==== 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 RACEMASE 19-NOV-93 1MDR . COMPND 2 MOLECULE: MANDELATE RACEMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR J.A.LANDRO,J.A.GERLT,J.W.KOZARICH,C.W.KOO,V.J.SHAH,G.L.KENYO . 357 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14018.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 272 76.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 8.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 10.6 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 31 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.0 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 0 1 0 3 0 1 0 1 1 3 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 3 2 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 PARALLEL BRIDGES PER LADDER . 3 1 1 0 0 0 1 0 0 0 0 0 0 1 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 1 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 3 A E 0 0 212 0, 0.0 2,-0.6 0, 0.0 39,-0.0 0.000 360.0 360.0 360.0 -63.5 41.5 30.2 -11.4 2 4 A V - 0 0 30 38,-0.1 74,-2.0 74,-0.1 2,-0.3 -0.901 360.0-178.0-100.6 122.8 42.0 28.4 -8.0 3 5 A L B -A 75 0A 54 -2,-0.6 37,-2.7 72,-0.3 2,-0.4 -0.879 32.5-113.4-112.3 153.1 43.3 25.0 -8.8 4 6 A I E +B 39 0B 0 70,-2.4 69,-3.3 -2,-0.3 35,-0.3 -0.751 33.3 177.9 -83.4 132.9 44.2 22.0 -6.7 5 7 A T E - 0 0 66 33,-3.0 2,-0.3 -2,-0.4 34,-0.2 0.648 55.4 -5.5-117.1 -11.8 47.9 21.5 -7.0 6 8 A G E -B 38 0B 21 32,-1.2 32,-2.0 65,-0.1 -1,-0.4 -0.977 46.6-147.4-173.0 164.7 48.7 18.6 -4.7 7 9 A L E -B 37 0B 25 -2,-0.3 2,-0.4 30,-0.2 30,-0.2 -0.987 16.7-176.4-142.9 128.9 47.4 16.1 -2.2 8 10 A R E -B 36 0B 122 28,-2.4 28,-2.4 -2,-0.3 2,-0.3 -0.990 3.8-170.2-130.0 140.9 49.5 14.7 0.7 9 11 A T E -B 35 0B 9 -2,-0.4 2,-0.4 26,-0.2 26,-0.2 -0.963 7.4-169.8-132.6 148.7 48.4 12.0 3.2 10 12 A R E -B 34 0B 29 24,-1.7 24,-3.1 -2,-0.3 2,-0.5 -0.996 15.1-144.4-136.7 134.5 49.9 10.7 6.4 11 13 A A E +B 33 0B 3 346,-0.5 346,-2.7 -2,-0.4 2,-0.3 -0.859 23.9 176.0-101.9 124.8 48.6 7.6 8.3 12 14 A V E -BC 32 356B 0 20,-2.6 20,-2.2 -2,-0.5 2,-0.4 -0.884 25.5-150.8-122.9 153.5 48.8 7.8 12.1 13 15 A N E -B 31 0B 46 342,-2.2 -2,-0.0 -2,-0.3 20,-0.0 -0.858 25.3-164.6-124.4 99.2 47.6 5.4 14.7 14 16 A V E -B 30 0B 1 16,-2.4 16,-3.0 -2,-0.4 2,-0.1 -0.639 18.0-120.2 -91.8 135.1 46.8 7.6 17.7 15 17 A P E -B 29 0B 67 0, 0.0 2,-0.5 0, 0.0 14,-0.2 -0.457 22.7-142.0 -72.2 142.4 46.3 6.1 21.3 16 18 A L E - 0 0 29 12,-1.3 303,-0.1 1,-0.2 0, 0.0 -0.907 7.9-140.4-104.2 133.8 42.9 6.8 22.9 17 19 A A E S+ 0 0 101 -2,-0.5 -1,-0.2 1,-0.2 12,-0.0 0.910 98.7 29.0 -56.1 -44.8 42.8 7.6 26.6 18 20 A Y E S- 0 0 114 -3,-0.1 2,-0.2 120,-0.0 -1,-0.2 -0.976 91.3-130.4-116.1 123.0 39.6 5.5 26.9 19 21 A P E - 0 0 43 0, 0.0 2,-1.1 0, 0.0 9,-0.2 -0.532 24.5-118.7 -66.5 132.3 39.3 2.6 24.5 20 22 A V E -B 27 0B 27 7,-2.2 7,-3.1 -2,-0.2 2,-0.4 -0.636 34.5-166.3 -80.1 97.2 35.9 2.7 22.8 21 23 A H E +B 26 0B 57 -2,-1.1 119,-2.7 5,-0.3 2,-0.3 -0.769 10.4 177.1 -80.7 128.0 34.4 -0.6 23.9 22 24 A T E > -B 25 0B 23 3,-2.8 3,-2.0 -2,-0.4 144,-0.1 -0.871 47.0-101.5-129.8 167.5 31.2 -1.7 22.0 23 25 A A T 3 S+ 0 0 31 142,-0.4 3,-0.1 -2,-0.3 172,-0.1 0.680 124.8 42.5 -58.9 -18.5 29.0 -4.8 22.0 24 26 A V T 3 S- 0 0 98 1,-0.4 -1,-0.3 171,-0.0 2,-0.2 0.223 130.0 -49.2-113.8 17.5 30.8 -5.9 18.8 25 27 A G E < -B 22 0B 39 -3,-2.0 -3,-2.8 2,-0.0 2,-0.4 -0.744 58.7 -85.3 140.5 168.5 34.5 -5.1 19.7 26 28 A T E -B 21 0B 73 -5,-0.3 2,-0.8 -2,-0.2 -5,-0.3 -0.939 17.0-147.7-116.5 138.5 36.8 -2.3 21.0 27 29 A V E +B 20 0B 38 -7,-3.1 -7,-2.2 -2,-0.4 26,-0.1 -0.924 26.5 172.5 -95.9 103.9 38.4 0.6 19.1 28 30 A G E + 0 0 38 -2,-0.8 -12,-1.3 -9,-0.2 2,-0.3 0.745 62.0 20.7 -90.7 -27.8 41.6 0.9 21.1 29 31 A T E S-B 15 0B 45 -14,-0.2 -9,-0.1 23,-0.2 -1,-0.0 -0.853 80.6-115.2-128.6 168.9 43.5 3.4 18.9 30 32 A A E -B 14 0B 0 -16,-3.0 -16,-2.4 -2,-0.3 2,-0.8 -0.916 22.1-155.6-107.6 105.2 42.3 5.9 16.3 31 33 A P E +B 13 0B 1 0, 0.0 20,-2.7 0, 0.0 21,-0.4 -0.761 28.1 177.4 -72.9 107.2 43.7 4.9 12.8 32 34 A L E -BD 12 50B 0 -20,-2.2 -20,-2.6 -2,-0.8 2,-0.5 -0.849 31.4-152.9-118.6 149.9 43.6 8.2 11.0 33 35 A V E -BD 11 49B 0 16,-1.8 16,-2.4 -2,-0.3 2,-0.4 -0.993 19.4-152.5-116.6 115.7 44.7 9.5 7.6 34 36 A L E -BD 10 48B 0 -24,-3.1 -24,-1.7 -2,-0.5 2,-0.4 -0.761 13.1-154.9 -89.5 135.3 45.5 13.2 7.7 35 37 A I E -BD 9 47B 0 12,-3.0 12,-1.6 -2,-0.4 2,-0.4 -0.944 14.7-170.5-122.6 136.5 45.0 15.0 4.4 36 38 A D E -BD 8 46B 9 -28,-2.4 -28,-2.4 -2,-0.4 2,-0.7 -0.997 6.2-166.6-123.0 119.9 46.6 18.1 3.0 37 39 A L E -BD 7 45B 0 8,-2.5 8,-2.7 -2,-0.4 2,-0.3 -0.939 11.1-154.5-113.1 112.6 45.1 19.5 -0.1 38 40 A A E -BD 6 44B 33 -32,-2.0 -33,-3.0 -2,-0.7 -32,-1.2 -0.638 10.9-164.0 -86.6 145.8 47.4 22.2 -1.7 39 41 A T E > -B 4 0B 8 4,-1.5 3,-1.8 -35,-0.3 -35,-0.2 -0.848 33.9-116.7-128.6 163.6 46.0 24.9 -4.0 40 42 A S T 3 S+ 0 0 60 -37,-2.7 -36,-0.1 1,-0.3 -1,-0.1 0.775 111.9 68.4 -67.6 -21.6 47.3 27.5 -6.5 41 43 A A T 3 S- 0 0 51 -38,-0.4 -1,-0.3 2,-0.1 3,-0.1 0.497 116.1-112.9 -75.9 1.9 46.1 30.2 -4.2 42 44 A G S < S+ 0 0 68 -3,-1.8 2,-0.4 1,-0.3 -2,-0.1 0.848 80.0 119.0 72.8 23.6 48.8 29.2 -1.7 43 45 A V - 0 0 33 -4,-0.1 -4,-1.5 -6,-0.0 2,-0.5 -0.934 53.6-144.5-117.7 154.7 46.3 27.9 0.9 44 46 A V E -D 38 0B 58 -2,-0.4 -6,-0.2 -6,-0.2 2,-0.2 -0.960 6.9-147.9-119.0 120.0 46.2 24.4 2.2 45 47 A G E -D 37 0B 0 -8,-2.7 -8,-2.5 -2,-0.5 2,-0.4 -0.499 17.6-158.3 -79.5 152.8 43.0 22.6 3.0 46 48 A H E +D 36 0B 25 62,-0.3 2,-0.3 61,-0.2 -10,-0.2 -0.991 23.4 144.1-133.3 142.4 43.0 20.0 5.8 47 49 A S E -D 35 0B 4 -12,-1.6 -12,-3.0 -2,-0.4 2,-0.3 -0.930 26.8-144.2-154.9 175.2 40.8 17.0 6.9 48 50 A Y E -D 34 0B 7 -2,-0.3 2,-0.3 -14,-0.3 -14,-0.2 -0.969 8.2-144.5-140.1 157.6 41.3 13.6 8.4 49 51 A L E -D 33 0B 0 -16,-2.4 -16,-1.8 -2,-0.3 2,-0.5 -0.881 12.8-134.1-118.3 155.2 39.5 10.3 7.8 50 52 A F E -D 32 0B 9 -2,-0.3 -18,-0.2 -18,-0.2 -20,-0.0 -0.964 12.3-169.4-112.7 123.0 38.8 7.6 10.4 51 53 A A - 0 0 4 -20,-2.7 2,-2.7 -2,-0.5 5,-0.2 0.478 20.8-147.3 -90.1 -4.0 39.7 4.0 9.3 52 54 A Y S S+ 0 0 63 -21,-0.4 -23,-0.2 3,-0.1 -1,-0.1 -0.183 78.4 35.7 66.1 -48.4 37.9 2.2 12.3 53 55 A T S > S- 0 0 60 -2,-2.7 3,-1.4 -22,-0.1 4,-0.4 -0.976 79.9-126.8-135.7 148.2 40.4 -0.6 12.4 54 56 A P G >> S+ 0 0 73 0, 0.0 3,-0.8 0, 0.0 4,-0.6 0.733 105.8 74.9 -64.4 -22.7 44.2 -0.6 11.6 55 57 A V G 34 S+ 0 0 130 1,-0.2 4,-0.3 2,-0.1 -3,-0.1 0.772 102.4 37.9 -58.7 -34.4 43.5 -3.4 9.1 56 58 A A G <> S+ 0 0 19 -3,-1.4 4,-2.2 -5,-0.2 -1,-0.2 0.472 95.6 89.7 -97.3 -1.3 42.0 -0.8 6.7 57 59 A L H <> S+ 0 0 4 -3,-0.8 4,-2.3 -4,-0.4 5,-0.2 0.952 89.0 39.0 -65.6 -55.7 44.5 2.1 7.4 58 60 A K H X S+ 0 0 131 -4,-0.6 4,-2.5 1,-0.2 -1,-0.2 0.880 115.3 54.7 -66.6 -36.6 47.2 1.5 4.9 59 61 A S H > S+ 0 0 65 -4,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.912 108.0 48.9 -59.4 -43.4 44.7 0.5 2.2 60 62 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.949 112.7 47.7 -67.6 -41.9 42.8 3.8 2.7 61 63 A K H X S+ 0 0 52 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.938 110.5 52.0 -60.0 -45.8 46.0 5.9 2.4 62 64 A Q H X S+ 0 0 103 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.864 108.4 51.9 -55.4 -40.2 47.1 4.0 -0.7 63 65 A L H X S+ 0 0 40 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.943 109.8 47.2 -66.3 -48.4 43.8 4.7 -2.4 64 66 A L H X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.914 111.6 51.8 -59.4 -43.3 43.9 8.4 -1.7 65 67 A D H < S+ 0 0 59 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.861 112.0 47.2 -62.7 -33.9 47.6 8.5 -3.0 66 68 A D H < S+ 0 0 107 -4,-2.0 3,-0.3 -5,-0.2 4,-0.3 0.806 110.3 52.5 -79.9 -20.0 46.4 6.7 -6.1 67 69 A M H >X S+ 0 0 4 -4,-1.9 3,-1.7 1,-0.2 4,-0.7 0.755 84.6 87.1 -82.2 -25.5 43.5 9.1 -6.5 68 70 A A H >X S+ 0 0 19 -4,-1.6 4,-1.8 1,-0.3 3,-1.3 0.858 80.5 63.8 -41.1 -42.0 45.7 12.2 -6.3 69 71 A A H 34 S+ 0 0 88 -4,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.842 98.8 52.2 -53.4 -39.5 46.3 12.1 -10.1 70 72 A M H <4 S+ 0 0 34 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.712 115.7 37.4 -79.6 -13.9 42.6 12.6 -11.0 71 73 A I H X< S+ 0 0 0 -3,-1.3 3,-1.9 -4,-0.7 -67,-0.3 0.618 84.9 106.6-109.3 -12.0 42.1 15.8 -8.9 72 74 A V T 3< S+ 0 0 43 -4,-1.8 -67,-0.2 1,-0.3 -65,-0.0 -0.465 91.0 17.7 -67.6 138.2 45.4 17.6 -9.3 73 75 A N T 3 S+ 0 0 110 -69,-3.3 -1,-0.3 1,-0.3 -68,-0.1 0.519 96.4 124.5 72.3 13.2 44.8 20.6 -11.7 74 76 A E S < S- 0 0 73 -3,-1.9 -70,-2.4 -70,-0.2 -1,-0.3 -0.719 72.6 -94.8 -91.5 149.6 41.1 20.5 -11.2 75 77 A P B -A 3 0A 67 0, 0.0 2,-2.1 0, 0.0 -72,-0.3 -0.308 37.8-106.6 -58.5 148.2 39.4 23.7 -10.0 76 78 A L S S+ 0 0 14 -74,-2.0 -74,-0.1 1,-0.1 -73,-0.1 -0.541 76.6 128.4 -77.8 81.2 38.8 24.0 -6.3 77 79 A A > - 0 0 32 -2,-2.1 4,-2.7 1,-0.1 3,-0.4 -0.767 40.4-168.0-142.7 87.5 35.1 23.4 -6.7 78 80 A P H > S+ 0 0 6 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.805 86.4 51.3 -49.5 -42.9 33.9 20.6 -4.3 79 81 A V H > S+ 0 0 75 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.927 114.6 44.1 -65.9 -43.1 30.4 20.1 -5.8 80 82 A S H > S+ 0 0 86 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.897 113.8 51.6 -68.0 -38.1 31.9 19.8 -9.3 81 83 A L H X S+ 0 0 8 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.882 107.6 51.9 -64.1 -40.6 34.7 17.5 -8.0 82 84 A E H X S+ 0 0 27 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.948 107.8 50.6 -64.6 -48.4 32.2 15.2 -6.3 83 85 A A H X S+ 0 0 57 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.912 112.1 49.5 -56.2 -39.6 30.1 14.8 -9.4 84 86 A M H X S+ 0 0 37 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.935 111.8 46.5 -67.1 -43.7 33.3 13.9 -11.4 85 87 A L H X S+ 0 0 3 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.900 109.3 55.3 -68.1 -32.2 34.5 11.3 -8.7 86 88 A A H < S+ 0 0 30 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.934 111.5 45.7 -61.0 -40.1 31.0 9.7 -8.6 87 89 A K H >< S+ 0 0 158 -4,-1.8 3,-1.1 -5,-0.2 4,-0.2 0.868 110.2 51.8 -72.5 -40.0 31.2 9.3 -12.4 88 90 A R H 3< S+ 0 0 132 -4,-2.3 3,-0.3 1,-0.2 4,-0.3 0.825 112.2 46.0 -71.4 -28.5 34.8 7.9 -12.3 89 91 A F T 3X S+ 0 0 32 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.2 0.269 80.6 116.4-102.0 20.0 33.9 5.3 -9.7 90 92 A C T <4 S+ 0 0 89 -3,-1.1 4,-0.3 1,-0.2 -1,-0.2 0.862 81.7 31.9 -37.3 -61.0 30.8 4.3 -11.6 91 93 A L T 4 S+ 0 0 173 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.898 118.1 53.9 -80.3 -39.6 31.7 0.8 -12.4 92 94 A A T 4 S- 0 0 77 -4,-0.3 -2,-0.2 1,-0.1 -1,-0.2 0.831 119.5 -95.4 -65.1 -38.0 33.9 0.1 -9.3 93 95 A G < - 0 0 26 -4,-2.8 2,-1.9 -7,-0.2 5,-0.2 0.455 20.7-132.0 117.9 105.2 31.2 1.1 -6.8 94 96 A Y S S+ 0 0 36 -4,-0.3 2,-0.2 -8,-0.1 -4,-0.1 -0.461 78.9 76.5 -85.6 69.4 31.0 4.5 -5.3 95 97 A T S >> S+ 0 0 65 -2,-1.9 4,-1.0 -6,-0.1 3,-0.9 -0.855 72.4 31.2-158.7-178.0 30.6 3.3 -1.7 96 98 A G H 3> S- 0 0 25 -2,-0.2 4,-2.1 1,-0.2 3,-0.4 -0.177 124.4 -9.0 55.8-140.3 32.8 1.9 1.1 97 99 A L H 3> S+ 0 0 58 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.839 136.4 56.6 -60.6 -36.7 36.4 3.0 1.3 98 100 A I H <> S+ 0 0 32 -3,-0.9 4,-2.5 1,-0.2 -1,-0.3 0.927 109.5 45.5 -60.7 -43.1 36.2 4.7 -2.1 99 101 A R H X S+ 0 0 11 -4,-1.0 4,-2.4 -3,-0.4 -1,-0.2 0.888 112.2 52.1 -67.1 -39.2 33.3 6.9 -0.9 100 102 A M H X S+ 0 0 9 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.914 109.8 49.0 -64.0 -41.0 35.2 7.6 2.3 101 103 A A H >X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 3,-0.7 0.969 110.1 50.6 -62.9 -50.4 38.3 8.7 0.4 102 104 A A H 3X S+ 0 0 6 -4,-2.5 4,-2.4 1,-0.3 -2,-0.2 0.893 108.3 53.7 -57.4 -36.5 36.2 11.0 -1.8 103 105 A A H 3X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 -1,-0.3 0.852 103.8 55.5 -68.0 -33.7 34.6 12.5 1.3 104 106 A G H S+ 0 0 0 -4,-1.8 5,-2.3 2,-0.2 -1,-0.2 0.861 111.2 51.0 -67.4 -39.6 36.9 29.0 3.3 115 117 A K H ><5S+ 0 0 49 -4,-1.9 3,-1.6 226,-0.2 -2,-0.2 0.938 107.2 53.3 -64.8 -44.9 40.6 29.8 3.7 116 118 A V H 3<5S+ 0 0 43 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.899 118.2 37.8 -50.2 -43.8 40.7 31.4 0.1 117 119 A H T 3<5S- 0 0 111 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.317 107.5-128.5 -96.2 12.5 37.7 33.6 1.3 118 120 A E T < 5 + 0 0 162 -3,-1.6 -3,-0.2 1,-0.2 -4,-0.1 0.757 66.8 123.2 48.5 37.3 39.0 34.1 4.8 119 121 A T < - 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