==== 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 16-DEC-08 3FK8 . COMPND 2 MOLECULE: DISULPHIDE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: XYLELLA FASTIDIOSA; . AUTHOR K.TAN,A.SATHER,G.SHACKELFORD,A.JOACHIMIAK,MIDWEST CENTER FOR . 131 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7275.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 90 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 11 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 10 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.3 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 0 0 0 2 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 PARALLEL BRIDGES PER LADDER . 0 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 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 18 A A 0 0 130 0, 0.0 3,-0.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 134.6 43.7 0.8 14.1 2 19 A L + 0 0 155 1,-0.2 0, 0.0 2,-0.0 0, 0.0 -0.632 360.0 7.9 -94.7 141.7 43.4 1.9 10.5 3 20 A N S S- 0 0 141 -2,-0.3 -1,-0.2 1,-0.1 0, 0.0 0.880 75.2-165.6 59.3 48.6 40.3 3.1 8.7 4 21 A L - 0 0 85 -3,-0.4 -1,-0.1 1,-0.1 33,-0.0 -0.287 22.2-131.0 -58.0 141.2 37.8 3.4 11.7 5 22 A P S S+ 0 0 20 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.866 89.2 56.1 -69.8 -29.3 34.1 3.8 10.7 6 23 A Y S S- 0 0 9 61,-0.1 2,-0.9 28,-0.0 -2,-0.1 -0.829 76.0-138.7-105.7 140.9 33.6 6.8 13.1 7 24 A D > - 0 0 87 -2,-0.4 3,-1.3 59,-0.2 61,-0.4 -0.826 12.5-168.6 -99.6 104.2 35.5 10.0 13.0 8 25 A E T 3 S+ 0 0 82 -2,-0.9 -1,-0.1 1,-0.3 59,-0.0 0.633 85.9 50.9 -68.9 -12.1 36.1 10.9 16.6 9 26 A H T 3 S+ 0 0 173 2,-0.1 -1,-0.3 -3,-0.0 -2,-0.0 0.464 83.2 119.7-102.4 -6.5 37.2 14.4 15.6 10 27 A A < - 0 0 25 -3,-1.3 2,-1.2 1,-0.1 3,-0.1 -0.246 68.9-126.5 -66.1 148.4 34.3 15.3 13.4 11 28 A D > - 0 0 96 1,-0.2 4,-2.3 2,-0.1 5,-0.2 -0.805 32.1-171.0 -85.2 91.1 32.1 18.3 14.1 12 29 A A H > S+ 0 0 4 -2,-1.2 4,-2.9 1,-0.2 5,-0.2 0.871 77.0 55.1 -64.0 -38.8 29.0 16.2 13.9 13 30 A W H > S+ 0 0 105 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.927 110.6 46.5 -58.9 -42.5 26.5 19.1 14.0 14 31 A T H > S+ 0 0 79 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.944 112.9 50.2 -62.7 -44.7 28.2 20.7 10.9 15 32 A Q H X S+ 0 0 79 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.884 111.8 46.9 -61.6 -41.5 28.2 17.3 9.2 16 33 A V H X S+ 0 0 1 -4,-2.9 4,-2.9 2,-0.2 5,-0.2 0.925 111.8 51.1 -67.7 -41.5 24.6 16.7 9.8 17 34 A K H X S+ 0 0 167 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.933 111.9 47.7 -58.0 -46.3 23.7 20.3 8.7 18 35 A K H X S+ 0 0 156 -4,-2.7 4,-1.5 2,-0.2 -1,-0.2 0.836 113.0 47.8 -64.0 -37.0 25.7 19.7 5.5 19 36 A A H X S+ 0 0 11 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.912 111.3 50.3 -72.2 -40.8 24.0 16.3 4.8 20 37 A L H X S+ 0 0 33 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.883 109.3 51.9 -65.3 -35.8 20.5 17.7 5.5 21 38 A A H X S+ 0 0 56 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.902 110.3 49.1 -64.6 -39.0 21.3 20.5 3.0 22 39 A A H X S+ 0 0 8 -4,-1.5 4,-2.6 1,-0.2 -2,-0.2 0.891 110.1 51.3 -67.0 -41.8 22.3 17.9 0.5 23 40 A G H X>S+ 0 0 0 -4,-2.6 5,-2.2 2,-0.2 4,-1.0 0.871 110.1 48.3 -62.3 -42.7 19.1 16.0 1.1 24 41 A K H <5S+ 0 0 144 -4,-2.3 3,-0.4 3,-0.2 -2,-0.2 0.948 114.2 47.4 -60.2 -46.5 17.0 19.0 0.6 25 42 A R H <5S+ 0 0 191 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.885 122.0 34.1 -60.0 -45.3 18.9 19.8 -2.6 26 43 A T H <5S- 0 0 54 -4,-2.6 -1,-0.2 2,-0.1 -2,-0.2 0.458 107.0-121.4 -91.8 -4.4 18.6 16.3 -4.0 27 44 A H T <5 + 0 0 152 -4,-1.0 -3,-0.2 -3,-0.4 -4,-0.1 0.938 69.2 131.5 57.2 47.7 15.2 15.5 -2.6 28 45 A K < - 0 0 43 -5,-2.2 -1,-0.2 -6,-0.1 34,-0.1 -0.949 60.3-111.8-124.0 148.1 16.5 12.6 -0.6 29 46 A P - 0 0 35 0, 0.0 34,-2.1 0, 0.0 2,-0.4 -0.405 31.0-126.5 -67.7 157.1 16.2 11.5 3.0 30 47 A T E -aB 63 96A 1 66,-3.0 66,-2.9 32,-0.2 2,-0.6 -0.909 12.4-147.5-107.8 135.2 19.3 11.7 5.2 31 48 A L E -aB 64 95A 0 32,-3.3 34,-2.5 -2,-0.4 2,-0.6 -0.923 8.6-163.4-103.2 116.4 20.4 8.7 7.2 32 49 A L E -aB 65 94A 0 62,-2.9 62,-2.0 -2,-0.6 2,-0.6 -0.923 5.2-163.8 -98.4 122.9 22.1 9.4 10.6 33 50 A V E -aB 66 93A 7 32,-2.8 34,-3.1 -2,-0.6 2,-0.5 -0.943 2.2-163.0-113.7 110.8 24.0 6.5 11.9 34 51 A F E +aB 67 92A 0 58,-3.0 58,-1.9 -2,-0.6 2,-0.3 -0.833 37.0 105.1 -95.5 129.7 24.9 6.7 15.6 35 52 A G E -a 68 0A 0 32,-2.2 34,-2.7 -2,-0.5 35,-0.5 -0.916 50.3-119.5-174.3-164.2 27.7 4.4 16.9 36 53 A A > - 0 0 0 -2,-0.3 3,-1.3 32,-0.2 7,-0.2 -0.990 26.5-112.2-159.0 159.6 31.3 4.2 18.0 37 54 A N T 3 S+ 0 0 14 -2,-0.3 6,-0.1 1,-0.3 -1,-0.1 0.757 111.1 60.3 -71.1 -24.9 34.5 2.4 17.0 38 55 A W T 3 S+ 0 0 119 32,-0.1 2,-0.6 4,-0.0 -1,-0.3 0.639 85.1 94.0 -73.1 -17.9 34.6 0.2 20.1 39 56 A C <> - 0 0 6 -3,-1.3 4,-2.3 1,-0.2 5,-0.2 -0.695 60.9-159.7 -90.4 116.8 31.3 -1.4 19.3 40 57 A T H > S+ 0 0 64 -2,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.839 93.8 54.3 -64.7 -32.4 31.5 -4.6 17.4 41 58 A D H > S+ 0 0 18 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.903 108.5 49.6 -66.7 -35.6 27.9 -4.3 16.1 42 59 A C H > S+ 0 0 1 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.913 110.9 49.1 -66.6 -40.6 28.7 -0.8 14.8 43 60 A R H X S+ 0 0 104 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.906 111.8 49.6 -64.7 -40.1 31.8 -2.1 13.0 44 61 A A H X S+ 0 0 28 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.904 109.3 50.9 -64.6 -42.0 29.8 -5.0 11.5 45 62 A L H X S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.943 111.3 48.7 -60.7 -46.2 27.0 -2.7 10.3 46 63 A D H X S+ 0 0 25 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.920 109.5 52.0 -60.0 -43.1 29.6 -0.5 8.6 47 64 A K H < S+ 0 0 144 -4,-2.3 4,-0.5 1,-0.2 3,-0.4 0.918 112.2 46.0 -61.4 -44.8 31.3 -3.4 6.9 48 65 A S H >< S+ 0 0 6 -4,-2.3 3,-1.5 1,-0.2 6,-0.3 0.919 109.4 53.0 -62.8 -42.6 28.0 -4.7 5.5 49 66 A L H 3< S+ 0 0 29 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.736 102.9 62.1 -65.6 -19.7 27.0 -1.3 4.3 50 67 A R T 3< S+ 0 0 152 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.626 81.3 104.2 -76.8 -18.7 30.3 -1.1 2.5 51 68 A N S <> S- 0 0 44 -3,-1.5 4,-2.7 -4,-0.5 5,-0.2 -0.080 85.9-107.4 -67.8 166.1 29.6 -4.1 0.3 52 69 A Q H > S+ 0 0 177 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.931 114.8 44.7 -63.6 -47.3 28.7 -3.5 -3.4 53 70 A K H > S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.944 119.4 41.8 -62.0 -45.2 24.9 -4.4 -3.2 54 71 A N H > S+ 0 0 2 -6,-0.3 4,-2.6 1,-0.2 5,-0.2 0.882 110.8 55.4 -75.8 -36.7 24.4 -2.4 0.0 55 72 A T H X S+ 0 0 63 -4,-2.7 4,-2.9 2,-0.2 5,-0.3 0.904 108.7 50.1 -56.7 -44.5 26.5 0.6 -1.1 56 73 A A H X S+ 0 0 61 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.920 110.9 48.2 -65.9 -43.4 24.4 1.0 -4.2 57 74 A L H X S+ 0 0 13 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.949 117.0 41.9 -58.7 -47.7 21.2 0.9 -2.2 58 75 A I H X S+ 0 0 17 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.930 114.5 49.9 -70.1 -44.1 22.3 3.5 0.3 59 76 A A H < S+ 0 0 60 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.888 111.4 49.3 -64.1 -38.0 24.0 5.8 -2.2 60 77 A K H < S+ 0 0 146 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.875 123.8 28.0 -66.6 -35.4 20.9 5.8 -4.5 61 78 A H H < S+ 0 0 49 -4,-1.6 2,-0.3 -5,-0.2 -2,-0.2 0.697 114.4 39.8-105.6 -19.6 18.5 6.6 -1.7 62 79 A F < - 0 0 6 -4,-2.8 2,-0.4 -5,-0.2 -32,-0.2 -0.916 55.0-136.1-135.6 152.0 20.2 8.5 1.1 63 80 A E E -a 30 0A 46 -34,-2.1 -32,-3.3 -2,-0.3 2,-0.4 -0.790 43.6-150.5 -89.1 147.1 22.6 11.2 2.2 64 81 A V E +a 31 0A 66 -2,-0.4 2,-0.4 -34,-0.2 -32,-0.2 -0.986 24.0 178.2-133.0 139.0 24.5 9.6 5.1 65 82 A V E -a 32 0A 10 -34,-2.5 -32,-2.8 -2,-0.4 2,-0.5 -0.992 17.4-148.6-134.7 130.6 26.3 10.9 8.2 66 83 A K E -a 33 0A 72 -2,-0.4 2,-0.5 -34,-0.2 -59,-0.2 -0.881 14.1-160.5 -96.8 126.6 28.0 8.8 10.9 67 84 A I E -a 34 0A 1 -34,-3.1 -32,-2.2 -2,-0.5 2,-0.4 -0.957 10.2-140.8-114.1 114.3 27.9 10.3 14.3 68 85 A D E -a 35 0A 4 -2,-0.5 -32,-0.2 -61,-0.4 -56,-0.1 -0.599 18.8-179.9 -69.8 126.6 30.4 9.1 17.0 69 86 A V >> - 0 0 0 -34,-2.7 4,-2.1 -2,-0.4 5,-1.7 0.376 23.5-157.8-107.7 6.1 28.8 8.7 20.4 70 87 A G T 45 - 0 0 1 -35,-0.5 2,-1.7 1,-0.2 -1,-0.3 -0.230 68.3 -17.1 58.5-145.0 32.1 7.6 22.1 71 88 A N T 45S- 0 0 103 1,-0.2 -1,-0.2 2,-0.0 -35,-0.0 -0.428 118.1 -69.5 -85.6 59.5 31.5 5.7 25.3 72 89 A F T 45S+ 0 0 96 -2,-1.7 -2,-0.2 1,-0.1 -1,-0.2 0.902 127.3 96.8 48.4 46.7 28.0 7.0 25.4 73 90 A D T <5 + 0 0 90 -4,-2.1 2,-0.3 1,-0.1 -3,-0.2 0.193 61.4 73.1-150.6 16.7 29.7 10.4 26.1 74 91 A R S > S+ 0 0 36 -2,-0.3 4,-1.7 1,-0.1 3,-0.7 0.741 76.0 147.4 54.3 29.4 27.4 14.0 20.7 76 93 A L H 3> + 0 0 67 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.854 66.4 56.1 -67.5 -32.0 24.7 13.1 23.2 77 94 A E H 3> S+ 0 0 90 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.795 103.4 55.0 -69.6 -25.9 22.8 16.3 22.5 78 95 A L H <> S+ 0 0 0 -3,-0.7 4,-1.0 2,-0.2 -2,-0.2 0.903 108.4 48.3 -73.9 -37.0 22.6 15.4 18.8 79 96 A S H ><>S+ 0 0 2 -4,-1.7 5,-2.2 1,-0.2 3,-0.8 0.944 111.9 50.1 -58.7 -49.1 21.1 12.1 19.7 80 97 A Q H ><5S+ 0 0 123 -4,-2.5 3,-1.2 1,-0.2 -2,-0.2 0.881 106.3 56.0 -59.2 -35.4 18.6 13.9 22.0 81 98 A A H 3<5S+ 0 0 61 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.773 109.5 46.2 -66.6 -27.8 17.7 16.3 19.2 82 99 A Y T <<5S- 0 0 34 -4,-1.0 -1,-0.3 -3,-0.8 -2,-0.2 0.022 133.7 -76.6-112.8 24.8 16.8 13.5 16.9 83 100 A G T < 5 - 0 0 39 -3,-1.2 -3,-0.2 1,-0.1 -2,-0.1 0.698 67.4 -80.9 95.9 24.0 14.7 11.4 19.2 84 101 A D > < + 0 0 46 -5,-2.2 3,-1.5 -6,-0.1 4,-0.4 0.849 61.9 170.1 54.4 46.4 17.2 9.6 21.5 85 102 A P G > S+ 0 0 1 0, 0.0 3,-0.7 0, 0.0 24,-0.2 0.780 70.9 54.4 -59.1 -30.5 18.0 6.8 18.9 86 103 A I G > S+ 0 0 11 1,-0.2 3,-2.2 2,-0.1 -2,-0.1 0.595 83.8 82.0 -82.2 -11.0 20.9 5.5 21.1 87 104 A Q G < S+ 0 0 132 -3,-1.5 -1,-0.2 1,-0.3 3,-0.1 0.789 93.8 50.2 -68.3 -15.8 19.0 5.0 24.3 88 105 A D G < S- 0 0 68 -3,-0.7 -1,-0.3 -4,-0.4 24,-0.2 0.259 129.6 -77.7-102.3 8.2 17.8 1.7 22.9 89 106 A G < - 0 0 21 -3,-2.2 -1,-0.4 22,-0.1 20,-0.2 -0.208 60.0 -53.0 114.0 161.8 21.4 0.6 21.9 90 107 A I S S+ 0 0 10 22,-0.2 2,-0.2 -2,-0.1 -49,-0.2 -0.868 100.7 47.9-118.1 153.5 24.0 1.2 19.2 91 108 A P S S+ 0 0 0 0, 0.0 20,-0.4 0, 0.0 2,-0.3 0.579 79.7 165.9 -68.5 152.6 24.3 1.2 16.2 92 109 A A E -B 34 0A 0 -58,-1.9 -58,-3.0 -2,-0.2 2,-0.3 -0.962 19.1-151.3-135.9 151.1 21.1 3.2 15.9 93 110 A V E -B 33 0A 0 -2,-0.3 13,-2.3 -60,-0.2 2,-0.4 -0.931 10.2-164.7-128.7 152.1 19.7 5.1 12.9 94 111 A V E -BC 32 105A 0 -62,-2.0 -62,-2.9 -2,-0.3 2,-0.6 -0.997 11.4-154.3-125.4 134.8 17.5 8.2 12.3 95 112 A V E -BC 31 104A 0 9,-3.0 8,-3.3 -2,-0.4 9,-1.5 -0.950 13.1-167.7-106.5 122.5 15.9 8.8 8.8 96 113 A V E -BC 30 102A 0 -66,-2.9 -66,-3.0 -2,-0.6 6,-0.3 -0.952 19.0-125.8-110.3 131.0 15.3 12.5 8.3 97 114 A N > - 0 0 62 4,-2.8 3,-2.4 -2,-0.5 -73,-0.1 -0.140 32.9 -95.7 -70.4 169.7 13.1 13.5 5.3 98 115 A S T 3 S+ 0 0 30 1,-0.3 -71,-0.1 2,-0.1 -1,-0.1 0.679 123.4 62.0 -64.0 -18.1 14.2 15.9 2.7 99 116 A D T 3 S- 0 0 102 2,-0.2 -1,-0.3 -72,-0.1 3,-0.1 0.370 119.9-105.0 -86.4 3.2 12.3 18.7 4.6 100 117 A G S < S+ 0 0 33 -3,-2.4 2,-0.4 1,-0.3 -2,-0.1 0.482 81.7 122.9 91.4 0.7 14.5 18.3 7.7 101 118 A K - 0 0 145 1,-0.1 -4,-2.8 -5,-0.0 -1,-0.3 -0.808 67.5-107.2-103.2 138.4 11.9 16.4 9.8 102 119 A V E +C 96 0A 65 -2,-0.4 -6,-0.3 -6,-0.3 3,-0.1 -0.321 33.5 176.6 -60.4 136.1 12.5 13.0 11.3 103 120 A R E + 0 0 132 -8,-3.3 2,-0.3 1,-0.4 -7,-0.2 0.745 65.4 2.6-100.0 -44.4 10.6 10.1 9.7 104 121 A Y E -C 95 0A 73 -9,-1.5 -9,-3.0 2,-0.0 -1,-0.4 -0.996 54.1-174.7-151.5 142.2 11.9 7.1 11.6 105 122 A T E -C 94 0A 21 -2,-0.3 2,-0.8 -11,-0.2 -11,-0.2 -0.988 34.7-114.8-133.4 148.4 14.2 6.3 14.4 106 123 A T + 0 0 2 -13,-2.3 -18,-0.3 -2,-0.3 3,-0.1 -0.748 43.7 162.5 -81.7 110.4 15.3 2.8 15.7 107 124 A K + 0 0 86 -2,-0.8 -1,-0.1 1,-0.1 -15,-0.0 0.210 65.2 52.9-111.9 7.6 13.7 2.8 19.2 108 125 A G S S- 0 0 60 -19,-0.1 -1,-0.1 -23,-0.0 -2,-0.1 0.048 116.1 -96.9-132.1 24.4 13.9 -1.0 20.0 109 126 A G > + 0 0 18 -24,-0.2 3,-1.7 -20,-0.2 4,-0.4 0.816 62.4 165.4 64.3 33.1 17.5 -1.7 19.3 110 127 A E T 3 S+ 0 0 81 1,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.786 80.1 27.3 -51.8 -36.2 16.6 -2.9 15.8 111 128 A L T > S+ 0 0 0 -20,-0.4 3,-1.9 -22,-0.1 -1,-0.3 0.313 88.9 106.7-110.1 10.7 20.3 -2.9 14.8 112 129 A A T < S+ 0 0 23 -3,-1.7 3,-0.2 1,-0.3 -22,-0.2 0.644 86.0 43.5 -72.0 -13.8 21.9 -3.4 18.2 113 130 A N T > S+ 0 0 90 -4,-0.4 3,-2.5 -3,-0.2 4,-0.5 -0.101 72.0 136.0-112.5 35.0 22.8 -7.0 17.2 114 131 A A G X + 0 0 2 -3,-1.9 3,-1.2 1,-0.3 -1,-0.1 0.769 61.7 69.2 -57.5 -26.4 24.1 -6.1 13.7 115 132 A R G 3 S+ 0 0 108 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.733 103.6 44.9 -61.7 -20.5 27.2 -8.4 14.2 116 133 A K G < S+ 0 0 156 -3,-2.5 -1,-0.3 2,-0.1 -2,-0.2 0.472 95.1 100.2 -96.8 -11.3 24.8 -11.3 14.0 117 134 A X S < S- 0 0 60 -3,-1.2 2,-0.1 -4,-0.5 -6,-0.0 -0.477 70.8-125.7 -79.2 148.4 22.8 -10.0 11.0 118 135 A S > - 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