==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 31-OCT-07 3B7T . COMPND 2 MOLECULE: LEUKOTRIENE A-4 HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.THOLANDER,J.HAEGGSTROM,M.THUNNISSEN,A.MUROYA,B.-P.ROQUES, . 613 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24507.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 443 72.3 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 . 95 15.5 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 38 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 78 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 189 30.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.6 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 1 1 0 0 5 2 2 1 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 . 2 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 0 1 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 0 185 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 60.4 19.1 -16.1 16.0 2 2 A E + 0 0 141 2,-0.0 2,-0.4 0, 0.0 0, 0.0 -0.763 360.0 170.8 -93.2 126.3 18.7 -16.4 12.3 3 3 A I - 0 0 54 -2,-0.5 2,-0.2 2,-0.0 0, 0.0 -0.962 11.5-167.7-135.4 112.3 19.9 -13.5 10.1 4 4 A V - 0 0 85 -2,-0.4 2,-1.0 8,-0.1 3,-0.1 -0.649 28.9-111.7 -98.5 158.1 20.0 -14.1 6.3 5 5 A D > - 0 0 23 -2,-0.2 3,-1.7 1,-0.2 305,-0.0 -0.779 25.1-168.5 -92.4 102.1 21.7 -11.8 3.8 6 6 A T T 3 S+ 0 0 36 -2,-1.0 365,-0.3 1,-0.3 -1,-0.2 0.679 83.8 60.9 -63.9 -16.1 18.8 -10.3 1.8 7 7 A C T 3 S+ 0 0 0 363,-0.1 2,-0.3 -3,-0.1 -1,-0.3 0.564 95.4 74.8 -88.6 -8.0 21.3 -9.0 -0.8 8 8 A S < - 0 0 21 -3,-1.7 141,-0.1 1,-0.1 139,-0.1 -0.794 50.9-170.3-109.4 150.4 22.5 -12.4 -1.8 9 9 A L + 0 0 32 -2,-0.3 -1,-0.1 73,-0.2 2,-0.1 0.318 63.1 102.0-111.5 0.5 20.9 -15.2 -3.9 10 10 A A S S- 0 0 15 1,-0.1 44,-0.2 138,-0.1 -2,-0.1 -0.281 89.0 -79.8 -81.8 168.6 23.6 -17.7 -2.9 11 11 A S - 0 0 14 42,-2.4 -1,-0.1 1,-0.1 44,-0.1 -0.504 58.5-110.5 -67.5 136.7 23.4 -20.5 -0.4 12 12 A P >> - 0 0 54 0, 0.0 3,-2.5 0, 0.0 4,-1.8 -0.220 23.1-105.8 -69.1 157.7 23.9 -19.1 3.1 13 13 A A T 34 S+ 0 0 31 1,-0.3 -2,-0.1 2,-0.2 4,-0.0 0.626 118.6 67.5 -59.1 -13.0 26.9 -19.7 5.3 14 14 A S T 34 S+ 0 0 63 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.641 106.7 38.9 -82.8 -13.6 24.7 -22.0 7.4 15 15 A V T <4 S- 0 0 21 -3,-2.5 30,-3.0 1,-0.4 31,-0.7 0.830 134.8 -22.5 -99.0 -48.4 24.5 -24.4 4.4 16 16 A C E < -A 44 0A 2 -4,-1.8 -1,-0.4 28,-0.3 2,-0.4 -0.979 57.5-148.8-161.4 151.4 28.0 -24.2 3.0 17 17 A R E -A 43 0A 95 26,-2.7 26,-2.6 -2,-0.3 2,-0.4 -0.993 19.6-121.7-135.4 138.4 30.9 -21.8 3.1 18 18 A T E +A 42 0A 6 -2,-0.4 24,-0.2 24,-0.2 3,-0.1 -0.584 25.8 179.7 -73.5 126.9 33.7 -21.0 0.7 19 19 A K E + 0 0 74 22,-3.1 136,-1.5 -2,-0.4 2,-0.3 0.724 63.0 5.7-100.7 -27.9 37.2 -21.6 2.2 20 20 A H E -Ab 41 155A 49 21,-1.2 21,-2.8 134,-0.2 2,-0.5 -0.976 53.4-153.5-160.6 141.2 39.5 -20.7 -0.6 21 21 A L E -Ab 40 156A 4 134,-2.4 136,-2.1 -2,-0.3 2,-0.6 -0.973 6.5-169.7-118.7 122.5 39.4 -19.3 -4.1 22 22 A H E -Ab 39 157A 50 17,-2.5 17,-2.8 -2,-0.5 2,-0.4 -0.951 16.5-165.0-111.0 116.6 42.1 -20.1 -6.7 23 23 A L E +Ab 38 158A 8 134,-2.6 136,-2.1 -2,-0.6 2,-0.4 -0.823 18.0 177.9-106.6 136.0 41.7 -17.8 -9.7 24 24 A R E +Ab 37 159A 106 13,-2.6 13,-2.7 -2,-0.4 2,-0.3 -0.931 25.7 150.3-133.2 107.2 43.3 -18.2 -13.1 25 25 A C E -Ab 36 160A 9 134,-2.3 136,-2.7 -2,-0.4 2,-0.4 -0.949 36.9-139.8-141.2 163.2 42.3 -15.5 -15.6 26 26 A S E -Ab 35 161A 37 9,-3.6 9,-2.3 -2,-0.3 2,-0.6 -0.953 19.4-135.1-121.6 137.8 43.4 -13.6 -18.6 27 27 A V E -A 34 0A 0 134,-2.6 2,-0.6 -2,-0.4 7,-0.2 -0.837 19.6-167.5 -95.0 121.4 42.7 -9.9 -19.1 28 28 A D E >>> +A 33 0A 39 5,-2.3 5,-1.6 -2,-0.6 4,-1.3 -0.843 13.4 179.3-116.9 98.3 41.6 -9.1 -22.7 29 29 A F T 345S+ 0 0 40 -2,-0.6 -1,-0.1 1,-0.2 101,-0.1 0.648 80.4 61.5 -68.6 -17.7 41.6 -5.4 -23.6 30 30 A T T 345S+ 0 0 132 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.845 120.3 23.7 -78.3 -33.8 40.3 -6.1 -27.1 31 31 A R T <45S- 0 0 119 -3,-0.5 -2,-0.2 2,-0.2 -1,-0.2 0.433 100.6-129.0-108.5 -3.9 37.0 -7.7 -25.9 32 32 A R T <5 + 0 0 97 -4,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.929 66.7 126.8 53.5 46.9 37.0 -5.9 -22.5 33 33 A T E < -A 28 0A 4 -5,-1.6 -5,-2.3 78,-0.1 2,-0.5 -0.954 57.5-141.5-133.8 153.8 36.5 -9.3 -20.9 34 34 A L E -A 27 0A 4 -2,-0.3 74,-2.2 -7,-0.2 2,-0.4 -0.973 29.4-174.6-112.2 123.2 38.2 -11.2 -18.1 35 35 A T E +AC 26 107A 49 -9,-2.3 -9,-3.6 -2,-0.5 2,-0.3 -0.969 26.4 81.4-125.9 141.7 38.3 -14.9 -18.9 36 36 A G E -AC 25 106A 16 70,-1.8 70,-2.3 -2,-0.4 2,-0.4 -0.992 66.7 -61.8 163.7-161.1 39.5 -17.9 -16.9 37 37 A T E -AC 24 105A 19 -13,-2.7 -13,-2.6 -2,-0.3 2,-0.5 -0.905 24.4-158.0-122.3 149.5 38.6 -20.3 -14.2 38 38 A A E -AC 23 104A 1 66,-2.0 66,-2.7 -2,-0.4 2,-0.8 -0.986 9.9-160.8-123.8 115.0 37.7 -19.9 -10.5 39 39 A A E -AC 22 103A 11 -17,-2.8 -17,-2.5 -2,-0.5 2,-0.5 -0.887 10.4-162.8 -99.9 111.7 38.3 -23.0 -8.4 40 40 A L E -AC 21 102A 5 62,-2.8 62,-3.0 -2,-0.8 2,-0.8 -0.845 11.6-151.6 -99.1 125.0 36.2 -22.7 -5.2 41 41 A T E -AC 20 101A 29 -21,-2.8 -22,-3.1 -2,-0.5 -21,-1.2 -0.855 27.2-172.1 -91.5 112.4 37.1 -24.9 -2.3 42 42 A V E -AC 18 100A 5 58,-2.9 58,-2.2 -2,-0.8 2,-0.5 -0.861 15.0-153.6-112.7 145.6 33.7 -25.2 -0.5 43 43 A Q E -AC 17 99A 14 -26,-2.6 -26,-2.7 -2,-0.4 56,-0.2 -0.967 16.9-129.6-120.1 128.6 32.9 -26.8 2.8 44 44 A S E -A 16 0A 0 54,-2.6 53,-2.3 -2,-0.5 -28,-0.3 -0.438 17.4-174.1 -74.4 146.0 29.5 -28.2 3.7 45 45 A Q + 0 0 32 -30,-3.0 2,-0.3 51,-0.2 -29,-0.2 0.345 69.9 57.9-116.6 -1.1 27.8 -27.2 6.9 46 46 A E S S- 0 0 78 -31,-0.7 3,-0.5 49,-0.1 2,-0.3 -0.844 86.6-103.7-126.5 165.3 24.9 -29.6 6.5 47 47 A D S S+ 0 0 123 -2,-0.3 48,-0.2 1,-0.2 47,-0.1 -0.670 97.9 9.7 -90.5 142.6 24.5 -33.4 6.1 48 48 A N S S- 0 0 82 46,-0.5 2,-0.4 -2,-0.3 -1,-0.2 0.921 78.3-176.4 58.6 49.4 23.7 -34.9 2.7 49 49 A L E +H 94 0B 10 45,-2.6 45,-2.2 -3,-0.5 -1,-0.2 -0.661 12.0 170.2 -79.1 127.6 24.3 -31.6 0.7 50 50 A R E + 0 0 153 -2,-0.4 40,-1.9 1,-0.3 2,-0.3 0.513 59.1 11.5-116.9 -8.2 23.5 -32.3 -2.9 51 51 A S E -H 89 0B 41 38,-0.2 2,-0.3 2,-0.0 -1,-0.3 -0.980 55.9-160.0-164.0 157.6 23.5 -28.8 -4.5 52 52 A L E -H 88 0B 4 36,-1.9 36,-2.9 -2,-0.3 2,-0.4 -0.991 14.1-134.9-144.9 150.1 24.5 -25.2 -3.8 53 53 A V E -H 87 0B 28 -2,-0.3 -42,-2.4 34,-0.2 2,-0.3 -0.862 18.5-170.2-109.8 143.4 23.6 -21.8 -5.3 54 54 A L E -H 86 0B 3 32,-2.0 32,-2.8 -2,-0.4 2,-0.3 -0.898 24.0-112.4-127.8 157.1 26.0 -19.0 -6.2 55 55 A D E +HI 85 146B 0 91,-2.6 91,-1.4 -2,-0.3 2,-0.3 -0.650 38.3 164.7 -89.1 147.3 25.6 -15.4 -7.2 56 56 A T E -H 84 0B 4 28,-1.0 28,-1.8 26,-0.3 2,-0.3 -0.962 16.5-167.9-154.2 156.4 26.4 -14.2 -10.7 57 57 A K S S- 0 0 18 84,-1.3 52,-0.2 -2,-0.3 56,-0.2 -0.782 74.9 -20.6-156.2 106.1 25.6 -11.1 -12.6 58 58 A D S S+ 0 0 44 -2,-0.3 51,-0.6 1,-0.2 2,-0.4 0.834 93.9 141.4 64.8 33.6 26.2 -10.7 -16.4 59 59 A L E -D 108 0A 17 49,-0.2 2,-0.7 82,-0.1 -1,-0.2 -0.849 48.9-138.0-106.5 146.9 28.7 -13.5 -16.4 60 60 A T E -D 107 0A 92 47,-2.6 47,-0.6 -2,-0.4 2,-0.4 -0.896 19.4-155.5-105.0 105.1 28.9 -16.1 -19.2 61 61 A I E -D 106 0A 19 -2,-0.7 45,-0.2 45,-0.2 3,-0.1 -0.672 16.1-180.0 -83.6 128.3 29.5 -19.6 -17.8 62 62 A E E - 0 0 137 43,-3.1 2,-0.3 -2,-0.4 -1,-0.2 0.875 62.3 -31.4 -92.0 -45.4 31.2 -22.1 -20.1 63 63 A K E -D 105 0A 65 42,-1.0 42,-2.8 2,-0.0 2,-0.5 -0.978 44.1-133.3-170.5 159.6 31.2 -25.1 -17.8 64 64 A V E -D 104 0A 1 7,-0.4 7,-2.3 -2,-0.3 2,-0.4 -0.990 23.8-167.8-124.4 125.8 31.5 -26.4 -14.2 65 65 A V E +DE 103 70A 22 38,-3.0 38,-2.2 -2,-0.5 2,-0.4 -0.960 9.9 174.9-122.2 131.6 33.9 -29.2 -13.4 66 66 A I E > S-DE 102 69A 2 3,-2.7 3,-2.1 -2,-0.4 36,-0.1 -1.000 74.7 -4.8-132.4 133.2 34.0 -31.3 -10.1 67 67 A N T 3 S- 0 0 110 34,-0.6 -1,-0.1 -2,-0.4 3,-0.1 0.862 131.1 -56.3 53.1 37.0 36.3 -34.3 -9.6 68 68 A G T 3 S+ 0 0 62 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.449 119.1 99.3 78.6 0.4 37.4 -34.0 -13.2 69 69 A Q E < S-E 66 0A 138 -3,-2.1 -3,-2.7 0, 0.0 2,-0.2 -0.869 74.6-111.1-121.6 154.6 33.9 -34.3 -14.7 70 70 A E E -E 65 0A 135 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.593 37.8-160.0 -81.4 142.6 31.4 -31.8 -16.0 71 71 A V - 0 0 19 -7,-2.3 -7,-0.4 -2,-0.2 2,-0.2 -0.778 20.7 -93.8-123.7 167.1 28.3 -31.3 -13.9 72 72 A K + 0 0 164 17,-0.3 17,-2.7 -2,-0.3 2,-0.3 -0.513 45.6 161.6 -78.0 143.9 24.7 -29.9 -14.2 73 73 A Y E -J 88 0B 82 15,-0.2 2,-0.3 -2,-0.2 15,-0.2 -0.974 18.7-156.8-158.7 151.8 24.0 -26.3 -13.3 74 74 A A E -J 87 0B 58 13,-2.3 13,-2.6 -2,-0.3 2,-0.6 -0.987 11.1-140.2-138.0 147.8 21.2 -23.9 -14.0 75 75 A L E -J 86 0B 81 -2,-0.3 11,-0.2 11,-0.2 3,-0.1 -0.931 20.4-147.6-110.0 119.0 20.9 -20.1 -14.1 76 76 A G - 0 0 37 9,-2.6 2,-0.3 -2,-0.6 3,-0.1 -0.050 39.5 -69.4 -71.1-176.7 17.7 -18.6 -12.7 77 77 A E - 0 0 164 1,-0.1 -1,-0.2 7,-0.1 0, 0.0 -0.572 59.0 -97.8 -79.9 138.2 16.1 -15.4 -14.0 78 78 A R - 0 0 102 -2,-0.3 6,-0.2 6,-0.1 2,-0.2 -0.078 27.0-156.1 -51.1 150.0 17.9 -12.2 -13.3 79 79 A Q > - 0 0 91 4,-1.2 3,-2.2 1,-0.5 4,-0.2 -0.587 40.5-103.7-132.7 69.2 16.7 -10.2 -10.3 80 80 A S G > S+ 0 0 76 1,-0.3 3,-2.3 2,-0.2 -1,-0.5 -0.102 98.5 0.8 45.4-134.8 17.8 -6.7 -11.1 81 81 A Y G 3 S+ 0 0 29 1,-0.3 -1,-0.3 -3,-0.1 57,-0.0 0.632 128.2 65.6 -56.0 -17.8 20.8 -5.5 -9.2 82 82 A K G < S- 0 0 23 -3,-2.2 -26,-0.3 1,-0.2 -1,-0.3 0.720 94.7-152.2 -78.4 -19.3 21.0 -8.9 -7.4 83 83 A G < - 0 0 0 -3,-2.3 -4,-1.2 -4,-0.2 -26,-0.3 -0.399 32.8 -38.9 82.5-160.9 21.9 -10.7 -10.7 84 84 A S E -H 56 0B 22 -28,-1.8 -28,-1.0 -6,-0.2 2,-0.2 -0.837 50.8-126.3-109.1 140.7 21.1 -14.3 -11.5 85 85 A P E -H 55 0B 24 0, 0.0 -9,-2.6 0, 0.0 2,-0.6 -0.609 18.4-153.7 -81.8 142.7 21.3 -17.3 -9.1 86 86 A M E -HJ 54 75B 0 -32,-2.8 -32,-2.0 -2,-0.2 2,-0.6 -0.935 7.0-161.4-120.4 106.8 23.5 -20.2 -10.4 87 87 A E E -HJ 53 74B 97 -13,-2.6 -13,-2.3 -2,-0.6 2,-0.4 -0.795 5.9-164.2 -93.7 123.7 22.5 -23.6 -8.9 88 88 A I E -HJ 52 73B 0 -36,-2.9 -36,-1.9 -2,-0.6 2,-0.6 -0.889 11.7-142.2-109.5 133.9 25.1 -26.3 -9.2 89 89 A S E -H 51 0B 57 -17,-2.7 -17,-0.3 -2,-0.4 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-299,-0.5 -1,-0.3 1,-0.2 -298,-0.1 0.757 117.0 21.1 -54.8 -27.5 31.2 12.9 -3.7 566 566 A F H <> S+ 0 0 0 -3,-2.2 4,-2.6 3,-0.1 5,-0.2 0.795 121.0 55.2-105.9 -53.0 31.7 15.8 -6.1 567 567 A T H X S+ 0 0 2 -4,-2.3 4,-2.2 1,-0.2 5,-0.3 0.889 106.9 50.0 -52.1 -46.9 30.3 14.7 -9.4 568 568 A R H X S+ 0 0 61 -4,-1.7 4,-2.1 -5,-0.2 -1,-0.2 0.953 113.7 43.2 -64.9 -46.3 26.8 13.8 -8.2 569 569 A P H > S+ 0 0 25 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.916 113.4 53.5 -66.0 -36.1 26.2 17.1 -6.3 570 570 A L H X S+ 0 0 1 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.880 111.4 44.2 -64.6 -39.1 27.7 19.2 -9.2 571 571 A F H X S+ 0 0 3 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.871 112.6 52.9 -72.4 -36.6 25.4 17.6 -11.8 572 572 A K H X S+ 0 0 104 -4,-2.1 4,-1.1 -5,-0.3 -2,-0.2 0.923 111.4 44.7 -65.9 -42.6 22.4 17.9 -9.5 573 573 A D H X S+ 0 0 23 -4,-2.4 4,-0.7 1,-0.2 -1,-0.2 0.870 112.5 51.4 -70.2 -36.1 22.9 21.6 -8.8 574 574 A L H < S+ 0 0 1 -4,-1.7 3,-0.5 1,-0.2 6,-0.3 0.864 109.2 52.0 -68.3 -32.8 23.6 22.3 -12.5 575 575 A A H < S+ 0 0 22 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.743 108.1 51.2 -74.0 -23.6 20.3 20.5 -13.4 576 576 A A H < S+ 0 0 77 -4,-1.1 2,-0.8 -3,-0.2 -1,-0.2 0.564 93.1 82.3 -88.7 -10.3 18.4 22.6 -10.9 577 577 A F S >X S- 0 0 7 -4,-0.7 4,-1.7 -3,-0.5 3,-1.7 -0.857 76.6-145.2 -97.4 109.8 19.7 25.9 -12.3 578 578 A D T 34 S+ 0 0 121 -2,-0.8 4,-0.5 1,-0.3 -1,-0.1 0.732 95.0 58.4 -45.0 -31.1 17.6 26.8 -15.3 579 579 A K T 34 S+ 0 0 121 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.822 117.2 29.6 -72.2 -32.7 20.6 28.3 -17.2 580 580 A S T <> S+ 0 0 1 -3,-1.7 4,-2.5 -6,-0.3 5,-0.3 0.529 92.0 99.2-104.9 -7.8 22.7 25.2 -17.1 581 581 A H H X S+ 0 0 80 -4,-1.7 4,-1.8 1,-0.2 3,-0.3 0.914 85.1 44.6 -44.6 -62.4 19.9 22.6 -17.1 582 582 A D H > S+ 0 0 107 -4,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.904 115.9 47.8 -52.3 -45.6 20.1 21.8 -20.8 583 583 A Q H > S+ 0 0 86 -4,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.828 106.6 55.6 -68.5 -32.4 23.9 21.7 -20.8 584 584 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 -3,-0.3 -1,-0.2 0.902 111.3 45.6 -66.3 -39.4 24.2 19.4 -17.7 585 585 A V H X S+ 0 0 35 -4,-1.8 4,-2.5 -5,-0.3 5,-0.2 0.933 112.7 49.6 -67.6 -47.8 22.0 16.8 -19.4 586 586 A R H X S+ 0 0 132 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.891 111.2 49.9 -59.1 -41.3 23.8 17.1 -22.7 587 587 A T H X S+ 0 0 21 -4,-2.4 4,-2.1 2,-0.2 5,-0.2 0.906 109.9 50.5 -65.3 -41.7 27.2 16.6 -21.0 588 588 A Y H X S+ 0 0 8 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.938 111.0 48.4 -61.5 -46.9 25.9 13.6 -19.1 589 589 A Q H < S+ 0 0 81 -4,-2.5 4,-0.5 1,-0.2 -1,-0.2 0.834 112.8 48.8 -63.9 -32.9 24.7 11.9 -22.2 590 590 A E H < S+ 0 0 148 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.849 120.5 34.2 -76.6 -33.8 27.9 12.6 -24.1 591 591 A H H >< S+ 0 0 68 -4,-2.1 3,-1.8 -5,-0.1 4,-0.4 0.661 93.0 93.9 -93.3 -19.2 30.2 11.3 -21.3 592 592 A K G >< S+ 0 0 56 -4,-2.3 3,-2.5 1,-0.3 8,-0.1 0.873 80.1 54.4 -37.7 -63.4 27.9 8.5 -20.1 593 593 A A G 3 S+ 0 0 104 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.732 115.4 40.7 -49.1 -28.4 29.4 5.7 -22.2 594 594 A S G < S+ 0 0 57 -3,-1.8 -1,-0.3 -4,-0.1 -2,-0.2 0.229 95.1 98.6-108.8 14.3 32.9 6.4 -20.8 595 595 A M S < S- 0 0 35 -3,-2.5 -33,-0.0 -4,-0.4 -331,-0.0 -0.538 92.5 -78.0 -93.0 164.6 32.0 7.1 -17.1 596 596 A H > - 0 0 4 -332,-0.2 4,-2.4 -2,-0.2 3,-0.3 -0.419 47.8-122.5 -60.3 134.5 32.4 4.5 -14.4 597 597 A P H > S+ 0 0 43 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.864 108.7 46.4 -48.3 -46.5 29.4 2.2 -14.8 598 598 A V H > S+ 0 0 6 -485,-0.3 4,-2.2 1,-0.2 5,-0.2 0.889 112.5 50.9 -66.3 -38.8 28.0 2.7 -11.2 599 599 A T H > S+ 0 0 3 -3,-0.3 4,-2.5 2,-0.2 5,-0.3 0.885 106.4 54.2 -65.3 -41.4 28.5 6.5 -11.5 600 600 A A H X S+ 0 0 12 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.956 109.7 49.2 -57.3 -49.4 26.6 6.6 -14.8 601 601 A M H X S+ 0 0 58 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.957 114.0 42.6 -53.3 -60.7 23.7 4.9 -13.2 602 602 A L H X S+ 0 0 5 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.834 115.4 48.1 -59.3 -39.2 23.4 7.1 -10.1 603 603 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.878 109.2 56.2 -69.6 -35.4 23.9 10.3 -12.0 604 604 A G H X>S+ 0 0 5 -4,-2.3 5,-2.3 -5,-0.3 4,-0.7 0.886 110.1 45.1 -61.4 -38.3 21.3 9.1 -14.4 605 605 A K H <5S+ 0 0 120 -4,-1.8 3,-0.4 3,-0.2 -2,-0.2 0.938 111.4 50.6 -71.0 -47.1 18.9 8.7 -11.5 606 606 A D H <5S+ 0 0 34 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.906 116.1 41.4 -58.0 -44.7 19.7 12.0 -9.9 607 607 A L H <5S- 0 0 21 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.635 108.5-130.6 -77.2 -14.8 19.1 13.9 -13.2 608 608 A K T <5 + 0 0 190 -4,-0.7 2,-0.3 -3,-0.4 -3,-0.2 0.962 56.1 140.6 63.0 54.8 16.1 11.7 -13.9 609 609 A V < 0 0 32 -5,-2.3 -1,-0.2 -6,-0.1 -2,-0.1 -0.882 360.0 360.0-125.1 159.1 17.1 10.7 -17.4 610 610 A D 0 0 163 -2,-0.3 -5,-0.0 -5,-0.0 0, 0.0 -0.650 360.0 360.0 74.3 360.0 16.9 7.5 -19.4 611 !* 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 0.0 612 702 B R 0 0 5 0, 0.0 2,-0.5 0, 0.0 -342,-0.2 0.000 360.0 360.0 360.0 164.5 35.5 3.2 2.0 613 703 B A B R 269 0D 12 -344,-1.9 -345,-2.3 -321,-0.1 -344,-1.0 -0.914 360.0 360.0-111.3 133.3 35.6 7.0 2.1 614 704 B R 0 0 71 -2,-0.5 -347,-0.1 -347,-0.2 -51,-0.1 -0.235 360.0 360.0 -56.2 360.0 33.1 9.1 0.2