==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURE GENOMICS, UNKNOWN FUNCTION 18-FEB-10 3LUP . COMPND 2 MOLECULE: DEGV FAMILY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS AGALACTIAE; . AUTHOR C.CHANG,R.WU,S.CLANCY,A.JOACHIMIAK,MIDWEST CENTER FOR STRUCT . 283 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13318.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 204 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 9.2 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 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 20 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 1 1 1 1 1 0 1 0 1 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 1 2 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 . 0 2 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 0 A A 0 0 149 0, 0.0 2,-0.3 0, 0.0 82,-0.0 0.000 360.0 360.0 360.0 80.3 -9.7 28.1 3.3 2 1 A X - 0 0 64 81,-0.1 2,-0.5 80,-0.1 80,-0.1 -0.483 360.0-171.3 -70.7 129.8 -8.6 30.0 6.4 3 2 A K - 0 0 78 -2,-0.3 80,-2.9 78,-0.1 81,-1.8 -0.957 22.4-163.4-116.8 107.4 -5.4 32.1 6.3 4 3 A L E -a 84 0A 8 -2,-0.5 2,-0.4 79,-0.2 81,-0.2 -0.769 9.9-158.0-104.1 132.4 -5.0 33.0 10.0 5 4 A A E -a 85 0A 0 79,-2.4 81,-2.6 -2,-0.4 2,-0.5 -0.826 7.5-146.6-104.6 147.4 -2.8 35.8 11.4 6 5 A L E -ab 86 24A 2 17,-3.6 19,-4.0 -2,-0.4 2,-0.4 -0.958 14.0-171.9-115.6 122.1 -1.5 36.0 14.9 7 6 A I E +ab 87 25A 0 79,-2.2 81,-3.3 -2,-0.5 2,-0.2 -0.929 17.1 145.1-115.2 136.3 -1.0 39.3 16.6 8 7 A T E - b 0 26A 0 17,-2.6 19,-3.2 -2,-0.4 2,-0.3 -0.806 37.4-112.1-146.5-176.1 0.6 39.9 20.0 9 8 A D E > - b 0 27A 1 79,-0.5 3,-1.7 17,-0.3 19,-0.2 -0.764 36.5 -97.3-124.4 171.9 2.8 42.5 21.7 10 9 A T T 3 S+ 0 0 60 17,-1.8 255,-0.1 1,-0.3 18,-0.1 0.528 112.8 74.7 -71.8 -3.7 6.4 42.5 22.9 11 10 A S T 3 S+ 0 0 7 254,-0.1 111,-1.2 2,-0.1 2,-0.3 0.691 78.8 90.8 -77.6 -19.4 5.4 41.6 26.5 12 11 A A B < S-d 122 0B 11 -3,-1.7 2,-0.9 109,-0.2 111,-0.2 -0.586 78.1-136.8 -73.6 134.0 4.7 38.0 25.3 13 12 A Y - 0 0 89 109,-2.2 113,-0.2 -2,-0.3 114,-0.2 -0.853 24.6-148.1 -96.2 108.9 7.7 35.8 25.6 14 13 A L - 0 0 38 -2,-0.9 5,-0.1 112,-0.1 113,-0.1 -0.632 12.7-116.6 -86.8 125.6 7.7 33.8 22.3 15 14 A P >> - 0 0 18 0, 0.0 4,-1.5 0, 0.0 3,-0.5 -0.073 32.1-109.9 -48.0 154.9 9.0 30.2 22.1 16 15 A E T 34 S+ 0 0 100 1,-0.2 4,-0.4 2,-0.2 3,-0.3 0.916 116.5 53.0 -58.5 -43.8 12.1 29.8 19.9 17 16 A A T 34 S+ 0 0 94 1,-0.2 -1,-0.2 2,-0.1 3,-0.0 0.745 112.9 43.8 -63.1 -29.0 10.1 27.8 17.2 18 17 A I T X4 S+ 0 0 9 -3,-0.5 3,-1.9 1,-0.1 -1,-0.2 0.676 86.1 97.8 -93.4 -24.4 7.4 30.6 16.8 19 18 A E T 3< S+ 0 0 45 -4,-1.5 -2,-0.1 -3,-0.3 -1,-0.1 0.824 95.1 22.7 -26.0 -80.5 9.7 33.7 16.9 20 19 A N T 3 S+ 0 0 162 -4,-0.4 -1,-0.3 3,-0.0 -2,-0.1 -0.017 84.8 148.8 -92.5 28.3 10.1 34.5 13.1 21 20 A H X - 0 0 49 -3,-1.9 3,-1.2 1,-0.1 -3,-0.1 -0.363 50.9-130.7 -66.0 143.7 6.9 32.7 11.9 22 21 A E T 3 S+ 0 0 155 1,-0.3 -1,-0.1 -2,-0.0 -2,-0.0 0.591 104.4 50.1 -78.1 -11.8 5.5 34.5 8.9 23 22 A D T 3 S+ 0 0 35 -18,-0.1 -17,-3.6 2,-0.0 2,-0.5 0.276 91.5 96.2-105.6 8.8 1.9 34.6 10.3 24 23 A V E < -b 6 0A 16 -3,-1.2 2,-0.4 -19,-0.2 -17,-0.2 -0.883 51.8-173.4-106.6 122.6 3.0 36.1 13.6 25 24 A Y E -b 7 0A 46 -19,-4.0 -17,-2.6 -2,-0.5 2,-0.5 -0.963 6.0-159.8-119.1 133.8 2.9 39.9 14.1 26 25 A V E -b 8 0A 63 -2,-0.4 2,-0.3 -19,-0.2 -17,-0.3 -0.948 5.3-151.2-121.9 115.2 4.3 41.7 17.2 27 26 A L E -b 9 0A 7 -19,-3.2 -17,-1.8 -2,-0.5 2,-0.3 -0.621 24.8-119.4 -78.8 138.4 3.2 45.2 18.3 28 27 A D - 0 0 55 -2,-0.3 38,-0.4 -19,-0.2 -1,-0.1 -0.570 14.6-148.1 -82.5 139.9 5.8 47.2 20.2 29 28 A I - 0 0 9 -2,-0.3 11,-0.4 36,-0.1 35,-0.1 -0.936 19.1-137.7-105.1 116.1 5.3 48.5 23.8 30 29 A P - 0 0 25 0, 0.0 33,-1.6 0, 0.0 2,-0.4 -0.421 8.1-150.9 -71.2 144.0 7.0 51.8 24.5 31 30 A I E -E 62 0C 0 7,-3.3 2,-0.7 31,-0.2 31,-0.3 -0.944 8.0-149.0-109.5 139.8 8.9 52.5 27.7 32 31 A I E +E 61 0C 52 29,-4.1 29,-2.2 -2,-0.4 6,-0.1 -0.898 23.9 164.7-115.0 106.2 9.1 56.0 29.0 33 32 A I S S- 0 0 21 4,-1.0 28,-0.1 -2,-0.7 -1,-0.1 0.492 81.6 -37.4 -82.8-128.3 12.2 57.0 31.0 34 33 A D S S- 0 0 101 1,-0.1 -2,-0.1 26,-0.1 25,-0.0 0.288 104.4 -77.5 -75.5 17.4 12.8 60.7 31.5 35 34 A G S S+ 0 0 39 2,-0.3 -1,-0.1 -4,-0.0 3,-0.1 0.250 115.8 118.1 91.9 0.2 11.4 60.8 27.9 36 35 A K S S+ 0 0 58 1,-0.1 2,-0.3 2,-0.0 -4,-0.1 0.932 70.4 11.8 -67.5 -62.0 15.0 59.5 27.2 37 36 A T + 0 0 3 1,-0.1 -4,-1.0 12,-0.1 -2,-0.3 -0.927 60.3 171.7-129.8 159.0 14.7 56.0 25.6 38 37 A Y + 0 0 99 -2,-0.3 -7,-3.3 1,-0.2 2,-0.5 0.755 47.7 43.6-139.2 -54.0 11.7 54.2 24.3 39 38 A I >>> - 0 0 34 -9,-0.2 4,-2.8 -11,-0.0 3,-1.7 -0.951 65.1-129.6-127.1 118.6 11.5 50.9 22.4 40 39 A E B 345S+f 44 0D 69 -2,-0.5 5,-0.2 -11,-0.4 -11,-0.1 -0.344 95.4 22.5 -58.6 131.7 13.5 47.8 23.2 41 40 A G T 345S+ 0 0 80 3,-2.0 -1,-0.2 1,-0.1 4,-0.1 0.153 130.7 42.1 97.2 -19.2 15.3 46.4 20.2 42 41 A Q T <45S+ 0 0 159 -3,-1.7 -2,-0.2 2,-0.2 3,-0.1 0.690 132.6 7.7-114.9 -44.6 15.3 49.7 18.3 43 42 A N T <5S+ 0 0 82 -4,-2.8 2,-0.3 1,-0.3 -3,-0.2 0.339 126.5 36.9-132.2 -9.4 16.2 52.4 20.7 44 43 A L B < -f 40 0D 4 -5,-0.9 -3,-2.0 -7,-0.1 -1,-0.3 -0.924 60.0-151.2-162.7 122.3 17.1 50.6 23.9 45 44 A T > - 0 0 77 -2,-0.3 4,-2.0 -5,-0.2 5,-0.1 -0.534 35.5-109.8 -88.3 165.1 18.9 47.4 24.8 46 45 A L H > S+ 0 0 50 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.868 119.9 50.8 -63.7 -34.2 18.2 45.5 28.0 47 46 A D H > S+ 0 0 106 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.882 109.9 48.2 -71.9 -37.8 21.6 46.5 29.4 48 47 A Q H > S+ 0 0 102 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.864 108.1 59.1 -65.4 -36.4 21.0 50.2 28.7 49 48 A Y H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.918 107.1 42.5 -58.3 -52.9 17.6 49.8 30.3 50 49 A Y H X S+ 0 0 6 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.837 113.7 53.0 -66.9 -35.1 18.9 48.6 33.7 51 50 A D H X S+ 0 0 114 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.914 112.0 45.4 -61.2 -45.5 21.6 51.3 33.6 52 51 A K H X S+ 0 0 71 -4,-2.7 4,-1.3 2,-0.2 -2,-0.2 0.845 110.6 55.5 -67.7 -34.5 18.9 53.9 32.9 53 52 A L H >< S+ 0 0 26 -4,-2.4 3,-0.7 1,-0.2 -2,-0.2 0.975 108.7 45.4 -59.4 -56.6 16.8 52.3 35.7 54 53 A A H 3< S+ 0 0 88 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.862 115.3 49.5 -51.3 -40.4 19.5 52.7 38.3 55 54 A A H 3< S+ 0 0 89 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.636 90.4 88.7 -84.4 -18.4 20.3 56.3 37.3 56 55 A S << - 0 0 39 -4,-1.3 3,-0.0 -3,-0.7 -23,-0.0 -0.525 57.2-156.6 -82.6 150.8 16.8 57.9 37.2 57 56 A K S S+ 0 0 112 -2,-0.2 2,-0.3 2,-0.1 -1,-0.1 0.341 82.8 59.4-103.3 1.4 15.2 59.5 40.3 58 57 A E S S- 0 0 166 -5,-0.1 -2,-0.1 0, 0.0 -24,-0.0 -0.959 94.1-106.5-126.7 144.4 11.7 59.0 38.8 59 58 A L - 0 0 65 -2,-0.3 2,-0.1 1,-0.1 -2,-0.1 -0.401 34.2-115.3 -67.9 146.2 10.2 55.6 37.9 60 59 A P - 0 0 9 0, 0.0 2,-0.3 0, 0.0 -27,-0.2 -0.378 28.4-154.2 -70.3 159.5 9.8 54.6 34.3 61 60 A K E -E 32 0C 127 -29,-2.2 -29,-4.1 -28,-0.1 2,-0.3 -0.866 2.4-144.2-123.4 164.6 6.3 54.2 32.7 62 61 A T E -E 31 0C 23 -2,-0.3 2,-0.3 -31,-0.3 -31,-0.2 -0.826 10.2-149.8-117.2 167.9 5.0 52.2 29.8 63 62 A S - 0 0 48 -33,-1.6 3,-0.1 -2,-0.3 -2,-0.0 -0.945 29.3 -91.9-132.2 157.3 2.3 53.0 27.3 64 63 A Q - 0 0 73 -2,-0.3 3,-0.1 -35,-0.1 -36,-0.1 -0.223 52.2 -94.6 -58.0 149.7 -0.1 50.8 25.4 65 64 A P - 0 0 4 0, 0.0 2,-0.3 0, 0.0 -36,-0.1 -0.273 60.9 -75.6 -59.1 161.5 1.0 49.7 21.9 66 65 A S > - 0 0 50 -38,-0.4 4,-2.0 1,-0.2 5,-0.2 -0.445 30.5-158.2 -67.5 123.1 -0.3 52.0 19.1 67 66 A L H > S+ 0 0 66 -2,-0.3 4,-2.9 1,-0.2 -1,-0.2 0.895 99.3 54.9 -60.0 -39.9 -4.0 51.6 18.2 68 67 A A H > S+ 0 0 55 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.850 105.4 51.3 -63.4 -36.9 -3.0 53.2 14.8 69 68 A E H > S+ 0 0 98 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.913 112.2 45.4 -68.5 -44.1 -0.3 50.5 14.3 70 69 A L H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.955 112.5 52.4 -58.0 -51.5 -2.8 47.7 15.0 71 70 A D H X S+ 0 0 59 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.908 113.0 43.1 -50.9 -50.9 -5.4 49.4 12.7 72 71 A D H X S+ 0 0 102 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.797 113.0 53.1 -67.9 -32.8 -2.9 49.7 9.8 73 72 A L H X S+ 0 0 35 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.878 107.3 51.9 -67.8 -40.6 -1.7 46.1 10.4 74 73 A L H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.929 111.3 46.3 -61.1 -46.7 -5.2 44.8 10.3 75 74 A C H X S+ 0 0 50 -4,-1.8 4,-1.8 -5,-0.2 5,-0.2 0.931 112.2 51.5 -60.8 -47.6 -5.8 46.6 7.0 76 75 A Q H X S+ 0 0 78 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.866 109.0 50.6 -56.0 -41.8 -2.4 45.2 5.6 77 76 A L H <>S+ 0 0 0 -4,-2.4 5,-2.1 2,-0.2 4,-0.3 0.915 105.9 56.1 -64.9 -42.7 -3.4 41.7 6.6 78 77 A E H ><5S+ 0 0 72 -4,-2.1 3,-0.7 1,-0.2 -2,-0.2 0.890 113.8 39.5 -55.1 -45.3 -6.7 42.0 4.8 79 78 A K H 3<5S+ 0 0 148 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.640 105.7 64.6 -83.7 -13.7 -5.0 42.9 1.6 80 79 A E T 3<5S- 0 0 91 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.479 123.2-106.4 -81.4 -0.5 -2.2 40.4 2.2 81 80 A G T < 5 + 0 0 43 -3,-0.7 -3,-0.2 -4,-0.3 -2,-0.1 0.442 67.2 150.3 91.9 2.9 -5.0 37.8 1.8 82 81 A Y < - 0 0 16 -5,-2.1 -1,-0.3 1,-0.1 -78,-0.2 -0.398 26.1-169.0 -65.2 144.8 -5.5 36.7 5.5 83 82 A T + 0 0 47 -80,-2.9 29,-1.9 1,-0.2 2,-0.3 0.753 65.2 31.5-106.3 -33.9 -9.1 35.6 6.4 84 83 A H E -ac 4 112A 38 -81,-1.8 -79,-2.4 27,-0.2 2,-0.4 -0.914 61.4-159.0-127.6 155.6 -9.0 35.3 10.2 85 84 A V E -ac 5 113A 0 27,-2.9 29,-2.6 -2,-0.3 2,-0.5 -0.997 5.1-168.3-136.3 129.8 -7.1 37.1 13.0 86 85 A L E -ac 6 114A 0 -81,-2.6 -79,-2.2 -2,-0.4 2,-0.6 -0.964 10.5-164.0-115.5 114.4 -6.4 36.1 16.6 87 86 A G E -a 7 0A 0 27,-2.7 2,-0.6 -2,-0.5 -79,-0.2 -0.885 8.5-179.6-101.3 115.6 -5.1 38.9 18.8 88 87 A L + 0 0 0 -81,-3.3 -79,-0.5 -2,-0.6 2,-0.2 -0.823 20.6 161.3-118.1 87.7 -3.4 37.7 22.0 89 88 A F - 0 0 2 -2,-0.6 29,-0.7 27,-0.4 31,-0.3 -0.560 43.9 -59.5-107.4 166.4 -2.2 40.7 24.0 90 89 A I S S- 0 0 15 -2,-0.2 8,-0.3 1,-0.1 -1,-0.2 0.023 76.3 -72.1 -34.1 138.9 -1.2 41.7 27.5 91 90 A A > - 0 0 0 29,-1.9 3,-1.8 27,-0.1 4,-0.2 -0.086 30.7-133.8 -41.0 129.5 -3.9 41.2 30.3 92 91 A A G > S+ 0 0 27 1,-0.3 3,-0.8 2,-0.2 7,-0.1 0.793 105.7 62.2 -50.2 -33.5 -6.9 43.6 30.4 93 92 A G G 3 S+ 0 0 21 103,-0.2 106,-0.4 104,-0.2 -1,-0.3 0.452 108.7 38.2 -78.7 -3.2 -6.2 43.9 34.2 94 93 A I G < S+ 0 0 19 -3,-1.8 2,-0.2 1,-0.4 -1,-0.2 0.208 127.2 19.2-129.8 14.5 -2.7 45.4 33.8 95 94 A S X - 0 0 19 -3,-0.8 3,-0.6 -4,-0.2 -1,-0.4 -0.795 63.7-133.5 177.7 135.2 -3.3 47.7 30.7 96 95 A G T 3> S+ 0 0 32 -2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.205 82.0 102.0 -84.9 15.9 -6.4 49.2 29.1 97 96 A F H 3> S+ 0 0 0 2,-0.2 4,-1.9 -6,-0.2 -1,-0.2 0.928 77.0 52.9 -64.8 -47.3 -5.1 48.1 25.7 98 97 A W H <> S+ 0 0 57 -3,-0.6 4,-0.5 -8,-0.3 3,-0.3 0.933 114.1 41.7 -52.1 -52.3 -7.4 45.1 25.5 99 98 A Q H >4 S+ 0 0 144 -4,-0.3 3,-0.7 1,-0.2 4,-0.3 0.868 114.0 54.8 -63.9 -35.3 -10.5 47.2 26.2 100 99 A N H 3< S+ 0 0 74 -4,-2.1 3,-0.3 1,-0.2 -2,-0.2 0.757 105.8 49.7 -72.6 -26.3 -9.2 50.0 23.9 101 100 A I H >< S+ 0 0 0 -4,-1.9 3,-1.2 -3,-0.3 4,-0.3 0.543 84.6 92.4 -88.3 -7.0 -8.8 47.8 20.8 102 101 A Q T X< S+ 0 0 51 -3,-0.7 3,-1.3 -4,-0.5 4,-0.4 0.793 76.7 59.7 -62.5 -35.2 -12.3 46.2 21.0 103 102 A F T >> S+ 0 0 102 -3,-0.3 3,-1.1 -4,-0.3 4,-0.8 0.804 89.9 75.3 -64.0 -26.1 -14.0 48.7 18.7 104 103 A L H <> S+ 0 0 5 -3,-1.2 4,-0.7 1,-0.3 3,-0.3 0.748 81.1 68.0 -60.4 -26.3 -11.5 47.7 15.9 105 104 A I H X4 S+ 0 0 41 -3,-1.3 3,-0.6 -4,-0.3 -1,-0.3 0.895 102.9 45.4 -59.4 -40.4 -13.4 44.4 15.3 106 105 A E H <4 S+ 0 0 147 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.2 0.704 106.9 60.6 -72.5 -21.6 -16.3 46.3 13.9 107 106 A E H 3< S+ 0 0 117 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.546 105.6 47.1 -85.4 -11.8 -14.0 48.5 11.8 108 107 A H X< + 0 0 14 -4,-0.7 3,-1.6 -3,-0.6 -1,-0.2 -0.594 62.8 161.5-126.6 70.2 -12.6 45.6 9.8 109 108 A P T 3 + 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.656 66.1 71.8 -70.3 -12.8 -15.7 43.6 8.8 110 109 A N T 3 S+ 0 0 125 -3,-0.1 2,-0.3 2,-0.0 -3,-0.0 0.426 96.0 58.1 -83.2 1.3 -13.8 41.8 6.0 111 110 A L S < S- 0 0 12 -3,-1.6 2,-0.6 -6,-0.2 -27,-0.2 -0.949 80.8-127.7-123.9 151.3 -11.8 39.7 8.6 112 111 A T E -c 84 0A 72 -29,-1.9 -27,-2.9 -2,-0.3 2,-0.4 -0.904 41.7-176.1 -95.5 119.3 -13.0 37.3 11.3 113 112 A I E -c 85 0A 17 -2,-0.6 2,-0.4 -29,-0.2 -27,-0.2 -0.957 20.8-175.3-129.6 130.6 -11.2 38.6 14.4 114 113 A A E +c 86 0A 17 -29,-2.6 -27,-2.7 -2,-0.4 -2,-0.0 -0.988 6.5 178.1-128.8 124.5 -11.0 37.5 18.0 115 114 A F - 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