==== 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 28-JUL-00 1FGT . COMPND 2 MOLECULE: SEED LIPOXYGENASE-1; . SOURCE 2 ORGANISM_SCIENTIFIC: GLYCINE MAX; . AUTHOR D.R.TOMCHICK,W.MINOR,T.HOLMAN . 816 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32029.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 530 65.0 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 . 97 11.9 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 . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 41 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 105 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 223 27.3 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 0 0 0 0 2 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 4 1 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 7 A K 0 0 107 0, 0.0 2,-0.6 0, 0.0 69,-0.2 0.000 360.0 360.0 360.0 146.9 72.1 35.7 3.4 2 8 A I E -A 69 0A 29 67,-2.8 67,-2.5 70,-0.0 2,-0.3 -0.791 360.0-136.2 -93.8 119.2 68.4 35.0 3.4 3 9 A K E +A 68 0A 80 -2,-0.6 96,-2.5 65,-0.2 2,-0.3 -0.571 32.2 180.0 -73.6 130.0 66.5 36.3 0.3 4 10 A G E -AB 67 98A 0 63,-2.9 63,-1.6 -2,-0.3 2,-0.4 -0.914 23.3-150.2-133.3 159.9 63.2 37.9 1.4 5 11 A T E -AB 66 97A 20 92,-2.1 92,-1.8 -2,-0.3 2,-0.5 -0.989 8.8-163.3-132.5 123.9 60.2 39.7 -0.2 6 12 A V E -AB 65 96A 1 59,-2.8 59,-2.9 -2,-0.4 2,-0.5 -0.914 4.3-165.1-107.2 128.9 58.2 42.4 1.5 7 13 A V E +AB 64 95A 13 88,-2.7 87,-2.4 -2,-0.5 88,-1.7 -0.960 20.3 156.7-114.2 130.3 54.8 43.2 0.1 8 14 A L E -AB 63 93A 1 55,-2.3 55,-2.1 -2,-0.5 85,-0.2 -0.949 34.9-132.8-146.3 164.7 53.1 46.5 1.3 9 15 A M E - B 0 92A 9 83,-2.6 83,-3.1 -2,-0.3 53,-0.1 -0.990 25.8-127.1-124.0 123.7 50.5 49.0 0.2 10 16 A P E > - B 0 91A 14 0, 0.0 3,-2.6 0, 0.0 4,-0.5 -0.409 31.8-107.2 -66.4 148.0 51.2 52.7 0.3 11 17 A K G > S+ 0 0 102 79,-0.7 3,-1.3 1,-0.3 80,-0.1 0.834 115.1 66.5 -44.0 -46.1 48.6 54.7 2.2 12 18 A N G 3 S+ 0 0 132 1,-0.3 -1,-0.3 2,-0.2 79,-0.0 0.674 93.5 64.6 -53.9 -16.9 47.1 56.3 -1.0 13 19 A E G < 0 0 67 -3,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.850 360.0 360.0 -76.5 -37.4 46.0 52.8 -2.0 14 20 A L < 0 0 55 -3,-1.3 213,-1.1 -4,-0.5 -2,-0.2 0.379 360.0 360.0-108.1 360.0 43.5 52.2 0.8 15 ! 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 16 32 A L > 0 0 93 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 -32.0 57.8 53.8 -4.4 17 33 A N G > + 0 0 123 1,-0.3 3,-1.5 2,-0.2 4,-0.0 0.700 360.0 74.9 -68.9 -18.2 61.5 54.6 -4.3 18 34 A A G 3 S+ 0 0 59 1,-0.3 -1,-0.3 2,-0.0 5,-0.1 0.724 88.1 61.1 -65.9 -19.1 60.9 56.6 -1.2 19 35 A F G < >S+ 0 0 17 -3,-1.5 5,-0.6 4,-0.1 29,-0.4 0.639 97.7 68.6 -81.7 -14.0 60.6 53.2 0.5 20 36 A L T X 5S+ 0 0 31 -3,-1.5 3,-2.5 -4,-0.2 4,-0.4 0.437 79.3 51.9 -79.0-139.1 64.2 52.3 -0.4 21 37 A G T 3 5S- 0 0 58 1,-0.2 3,-0.2 28,-0.2 27,-0.1 -0.107 129.7 -34.6 43.9-134.1 67.2 54.0 1.1 22 38 A R T 3 5S+ 0 0 187 1,-0.2 -1,-0.2 25,-0.1 3,-0.1 -0.070 108.4 109.7-108.5 32.9 67.0 54.0 4.9 23 39 A S T < 5S+ 0 0 27 -3,-2.5 63,-3.5 1,-0.2 64,-0.6 0.878 80.0 24.9 -75.5 -41.6 63.2 54.4 5.1 24 40 A V E < -E 85 0B 1 -5,-0.6 24,-1.2 -4,-0.4 2,-0.4 -0.984 65.1-174.9-132.7 125.8 62.2 50.9 6.3 25 41 A S E -EF 84 47B 0 59,-2.1 59,-2.4 -2,-0.4 2,-0.3 -0.938 3.3-167.0-121.4 143.7 64.2 48.4 8.3 26 42 A L E -EF 83 46B 0 20,-2.9 20,-1.9 -2,-0.4 2,-0.4 -0.925 3.7-161.6-124.0 151.0 63.4 44.9 9.4 27 43 A Q E -E 82 0B 30 55,-2.3 55,-2.6 -2,-0.3 18,-0.1 -0.975 16.5-136.1-134.9 119.5 65.1 42.6 11.9 28 44 A L E -E 81 0B 2 -2,-0.4 15,-2.8 16,-0.3 2,-0.4 -0.398 15.5-152.1 -72.3 152.1 64.6 38.8 12.0 29 45 A I E -EG 80 42B 0 51,-2.8 50,-2.4 13,-0.2 51,-1.3 -0.993 15.7-122.9-128.1 132.2 64.1 37.2 15.3 30 46 A S E -E 78 0B 0 11,-2.7 46,-0.1 -2,-0.4 10,-0.1 -0.553 15.8-168.3 -79.4 137.6 65.1 33.6 16.0 31 47 A A E S+ 0 0 11 46,-2.9 106,-0.3 -2,-0.3 -1,-0.1 0.531 92.4 33.1 -96.1 -9.8 62.5 31.0 17.2 32 48 A T E S+ 0 0 77 45,-0.5 2,-0.6 43,-0.3 44,-0.2 0.651 108.1 62.4-119.3 -25.6 65.3 28.5 18.0 33 49 A K E - 0 0 95 42,-0.5 8,-2.9 44,-0.2 2,-0.3 -0.931 66.5-169.7-110.4 121.8 68.3 30.4 19.2 34 50 A A E - G 0 40B 38 -2,-0.6 6,-0.3 6,-0.3 -3,-0.1 -0.780 17.4-124.2-113.4 153.8 68.0 32.5 22.4 35 51 A D > - 0 0 62 4,-3.1 3,-1.4 -2,-0.3 -1,-0.1 0.043 54.1 -73.9 -75.2-168.0 70.1 35.1 24.1 36 52 A A T 3 S+ 0 0 105 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.490 133.0 52.3 -70.5 -3.4 71.2 34.9 27.8 37 53 A H T 3 S- 0 0 167 2,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.422 120.3-102.3-111.7 -1.3 67.7 35.7 28.9 38 54 A G S < S+ 0 0 39 -3,-1.4 2,-0.4 1,-0.3 101,-0.2 0.459 80.4 130.4 94.1 3.6 65.8 33.0 26.9 39 55 A K - 0 0 56 1,-0.1 -4,-3.1 98,-0.1 -1,-0.3 -0.739 68.7 -96.1 -95.6 136.4 64.6 35.5 24.3 40 56 A G E -G 34 0B 0 96,-2.9 -6,-0.3 -2,-0.4 -9,-0.1 -0.139 46.6-107.4 -47.4 136.7 65.1 34.8 20.6 41 57 A K E - 0 0 83 -8,-2.9 -11,-2.7 34,-0.2 2,-0.4 -0.387 32.7-136.8 -68.6 147.6 68.2 36.4 19.2 42 58 A V E -G 29 0B 50 -13,-0.2 -13,-0.2 -3,-0.1 -1,-0.1 -0.898 10.4-138.2-113.0 135.0 67.6 39.5 16.9 43 59 A G - 0 0 16 -15,-2.8 2,-0.1 -2,-0.4 28,-0.1 0.014 35.6 -73.4 -76.2-173.8 69.4 40.3 13.7 44 60 A K - 0 0 127 26,-0.4 -16,-0.3 1,-0.1 2,-0.3 -0.381 56.4 -88.1 -78.5 158.3 70.7 43.5 12.3 45 61 A D - 0 0 71 -18,-0.1 2,-0.4 -2,-0.1 -18,-0.2 -0.524 50.7-168.6 -66.8 128.9 68.5 46.4 10.9 46 62 A T E -F 26 0B 18 -20,-1.9 -20,-2.9 -2,-0.3 2,-0.2 -0.990 4.8-150.3-126.1 129.0 68.0 45.5 7.3 47 63 A F E -F 25 0B 33 -2,-0.4 21,-0.3 -22,-0.2 -22,-0.2 -0.573 31.6 -87.1 -99.8 162.0 66.5 48.0 4.8 48 64 A L - 0 0 6 -24,-1.2 19,-0.2 -29,-0.4 -25,-0.1 -0.436 37.6-165.8 -63.3 134.5 64.5 47.5 1.7 49 65 A E - 0 0 97 17,-2.6 2,-0.3 1,-0.3 -28,-0.2 0.828 53.4 -33.0 -94.7 -37.4 66.9 47.1 -1.2 50 66 A G E -C 66 0A 16 16,-1.1 16,-2.8 -30,-0.1 2,-0.4 -0.993 64.7 -75.8-172.5 172.7 64.7 47.5 -4.3 51 67 A I E -C 65 0A 60 -2,-0.3 2,-0.6 14,-0.2 14,-0.3 -0.686 37.6-145.3 -85.1 128.9 61.4 47.1 -6.0 52 68 A N E +C 64 0A 26 12,-2.8 12,-0.6 -2,-0.4 -1,-0.0 -0.848 24.7 169.5 -95.0 124.0 60.6 43.5 -7.1 53 69 A T + 0 0 133 -2,-0.6 -1,-0.1 10,-0.1 -2,-0.0 -0.149 49.4 96.5-125.3 37.9 58.7 43.6 -10.4 54 70 A S + 0 0 97 3,-0.1 -1,-0.1 10,-0.0 -2,-0.0 0.938 57.6 73.5 -92.5 -61.8 58.9 39.9 -11.1 55 71 A L - 0 0 110 1,-0.2 9,-0.1 2,-0.1 -3,-0.0 -0.367 59.4-153.6 -64.5 131.6 55.8 37.9 -10.0 56 72 A P S S+ 0 0 124 0, 0.0 2,-0.4 0, 0.0 3,-0.4 0.848 80.0 82.5 -69.7 -33.7 52.7 38.4 -12.1 57 73 A T + 0 0 104 1,-0.2 -2,-0.1 2,-0.0 -3,-0.1 -0.587 62.0 80.4 -75.4 125.7 50.6 37.6 -9.0 58 74 A L + 0 0 60 -2,-0.4 -1,-0.2 5,-0.0 5,-0.1 -0.256 45.5 148.3 178.1 -74.4 50.2 40.6 -6.7 59 75 A G > + 0 0 49 -3,-0.4 3,-2.1 3,-0.1 -2,-0.0 0.032 32.7 95.3 50.3-158.9 47.5 43.0 -7.7 60 76 A A T 3 S- 0 0 42 1,-0.3 3,-0.1 -51,-0.0 -1,-0.1 0.838 118.6 -66.2 42.5 51.6 45.4 45.1 -5.2 61 77 A G T 3 S+ 0 0 30 1,-0.2 -1,-0.3 -52,-0.1 2,-0.2 0.786 98.0 149.6 46.3 30.2 47.6 48.2 -5.3 62 78 A E < - 0 0 42 -3,-2.1 2,-0.4 -53,-0.1 -53,-0.2 -0.618 32.2-162.2 -94.3 153.8 50.4 46.1 -3.8 63 79 A S E -A 8 0A 24 -55,-2.1 -55,-2.3 -2,-0.2 2,-0.4 -0.999 8.7-143.1-136.7 138.6 54.1 46.5 -4.3 64 80 A A E -AC 7 52A 8 -12,-0.6 -12,-2.8 -2,-0.4 2,-0.4 -0.802 11.5-163.7-104.6 142.7 56.9 44.0 -3.6 65 81 A F E -AC 6 51A 0 -59,-2.9 -59,-2.8 -2,-0.4 -14,-0.2 -0.983 14.7-132.7-127.9 135.2 60.4 44.9 -2.3 66 82 A N E +AC 5 50A 42 -16,-2.8 -17,-2.6 -2,-0.4 -16,-1.1 -0.545 30.4 167.7 -82.4 149.7 63.5 42.7 -2.3 67 83 A I E -A 4 0A 0 -63,-1.6 -63,-2.9 -19,-0.2 2,-0.5 -0.946 21.1-152.0-161.7 139.6 65.6 42.4 0.9 68 84 A H E -A 3 0A 77 -21,-0.3 2,-0.4 -2,-0.3 -65,-0.2 -0.972 12.5-148.7-121.9 127.7 68.4 40.2 2.0 69 85 A F E -A 2 0A 4 -67,-2.5 -67,-2.8 -2,-0.5 2,-1.3 -0.797 16.3-130.8-100.8 134.9 69.1 39.3 5.6 70 86 A E + 0 0 141 -2,-0.4 -26,-0.4 -69,-0.2 2,-0.3 -0.678 57.8 138.8 -78.3 97.2 72.5 38.6 7.1 71 87 A W - 0 0 22 -2,-1.3 2,-0.2 -28,-0.1 -2,-0.1 -0.899 30.8-171.0-151.3 115.5 71.5 35.3 8.9 72 88 A D > - 0 0 93 -2,-0.3 3,-2.8 1,-0.1 4,-0.3 -0.670 44.2 -96.4-104.8 163.2 73.5 32.1 9.1 73 89 A G G > S+ 0 0 72 1,-0.3 3,-1.7 -2,-0.2 -1,-0.1 0.741 117.6 70.5 -46.0 -29.1 72.4 28.7 10.4 74 90 A S G 3 S+ 0 0 70 1,-0.3 -1,-0.3 2,-0.0 3,-0.1 0.711 90.4 59.3 -65.2 -21.4 74.0 29.6 13.8 75 91 A M G < S- 0 0 37 -3,-2.8 -42,-0.5 1,-0.3 -43,-0.3 0.506 107.6-134.1 -84.0 -4.6 71.2 32.2 14.5 76 92 A G < - 0 0 13 -3,-1.7 -1,-0.3 -4,-0.3 -46,-0.0 -0.467 42.1 -35.0 87.4-160.9 68.7 29.4 14.2 77 93 A I - 0 0 105 -2,-0.1 -46,-2.9 -3,-0.1 -45,-0.5 -0.886 63.3-119.3-104.4 126.7 65.4 29.5 12.2 78 94 A P E +E 30 0B 8 0, 0.0 -48,-0.3 0, 0.0 3,-0.1 -0.429 35.8 168.1 -65.5 133.5 63.6 32.9 12.1 79 95 A G E + 0 0 5 -50,-2.4 45,-2.4 1,-0.2 2,-0.3 0.334 64.8 6.0-125.5 2.6 60.1 32.8 13.6 80 96 A A E -EH 29 123B 0 -51,-1.3 -51,-2.8 43,-0.3 2,-0.3 -0.962 61.3-148.3-169.1 175.0 59.3 36.5 13.9 81 97 A F E -EH 28 122B 0 41,-2.2 41,-2.5 -2,-0.3 2,-0.3 -0.988 11.1-133.7-160.7 152.0 60.6 40.0 12.9 82 98 A Y E -EH 27 121B 51 -55,-2.6 -55,-2.3 -2,-0.3 2,-0.4 -0.741 23.0-166.0-100.8 152.0 60.6 43.6 14.0 83 99 A I E -EH 26 120B 3 37,-1.8 37,-0.7 -2,-0.3 2,-0.4 -0.999 7.6-167.7-143.9 139.8 59.9 46.4 11.6 84 100 A K E -E 25 0B 35 -59,-2.4 -59,-2.1 -2,-0.4 2,-0.6 -0.997 10.1-152.6-129.1 128.9 60.5 50.2 11.9 85 101 A N E +Ei 24 112B 0 26,-0.6 28,-3.2 -2,-0.4 29,-0.3 -0.908 12.7 179.4-102.6 117.7 59.0 52.7 9.5 86 102 A Y + 0 0 93 -63,-3.5 -62,-0.2 -2,-0.6 -1,-0.1 0.530 53.3 98.6 -93.8 -10.1 61.2 55.8 9.3 87 103 A M S S- 0 0 35 -64,-0.6 26,-0.2 2,-0.2 -2,-0.1 -0.297 80.1-124.2 -72.3 161.8 59.0 57.6 6.8 88 104 A Q S S+ 0 0 145 24,-0.1 24,-0.5 2,-0.1 2,-0.3 0.913 91.5 64.1 -74.9 -41.1 56.5 60.2 8.0 89 105 A V S S- 0 0 80 22,-0.1 -2,-0.2 1,-0.1 2,-0.0 -0.603 85.3-118.8 -89.6 142.9 53.5 58.5 6.5 90 106 A E - 0 0 18 -2,-0.3 -79,-0.7 22,-0.1 2,-0.3 -0.312 25.3-161.0 -73.8 156.6 52.2 55.0 7.5 91 107 A F E -BD 10 110A 1 19,-1.4 19,-2.7 -81,-0.2 2,-0.8 -0.926 23.7-111.5-135.2 160.5 52.0 52.1 5.0 92 108 A F E -BD 9 109A 24 -83,-3.1 -83,-2.6 -2,-0.3 2,-0.5 -0.844 28.0-148.0 -97.9 110.7 50.0 48.9 5.1 93 109 A L E +BD 8 108A 1 15,-2.8 15,-2.0 -2,-0.8 -85,-0.2 -0.638 20.3 175.5 -78.9 120.6 52.3 45.9 5.6 94 110 A K E - 0 0 39 -87,-2.4 12,-2.3 -2,-0.5 13,-1.4 0.929 52.7 -36.1 -89.2 -56.5 50.9 42.8 3.8 95 111 A S E -BD 7 105A 24 -88,-1.7 -88,-2.7 10,-0.2 2,-0.4 -0.987 34.0-138.1-163.5 168.6 53.6 40.2 4.2 96 112 A L E -BD 6 104A 0 8,-1.5 8,-2.2 -2,-0.3 2,-0.4 -0.990 21.4-169.0-133.4 135.0 57.2 39.0 4.4 97 113 A T E -BD 5 103A 24 -92,-1.8 -92,-2.1 -2,-0.4 2,-0.4 -0.998 4.5-159.9-130.8 129.0 58.3 35.8 2.7 98 114 A L E BD 4 102A 3 4,-2.8 4,-2.4 -2,-0.4 -94,-0.2 -0.932 360.0 360.0-111.5 131.9 61.7 34.2 3.3 99 115 A E 0 0 125 -96,-2.5 -1,-0.0 -2,-0.4 -96,-0.0 -0.068 360.0 360.0-120.0 360.0 63.2 31.7 0.7 100 ! 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 0.0 101 122 A T 0 0 121 0, 0.0 2,-0.5 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 139.8 59.9 28.8 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57.8 -58.8 -42.4 25.8 57.6 -0.7 293 314 A K G >< S+ 0 0 104 -4,-2.8 3,-0.5 1,-0.3 -1,-0.3 0.737 99.6 59.4 -62.3 -19.0 25.9 58.3 -4.5 294 315 A E G < S+ 0 0 98 -3,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.615 91.7 72.0 -83.8 -10.6 25.6 54.6 -5.1 295 316 A L G < S+ 0 0 7 -3,-1.9 2,-0.3 -4,-0.5 -1,-0.2 0.681 102.4 30.4 -78.0 -21.3 22.2 54.5 -3.3 296 317 A Y < - 0 0 16 -3,-0.5 2,-0.3 -4,-0.4 10,-0.2 -0.991 68.1-130.8-141.9 148.8 20.2 56.4 -5.9 297 318 A R E -N 305 0F 190 8,-2.4 8,-2.4 -2,-0.3 2,-0.3 -0.709 38.1-178.2 -89.8 150.9 20.0 56.8 -9.7 298 319 A T E -N 304 0F 50 -2,-0.3 6,-0.2 6,-0.2 -23,-0.0 -0.967 44.2-136.4-149.1 160.7 19.8 60.5 -10.6 299 320 A D - 0 0 80 4,-0.5 5,-0.1 -2,-0.3 -1,-0.1 0.312 57.1-115.9 -95.8 3.3 19.5 62.8 -13.6 300 321 A G S S+ 0 0 24 3,-0.4 4,-0.1 1,-0.1 -13,-0.0 0.421 100.8 62.0 77.1 1.0 22.1 64.9 -11.9 301 322 A Q S S- 0 0 87 2,-0.1 -18,-0.3 -18,-0.1 -17,-0.2 0.764 121.3 -23.2-120.1 -63.7 19.6 67.7 -11.5 302 323 A H S S+ 0 0 62 -19,-0.1 -24,-3.2 -20,-0.1 2,-0.4 0.477 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61.6 -61.4 -34.2 -2.2 37.7 4.8 323 344 A E H > S+ 0 0 89 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.924 107.4 41.2 -59.0 -45.2 -0.1 34.9 3.2 324 345 A E H > S+ 0 0 0 -6,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.900 109.8 58.9 -72.6 -37.8 2.9 37.1 2.9 325 346 A F H < S+ 0 0 14 -4,-2.2 4,-0.4 1,-0.2 -2,-0.2 0.937 115.0 36.5 -54.4 -49.1 2.5 38.7 6.3 326 347 A A H >< S+ 0 0 0 -4,-2.2 3,-1.5 96,-0.2 4,-0.4 0.903 112.7 58.3 -72.9 -39.8 2.7 35.3 8.0 327 348 A R H >X S+ 0 0 3 -4,-2.3 3,-1.8 -5,-0.3 4,-1.6 0.872 98.0 60.3 -59.4 -35.5 5.3 33.9 5.6 328 349 A E H 3X S+ 0 0 8 -4,-2.4 4,-1.5 1,-0.3 6,-0.5 0.700 91.4 69.2 -69.8 -13.6 7.8 36.7 6.4 329 350 A M H <4 S+ 0 0 8 -3,-1.5 9,-0.5 -4,-0.4 8,-0.4 0.708 115.5 25.4 -74.1 -14.3 7.7 35.5 10.0 330 351 A I H <4 S+ 0 0 0 -3,-1.8 259,-2.0 -4,-0.4 260,-0.3 0.515 141.9 20.2-122.0 -8.9 9.6 32.4 8.8 331 352 A A H < S+ 0 0 0 -4,-1.6 -3,-0.2 257,-0.2 -2,-0.2 0.175 104.5 92.0-145.8 17.9 11.4 33.6 5.7 332 353 A G S < S- 0 0 0 -4,-1.5 343,-0.1 -5,-0.2 344,-0.1 -0.089 96.2 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-3,-1.0 4,-2.0 -4,-0.4 -2,-0.2 0.856 107.9 52.2 -69.4 -32.3 34.3 38.5 22.2 490 511 A V H X S+ 0 0 0 -4,-1.4 4,-1.9 -3,-0.3 5,-0.2 0.952 111.6 46.7 -66.4 -47.8 36.4 40.4 19.6 491 512 A I H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.953 113.2 47.9 -59.7 -52.2 38.0 42.5 22.4 492 513 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-0.4 0.874 108.0 56.4 -56.6 -41.7 38.8 39.4 24.6 493 514 A T H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.923 111.5 40.9 -59.2 -45.8 40.2 37.5 21.6 494 515 A H H < S+ 0 0 15 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.832 116.2 51.3 -73.8 -30.0 42.8 40.2 20.8 495 516 A R H < S+ 0 0 28 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.801 127.9 15.8 -74.7 -29.0 43.6 40.8 24.5 496 517 A H H < S+ 0 0 20 -4,-2.2 2,-0.6 -5,-0.2 131,-0.2 0.608 108.3 70.9-124.4 -15.5 44.2 37.2 25.4 497 518 A L S < S- 0 0 1 -4,-2.2 -1,-0.1 -5,-0.4 127,-0.0 -0.933 75.6-132.9-108.4 119.3 44.7 34.9 22.4 498 519 A S > - 0 0 4 -2,-0.6 3,-2.1 1,-0.1 6,-0.3 -0.289 24.8-111.1 -64.4 154.8 48.0 35.5 20.6 499 520 A V T 3 S+ 0 0 54 1,-0.3 -1,-0.1 -358,-0.1 6,-0.1 0.742 122.1 59.9 -56.5 -20.9 48.0 35.8 16.9 500 521 A L T 3 S+ 0 0 4 -373,-0.1 -372,-2.2 4,-0.1 -1,-0.3 0.653 82.7 108.8 -80.0 -17.0 49.8 32.4 17.0 501 522 A H <> - 0 0 0 -3,-2.1 4,-2.4 -374,-0.2 5,-0.2 -0.361 69.2-138.5 -68.5 132.6 46.9 30.8 18.9 502 523 A P H > S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.862 105.7 49.4 -58.3 -34.0 44.8 28.3 16.9 503 524 A I H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.829 107.3 55.1 -76.5 -30.2 41.6 29.7 18.4 504 525 A Y H > S+ 0 0 38 -6,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.947 111.6 44.9 -63.5 -47.5 42.6 33.2 17.5 505 526 A K H < S+ 0 0 17 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.841 112.8 51.6 -65.2 -33.0 43.1 32.0 13.9 506 527 A L H < S+ 0 0 0 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.926 121.4 29.6 -69.3 -43.6 39.8 30.1 14.0 507 528 A L H >< S+ 0 0 0 -4,-2.5 3,-1.9 1,-0.1 -2,-0.2 0.840 98.4 75.8 -90.0 -35.8 37.7 33.0 15.2 508 529 A T G >< S+ 0 0 32 -4,-2.6 3,-2.2 1,-0.3 4,-0.4 0.759 86.6 62.9 -54.6 -31.6 39.2 36.3 14.0 509 530 A P G > S+ 0 0 27 0, 0.0 3,-0.9 0, 0.0 -1,-0.3 0.845 99.4 60.1 -62.2 -25.6 38.0 36.1 10.4 510 531 A H G < S+ 0 0 4 -3,-1.9 306,-0.5 1,-0.2 -2,-0.2 0.359 99.8 55.2 -82.2 7.3 34.5 36.2 12.0 511 532 A Y G X> S+ 0 0 2 -3,-2.2 3,-2.1 304,-0.2 4,-0.5 0.416 71.9 143.9-114.3 -2.7 35.2 39.6 13.5 512 533 A R T <4 S- 0 0 59 -3,-0.9 303,-0.1 -4,-0.4 -289,-0.1 -0.149 81.0 -12.0 -48.7 122.1 36.2 41.5 10.3 513 534 A N T 3> S+ 0 0 5 -290,-0.1 4,-2.9 1,-0.1 5,-0.3 0.344 100.3 118.3 69.4 -0.0 34.9 45.1 10.5 514 535 A N H <> S+ 0 0 0 -3,-2.1 4,-2.3 2,-0.2 5,-0.2 0.932 76.7 42.2 -64.4 -50.2 32.7 44.5 13.5 515 536 A M H X S+ 0 0 3 -4,-0.5 4,-2.3 2,-0.2 -1,-0.2 0.892 115.5 53.6 -64.2 -35.1 34.3 46.9 15.9 516 537 A N H > S+ 0 0 9 -293,-0.4 4,-2.3 2,-0.2 5,-0.2 0.964 111.4 41.8 -64.0 -53.7 34.6 49.5 13.1 517 538 A I H X S+ 0 0 12 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.886 114.3 54.3 -64.4 -33.9 30.9 49.4 12.2 518 539 A N H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.902 108.1 47.7 -64.8 -42.5 30.0 49.4 15.8 519 540 A A H X S+ 0 0 1 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.913 112.6 48.9 -64.8 -40.9 32.0 52.5 16.6 520 541 A L H X S+ 0 0 27 -4,-2.3 4,-2.2 1,-0.2 5,-0.4 0.828 110.9 53.0 -67.0 -29.1 30.5 54.2 13.6 521 542 A A H X>S+ 0 0 6 -4,-1.8 5,-2.9 -5,-0.2 4,-1.8 0.891 105.0 52.2 -71.7 -41.8 27.1 53.1 14.9 522 543 A R H <5S+ 0 0 2 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.850 115.0 45.7 -63.1 -29.1 27.6 54.5 18.4 523 544 A Q H <5S+ 0 0 19 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.884 136.2 0.7 -81.6 -38.9 28.5 57.8 16.6 524 545 A S H <5S+ 0 0 2 -4,-2.2 7,-2.1 -5,-0.1 -3,-0.2 0.579 126.9 47.4-129.1 -15.3 25.6 58.0 14.1 525 546 A L T <5S+ 0 0 19 -4,-1.8 7,-2.3 -5,-0.4 8,-0.5 0.876 123.7 17.9 -98.1 -48.0 23.2 55.1 14.3 526 547 A I S S- 0 0 29 -6,-0.4 3,-2.5 1,-0.1 6,-0.4 -0.318 84.6 -72.0 -79.7 166.7 23.4 58.0 19.3 528 549 A A T 3 S+ 0 0 9 -357,-2.8 -1,-0.1 1,-0.3 -348,-0.1 -0.446 125.5 4.1 -62.3 124.9 21.0 60.6 20.8 529 550 A N T 3 S+ 0 0 95 -2,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.666 106.2 139.4 69.8 18.6 19.0 62.1 17.8 530 551 A G S <> S- 0 0 0 -3,-2.5 4,-1.8 -8,-0.1 -5,-0.2 -0.004 71.5 -76.5 -78.0-170.9 20.8 59.6 15.6 531 552 A I H > S+ 0 0 1 -7,-2.1 4,-0.9 1,-0.2 5,-0.2 0.921 127.8 44.3 -58.3 -50.5 19.3 57.6 12.7 532 553 A I H >> S+ 0 0 4 -7,-2.3 4,-2.6 1,-0.2 3,-0.9 0.940 113.3 50.0 -63.9 -46.4 17.5 55.0 14.7 533 554 A E H 34 S+ 0 0 10 -8,-0.5 -1,-0.2 -6,-0.4 -2,-0.2 0.848 114.7 45.2 -61.8 -31.8 16.0 57.4 17.2 534 555 A T H 3< S+ 0 0 43 -4,-1.8 -1,-0.2 1,-0.1 -2,-0.2 0.568 122.7 34.0 -91.6 -4.4 14.8 59.7 14.4 535 556 A T H << S+ 0 0 4 -3,-0.9 2,-0.3 -4,-0.9 -2,-0.2 0.604 104.7 71.0-121.3 -16.0 13.3 57.0 12.2 536 557 A F S >< S- 0 0 17 -4,-2.6 3,-1.8 -5,-0.2 153,-0.2 -0.775 83.8-108.8-109.5 151.1 11.9 54.3 14.6 537 558 A L T 3 S+ 0 0 4 151,-2.4 152,-0.1 -2,-0.3 4,-0.1 0.799 108.0 55.3 -37.5 -53.7 9.0 54.2 16.9 538 559 A P T > S- 0 0 0 0, 0.0 3,-2.6 0, 0.0 -1,-0.3 0.600 76.3-177.7 -67.8 -11.3 10.7 54.4 20.3 539 560 A S G X S+ 0 0 42 -3,-1.8 3,-2.2 -7,-0.3 4,-0.3 -0.202 73.2 6.0 53.4-131.0 12.7 57.5 19.7 540 561 A K G 3 S+ 0 0 87 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.548 131.5 59.3 -62.3 -6.8 14.8 58.2 22.7 541 562 A Y G <> S+ 0 0 46 -3,-2.6 4,-2.0 1,-0.1 -1,-0.3 0.492 79.3 96.8 -97.9 -2.9 13.8 54.9 24.4 542 563 A S H <> S+ 0 0 0 -3,-2.2 4,-1.1 1,-0.2 -2,-0.1 0.915 85.2 37.3 -53.2 -59.0 15.1 52.8 21.5 543 564 A V H >> S+ 0 0 8 -4,-0.3 4,-1.0 1,-0.2 3,-0.6 0.913 114.3 54.4 -67.7 -40.9 18.5 51.7 22.8 544 565 A E H >> S+ 0 0 31 -4,-0.3 4,-2.0 1,-0.2 3,-0.5 0.872 100.9 61.6 -62.4 -29.8 17.5 51.3 26.4 545 566 A M H 3X S+ 0 0 6 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.900 100.3 54.5 -58.7 -37.8 14.7 49.0 25.3 546 567 A S H < S+ 0 0 32 -4,-2.0 3,-0.6 1,-0.2 4,-0.3 0.914 111.4 47.2 -61.8 -40.5 15.8 45.5 28.9 549 570 A V H >< S+ 0 0 25 -4,-2.0 3,-2.2 1,-0.2 -1,-0.2 0.891 102.5 63.7 -67.6 -36.1 15.8 42.7 26.4 550 571 A Y H >< S+ 0 0 0 -4,-1.8 3,-2.1 1,-0.3 -1,-0.2 0.772 84.5 75.4 -60.3 -26.6 19.4 41.9 27.1 551 572 A K T << S+ 0 0 99 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.793 103.7 39.9 -53.4 -27.9 18.4 41.0 30.7 552 573 A N T < S+ 0 0 125 -3,-2.2 -1,-0.3 -4,-0.3 2,-0.3 0.248 85.8 125.4-105.4 8.3 17.0 37.8 29.0 553 574 A W < - 0 0 9 -3,-2.1 2,-0.5 -4,-0.1 -3,-0.0 -0.549 39.1-169.5 -72.1 131.3 19.9 37.2 26.6 554 575 A V > - 0 0 19 -2,-0.3 3,-0.9 1,-0.1 4,-0.3 -0.975 17.4-151.9-128.8 116.2 21.3 33.7 26.9 555 576 A F G > S+ 0 0 0 -2,-0.5 3,-1.8 1,-0.3 4,-0.3 0.903 97.5 48.2 -50.8 -49.9 24.6 32.8 25.1 556 577 A T G > S+ 0 0 28 1,-0.3 3,-0.8 2,-0.2 -1,-0.3 0.717 103.0 63.2 -71.0 -15.5 23.8 29.1 24.8 557 578 A D G < S+ 0 0 38 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.459 86.6 73.8 -85.6 -1.3 20.3 29.9 23.5 558 579 A Q G < S+ 0 0 25 -3,-1.8 -1,-0.2 -4,-0.3 -2,-0.2 0.615 71.2 102.9 -82.2 -14.5 22.0 31.6 20.5 559 580 A A S <> S- 0 0 11 -3,-0.8 4,-2.5 -4,-0.3 5,-0.2 -0.496 83.1-125.5 -63.7 135.5 22.8 28.1 19.1 560 581 A L H > S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.920 105.8 47.9 -56.7 -47.4 20.3 27.4 16.4 561 582 A P H > S+ 0 0 25 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.951 113.6 48.2 -59.8 -45.5 19.0 24.1 17.7 562 583 A A H > S+ 0 0 31 1,-0.2 4,-3.0 -6,-0.2 -2,-0.2 0.906 111.4 50.9 -59.9 -41.0 18.5 25.5 21.2 563 584 A D H X S+ 0 0 31 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.922 110.1 48.3 -62.3 -46.3 16.8 28.6 19.8 564 585 A L H <>S+ 0 0 0 -4,-2.5 5,-2.3 2,-0.2 6,-0.9 0.910 115.7 45.0 -61.8 -42.1 14.3 26.5 17.7 565 586 A I H ><5S+ 0 0 69 -4,-2.4 3,-1.6 -5,-0.2 -2,-0.2 0.936 111.3 52.1 -68.3 -44.0 13.6 24.3 20.7 566 587 A K H 3<5S+ 0 0 91 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.888 110.2 49.6 -59.4 -40.0 13.2 27.3 23.1 567 588 A R T 3<5S- 0 0 8 -4,-2.3 -227,-2.6 -5,-0.2 -1,-0.3 0.442 111.8-120.0 -80.7 0.8 10.7 28.9 20.8 568 589 A G T < 5S+ 0 0 13 -3,-1.6 -3,-0.2 -229,-0.2 -2,-0.1 0.801 83.7 114.3 68.5 26.4 8.6 25.8 20.5 569 590 A V S - 0 0 40 6,-2.6 3,-2.0 -2,-0.2 6,-0.3 -0.641 25.7-165.5-159.6 96.1 14.7 14.2 18.0 574 595 A P T 3 S+ 0 0 109 0, 0.0 5,-0.1 0, 0.0 6,-0.1 0.711 86.1 70.4 -55.5 -23.9 17.9 12.1 17.7 575 596 A S T 3 S+ 0 0 102 4,-0.1 5,-0.0 3,-0.1 3,-0.0 0.495 87.5 83.9 -75.3 -1.2 16.5 10.2 14.7 576 597 A T S X S- 0 0 32 -3,-2.0 3,-1.2 1,-0.1 -3,-0.1 -0.713 90.3-114.5-101.9 155.3 16.8 13.3 12.6 577 598 A P T 3 S+ 0 0 124 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.878 116.3 33.6 -51.3 -44.2 20.0 14.5 10.8 578 599 A H T 3 S- 0 0 57 2,-0.4 3,-0.1 -5,-0.1 -3,-0.1 0.363 111.7-110.9 -98.7 5.1 20.3 17.6 12.9 579 600 A G S < S+ 0 0 21 -3,-1.2 -6,-2.6 -6,-0.3 2,-0.3 0.519 91.3 83.5 80.7 1.0 19.0 16.2 16.2 580 601 A V E -S 572 0H 11 -8,-0.3 2,-0.5 -6,-0.1 -2,-0.4 -0.994 64.8-145.5-139.7 146.0 15.8 18.4 15.9 581 602 A R E -S 571 0H 138 -10,-2.9 -10,-2.2 -2,-0.3 2,-0.2 -0.951 24.0-131.3-111.0 122.2 12.5 18.0 14.2 582 603 A L E -S 570 0H 29 -2,-0.5 -12,-0.3 -12,-0.2 3,-0.1 -0.526 5.1-153.8 -74.4 137.8 10.9 21.2 12.9 583 604 A L S S+ 0 0 23 -14,-2.9 2,-0.6 1,-0.3 -13,-0.2 0.642 97.8 46.9 -84.3 -15.4 7.2 21.7 13.8 584 605 A I S > S- 0 0 0 -15,-0.7 3,-0.5 1,-0.1 -1,-0.3 -0.960 83.6-164.4-118.2 102.1 6.8 23.9 10.7 585 606 A E T 3 S+ 0 0 170 -2,-0.6 2,-1.0 1,-0.3 -1,-0.1 0.894 82.3 47.5 -63.0 -37.7 8.6 21.6 8.2 586 607 A D T 3 S+ 0 0 22 -166,-0.3 -1,-0.3 -3,-0.1 3,-0.1 -0.623 71.6 143.2-101.4 68.3 9.0 24.2 5.4 587 608 A Y <> - 0 0 0 -2,-1.0 4,-3.1 -3,-0.5 5,-0.3 -0.902 36.9-160.4-106.7 95.2 10.4 27.0 7.8 588 609 A P H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 5,-0.4 0.872 82.4 46.4 -50.0 -51.3 13.0 28.4 5.4 589 610 A Y H > S+ 0 0 2 -259,-2.0 4,-2.5 1,-0.2 5,-0.1 0.947 118.9 41.9 -58.8 -48.7 15.2 30.2 7.8 590 611 A A H > S+ 0 0 0 -260,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.908 115.4 47.8 -67.2 -42.8 15.4 27.3 10.1 591 612 A A H X S+ 0 0 16 -4,-3.1 4,-1.0 2,-0.2 -1,-0.2 0.914 119.2 39.1 -66.3 -44.1 15.8 24.5 7.5 592 613 A D H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.3 3,-0.3 0.894 114.2 56.4 -71.5 -38.6 18.5 26.3 5.6 593 614 A G H X S+ 0 0 0 -4,-2.5 4,-3.3 -5,-0.4 -2,-0.2 0.884 101.2 56.2 -59.7 -40.7 20.0 27.5 8.9 594 615 A L H X S+ 0 0 5 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.865 105.8 52.3 -62.1 -34.4 20.4 23.9 10.2 595 616 A E H X S+ 0 0 20 -4,-1.0 4,-1.9 -3,-0.3 -1,-0.2 0.947 113.8 41.6 -65.1 -48.4 22.4 23.1 7.1 596 617 A I H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.938 113.2 54.2 -64.4 -44.9 24.8 26.0 7.6 597 618 A W H X S+ 0 0 20 -4,-3.3 4,-2.4 1,-0.2 -1,-0.2 0.907 108.8 49.3 -53.1 -46.8 24.9 25.3 11.4 598 619 A A H X S+ 0 0 27 -4,-2.3 4,-2.6 -5,-0.2 -1,-0.2 0.880 109.0 51.9 -62.0 -40.9 25.9 21.7 10.7 599 620 A A H X S+ 0 0 2 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.922 111.6 46.3 -63.9 -44.0 28.7 22.7 8.3 600 621 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.929 111.2 53.1 -63.8 -42.1 30.2 25.1 10.8 601 622 A K H X S+ 0 0 87 -4,-2.4 4,-2.9 -5,-0.2 5,-0.2 0.941 108.1 49.6 -58.0 -49.3 29.9 22.4 13.5 602 623 A T H X S+ 0 0 78 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.901 112.1 49.8 -55.9 -42.1 31.8 19.8 11.4 603 624 A W H X S+ 0 0 5 -4,-1.9 4,-2.2 2,-0.2 3,-0.3 0.938 112.9 44.1 -64.6 -48.2 34.5 22.4 10.7 604 625 A V H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.925 112.9 52.9 -64.0 -43.0 35.0 23.4 14.4 605 626 A Q H < S+ 0 0 92 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.754 113.2 44.0 -63.0 -27.1 34.9 19.7 15.4 606 627 A E H < S+ 0 0 58 -4,-1.4 4,-0.4 -3,-0.3 -1,-0.2 0.812 115.8 47.6 -86.8 -32.0 37.6 18.9 12.9 607 628 A Y H >X S+ 0 0 1 -4,-2.2 3,-1.7 -5,-0.2 4,-0.5 0.955 104.0 56.6 -72.6 -53.0 39.8 21.9 13.7 608 629 A V H >X S+ 0 0 1 -4,-2.6 3,-2.0 1,-0.3 4,-2.0 0.872 100.9 56.9 -48.8 -48.7 39.8 21.7 17.5 609 630 A P H 34 S+ 0 0 76 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.704 94.7 68.1 -59.2 -21.4 41.3 18.2 17.7 610 631 A L H <4 S+ 0 0 49 -3,-1.7 -2,-0.2 -4,-0.4 3,-0.1 0.743 117.6 22.8 -69.5 -21.6 44.3 19.3 15.6 611 632 A Y H << S+ 0 0 33 -3,-2.0 2,-0.4 -4,-0.5 -1,-0.2 0.596 124.8 47.8-120.2 -16.4 45.3 21.4 18.6 612 633 A Y < + 0 0 3 -4,-2.0 -1,-0.3 1,-0.1 3,-0.1 -0.970 51.7 179.5-132.7 115.5 43.7 19.8 21.6 613 634 A A + 0 0 76 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.851 69.8 10.6 -81.9 -37.8 43.9 16.1 22.2 614 635 A R S >> S- 0 0 179 1,-0.1 3,-1.2 36,-0.0 4,-0.8 -0.905 80.1 -99.1-139.6 167.9 42.0 15.9 25.4 615 636 A D H >> S+ 0 0 70 -2,-0.3 4,-2.0 1,-0.3 3,-0.8 0.836 119.5 61.4 -55.2 -34.4 39.8 17.9 27.8 616 637 A D H 3> S+ 0 0 101 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.836 96.3 58.8 -62.9 -33.1 42.8 18.5 30.0 617 638 A D H <4 S+ 0 0 70 -3,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.765 107.2 47.9 -66.2 -27.5 44.6 20.3 27.1 618 639 A V H X< S+ 0 0 0 -4,-0.8 3,-1.2 -3,-0.8 -2,-0.2 0.892 111.3 49.3 -79.4 -41.8 41.7 22.8 27.0 619 640 A K H 3< S+ 0 0 112 -4,-2.0 -2,-0.2 30,-0.4 -3,-0.1 0.848 111.5 50.3 -66.0 -32.5 41.8 23.3 30.8 620 641 A N T 3< S+ 0 0 126 -4,-2.1 2,-1.0 -5,-0.2 -1,-0.2 0.290 78.0 108.0 -92.2 10.4 45.5 23.9 30.8 621 642 A D <> - 0 0 5 -3,-1.2 4,-2.5 1,-0.2 5,-0.2 -0.790 52.5-166.0 -88.3 107.0 45.6 26.5 28.0 622 643 A S H > S+ 0 0 69 -2,-1.0 4,-1.9 2,-0.2 -1,-0.2 0.861 85.1 48.3 -62.9 -37.9 46.4 29.7 30.0 623 644 A E H > S+ 0 0 15 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.945 112.3 48.4 -68.2 -46.9 45.5 32.0 27.1 624 645 A L H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.904 112.8 48.4 -60.0 -42.9 42.2 30.2 26.4 625 646 A Q H X S+ 0 0 37 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.889 113.6 45.7 -67.0 -38.5 41.2 30.3 30.1 626 647 A H H X S+ 0 0 104 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.879 111.4 54.7 -70.0 -36.5 42.0 33.9 30.5 627 648 A W H X S+ 0 0 0 -4,-2.6 4,-2.5 -131,-0.2 -2,-0.2 0.961 113.2 39.6 -59.3 -56.9 40.2 34.7 27.2 628 649 A W H X S+ 0 0 13 -4,-2.4 4,-2.3 1,-0.2 5,-0.3 0.915 113.2 54.2 -63.5 -46.0 37.0 33.1 28.3 629 650 A K H X S+ 0 0 121 -4,-2.2 4,-2.4 -5,-0.2 5,-0.2 0.889 114.7 42.3 -56.2 -38.7 37.1 34.3 31.9 630 651 A E H X>S+ 0 0 25 -4,-1.9 4,-2.3 2,-0.2 5,-2.2 0.888 108.8 56.2 -77.0 -38.3 37.4 37.8 30.6 631 652 A A H <>S+ 0 0 0 -4,-2.5 5,-1.8 3,-0.2 -2,-0.2 0.923 119.8 33.3 -59.4 -42.3 34.9 37.6 27.8 632 653 A V H <5S+ 0 0 14 -4,-2.3 7,-0.3 3,-0.2 -2,-0.2 0.952 123.2 41.1 -78.0 -53.6 32.3 36.5 30.4 633 654 A E H <5S+ 0 0 76 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.2 0.758 136.2 13.0 -71.7 -24.8 33.3 38.4 33.5 634 655 A K T ><5S+ 0 0 124 -4,-2.3 3,-1.3 -5,-0.2 -3,-0.2 0.765 127.3 48.0-114.1 -55.2 34.1 41.7 31.8 635 656 A G T 3 S- 0 0 41 -32,-0.1 4,-1.8 1,-0.1 5,-0.1 -0.918 83.4-114.6-138.2 163.8 36.4 20.2 27.9 651 672 A L H > S+ 0 0 43 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.883 117.6 57.3 -63.4 -39.3 36.8 19.8 24.1 652 673 A E H > S+ 0 0 151 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.917 107.1 46.0 -57.8 -48.7 33.0 19.8 23.9 653 674 A D H > S+ 0 0 29 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.858 111.5 51.7 -64.3 -37.8 32.7 23.2 25.6 654 675 A L H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.937 111.8 46.9 -66.0 -44.1 35.4 24.7 23.4 655 676 A V H X S+ 0 0 18 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.935 113.0 50.3 -61.6 -47.0 33.6 23.4 20.3 656 677 A E H X S+ 0 0 66 -4,-2.7 4,-2.6 -5,-0.2 5,-0.2 0.950 111.5 46.3 -56.6 -53.9 30.3 24.7 21.6 657 678 A V H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.920 116.2 44.4 -57.8 -47.3 31.6 28.2 22.3 658 679 A C H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.2 5,-0.2 0.906 112.4 52.7 -64.7 -42.0 33.4 28.6 19.0 659 680 A L H X S+ 0 0 7 -4,-2.9 4,-2.4 -5,-0.2 -2,-0.2 0.927 111.0 46.3 -59.5 -46.6 30.5 27.2 17.0 660 681 A I H X S+ 0 0 2 -4,-2.6 4,-2.5 -5,-0.2 5,-0.2 0.917 112.7 50.2 -64.9 -42.7 28.0 29.7 18.6 661 682 A I H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.942 113.1 45.2 -61.4 -46.7 30.4 32.6 18.1 662 683 A I H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 5,-0.3 0.896 112.7 52.6 -64.2 -38.0 30.9 31.7 14.4 663 684 A W H <>S+ 0 0 2 -4,-2.4 5,-2.6 -5,-0.2 6,-0.5 0.947 110.4 46.0 -61.9 -50.0 27.1 31.2 13.9 664 685 A I H <>S+ 0 0 0 -4,-2.5 5,-1.4 1,-0.2 -1,-0.2 0.918 115.8 46.4 -59.7 -44.9 26.2 34.5 15.4 665 686 A A H <5S+ 0 0 0 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.783 126.2 21.6 -71.8 -30.7 28.8 36.4 13.3 666 687 A S T X5S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.2 5,-0.2 0.797 130.1 16.9-101.7 -85.9 28.2 34.8 10.0 667 688 A A H >5S+ 0 0 0 -5,-0.3 4,-2.6 2,-0.2 5,-0.2 0.844 123.7 50.7 -63.2 -41.8 24.8 33.1 9.2 668 689 A L H >X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 3,-0.5 0.944 108.5 51.8 -62.6 -44.4 23.3 37.5 7.4 671 692 A A H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.831 117.4 37.9 -62.1 -33.8 19.8 36.1 7.8 672 693 A V H 3< S+ 0 0 0 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.558 123.9 40.4 -96.4 -5.5 18.7 39.1 9.7 673 694 A N H X< S+ 0 0 0 -4,-1.3 3,-2.1 -3,-0.5 4,-0.2 0.854 100.9 56.8-107.5 -48.9 20.6 41.7 7.8 674 695 A F T 3< S+ 0 0 2 -4,-2.1 135,-0.4 1,-0.3 -3,-0.1 0.530 101.8 58.2 -74.5 0.4 20.7 41.2 4.0 675 696 A G T 3>>S+ 0 0 0 -5,-0.3 4,-2.6 -4,-0.2 5,-0.6 0.358 77.3 103.4-100.9 4.9 16.9 41.1 3.6 676 697 A N H <>5S+ 0 0 9 -3,-2.1 4,-2.3 1,-0.2 55,-0.1 0.937 93.7 22.8 -53.0 -59.6 16.6 44.6 5.1 677 698 A Y H >5S+ 0 0 3 53,-0.6 4,-2.4 -4,-0.2 -366,-0.2 0.894 118.2 63.2 -78.4 -38.7 16.1 46.6 1.9 678 699 A P H 45S+ 0 0 0 0, 0.0 -367,-2.6 0, 0.0 -2,-0.2 0.910 125.0 17.2 -52.4 -39.9 14.8 43.6 -0.1 679 700 A Y H ><5S+ 0 0 0 -4,-2.6 3,-0.6 -369,-0.1 -2,-0.2 0.833 133.7 42.7 -98.1 -38.2 11.8 43.4 2.2 680 701 A G H 3< S- 0 0 0 -3,-0.6 3,-1.7 -5,-0.1 4,-1.4 -0.965 81.8-153.4-108.5 108.3 8.7 49.3 0.6 683 704 A I T 34 S+ 0 0 2 -2,-0.7 35,-0.2 1,-0.3 -1,-0.1 0.810 90.9 61.1 -56.9 -29.6 7.8 51.2 3.7 684 705 A M T 34 S+ 0 0 1 1,-0.2 -1,-0.3 2,-0.2 -4,-0.1 0.820 104.5 49.4 -67.1 -27.0 4.3 49.8 3.8 685 706 A N T <4 S+ 0 0 11 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.820 128.1 20.5 -80.6 -33.3 5.7 46.2 4.1 686 707 A R S < S- 0 0 16 -4,-1.4 -1,-0.2 -6,-0.2 -2,-0.2 -0.540 78.6-171.4-135.2 70.3 8.0 47.1 6.9 687 708 A P - 0 0 0 0, 0.0 -217,-0.3 0, 0.0 -3,-0.1 -0.391 11.4-159.1 -63.2 140.6 6.9 50.3 8.7 688 709 A T S S+ 0 0 10 1,-0.1 -151,-2.4 -153,-0.1 2,-0.3 0.567 70.9 17.9 -96.3 -10.4 9.4 51.5 11.3 689 710 A A - 0 0 13 -153,-0.2 29,-0.8 -152,-0.1 2,-0.4 -0.984 57.5-147.1-158.3 153.7 6.9 53.6 13.3 690 711 A S B -T 717 0I 1 -2,-0.3 -284,-2.2 27,-0.2 27,-0.2 -0.982 8.2-170.6-127.1 144.3 3.2 54.2 14.0 691 712 A R + 0 0 47 25,-2.7 2,-0.3 -2,-0.4 -286,-0.2 0.443 64.6 25.2-116.5 -6.2 1.9 57.7 14.8 692 713 A R - 0 0 55 -286,-0.4 -1,-0.2 24,-0.4 -286,-0.2 -0.981 69.8-121.1-155.6 156.7 -1.7 57.2 15.9 693 714 A L - 0 0 31 -2,-0.3 -2,-0.1 1,-0.2 -285,-0.0 -0.260 58.0 -63.0 -89.1-179.8 -3.9 54.5 17.4 694 715 A L - 0 0 19 1,-0.1 -1,-0.2 -2,-0.1 8,-0.1 -0.436 63.5-109.9 -65.8 139.9 -7.1 53.1 15.8 695 716 A P - 0 0 30 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.333 24.1-116.4 -72.7 153.6 -9.7 55.8 15.3 696 717 A E > - 0 0 108 1,-0.1 3,-0.8 -2,-0.1 6,-0.5 -0.618 38.1 -99.2 -85.9 146.4 -13.0 56.0 17.2 697 718 A K T 3 S+ 0 0 151 -2,-0.2 -1,-0.1 1,-0.2 4,-0.1 -0.246 107.4 37.1 -60.5 155.1 -16.2 55.6 15.3 698 719 A G T 3 S+ 0 0 76 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.0 0.691 94.8 108.5 75.3 18.4 -18.0 58.9 14.5 699 720 A T S <> S- 0 0 36 -3,-0.8 4,-2.2 1,-0.1 -1,-0.3 -0.866 80.5-115.6-123.4 158.7 -14.8 60.8 13.9 700 721 A P H > S+ 0 0 96 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.873 116.4 58.8 -60.8 -34.7 -13.2 62.1 10.6 701 722 A E H > S+ 0 0 86 1,-0.2 4,-1.4 2,-0.2 -4,-0.1 0.894 106.7 47.7 -60.5 -41.1 -10.3 59.7 11.1 702 723 A Y H > S+ 0 0 41 -6,-0.5 4,-1.2 -3,-0.3 3,-0.4 0.935 109.9 51.6 -66.3 -44.1 -12.8 56.8 11.1 703 724 A E H X S+ 0 0 87 -4,-2.2 4,-2.7 1,-0.2 3,-0.2 0.859 104.9 58.7 -60.7 -32.1 -14.5 58.1 8.0 704 725 A E H X S+ 0 0 32 -4,-2.2 4,-3.2 1,-0.2 8,-0.3 0.876 98.1 57.9 -65.2 -37.6 -11.1 58.3 6.3 705 726 A M H < S+ 0 0 4 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.868 112.4 43.1 -59.9 -33.3 -10.5 54.6 6.8 706 727 A I H < S+ 0 0 81 -4,-1.2 3,-0.3 -3,-0.2 -2,-0.2 0.937 125.2 30.2 -76.2 -48.7 -13.7 54.1 4.9 707 728 A N H < S+ 0 0 124 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.683 134.3 20.0 -87.9 -21.8 -13.2 56.6 2.1 708 729 A N X + 0 0 74 -4,-3.2 4,-2.2 -5,-0.2 3,-0.3 -0.535 63.0 167.7-150.1 73.9 -9.4 56.7 1.7 709 730 A H H > S+ 0 0 78 -3,-0.3 4,-2.4 1,-0.2 5,-0.2 0.836 78.2 55.7 -62.4 -34.2 -7.8 53.6 3.2 710 731 A E H > S+ 0 0 55 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.906 110.3 45.8 -66.7 -37.7 -4.4 54.2 1.6 711 732 A K H > S+ 0 0 25 -3,-0.3 4,-2.5 2,-0.2 5,-0.2 0.892 109.9 54.0 -70.7 -38.8 -4.2 57.6 3.3 712 733 A A H X S+ 0 0 0 -4,-2.2 4,-0.9 -8,-0.3 -2,-0.2 0.930 112.3 46.0 -58.5 -42.7 -5.5 56.2 6.6 713 734 A Y H >X S+ 0 0 6 -4,-2.4 4,-2.1 1,-0.2 3,-0.6 0.936 112.8 48.1 -65.5 -48.9 -2.6 53.7 6.4 714 735 A L H 3< S+ 0 0 2 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.840 108.5 53.6 -64.7 -31.3 0.0 56.3 5.4 715 736 A R H 3< S+ 0 0 104 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.746 110.7 50.5 -73.5 -22.6 -1.0 58.7 8.2 716 737 A T H << S+ 0 0 4 -4,-0.9 -25,-2.7 -3,-0.6 -24,-0.4 0.879 107.5 55.4 -82.1 -42.3 -0.5 55.8 10.6 717 738 A I B < S-T 690 0I 0 -4,-2.1 -27,-0.2 -27,-0.2 -33,-0.1 -0.171 107.4 -42.2 -87.4-179.8 3.0 54.6 9.5 718 739 A T - 0 0 3 -29,-0.8 -1,-0.2 -35,-0.2 -2,-0.1 -0.107 67.0-115.6 -39.3 129.2 6.4 56.3 9.2 719 740 A S > - 0 0 17 -3,-0.1 4,-1.9 1,-0.1 5,-0.2 -0.195 28.2-102.2 -68.3 162.1 6.1 59.7 7.6 720 741 A K H > S+ 0 0 15 -460,-0.4 4,-2.4 2,-0.2 5,-0.2 0.872 115.0 52.7 -54.7 -46.6 7.7 60.4 4.3 721 742 A L H > S+ 0 0 35 -461,-0.5 4,-1.7 1,-0.2 -1,-0.2 0.979 113.7 40.9 -60.6 -56.3 10.8 62.3 5.5 722 743 A P H > S+ 0 0 28 0, 0.0 4,-3.0 0, 0.0 -1,-0.2 0.841 111.4 60.3 -62.2 -26.5 12.0 59.6 8.0 723 744 A T H X S+ 0 0 0 -4,-1.9 4,-2.9 2,-0.2 5,-0.3 0.940 102.9 50.5 -63.5 -44.8 11.0 57.0 5.4 724 745 A L H X S+ 0 0 0 -4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.905 114.0 45.3 -59.2 -39.1 13.6 58.6 2.9 725 746 A I H X S+ 0 0 5 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.934 114.9 45.6 -69.7 -47.5 16.3 58.4 5.6 726 747 A S H X S+ 0 0 5 -4,-3.0 4,-2.5 1,-0.2 5,-0.3 0.874 110.0 53.9 -67.7 -36.0 15.5 54.9 6.8 727 748 A L H X S+ 0 0 3 -4,-2.9 4,-1.6 -5,-0.2 -1,-0.2 0.894 109.2 50.6 -62.8 -38.1 15.3 53.5 3.2 728 749 A S H X S+ 0 0 0 -4,-1.3 4,-1.9 -5,-0.3 -2,-0.2 0.922 110.8 48.3 -65.7 -41.1 18.7 55.0 2.6 729 750 A V H X S+ 0 0 4 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.948 112.8 45.3 -65.8 -47.6 20.1 53.4 5.7 730 751 A I H X S+ 0 0 17 -4,-2.5 4,-1.4 1,-0.2 -53,-0.6 0.785 108.0 59.1 -70.0 -23.8 18.8 49.9 5.1 731 752 A E H < S+ 0 0 12 -4,-1.6 3,-0.3 -5,-0.3 4,-0.3 0.947 108.7 45.0 -67.1 -44.1 19.9 50.1 1.5 732 753 A I H >< S+ 0 0 1 -4,-1.9 3,-1.7 1,-0.2 -2,-0.2 0.948 112.7 51.4 -59.8 -48.0 23.5 50.6 2.7 733 754 A L H 3< S+ 0 0 9 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.745 107.2 53.3 -63.2 -25.1 23.1 47.8 5.2 734 755 A S T 3< S+ 0 0 0 -4,-1.4 75,-0.4 -3,-0.3 2,-0.4 0.389 89.8 100.2 -91.7 1.4 21.8 45.3 2.7 735 756 A T < - 0 0 27 -3,-1.7 2,-0.6 -4,-0.3 72,-0.2 -0.750 64.6-141.7 -94.9 134.1 24.8 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