==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE, OXIDOREDUCTASE 15-MAY-03 1PBT . COMPND 2 MOLECULE: 6-PHOSPHOGLUCONOLACTONASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR Y.KIM,A.JOACHIMIAK,A.EDWARDS,T.SKARINA,A.SAVCHENKO,MIDWEST . 220 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10548.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 158 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 15.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 5.5 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 . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 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 . 19 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 59 26.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 0 0 2 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 1 1 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 PARALLEL BRIDGES PER LADDER . 2 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 X 0 0 209 0, 0.0 2,-0.4 0, 0.0 211,-0.0 0.000 360.0 360.0 360.0 179.3 31.6 22.7 31.9 2 2 A E + 0 0 86 211,-0.1 2,-0.2 209,-0.1 211,-0.2 -0.786 360.0 137.6 -96.7 130.1 29.4 20.1 30.1 3 3 A K E -a 213 0A 101 209,-0.8 211,-1.8 -2,-0.4 2,-0.4 -0.888 47.1 -95.1-154.4-175.8 27.3 17.6 32.0 4 4 A T E -a 214 0A 55 -2,-0.2 2,-0.4 209,-0.2 211,-0.2 -0.904 27.2-166.3-115.2 141.2 23.9 15.9 32.1 5 5 A V E -a 215 0A 46 209,-2.4 211,-2.9 -2,-0.4 2,-0.5 -0.988 3.9-160.1-127.2 135.7 20.9 17.0 34.2 6 6 A I E -a 216 0A 59 -2,-0.4 2,-0.5 209,-0.2 211,-0.2 -0.972 0.6-161.5-121.6 126.7 17.8 14.8 34.9 7 7 A Y E -a 217 0A 81 209,-3.1 211,-3.4 -2,-0.5 2,-0.7 -0.929 4.3-159.0-107.4 126.0 14.4 16.2 36.0 8 8 A L E -a 218 0A 99 -2,-0.5 2,-0.4 209,-0.2 211,-0.2 -0.911 15.6-169.1-106.6 108.1 12.0 13.8 37.6 9 9 A L E +a 219 0A 24 209,-3.2 211,-0.9 -2,-0.7 4,-0.1 -0.857 24.1 179.4-107.8 132.1 8.5 15.2 37.4 10 10 A E S S+ 0 0 147 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.753 73.3 16.4 -92.7 -32.8 5.4 13.9 39.1 11 11 A D S S+ 0 0 147 1,-0.1 -1,-0.2 2,-0.1 5,-0.1 -0.923 111.6 23.7-142.0 166.4 3.0 16.5 37.8 12 12 A G > + 0 0 43 -2,-0.3 4,-2.3 -3,-0.1 5,-0.2 0.836 64.8 165.2 46.7 43.4 2.4 19.2 35.1 13 13 A Y H > + 0 0 9 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.939 67.5 43.3 -52.8 -61.8 4.9 17.5 32.8 14 14 A V H > S+ 0 0 30 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.945 115.3 47.7 -54.6 -53.6 4.1 19.3 29.5 15 15 A D H > S+ 0 0 106 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.896 112.8 50.5 -56.4 -40.5 3.7 22.8 31.1 16 16 A F H X S+ 0 0 65 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.953 112.9 44.9 -62.0 -50.4 7.0 22.3 32.9 17 17 A V H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.928 111.9 52.6 -59.1 -46.3 8.9 21.2 29.8 18 18 A V H X S+ 0 0 10 -4,-3.0 4,-3.1 -5,-0.2 -1,-0.2 0.925 109.1 49.6 -56.9 -46.4 7.3 24.0 27.7 19 19 A E H X S+ 0 0 85 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.895 111.6 49.2 -62.1 -39.0 8.4 26.6 30.2 20 20 A K H X S+ 0 0 71 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.937 114.4 43.3 -65.7 -45.9 12.0 25.2 30.3 21 21 A I H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 5,-0.3 0.905 113.1 54.6 -65.6 -39.8 12.2 25.2 26.5 22 22 A R H X S+ 0 0 61 -4,-3.1 4,-2.4 -5,-0.3 -2,-0.2 0.939 109.1 46.1 -59.3 -48.5 10.6 28.7 26.4 23 23 A T H X S+ 0 0 44 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.906 113.3 50.3 -61.1 -42.5 13.2 30.1 28.7 24 24 A K H X S+ 0 0 23 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.915 111.5 46.2 -63.9 -44.8 16.1 28.6 26.8 25 25 A X H X S+ 0 0 3 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.904 111.6 53.0 -65.5 -39.4 14.9 29.8 23.4 26 26 A E H X S+ 0 0 72 -4,-2.4 4,-1.1 -5,-0.3 -2,-0.2 0.938 111.0 46.8 -60.4 -45.1 14.3 33.3 24.9 27 27 A K H >X S+ 0 0 88 -4,-2.4 4,-0.9 1,-0.2 3,-0.5 0.919 112.2 50.3 -61.8 -44.8 17.9 33.2 26.2 28 28 A L H >X S+ 0 0 2 -4,-2.6 4,-2.2 1,-0.2 3,-0.8 0.906 108.0 52.6 -61.1 -42.2 19.2 32.0 22.9 29 29 A L H 3< S+ 0 0 12 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.724 104.4 56.2 -68.6 -20.3 17.4 34.7 21.0 30 30 A E H << S+ 0 0 158 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.736 114.1 41.3 -81.2 -20.9 18.9 37.4 23.3 31 31 A E H << S+ 0 0 138 -4,-0.9 2,-0.3 -3,-0.8 -2,-0.2 0.762 121.3 25.8 -95.6 -31.1 22.3 36.1 22.3 32 32 A K < - 0 0 63 -4,-2.2 -1,-0.2 1,-0.1 3,-0.1 -0.957 64.8-129.8-137.0 155.8 22.0 35.4 18.5 33 33 A D S S+ 0 0 114 -2,-0.3 2,-0.4 1,-0.1 -1,-0.1 0.896 96.3 27.5 -69.9 -42.1 19.9 36.7 15.6 34 34 A K - 0 0 96 -6,-0.1 2,-0.4 28,-0.0 28,-0.2 -0.943 67.2-163.5-124.3 144.9 18.9 33.2 14.4 35 35 A I E -b 62 0A 0 26,-2.2 28,-2.9 -2,-0.4 2,-0.5 -0.950 8.9-148.0-125.6 148.2 18.6 29.9 16.3 36 36 A F E -b 63 0A 13 -2,-0.4 91,-2.4 26,-0.2 92,-1.6 -0.970 16.1-172.4-121.1 124.0 18.4 26.4 14.8 37 37 A V E -bc 64 128A 0 26,-3.3 28,-2.4 -2,-0.5 2,-0.4 -0.954 13.9-148.1-123.8 131.0 16.3 23.8 16.6 38 38 A V E -bc 65 129A 0 90,-3.0 92,-3.2 -2,-0.4 2,-0.4 -0.802 17.1-161.4 -95.7 136.9 16.1 20.0 15.9 39 39 A L E -bc 66 130A 3 26,-3.2 28,-2.5 -2,-0.4 29,-0.4 -0.971 6.9-155.3-124.6 129.9 12.8 18.3 16.6 40 40 A A - 0 0 5 90,-2.3 29,-0.0 -2,-0.4 2,-0.0 -0.594 18.1-133.7 -92.5 159.1 12.0 14.6 17.0 41 41 A G + 0 0 12 -2,-0.2 3,-0.2 27,-0.1 -1,-0.1 0.024 50.0 103.5 -90.9-154.6 8.5 13.3 16.3 42 42 A G S > S- 0 0 35 1,-0.1 4,-1.7 2,-0.1 -2,-0.0 -0.010 80.0 -74.3 100.2 156.9 6.6 10.9 18.6 43 43 A R T 4 S+ 0 0 233 1,-0.2 -1,-0.1 2,-0.2 -2,-0.0 0.716 122.0 50.6 -65.0 -24.6 3.8 11.0 21.1 44 44 A T T > S+ 0 0 22 -3,-0.2 4,-0.6 140,-0.1 -1,-0.2 0.904 112.2 42.4 -84.1 -40.3 5.7 12.8 23.9 45 45 A P H >> S+ 0 0 3 0, 0.0 4,-2.2 0, 0.0 3,-0.5 0.866 100.2 71.3 -74.2 -33.1 7.2 15.7 22.0 46 46 A L H 3X S+ 0 0 30 -4,-1.7 4,-2.4 1,-0.2 5,-0.1 0.895 95.9 49.8 -48.9 -51.4 4.1 16.6 20.0 47 47 A P H 3> S+ 0 0 43 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.849 110.9 52.4 -57.7 -35.9 2.0 18.0 22.9 48 48 A V H X S+ 0 0 86 -4,-1.4 3,-1.3 1,-0.2 4,-0.5 0.877 111.8 56.8 -75.8 -40.3 2.0 24.6 23.3 52 52 A L H >< S+ 0 0 9 -4,-2.4 3,-1.3 1,-0.3 -2,-0.2 0.860 98.9 61.7 -60.0 -34.7 5.2 26.1 22.0 53 53 A A T 3< S+ 0 0 9 -4,-2.6 -1,-0.3 1,-0.3 40,-0.2 0.741 99.1 57.1 -63.3 -22.2 3.4 27.1 18.8 54 54 A E T <4 S+ 0 0 102 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.655 86.8 102.1 -83.6 -15.5 1.1 29.3 20.9 55 55 A Q S << S- 0 0 58 -3,-1.3 2,-1.5 -4,-0.5 -3,-0.0 -0.336 82.4-113.1 -71.2 147.0 4.0 31.3 22.4 56 56 A K + 0 0 202 -2,-0.1 -1,-0.1 2,-0.1 -2,-0.1 -0.644 57.9 150.6 -83.4 90.5 4.9 34.7 21.2 57 57 A F - 0 0 17 -2,-1.5 2,-2.0 -4,-0.1 3,-0.1 -0.824 60.6-107.7-116.2 157.5 8.3 34.1 19.6 58 58 A P > - 0 0 43 0, 0.0 3,-3.0 0, 0.0 4,-0.3 -0.604 42.1-172.2 -84.9 77.0 9.8 35.9 16.6 59 59 A W G > S+ 0 0 30 -2,-2.0 3,-1.3 1,-0.3 35,-0.0 0.683 74.4 66.7 -46.1 -28.7 9.2 32.9 14.4 60 60 A N G 3 S+ 0 0 105 1,-0.2 -1,-0.3 34,-0.1 34,-0.1 0.648 100.1 52.5 -72.1 -11.3 11.2 34.3 11.5 61 61 A R G < S+ 0 0 63 -3,-3.0 -26,-2.2 -27,-0.1 2,-0.5 0.393 96.9 79.8-101.9 0.6 14.3 34.1 13.6 62 62 A I E < -b 35 0A 0 -3,-1.3 2,-0.4 -4,-0.3 -26,-0.2 -0.943 60.2-165.7-115.2 126.4 13.8 30.4 14.5 63 63 A H E -b 36 0A 21 -28,-2.9 -26,-3.3 -2,-0.5 2,-0.4 -0.920 8.4-154.6-111.8 135.8 14.7 27.6 12.0 64 64 A F E -bd 37 99A 7 34,-2.6 36,-2.5 -2,-0.4 2,-0.4 -0.875 10.6-174.8-115.0 143.3 13.5 24.0 12.6 65 65 A F E -bd 38 100A 0 -28,-2.4 -26,-3.2 -2,-0.4 2,-0.2 -0.996 25.5-125.3-133.5 134.1 14.9 20.6 11.4 66 66 A L E -b 39 0A 0 34,-1.3 -26,-0.2 -2,-0.4 3,-0.1 -0.578 12.8-142.5 -75.9 143.2 13.4 17.2 11.9 67 67 A S S S- 0 0 0 -28,-2.5 103,-2.7 1,-0.3 74,-0.3 0.766 77.2 -20.1 -74.8 -25.2 15.7 14.7 13.6 68 68 A D E -G 169 0B 8 -29,-0.4 2,-0.3 101,-0.2 -1,-0.3 -0.976 59.4-142.3-172.1 167.0 14.5 11.9 11.3 69 69 A E E -G 168 0B 0 99,-2.8 99,-2.5 -2,-0.3 2,-0.4 -0.999 20.9-121.0-145.8 143.4 11.7 10.8 9.0 70 70 A R E -G 167 0B 47 -2,-0.3 2,-2.6 8,-0.3 97,-0.2 -0.703 38.2-116.9 -80.4 133.9 9.9 7.6 8.2 71 71 A Y S S+ 0 0 66 95,-2.9 -1,-0.1 -2,-0.4 96,-0.1 -0.455 79.4 106.2 -75.5 75.8 10.3 6.9 4.5 72 72 A V S S- 0 0 18 -2,-2.6 32,-0.2 93,-0.1 4,-0.0 -0.905 82.7 -59.8-142.5 167.2 6.6 7.2 3.7 73 73 A P > - 0 0 83 0, 0.0 3,-2.1 0, 0.0 5,-0.2 -0.177 47.1-122.3 -52.9 142.5 4.5 9.9 2.0 74 74 A L T 3 S+ 0 0 39 1,-0.3 8,-0.1 7,-0.1 5,-0.0 0.576 111.9 54.0 -66.6 -9.4 4.6 13.2 3.7 75 75 A D T 3 S+ 0 0 124 7,-0.1 -1,-0.3 6,-0.1 2,-0.2 0.302 84.5 114.8-106.5 12.1 0.8 13.2 4.1 76 76 A S S X S- 0 0 23 -3,-2.1 3,-2.4 1,-0.1 6,-0.2 -0.520 74.8-128.1 -79.6 143.8 0.9 9.8 5.9 77 77 A D T 3 S+ 0 0 112 1,-0.3 -1,-0.1 -2,-0.2 6,-0.1 0.653 112.9 61.7 -66.3 -8.8 -0.2 9.6 9.5 78 78 A Q T 3 S+ 0 0 71 -5,-0.2 2,-0.5 4,-0.0 -1,-0.3 0.367 82.7 104.9 -95.4 3.7 3.2 7.8 9.9 79 79 A S <> - 0 0 0 -3,-2.4 4,-2.0 1,-0.2 5,-0.2 -0.726 61.4-153.2 -89.0 127.7 5.1 10.9 8.7 80 80 A N H > S+ 0 0 8 -2,-0.5 4,-2.7 1,-0.2 5,-0.3 0.909 98.8 55.2 -64.5 -37.8 6.9 13.0 11.3 81 81 A F H > S+ 0 0 32 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.947 106.4 49.4 -60.0 -47.7 6.5 16.0 9.1 82 82 A R H > S+ 0 0 91 -6,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.955 114.5 44.9 -56.7 -49.3 2.8 15.6 8.9 83 83 A N H X S+ 0 0 41 -4,-2.0 4,-1.5 -7,-0.2 -1,-0.2 0.884 116.1 43.6 -62.8 -44.1 2.4 15.3 12.7 84 84 A I H X>S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-1.2 0.854 111.8 55.2 -71.9 -32.8 4.8 18.1 13.6 85 85 A N H <>S+ 0 0 48 -4,-2.7 5,-2.5 -5,-0.3 6,-0.3 0.899 105.8 54.1 -64.1 -38.0 3.2 20.3 10.8 86 86 A E H <5S+ 0 0 88 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.890 119.9 29.4 -64.1 -40.7 -0.2 19.7 12.4 87 87 A V H <5S+ 0 0 18 -4,-1.5 -34,-0.2 -5,-0.1 -2,-0.2 0.685 140.9 1.7 -94.6 -17.4 0.8 20.9 15.9 88 88 A L T >X5S+ 0 0 4 -4,-2.6 4,-3.1 -5,-0.2 3,-1.0 0.662 118.3 52.5-133.0 -62.4 3.5 23.4 15.0 89 89 A F T 34 - 0 0 50 0, 0.0 3,-2.4 0, 0.0 4,-0.3 -0.251 25.4-123.7 -54.9 134.5 8.3 31.2 7.4 96 96 A S G > S+ 0 0 111 1,-0.3 3,-1.8 2,-0.2 -2,-0.0 0.858 110.5 58.1 -48.3 -41.9 8.3 28.3 5.0 97 97 A G G 3 S+ 0 0 59 1,-0.3 -1,-0.3 3,-0.0 -34,-0.0 0.613 97.8 62.3 -66.7 -12.1 12.1 28.7 4.4 98 98 A N G < S+ 0 0 18 -3,-2.4 -34,-2.6 -35,-0.1 2,-0.5 0.444 89.9 81.5 -91.1 -3.3 12.7 28.3 8.1 99 99 A V E < -d 64 0A 21 -3,-1.8 2,-0.4 -4,-0.3 -34,-0.2 -0.926 57.8-175.4-112.3 123.1 11.3 24.7 8.1 100 100 A H E +d 65 0A 20 -36,-2.5 -34,-1.3 -2,-0.5 2,-0.2 -0.958 13.2 153.1-121.2 129.8 13.5 21.8 6.9 101 101 A Y - 0 0 85 -2,-0.4 2,-0.5 -36,-0.2 -32,-0.1 -0.820 49.0 -78.5-142.2 178.8 12.3 18.2 6.5 102 102 A V - 0 0 0 -2,-0.2 2,-1.6 -34,-0.1 -21,-0.1 -0.764 34.5-138.6 -90.2 124.5 13.1 15.1 4.6 103 103 A D > - 0 0 31 -2,-0.5 3,-1.7 8,-0.4 11,-0.1 -0.628 23.3-179.5 -81.8 87.9 11.7 15.1 1.0 104 104 A T T 3 + 0 0 15 -2,-1.6 -1,-0.2 1,-0.3 4,-0.1 0.444 67.8 82.3 -70.6 1.8 10.5 11.5 0.9 105 105 A S T 3 S+ 0 0 92 2,-0.1 -1,-0.3 6,-0.1 3,-0.1 0.667 85.0 74.0 -78.1 -15.8 9.3 12.0 -2.7 106 106 A L S < S- 0 0 52 -3,-1.7 5,-0.1 1,-0.1 6,-0.0 -0.526 106.1 -80.8 -95.0 160.5 12.9 11.3 -3.7 107 107 A P >> - 0 0 84 0, 0.0 4,-2.3 0, 0.0 3,-0.6 -0.370 55.3-107.1 -56.3 144.0 14.8 8.0 -3.8 108 108 A I H 3> S+ 0 0 33 1,-0.3 4,-2.1 2,-0.2 5,-0.1 0.819 118.1 46.8 -46.9 -45.9 15.9 7.5 -0.2 109 109 A E H 3> S+ 0 0 94 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.896 113.7 49.3 -67.1 -36.0 19.6 8.2 -0.7 110 110 A K H <> S+ 0 0 110 -3,-0.6 4,-2.3 2,-0.2 -2,-0.2 0.850 108.6 52.8 -69.9 -32.7 18.7 11.3 -2.7 111 111 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -8,-0.4 0.903 110.8 49.4 -67.6 -38.6 16.3 12.4 0.1 112 112 A C H X S+ 0 0 6 -4,-2.1 4,-2.8 -5,-0.3 -2,-0.2 0.960 112.5 45.1 -62.5 -53.1 19.2 12.0 2.5 113 113 A E H X S+ 0 0 80 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.869 111.8 52.1 -62.6 -37.6 21.7 14.0 0.5 114 114 A K H X S+ 0 0 65 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.948 111.8 47.2 -63.8 -45.8 19.2 16.8 -0.2 115 115 A Y H X S+ 0 0 3 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.929 110.9 51.4 -61.9 -44.6 18.5 17.1 3.5 116 116 A E H X S+ 0 0 26 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.937 109.3 49.7 -59.4 -46.5 22.2 17.0 4.4 117 117 A R H X S+ 0 0 154 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.886 111.2 51.1 -58.1 -39.1 23.0 19.8 1.9 118 118 A E H X S+ 0 0 62 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.917 111.0 47.1 -63.9 -46.5 20.1 21.9 3.4 119 119 A I H X S+ 0 0 6 -4,-2.5 4,-2.4 2,-0.2 3,-0.3 0.955 112.4 48.4 -60.6 -53.6 21.3 21.4 6.9 120 120 A R H < S+ 0 0 124 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.889 111.6 51.3 -56.3 -40.0 24.9 22.3 6.1 121 121 A S H < S+ 0 0 107 -4,-2.1 -1,-0.2 -5,-0.3 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