2.5 5,-1.3 1,-0.2 -2,-0.2 0.919 115.1 46.1 -58.7 -47.4 26.4 34.4 15.5 667 686 A A H <5S+ 0 0 0 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.773 125.9 22.2 -70.5 -28.4 29.0 36.3 13.4 668 687 A S T X5S+ 0 0 0 -4,-1.8 4,-2.4 -3,-0.2 5,-0.2 0.789 129.5 17.3-103.2 -86.9 28.3 34.6 10.1 669 688 A A H >5S+ 0 0 0 -5,-0.3 4,-2.6 2,-0.2 5,-0.2 0.852 124.0 50.7 -61.7 -42.9 25.0 32.9 9.3 670 689 A L H >< S+ 0 0 0 -4,-1.6 3,-1.7 -3,-0.3 -3,-0.2 0.894 102.0 54.1-101.2 -48.3 20.9 41.7 7.9 676 695 A F T 3< S+ 0 0 1 -4,-1.9 135,-0.3 1,-0.3 3,-0.1 0.530 100.7 60.3 -76.4 -0.8 20.8 41.2 4.1 677 696 A G T 3>>S+ 0 0 0 -5,-0.3 4,-2.5 -342,-0.2 5,-0.6 0.409 76.3 100.4 -99.2 5.0 17.0 41.1 3.8 678 697 A Q H <>5S+ 0 0 8 -3,-1.7 4,-2.4 1,-0.2 -1,-0.1 0.925 93.0 25.7 -58.7 -56.2 16.6 44.6 5.1 679 698 A Y H >5S+ 0 0 3 53,-0.5 4,-2.4 3,-0.2 -366,-0.2 0.898 117.9 61.7 -75.9 -38.0 16.1 46.6 1.9 680 699 A P H 45S+ 0 0 0 0, 0.0 -367,-2.2 0, 0.0 -2,-0.2 0.897 125.5 17.1 -54.8 -39.3 14.8 43.5 -0.1 681 700 A Y H ><5S+ 0 0 0 -4,-2.5 3,-0.5 -369,-0.1 -2,-0.2 0.810 134.1 42.8 -98.0 -36.5 11.8 43.3 2.3 682 701 A G H 3< S- 0 0 0 -3,-0.5 3,-1.6 -5,-0.1 4,-1.3 -0.961 81.4-153.6-107.1 107.9 8.7 49.2 0.6 685 704 A I T 34 S+ 0 0 3 -2,-0.6 35,-0.2 1,-0.3 -1,-0.1 0.825 90.7 60.5 -56.7 -31.5 7.8 51.2 3.8 686 705 A M T 34 S+ 0 0 1 1,-0.2 -1,-0.3 2,-0.1 -4,-0.1 0.807 104.6 49.7 -66.2 -29.0 4.3 49.8 3.9 687 706 A N T <4 S+ 0 0 13 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.826 128.1 20.2 -77.0 -35.3 5.7 46.2 4.2 688 707 A R S < S- 0 0 20 -4,-1.3 -1,-0.2 -6,-0.2 -2,-0.1 -0.557 79.4-171.7-133.1 69.4 8.1 47.0 7.1 689 708 A P - 0 0 1 0, 0.0 -217,-0.3 0, 0.0 3,-0.1 -0.392 12.2-157.8 -63.9 141.9 6.9 50.2 8.8 690 709 A T S S+ 0 0 11 1,-0.2 -151,-2.3 -153,-0.1 2,-0.3 0.547 70.4 15.8 -95.3 -10.8 9.4 51.6 11.4 691 710 A A - 0 0 15 -153,-0.2 29,-0.9 -152,-0.1 2,-0.3 -0.985 57.3-145.7-159.3 156.5 7.0 53.6 13.4 692 711 A S B -T 719 0I 1 -2,-0.3 -284,-2.0 27,-0.2 27,-0.2 -0.977 7.8-168.6-128.2 144.1 3.3 54.2 14.1 693 712 A R + 0 0 52 25,-2.7 2,-0.3 -2,-0.3 -286,-0.2 0.459 65.0 22.6-115.0 -6.9 1.9 57.7 15.0 694 713 A R S S- 0 0 59 -286,-0.4 -1,-0.2 24,-0.4 -286,-0.2 -0.981 70.5-117.6-157.5 156.7 -1.6 57.2 16.2 695 714 A L - 0 0 32 -2,-0.3 -2,-0.1 1,-0.2 -285,-0.0 -0.240 58.3 -63.9 -86.4 178.5 -3.8 54.5 17.7 696 715 A L - 0 0 21 1,-0.1 -1,-0.2 -2,-0.1 2,-0.1 -0.418 63.6-109.2 -64.3 143.1 -7.0 53.1 16.0 697 716 A P - 0 0 33 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.368 24.4-114.5 -76.7 154.9 -9.7 55.8 15.6 698 717 A E > - 0 0 110 1,-0.1 3,-1.1 -2,-0.1 6,-0.4 -0.611 37.6-100.2 -85.3 144.9 -13.0 56.0 17.5 699 718 A K T 3 S+ 0 0 154 -2,-0.2 -1,-0.1 1,-0.2 4,-0.0 -0.358 108.6 36.0 -62.2 142.7 -16.3 55.5 15.6 700 719 A G T 3 S+ 0 0 71 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.0 0.592 93.8 108.7 89.8 9.6 -17.9 58.8 14.8 701 720 A T S <> S- 0 0 38 -3,-1.1 4,-2.0 1,-0.1 -1,-0.3 -0.790 80.0-115.5-115.4 159.9 -14.7 60.7 14.2 702 721 A P H > S+ 0 0 95 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.846 116.9 59.3 -63.7 -29.4 -13.3 62.1 10.9 703 722 A E H > S+ 0 0 87 1,-0.2 4,-1.2 2,-0.2 -4,-0.1 0.883 105.4 48.5 -64.3 -38.5 -10.4 59.7 11.3 704 723 A Y H > S+ 0 0 41 -6,-0.4 4,-1.1 -3,-0.3 3,-0.5 0.919 108.2 53.9 -67.8 -40.1 -12.8 56.8 11.3 705 724 A E H X S+ 0 0 88 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.842 102.7 59.6 -62.0 -31.4 -14.5 58.1 8.2 706 725 A E H X S+ 0 0 34 -4,-1.7 4,-3.1 1,-0.2 8,-0.3 0.867 96.7 58.5 -65.8 -37.5 -11.1 58.2 6.5 707 726 A M H < S+ 0 0 4 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.888 112.4 42.3 -60.0 -35.9 -10.6 54.5 7.0 708 727 A I H < S+ 0 0 89 -4,-1.1 3,-0.3 -3,-0.1 -2,-0.2 0.955 125.8 30.3 -74.6 -49.9 -13.8 53.9 5.0 709 728 A N H < S+ 0 0 131 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.725 134.9 18.6 -84.0 -27.5 -13.3 56.5 2.3 710 729 A N X + 0 0 78 -4,-3.1 4,-2.1 -5,-0.2 -1,-0.2 -0.563 63.3 167.5-145.6 74.7 -9.5 56.7 1.8 711 730 A H H > S+ 0 0 78 -3,-0.3 4,-2.1 1,-0.2 5,-0.2 0.825 77.7 55.9 -63.3 -32.3 -7.9 53.6 3.3 712 731 A E H > S+ 0 0 58 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.912 110.0 46.5 -67.3 -39.7 -4.5 54.2 1.7 713 732 A K H > S+ 0 0 10 2,-0.2 4,-2.3 -3,-0.2 -2,-0.2 0.886 109.5 53.9 -67.8 -39.4 -4.3 57.6 3.4 714 733 A A H X S+ 0 0 1 -4,-2.1 4,-0.9 -8,-0.3 -1,-0.2 0.915 112.1 45.8 -58.8 -42.3 -5.4 56.2 6.7 715 734 A Y H >X S+ 0 0 7 -4,-2.1 4,-2.1 1,-0.2 3,-0.7 0.947 113.1 48.3 -65.0 -50.2 -2.6 53.7 6.5 716 735 A L H 3< S+ 0 0 3 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.816 108.4 53.6 -63.8 -32.5 0.0 56.3 5.5 717 736 A R H 3< S+ 0 0 103 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.740 111.0 49.2 -72.5 -23.7 -1.0 58.7 8.3 718 737 A T H << S+ 0 0 4 -4,-0.9 -25,-2.7 -3,-0.7 -24,-0.4 0.875 107.5 56.5 -83.5 -42.6 -0.5 55.9 10.8 719 738 A I B < S-T 692 0I 1 -4,-2.1 -27,-0.2 -27,-0.2 -33,-0.1 -0.205 107.9 -41.8 -85.9 179.3 3.0 54.6 9.7 720 739 A T - 0 0 4 -29,-0.9 -1,-0.2 -35,-0.2 -2,-0.1 -0.050 67.0-116.1 -39.1 128.0 6.4 56.3 9.3 721 740 A S > - 0 0 18 -3,-0.1 4,-2.1 1,-0.1 5,-0.2 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