==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 02-JUL-02 1H13 . COMPND 2 MOLECULE: ENDO-1,4-BETA-XYLANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOALTEROMONAS HALOPLANKTIS; . AUTHOR F.VAN PETEGEM,T.COLLINS,M.A.MEUWIS,G.FELLER,C.GERDAY, . 403 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14948.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 279 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 22 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 160 39.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 2 0 0 0 0 0 2 0 2 1 3 1 0 0 1 1 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 4 5 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 A 0 0 120 0, 0.0 23,-0.2 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 150.3 11.4 20.6 -1.2 2 2 A F - 0 0 23 1,-0.1 2,-1.1 22,-0.1 356,-0.1 -0.371 360.0-129.8 -58.1 128.0 11.8 17.4 0.7 3 3 A N + 0 0 64 1,-0.2 -1,-0.1 -2,-0.1 352,-0.1 -0.765 28.5 178.6 -82.4 101.5 15.1 17.1 2.4 4 4 A N S S+ 0 0 80 -2,-1.1 -1,-0.2 1,-0.2 -2,-0.1 0.293 70.2 66.6 -86.8 12.4 16.2 13.7 1.3 5 5 A N S S- 0 0 114 352,-0.0 -1,-0.2 0, 0.0 351,-0.1 -0.539 77.1-165.4-129.8 67.0 19.5 14.0 3.2 6 6 A P - 0 0 6 0, 0.0 4,-0.1 0, 0.0 297,-0.1 -0.215 28.6-101.6 -60.5 138.5 18.4 14.0 6.8 7 7 A S - 0 0 69 1,-0.1 291,-2.7 2,-0.1 4,-0.1 -0.239 9.5-142.1 -62.4 144.6 21.1 15.2 9.2 8 8 A S S S+ 0 0 74 289,-0.3 2,-0.6 -3,-0.1 -1,-0.1 0.489 91.1 76.9 -76.4 -10.9 23.1 12.8 11.3 9 9 A V S S- 0 0 81 288,-0.1 288,-0.3 3,-0.0 -2,-0.1 -0.917 85.8-134.5 -99.4 124.4 22.9 15.4 14.0 10 10 A G >> - 0 0 1 286,-0.6 4,-2.7 -2,-0.6 3,-0.6 -0.336 16.4-113.9 -81.9 163.4 19.5 15.4 15.6 11 11 A A H 3> S+ 0 0 3 283,-2.8 4,-2.4 1,-0.2 284,-0.2 0.786 113.9 65.4 -58.5 -31.1 17.2 18.3 16.5 12 12 A Y H 34 S+ 0 0 28 283,-2.3 -1,-0.2 282,-0.2 284,-0.1 0.917 112.1 33.0 -63.0 -39.3 17.7 17.5 20.2 13 13 A S H <4 S+ 0 0 90 -3,-0.6 -2,-0.2 282,-0.5 -1,-0.2 0.891 128.1 36.1 -81.1 -44.2 21.4 18.4 19.9 14 14 A S H < S- 0 0 58 -4,-2.7 -3,-0.2 2,-0.2 -2,-0.2 0.760 91.9-133.4 -83.3 -25.9 21.2 21.2 17.3 15 15 A G < + 0 0 54 -4,-2.4 2,-0.7 -5,-0.3 -4,-0.1 0.417 67.3 125.5 82.1 -1.1 17.9 22.8 18.3 16 16 A T - 0 0 103 -6,-0.2 2,-0.4 -5,-0.0 -1,-0.2 -0.848 42.3-167.9 -96.9 109.1 16.9 22.8 14.6 17 17 A Y - 0 0 45 -2,-0.7 2,-0.1 -3,-0.1 381,-0.1 -0.829 18.3-127.3 -96.8 131.2 13.6 21.0 14.1 18 18 A R - 0 0 31 -2,-0.4 2,-0.5 374,-0.1 377,-0.2 -0.470 6.8-150.4 -69.9 148.9 12.5 20.1 10.6 19 19 A N > - 0 0 26 375,-0.1 4,-2.4 1,-0.1 3,-0.2 -0.891 15.9-176.2-116.8 90.4 9.1 21.2 9.4 20 20 A L H > S+ 0 0 0 -2,-0.5 4,-2.0 372,-0.3 374,-0.2 0.896 80.2 55.1 -62.8 -37.9 8.3 18.4 7.0 21 21 A A H 4>S+ 0 0 0 372,-2.9 5,-2.5 1,-0.2 -1,-0.2 0.900 108.6 48.9 -63.1 -35.5 5.1 20.0 5.9 22 22 A Q H >45S+ 0 0 129 371,-0.3 3,-2.1 1,-0.2 -1,-0.2 0.921 107.6 53.9 -68.5 -44.0 6.9 23.1 5.0 23 23 A E H 3<5S+ 0 0 33 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.871 106.9 54.1 -53.2 -37.9 9.5 21.2 3.1 24 24 A M T 3<5S- 0 0 32 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.299 121.2-109.9 -83.6 7.6 6.6 19.6 1.2 25 25 A G T < 5 + 0 0 58 -3,-2.1 -3,-0.2 1,-0.2 -2,-0.1 0.651 64.1 152.4 78.0 19.2 5.3 23.1 0.2 26 26 A K < - 0 0 57 -5,-2.5 2,-0.3 -6,-0.2 -1,-0.2 -0.423 28.7-151.2 -81.6 157.5 2.2 23.1 2.3 27 27 A T + 0 0 114 1,-0.2 -1,-0.0 -2,-0.1 -5,-0.0 -0.769 69.8 31.6-121.6 167.9 0.6 26.2 3.7 28 28 A N S > S+ 0 0 71 -2,-0.3 4,-1.9 1,-0.1 -1,-0.2 0.848 72.3 153.1 55.1 38.9 -1.4 27.0 6.8 29 29 A I H > + 0 0 14 -3,-0.2 4,-2.3 1,-0.2 5,-0.2 0.947 65.4 44.5 -68.3 -49.3 0.5 24.4 8.6 30 30 A Q H > S+ 0 0 75 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.898 111.1 55.3 -65.4 -36.4 0.2 25.7 12.1 31 31 A Q H > S+ 0 0 63 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.919 108.7 48.3 -59.5 -41.2 -3.5 26.4 11.7 32 32 A K H X S+ 0 0 46 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.903 111.7 49.0 -68.7 -40.4 -4.1 22.8 10.7 33 33 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.934 113.0 48.5 -60.4 -46.8 -2.1 21.5 13.7 34 34 A N H X S+ 0 0 71 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.908 111.7 47.5 -63.8 -42.4 -4.0 23.8 16.0 35 35 A S H X S+ 0 0 48 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.852 107.2 57.9 -69.9 -33.1 -7.4 22.8 14.6 36 36 A T H X S+ 0 0 2 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.956 111.6 41.8 -58.5 -48.8 -6.5 19.1 14.8 37 37 A F H X S+ 0 0 1 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.956 113.8 52.6 -62.5 -48.1 -5.9 19.6 18.5 38 38 A D H < S+ 0 0 79 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.879 112.7 43.8 -59.1 -37.4 -8.9 21.8 19.0 39 39 A N H >< S+ 0 0 56 -4,-2.6 3,-0.9 1,-0.2 5,-0.3 0.879 114.7 48.2 -77.6 -34.7 -11.2 19.2 17.4 40 40 A M H 3< S+ 0 0 4 -4,-2.3 9,-2.8 -5,-0.3 10,-1.8 0.873 121.0 37.9 -67.9 -34.9 -9.7 16.2 19.2 41 41 A F T 3< S+ 0 0 13 -4,-2.7 2,-0.3 -5,-0.2 -1,-0.2 -0.088 101.9 95.7-107.4 28.9 -9.9 18.1 22.5 42 42 A G S < S- 0 0 17 -3,-0.9 2,-1.9 -5,-0.1 3,-0.4 -0.890 83.4-111.4-120.7 157.2 -13.3 19.8 21.8 43 43 A Y S S+ 0 0 151 -2,-0.3 -3,-0.1 1,-0.2 -4,-0.1 -0.425 78.9 113.0 -89.9 69.2 -16.8 18.7 22.8 44 44 A N - 0 0 51 -2,-1.9 -1,-0.2 -5,-0.3 -4,-0.1 0.529 67.8-139.9-116.4 -8.5 -18.0 18.0 19.3 45 45 A N S S+ 0 0 70 -3,-0.4 331,-0.1 1,-0.1 -2,-0.1 0.703 86.0 83.3 52.0 25.8 -18.5 14.2 19.4 46 46 A T S S- 0 0 66 -7,-0.2 330,-0.7 -4,-0.2 -1,-0.1 0.712 112.0 -2.4-120.3 -75.8 -17.1 14.2 15.9 47 47 A Q S S+ 0 0 40 -8,-0.2 -8,-0.1 328,-0.2 -4,-0.1 0.589 103.8 129.3 -85.3 -17.3 -13.3 14.2 16.0 48 48 A Q + 0 0 9 1,-0.1 -8,-0.2 -6,-0.1 -7,-0.2 -0.078 20.4 156.6 -51.4 132.7 -13.4 14.4 19.8 49 49 A L + 0 0 1 -9,-2.8 16,-2.6 1,-0.1 2,-0.6 0.471 54.5 85.7-122.7 -14.5 -11.3 11.9 21.8 50 50 A Y E +A 64 0A 11 -10,-1.8 14,-0.2 14,-0.2 -1,-0.1 -0.827 57.6 174.3 -99.0 115.5 -11.0 13.9 25.0 51 51 A Y E -A 63 0A 32 12,-2.9 12,-2.5 -2,-0.6 2,-0.2 -0.954 29.2-117.9-127.0 141.5 -13.9 13.4 27.4 52 52 A P E -A 62 0A 49 0, 0.0 2,-0.5 0, 0.0 10,-0.3 -0.475 19.7-148.1 -75.3 148.4 -14.7 14.5 30.9 53 53 A Y E +A 61 0A 3 8,-3.1 7,-2.4 -2,-0.2 8,-1.4 -0.984 20.9 177.9-116.3 124.3 -15.3 12.0 33.6 54 54 A T E -A 59 0A 70 -2,-0.5 2,-0.5 5,-0.2 5,-0.2 -0.898 18.5-153.1-124.0 153.7 -17.7 12.9 36.4 55 55 A E E > S-A 58 0A 48 3,-2.3 3,-2.2 -2,-0.3 77,-0.1 -0.985 82.1 -17.2-129.1 118.6 -18.9 11.1 39.4 56 56 A N T 3 S- 0 0 138 -2,-0.5 3,-0.1 1,-0.3 -1,-0.1 0.853 129.8 -52.6 53.6 38.9 -22.3 11.9 40.8 57 57 A G T 3 S+ 0 0 72 1,-0.2 2,-0.5 0, 0.0 -1,-0.3 0.414 112.5 121.8 80.2 1.2 -22.2 15.2 38.8 58 58 A V E < -A 55 0A 78 -3,-2.2 -3,-2.3 1,-0.0 -1,-0.2 -0.847 65.6-121.5-100.3 122.8 -18.9 16.2 40.2 59 59 A Y E +A 54 0A 93 -2,-0.5 -5,-0.2 -5,-0.2 3,-0.1 -0.423 39.3 163.0 -60.5 133.6 -16.1 16.8 37.7 60 60 A K E - 0 0 75 -7,-2.4 2,-0.3 1,-0.4 -6,-0.2 0.734 50.5 -52.9-116.0 -61.6 -13.1 14.6 38.3 61 61 A A E -A 53 0A 0 -8,-1.4 -8,-3.1 40,-0.1 -1,-0.4 -0.856 50.2 -97.3-167.1-175.0 -10.7 14.4 35.3 62 62 A H E -A 52 0A 6 36,-2.1 2,-0.3 -10,-0.3 40,-0.3 -0.921 26.4-167.9-124.5 157.6 -10.6 13.6 31.6 63 63 A Y E -A 51 0A 14 -12,-2.5 -12,-2.9 -2,-0.3 2,-0.6 -0.953 29.2-113.9-138.2 162.5 -9.7 10.6 29.5 64 64 A I E -A 50 0A 0 -2,-0.3 2,-0.6 -14,-0.2 12,-0.6 -0.847 40.6-135.3 -92.5 119.6 -9.0 9.7 25.9 65 65 A K E -B 75 0B 39 -16,-2.6 2,-1.6 -2,-0.6 10,-0.2 -0.723 6.5-150.1 -86.5 120.1 -11.9 7.4 24.9 66 66 A A E -B 74 0B 2 8,-2.6 8,-2.1 -2,-0.6 -1,-0.1 -0.654 23.8-152.7 -87.1 80.5 -11.0 4.3 23.0 67 67 A I + 0 0 22 -2,-1.6 313,-0.3 6,-0.2 314,-0.2 -0.362 18.2 179.6 -56.7 133.0 -14.2 4.2 21.0 68 68 A N > - 0 0 41 1,-0.1 4,-1.6 312,-0.1 310,-0.1 -0.765 18.4-162.0-150.6 103.2 -14.9 0.6 20.1 69 69 A P T 4 S+ 0 0 61 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.630 87.2 25.4 -60.8 -23.2 -18.0 -0.2 18.1 70 70 A D T 4 S+ 0 0 98 2,-0.1 3,-0.1 1,-0.0 -2,-0.0 0.787 125.7 38.0-120.6 -22.8 -18.3 -3.8 18.8 71 71 A E T 4 S- 0 0 65 1,-0.1 -1,-0.0 3,-0.0 2,-0.0 0.434 115.1 -97.3-104.3 -2.9 -16.5 -4.6 22.2 72 72 A G < - 0 0 31 -4,-1.6 -1,-0.1 2,-0.0 -2,-0.1 0.207 47.2 -69.2 98.6 140.6 -17.7 -1.5 23.9 73 73 A D + 0 0 76 -4,-0.1 55,-0.3 -6,-0.1 2,-0.2 -0.312 59.4 174.3 -63.0 145.9 -15.8 1.8 24.5 74 74 A D E -B 66 0B 2 -8,-2.1 -8,-2.6 53,-0.1 2,-0.4 -0.745 29.6-115.3-141.7-175.8 -12.9 1.6 26.8 75 75 A I E -BC 65 126B 4 51,-2.3 51,-2.6 -2,-0.2 2,-0.3 -0.999 30.0-167.1-134.4 127.1 -10.0 3.7 28.1 76 76 A R E > - C 0 125B 60 -12,-0.6 4,-2.0 -2,-0.4 -12,-0.2 -0.857 28.6-133.4-123.2 149.0 -6.4 2.8 27.4 77 77 A T H > S+ 0 0 1 47,-1.0 4,-2.6 -2,-0.3 5,-0.2 0.848 105.0 58.2 -66.2 -37.8 -3.1 4.0 28.7 78 78 A E H > S+ 0 0 19 46,-0.2 4,-2.6 2,-0.2 5,-0.2 0.985 110.1 42.2 -56.7 -53.3 -1.6 4.4 25.3 79 79 A G H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.872 113.9 52.3 -62.0 -40.0 -4.2 6.8 24.2 80 80 A Q H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.933 112.6 44.3 -59.3 -47.8 -4.1 8.7 27.5 81 81 A S H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.856 112.3 52.1 -71.5 -34.7 -0.4 9.1 27.3 82 82 A W H X S+ 0 0 4 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.895 108.3 52.4 -63.9 -40.6 -0.4 10.1 23.7 83 83 A G H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.907 109.2 48.5 -63.8 -42.6 -3.0 12.7 24.5 84 84 A M H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.892 109.9 53.3 -61.6 -40.4 -0.9 14.1 27.3 85 85 A T H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.933 109.6 47.7 -60.5 -45.2 2.1 14.2 24.9 86 86 A A H X S+ 0 0 0 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.916 110.8 52.0 -60.9 -45.5 0.1 16.1 22.4 87 87 A A H ><>S+ 0 0 0 -4,-2.3 5,-2.8 1,-0.2 3,-0.6 0.929 108.6 48.8 -59.8 -45.1 -1.1 18.6 25.0 88 88 A V H ><5S+ 0 0 0 -4,-2.5 3,-1.1 1,-0.3 -1,-0.2 0.896 107.2 56.3 -68.3 -32.1 2.4 19.4 26.3 89 89 A M H 3<5S+ 0 0 3 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.804 113.2 40.5 -66.7 -28.7 3.7 20.0 22.8 90 90 A L T <<5S- 0 0 23 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.281 115.4-111.7-102.0 9.1 1.0 22.6 22.2 91 91 A N T < 5 + 0 0 86 -3,-1.1 2,-1.0 -4,-0.4 -3,-0.2 0.869 63.8 152.3 66.6 39.5 1.2 24.2 25.6 92 92 A K >< + 0 0 57 -5,-2.8 4,-2.0 1,-0.2 -1,-0.2 -0.720 12.0 169.0-106.0 84.7 -2.2 22.9 26.6 93 93 A Q H > + 0 0 78 -2,-1.0 4,-3.1 1,-0.2 5,-0.2 0.885 68.9 50.0 -72.7 -44.3 -1.9 22.7 30.3 94 94 A E H > S+ 0 0 122 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.923 112.5 49.6 -60.1 -45.5 -5.5 22.1 31.5 95 95 A E H > S+ 0 0 45 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.921 113.4 47.2 -58.2 -48.0 -5.9 19.4 29.0 96 96 A F H X S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.2 5,-0.2 0.943 113.4 47.2 -55.6 -52.3 -2.7 17.8 30.1 97 97 A D H X S+ 0 0 8 -4,-3.1 4,-2.8 1,-0.2 -2,-0.2 0.876 109.7 52.6 -62.3 -39.7 -3.5 18.1 33.8 98 98 A N H X S+ 0 0 14 -4,-2.8 -36,-2.1 -5,-0.2 4,-1.3 0.890 113.3 44.2 -65.4 -39.4 -7.0 16.7 33.3 99 99 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.904 114.6 48.5 -71.4 -40.7 -5.7 13.6 31.6 100 100 A W H X S+ 0 0 2 -4,-2.9 4,-2.9 1,-0.2 5,-0.3 0.924 107.2 56.0 -68.2 -38.4 -2.8 13.1 34.0 101 101 A R H X S+ 0 0 54 -4,-2.8 4,-1.9 -5,-0.2 -1,-0.2 0.907 109.4 47.8 -56.5 -43.2 -5.1 13.4 37.0 102 102 A F H X>S+ 0 0 0 -4,-1.3 4,-2.9 -40,-0.3 5,-0.8 0.923 111.8 48.6 -60.4 -49.3 -7.2 10.6 35.5 103 103 A A H X>S+ 0 0 0 -4,-2.2 5,-2.1 3,-0.2 4,-1.4 0.947 113.4 45.8 -59.8 -51.1 -4.3 8.4 34.9 104 104 A K H <5S+ 0 0 79 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.868 120.8 39.0 -64.0 -35.0 -2.8 8.8 38.3 105 105 A A H <5S+ 0 0 60 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.879 133.3 15.2 -79.3 -43.0 -6.1 8.3 40.1 106 106 A Y H <5S+ 0 0 46 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.709 125.2 44.0-114.4 -32.1 -7.7 5.6 38.0 107 107 A Q T < - 0 0 60 0, 0.0 3,-1.8 0, 0.0 10,-0.5 -0.144 23.2-125.4 -59.4 149.1 -1.6 0.7 43.8 111 111 A D T 3 S+ 0 0 92 1,-0.3 8,-0.1 8,-0.3 -2,-0.0 0.684 112.3 50.2 -66.8 -18.0 1.9 0.6 45.0 112 112 A N T 3 S+ 0 0 135 6,-0.1 -1,-0.3 7,-0.0 4,-0.1 0.048 77.2 148.0-108.5 25.0 0.9 -2.0 47.5 113 113 A H < - 0 0 17 -3,-1.8 6,-0.2 1,-0.2 5,-0.1 -0.280 58.8-120.2 -53.1 144.0 -0.9 -4.2 45.0 114 114 A P S S+ 0 0 128 0, 0.0 2,-0.8 0, 0.0 -1,-0.2 0.792 103.2 68.1 -61.8 -26.1 -0.6 -7.9 46.2 115 115 A D S >> S- 0 0 49 1,-0.2 3,-2.1 2,-0.0 4,-0.7 -0.832 75.2-156.4 -94.3 111.1 1.1 -8.7 42.9 116 116 A A G >4 S+ 0 0 53 -2,-0.8 3,-0.8 1,-0.3 -1,-0.2 0.817 89.9 64.7 -58.2 -28.4 4.5 -7.0 43.0 117 117 A K G 34 S+ 0 0 105 1,-0.3 -1,-0.3 -3,-0.1 77,-0.0 0.690 104.3 45.6 -70.3 -18.4 4.7 -7.0 39.3 118 118 A K G X4 S+ 0 0 38 -3,-2.1 3,-1.8 -5,-0.1 -1,-0.3 0.512 79.9 126.3 -96.9 -10.1 1.6 -4.7 39.0 119 119 A Q T << S- 0 0 56 -3,-0.8 -8,-0.3 -4,-0.7 3,-0.1 -0.318 89.1 -10.4 -61.6 120.0 2.7 -2.2 41.7 120 120 A G T 3 S+ 0 0 2 -11,-1.2 -1,-0.3 -10,-0.5 2,-0.1 0.423 101.9 124.8 73.8 -2.1 2.6 1.2 40.3 121 121 A V < - 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