==== 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 HYDROLASE 22-JUN-06 2HF2 . COMPND 2 MOLECULE: SUGAR PHOSPHATASE SUPH; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Y.PATSKOVSKY,U.RAMAGOPAL,S.C.ALMO,S.K.BURLEY,NEW YORK SGX RE . 536 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24826.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 373 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 54 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 63 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 2 0.4 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 . 27 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 25.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.6 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 2 4 2 0 0 0 8 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 8 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 . 0 2 2 4 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 L 0 0 155 0, 0.0 2,-0.3 0, 0.0 205,-0.1 0.000 360.0 360.0 360.0 -15.6 10.4 -10.2 6.1 2 2 A S - 0 0 61 1,-0.1 2,-0.6 2,-0.0 264,-0.0 -0.607 360.0-120.3 -81.4 134.6 6.8 -9.0 6.6 3 3 A V + 0 0 9 -2,-0.3 204,-0.2 1,-0.2 3,-0.1 -0.633 44.8 155.5 -75.0 116.5 6.2 -6.4 9.3 4 4 A K + 0 0 90 202,-2.9 35,-2.5 -2,-0.6 2,-0.3 0.548 64.1 33.5-113.7 -14.1 3.7 -7.9 11.9 5 5 A V E -ab 39 207A 0 201,-1.7 203,-3.0 33,-0.2 2,-0.5 -0.994 55.4-164.1-145.3 133.5 4.6 -5.9 15.0 6 6 A I E -ab 40 208A 0 33,-2.6 35,-3.0 -2,-0.3 2,-0.4 -0.991 15.7-173.2-116.4 123.7 5.8 -2.3 15.6 7 7 A V E -ab 41 209A 0 201,-3.0 203,-2.1 -2,-0.5 2,-0.4 -0.954 3.8-177.6-118.2 133.6 7.3 -1.6 19.1 8 8 A T E -ab 42 210A 0 33,-2.7 35,-2.9 -2,-0.4 203,-0.2 -0.974 22.7-136.1-131.8 143.7 8.2 1.8 20.3 9 9 A D > - 0 0 6 201,-1.8 5,-1.3 -2,-0.4 35,-0.2 -0.447 21.1-143.0 -78.1 166.8 9.8 3.3 23.4 10 10 A X I > >S+ 0 0 0 33,-0.2 3,-2.7 3,-0.2 5,-1.9 0.805 72.0 62.2 -97.9 -86.6 8.1 6.4 24.8 11 11 A D I 3 5S+ 0 0 41 1,-0.3 202,-0.2 2,-0.2 201,-0.2 -0.167 123.9 1.9 -48.0 126.8 10.5 9.0 26.3 12 12 A G I 3 5S+ 0 0 10 3,-0.4 235,-0.3 4,-0.3 -1,-0.3 0.457 136.4 53.6 75.8 1.9 12.9 10.3 23.6 13 13 A T I < 5S+ 0 0 3 -3,-2.7 239,-0.6 3,-0.1 -3,-0.2 0.502 119.5 11.4-127.5 -87.5 11.2 8.1 21.0 14 14 A F I - 0 0 38 4,-2.5 3,-1.6 -2,-0.4 -4,-0.3 -0.102 43.8 -85.3 -77.8-173.0 8.9 14.7 21.8 17 17 A D T 3 S+ 0 0 98 1,-0.3 231,-0.1 2,-0.1 -1,-0.1 0.798 131.9 58.0 -68.6 -25.9 10.7 16.9 24.4 18 18 A A T 3 S- 0 0 51 2,-0.1 -1,-0.3 410,-0.0 3,-0.1 0.385 118.2-115.8 -80.5 0.3 7.3 18.4 25.4 19 19 A K S < S+ 0 0 52 -3,-1.6 2,-0.3 1,-0.3 -2,-0.1 0.849 79.9 105.6 67.8 38.3 6.1 14.8 26.1 20 20 A T - 0 0 34 405,-0.0 -4,-2.5 348,-0.0 2,-0.3 -0.830 48.7-160.6-138.7 171.6 3.5 14.9 23.4 21 21 A Y - 0 0 26 -2,-0.3 2,-1.4 -6,-0.2 -6,-0.1 -0.944 41.8 -81.8-148.1 169.4 3.0 13.4 19.9 22 22 A N > - 0 0 60 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 -0.647 46.5-179.0 -81.0 92.3 0.9 14.0 16.8 23 23 A Q H > S+ 0 0 51 -2,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.912 76.3 48.7 -63.5 -49.3 -2.3 12.3 17.9 24 24 A P H > S+ 0 0 99 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.921 113.9 46.9 -57.3 -43.0 -4.4 12.8 14.7 25 25 A R H > S+ 0 0 66 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.954 114.2 46.8 -63.8 -48.3 -1.6 11.6 12.5 26 26 A F H X S+ 0 0 2 -4,-2.6 4,-3.1 2,-0.2 -1,-0.2 0.848 109.3 55.1 -60.4 -36.3 -0.9 8.5 14.6 27 27 A X H X S+ 0 0 58 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.976 110.0 44.8 -60.5 -56.1 -4.6 7.7 14.8 28 28 A A H X S+ 0 0 58 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.884 115.2 50.0 -55.4 -41.2 -5.0 7.6 11.0 29 29 A Q H X S+ 0 0 6 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.894 110.4 48.8 -63.4 -44.8 -1.8 5.6 10.9 30 30 A Y H X S+ 0 0 8 -4,-3.1 4,-2.6 2,-0.2 -2,-0.2 0.895 105.8 57.1 -62.6 -41.3 -3.0 3.1 13.5 31 31 A Q H X S+ 0 0 113 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.941 110.8 45.3 -52.8 -46.1 -6.3 2.7 11.6 32 32 A E H X S+ 0 0 82 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.808 110.0 53.0 -65.9 -35.4 -4.2 1.7 8.6 33 33 A L H <>S+ 0 0 0 -4,-1.8 5,-3.0 2,-0.2 4,-0.2 0.874 107.5 52.8 -67.7 -39.1 -2.0 -0.7 10.7 34 34 A K H ><5S+ 0 0 91 -4,-2.6 3,-1.3 3,-0.2 -2,-0.2 0.884 103.9 56.1 -62.7 -41.1 -5.1 -2.4 12.0 35 35 A K H 3<5S+ 0 0 165 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.869 111.6 44.1 -57.2 -37.7 -6.4 -3.0 8.4 36 36 A R T 3<5S- 0 0 96 -4,-1.2 -1,-0.3 2,-0.1 -2,-0.2 0.411 115.8-117.3 -87.2 0.4 -3.1 -4.8 7.7 37 37 A G T < 5 + 0 0 50 -3,-1.3 2,-0.5 1,-0.2 -3,-0.2 0.791 60.3 153.3 66.5 30.0 -3.2 -6.7 10.9 38 38 A I < - 0 0 5 -5,-3.0 -33,-0.2 -8,-0.1 -1,-0.2 -0.826 39.0-134.5 -94.2 123.2 -0.0 -5.1 12.3 39 39 A K E -a 5 0A 65 -35,-2.5 -33,-2.6 -2,-0.5 2,-0.4 -0.491 11.3-149.1 -73.7 143.4 0.2 -5.0 16.1 40 40 A F E -a 6 0A 1 -35,-0.2 23,-2.2 -2,-0.2 2,-0.4 -0.977 17.1-174.0-117.3 131.5 1.4 -1.8 17.8 41 41 A V E -ac 7 63A 1 -35,-3.0 -33,-2.7 -2,-0.4 2,-0.6 -0.975 18.4-155.0-129.2 131.5 3.3 -2.1 21.1 42 42 A V E -ac 8 64A 0 21,-2.4 23,-3.3 -2,-0.4 2,-0.5 -0.945 17.0-175.1-102.5 120.8 4.5 0.5 23.6 43 43 A A E + c 0 65A 0 -35,-2.9 2,-0.3 -2,-0.6 -33,-0.2 -0.958 20.2 141.5-122.7 116.6 7.5 -0.8 25.6 44 44 A S - 0 0 2 21,-2.7 24,-1.6 -2,-0.5 25,-0.4 -0.969 61.1-120.4-149.9 157.1 8.8 1.4 28.4 45 45 A N S S+ 0 0 67 -2,-0.3 21,-0.1 22,-0.3 -1,-0.1 0.706 83.8 108.8 -63.9 -25.1 10.3 1.6 32.0 46 46 A N S S- 0 0 18 21,-0.1 21,-2.7 1,-0.1 22,-0.2 0.003 82.0 -89.2 -58.8 158.2 7.2 3.8 32.8 47 47 A Q > - 0 0 30 19,-0.2 4,-1.7 1,-0.1 3,-0.4 -0.337 34.6-118.9 -63.4 148.4 4.2 2.9 35.0 48 48 A Y H > S+ 0 0 19 1,-0.2 4,-2.4 2,-0.2 3,-0.3 0.911 114.8 51.3 -57.5 -44.2 1.3 1.2 33.2 49 49 A Y H > S+ 0 0 97 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.793 107.7 52.6 -67.3 -25.1 -1.0 4.0 34.2 50 50 A Q H 4 S+ 0 0 29 -3,-0.4 4,-0.3 2,-0.2 -1,-0.2 0.810 110.7 48.3 -79.1 -27.2 1.4 6.6 32.9 51 51 A L H >< S+ 0 0 0 -4,-1.7 3,-1.4 -3,-0.3 4,-0.3 0.942 109.5 49.8 -72.3 -51.4 1.6 4.9 29.5 52 52 A I H >< S+ 0 0 19 -4,-2.4 3,-0.9 1,-0.3 7,-0.2 0.679 94.8 72.3 -68.4 -19.0 -2.2 4.4 29.0 53 53 A S T 3< S+ 0 0 40 -4,-0.8 -1,-0.3 1,-0.3 -2,-0.1 0.755 95.8 54.3 -66.1 -24.4 -2.9 8.1 29.7 54 54 A F T < S+ 0 0 0 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.656 112.9 43.1 -78.5 -18.9 -1.3 8.9 26.3 55 55 A F X> + 0 0 3 -3,-0.9 4,-1.8 -4,-0.3 3,-1.8 -0.363 61.4 151.3-125.9 55.8 -3.7 6.4 24.6 56 56 A P T 34 S+ 0 0 65 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.791 82.2 41.9 -61.8 -26.6 -7.2 6.9 26.0 57 57 A E T 34 S+ 0 0 136 -3,-0.1 -2,-0.1 1,-0.1 -3,-0.0 0.397 125.3 33.3 -96.5 -1.8 -8.8 5.8 22.7 58 58 A L T X> S+ 0 0 10 -3,-1.8 4,-2.7 -6,-0.2 3,-2.1 0.424 80.3 107.0-131.1 0.2 -6.5 2.9 22.0 59 59 A K T 3< S+ 0 0 73 -4,-1.8 17,-0.4 1,-0.3 -2,-0.1 0.667 87.5 42.4 -64.2 -20.9 -5.5 1.5 25.4 60 60 A D T 34 S+ 0 0 98 15,-0.1 -1,-0.3 -4,-0.1 17,-0.1 0.387 118.6 48.3-100.5 1.0 -7.7 -1.7 25.1 61 61 A E T <4 S+ 0 0 58 -3,-2.1 14,-0.3 14,-0.1 -2,-0.2 0.823 105.6 50.1-105.7 -51.6 -6.5 -2.1 21.5 62 62 A I S < S- 0 0 2 -4,-2.7 14,-0.6 -7,-0.1 2,-0.3 -0.262 84.2-110.7 -86.5 178.1 -2.8 -1.8 21.4 63 63 A S E -c 41 0A 5 -23,-2.2 -21,-2.4 11,-0.2 2,-0.4 -0.807 21.5-150.3-117.3 154.5 -0.3 -3.6 23.7 64 64 A F E -cD 42 73A 0 9,-2.3 9,-2.6 -2,-0.3 2,-0.6 -0.969 16.3-169.8-130.1 131.3 1.9 -2.5 26.6 65 65 A V E +cD 43 72A 0 -23,-3.3 -21,-2.7 -2,-0.4 3,-0.3 -0.946 36.1 177.0-110.7 103.8 5.2 -3.7 28.0 66 66 A A E > > + D 0 71A 0 5,-3.0 5,-2.0 -2,-0.6 3,-1.0 -0.624 48.9 23.5-110.2 160.6 5.3 -1.6 31.2 67 67 A E G > 5S- 0 0 19 -21,-2.7 3,-1.6 1,-0.3 -22,-0.3 0.873 129.9 -62.0 52.5 45.8 7.6 -1.3 34.2 68 68 A N G 3 5S- 0 0 43 -24,-1.6 -1,-0.3 -3,-0.3 -23,-0.2 0.842 109.4 -39.8 45.0 45.6 10.5 -2.7 32.1 69 69 A G G < 5S+ 0 0 0 -3,-1.0 -1,-0.3 -25,-0.4 119,-0.2 0.321 114.0 108.4 93.1 -6.2 8.7 -6.0 31.5 70 70 A A T < 5S+ 0 0 7 -3,-1.6 12,-2.3 -4,-0.4 2,-0.4 0.721 86.4 39.1 -73.3 -19.1 7.2 -6.5 35.0 71 71 A L E < -DE 66 81A 12 -5,-2.0 -5,-3.0 10,-0.2 2,-0.4 -0.993 67.6-179.2-133.6 127.1 3.8 -5.7 33.5 72 72 A V E -DE 65 80A 0 8,-2.5 7,-2.6 -2,-0.4 8,-1.8 -0.988 3.4-175.1-129.6 125.8 2.5 -6.9 30.1 73 73 A Y E +DE 64 78A 29 -9,-2.6 -9,-2.3 -2,-0.4 2,-0.4 -0.937 5.7 179.2-121.3 142.0 -0.9 -6.0 28.6 74 74 A E E > S- E 0 77A 28 3,-2.5 3,-1.8 -2,-0.4 -11,-0.2 -0.983 76.4 -5.4-144.6 125.4 -2.5 -7.2 25.4 75 75 A H T 3 S- 0 0 89 -2,-0.4 -15,-0.1 -14,-0.3 -14,-0.1 0.834 129.1 -58.6 52.5 39.6 -6.0 -6.1 24.3 76 76 A G T 3 S+ 0 0 23 -14,-0.6 2,-0.4 -17,-0.4 -1,-0.3 0.484 117.3 108.8 74.3 4.3 -6.5 -4.3 27.6 77 77 A K E < S-E 74 0A 148 -3,-1.8 -3,-2.5 -17,-0.1 2,-0.5 -0.922 78.0-108.6-115.7 138.1 -5.9 -7.5 29.6 78 78 A Q E +E 73 0A 65 -2,-0.4 -5,-0.3 -5,-0.2 3,-0.1 -0.518 36.8 173.1 -64.3 113.3 -2.9 -8.3 31.8 79 79 A L E + 0 0 71 -7,-2.6 2,-0.3 -2,-0.5 -6,-0.2 0.787 66.4 11.7 -88.3 -38.9 -1.0 -11.1 30.0 80 80 A F E +E 72 0A 45 -8,-1.8 -8,-2.5 2,-0.0 2,-0.3 -0.997 59.4 176.0-141.8 146.5 2.0 -11.2 32.3 81 81 A H E -E 71 0A 55 -2,-0.3 -10,-0.2 -10,-0.2 2,-0.2 -0.984 23.7-132.9-143.8 143.6 3.1 -9.8 35.7 82 82 A G + 0 0 5 -12,-2.3 2,-0.3 -2,-0.3 60,-0.1 -0.542 32.9 177.7 -76.8 157.8 6.1 -10.2 37.9 83 83 A E - 0 0 96 -2,-0.2 2,-0.3 61,-0.1 61,-0.2 -0.970 26.3-136.1-159.3 151.6 5.6 -11.0 41.6 84 84 A L - 0 0 7 59,-1.9 59,-0.4 -2,-0.3 2,-0.1 -0.749 33.2-112.8 -95.2 154.3 7.3 -11.7 44.8 85 85 A T > - 0 0 70 -2,-0.3 4,-2.3 57,-0.1 5,-0.2 -0.321 31.4-104.6 -73.6 167.0 6.2 -14.4 47.2 86 86 A R H > S+ 0 0 103 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.848 125.9 54.3 -57.9 -34.7 4.7 -13.5 50.7 87 87 A H H > S+ 0 0 112 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.922 108.1 45.5 -61.9 -51.3 8.1 -14.7 51.9 88 88 A E H > S+ 0 0 51 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.848 110.7 52.2 -70.1 -38.2 10.2 -12.3 49.7 89 89 A S H X S+ 0 0 13 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.865 109.5 51.7 -61.9 -39.0 8.0 -9.3 50.4 90 90 A R H X S+ 0 0 118 -4,-1.4 4,-2.1 -5,-0.2 -2,-0.2 0.956 111.6 46.2 -60.5 -53.8 8.5 -10.0 54.2 91 91 A I H X S+ 0 0 64 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.897 113.2 49.3 -53.7 -48.9 12.3 -10.2 53.7 92 92 A V H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 3,-0.2 0.940 111.7 47.1 -59.8 -49.6 12.4 -7.0 51.6 93 93 A I H X S+ 0 0 7 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.832 105.8 60.0 -66.5 -34.0 10.4 -4.9 54.1 94 94 A G H < S+ 0 0 36 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.935 107.7 45.8 -53.3 -49.9 12.4 -6.2 57.0 95 95 A E H < S+ 0 0 38 -4,-1.7 3,-0.3 1,-0.2 -2,-0.2 0.811 109.9 53.1 -65.3 -35.3 15.5 -4.7 55.4 96 96 A L H < S+ 0 0 33 -4,-1.6 2,-1.6 1,-0.2 -1,-0.2 0.802 93.8 73.6 -71.7 -29.4 13.7 -1.4 54.6 97 97 A L < 0 0 118 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.1 -0.291 360.0 360.0 -79.3 49.8 12.7 -1.1 58.3 98 98 A K 0 0 183 -2,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.325 360.0 360.0-147.0 360.0 16.3 -0.2 59.2 99 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 100 103 A N 0 0 89 0, 0.0 49,-3.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 137.8 10.3 6.1 53.4 101 104 A F E -H 148 0B 21 47,-0.2 11,-0.5 45,-0.0 2,-0.4 -0.932 360.0-151.1-139.6 158.8 8.9 3.7 50.8 102 105 A V E -H 147 0B 0 45,-2.6 45,-2.6 -2,-0.3 2,-0.4 -0.985 17.8-148.2-122.1 133.6 6.0 2.7 48.5 103 106 A A E -HI 146 110B 0 7,-2.9 7,-3.0 -2,-0.4 2,-0.6 -0.906 13.4-140.6-101.4 132.8 5.3 -0.9 47.5 104 107 A C E +HI 145 109B 9 41,-3.5 40,-2.6 -2,-0.4 41,-1.0 -0.846 26.9 171.3-101.8 115.7 3.9 -1.5 44.0 105 108 A G E -H 143 0B 10 3,-2.3 38,-0.2 -2,-0.6 -22,-0.0 -0.557 46.0 -99.8-111.1 178.1 1.2 -4.2 43.6 106 109 A L S S+ 0 0 40 36,-1.1 3,-0.1 -2,-0.2 37,-0.1 0.810 119.5 29.1 -68.5 -31.5 -1.1 -5.3 40.8 107 110 A Q S S- 0 0 125 1,-0.3 2,-0.3 35,-0.2 -1,-0.2 0.686 131.0 -10.8-103.0 -22.2 -4.2 -3.4 42.1 108 111 A S - 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