==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 24-MAR-06 2CIQ . COMPND 2 MOLECULE: HEXOSE-6-PHOSPHATE MUTAROTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR M.GRAILLE,J.-P.BALTAZE,N.LEULLIOT,D.LIGER, . 287 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12652.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 203 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 121 42.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 0.3 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 . 32 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 . 4 3 3 2 6 3 0 1 1 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 . 0 0 0 0 1 0 0 2 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 2 A P 0 0 70 0, 0.0 11,-2.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 156.1 24.6 23.5 37.4 2 3 A I E -A 11 0A 43 9,-0.2 2,-0.4 2,-0.0 9,-0.2 -0.998 360.0-171.9-131.7 138.9 22.8 23.4 34.0 3 4 A K E -A 10 0A 128 7,-2.2 7,-2.4 -2,-0.4 2,-0.4 -0.989 5.7-160.4-135.6 118.0 22.3 26.4 31.7 4 5 A E E +A 9 0A 107 -2,-0.4 5,-0.2 5,-0.2 2,-0.2 -0.880 12.5 172.6-106.2 133.6 20.1 26.4 28.6 5 6 A T - 0 0 64 3,-3.1 -2,-0.0 -2,-0.4 0, 0.0 -0.648 50.7 -92.0-119.3 178.6 20.3 28.8 25.7 6 7 A D S S+ 0 0 143 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.859 124.2 28.7 -60.6 -35.7 18.5 28.8 22.4 7 8 A K S S+ 0 0 135 1,-0.1 18,-2.4 18,-0.1 19,-0.5 0.641 125.1 11.3-102.7 -19.7 21.3 26.9 20.6 8 9 A E E - B 0 24A 39 16,-0.3 -3,-3.1 17,-0.1 2,-0.4 -0.945 52.7-129.9-155.6 169.3 22.9 24.8 23.4 9 10 A V E -AB 4 23A 0 14,-2.3 14,-3.0 -2,-0.3 2,-0.4 -0.983 22.4-162.4-126.8 139.6 22.9 23.4 26.9 10 11 A V E -AB 3 22A 12 -7,-2.4 -7,-2.2 -2,-0.4 2,-0.4 -0.991 1.1-164.2-129.8 125.4 25.9 23.6 29.2 11 12 A L E -AB 2 21A 0 10,-2.6 10,-2.0 -2,-0.4 2,-0.4 -0.895 4.4-171.3-106.6 138.1 26.5 21.5 32.3 12 13 A T E - B 0 20A 35 -11,-2.6 8,-0.2 -2,-0.4 5,-0.2 -0.969 30.1-112.2-124.9 144.3 29.1 22.4 34.9 13 14 A H E > - B 0 16A 15 6,-2.5 3,-1.0 3,-0.7 6,-0.2 -0.609 19.1-137.0 -80.0 134.5 30.1 20.1 37.7 14 15 A P T 3 S+ 0 0 66 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.763 103.1 50.3 -62.8 -25.9 28.9 21.4 41.2 15 16 A A T 3 S+ 0 0 87 1,-0.3 2,-0.2 2,-0.0 -2,-0.0 0.662 129.4 13.8 -83.2 -18.1 32.3 20.5 42.8 16 17 A D E X -B 13 0A 50 -3,-1.0 3,-2.3 3,-0.2 -3,-0.7 -0.669 60.5-160.3-162.2 102.2 34.3 22.3 40.2 17 18 A E E 3 S+ 0 0 156 1,-0.3 -1,-0.0 -3,-0.2 20,-0.0 0.571 88.8 72.2 -64.0 -11.5 32.8 24.7 37.6 18 19 A T E 3 S+ 0 0 49 -6,-0.1 19,-2.3 -5,-0.1 2,-0.6 0.493 81.6 80.7 -83.4 -5.5 35.9 24.2 35.4 19 20 A T E < + 0 0 1 -3,-2.3 -6,-2.5 17,-0.2 2,-0.3 -0.923 69.9 146.3 -96.8 119.7 34.6 20.7 34.5 20 21 A S E -BC 12 34A 11 14,-1.9 14,-2.3 -2,-0.6 2,-0.3 -0.945 39.7-150.6-150.3 162.4 32.0 21.3 31.9 21 22 A V E -BC 11 33A 0 -10,-2.0 -10,-2.6 -2,-0.3 2,-0.5 -0.980 10.7-155.3-139.6 136.8 30.2 19.9 28.8 22 23 A H E -BC 10 32A 43 10,-2.2 9,-2.2 -2,-0.3 10,-1.1 -0.957 10.9-169.0-110.0 130.0 28.6 21.9 26.0 23 24 A I E -BC 9 30A 0 -14,-3.0 -14,-2.3 -2,-0.5 2,-0.3 -0.979 13.8-143.4-124.6 119.5 25.9 20.2 24.0 24 25 A L E > -BC 8 29A 6 5,-2.5 5,-1.3 -2,-0.5 4,-0.3 -0.616 11.5-140.3 -76.4 133.5 24.5 21.7 20.8 25 26 A K T > 5S+ 0 0 25 -18,-2.4 64,-2.4 -2,-0.3 3,-1.6 0.915 87.8 86.8 -62.4 -36.8 20.8 21.1 20.3 26 27 A Y B > 5S-F 88 0B 23 -19,-0.5 3,-1.0 1,-0.3 62,-0.3 -0.505 118.3 -8.6 -62.0 113.7 21.6 20.6 16.6 27 28 A G T 3 5S- 0 0 0 60,-3.0 34,-0.3 -2,-0.5 -1,-0.3 0.384 104.6 -97.7 78.6 1.3 22.5 16.8 16.5 28 29 A A T < 5S- 0 0 1 -3,-1.6 2,-0.8 -4,-0.3 -1,-0.3 0.958 71.5-179.2 41.1 54.2 22.4 16.8 20.3 29 30 A T E < < -C 24 0A 1 -5,-1.3 -5,-2.5 -3,-1.0 2,-0.3 -0.742 31.6-147.0 -95.7 105.2 26.1 17.2 19.6 30 31 A V E +CD 23 59A 3 -2,-0.8 29,-2.6 29,-0.6 -7,-0.2 -0.524 26.9 168.7 -58.6 124.6 28.6 17.3 22.5 31 32 A Y E + 0 0 35 -9,-2.2 2,-0.3 1,-0.3 27,-0.2 0.531 59.2 30.2-122.5 -5.9 31.2 19.7 21.1 32 33 A S E +C 22 0A 10 -10,-1.1 -10,-2.2 25,-0.1 2,-0.4 -0.979 51.0 175.4-149.2 139.2 33.3 20.4 24.2 33 34 A W E -C 21 0A 0 -2,-0.3 7,-3.1 -12,-0.2 2,-0.5 -0.918 13.5-170.2-141.2 113.6 34.1 18.5 27.4 34 35 A K E -CE 20 39A 84 -14,-2.3 -14,-1.9 -2,-0.4 2,-0.6 -0.904 9.6-160.6-108.5 133.0 36.5 20.1 29.8 35 36 A L E > S- E 0 38A 18 3,-2.6 3,-2.2 -2,-0.5 -16,-0.2 -0.956 83.4 -26.2-111.1 109.4 38.0 18.2 32.7 36 37 A K T 3 S- 0 0 124 -2,-0.6 -17,-0.2 1,-0.3 -1,-0.2 0.904 130.5 -45.5 48.5 46.1 39.3 20.8 35.2 37 38 A S T 3 S+ 0 0 79 -19,-2.3 2,-0.6 1,-0.2 -1,-0.3 0.195 114.7 118.4 88.7 -15.2 39.8 23.3 32.4 38 39 A E E < -E 35 0A 104 -3,-2.2 -3,-2.6 -20,-0.0 2,-0.2 -0.764 64.4-129.6 -91.8 119.8 41.4 20.8 30.0 39 40 A E E -E 34 0A 46 -2,-0.6 -5,-0.2 -5,-0.2 -7,-0.0 -0.488 23.0-176.6 -69.2 130.5 39.6 20.1 26.7 40 41 A Q + 0 0 0 -7,-3.1 122,-2.5 -2,-0.2 2,-0.3 0.631 60.1 63.9-103.0 -21.1 39.1 16.4 26.1 41 42 A L B S-G 161 0C 1 -8,-0.4 2,-0.4 120,-0.3 120,-0.2 -0.817 76.5-125.6-109.8 147.3 37.5 16.4 22.7 42 43 A W - 0 0 6 118,-2.0 16,-2.4 -2,-0.3 2,-0.4 -0.748 27.6-179.9 -89.0 137.2 38.9 17.7 19.3 43 44 A L B -O 57 0D 40 -2,-0.4 14,-0.2 14,-0.3 -12,-0.0 -0.996 31.0-115.3-137.0 129.6 36.8 20.2 17.4 44 45 A S > - 0 0 4 12,-2.3 3,-1.5 -2,-0.4 12,-0.1 -0.349 18.5-131.8 -58.0 142.1 37.8 21.7 14.1 45 46 A T T 3 S+ 0 0 117 206,-2.0 -1,-0.1 1,-0.3 205,-0.1 0.654 112.3 46.8 -69.9 -14.6 38.5 25.5 14.2 46 47 A A T 3 S+ 0 0 33 203,-0.4 -1,-0.3 205,-0.4 -2,-0.1 0.124 82.9 135.8-109.3 15.4 36.2 25.7 11.2 47 48 A A < - 0 0 19 -3,-1.5 2,-0.5 204,-0.2 8,-0.1 -0.376 55.6-125.0 -62.7 142.4 33.5 23.5 12.6 48 49 A K + 0 0 85 6,-0.4 3,-0.1 1,-0.1 8,-0.1 -0.814 31.8 172.2 -88.6 128.3 29.9 24.8 12.0 49 50 A L + 0 0 58 -2,-0.5 -23,-0.2 1,-0.1 -1,-0.1 0.218 62.9 85.1-111.9 11.6 27.9 25.1 15.2 50 51 A D S S- 0 0 91 3,-0.1 -1,-0.1 1,-0.0 -2,-0.0 0.354 104.5-106.7 -99.8 5.1 25.0 26.9 13.4 51 52 A G S S+ 0 0 27 2,-0.3 -24,-0.1 -3,-0.1 -2,-0.0 0.510 87.1 119.3 82.5 6.5 23.0 23.9 12.1 52 53 A S S S- 0 0 73 1,-0.2 -3,-0.0 2,-0.0 34,-0.0 0.803 88.7 -16.6 -73.3 -28.2 24.1 24.4 8.5 53 54 A K S S- 0 0 77 -5,-0.1 -2,-0.3 32,-0.1 -1,-0.2 -0.952 95.9 -58.4-165.9 164.9 25.8 20.9 8.4 54 55 A P - 0 0 31 0, 0.0 -6,-0.4 0, 0.0 2,-0.3 -0.136 61.4 -98.1 -56.1 153.8 27.0 18.3 10.9 55 56 A V - 0 0 3 30,-0.3 2,-1.5 -29,-0.1 -6,-0.1 -0.523 25.6-140.7 -74.4 126.2 29.6 19.3 13.5 56 57 A R S S+ 0 0 63 -2,-0.3 -12,-2.3 193,-0.1 2,-0.3 -0.635 77.5 11.0 -89.0 84.2 33.2 18.4 12.5 57 58 A G B S+O 43 0D 0 -2,-1.5 -14,-0.3 -14,-0.2 2,-0.1 -0.867 92.6 65.0 139.6-175.4 34.4 17.3 16.0 58 59 A G S S- 0 0 0 -16,-2.4 102,-2.4 102,-0.3 -27,-0.3 -0.418 108.2 -40.1 67.1-134.2 33.0 16.5 19.4 59 60 A I B -D 30 0A 1 -29,-2.6 -29,-0.6 100,-0.2 100,-0.2 -0.634 61.9-169.1-129.7 73.5 30.7 13.5 19.5 60 61 A P - 0 0 2 0, 0.0 98,-2.9 0, 0.0 2,-0.5 -0.346 23.2-124.8 -59.0 146.8 28.4 13.5 16.4 61 62 A L E -H 157 0C 3 -34,-0.3 2,-0.7 96,-0.2 24,-0.5 -0.827 17.2-151.4 -99.7 131.6 25.6 10.9 16.7 62 63 A V E +H 156 0C 0 94,-2.8 94,-1.8 -2,-0.5 20,-0.2 -0.873 24.0 179.8-109.4 112.0 25.3 8.3 14.0 63 64 A F B -p 82 0E 0 18,-0.9 21,-2.2 -2,-0.7 20,-2.1 -0.921 51.9 -7.9-166.7 142.3 21.7 6.9 13.3 64 65 A P S S+ 0 0 0 0, 0.0 90,-2.2 0, 0.0 2,-0.4 -0.958 124.7 28.3 -96.6 11.2 20.2 5.0 11.6 65 66 A V - 0 0 2 88,-0.2 2,-0.5 14,-0.1 -2,-0.2 -0.995 61.0-146.2-133.9 132.0 23.0 4.1 9.2 66 67 A F S S- 0 0 26 -2,-0.4 2,-0.1 -4,-0.1 14,-0.0 -0.818 75.4 -16.0 -88.0 131.8 26.7 4.0 9.7 67 68 A G S S- 0 0 9 -2,-0.5 14,-2.1 2,-0.0 2,-0.5 -0.362 112.3 -41.2 74.1-158.7 28.6 5.0 6.5 68 69 A K - 0 0 124 12,-0.2 2,-0.3 13,-0.1 8,-0.1 -0.942 57.5-147.4-107.4 124.0 26.7 5.0 3.2 69 70 A N + 0 0 19 -2,-0.5 -2,-0.0 6,-0.4 -4,-0.0 -0.682 18.8 176.5 -90.0 144.4 24.3 2.1 2.6 70 71 A S S S+ 0 0 103 -2,-0.3 -1,-0.1 7,-0.0 6,-0.1 0.662 71.1 42.4-115.3 -26.7 23.9 0.8 -1.0 71 72 A T S S+ 0 0 128 4,-0.0 2,-0.4 5,-0.0 3,-0.0 0.549 83.6 90.1-110.9 -12.3 21.5 -2.2 -0.8 72 73 A D S > S- 0 0 29 1,-0.1 4,-1.9 2,-0.0 5,-0.2 -0.769 73.6-132.0 -88.4 134.5 18.6 -1.4 1.6 73 74 A E T 4 S+ 0 0 125 -2,-0.4 -1,-0.1 1,-0.2 4,-0.1 0.871 100.4 20.2 -52.7 -43.7 15.7 0.2 -0.2 74 75 A H T >4 S+ 0 0 66 2,-0.1 3,-1.9 1,-0.1 4,-0.4 0.886 121.7 53.3 -96.4 -47.0 15.3 3.0 2.4 75 76 A L G >4 S+ 0 0 1 1,-0.3 3,-1.6 2,-0.2 -6,-0.4 0.842 100.5 65.2 -61.3 -29.4 18.6 3.3 4.2 76 77 A S G 3< S+ 0 0 34 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.1 0.683 92.6 64.0 -66.7 -15.5 20.3 3.6 0.9 77 78 A K G < S+ 0 0 86 -3,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.658 87.5 89.3 -79.6 -16.1 18.5 6.9 0.4 78 79 A L S < S- 0 0 1 -3,-1.6 -9,-0.3 -4,-0.4 3,-0.1 -0.491 81.3-109.2 -86.0 155.4 20.2 8.6 3.3 79 80 A P > - 0 0 50 0, 0.0 3,-2.1 0, 0.0 -10,-0.1 -0.217 60.5 -60.8 -71.2 167.3 23.5 10.5 3.3 80 81 A Q T 3 S+ 0 0 109 1,-0.3 -12,-0.2 -12,-0.1 -14,-0.1 -0.250 125.2 10.7 -50.7 130.6 26.6 9.1 5.0 81 82 A H T 3 S- 0 0 13 -14,-2.1 -18,-0.9 -3,-0.1 4,-0.4 0.518 109.8-109.4 72.8 10.3 26.0 8.5 8.7 82 83 A G B < -p 63 0E 0 -3,-2.1 -20,-0.0 -15,-0.4 -16,-0.0 -0.377 41.5 -59.0 87.2-151.7 22.3 9.1 8.7 83 84 A L S > S+ 0 0 0 -20,-2.1 3,-0.7 -2,-0.1 29,-0.4 0.471 102.1 85.6-124.5 -7.1 20.0 11.8 10.0 84 85 A A G > S+ 0 0 0 -21,-2.2 3,-1.0 -3,-0.3 -57,-0.2 0.904 92.4 50.8 -64.5 -38.4 20.6 12.1 13.8 85 86 A R G 3 S+ 0 0 34 -24,-0.5 -30,-0.3 -4,-0.4 -1,-0.2 0.566 113.2 44.5 -82.0 -8.4 23.6 14.4 13.4 86 87 A N G < S+ 0 0 21 -3,-0.7 2,-0.4 -32,-0.1 -1,-0.2 0.067 97.4 87.0-120.1 25.5 21.7 16.9 11.1 87 88 A S S < S- 0 0 2 -3,-1.0 -60,-3.0 25,-0.1 2,-0.7 -0.929 80.1-118.7-120.0 145.5 18.4 17.1 13.0 88 89 A T B -F 26 0B 81 22,-0.4 -62,-0.3 -2,-0.4 2,-0.1 -0.773 32.2-147.9 -87.5 116.4 17.7 19.5 15.8 89 90 A W - 0 0 5 -64,-2.4 2,-0.5 -2,-0.7 17,-0.2 -0.444 13.9-114.8 -82.7 157.8 17.0 17.5 19.0 90 91 A E E -Q 105 0F 95 15,-2.7 15,-2.6 -2,-0.1 2,-0.6 -0.826 22.2-126.9 -92.2 128.2 14.6 18.7 21.7 91 92 A F E -Q 104 0F 35 -2,-0.5 13,-0.2 13,-0.2 3,-0.1 -0.674 23.4-171.6 -73.0 118.8 16.0 19.5 25.1 92 93 A L E - 0 0 76 11,-2.5 12,-0.2 -2,-0.6 2,-0.2 0.600 41.7-108.3 -90.7 -14.4 13.9 17.4 27.4 93 94 A G E -Q 103 0F 19 10,-1.0 10,-2.3 -3,-0.0 -1,-0.3 -0.536 42.2 -46.6 119.6 178.2 15.3 18.8 30.6 94 95 A Q E -Q 102 0F 82 8,-0.2 8,-0.3 -2,-0.2 3,-0.1 -0.632 33.9-177.9 -86.0 144.4 17.6 18.0 33.5 95 96 A T E S+ 0 0 72 6,-2.5 2,-0.3 1,-0.3 7,-0.2 0.567 70.9 22.3-113.7 -14.9 17.2 14.7 35.3 96 97 A K E > -Q 101 0F 80 5,-1.5 5,-2.3 1,-0.1 -1,-0.3 -0.995 46.6-160.0-153.3 146.6 19.9 15.2 38.0 97 98 A E E 5S+Q 100 0F 107 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.0 0.754 84.6 56.8 -93.6 -30.7 21.8 17.9 39.7 98 99 A N T 5S+ 0 0 107 1,-0.6 -1,-0.3 -85,-0.1 34,-0.1 -0.837 119.8 20.2-151.3 107.7 24.7 15.8 40.8 99 100 A P T 5S- 0 0 28 0, 0.0 -1,-0.6 0, 0.0 33,-0.2 0.494 112.1-121.1 -72.1 140.8 26.1 14.3 38.7 100 101 A P E 5 +Q 97 0F 2 0, 0.0 31,-2.6 0, 0.0 2,-0.4 -0.340 42.0 179.8 -55.6 122.4 24.5 16.9 36.4 101 102 A T E < +QR 96 130F 2 -5,-2.3 -6,-2.5 29,-0.2 -5,-1.5 -0.993 9.7 178.0-133.7 136.7 22.4 14.9 33.9 102 103 A V E -QR 94 129F 0 27,-2.3 27,-2.6 -2,-0.4 2,-0.3 -0.913 15.1-141.8-132.5 160.9 20.3 16.0 31.0 103 104 A Q E -QR 93 128F 60 -10,-2.3 -11,-2.5 -2,-0.3 -10,-1.0 -0.941 9.3-169.6-125.9 148.1 18.1 14.4 28.3 104 105 A F E -QR 91 127F 0 23,-2.3 23,-2.5 -2,-0.3 2,-0.3 -0.959 11.5-156.6-130.4 148.6 17.6 15.2 24.6 105 106 A G E -QR 90 126F 4 -15,-2.6 -15,-2.7 -2,-0.3 2,-0.3 -0.930 11.2-174.9-131.5 153.4 14.9 13.6 22.3 106 107 A L E + R 0 125F 0 19,-1.8 19,-2.6 -2,-0.3 -17,-0.1 -0.995 10.3 160.9-142.7 141.8 14.3 13.0 18.6 107 108 A K >> - 0 0 76 -2,-0.3 3,-1.9 17,-0.2 4,-1.0 -0.958 54.5 -95.2-152.6 159.1 11.4 11.7 16.7 108 109 A P G >4 S+ 0 0 20 0, 0.0 3,-0.6 0, 0.0 8,-0.1 0.819 117.3 65.0 -48.9 -37.3 10.4 11.9 13.0 109 110 A E G 34 S+ 0 0 140 1,-0.2 7,-0.0 7,-0.0 -3,-0.0 0.776 115.8 27.0 -58.4 -30.2 8.0 14.9 13.7 110 111 A I G <4 S+ 0 0 67 -3,-1.9 -22,-0.4 2,-0.1 -1,-0.2 0.410 102.9 102.1-113.5 -0.5 10.9 17.2 14.7 111 112 A A S << S- 0 0 9 -4,-1.0 -24,-0.1 -3,-0.6 -27,-0.1 -0.124 92.6 -53.0 -79.8 179.0 13.8 15.6 12.7 112 113 A N > - 0 0 23 -29,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.332 52.9-146.1 -57.9 116.8 15.4 16.7 9.5 113 114 A P H > S+ 0 0 98 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.890 92.9 45.8 -56.4 -49.6 12.4 17.2 7.1 114 115 A E H > S+ 0 0 129 1,-0.2 4,-1.3 2,-0.2 -2,-0.1 0.929 118.0 43.3 -56.6 -50.6 14.2 16.1 3.8 115 116 A L H > S+ 0 0 17 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.842 108.7 57.4 -70.1 -32.8 15.8 13.1 5.4 116 117 A T H < S+ 0 0 24 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.900 104.3 53.5 -66.7 -37.3 12.7 12.0 7.3 117 118 A K H < S+ 0 0 177 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.879 110.1 47.9 -63.4 -36.1 10.8 11.9 4.0 118 119 A L H < S+ 0 0 66 -4,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.852 126.9 26.2 -71.1 -36.0 13.5 9.6 2.6 119 120 A W S < S+ 0 0 5 -4,-2.0 2,-1.6 -42,-0.1 -1,-0.3 -0.688 73.2 175.4-129.2 75.4 13.5 7.3 5.6 120 121 A P + 0 0 77 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 -0.205 26.2 142.7 -83.1 49.7 10.0 7.6 7.2 121 122 A M - 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