==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 31-JAN-13 3W5M . COMPND 2 MOLECULE: PUTATIVE RHAMNOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES AVERMITILIS; . AUTHOR Z.FUJIMOTO,A.JACKSON,M.MICHIKAWA,T.MAEHARA,M.MOMMA,B.F.HENRI . 1030 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38444.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 666 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 280 27.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 78 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 93 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 151 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 2 1 0 1 0 2 1 0 0 1 3 0 1 0 1 0 1 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 16 10 4 7 6 4 3 3 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 0 1 1 4 2 0 0 1 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 A 0 0 114 0, 0.0 31,-0.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 171.5 29.4 55.2 20.0 2 4 A L - 0 0 7 29,-0.1 97,-0.4 94,-0.1 2,-0.3 -0.758 360.0-173.6 -92.8 134.7 27.5 51.9 20.5 3 5 A R E -A 30 0A 150 27,-2.0 27,-2.5 -2,-0.4 2,-0.4 -0.991 24.5-120.6-132.7 148.4 26.7 49.7 17.4 4 6 A V E -A 29 0A 20 -2,-0.3 2,-0.4 95,-0.3 98,-0.3 -0.678 31.0-172.4 -85.4 131.6 24.6 46.5 17.0 5 7 A T - 0 0 42 23,-2.7 96,-0.0 -2,-0.4 -2,-0.0 -0.988 58.8 -5.3-125.6 135.1 26.6 43.6 15.5 6 8 A S S S- 0 0 75 -2,-0.4 -1,-0.2 1,-0.1 23,-0.0 0.922 72.5-161.2 56.9 56.5 25.2 40.2 14.3 7 9 A P - 0 0 13 0, 0.0 2,-0.3 0, 0.0 20,-0.2 -0.365 12.8-166.7 -69.4 152.7 21.6 40.5 15.4 8 10 A S E -B 26 0B 20 18,-2.2 18,-2.4 5,-0.1 2,-0.4 -0.918 22.7-144.7-140.4 163.4 19.8 37.1 15.6 9 11 A V E > S-BC 25 12B 1 3,-2.9 3,-1.7 -2,-0.3 16,-0.2 -0.997 88.7 -10.3-130.8 123.9 16.4 35.5 15.9 10 12 A E T 3 S- 0 0 27 14,-3.0 -1,-0.1 -2,-0.4 15,-0.1 0.914 131.7 -52.8 47.9 49.6 16.1 32.3 18.0 11 13 A Y T 3 S+ 0 0 24 13,-0.4 2,-0.3 1,-0.1 -1,-0.3 0.397 122.1 86.3 75.1 -0.3 19.9 32.0 18.2 12 14 A V B < S-C 9 0B 33 -3,-1.7 -3,-2.9 3,-0.0 2,-0.5 -0.938 76.9-114.7-133.3 158.1 20.5 32.2 14.5 13 15 A Q S S- 0 0 83 -2,-0.3 -5,-0.1 1,-0.2 93,-0.1 -0.748 95.3 -11.2 -86.3 126.4 21.1 34.8 11.7 14 16 A R S S- 0 0 119 -2,-0.5 -1,-0.2 91,-0.3 92,-0.2 0.907 78.6-157.8 56.1 54.8 18.2 34.8 9.2 15 17 A P - 0 0 16 0, 0.0 92,-2.2 0, 0.0 2,-0.6 -0.451 2.9-149.6 -67.3 135.4 16.3 31.6 10.1 16 18 A L E S+e 107 0C 51 1,-0.2 340,-0.3 90,-0.2 92,-0.1 -0.935 76.9 15.8-108.0 115.8 14.3 30.3 7.2 17 19 A G E S+ 0 0 10 90,-2.2 2,-0.5 -2,-0.6 91,-0.3 0.901 77.6 167.5 91.7 50.0 11.1 28.5 8.2 18 20 A L E -e 108 0C 30 89,-2.6 91,-0.6 -3,-0.3 -1,-0.2 -0.871 18.4-172.2-102.7 123.5 10.7 29.5 11.9 19 21 A D + 0 0 39 -2,-0.5 -1,-0.1 89,-0.2 89,-0.1 0.480 38.4 127.9 -98.0 -1.8 7.3 28.7 13.5 20 22 A A - 0 0 33 1,-0.2 -2,-0.1 2,-0.1 58,-0.1 -0.255 51.6-148.6 -54.9 131.7 7.7 30.6 16.8 21 23 A A S S+ 0 0 57 1,-0.3 57,-0.4 56,-0.1 -1,-0.2 0.835 98.4 27.3 -67.8 -34.6 4.7 32.9 17.5 22 24 A H S S- 0 0 106 55,-0.1 -1,-0.3 52,-0.1 -2,-0.1 -0.627 87.3-159.4-128.2 73.1 7.0 35.3 19.4 23 25 A P - 0 0 0 0, 0.0 50,-2.5 0, 0.0 2,-0.5 -0.256 20.9-120.9 -58.0 140.6 10.5 34.8 18.0 24 26 A R E - D 0 72B 12 48,-0.2 -14,-3.0 46,-0.0 -13,-0.4 -0.744 25.9-153.2 -94.7 125.1 13.2 36.0 20.4 25 27 A L E -BD 9 71B 1 46,-3.4 46,-3.2 -2,-0.5 2,-0.4 -0.677 9.7-169.2-102.2 143.6 15.5 38.7 19.1 26 28 A S E -B 8 0B 4 -18,-2.4 -18,-2.2 -2,-0.3 43,-0.2 -0.990 9.4-170.7-134.4 143.7 19.1 39.4 20.2 27 29 A W - 0 0 0 41,-3.0 -21,-0.1 -2,-0.4 935,-0.0 -0.688 6.8-163.5-136.4 83.6 21.5 42.3 19.6 28 30 A P - 0 0 17 0, 0.0 -23,-2.7 0, 0.0 2,-0.3 -0.353 21.3-150.8 -54.6 143.2 25.1 41.9 20.6 29 31 A M E -A 4 0A 8 933,-0.7 2,-0.4 955,-0.4 -25,-0.2 -0.888 9.7-154.2-121.3 155.7 26.7 45.4 20.7 30 32 A A E +A 3 0A 27 -27,-2.5 -27,-2.0 -2,-0.3 2,-0.3 -0.973 16.0 167.4-128.4 143.5 30.2 46.6 20.1 31 33 A S - 0 0 24 -2,-0.4 -29,-0.1 -29,-0.2 5,-0.1 -0.924 33.1-150.4-155.0 132.8 32.0 49.7 21.4 32 34 A A S S+ 0 0 115 -31,-0.4 991,-0.3 -2,-0.3 -1,-0.1 0.729 84.6 80.4 -70.1 -23.6 35.6 50.8 21.5 33 35 A A S S- 0 0 42 -32,-0.2 3,-0.3 989,-0.1 988,-0.1 -0.687 83.3-123.3 -85.5 138.0 34.8 52.8 24.7 34 36 A P S S+ 0 0 59 0, 0.0 988,-0.3 0, 0.0 -1,-0.1 -0.217 80.1 36.0 -73.0 163.9 34.6 51.0 28.1 35 37 A G S S+ 0 0 47 986,-2.5 2,-0.3 1,-0.2 987,-0.1 0.726 71.8 164.4 74.1 32.8 31.7 50.8 30.6 36 38 A R + 0 0 35 -3,-0.3 949,-3.0 -5,-0.1 950,-0.4 -0.643 10.0 174.1 -92.4 135.8 28.7 50.7 28.2 37 39 A R - 0 0 133 -2,-0.3 56,-0.9 947,-0.2 2,-0.4 -0.966 30.4-118.1-132.8 151.4 25.2 49.8 29.2 38 40 A Q E +F 92 0C 1 -2,-0.3 54,-0.2 28,-0.2 3,-0.1 -0.776 26.1 175.0 -89.4 131.3 21.9 49.8 27.4 39 41 A S E + 0 0 40 52,-3.1 26,-1.5 -2,-0.4 2,-0.3 0.684 68.7 1.5 -99.8 -29.4 19.1 52.0 28.8 40 42 A A E -FG 91 64C 2 51,-1.3 51,-2.1 24,-0.3 -1,-0.3 -0.982 56.9-161.8-153.7 161.1 16.5 51.5 26.0 41 43 A Y E -FG 90 63C 24 22,-2.2 22,-3.5 -2,-0.3 2,-0.3 -0.955 4.3-158.1-140.5 164.3 15.8 49.7 22.7 42 44 A Q E -F 89 0C 13 47,-2.1 47,-1.5 -2,-0.3 2,-0.4 -0.940 8.3-164.4-145.0 125.6 13.5 50.0 19.8 43 45 A V E -F 88 0C 1 18,-0.4 17,-2.6 -2,-0.3 2,-0.4 -0.882 2.9-170.4-110.2 135.5 12.6 47.3 17.4 44 46 A R E -FH 87 59C 45 43,-2.5 43,-1.8 -2,-0.4 2,-0.4 -0.978 0.4-171.0-121.6 143.6 10.9 47.7 14.0 45 47 A V E +FH 86 58C 0 13,-2.7 13,-2.4 -2,-0.4 12,-1.6 -0.994 14.3 163.0-132.4 136.4 9.5 45.0 11.8 46 48 A A E -F 85 0C 0 39,-2.3 39,-2.9 -2,-0.4 6,-0.1 -0.926 49.3-108.6-149.7 167.1 8.3 45.4 8.2 47 49 A S S S+ 0 0 70 -2,-0.3 2,-0.3 37,-0.2 36,-0.1 0.532 102.6 25.2 -82.8 -4.9 7.5 43.5 5.0 48 50 A S S S- 0 0 47 37,-0.1 4,-0.2 1,-0.1 37,-0.1 -0.979 78.7-115.9-151.5 161.7 10.6 44.8 3.3 49 51 A A S > S+ 0 0 43 -2,-0.3 3,-1.3 1,-0.2 4,-0.2 0.926 118.4 45.1 -64.3 -46.1 14.1 46.1 4.2 50 52 A A G > S+ 0 0 87 1,-0.2 3,-1.2 2,-0.1 4,-0.3 0.849 103.3 67.7 -65.3 -34.7 13.3 49.6 2.7 51 53 A G G > S+ 0 0 20 1,-0.2 3,-0.9 2,-0.1 -1,-0.2 0.541 74.1 90.1 -62.3 -8.2 10.0 49.6 4.5 52 54 A L G < S+ 0 0 12 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.1 0.764 77.3 61.5 -65.4 -25.2 11.6 49.7 7.9 53 55 A S G < S+ 0 0 70 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.784 121.1 25.9 -69.8 -27.8 11.6 53.6 8.0 54 56 A H S < S- 0 0 162 -3,-0.9 -1,-0.3 -4,-0.3 2,-0.1 -0.687 97.8-156.6-128.9 76.4 7.8 53.4 7.8 55 57 A P - 0 0 33 0, 0.0 -9,-0.2 0, 0.0 -3,-0.1 -0.355 18.0-172.6 -69.4 128.9 7.2 49.9 9.4 56 58 A D S S+ 0 0 102 -2,-0.1 -10,-0.2 -5,-0.1 3,-0.1 0.484 80.2 41.9 -96.7 -7.1 4.0 48.1 8.5 57 59 A V S S- 0 0 32 -12,-1.6 2,-0.3 1,-0.3 -11,-0.2 0.836 119.8 -17.4-103.1 -59.1 4.3 45.2 10.9 58 60 A W E -H 45 0C 44 -13,-2.4 -13,-2.7 17,-0.1 -1,-0.3 -0.999 38.1-178.2-152.0 147.8 5.6 46.4 14.3 59 61 A D E -H 44 0C 62 -2,-0.3 -15,-0.2 -15,-0.2 3,-0.1 -0.850 9.6-166.7-142.7 109.6 7.3 49.3 16.0 60 62 A S - 0 0 29 -17,-2.6 -16,-0.1 -2,-0.3 -19,-0.1 0.674 32.4-144.1 -64.1 -16.9 7.9 48.7 19.7 61 63 A G - 0 0 25 -18,-0.4 2,-0.5 2,-0.1 -18,-0.4 -0.109 52.6 -31.5 61.1-176.8 8.7 52.4 20.1 62 64 A K - 0 0 117 -20,-0.1 2,-0.5 -3,-0.1 -20,-0.2 -0.567 69.3-163.4 -73.4 116.1 11.5 53.3 22.6 63 65 A V E -G 41 0C 44 -22,-3.5 -22,-2.2 -2,-0.5 2,-0.7 -0.904 16.4-134.9-109.4 123.0 11.4 50.7 25.4 64 66 A V E +G 40 0C 129 -2,-0.5 2,-0.3 -24,-0.2 -24,-0.3 -0.668 59.7 111.5 -79.7 110.6 13.1 51.5 28.7 65 67 A S - 0 0 25 -26,-1.5 -2,-0.1 -2,-0.7 0, 0.0 -0.936 64.5-138.1-174.6 147.0 15.0 48.2 29.5 66 68 A D + 0 0 71 -2,-0.3 2,-0.4 -26,-0.0 -28,-0.2 0.209 66.7 123.1 -98.6 12.7 18.5 46.9 29.7 67 69 A D + 0 0 84 1,-0.1 3,-0.1 -28,-0.1 -2,-0.1 -0.607 19.7 152.9 -76.2 127.5 17.4 43.6 27.9 68 70 A S + 0 0 1 -2,-0.4 -41,-3.0 1,-0.2 2,-0.4 0.364 53.1 69.3-133.6 2.3 19.4 42.9 24.8 69 71 A V S S- 0 0 26 -43,-0.2 -43,-0.2 1,-0.2 -1,-0.2 -0.988 107.1 -5.3-132.8 129.2 19.2 39.1 24.5 70 72 A L S S+ 0 0 19 -2,-0.4 -44,-0.2 1,-0.2 -1,-0.2 0.871 74.2 172.5 59.4 43.8 16.2 36.9 23.7 71 73 A V E -D 25 0B 10 -46,-3.2 -46,-3.4 -3,-0.1 -1,-0.2 -0.738 31.9-122.9 -82.5 119.1 13.7 39.7 23.6 72 74 A P E -D 24 0B 70 0, 0.0 -48,-0.2 0, 0.0 -1,-0.0 -0.437 19.4-110.3 -71.3 133.2 10.4 38.3 22.4 73 75 A Y - 0 0 2 -50,-2.5 -49,-0.0 -2,-0.2 -15,-0.0 -0.366 37.4-179.8 -45.6 129.4 8.6 39.7 19.4 74 76 A A + 0 0 69 -3,-0.1 -1,-0.1 3,-0.0 -52,-0.1 -0.033 38.9 103.4-135.5 34.9 5.5 41.4 20.7 75 77 A G S S- 0 0 18 1,-0.2 3,-0.1 -17,-0.1 -17,-0.1 -0.148 81.5 -40.8 -95.0-161.7 3.8 42.9 17.7 76 78 A P S S- 0 0 69 0, 0.0 -1,-0.2 0, 0.0 -19,-0.0 -0.180 83.2 -72.5 -63.0 153.0 0.7 41.7 15.8 77 79 A P - 0 0 123 0, 0.0 2,-0.1 0, 0.0 -55,-0.1 -0.194 54.4-119.9 -51.5 133.0 0.2 37.9 15.1 78 80 A L - 0 0 20 -57,-0.4 6,-0.0 -3,-0.1 -56,-0.0 -0.455 21.3-135.7 -74.1 147.2 2.7 36.6 12.5 79 81 A K > - 0 0 123 -2,-0.1 3,-0.6 1,-0.1 29,-0.2 -0.696 26.0 -99.5 -97.9 154.7 1.4 35.0 9.3 80 82 A P T 3 S+ 0 0 42 0, 0.0 30,-0.2 0, 0.0 29,-0.1 -0.273 98.9 17.7 -68.7 157.5 2.7 31.8 7.7 81 83 A R T 3 S+ 0 0 45 28,-2.6 2,-0.4 1,-0.2 28,-0.1 0.778 94.9 135.3 55.4 32.9 5.2 31.7 4.8 82 84 A T < - 0 0 25 -3,-0.6 26,-2.5 27,-0.3 2,-0.5 -0.947 52.6-139.2-122.4 133.3 6.2 35.3 5.4 83 85 A R E - I 0 107C 61 -2,-0.4 2,-0.5 24,-0.3 24,-0.3 -0.755 20.2-162.0 -85.1 124.6 9.5 37.0 5.4 84 86 A Y E - I 0 106C 10 22,-3.5 22,-2.1 -2,-0.5 2,-0.3 -0.947 3.2-153.9-110.4 121.5 9.8 39.6 8.2 85 87 A F E -FI 46 105C 41 -39,-2.9 -39,-2.3 -2,-0.5 2,-0.3 -0.671 20.0-179.5 -92.7 142.8 12.5 42.3 8.0 86 88 A W E +FI 45 104C 1 18,-2.4 18,-2.7 -2,-0.3 2,-0.3 -0.989 18.0 179.1-146.0 160.6 13.7 43.8 11.2 87 89 A S E -F 44 0C 5 -43,-1.8 -43,-2.5 -2,-0.3 2,-0.3 -0.975 9.5-161.9-154.3 149.1 16.1 46.3 12.7 88 90 A V E -F 43 0C 0 -2,-0.3 13,-2.8 -45,-0.2 2,-0.3 -0.961 4.9-173.7-135.3 154.2 16.9 47.5 16.2 89 91 A R E -F 42 0C 65 -47,-1.5 -47,-2.1 -2,-0.3 2,-0.3 -0.956 11.8-157.7-140.5 156.2 18.6 50.5 17.7 90 92 A V E -F 41 0C 1 9,-0.3 8,-2.3 -2,-0.3 2,-0.5 -0.899 14.3-130.4-133.4 164.1 19.5 51.2 21.3 91 93 A W E -FJ 40 97C 22 -51,-2.1 -52,-3.1 -2,-0.3 -51,-1.3 -0.967 24.3-137.3-114.2 127.3 20.3 54.0 23.7 92 94 A D E -F 38 0C 14 4,-2.2 3,-0.5 -2,-0.5 -54,-0.2 -0.121 42.8 -83.1 -70.0 179.2 23.4 53.9 25.9 93 95 A A S S+ 0 0 43 -56,-0.9 -55,-0.1 1,-0.2 -1,-0.1 0.601 130.5 52.5 -66.7 -11.1 23.3 54.9 29.6 94 96 A D S S- 0 0 155 2,-0.1 -1,-0.2 0, 0.0 -3,-0.0 0.798 120.6-103.4 -89.8 -34.1 23.7 58.6 28.6 95 97 A G S S+ 0 0 37 -3,-0.5 2,-0.3 1,-0.3 -2,-0.1 0.363 71.8 140.1 125.1 2.5 20.8 58.7 26.1 96 98 A G - 0 0 35 1,-0.0 -4,-2.2 -5,-0.0 -1,-0.3 -0.624 44.2-136.1 -78.4 133.0 22.7 58.5 22.8 97 99 A A B -J 91 0C 48 -2,-0.3 -6,-0.2 -6,-0.2 2,-0.1 -0.548 11.0-133.1 -89.5 149.9 21.1 56.3 20.1 98 100 A S - 0 0 10 -8,-2.3 -95,-0.1 -2,-0.2 -1,-0.1 -0.343 36.0 -84.0 -85.6 175.2 23.0 53.9 17.9 99 101 A E - 0 0 156 -97,-0.4 -9,-0.3 1,-0.1 2,-0.3 -0.343 57.7 -93.1 -59.9 159.9 22.6 53.5 14.1 100 102 A W - 0 0 72 -11,-0.1 -11,-0.2 1,-0.1 -1,-0.1 -0.639 52.6-102.2 -70.5 140.3 19.7 51.2 13.2 101 103 A S - 0 0 7 -13,-2.8 3,-0.1 -2,-0.3 -1,-0.1 -0.353 47.4 -86.8 -63.2 149.1 21.2 47.8 12.8 102 104 A A - 0 0 81 -98,-0.3 -1,-0.1 1,-0.1 -14,-0.1 -0.374 64.8 -90.5 -52.8 129.5 21.7 46.8 9.2 103 105 A P + 0 0 77 0, 0.0 2,-0.2 0, 0.0 -16,-0.2 -0.114 54.9 176.5 -50.7 139.8 18.3 45.3 8.3 104 106 A S E - I 0 86C 9 -18,-2.7 -18,-2.4 -3,-0.1 2,-0.3 -0.700 9.5-150.1-130.5-174.3 18.0 41.5 8.8 105 107 A W E - I 0 85C 47 -20,-0.3 2,-0.3 -2,-0.2 -91,-0.3 -0.993 14.9-160.9-154.6 157.5 15.1 39.1 8.5 106 108 A W E - I 0 84C 0 -22,-2.1 -22,-3.5 -2,-0.3 2,-0.4 -0.953 18.5-146.7-130.3 158.1 13.4 35.9 9.6 107 109 A E E -eI 16 83C 0 -92,-2.2 -89,-2.6 -2,-0.3 -90,-2.2 -0.988 12.0-133.4-127.2 128.2 10.9 33.9 7.6 108 110 A T E -e 18 0C 0 -26,-2.5 -89,-0.2 -2,-0.4 2,-0.0 -0.392 16.6-143.3 -72.5 151.5 8.0 31.9 9.0 109 111 A G - 0 0 0 -91,-0.6 -28,-2.6 -28,-0.1 -27,-0.3 0.092 51.0 -60.1 -87.3-148.0 7.2 28.4 7.9 110 112 A L - 0 0 0 -30,-0.2 5,-0.1 -93,-0.1 -2,-0.1 0.674 59.3-153.6 -77.7 -18.9 3.8 26.8 7.5 111 113 A M + 0 0 41 -32,-0.1 3,-0.1 3,-0.1 2,-0.1 0.891 61.7 13.3 47.3 55.9 2.8 27.4 11.2 112 114 A G S > S- 0 0 28 358,-0.3 3,-1.9 1,-0.1 4,-0.2 -0.156 83.5 -92.2 126.0 146.1 0.4 24.5 11.5 113 115 A A G > S+ 0 0 69 1,-0.3 3,-1.9 2,-0.2 -1,-0.1 0.775 112.5 68.2 -54.2 -34.6 -1.0 21.3 10.0 114 116 A S G 3 S+ 0 0 104 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.667 89.3 65.1 -67.3 -14.5 -3.8 23.1 8.1 115 117 A Q G < S+ 0 0 43 -3,-1.9 2,-0.4 -5,-0.1 -1,-0.3 0.547 87.2 85.4 -87.5 -5.1 -1.2 24.8 5.8 116 118 A W < + 0 0 29 -3,-1.9 284,-0.0 -4,-0.2 0, 0.0 -0.791 39.7 166.2 -92.0 133.0 -0.2 21.4 4.3 117 119 A S + 0 0 53 -2,-0.4 -1,-0.1 2,-0.1 297,-0.1 0.379 46.3 112.2-115.8 -3.3 -2.1 20.0 1.5 118 120 A A - 0 0 14 295,-0.1 2,-0.4 1,-0.1 298,-0.2 -0.220 60.7-134.1 -61.1 155.4 0.6 17.4 0.6 119 121 A K - 0 0 132 296,-2.4 280,-0.4 280,-0.2 2,-0.3 -0.917 20.3-108.5-112.1 145.3 -0.2 13.6 1.2 120 122 A W - 0 0 37 -2,-0.4 342,-1.4 278,-0.1 2,-0.3 -0.534 43.9-173.1 -66.9 128.7 2.1 11.1 2.8 121 123 A I E -KL 397 461D 2 276,-2.4 276,-3.1 -2,-0.3 2,-0.3 -0.953 12.9-174.8-129.4 153.3 3.5 8.7 0.2 122 124 A S E - L 0 460D 1 338,-2.4 338,-2.5 -2,-0.3 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29.9 23.0 60.4 826 828 A L G <> S+ 0 0 34 -3,-2.2 4,-2.5 1,-0.1 -1,-0.2 0.299 82.0 96.4-114.9 5.9 31.2 19.8 58.7 827 829 A R H <> S+ 0 0 43 -3,-1.2 4,-2.8 -4,-0.3 5,-0.2 0.921 85.9 51.8 -62.9 -44.1 32.2 21.0 55.2 828 830 A K H > S+ 0 0 155 -4,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.934 112.7 45.9 -54.4 -50.2 35.8 21.3 56.2 829 831 A A H > S+ 0 0 33 -4,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.900 113.2 49.0 -60.9 -45.3 35.9 17.8 57.6 830 832 A A H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.908 114.6 45.0 -63.6 -41.0 34.1 16.3 54.6 831 833 A A H X S+ 0 0 2 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.864 110.3 53.9 -70.8 -38.2 36.5 18.0 52.2 832 834 A D H X S+ 0 0 74 -4,-2.6 4,-1.7 -5,-0.2 -2,-0.2 0.897 109.1 50.1 -57.5 -44.7 39.5 17.0 54.3 833 835 A R H X S+ 0 0 69 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.803 107.8 53.5 -63.5 -35.0 38.3 13.4 54.0 834 836 A L H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.945 109.8 46.6 -65.0 -49.6 37.9 13.7 50.2 835 837 A V H X S+ 0 0 24 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.841 110.0 55.3 -59.5 -36.5 41.5 14.9 49.9 836 838 A A H X S+ 0 0 32 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.892 107.5 48.4 -65.4 -41.7 42.6 12.1 52.2 837 839 A L H X S+ 0 0 25 -4,-1.9 4,-0.8 2,-0.2 -2,-0.2 0.852 112.8 48.4 -67.0 -37.3 40.9 9.5 49.9 838 840 A I H ><>S+ 0 0 0 -4,-2.0 5,-1.8 2,-0.2 6,-1.0 0.926 111.7 48.9 -66.2 -48.8 42.6 11.0 46.8 839 841 A E H ><5S+ 0 0 114 -4,-2.7 3,-1.6 1,-0.2 -2,-0.2 0.911 108.0 55.8 -55.5 -44.5 46.0 11.1 48.5 840 842 A A H 3<5S+ 0 0 80 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.728 102.2 56.1 -62.1 -26.5 45.5 7.4 49.5 841 843 A K T <<5S- 0 0 93 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.049 128.6 -98.9 -92.6 24.6 44.9 6.5 45.9 842 844 A D T < 5S- 0 0 112 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.2 0.871 81.2 -51.1 56.8 42.6 48.3 8.0 45.0 843 845 A W S - 0 0 0 -98,-0.2 4,-2.4 -101,-0.1 -102,-0.2 0.067 52.9 -52.0 -92.5-152.7 32.3 7.5 38.0 849 851 A F T 4 S+ 0 0 3 -104,-2.6 -105,-0.1 1,-0.2 -103,-0.1 0.824 134.6 38.9 -56.4 -40.6 29.7 9.3 35.8 850 852 A L T 4 S+ 0 0 0 2,-0.1 4,-0.4 1,-0.1 -1,-0.2 0.836 119.8 43.3 -86.5 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