==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 08-NOV-96 2MBR . COMPND 2 MOLECULE: URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMINE . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR T.E.BENSON,C.T.WALSH,J.M.HOGLE . 340 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15563.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 19.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 5 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 32 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 21.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 0 1 0 0 2 0 0 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 PARALLEL BRIDGES PER LADDER . 4 3 4 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 3 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 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 H 0 0 131 0, 0.0 14,-2.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -34.4 4.2 -13.3 14.7 2 4 A S B -A 14 0A 43 12,-0.2 12,-0.3 1,-0.1 10,-0.1 -0.506 360.0-169.0 -77.5 134.6 6.5 -10.5 13.4 3 5 A L > + 0 0 0 10,-3.2 3,-2.2 -2,-0.3 4,-0.3 0.501 63.2 103.1 -91.2 -7.2 5.6 -6.8 14.1 4 6 A K G > S+ 0 0 91 9,-0.6 3,-1.0 1,-0.3 6,-0.3 0.856 81.7 44.3 -48.8 -43.9 8.2 -5.6 11.7 5 7 A P G 3 S+ 0 0 93 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.625 109.3 61.7 -80.5 -2.2 5.8 -4.8 8.9 6 8 A W G < S+ 0 0 71 -3,-2.2 2,-0.4 5,-0.2 -2,-0.2 0.312 98.4 54.3-103.6 6.8 3.5 -3.1 11.3 7 9 A N S X S- 0 0 5 -3,-1.0 3,-1.9 -4,-0.3 41,-0.2 -0.984 71.3-140.3-141.0 128.8 5.7 -0.3 12.7 8 10 A T T 3 S+ 0 0 30 39,-1.8 216,-0.7 38,-0.4 40,-0.2 0.692 100.6 69.7 -61.1 -20.3 7.5 2.2 10.5 9 11 A F T 3 S- 0 0 0 38,-0.6 -1,-0.3 41,-0.4 214,-0.2 0.772 102.3-133.6 -69.4 -20.8 10.6 2.0 12.7 10 12 A G < + 0 0 17 -3,-1.9 2,-0.2 -6,-0.3 -6,-0.1 0.715 42.8 167.1 77.3 18.4 11.1 -1.5 11.3 11 13 A I - 0 0 1 -8,-0.1 2,-0.9 -7,-0.1 -1,-0.2 -0.471 30.1-139.7 -68.1 134.7 11.7 -3.0 14.7 12 14 A D + 0 0 92 284,-0.4 2,-0.3 -2,-0.2 286,-0.1 -0.782 47.6 128.2-105.8 92.1 11.5 -6.7 14.6 13 15 A H - 0 0 30 -2,-0.9 -10,-3.2 41,-0.1 -9,-0.6 -0.763 49.1-119.0-126.6 173.9 9.8 -8.1 17.6 14 16 A N B -A 2 0A 53 -2,-0.3 42,-2.8 -12,-0.3 2,-0.3 -0.780 14.0-156.1-116.9 162.2 6.9 -10.6 17.7 15 17 A A E -b 56 0B 0 -14,-2.4 42,-0.2 -2,-0.3 44,-0.1 -0.915 29.8-119.4-131.0 155.6 3.4 -10.5 19.0 16 18 A Q E S- 0 0 93 42,-1.4 2,-0.3 40,-0.9 43,-0.2 0.925 97.6 -3.7 -62.9 -41.8 1.2 -13.5 20.0 17 19 A H E -b 59 0B 91 41,-1.3 43,-2.3 -16,-0.1 2,-0.4 -0.979 59.5-161.2-148.0 151.7 -1.3 -12.5 17.3 18 20 A I E -b 60 0B 40 -2,-0.3 2,-0.4 41,-0.2 43,-0.2 -0.994 19.0-178.0-135.6 126.1 -1.7 -9.7 14.8 19 21 A V E -b 61 0B 50 41,-2.9 43,-3.2 -2,-0.4 2,-0.5 -0.995 22.8-139.0-133.5 135.2 -5.1 -9.2 13.4 20 22 A C E -b 62 0B 63 -2,-0.4 2,-0.8 41,-0.2 43,-0.2 -0.858 15.5-152.4 -91.8 125.6 -6.5 -6.7 10.8 21 23 A A E -b 63 0B 2 41,-2.8 43,-2.3 -2,-0.5 63,-0.1 -0.878 14.0-178.0-100.9 104.9 -9.9 -5.3 11.7 22 24 A E S S+ 0 0 136 -2,-0.8 44,-0.7 41,-0.1 2,-0.3 0.629 73.2 11.7 -74.9 -18.0 -11.7 -4.3 8.5 23 25 A D S > S- 0 0 61 42,-0.2 4,-1.7 -3,-0.1 5,-0.1 -0.935 86.2 -96.9-149.6 174.8 -14.6 -3.0 10.5 24 26 A E H > S+ 0 0 45 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.868 119.1 56.8 -64.3 -40.6 -15.6 -2.2 14.1 25 27 A Q H > S+ 0 0 141 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.912 108.8 48.4 -58.6 -42.2 -17.3 -5.5 14.8 26 28 A Q H > S+ 0 0 67 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.891 111.4 48.9 -64.8 -43.0 -14.0 -7.3 13.9 27 29 A L H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.922 114.1 46.4 -63.5 -45.6 -12.0 -5.0 16.1 28 30 A L H X S+ 0 0 23 -4,-2.9 4,-2.8 2,-0.2 -2,-0.2 0.938 113.7 47.5 -63.1 -47.5 -14.3 -5.5 19.0 29 31 A N H X S+ 0 0 82 -4,-2.8 4,-3.1 -5,-0.2 5,-0.2 0.950 112.5 49.8 -58.3 -49.7 -14.4 -9.3 18.5 30 32 A A H X S+ 0 0 20 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.924 113.2 46.5 -54.5 -49.0 -10.6 -9.4 18.2 31 33 A W H X S+ 0 0 46 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.887 113.3 49.4 -62.0 -42.3 -10.3 -7.4 21.4 32 34 A Q H X S+ 0 0 85 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.939 112.0 47.2 -62.5 -49.3 -12.9 -9.6 23.2 33 35 A Y H X S+ 0 0 162 -4,-3.1 4,-1.6 2,-0.2 6,-0.2 0.962 114.2 46.9 -59.3 -52.9 -11.2 -12.8 22.2 34 36 A A H <>S+ 0 0 2 -4,-2.5 5,-2.4 -5,-0.2 3,-0.3 0.913 113.4 46.3 -57.4 -49.1 -7.8 -11.6 23.2 35 37 A T H ><5S+ 0 0 53 -4,-2.4 3,-1.7 1,-0.2 -1,-0.2 0.845 108.1 57.5 -66.2 -30.2 -8.7 -10.2 26.6 36 38 A A H 3<5S+ 0 0 75 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.874 103.1 54.1 -66.2 -33.6 -10.8 -13.3 27.4 37 39 A E T 3<5S- 0 0 91 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.166 124.8-109.3 -84.9 20.1 -7.5 -15.3 26.9 38 40 A G T < 5S+ 0 0 49 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.586 75.7 138.7 63.7 12.8 -6.0 -12.9 29.5 39 41 A Q < - 0 0 28 -5,-2.4 -1,-0.2 -6,-0.2 19,-0.2 -0.610 54.4-119.5 -91.2 148.3 -3.9 -11.2 26.8 40 42 A P - 0 0 21 0, 0.0 19,-2.5 0, 0.0 2,-0.4 -0.410 27.5-142.9 -80.6 160.1 -3.2 -7.5 26.4 41 43 A V E -c 59 0B 16 17,-0.2 2,-0.4 289,-0.1 19,-0.2 -0.988 14.1-171.1-130.3 137.1 -4.4 -5.7 23.2 42 44 A L E -c 60 0B 23 17,-2.5 19,-3.3 -2,-0.4 2,-0.4 -0.991 11.0-152.1-127.4 130.6 -2.8 -3.0 21.2 43 45 A I E -c 61 0B 47 -2,-0.4 2,-0.3 17,-0.2 19,-0.2 -0.871 18.1-172.6-100.7 135.4 -4.6 -1.1 18.3 44 46 A L E -c 62 0B 11 17,-3.0 19,-3.5 -2,-0.4 -37,-0.1 -0.931 23.2-172.4-129.2 150.7 -2.3 0.3 15.6 45 47 A G S S- 0 0 6 -2,-0.3 -1,-0.2 17,-0.2 65,-0.1 0.613 88.9 -30.2 -96.6 -90.1 -3.0 2.5 12.6 46 48 A E S S- 0 0 51 65,-0.1 -38,-0.4 16,-0.1 64,-0.1 0.350 76.4-122.5-111.6 7.2 0.3 2.4 10.8 47 49 A G + 0 0 5 -40,-0.2 -39,-1.8 1,-0.1 -38,-0.6 0.862 69.5 135.8 54.5 34.7 2.6 2.0 13.8 48 50 A S S S+ 0 0 25 -41,-0.2 -1,-0.1 1,-0.2 -41,-0.1 0.367 71.1 41.9 -93.1 7.6 4.4 5.2 12.7 49 51 A N S S+ 0 0 36 275,-0.1 276,-3.2 276,-0.0 2,-0.3 0.121 98.2 89.3-136.9 21.0 4.5 6.5 16.3 50 52 A V E -d 325 0C 13 -3,-0.4 2,-0.5 274,-0.2 -41,-0.4 -0.919 50.6-160.2-127.4 148.7 5.5 3.4 18.3 51 53 A L E -d 326 0C 0 274,-3.0 276,-3.0 -2,-0.3 2,-0.5 -0.984 18.6-145.3-124.5 110.1 8.7 1.7 19.5 52 54 A F E -d 327 0C 0 -2,-0.5 276,-0.2 274,-0.2 3,-0.1 -0.711 10.5-167.9 -77.6 124.2 8.3 -1.9 20.4 53 55 A L - 0 0 30 274,-3.1 2,-0.3 -2,-0.5 275,-0.2 0.689 64.7 -28.3 -86.5 -17.2 10.7 -2.6 23.2 54 56 A E S S- 0 0 96 273,-0.7 -1,-0.2 274,-0.1 -41,-0.1 -0.944 97.5 -34.4-177.4-178.3 10.3 -6.4 23.1 55 57 A D - 0 0 87 -2,-0.3 2,-0.5 -42,-0.1 -40,-0.2 -0.342 60.2-126.8 -60.3 135.1 8.0 -9.2 22.1 56 58 A Y E -b 15 0B 4 -42,-2.8 -40,-0.9 2,-0.1 274,-0.2 -0.780 9.5-150.6 -88.5 124.8 4.4 -8.2 22.8 57 59 A R E S+ 0 0 127 272,-2.7 2,-0.1 -2,-0.5 273,-0.1 0.346 73.8 37.4 -80.0 10.2 2.6 -10.9 25.0 58 60 A G E S- 0 0 0 271,-0.2 -42,-1.4 -19,-0.2 -41,-1.3 -0.424 96.8 -52.3-134.8-150.8 -0.8 -10.2 23.5 59 61 A T E -bc 17 41B 7 -19,-2.5 -17,-2.5 -43,-0.2 2,-0.6 -0.803 32.4-156.0-104.5 136.2 -2.8 -9.3 20.4 60 62 A V E -bc 18 42B 0 -43,-2.3 -41,-2.9 -2,-0.4 2,-0.6 -0.956 10.2-158.3-112.0 118.3 -2.1 -6.3 18.0 61 63 A I E -bc 19 43B 0 -19,-3.3 -17,-3.0 -2,-0.6 2,-0.7 -0.906 7.3-148.1-102.3 119.7 -5.1 -5.2 16.0 62 64 A I E -bc 20 44B 0 -43,-3.2 -41,-2.8 -2,-0.6 2,-0.8 -0.828 20.0-135.1 -86.9 112.5 -4.3 -3.3 12.9 63 65 A N E +b 21 0B 8 -19,-3.5 -41,-0.1 -2,-0.7 50,-0.1 -0.637 40.3 157.5 -77.5 108.4 -7.1 -0.8 12.5 64 66 A R + 0 0 59 -43,-2.3 2,-0.9 -2,-0.8 -1,-0.1 -0.161 14.3 146.6-122.6 36.0 -8.2 -0.9 8.8 65 67 A I - 0 0 21 -42,-0.1 19,-2.8 20,-0.1 20,-0.5 -0.654 33.1-174.2 -75.8 105.1 -11.8 0.5 9.2 66 68 A K + 0 0 114 -2,-0.9 2,-0.2 -44,-0.7 17,-0.1 -0.668 24.3 93.6-110.6 162.0 -12.2 2.4 6.0 67 69 A G - 0 0 33 -2,-0.2 15,-3.1 15,-0.2 2,-0.4 -0.443 41.7-139.4 137.5 149.9 -14.7 4.7 4.3 68 70 A I E -F 81 0D 52 13,-0.2 2,-0.4 -2,-0.2 13,-0.2 -0.993 12.1-170.8-138.0 139.2 -15.3 8.4 4.0 69 71 A E E -F 80 0D 123 11,-1.1 11,-2.4 -2,-0.4 2,-0.5 -0.999 9.6-153.0-129.9 138.4 -18.6 10.3 4.1 70 72 A I E -F 79 0D 70 -2,-0.4 2,-0.5 9,-0.2 9,-0.2 -0.954 9.1-172.2-116.4 123.8 -19.0 13.9 3.2 71 73 A H E -F 78 0D 108 7,-3.1 7,-2.9 -2,-0.5 2,-0.4 -0.971 18.2-139.2-112.6 129.2 -21.9 15.8 4.8 72 74 A D E +F 77 0D 87 -2,-0.5 5,-0.2 5,-0.2 -2,-0.0 -0.770 21.8 176.9 -96.6 134.4 -22.5 19.3 3.4 73 75 A E E > -F 76 0D 66 3,-2.0 3,-0.5 -2,-0.4 107,-0.1 -0.933 43.7-110.7-125.7 151.9 -23.4 22.3 5.6 74 76 A P T 3 S+ 0 0 110 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.827 117.9 36.8 -51.0 -33.5 -23.8 25.8 4.2 75 77 A D T 3 S- 0 0 71 1,-0.2 105,-2.4 105,-0.1 106,-0.6 0.624 125.2 -2.8 -95.8 -19.1 -20.6 26.9 6.0 76 78 A A E < -FG 73 179D 0 -3,-0.5 -3,-2.0 103,-0.3 2,-0.5 -0.994 64.8 -98.1-166.8 169.7 -18.3 23.8 5.7 77 79 A W E -FG 72 178D 69 101,-3.2 101,-3.0 -2,-0.3 2,-0.6 -0.835 31.1-155.3 -99.8 131.1 -17.7 20.3 4.7 78 80 A Y E -FG 71 177D 62 -7,-2.9 -7,-3.1 -2,-0.5 2,-0.5 -0.945 8.9-164.4-111.3 122.0 -18.0 17.6 7.3 79 81 A L E -FG 70 176D 0 97,-3.1 97,-2.5 -2,-0.6 2,-0.7 -0.909 12.2-162.6-109.4 131.0 -16.1 14.5 6.8 80 82 A H E -FG 69 175D 45 -11,-2.4 -11,-1.1 -2,-0.5 2,-0.4 -0.927 24.5-171.0-111.2 101.1 -16.7 11.3 8.7 81 83 A V E -FG 68 174D 0 93,-3.2 93,-2.7 -2,-0.7 -13,-0.2 -0.826 23.7-118.0-104.7 129.9 -13.5 9.3 8.1 82 84 A G E > - G 0 173D 8 -15,-3.1 3,-2.2 -2,-0.4 30,-0.3 -0.367 26.0-121.7 -60.6 140.7 -12.9 5.7 9.0 83 85 A A T 3 S+ 0 0 1 89,-3.1 30,-2.7 1,-0.3 31,-0.4 0.776 110.3 58.0 -54.2 -29.7 -10.1 5.2 11.5 84 86 A G T 3 S+ 0 0 2 -19,-2.8 -1,-0.3 88,-0.3 -18,-0.2 0.427 77.0 115.3 -83.8 -2.5 -8.3 3.0 9.1 85 87 A E S < S- 0 0 43 -3,-2.2 27,-2.5 -20,-0.5 2,-0.5 -0.421 75.5-110.9 -67.8 143.7 -8.1 5.6 6.3 86 88 A N B > -K 111 0E 16 25,-0.2 4,-2.2 1,-0.1 25,-0.2 -0.656 22.9-141.7 -78.0 127.4 -4.5 6.7 5.4 87 89 A W H > S+ 0 0 2 23,-2.7 4,-2.5 -2,-0.5 5,-0.2 0.936 96.1 46.6 -56.1 -55.4 -4.0 10.3 6.5 88 90 A H H > S+ 0 0 34 20,-0.5 4,-2.6 22,-0.4 -1,-0.2 0.882 112.4 51.6 -56.6 -41.0 -1.9 11.5 3.6 89 91 A R H > S+ 0 0 153 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.910 108.8 51.9 -63.5 -37.6 -4.2 9.9 1.1 90 92 A L H X S+ 0 0 4 -4,-2.2 4,-3.3 2,-0.2 -2,-0.2 0.932 108.6 50.5 -63.3 -46.0 -7.1 11.6 2.8 91 93 A V H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.945 113.1 44.9 -56.8 -50.9 -5.3 15.0 2.5 92 94 A K H X S+ 0 0 114 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.904 114.0 52.1 -60.2 -38.3 -4.7 14.5 -1.2 93 95 A Y H X S+ 0 0 80 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.948 108.9 47.9 -61.9 -51.6 -8.3 13.3 -1.6 94 96 A T H <>S+ 0 0 0 -4,-3.3 5,-2.9 2,-0.2 -1,-0.2 0.899 114.1 46.9 -57.6 -45.3 -9.7 16.3 0.1 95 97 A L H ><5S+ 0 0 20 -4,-2.4 3,-2.3 3,-0.2 -1,-0.2 0.945 110.3 53.3 -62.5 -45.0 -7.6 18.6 -2.0 96 98 A Q H 3<5S+ 0 0 146 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.874 108.7 50.0 -56.8 -41.0 -8.5 16.7 -5.2 97 99 A E T 3<5S- 0 0 92 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.306 122.1-107.1 -81.3 7.4 -12.2 17.1 -4.3 98 100 A G T < 5S+ 0 0 51 -3,-2.3 -3,-0.2 -5,-0.1 -2,-0.1 0.882 82.7 125.8 69.6 37.8 -11.8 20.9 -3.8 99 101 A M < - 0 0 7 -5,-2.9 3,-0.3 -6,-0.1 -1,-0.1 -0.627 38.6-179.7-126.4 69.3 -12.1 20.7 0.0 100 102 A P + 0 0 21 0, 0.0 102,-0.0 0, 0.0 -9,-0.0 -0.202 42.0 95.0 -69.2 163.1 -8.9 22.4 1.3 101 103 A G S S+ 0 0 15 77,-0.1 3,-0.2 81,-0.1 76,-0.1 0.058 77.6 68.3 139.0 -17.3 -8.0 22.9 4.9 102 104 A L > + 0 0 0 -3,-0.3 3,-2.0 -11,-0.2 -11,-0.1 0.480 64.3 102.9-106.4 -2.7 -5.8 19.8 5.5 103 105 A E G > S+ 0 0 2 1,-0.3 3,-1.7 2,-0.2 -1,-0.1 0.803 74.4 59.0 -53.3 -34.4 -2.8 20.8 3.3 104 106 A N G 3 S+ 0 0 0 1,-0.3 -1,-0.3 -3,-0.2 21,-0.2 0.733 104.3 54.0 -68.8 -19.5 -0.5 21.9 6.2 105 107 A L G X S+ 0 0 0 -3,-2.0 3,-1.2 19,-0.1 -1,-0.3 0.152 83.6 139.2 -99.7 17.6 -0.8 18.3 7.5 106 108 A A T < + 0 0 0 -3,-1.7 -18,-0.1 1,-0.2 -17,-0.1 -0.241 64.0 13.5 -63.9 146.6 0.2 16.8 4.2 107 109 A L T 3 S+ 0 0 56 1,-0.2 -1,-0.2 -19,-0.1 -19,-0.1 0.396 80.9 143.1 70.1 1.2 2.6 13.8 4.2 108 110 A I < - 0 0 18 -3,-1.2 -20,-0.5 1,-0.1 -1,-0.2 -0.580 49.4-128.5 -72.2 122.1 2.2 13.0 7.9 109 111 A P + 0 0 59 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.177 59.0 58.3 -66.6 169.0 2.2 9.2 8.1 110 112 A G S S- 0 0 4 -64,-0.1 -23,-2.7 -65,-0.1 -22,-0.4 -0.331 81.1 -58.9 105.2 172.6 -0.4 7.2 9.9 111 113 A C B >> -K 86 0E 4 -25,-0.2 3,-0.9 -24,-0.1 4,-0.8 -0.606 40.7-117.7 -93.4 157.5 -4.1 6.5 9.9 112 114 A V G >4 S+ 0 0 0 -27,-2.5 3,-1.1 -30,-0.3 -29,-0.2 0.902 113.3 63.4 -61.1 -37.0 -6.9 9.0 10.5 113 115 A G G 34 S+ 0 0 5 -30,-2.7 4,-0.4 -28,-0.3 -1,-0.2 0.804 104.2 47.1 -59.9 -28.1 -7.9 7.1 13.6 114 116 A S G <> S+ 0 0 45 -3,-0.9 4,-0.9 -31,-0.4 3,-0.4 0.694 89.6 87.7 -88.0 -15.5 -4.6 7.9 15.2 115 117 A S T <<>S+ 0 0 3 -3,-1.1 5,-2.1 -4,-0.8 12,-0.2 0.776 88.7 45.2 -55.7 -36.7 -4.6 11.6 14.2 116 118 A P T >45S+ 0 0 0 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.863 97.6 75.9 -77.4 -30.2 -6.5 12.9 17.3 117 119 A I T 345S+ 0 0 40 -3,-0.4 45,-0.2 -4,-0.4 -2,-0.2 0.856 116.2 14.4 -47.1 -53.1 -4.4 10.8 19.7 118 120 A Q T 3<5S- 0 0 12 -4,-0.9 39,-0.4 40,-0.1 -1,-0.3 0.023 107.3-115.7-113.6 27.3 -1.3 13.1 19.6 119 121 A N T < 5 - 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