==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-AUG-13 4M51 . COMPND 2 MOLECULE: AMIDOHYDROLASE FAMILY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: NITRATIRUPTOR SP. SB155-2; . AUTHOR Y.PATSKOVSKY,R.TORO,A.GOBBLE,F.M.RAUSHEL,S.C.ALMO,ENZYME FUN . 402 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16671.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 302 75.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 52 12.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 7.7 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 . 0 0.0 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 . 39 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.5 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 0 3 2 2 1 1 1 1 1 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 2 1 1 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 1 3 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 1 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 1 A M 0 0 61 0, 0.0 43,-0.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 141.3 -4.2 -3.2 20.7 2 2 A R E -Ab 23 44A 90 21,-2.4 21,-2.6 41,-0.2 2,-0.4 -0.943 360.0-149.6-134.9 155.2 -2.3 -2.8 24.0 3 3 A I E -Ab 22 45A 1 41,-2.2 43,-2.9 -2,-0.3 2,-0.4 -0.995 7.8-168.6-125.4 132.8 -2.8 -0.9 27.2 4 4 A I E -Ab 21 46A 2 17,-2.3 17,-2.5 -2,-0.4 43,-0.2 -0.994 4.2-164.9-120.3 127.0 0.0 0.4 29.5 5 5 A K E + b 0 47A 29 41,-2.9 43,-3.0 -2,-0.4 15,-0.2 -0.916 19.2 174.1-108.1 99.7 -0.8 1.8 33.0 6 6 A P E - b 0 48A 0 0, 0.0 13,-0.3 0, 0.0 43,-0.2 -0.494 47.5-104.4 -93.4 175.2 2.2 3.7 34.3 7 7 A F E S- 0 0 64 44,-2.4 11,-0.5 41,-0.9 2,-0.3 0.907 101.2 -8.4 -59.1 -44.4 2.5 5.8 37.5 8 8 A A E -Cb 17 52A 1 43,-0.9 45,-2.1 9,-0.2 2,-0.4 -0.989 60.5-136.3-153.4 157.5 2.3 8.9 35.4 9 9 A I E -Cb 16 53A 0 7,-2.6 7,-2.6 -2,-0.3 2,-0.6 -0.971 9.4-154.4-114.4 129.7 2.3 10.1 31.8 10 10 A L E -C 15 0A 0 43,-2.8 5,-0.2 -2,-0.4 348,-0.2 -0.938 9.3-172.5-101.3 114.7 4.3 13.1 30.7 11 11 A T - 0 0 10 3,-2.7 347,-2.3 -2,-0.6 -1,-0.1 0.631 55.5-108.6 -80.9 -16.6 2.3 14.3 27.7 12 12 A P S S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 329,-0.1 -0.992 110.8 44.3 -90.1 -15.5 4.9 16.2 27.7 13 13 A Q S S+ 0 0 70 -3,-0.2 2,-0.3 328,-0.1 328,-0.1 0.646 118.2 36.1 -84.0 -4.0 3.3 19.4 28.7 14 14 A T S S- 0 0 65 2,-0.0 -3,-2.7 -5,-0.0 2,-0.6 -0.940 73.5-127.5-136.0 157.7 1.1 17.9 31.5 15 15 A I E -C 10 0A 44 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.936 27.4-168.7-102.0 117.7 1.5 15.2 34.1 16 16 A I E +C 9 0A 38 -7,-2.6 -7,-2.6 -2,-0.6 2,-0.3 -0.953 6.7 179.4-110.3 129.0 -1.4 12.7 34.1 17 17 A Q E +C 8 0A 70 -2,-0.5 -9,-0.2 -9,-0.2 -10,-0.1 -0.773 60.6 34.5-117.4 165.4 -1.9 10.2 36.9 18 18 A D S S+ 0 0 124 -11,-0.5 2,-0.3 -2,-0.3 -1,-0.1 0.769 99.2 97.8 63.2 27.0 -4.5 7.5 37.4 19 19 A K - 0 0 86 -13,-0.3 13,-0.3 -3,-0.2 2,-0.2 -0.977 55.1-152.7-141.3 157.9 -4.8 6.9 33.6 20 20 A A E - D 0 31A 0 11,-3.2 11,-1.8 -2,-0.3 2,-0.4 -0.717 18.0-120.0-120.6 171.5 -3.4 4.4 31.1 21 21 A V E -AD 4 30A 0 -17,-2.5 -17,-2.3 -2,-0.2 2,-0.5 -0.973 13.3-158.9-121.9 126.1 -2.7 4.5 27.4 22 22 A A E +AD 3 29A 0 7,-2.6 6,-2.7 -2,-0.4 7,-1.6 -0.898 29.4 158.5 -99.8 132.6 -4.3 2.3 24.7 23 23 A F E +AD 2 27A 1 -21,-2.6 -21,-2.4 -2,-0.5 4,-0.2 -0.993 30.1 166.0-152.1 155.2 -2.3 2.1 21.5 24 24 A D S S- 0 0 71 2,-2.1 3,-0.1 -2,-0.3 -1,-0.1 0.280 92.9 -27.8-126.3 -95.0 -1.6 0.1 18.4 25 25 A K S S+ 0 0 90 374,-0.1 339,-2.6 1,-0.1 2,-0.3 0.742 141.5 31.7 -85.3 -36.0 0.4 2.1 15.8 26 26 A K B S-H 363 0B 96 337,-0.3 -2,-2.1 372,-0.1 2,-0.5 -0.748 100.4 -91.9-115.6 160.0 -1.1 5.3 17.1 27 27 A I E +D 23 0A 1 335,-3.1 334,-2.9 332,-0.3 -4,-0.3 -0.686 44.9 178.6 -67.0 118.9 -2.2 6.4 20.6 28 28 A E E - 0 0 77 -6,-2.7 2,-0.3 -2,-0.5 -5,-0.2 0.760 55.4 -6.3-100.2 -33.3 -5.9 5.5 20.5 29 29 A A E -D 22 0A 17 -7,-1.6 -7,-2.6 2,-0.1 2,-0.4 -0.982 44.5-153.5-163.0 152.9 -7.1 6.5 24.0 30 30 A I E +D 21 0A 38 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.979 50.1 110.2-132.1 114.1 -6.0 7.8 27.4 31 31 A D E S-D 20 0A 46 -11,-1.8 -11,-3.2 -2,-0.4 -2,-0.1 -0.964 71.2 -56.4-168.0 174.2 -8.3 6.8 30.2 32 32 A T > - 0 0 48 -2,-0.3 4,-2.8 -13,-0.3 5,-0.2 -0.324 50.3-116.0 -60.6 154.2 -8.5 4.7 33.3 33 33 A V H > S+ 0 0 31 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.922 117.4 60.4 -56.2 -42.5 -7.9 1.0 32.7 34 34 A E H > S+ 0 0 139 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.911 111.5 38.1 -51.7 -48.3 -11.5 0.4 33.8 35 35 A N H > S+ 0 0 41 -3,-0.2 4,-1.0 1,-0.2 3,-0.4 0.882 113.5 56.2 -72.9 -37.2 -12.8 2.6 31.0 36 36 A L H >X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 3,-0.6 0.886 101.8 54.3 -64.7 -41.4 -10.2 1.4 28.4 37 37 A I H 3< S+ 0 0 81 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.795 100.6 61.7 -69.3 -22.2 -11.1 -2.3 28.7 38 38 A K H 3< S+ 0 0 131 -4,-0.7 -1,-0.2 -3,-0.4 -2,-0.2 0.869 116.3 31.9 -63.1 -38.0 -14.7 -1.5 27.9 39 39 A K H << S+ 0 0 103 -4,-1.0 -2,-0.2 -3,-0.6 -1,-0.2 0.780 131.2 35.0 -86.1 -31.3 -13.6 -0.1 24.5 40 40 A Y >< + 0 0 45 -4,-2.6 3,-2.1 -5,-0.1 -1,-0.2 -0.569 60.2 157.1-128.0 65.3 -10.7 -2.4 24.0 41 41 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.705 77.3 61.2 -65.2 -15.5 -11.6 -5.8 25.5 42 42 A N T 3 S+ 0 0 118 -3,-0.1 2,-0.6 2,-0.1 -5,-0.1 0.382 84.4 97.6 -87.0 -0.3 -9.0 -7.3 23.1 43 43 A A < - 0 0 9 -3,-2.1 -41,-0.2 -6,-0.1 -3,-0.1 -0.835 68.0-139.2-100.2 118.9 -6.1 -5.3 24.7 44 44 A A E -b 2 0A 77 -2,-0.6 -41,-2.2 -43,-0.6 2,-0.5 -0.411 23.2-130.7 -64.9 147.2 -3.9 -6.9 27.2 45 45 A V E -b 3 0A 45 -43,-0.2 2,-0.6 -2,-0.1 -41,-0.2 -0.920 15.0-161.4-111.5 123.8 -3.0 -4.6 30.1 46 46 A E E -b 4 0A 58 -43,-2.9 -41,-2.9 -2,-0.5 2,-0.6 -0.931 8.9-155.6-100.5 119.6 0.5 -4.0 31.3 47 47 A H E +b 5 0A 107 -2,-0.6 2,-0.3 -43,-0.2 3,-0.1 -0.886 19.8 169.7 -96.5 118.7 0.7 -2.5 34.8 48 48 A D E > +b 6 0A 30 -43,-3.0 3,-1.7 -2,-0.6 -41,-0.9 -0.674 4.4 167.2-127.3 71.4 4.0 -0.6 35.3 49 49 A E E 3 S+ 0 0 87 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.603 74.8 49.9 -73.9 -13.0 3.2 1.1 38.5 50 50 A N E 3 S+ 0 0 123 -3,-0.1 321,-2.6 -43,-0.1 -1,-0.3 -0.090 103.4 78.9-111.7 31.5 6.9 2.1 39.1 51 51 A S E < - E 0 370A 13 -3,-1.7 -44,-2.4 319,-0.3 -43,-0.9 -0.865 64.5-139.5-134.8 164.5 7.4 3.6 35.6 52 52 A L E -bE 8 369A 0 317,-2.6 317,-2.4 -2,-0.3 2,-0.4 -0.950 9.8-145.2-121.4 145.3 6.6 6.7 33.6 53 53 A L E +bE 9 368A 0 -45,-2.1 -43,-2.8 -2,-0.4 315,-0.2 -0.939 29.8 156.6-106.2 135.2 5.5 7.0 30.0 54 54 A L E - E 0 367A 0 313,-2.0 313,-2.9 -2,-0.4 -43,-0.1 -0.930 45.5 -83.4-144.5 166.0 6.8 10.0 28.0 55 55 A P E - E 0 366A 0 0, 0.0 311,-0.3 0, 0.0 2,-0.1 -0.385 48.2-100.0 -67.0 153.1 7.2 10.6 24.3 56 56 A G - 0 0 0 309,-1.8 57,-0.2 340,-0.2 2,-0.1 -0.401 48.3-106.5 -57.5 145.2 10.2 9.4 22.4 57 57 A F E -i 113 0C 0 55,-2.5 57,-2.6 -2,-0.1 58,-1.4 -0.432 19.7-139.8 -71.2 153.1 12.7 12.2 21.9 58 58 A A E -i 115 0C 0 285,-2.3 58,-0.2 56,-0.2 245,-0.2 -0.921 10.8-168.7-101.7 141.4 13.3 14.0 18.6 59 59 A N E -i 116 0C 0 56,-2.6 58,-2.3 -2,-0.4 245,-0.2 -0.830 7.7-177.7-125.6 87.2 17.0 14.8 17.9 60 60 A P E + 0 0 0 0, 0.0 2,-0.3 0, 0.0 244,-0.1 0.379 63.6 47.4 -78.1 5.9 16.7 17.2 14.9 61 61 A H E + 0 0 0 242,-0.1 245,-2.1 245,-0.1 2,-0.3 -0.774 62.2 137.6-151.0 103.5 20.4 17.7 14.3 62 62 A L E -i 118 0C 0 55,-2.1 57,-2.8 -2,-0.3 2,-1.0 -0.996 40.5-144.6-147.1 138.6 23.1 15.1 14.1 63 63 A H > + 0 0 19 -2,-0.3 3,-1.4 55,-0.2 245,-0.4 -0.779 23.0 178.9 -99.1 87.5 26.0 14.5 11.8 64 64 A L G > S+ 0 0 0 -2,-1.0 3,-1.7 55,-0.3 -1,-0.2 0.785 70.3 69.5 -65.1 -30.9 26.0 10.7 11.6 65 65 A E G 3 S+ 0 0 12 54,-0.5 3,-0.3 1,-0.3 31,-0.3 0.715 95.9 56.2 -64.1 -21.9 29.0 10.4 9.2 66 66 A F G X + 0 0 14 -3,-1.4 3,-2.0 1,-0.2 -1,-0.3 0.138 69.7 119.7 -93.2 21.3 31.3 11.6 12.0 67 67 A S T < + 0 0 11 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.541 62.5 65.7 -73.5 -4.9 30.3 8.9 14.5 68 68 A A T 3 S+ 0 0 32 -3,-0.3 -1,-0.3 24,-0.2 2,-0.3 0.550 77.3 111.4 -85.6 -9.5 33.8 7.4 14.8 69 69 A N < + 0 0 3 -3,-2.0 242,-0.1 1,-0.2 241,-0.1 -0.509 21.6 142.6 -70.4 132.8 35.1 10.6 16.5 70 70 A K S S- 0 0 179 -2,-0.3 -1,-0.2 239,-0.1 -2,-0.0 0.537 87.6 -15.6-123.0 -60.9 36.1 10.4 20.1 71 71 A A S S+ 0 0 91 3,-0.0 4,-0.1 1,-0.0 -2,-0.1 0.137 107.5 96.7-136.8 20.0 39.2 12.6 20.6 72 72 A T S S+ 0 0 67 2,-0.1 2,-0.1 20,-0.0 -3,-0.1 0.895 71.4 68.8 -82.0 -42.0 40.5 13.1 17.0 73 73 A L S S- 0 0 9 1,-0.1 2,-0.6 15,-0.0 8,-0.1 -0.435 90.9-106.8 -79.6 156.1 38.9 16.5 16.3 74 74 A Q - 0 0 111 6,-0.3 3,-0.3 7,-0.3 2,-0.2 -0.741 35.9-165.0 -90.0 119.1 40.0 19.7 18.2 75 75 A Y + 0 0 64 -2,-0.6 211,-0.2 1,-0.1 210,-0.1 -0.537 56.1 56.3 -96.3 164.8 37.7 21.1 20.8 76 76 A G S S+ 0 0 48 209,-2.5 2,-0.3 -2,-0.2 210,-0.2 0.003 102.1 41.6 112.5 -23.7 37.7 24.5 22.6 77 77 A D S > S- 0 0 63 -3,-0.3 4,-1.9 1,-0.1 210,-0.2 -0.973 70.8-132.9-159.2 136.8 37.5 26.9 19.7 78 78 A F H > S+ 0 0 3 208,-0.6 4,-2.6 -2,-0.3 5,-0.2 0.910 100.6 48.0 -68.6 -50.0 35.4 26.9 16.5 79 79 A I H > S+ 0 0 15 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.950 113.5 48.4 -60.5 -46.9 38.0 27.8 13.8 80 80 A P H > S+ 0 0 46 0, 0.0 4,-1.9 0, 0.0 -6,-0.3 0.889 110.4 53.1 -60.2 -34.8 40.6 25.3 15.1 81 81 A W H X S+ 0 0 29 -4,-1.9 4,-2.3 2,-0.2 -7,-0.3 0.942 108.7 49.6 -60.5 -48.5 37.8 22.7 15.1 82 82 A L H X S+ 0 0 17 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.918 109.6 50.7 -56.4 -47.3 37.0 23.5 11.5 83 83 A Y H X S+ 0 0 80 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.886 110.0 51.4 -56.5 -40.5 40.7 23.1 10.5 84 84 A S H X S+ 0 0 9 -4,-1.9 4,-2.6 -5,-0.2 5,-0.2 0.882 107.4 51.6 -68.7 -36.4 40.7 19.7 12.3 85 85 A V H X S+ 0 0 13 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.942 111.5 47.7 -59.6 -48.8 37.6 18.6 10.4 86 86 A I H < S+ 0 0 47 -4,-2.4 4,-0.4 1,-0.2 -2,-0.2 0.908 115.9 45.3 -59.5 -42.8 39.3 19.5 7.2 87 87 A R H < S+ 0 0 133 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.891 124.7 28.4 -67.7 -40.3 42.5 17.7 8.3 88 88 A H H >X S+ 0 0 58 -4,-2.6 4,-2.8 1,-0.1 3,-1.1 0.603 91.2 89.3-104.8 -14.1 41.0 14.5 9.6 89 89 A R H 3X S+ 0 0 74 -4,-2.4 4,-2.5 1,-0.3 -1,-0.1 0.840 80.6 62.8 -61.8 -33.3 37.8 13.9 7.7 90 90 A E H 34 S+ 0 0 160 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.850 118.7 28.6 -60.1 -33.1 39.4 11.8 4.9 91 91 A D H <> S+ 0 0 117 -3,-1.1 4,-1.0 -4,-0.1 -2,-0.2 0.808 120.6 53.2 -91.9 -37.5 40.4 9.2 7.5 92 92 A L H X S+ 0 0 6 -4,-2.8 4,-0.8 2,-0.2 -24,-0.2 0.877 102.0 57.8 -68.3 -41.1 37.7 9.7 10.1 93 93 A L H >< S+ 0 0 33 -4,-2.5 3,-1.4 -5,-0.2 -1,-0.2 0.955 107.0 45.4 -60.2 -51.4 34.7 9.3 7.7 94 94 A P H 34 S+ 0 0 87 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.765 100.0 70.6 -67.3 -20.2 35.6 5.8 6.4 95 95 A L H 3< S+ 0 0 119 -4,-1.0 2,-1.3 1,-0.2 -2,-0.2 0.796 87.8 69.1 -62.3 -28.8 36.3 4.7 10.0 96 96 A a S << S+ 0 0 10 -3,-1.4 -1,-0.2 -4,-0.8 -29,-0.1 -0.709 79.1 169.2 -89.5 84.1 32.6 4.9 10.5 97 97 A D > - 0 0 94 -2,-1.3 4,-2.6 4,-0.0 5,-0.2 -0.045 53.5 -74.2 -82.4-171.8 31.7 2.0 8.3 98 98 A G H > S+ 0 0 50 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.865 132.7 50.3 -57.5 -39.7 28.4 0.3 8.0 99 99 A A H > S+ 0 0 63 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.900 110.6 49.8 -65.6 -41.0 28.7 -1.5 11.4 100 100 A a H > S+ 0 0 26 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.942 113.5 46.0 -63.3 -45.7 29.5 1.8 13.1 101 101 A L H X S+ 0 0 11 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.924 113.5 48.8 -62.7 -45.6 26.5 3.6 11.5 102 102 A E H X S+ 0 0 137 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.923 114.0 45.6 -61.3 -45.6 24.2 0.7 12.3 103 103 A Q H X S+ 0 0 110 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.871 110.9 53.6 -63.9 -42.0 25.3 0.6 15.9 104 104 A T H X S+ 0 0 8 -4,-2.4 4,-1.6 -5,-0.2 -2,-0.2 0.943 111.1 45.6 -60.4 -48.3 25.1 4.3 16.3 105 105 A L H X S+ 0 0 4 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.900 111.5 52.1 -63.8 -39.3 21.5 4.4 15.1 106 106 A S H X S+ 0 0 62 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.898 108.0 52.2 -62.9 -39.1 20.5 1.5 17.3 107 107 A S H X S+ 0 0 41 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.828 102.7 58.8 -67.5 -31.9 22.0 3.3 20.3 108 108 A I H ><>S+ 0 0 2 -4,-1.6 5,-2.0 2,-0.2 3,-0.5 0.948 109.3 44.6 -58.3 -49.3 20.0 6.4 19.5 109 109 A I H ><5S+ 0 0 10 -4,-1.7 3,-2.3 1,-0.2 -2,-0.2 0.929 109.4 55.9 -60.6 -44.4 16.8 4.3 19.8 110 110 A Q H 3<5S+ 0 0 79 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.741 104.0 54.4 -65.6 -21.7 18.1 2.6 23.0 111 111 A T T <<5S- 0 0 8 -4,-1.3 206,-0.3 -3,-0.5 -1,-0.3 0.304 128.2 -95.2 -94.3 10.1 18.6 6.0 24.6 112 112 A G T < 5S+ 0 0 0 -3,-2.3 -55,-2.5 1,-0.3 2,-0.5 0.483 80.0 133.7 97.9 3.4 15.0 7.0 23.9 113 113 A T E < +i 57 0C 0 -5,-2.0 -1,-0.3 -57,-0.2 -55,-0.2 -0.773 21.2 171.4 -88.7 132.2 15.2 8.9 20.7 114 114 A T E + 0 0 0 -57,-2.6 21,-2.1 -2,-0.5 2,-0.3 0.499 64.0 39.0-117.8 -9.7 12.6 8.0 18.1 115 115 A A E -ij 58 135C 0 -58,-1.4 -56,-2.6 19,-0.2 2,-0.3 -0.994 65.0-176.7-144.0 138.8 13.0 10.7 15.4 116 116 A I E -ij 59 136C 0 19,-2.5 21,-2.5 -2,-0.3 2,-0.6 -0.933 27.8-140.3-134.2 156.0 16.2 12.3 14.0 117 117 A G E - 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