==== 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 TRANSPORT PROTEIN 03-DEC-09 3KXR . COMPND 2 MOLECULE: MAGNESIUM TRANSPORTER, PUTATIVE; . SOURCE 2 ORGANISM_SCIENTIFIC: SHEWANELLA ONEIDENSIS MR-1; . AUTHOR Z.FRATCZAK,M.D.ZIMMERMAN,M.CHRUSZCZ,M.CYMBOROWSKI,O.KAGAN, . 171 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10107.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 110 64.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 11.7 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 . 2 1.2 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 . 5 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 50 29.2 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+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 0 0 1 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 3 0 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 D 0 0 149 0, 0.0 2,-0.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 53.3 -11.7 8.9 21.3 2 8 A L - 0 0 111 1,-0.1 4,-0.0 3,-0.0 0, 0.0 -0.415 360.0-143.1 -92.6 155.9 -10.8 8.8 25.1 3 9 A L S > S+ 0 0 89 2,-0.2 3,-1.8 1,-0.2 4,-0.3 0.928 98.6 44.3 -79.3 -54.9 -10.9 11.5 27.7 4 10 A F G > S+ 0 0 29 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.827 108.6 61.8 -70.1 -25.2 -7.9 11.0 30.0 5 11 A A G 3 S+ 0 0 90 1,-0.2 -1,-0.3 26,-0.1 -2,-0.2 0.610 101.8 55.4 -65.2 -12.2 -5.9 10.4 26.7 6 12 A Q G < S+ 0 0 143 -3,-1.8 2,-0.5 1,-0.1 -1,-0.2 0.462 97.0 72.6-101.4 -6.6 -6.9 14.1 25.9 7 13 A L S < S- 0 0 43 -3,-1.0 -1,-0.1 -4,-0.3 -4,-0.0 -0.951 70.6-144.4-115.3 127.2 -5.5 15.7 29.1 8 14 A S > - 0 0 30 -2,-0.5 4,-1.9 1,-0.1 3,-0.4 -0.466 28.1-113.9 -81.7 158.3 -1.8 16.1 29.8 9 15 A P H > S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.847 120.2 58.3 -57.4 -28.9 -0.3 15.8 33.2 10 16 A E H > S+ 0 0 49 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.856 101.4 53.8 -66.9 -38.7 0.4 19.5 32.9 11 17 A D H > S+ 0 0 58 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.932 107.3 51.9 -58.3 -45.4 -3.2 20.3 32.4 12 18 A L H < S+ 0 0 1 -4,-1.9 -2,-0.2 1,-0.2 7,-0.2 0.934 111.5 46.3 -59.6 -44.7 -4.0 18.4 35.6 13 19 A I H >< S+ 0 0 24 -4,-2.0 3,-1.8 1,-0.2 4,-0.2 0.925 111.3 50.5 -62.7 -47.4 -1.4 20.5 37.5 14 20 A E H 3< S+ 0 0 140 -4,-2.7 3,-0.3 1,-0.3 -1,-0.2 0.844 116.6 42.8 -62.0 -32.0 -2.6 23.7 36.1 15 21 A W T >X S+ 0 0 128 -4,-2.1 4,-1.9 -5,-0.2 3,-1.7 0.071 76.0 118.7-102.4 25.8 -6.2 22.7 37.0 16 22 A S T <4 S+ 0 0 68 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.808 73.3 54.6 -67.1 -28.5 -5.4 21.4 40.5 17 23 A D T 34 S+ 0 0 137 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.598 117.0 36.7 -72.3 -11.7 -7.6 24.0 42.2 18 24 A Y T <4 S+ 0 0 167 -3,-1.7 -2,-0.2 2,-0.1 -1,-0.2 0.631 98.2 76.9-121.1 -22.2 -10.6 23.0 40.1 19 25 A L S < S- 0 0 31 -4,-1.9 -1,-0.0 -7,-0.2 2,-0.0 -0.817 82.1-113.4 -92.6 136.4 -10.6 19.2 39.5 20 26 A P >> - 0 0 75 0, 0.0 4,-2.0 0, 0.0 3,-0.6 -0.322 25.0-120.1 -57.5 146.4 -11.7 16.8 42.3 21 27 A E H 3> S+ 0 0 98 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.894 114.7 61.9 -60.6 -35.0 -8.8 14.6 43.6 22 28 A S H 3> S+ 0 0 70 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.871 104.9 46.5 -56.3 -39.8 -10.9 11.6 42.5 23 29 A F H <> S+ 0 0 34 -3,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.916 111.3 50.7 -71.8 -43.2 -10.7 12.9 38.9 24 30 A T H X S+ 0 0 16 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.958 110.5 50.5 -60.0 -46.9 -7.0 13.5 39.1 25 31 A D H X S+ 0 0 98 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.838 109.6 48.7 -60.4 -38.4 -6.4 10.0 40.4 26 32 A R H X S+ 0 0 124 -4,-1.8 4,-1.3 -5,-0.2 -1,-0.2 0.910 112.2 50.6 -69.9 -37.8 -8.4 8.3 37.7 27 33 A A H X S+ 0 0 2 -4,-2.4 4,-0.9 1,-0.2 -2,-0.2 0.919 111.2 47.9 -59.9 -44.9 -6.5 10.4 35.1 28 34 A L H >< S+ 0 0 19 -4,-2.6 3,-0.7 1,-0.2 -2,-0.2 0.896 109.3 53.1 -64.8 -43.5 -3.1 9.4 36.6 29 35 A A H 3< S+ 0 0 77 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.784 110.3 48.6 -61.8 -27.6 -4.1 5.7 36.7 30 36 A Q H 3< S+ 0 0 105 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.641 100.4 81.5 -91.6 -12.3 -5.0 5.8 33.0 31 37 A X S << S- 0 0 15 -4,-0.9 2,-0.1 -3,-0.7 -26,-0.1 -0.311 89.1 -87.7 -87.8 173.0 -1.8 7.5 31.9 32 38 A G > - 0 0 34 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.377 35.3-113.9 -74.3 156.4 1.7 6.1 31.2 33 39 A E H > S+ 0 0 105 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.868 119.0 57.5 -57.7 -36.6 4.2 5.8 34.0 34 40 A R H > S+ 0 0 95 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.893 107.3 47.6 -60.7 -41.2 6.3 8.5 32.1 35 41 A Q H > S+ 0 0 62 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.903 109.3 52.3 -70.3 -39.5 3.4 10.9 32.3 36 42 A R H X S+ 0 0 71 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.875 108.1 53.0 -59.0 -36.5 2.8 10.1 36.0 37 43 A Q H X S+ 0 0 69 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.919 107.3 51.0 -66.0 -41.4 6.5 10.9 36.6 38 44 A R H X S+ 0 0 94 -4,-1.8 4,-2.4 1,-0.2 5,-0.2 0.898 108.9 52.2 -62.4 -40.3 6.0 14.3 34.8 39 45 A F H X S+ 0 0 18 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.923 106.9 51.2 -63.0 -45.0 3.1 15.0 37.1 40 46 A E H X S+ 0 0 105 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.882 111.9 48.2 -61.6 -36.7 5.1 14.3 40.3 41 47 A L H X S+ 0 0 13 -4,-1.9 4,-3.2 2,-0.2 -1,-0.2 0.916 112.8 46.1 -69.8 -45.8 7.9 16.7 39.1 42 48 A Y H < S+ 0 0 36 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.855 112.8 52.9 -62.3 -33.6 5.5 19.5 38.2 43 49 A D H < S+ 0 0 99 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.812 117.6 35.7 -73.4 -28.4 3.7 18.9 41.5 44 50 A Q H < S+ 0 0 126 -4,-1.3 2,-0.4 -5,-0.2 -2,-0.2 0.824 116.9 51.1 -93.3 -33.5 6.9 19.2 43.5 45 51 A Y S < S- 0 0 19 -4,-3.2 -1,-0.2 -5,-0.1 81,-0.0 -0.896 77.4-130.2-116.8 136.4 8.8 21.9 41.5 46 52 A S > - 0 0 65 -2,-0.4 3,-2.0 1,-0.1 6,-0.3 -0.137 39.4 -86.0 -81.1 177.2 7.4 25.3 40.5 47 53 A E T 3 S+ 0 0 148 1,-0.3 -1,-0.1 5,-0.1 82,-0.0 0.645 124.2 44.3 -66.3 -22.1 7.6 26.8 37.0 48 54 A N T 3 S+ 0 0 82 80,-0.1 2,-0.4 81,-0.1 81,-0.4 0.060 91.3 99.0-110.6 27.2 11.0 28.3 37.2 49 55 A E X - 0 0 50 -3,-2.0 3,-1.7 79,-0.2 4,-0.4 -0.948 68.7-140.5-112.3 131.8 12.8 25.3 38.9 50 56 A I G > S+ 0 0 0 77,-2.8 3,-1.8 -2,-0.4 4,-0.4 0.804 96.0 75.7 -63.8 -26.2 14.8 23.0 36.7 51 57 A G G > S+ 0 0 0 74,-3.0 3,-1.1 1,-0.3 -1,-0.3 0.837 86.2 64.1 -46.1 -37.4 13.5 20.0 38.8 52 58 A R G < S+ 0 0 36 -3,-1.7 -1,-0.3 -6,-0.3 -2,-0.2 0.822 107.7 39.0 -61.4 -31.2 10.3 20.4 36.9 53 59 A Y G < S+ 0 0 78 -3,-1.8 -1,-0.2 -4,-0.4 -2,-0.2 0.200 86.8 133.4-109.1 14.3 11.9 19.5 33.5 54 60 A T < - 0 0 9 -3,-1.1 2,-0.5 -4,-0.4 103,-0.2 -0.378 48.7-141.0 -64.9 140.2 14.2 16.8 34.8 55 61 A D B -A 156 0A 51 101,-2.9 101,-2.8 1,-0.1 91,-0.1 -0.903 5.5-157.9-107.7 126.1 14.4 13.6 32.9 56 62 A H + 0 0 69 -2,-0.5 2,-0.5 99,-0.2 -1,-0.1 0.690 67.6 101.7 -76.2 -19.8 14.6 10.4 34.9 57 63 A Q + 0 0 100 99,-0.1 2,-0.3 -3,-0.0 99,-0.1 -0.550 53.5 122.2 -67.5 115.4 16.2 8.6 31.9 58 64 A X - 0 0 39 -2,-0.5 2,-0.7 2,-0.1 27,-0.1 -0.996 67.4 -95.6-166.3 162.4 19.9 8.4 32.4 59 65 A L + 0 0 2 25,-0.4 27,-2.9 -2,-0.3 2,-0.3 -0.817 54.8 158.3 -87.2 111.6 22.9 6.2 32.7 60 66 A V E +d 86 0B 43 -2,-0.7 2,-0.3 25,-0.2 27,-0.2 -0.998 14.9 176.8-135.7 141.8 23.5 5.7 36.5 61 67 A L E -d 87 0B 35 25,-2.4 27,-2.1 -2,-0.3 2,-0.0 -0.975 30.2-109.8-138.3 155.7 25.4 3.0 38.4 62 68 A S E > -d 88 0B 55 -2,-0.3 3,-2.0 25,-0.2 27,-0.2 -0.265 40.5 -97.4 -78.3 174.8 26.1 2.4 42.1 63 69 A D T 3 S+ 0 0 27 25,-1.3 50,-0.3 1,-0.3 26,-0.1 0.406 119.3 69.3 -80.0 7.2 29.6 2.8 43.6 64 70 A K T 3 S+ 0 0 158 48,-0.1 -1,-0.3 47,-0.1 2,-0.1 0.484 79.5 106.5 -92.8 -6.7 30.1 -0.9 43.4 65 71 A A < - 0 0 8 -3,-2.0 47,-2.5 46,-0.1 48,-0.5 -0.374 55.8-149.4 -76.4 154.3 30.2 -0.8 39.6 66 72 A T B >> -F 111 0C 33 45,-0.3 4,-1.8 46,-0.1 3,-0.7 -0.666 35.9 -95.1-111.0 170.7 33.4 -1.2 37.5 67 73 A V H 3> S+ 0 0 0 43,-2.3 4,-3.1 40,-0.4 5,-0.2 0.837 122.5 64.6 -48.1 -38.4 34.6 0.1 34.1 68 74 A A H 3> S+ 0 0 37 40,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.911 103.9 44.1 -58.4 -45.0 33.3 -3.1 32.6 69 75 A Q H <> S+ 0 0 89 -3,-0.7 4,-2.0 39,-0.3 -1,-0.2 0.900 113.5 50.6 -65.6 -40.6 29.7 -2.2 33.6 70 76 A A H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 5,-0.2 0.941 109.7 50.2 -66.1 -45.2 30.1 1.3 32.4 71 77 A Q H X S+ 0 0 44 -4,-3.1 4,-1.6 1,-0.2 -1,-0.2 0.916 111.8 48.2 -58.0 -42.4 31.5 0.3 29.0 72 78 A R H X S+ 0 0 156 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.856 108.2 55.3 -69.6 -32.1 28.6 -2.2 28.5 73 79 A F H X S+ 0 0 46 -4,-2.0 4,-1.1 1,-0.2 -1,-0.2 0.922 109.3 46.1 -65.6 -43.3 26.0 0.5 29.5 74 80 A F H < S+ 0 0 10 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.838 116.3 45.9 -69.7 -31.9 27.3 2.9 26.9 75 81 A R H < S+ 0 0 122 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.794 115.3 44.5 -82.5 -25.8 27.4 0.2 24.2 76 82 A R H < S+ 0 0 152 -4,-2.1 2,-0.4 -5,-0.1 -2,-0.2 0.574 106.5 60.1 -96.5 -12.6 23.9 -1.4 25.0 77 83 A I < - 0 0 67 -4,-1.1 2,-0.5 -5,-0.2 -1,-0.0 -0.962 61.0-154.7-123.5 136.0 21.8 1.7 25.3 78 84 A E + 0 0 192 -2,-0.4 2,-0.4 2,-0.0 -3,-0.1 -0.948 27.7 166.8-106.5 124.7 21.0 4.4 22.9 79 85 A L > - 0 0 40 -2,-0.5 3,-0.7 3,-0.2 -2,-0.0 -0.999 38.4-105.4-143.8 137.7 20.1 7.7 24.6 80 86 A D T 3 S- 0 0 75 -2,-0.4 -2,-0.0 1,-0.2 0, 0.0 -0.337 98.4 -1.7 -60.0 137.0 19.7 11.3 23.5 81 87 A C T 3 S+ 0 0 21 1,-0.2 2,-0.5 77,-0.1 -1,-0.2 0.897 95.6 148.0 50.5 55.0 22.5 13.6 24.5 82 88 A N < + 0 0 11 -3,-0.7 -1,-0.2 1,-0.1 -3,-0.2 -0.967 15.5 124.3-130.3 116.9 24.4 11.1 26.4 83 89 A D + 0 0 46 -2,-0.5 17,-2.6 -24,-0.1 18,-0.3 0.208 65.8 68.4-146.9 22.9 28.0 10.7 26.9 84 90 A N E - E 0 99B 2 15,-0.2 2,-0.4 16,-0.1 -25,-0.4 -0.918 59.0-151.7-133.5 160.9 28.3 10.6 30.7 85 91 A L E - E 0 98B 0 13,-2.3 13,-2.9 -2,-0.3 2,-0.4 -0.995 15.5-135.0-138.0 138.6 27.3 8.2 33.4 86 92 A F E -dE 60 97B 0 -27,-2.9 -25,-2.4 -2,-0.4 2,-0.5 -0.777 9.4-150.2-104.5 138.7 26.5 9.1 37.0 87 93 A I E -dE 61 96B 0 9,-2.7 8,-2.9 -2,-0.4 9,-1.2 -0.912 16.7-179.4-110.2 131.4 27.6 7.3 40.1 88 94 A V E -dE 62 94B 10 -27,-2.1 -25,-1.3 -2,-0.5 6,-0.2 -0.888 22.5-124.8-124.5 155.8 25.6 7.1 43.3 89 95 A D > - 0 0 44 4,-1.9 3,-1.9 -2,-0.3 -1,-0.0 -0.225 48.2 -83.7 -83.8-174.4 26.1 5.6 46.7 90 96 A E T 3 S+ 0 0 180 1,-0.3 -1,-0.0 2,-0.1 -28,-0.0 0.654 131.1 53.8 -73.3 -14.2 23.7 3.1 48.3 91 97 A A T 3 S- 0 0 52 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.202 121.1-108.4 -96.2 13.2 21.5 5.9 49.6 92 98 A D < + 0 0 83 -3,-1.9 61,-2.0 1,-0.2 2,-0.4 0.652 65.3 156.0 72.8 15.9 21.3 7.3 46.0 93 99 A K B -G 152 0D 64 59,-0.2 -4,-1.9 1,-0.1 2,-0.3 -0.624 49.9-113.9 -73.6 130.3 23.5 10.3 46.8 94 100 A Y E +E 88 0B 38 57,-2.3 -6,-0.2 -2,-0.4 3,-0.1 -0.503 39.1 172.7 -62.5 125.7 25.2 11.6 43.7 95 101 A L E - 0 0 61 -8,-2.9 2,-0.3 1,-0.3 -7,-0.2 0.680 52.4 -63.1-100.7 -35.0 28.9 11.1 44.0 96 102 A G E -E 87 0B 0 -9,-1.2 -9,-2.7 2,-0.0 2,-0.4 -0.986 45.7 -85.5 167.7-174.9 30.2 12.1 40.5 97 103 A T E -E 86 0B 5 20,-0.3 20,-3.1 -2,-0.3 2,-0.4 -0.954 20.3-158.4-127.0 136.4 30.3 11.6 36.8 98 104 A V E -E 85 0B 2 -13,-2.9 -13,-2.3 -2,-0.4 2,-0.3 -0.963 21.6-133.4-111.2 140.7 32.4 9.4 34.6 99 105 A R E > -E 84 0B 14 -2,-0.4 4,-2.8 -15,-0.2 3,-0.3 -0.725 10.2-130.0 -94.8 142.8 32.8 10.3 30.9 100 106 A R H > S+ 0 0 90 -17,-2.6 4,-1.6 -2,-0.3 5,-0.1 0.905 107.5 52.8 -48.8 -52.2 32.5 7.9 28.0 101 107 A Y H 4 S+ 0 0 155 -18,-0.3 -1,-0.2 1,-0.2 3,-0.1 0.896 113.9 42.2 -58.2 -41.2 35.7 9.0 26.4 102 108 A D H >4 S+ 0 0 64 -3,-0.3 3,-2.2 1,-0.2 4,-0.3 0.910 109.1 56.8 -72.0 -41.9 37.7 8.4 29.6 103 109 A I H >< S+ 0 0 1 -4,-2.8 3,-0.7 1,-0.3 -1,-0.2 0.729 98.5 60.5 -72.6 -16.4 36.1 5.2 30.6 104 110 A F T 3< S+ 0 0 84 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.461 102.5 56.3 -81.4 3.2 37.0 3.5 27.3 105 111 A K T < S+ 0 0 136 -3,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.433 95.8 78.0-106.3 -2.5 40.7 4.2 28.3 106 112 A H S < S- 0 0 67 -3,-0.7 9,-0.0 -4,-0.3 -3,-0.0 -0.509 89.3 -91.5-104.3 172.4 40.7 2.4 31.6 107 113 A E > - 0 0 111 -2,-0.2 3,-1.8 1,-0.1 -40,-0.4 -0.612 32.9-125.9 -82.4 143.1 40.9 -1.3 32.6 108 114 A P T 3 S+ 0 0 59 0, 0.0 -40,-2.3 0, 0.0 -39,-0.3 0.708 105.7 60.5 -64.9 -22.8 37.5 -3.0 33.0 109 115 A H T 3 S+ 0 0 141 -42,-0.2 -2,-0.0 -43,-0.1 -3,-0.0 0.557 81.8 110.0 -78.3 -8.6 38.2 -4.3 36.5 110 116 A E S < S- 0 0 45 -3,-1.8 -43,-2.3 1,-0.1 -42,-0.1 -0.486 73.9-115.9 -76.8 132.4 38.6 -0.7 37.8 111 117 A P B > -F 66 0C 63 0, 0.0 3,-1.3 0, 0.0 -45,-0.3 -0.417 13.0-138.9 -67.4 136.9 36.0 0.7 40.2 112 118 A L G > S+ 0 0 0 -47,-2.5 3,-2.6 1,-0.3 -46,-0.1 0.854 100.6 69.3 -62.6 -33.1 34.2 3.7 38.8 113 119 A I G > S+ 0 0 79 -48,-0.5 3,-0.5 -50,-0.3 -1,-0.3 0.782 97.3 54.0 -60.4 -21.4 34.3 5.3 42.1 114 120 A S G < S+ 0 0 75 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.489 106.8 51.3 -87.7 -1.1 38.1 5.7 41.5 115 121 A L G < S+ 0 0 34 -3,-2.6 -1,-0.2 -4,-0.2 -2,-0.2 -0.013 70.6 151.0-125.3 30.5 37.6 7.4 38.2 116 122 A L < - 0 0 55 -3,-0.5 -18,-0.2 -18,-0.1 2,-0.1 -0.412 53.0-107.8 -69.4 137.5 35.2 10.3 38.9 117 123 A S - 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