==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE, TRANSFERASE 10-JUL-05 2CZ2 . COMPND 2 MOLECULE: MALEYLACETOACETATE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR E.MIZOHATA,S.MORITA,Y.KINOSHITA,K.NAGANO,H.UDA,T.UCHIKUBO,M. . 211 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10860.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 144 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 4.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 6 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 41.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.9 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 1 0 1 1 0 0 0 2 1 0 0 1 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 4 A G 0 0 132 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 158.9 -9.1 5.9 -10.6 2 5 A K - 0 0 96 1,-0.1 26,-0.2 59,-0.1 58,-0.1 -0.342 360.0 -88.9 -68.2 153.4 -5.7 7.3 -9.3 3 6 A P - 0 0 20 0, 0.0 26,-2.6 0, 0.0 2,-0.5 -0.317 41.9-140.2 -58.2 147.5 -5.5 9.3 -6.1 4 7 A I E -aB 29 60A 52 56,-2.0 56,-2.8 24,-0.2 2,-0.5 -0.979 12.3-161.8-119.5 119.2 -6.1 13.0 -6.6 5 8 A L E -aB 30 59A 0 24,-3.1 26,-2.7 -2,-0.5 2,-0.7 -0.900 10.6-148.0-102.9 126.5 -4.0 15.5 -4.7 6 9 A Y E +aB 31 58A 30 52,-3.0 52,-1.1 -2,-0.5 2,-0.3 -0.853 40.2 160.7 -90.1 116.5 -5.1 19.1 -4.4 7 10 A S E -a 32 0A 0 24,-1.6 26,-2.4 -2,-0.7 2,-0.4 -0.923 41.4-145.9-141.9 154.2 -1.9 21.1 -4.3 8 11 A Y > - 0 0 11 -2,-0.3 3,-1.4 24,-0.2 6,-0.2 -0.985 28.4-129.1-120.6 138.5 -0.3 24.5 -4.8 9 12 A F T 3 S+ 0 0 16 -2,-0.4 194,-0.1 1,-0.3 198,-0.1 0.847 106.7 39.1 -57.7 -38.4 3.3 24.5 -6.2 10 13 A R T 3 S+ 0 0 94 192,-0.1 2,-0.4 -3,-0.1 -1,-0.3 0.448 86.9 117.5 -90.6 -6.7 4.8 26.7 -3.5 11 14 A S <> - 0 0 16 -3,-1.4 4,-2.2 1,-0.2 5,-0.1 -0.519 52.0-156.4 -70.6 120.4 2.8 25.2 -0.6 12 15 A S H > S+ 0 0 6 -2,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.905 94.9 51.4 -59.7 -42.7 5.1 23.6 2.0 13 16 A C H > S+ 0 0 14 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.845 109.6 50.1 -67.1 -35.5 2.3 21.3 3.3 14 17 A S H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.901 105.9 55.9 -66.4 -43.6 1.5 20.1 -0.2 15 18 A W H X S+ 0 0 7 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.931 101.3 59.6 -54.1 -43.4 5.2 19.4 -0.8 16 19 A R H X S+ 0 0 6 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.913 108.6 42.7 -48.3 -53.2 5.2 17.1 2.2 17 20 A V H X S+ 0 0 0 -4,-1.1 4,-2.7 -3,-0.2 -1,-0.2 0.905 110.5 55.0 -66.8 -38.9 2.5 14.9 0.7 18 21 A R H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.899 109.1 49.5 -62.1 -38.3 4.0 14.9 -2.7 19 22 A I H X S+ 0 0 1 -4,-2.9 4,-2.8 -5,-0.2 -2,-0.2 0.947 111.5 48.2 -62.2 -46.1 7.3 13.6 -1.1 20 23 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.890 110.8 50.5 -62.8 -41.9 5.4 10.9 0.8 21 24 A L H <>S+ 0 0 0 -4,-2.7 5,-2.2 2,-0.2 4,-0.4 0.921 112.4 47.2 -63.7 -41.3 3.5 9.8 -2.3 22 25 A A H ><5S+ 0 0 30 -4,-2.2 3,-1.1 -5,-0.2 -2,-0.2 0.927 110.5 52.7 -61.8 -46.9 6.8 9.6 -4.3 23 26 A L H 3<5S+ 0 0 32 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.922 111.7 45.4 -52.2 -46.8 8.4 7.6 -1.4 24 27 A K T 3<5S- 0 0 19 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.442 111.8-120.6 -81.9 -0.7 5.5 5.1 -1.4 25 28 A G T < 5 + 0 0 65 -3,-1.1 2,-0.6 -4,-0.4 -3,-0.2 0.745 55.6 158.9 71.0 24.2 5.6 4.8 -5.2 26 29 A I < - 0 0 24 -5,-2.2 2,-0.5 -6,-0.2 -1,-0.2 -0.722 36.1-141.7 -89.1 121.0 2.0 5.9 -5.5 27 30 A D + 0 0 104 -2,-0.6 2,-0.3 -5,-0.0 -5,-0.0 -0.721 35.5 166.4 -82.4 123.3 1.0 7.3 -8.9 28 31 A Y - 0 0 42 -2,-0.5 2,-0.3 -26,-0.2 -24,-0.2 -0.865 33.3-124.9-136.7 165.2 -1.3 10.2 -8.5 29 32 A E E -a 4 0A 100 -26,-2.6 -24,-3.1 -2,-0.3 2,-0.4 -0.847 22.7-138.9-109.4 149.4 -2.9 13.1 -10.3 30 33 A I E -a 5 0A 38 -2,-0.3 -24,-0.2 -26,-0.2 -26,-0.0 -0.932 10.3-165.7-111.1 134.4 -2.7 16.8 -9.2 31 34 A V E -a 6 0A 53 -26,-2.7 -24,-1.6 -2,-0.4 2,-0.1 -0.968 28.6-136.2-107.9 108.2 -5.4 19.3 -9.3 32 35 A P E -a 7 0A 48 0, 0.0 2,-0.5 0, 0.0 -24,-0.2 -0.454 16.2-164.6 -68.7 140.7 -3.7 22.7 -8.8 33 36 A I - 0 0 6 -26,-2.4 2,-0.7 -2,-0.1 23,-0.1 -0.983 15.5-142.0-123.7 110.7 -5.2 25.2 -6.4 34 37 A N - 0 0 56 -2,-0.5 7,-3.0 1,-0.2 8,-0.3 -0.658 14.5-169.9 -79.9 110.8 -3.8 28.7 -6.8 35 38 A L S S+ 0 0 21 -2,-0.7 -1,-0.2 5,-0.3 -27,-0.0 0.579 78.4 32.1 -80.3 -8.9 -3.6 30.2 -3.3 36 39 A I S > S+ 0 0 81 4,-0.1 3,-1.2 2,-0.0 -1,-0.2 0.716 86.1 100.1-118.7 -34.6 -2.8 33.7 -4.3 37 40 A K G > S- 0 0 140 1,-0.3 3,-2.3 2,-0.2 -3,-0.1 -0.394 103.5 -9.4 -71.7 130.7 -4.5 34.7 -7.6 38 41 A D G 3 S- 0 0 157 1,-0.3 -1,-0.3 -2,-0.1 -2,-0.0 0.851 136.4 -47.6 55.4 41.2 -7.7 36.7 -7.3 39 42 A G G < S- 0 0 46 -3,-1.2 -1,-0.3 3,-0.0 -2,-0.2 0.262 109.8 -63.3 84.9 -15.8 -7.7 36.2 -3.5 40 43 A G X - 0 0 8 -3,-2.3 3,-1.4 1,-0.1 -5,-0.3 0.349 31.7-119.6 108.6 130.9 -7.1 32.4 -3.8 41 44 A Q G > S+ 0 0 81 -7,-3.0 3,-1.6 1,-0.3 6,-0.3 0.648 103.5 79.4 -70.8 -19.1 -8.9 29.5 -5.3 42 45 A Q G 3 S+ 0 0 12 -8,-0.3 -1,-0.3 1,-0.3 9,-0.1 0.643 88.2 58.6 -64.9 -14.5 -9.1 27.9 -1.8 43 46 A F G < S+ 0 0 96 -3,-1.4 -1,-0.3 4,-0.1 -2,-0.2 0.493 79.2 115.6 -93.8 -2.6 -12.0 30.2 -1.0 44 47 A T S <> S- 0 0 51 -3,-1.6 4,-2.6 1,-0.1 5,-0.2 -0.240 77.1-119.0 -64.5 153.8 -14.2 29.0 -3.9 45 48 A E H > S+ 0 0 135 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.909 114.0 53.1 -59.9 -38.9 -17.4 27.3 -2.9 46 49 A E H > S+ 0 0 143 1,-0.2 4,-1.1 2,-0.2 3,-0.3 0.914 111.3 43.4 -65.7 -45.7 -16.3 24.1 -4.6 47 50 A F H > S+ 0 0 9 -6,-0.3 4,-3.0 1,-0.2 3,-0.3 0.899 108.4 59.8 -70.1 -36.2 -13.0 23.9 -2.8 48 51 A Q H < S+ 0 0 58 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.806 103.1 52.1 -57.9 -31.2 -14.7 24.9 0.5 49 52 A T H < S+ 0 0 115 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.821 111.6 47.5 -74.4 -29.2 -16.9 21.7 0.2 50 53 A L H < S+ 0 0 31 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.2 0.923 136.5 4.9 -71.2 -48.8 -13.7 19.7 -0.3 51 54 A N >< - 0 0 9 -4,-3.0 3,-2.5 -9,-0.1 -1,-0.3 -0.834 60.4-164.8-142.7 100.1 -12.0 21.3 2.7 52 55 A P T 3 S+ 0 0 97 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.672 90.7 68.2 -57.3 -20.0 -14.0 23.7 4.9 53 56 A X T 3 S- 0 0 118 2,-0.1 3,-0.1 -3,-0.1 -5,-0.1 0.546 102.8-133.7 -76.5 -10.1 -10.6 24.8 6.4 54 57 A K < + 0 0 82 -3,-2.5 2,-0.3 1,-0.2 -12,-0.1 0.875 62.8 116.9 62.7 45.8 -9.8 26.4 2.9 55 58 A Q - 0 0 62 -4,-0.2 -1,-0.2 -8,-0.1 -2,-0.1 -0.956 56.5 -93.9-136.6 156.5 -6.2 24.9 2.8 56 59 A V S S+ 0 0 12 -2,-0.3 -43,-0.2 -3,-0.1 -42,-0.2 -0.840 78.2 61.7-106.1 154.3 -4.2 22.5 0.7 57 60 A P + 0 0 4 0, 0.0 11,-0.8 0, 0.0 2,-0.3 0.439 51.5 160.5 -86.8 162.1 -3.4 19.7 0.7 58 61 A A E -BC 6 67A 0 -52,-1.1 -52,-3.0 9,-0.2 2,-0.5 -0.985 19.3-159.5-131.3 140.0 -6.4 17.5 0.3 59 62 A L E -BC 5 66A 0 7,-2.8 7,-2.9 -2,-0.3 2,-0.6 -0.979 10.1-157.9-124.0 121.0 -6.1 13.9 -1.0 60 63 A K E +BC 4 65A 75 -56,-2.8 -56,-2.0 -2,-0.5 2,-0.3 -0.893 36.3 148.5 -89.2 118.7 -8.8 11.8 -2.5 61 64 A I E > + C 0 64A 4 3,-2.2 3,-2.0 -2,-0.6 -59,-0.1 -0.985 57.1 3.2-153.6 140.0 -7.7 8.2 -2.1 62 65 A D T 3 S- 0 0 89 -2,-0.3 3,-0.1 1,-0.3 -60,-0.0 0.792 129.1 -55.0 53.2 32.1 -9.4 4.8 -1.6 63 66 A G T 3 S+ 0 0 88 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.518 119.3 91.5 84.1 4.8 -12.8 6.4 -1.9 64 67 A I E < -C 61 0A 81 -3,-2.0 -3,-2.2 -5,-0.0 2,-0.5 -0.829 68.5-128.2-125.3 168.3 -12.4 9.1 0.8 65 68 A T E -C 60 0A 70 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.981 25.6-170.0-117.4 121.3 -11.1 12.6 1.1 66 69 A I E -C 59 0A 21 -7,-2.9 -7,-2.8 -2,-0.5 2,-0.2 -0.959 3.7-173.3-115.3 134.0 -8.4 13.4 3.6 67 70 A V E +C 58 0A 44 -2,-0.4 -9,-0.2 -9,-0.2 -11,-0.1 -0.683 49.7 64.7-115.5 167.6 -7.2 16.8 4.7 68 71 A Q S > S- 0 0 108 -11,-0.8 4,-2.7 -2,-0.2 3,-0.2 0.816 73.4-125.2 80.7 109.9 -4.3 17.7 7.0 69 72 A S H > S+ 0 0 4 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.844 108.4 47.8 -55.6 -39.5 -0.9 16.8 5.6 70 73 A L H > S+ 0 0 26 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.898 111.3 50.7 -73.0 -32.8 0.2 14.7 8.7 71 74 A A H > S+ 0 0 49 -3,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.911 111.9 48.9 -66.0 -41.5 -3.1 12.9 8.8 72 75 A I H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.943 111.7 48.5 -57.1 -50.0 -2.7 12.1 5.1 73 76 A X H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.896 109.7 51.4 -65.6 -39.1 0.9 10.9 5.6 74 77 A E H X S+ 0 0 37 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.885 110.5 50.4 -62.5 -38.1 -0.2 8.7 8.6 75 78 A Y H X S+ 0 0 57 -4,-2.0 4,-1.8 2,-0.2 5,-0.2 0.937 110.8 47.9 -62.8 -47.3 -2.9 7.2 6.4 76 79 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.913 111.3 52.4 -59.4 -40.9 -0.4 6.5 3.6 77 80 A E H < S+ 0 0 19 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.913 111.5 45.2 -61.4 -42.8 1.9 5.0 6.2 78 81 A E H < S+ 0 0 139 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.801 122.6 35.0 -71.8 -31.0 -0.7 2.6 7.6 79 82 A T H < S+ 0 0 58 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.689 127.4 32.3-101.0 -24.0 -2.0 1.5 4.1 80 83 A R S < S- 0 0 65 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.1 -0.799 76.1-175.9-130.1 83.5 1.3 1.4 2.0 81 84 A P + 0 0 75 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.760 38.5 100.3 -63.2 -33.9 3.9 0.5 4.6 82 85 A I S S+ 0 0 102 2,-0.1 2,-0.1 -58,-0.1 3,-0.0 -0.842 73.7 33.2-112.6 143.6 7.2 0.6 2.8 83 86 A P S S- 0 0 51 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.621 100.5-127.4 -68.3 148.0 9.3 2.7 2.7 84 87 A R - 0 0 118 1,-0.2 -2,-0.1 -2,-0.1 4,-0.0 -0.436 25.6-171.6 -72.0 131.6 8.5 3.5 6.4 85 88 A L S S+ 0 0 1 -4,-0.2 73,-2.8 -2,-0.2 74,-0.3 0.587 84.7 39.8 -84.6 -22.4 7.8 7.1 7.3 86 89 A L S S- 0 0 2 71,-0.2 -1,-0.2 72,-0.1 7,-0.1 -0.995 88.5-123.3-129.5 138.5 7.8 6.0 11.0 87 90 A P - 0 0 30 0, 0.0 -2,-0.1 0, 0.0 6,-0.0 -0.122 24.2-113.0 -74.1 176.7 10.2 3.4 12.6 88 91 A Q S S+ 0 0 146 -4,-0.0 3,-0.0 4,-0.0 -2,-0.0 0.850 91.5 85.9 -83.2 -32.0 9.0 0.3 14.4 89 92 A D S > S- 0 0 63 1,-0.1 4,-2.7 2,-0.0 3,-0.3 -0.526 72.8-143.3 -75.1 121.0 10.1 1.3 17.9 90 93 A P H > S+ 0 0 98 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.833 99.9 55.4 -56.9 -30.3 7.4 3.4 19.7 91 94 A Q H > S+ 0 0 156 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.924 111.2 42.2 -72.6 -36.5 10.0 5.5 21.4 92 95 A K H > S+ 0 0 113 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.853 110.3 58.0 -74.2 -34.6 11.7 6.4 18.1 93 96 A R H X S+ 0 0 67 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.900 103.2 54.4 -58.4 -41.7 8.3 6.9 16.5 94 97 A A H X S+ 0 0 49 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.888 107.0 50.1 -60.2 -38.7 7.6 9.5 19.2 95 98 A I H X S+ 0 0 50 -4,-1.3 4,-2.2 2,-0.2 5,-0.2 0.921 110.8 48.8 -67.1 -42.8 10.7 11.4 18.3 96 99 A V H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.931 114.6 45.4 -61.1 -44.0 9.8 11.4 14.6 97 100 A R H X S+ 0 0 76 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.886 109.5 56.1 -69.0 -35.0 6.3 12.6 15.5 98 101 A X H X S+ 0 0 104 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.923 111.5 42.5 -59.9 -47.0 7.7 15.3 17.9 99 102 A I H X S+ 0 0 1 -4,-2.2 4,-2.1 2,-0.2 5,-0.2 0.915 113.1 52.5 -68.7 -40.5 9.8 16.8 15.2 100 103 A S H X S+ 0 0 0 -4,-2.2 4,-3.1 -5,-0.2 -2,-0.2 0.935 113.3 44.7 -60.6 -43.2 7.1 16.6 12.6 101 104 A D H X>S+ 0 0 77 -4,-2.7 4,-3.0 2,-0.2 5,-1.5 0.850 105.6 60.2 -71.6 -35.8 4.7 18.4 15.0 102 105 A L H X5S+ 0 0 38 -4,-2.2 4,-0.7 -5,-0.2 5,-0.4 0.951 117.4 33.7 -54.2 -47.5 7.3 21.0 16.0 103 106 A I H X>S+ 0 0 0 -4,-2.1 5,-2.5 3,-0.2 4,-1.3 0.963 124.8 40.9 -71.3 -51.9 7.4 22.0 12.3 104 107 A A H <5S+ 0 0 13 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.756 133.5 19.8 -78.3 -26.5 3.8 21.4 11.3 105 108 A S H <5S+ 0 0 80 -4,-3.0 -3,-0.2 -5,-0.2 -1,-0.2 0.678 129.9 43.3-107.1 -32.8 2.1 22.8 14.4 106 109 A G H <X5S+ 0 0 0 -4,-1.3 3,-1.3 -5,-0.4 4,-0.6 0.708 117.0 54.3-119.4 -61.7 6.3 26.8 12.8 108 111 A Q G >44 S+ 0 0 46 0, 0.0 3,-0.7 0, 0.0 -1,-0.3 0.831 105.7 54.3 -59.4 -28.6 0.9 27.7 10.9 110 113 A L G <4 S+ 0 0 73 -3,-1.3 -2,-0.2 1,-0.2 21,-0.1 0.552 114.2 40.5 -83.3 -10.2 2.4 30.9 12.1 111 114 A Q G << S+ 0 0 6 -3,-1.7 -1,-0.2 -4,-0.6 -3,-0.1 0.159 87.4 129.1-118.0 13.3 3.9 31.7 8.7 112 115 A N S X> S- 0 0 34 -3,-0.7 4,-2.7 -4,-0.4 3,-0.5 -0.348 71.3-110.3 -68.9 153.4 0.9 30.6 6.6 113 116 A L H 3> S+ 0 0 44 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.889 116.3 50.2 -51.4 -52.1 -0.5 32.9 4.0 114 117 A S H 3> S+ 0 0 59 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.831 112.8 47.5 -62.5 -33.4 -3.8 33.7 5.8 115 118 A V H <> S+ 0 0 45 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.921 110.2 51.0 -71.1 -46.9 -1.8 34.5 9.0 116 119 A L H X S+ 0 0 13 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.888 107.4 55.6 -58.1 -34.3 0.7 36.8 7.2 117 120 A K H < S+ 0 0 129 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.897 107.8 48.1 -65.5 -40.8 -2.3 38.6 5.6 118 121 A Q H < S+ 0 0 176 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.808 108.5 54.0 -67.6 -30.7 -3.7 39.3 9.1 119 122 A V H < S- 0 0 36 -4,-1.9 4,-0.2 1,-0.1 -2,-0.2 0.896 111.9-131.9 -67.5 -39.6 -0.3 40.6 10.2 120 123 A G >X - 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