==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 30-AUG-12 4B8V . COMPND 2 MOLECULE: EXTRACELLULAR PROTEIN 6; . SOURCE 2 ORGANISM_SCIENTIFIC: PASSALORA FULVA; . AUTHOR R.SALEEM-BATCHA,A.SANCHEZ-VALLET,G.HANSEN,B.P.H.J.THOMMA,J.R . 189 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11037.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 57.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 10.6 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 . 0 0.0 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 . 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 . 16 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 15.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.1 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 1 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 2 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 . 4 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 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 7 A a 0 0 40 0, 0.0 56,-2.5 0, 0.0 55,-0.5 0.000 360.0 360.0 360.0 -26.2 14.0 42.9 10.9 2 8 A G + 0 0 45 53,-0.2 54,-1.8 54,-0.2 2,-0.1 0.949 360.0 178.9 61.4 47.3 12.1 46.0 9.9 3 9 A S - 0 0 43 52,-0.3 51,-0.2 53,-0.1 52,-0.2 -0.328 35.1-142.0 -75.2 161.2 9.2 44.9 12.0 4 10 A T S S- 0 0 104 49,-2.2 2,-0.3 1,-0.3 50,-0.1 0.466 80.5 -7.2-102.9 -6.5 6.0 46.9 12.3 5 11 A S E -A 53 0A 45 48,-0.7 48,-2.9 2,-0.0 2,-0.4 -0.930 64.0-122.0-173.0 161.7 5.4 46.0 16.0 6 12 A N E -A 52 0A 105 -2,-0.3 2,-0.4 46,-0.2 44,-0.0 -0.979 23.1-167.6-117.2 131.9 6.7 43.8 18.8 7 13 A I E -A 51 0A 66 44,-2.1 44,-3.3 -2,-0.4 2,-0.5 -0.919 20.7-133.8-110.8 140.7 4.5 41.3 20.6 8 14 A K E -A 50 0A 162 -2,-0.4 2,-0.4 42,-0.2 42,-0.2 -0.840 36.0-168.1 -86.6 128.5 5.4 39.4 23.8 9 15 A Y E -A 49 0A 29 40,-2.9 40,-2.6 -2,-0.5 2,-0.5 -0.960 20.0-134.4-127.3 142.7 4.4 35.9 23.1 10 16 A T E -A 48 0A 75 -2,-0.4 38,-0.2 38,-0.2 2,-0.2 -0.832 26.1-124.9-101.7 126.2 4.1 32.8 25.2 11 17 A V - 0 0 6 36,-2.8 35,-2.8 -2,-0.5 2,-0.2 -0.442 35.9-177.3 -74.4 130.2 5.6 29.5 23.9 12 18 A V > - 0 0 76 -2,-0.2 3,-2.2 33,-0.2 -1,-0.0 -0.683 36.9 -57.0-123.7 171.3 3.1 26.7 23.7 13 19 A K T 3 S+ 0 0 188 1,-0.3 -1,-0.1 -2,-0.2 0, 0.0 -0.235 121.3 19.1 -50.4 132.8 3.1 23.0 22.8 14 20 A G T 3 S+ 0 0 67 1,-0.3 -1,-0.3 -3,-0.1 5,-0.1 0.233 91.1 141.4 90.7 -10.4 4.3 22.3 19.3 15 21 A D < + 0 0 30 -3,-2.2 2,-0.3 4,-0.1 -1,-0.3 -0.332 19.8 166.6 -69.1 142.1 6.2 25.6 18.9 16 22 A T > - 0 0 71 -2,-0.1 4,-2.7 26,-0.1 5,-0.2 -0.922 51.1-107.9-131.8 168.1 9.6 26.0 17.2 17 23 A L H > S+ 0 0 5 23,-0.4 4,-2.6 -2,-0.3 5,-0.2 0.867 122.9 56.7 -64.5 -28.8 11.2 29.3 16.2 18 24 A T H > S+ 0 0 92 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.962 109.9 42.9 -64.7 -48.9 10.4 28.2 12.6 19 25 A S H > S+ 0 0 44 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.907 116.9 47.4 -65.7 -37.9 6.7 27.9 13.4 20 26 A I H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 6,-0.2 0.924 109.9 52.1 -63.7 -45.7 6.6 31.2 15.5 21 27 A A H <>S+ 0 0 4 -4,-2.6 5,-2.5 -5,-0.2 4,-0.5 0.876 112.1 47.4 -61.1 -35.9 8.5 33.1 12.8 22 28 A K H ><5S+ 0 0 173 -4,-1.9 3,-0.6 3,-0.2 -1,-0.2 0.914 110.4 50.7 -75.5 -42.5 5.9 31.9 10.2 23 29 A K H 3<5S+ 0 0 134 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.912 121.9 32.9 -57.5 -43.5 2.9 32.8 12.4 24 30 A F T 3<5S- 0 0 29 -4,-2.3 30,-2.9 -5,-0.1 -1,-0.2 0.345 106.0-120.3 -99.5 8.4 4.2 36.3 13.0 25 31 A K T < 5S+ 0 0 146 -3,-0.6 30,-2.7 -4,-0.5 -3,-0.2 0.918 72.4 130.1 49.4 48.3 6.0 36.9 9.7 26 32 A S < - 0 0 5 -5,-2.5 2,-0.4 -6,-0.2 -1,-0.1 -0.366 60.3-100.2-108.2-169.1 9.2 37.4 11.7 27 33 A G > - 0 0 0 25,-0.2 4,-2.0 -2,-0.1 33,-0.2 -0.975 14.8-134.3-120.9 140.6 12.7 35.9 11.3 28 34 A I H > S+ 0 0 15 -2,-0.4 4,-2.1 1,-0.2 32,-0.2 0.916 108.0 45.4 -48.1 -51.7 14.2 33.0 13.3 29 35 A b H > S+ 0 0 7 30,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.809 107.9 56.1 -75.7 -26.0 17.4 34.9 13.8 30 36 A N H > S+ 0 0 27 29,-0.8 4,-2.6 2,-0.2 -1,-0.2 0.894 108.3 48.4 -67.0 -39.2 15.8 38.1 14.7 31 37 A I H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.938 112.8 49.9 -67.0 -40.6 13.9 36.4 17.5 32 38 A V H <>S+ 0 0 20 -4,-2.1 5,-2.0 -5,-0.2 4,-0.5 0.932 113.5 45.3 -58.6 -48.3 17.2 34.8 18.6 33 39 A S H ><5S+ 0 0 88 -4,-2.6 3,-1.0 1,-0.2 -2,-0.2 0.936 113.6 46.6 -65.4 -48.9 19.0 38.1 18.6 34 40 A V H 3<5S+ 0 0 68 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.822 120.1 39.5 -66.5 -31.9 16.3 40.1 20.4 35 41 A N T 3<5S- 0 0 34 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.352 103.8-126.8 -98.0 2.5 15.8 37.5 23.1 36 42 A K T < 5 - 0 0 189 -3,-1.0 2,-0.4 -4,-0.5 -3,-0.2 0.907 40.1-178.6 49.4 47.5 19.5 36.6 23.5 37 43 A L < - 0 0 42 -5,-2.0 -1,-0.2 -6,-0.2 -2,-0.1 -0.660 23.7-154.3 -76.8 129.4 18.8 32.9 23.0 38 44 A A S S+ 0 0 111 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.1 0.741 84.2 30.6 -70.1 -27.9 21.9 30.7 23.2 39 45 A N > - 0 0 41 3,-0.3 3,-2.3 1,-0.1 -1,-0.2 -0.938 65.0-153.6-142.3 107.8 20.4 28.0 21.0 40 46 A P T 3 S+ 0 0 28 0, 0.0 -23,-0.4 0, 0.0 -1,-0.1 0.721 98.0 58.5 -56.4 -22.2 17.9 28.7 18.2 41 47 A N T 3 S+ 0 0 84 1,-0.1 2,-0.6 -25,-0.1 107,-0.1 0.579 95.5 76.4 -79.0 -10.2 16.6 25.1 18.6 42 48 A L < + 0 0 44 -3,-2.3 2,-0.4 -26,-0.1 -3,-0.3 -0.899 44.2 148.9-116.5 111.5 15.7 25.6 22.3 43 49 A I - 0 0 30 -2,-0.6 2,-0.3 -28,-0.2 3,-0.0 -0.994 39.4-129.3-134.8 134.6 12.6 27.5 23.5 44 50 A E > - 0 0 123 -2,-0.4 3,-2.3 1,-0.1 -33,-0.3 -0.672 24.5-104.9 -92.1 134.9 11.0 26.4 26.7 45 51 A L T 3 S+ 0 0 100 -2,-0.3 -33,-0.2 1,-0.3 3,-0.1 -0.318 108.7 18.8 -48.5 132.2 7.2 25.8 27.1 46 52 A G T 3 S+ 0 0 54 -35,-2.8 -1,-0.3 1,-0.3 -34,-0.1 0.290 93.0 133.9 83.7 -7.7 5.7 28.7 29.0 47 53 A A < - 0 0 37 -3,-2.3 -36,-2.8 -37,-0.1 2,-0.4 -0.359 53.9-126.8 -68.6 150.9 8.6 31.1 28.2 48 54 A T E -A 10 0A 86 -38,-0.2 2,-0.4 -3,-0.1 -38,-0.2 -0.875 27.1-172.6 -96.8 135.0 7.9 34.7 27.0 49 55 A L E -A 9 0A 7 -40,-2.6 -40,-2.9 -2,-0.4 2,-0.5 -0.986 24.8-129.3-126.7 142.5 9.6 35.8 23.8 50 56 A I E -A 8 0A 57 -2,-0.4 -42,-0.2 -42,-0.2 -15,-0.1 -0.783 31.1-165.1 -82.7 126.9 9.7 39.2 22.2 51 57 A I E -A 7 0A 0 -44,-3.3 -44,-2.1 -2,-0.5 2,-0.7 -0.946 18.4-141.7-121.8 115.7 8.7 38.7 18.6 52 58 A P E -A 6 0A 5 0, 0.0 3,-0.3 0, 0.0 -25,-0.2 -0.690 33.6-149.1 -72.1 116.5 9.3 41.4 15.9 53 59 A E E +A 5 0A 44 -48,-2.9 -49,-2.2 -2,-0.7 -48,-0.7 -0.582 59.9 6.8 -91.8 153.6 6.1 41.0 13.8 54 60 A N S S- 0 0 76 -30,-2.9 2,-0.3 -51,-0.2 -1,-0.2 0.940 80.4-165.1 44.9 62.6 5.5 41.5 10.1 55 61 A a - 0 0 18 -30,-2.7 -52,-0.3 -3,-0.3 -53,-0.2 -0.593 24.7-157.1 -79.6 136.6 9.2 42.1 9.2 56 62 A S S S+ 0 0 105 -54,-1.8 -54,-0.2 -55,-0.5 -1,-0.1 0.711 96.3 31.6 -78.4 -19.9 10.1 43.6 5.8 57 63 A N S S- 0 0 117 -56,-2.5 -1,-0.2 2,-0.0 2,-0.1 -0.572 81.0-177.9-140.7 65.8 13.6 42.0 6.1 58 64 A P - 0 0 58 0, 0.0 2,-0.6 0, 0.0 -31,-0.1 -0.464 15.9-149.0 -73.8 142.0 13.4 38.7 8.0 59 65 A D + 0 0 54 -2,-0.1 -30,-2.3 1,-0.1 -29,-0.8 -0.958 34.0 150.9-111.0 110.5 16.6 36.7 8.7 60 66 A N S S+ 0 0 66 -2,-0.6 -1,-0.1 -32,-0.2 6,-0.1 0.217 70.0 50.2-114.7 8.8 15.9 33.0 8.8 61 67 A K S > S+ 0 0 169 2,-0.1 3,-0.5 4,-0.1 5,-0.2 0.720 84.3 72.8-121.2 -32.5 19.4 31.9 7.7 62 68 A S T 3 S+ 0 0 93 1,-0.2 -2,-0.0 3,-0.1 3,-0.0 0.762 107.5 31.6 -69.7 -27.7 22.3 33.5 9.5 63 69 A b T 3 S+ 0 0 46 -4,-0.1 2,-0.3 -23,-0.0 -1,-0.2 0.451 114.0 58.5-110.6 -5.2 22.1 31.7 12.8 64 70 A V < - 0 0 40 -3,-0.5 2,-0.9 -24,-0.1 -35,-0.0 -0.943 69.8-133.4-130.3 145.5 20.7 28.3 11.8 65 71 A S - 0 0 112 -2,-0.3 -3,-0.1 -3,-0.0 -4,-0.1 -0.856 26.7-151.8 -95.3 98.4 21.9 25.5 9.4 66 72 A T - 0 0 112 -2,-0.9 2,-0.1 -5,-0.2 -2,-0.0 -0.607 13.4-143.1 -70.2 107.2 18.7 24.8 7.5 67 73 A P - 0 0 113 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 -0.461 16.0-120.7 -75.2 146.6 19.0 21.1 6.4 68 74 A A - 0 0 90 1,-0.2 3,-0.1 -2,-0.1 0, 0.0 -0.038 43.5 -67.3 -74.4 179.6 17.7 20.1 3.0 69 75 A E - 0 0 144 1,-0.1 -1,-0.2 2,-0.0 31,-0.1 -0.466 66.5 -96.4 -63.4 138.0 15.0 17.5 2.2 70 76 A P + 0 0 21 0, 0.0 29,-0.2 0, 0.0 31,-0.2 -0.322 41.5 177.5 -56.0 144.6 16.2 14.0 3.1 71 77 A T + 0 0 115 27,-0.3 28,-0.1 29,-0.1 29,-0.1 0.520 47.2 98.6-122.1 -18.9 17.7 12.1 0.1 72 78 A E B -b 99 0B 105 26,-0.5 28,-2.4 1,-0.1 31,-0.2 -0.309 55.2-156.4 -71.3 156.9 18.8 8.8 1.8 73 79 A T S S+ 0 0 88 26,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.279 72.5 38.9-118.9 8.8 16.5 5.8 1.5 74 80 A c S S- 0 0 30 24,-0.2 53,-0.2 23,-0.1 -1,-0.1 -0.988 70.3-127.4-155.2 159.5 17.9 3.9 4.6 75 81 A V B -c 127 0C 1 51,-2.8 53,-2.0 -2,-0.3 2,-0.2 -0.892 32.5-118.0-108.1 132.6 19.1 4.5 8.2 76 82 A P S S- 0 0 29 0, 0.0 2,-1.6 0, 0.0 111,-0.1 -0.522 78.3 -13.4 -73.3 133.0 22.5 3.1 9.3 77 83 A G S S+ 0 0 25 51,-0.4 56,-0.2 -2,-0.2 54,-0.1 -0.373 104.8 71.6 91.0 -58.7 22.7 0.6 12.2 78 84 A L + 0 0 31 -2,-1.6 50,-0.1 1,-0.2 2,-0.1 -0.967 59.0 20.9-165.7 167.2 19.3 0.6 13.9 79 85 A P - 0 0 18 0, 0.0 -1,-0.2 0, 0.0 46,-0.1 0.668 30.3-162.8 -97.7 168.8 16.4 0.3 14.6 80 86 A G S S+ 0 0 56 44,-0.1 45,-1.8 1,-0.1 2,-0.3 0.718 80.3 15.2 -73.0 -23.4 14.4 -2.4 12.8 81 87 A S E -D 124 0D 57 43,-0.3 2,-0.3 45,-0.0 43,-0.2 -0.959 58.3-156.1-150.9 163.2 11.1 -0.9 13.8 82 88 A Y E -D 123 0D 5 41,-2.2 41,-3.0 -2,-0.3 2,-0.5 -0.991 18.9-133.8-144.6 138.5 9.5 2.2 15.3 83 89 A T E -D 122 0D 45 -2,-0.3 39,-0.2 39,-0.2 2,-0.1 -0.884 24.7-119.8-101.8 124.9 6.2 2.5 17.2 84 90 A I - 0 0 5 37,-2.8 36,-3.0 -2,-0.5 2,-0.3 -0.416 31.4-170.0 -62.3 132.0 3.7 5.3 16.3 85 91 A V > - 0 0 51 34,-0.2 3,-2.4 -2,-0.1 82,-0.0 -0.755 41.1 -63.1-116.4 168.0 2.9 7.8 19.1 86 92 A S T 3 S+ 0 0 101 1,-0.3 -1,-0.1 -2,-0.3 3,-0.1 -0.182 122.7 15.9 -54.6 131.7 0.2 10.5 19.2 87 93 A G T 3 S+ 0 0 69 1,-0.3 -1,-0.3 -3,-0.1 2,-0.1 0.296 90.9 136.8 91.3 -12.2 0.8 13.1 16.6 88 94 A D < - 0 0 26 -3,-2.4 2,-0.3 4,-0.1 -1,-0.3 -0.385 28.8-176.0 -71.7 147.3 3.2 11.1 14.5 89 95 A T > - 0 0 58 -3,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.946 37.7-118.3-132.8 155.3 2.9 11.1 10.7 90 96 A L H > S+ 0 0 6 24,-0.5 4,-2.4 -2,-0.3 5,-0.2 0.859 115.5 57.4 -61.9 -34.7 4.9 9.1 8.2 91 97 A T H > S+ 0 0 56 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.942 111.5 39.9 -54.4 -50.3 6.1 12.4 6.8 92 98 A N H > S+ 0 0 78 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.874 114.3 52.3 -73.7 -30.8 7.5 13.6 10.1 93 99 A I H X S+ 0 0 2 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.940 109.8 49.1 -69.7 -43.8 8.9 10.2 11.1 94 100 A S H <>S+ 0 0 2 -4,-2.4 5,-2.4 -5,-0.2 4,-0.5 0.939 110.9 51.4 -58.9 -45.2 10.8 9.9 7.8 95 101 A Q H ><5S+ 0 0 81 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.939 107.9 51.9 -54.9 -45.5 12.2 13.4 8.3 96 102 A D H 3<5S+ 0 0 31 -4,-2.4 63,-2.4 1,-0.3 62,-0.4 0.821 112.0 46.0 -61.7 -35.6 13.3 12.4 11.8 97 103 A F T 3<5S- 0 0 3 -4,-1.9 -1,-0.3 61,-0.2 -2,-0.2 0.445 112.1-123.4 -82.5 0.0 15.1 9.4 10.4 98 104 A N T < 5S+ 0 0 83 -3,-1.5 -26,-0.5 -4,-0.5 -27,-0.3 0.837 71.9 120.2 56.0 40.3 16.6 11.6 7.6 99 105 A I B - 0 0 33 -28,-2.4 4,-1.6 -2,-0.3 5,-0.2 -0.384 28.2-127.0 -68.0 146.6 12.7 10.0 2.1 101 107 A L H > S+ 0 0 61 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.926 111.8 59.7 -54.5 -47.3 9.0 9.5 2.8 102 108 A D H > S+ 0 0 122 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.900 102.6 50.4 -48.2 -44.2 8.9 7.3 -0.2 103 109 A S H > S+ 0 0 12 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.881 110.3 49.4 -66.3 -36.4 11.5 4.9 1.3 104 110 A L H < S+ 0 0 0 -4,-1.6 4,-0.3 -3,-0.2 -2,-0.2 0.921 112.2 47.2 -70.9 -40.7 9.6 4.6 4.6 105 111 A I H >< S+ 0 0 61 -4,-2.6 3,-2.0 1,-0.2 6,-0.2 0.938 110.4 54.0 -62.7 -46.2 6.3 3.8 2.8 106 112 A A H 3< S+ 0 0 68 -4,-2.8 3,-0.4 1,-0.3 -1,-0.2 0.836 105.0 54.3 -56.4 -30.8 8.1 1.3 0.6 107 113 A A T 3< S+ 0 0 29 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.524 109.4 51.2 -76.1 -10.1 9.4 -0.4 3.7 108 114 A N X + 0 0 2 -3,-2.0 3,-2.1 -4,-0.3 -1,-0.2 -0.474 55.6 153.7-131.7 60.8 5.8 -0.7 5.0 109 115 A T T 3 + 0 0 129 -3,-0.4 -1,-0.1 1,-0.3 -2,-0.1 0.728 69.0 72.8 -71.2 -16.1 3.7 -2.3 2.2 110 116 A Q T 3 S+ 0 0 107 -3,-0.1 2,-0.6 2,-0.0 -1,-0.3 0.650 75.8 93.2 -65.7 -17.7 1.3 -3.7 4.9 111 117 A I < - 0 0 22 -3,-2.1 -3,-0.1 -6,-0.2 6,-0.1 -0.738 61.3-165.3 -81.8 120.0 0.1 -0.1 5.5 112 118 A E S S+ 0 0 196 -2,-0.6 -1,-0.2 1,-0.3 -2,-0.0 0.880 78.4 18.4 -72.9 -44.7 -3.0 0.3 3.2 113 119 A N > - 0 0 82 3,-0.4 3,-2.1 1,-0.1 -1,-0.3 -0.984 69.4-149.8-131.0 114.6 -3.2 4.1 3.4 114 120 A P T 3 S+ 0 0 47 0, 0.0 -24,-0.5 0, 0.0 3,-0.1 0.572 97.6 56.7 -63.9 -10.3 -0.1 6.0 4.5 115 121 A D T 3 S+ 0 0 146 1,-0.2 2,-0.6 -26,-0.1 -3,-0.0 0.354 96.4 69.7 -97.7 1.1 -2.3 8.8 6.0 116 122 A A < + 0 0 59 -3,-2.1 -3,-0.4 2,-0.0 2,-0.3 -0.813 62.9 143.5-124.0 84.8 -4.2 6.4 8.3 117 123 A I - 0 0 30 -2,-0.6 2,-0.3 -29,-0.1 -6,-0.0 -0.869 35.9-137.4-119.9 160.1 -1.9 5.1 11.0 118 124 A D > - 0 0 114 -2,-0.3 3,-2.2 -32,-0.0 -34,-0.2 -0.886 25.2 -98.4-124.0 147.2 -2.7 4.4 14.6 119 125 A V T 3 S+ 0 0 108 -2,-0.3 -34,-0.2 1,-0.3 3,-0.1 -0.410 114.0 26.9 -58.4 132.8 -1.1 5.1 18.0 120 126 A G T 3 S+ 0 0 45 -36,-3.0 -1,-0.3 1,-0.3 2,-0.1 0.231 87.0 135.0 93.9 -14.1 0.7 1.9 18.9 121 127 A Q < - 0 0 48 -3,-2.2 -37,-2.8 -37,-0.1 2,-0.4 -0.482 49.8-136.1 -67.1 140.0 1.2 0.6 15.4 122 128 A I E -D 83 0D 100 -39,-0.2 2,-0.3 -2,-0.1 -39,-0.2 -0.847 21.5-170.7-100.7 130.9 4.6 -0.8 14.6 123 129 A I E -D 82 0D 1 -41,-3.0 -41,-2.2 -2,-0.4 2,-0.3 -0.878 24.6-112.9-116.5 151.6 6.4 0.2 11.3 124 130 A T E -D 81 0D 64 -2,-0.3 -43,-0.3 -43,-0.2 -17,-0.1 -0.649 21.6-149.7 -79.1 136.7 9.5 -1.1 9.8 125 131 A V - 0 0 3 -45,-1.8 2,-0.6 -2,-0.3 -21,-0.1 -0.970 21.1-125.1-103.9 120.6 12.5 1.2 9.5 126 132 A P - 0 0 25 0, 0.0 -51,-2.8 0, 0.0 2,-0.4 -0.592 28.6-162.0 -72.7 117.3 14.6 0.5 6.5 127 133 A V B -c 75 0C 52 -2,-0.6 3,-0.1 -53,-0.2 -47,-0.0 -0.837 22.6-110.5-101.2 135.2 18.2 -0.1 7.7 128 134 A c - 0 0 8 -53,-2.0 -51,-0.4 -2,-0.4 3,-0.4 -0.358 37.4-110.3 -60.3 133.3 21.2 0.1 5.4 129 135 A P S S+ 0 0 112 0, 0.0 59,-0.2 0, 0.0 -1,-0.1 -0.317 99.7 19.9 -59.9 153.3 22.8 -3.2 4.8 130 136 A S S S+ 0 0 69 1,-0.2 58,-2.4 57,-0.1 2,-0.3 0.943 98.8 125.3 50.8 62.2 26.3 -3.5 6.4 131 137 A S E +E 187 0E 24 -3,-0.4 2,-0.3 56,-0.3 56,-0.2 -0.959 30.3 170.5-146.4 158.5 25.8 -0.7 8.9 132 138 A Q E -E 186 0E 93 54,-2.3 54,-2.6 -2,-0.3 2,-0.4 -0.989 31.5-121.7-157.9 160.9 26.1 -0.2 12.7 133 139 A d E -E 185 0E 19 -2,-0.3 3,-0.2 52,-0.3 52,-0.2 -0.937 28.2-138.6-107.0 147.0 26.1 2.2 15.5 134 140 A E S S+ 0 0 118 49,-2.1 50,-0.2 50,-0.6 -1,-0.1 0.748 76.8 3.6 -83.7 -29.4 29.2 2.1 17.6 135 141 A A - 0 0 54 48,-0.8 2,-0.4 2,-0.1 -1,-0.2 -0.406 61.9-172.8-164.1 83.0 28.2 2.4 21.3 136 142 A V + 0 0 67 -3,-0.2 2,-0.3 46,-0.1 44,-0.0 -0.639 35.8 108.0 -94.7 121.7 24.5 2.5 22.3 137 143 A G E -F 181 0F 30 44,-1.8 44,-2.9 -2,-0.4 42,-0.1 -0.928 59.4 -28.8-171.9-169.2 24.0 3.2 26.0 138 144 A T E +F 180 0F 96 -2,-0.3 2,-0.3 42,-0.2 42,-0.2 -0.331 42.5 175.3 -73.5 146.0 22.9 5.4 28.8 139 145 A Y E -F 179 0F 44 40,-2.1 40,-2.8 -2,-0.1 2,-0.5 -0.986 23.3-136.9-145.7 133.5 23.2 9.2 28.8 140 146 A N E -F 178 0F 94 -2,-0.3 38,-0.2 38,-0.2 37,-0.1 -0.835 27.2-118.3 -97.9 129.0 21.9 11.6 31.4 141 147 A I - 0 0 6 36,-3.1 35,-3.0 -2,-0.5 2,-0.3 -0.302 28.3-161.9 -63.7 134.0 20.1 14.7 30.2 142 148 A V > - 0 0 77 33,-0.2 3,-2.2 34,-0.1 -1,-0.0 -0.752 41.1 -68.1-111.3 164.5 21.8 18.1 31.0 143 149 A A T 3 S+ 0 0 82 -2,-0.3 -1,-0.1 1,-0.3 31,-0.1 -0.326 121.5 15.1 -55.9 127.6 20.1 21.5 30.9 144 150 A G T 3 S+ 0 0 30 1,-0.3 -1,-0.3 -3,-0.0 2,-0.1 0.278 86.9 147.6 93.3 -6.6 19.2 22.5 27.4 145 151 A D < + 0 0 32 -3,-2.2 2,-0.3 4,-0.1 -1,-0.3 -0.347 20.5 178.8 -60.0 140.0 19.7 19.0 25.8 146 152 A L > - 0 0 30 1,-0.1 4,-2.8 -2,-0.1 3,-0.3 -0.987 39.4-123.0-141.4 146.5 17.4 18.2 22.8 147 153 A F H > S+ 0 0 6 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.902 112.7 58.4 -56.6 -40.0 17.2 15.1 20.6 148 154 A V H > S+ 0 0 60 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.904 112.7 38.2 -58.7 -38.4 17.8 17.4 17.6 149 155 A D H > S+ 0 0 37 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.883 112.3 54.7 -83.3 -39.5 21.1 18.5 19.0 150 156 A L H X S+ 0 0 4 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.890 104.9 58.2 -59.4 -35.3 22.2 15.2 20.5 151 157 A A H X>S+ 0 0 8 -4,-2.6 5,-2.3 -5,-0.3 4,-0.7 0.937 109.2 42.9 -61.9 -45.6 21.7 13.7 17.0 152 158 A A H ><5S+ 0 0 70 -4,-1.2 3,-0.7 -5,-0.2 -1,-0.2 0.953 116.0 47.5 -62.9 -48.2 24.1 16.0 15.5 153 159 A T H 3<5S+ 0 0 102 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.894 120.8 36.6 -60.6 -42.4 26.7 15.8 18.4 154 160 A Y H 3<5S- 0 0 62 -4,-2.7 30,-3.0 -5,-0.2 31,-0.2 0.364 110.6-115.1 -99.4 8.5 26.7 12.0 18.5 155 161 A H T <<5S+ 0 0 126 -3,-0.7 30,-2.6 -4,-0.7 2,-0.2 0.962 79.2 102.4 57.0 55.0 26.2 11.3 14.7 156 162 A T < - 0 0 18 -5,-2.3 2,-0.3 28,-0.2 -1,-0.2 -0.613 67.3 -98.5-136.0-157.4 22.8 9.8 14.8 157 163 A T > - 0 0 21 -2,-0.2 4,-2.1 1,-0.1 3,-0.2 -0.935 21.3-117.3-130.8 156.4 19.3 10.9 14.1 158 164 A I H > S+ 0 0 39 -62,-0.4 4,-2.7 -2,-0.3 -61,-0.2 0.904 116.6 54.3 -52.5 -45.6 16.3 12.2 16.0 159 165 A G H > S+ 0 0 1 -63,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.879 105.9 50.3 -59.6 -42.0 14.4 9.1 14.8 160 166 A Q H > S+ 0 0 1 -64,-0.3 4,-1.8 -3,-0.2 -1,-0.2 0.896 112.4 47.7 -67.0 -40.6 17.0 6.6 16.1 161 167 A I H X S+ 0 0 0 -4,-2.1 4,-0.7 1,-0.2 -2,-0.2 0.945 112.8 49.9 -64.2 -44.2 16.9 8.4 19.6 162 168 A K H >< S+ 0 0 39 -4,-2.7 3,-1.0 -5,-0.2 6,-0.3 0.909 108.5 51.9 -59.9 -43.5 13.1 8.3 19.5 163 169 A A H >< S+ 0 0 19 -4,-2.4 3,-0.7 1,-0.3 -1,-0.2 0.894 109.8 48.1 -64.0 -34.8 13.0 4.6 18.7 164 170 A L H 3< S+ 0 0 58 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.531 125.4 31.6 -80.9 -8.6 15.3 3.7 21.5 165 171 A N T X< S+ 0 0 13 -3,-1.0 3,-2.1 -4,-0.7 -1,-0.3 -0.439 78.2 160.5-140.2 55.8 13.2 5.9 23.9 166 172 A N T < S+ 0 0 37 -3,-0.7 -3,-0.1 1,-0.3 -2,-0.1 0.703 71.5 46.7 -74.0 -12.3 9.8 5.4 22.2 167 173 A N T 3 S+ 0 0 155 -4,-0.1 2,-0.5 2,-0.1 -1,-0.3 0.255 90.1 103.0-107.6 19.6 7.6 6.4 25.2 168 174 A V < - 0 0 34 -3,-2.1 -3,-0.1 -6,-0.3 5,-0.1 -0.864 66.9-140.6-101.0 124.6 9.7 9.6 25.9 169 175 A N > - 0 0 73 -2,-0.5 3,-2.1 1,-0.1 -2,-0.1 -0.743 9.6-146.0 -84.0 119.1 8.2 12.9 24.8 170 176 A P G > S+ 0 0 41 0, 0.0 3,-0.5 0, 0.0 -23,-0.2 0.722 97.8 58.4 -61.9 -17.8 11.2 14.9 23.5 171 177 A S G 3 S+ 0 0 84 1,-0.2 -126,-0.2 -25,-0.1 -2,-0.0 0.362 101.4 55.8 -90.1 5.0 9.5 18.1 24.9 172 178 A K G < S+ 0 0 142 -3,-2.1 2,-0.2 2,-0.1 -1,-0.2 -0.186 70.6 143.0-129.5 36.0 9.4 16.8 28.5 173 179 A L < - 0 0 35 -3,-0.5 2,-0.3 -28,-0.1 3,-0.0 -0.614 33.7-154.6 -83.0 142.3 13.1 16.0 29.2 174 180 A K > - 0 0 155 -2,-0.2 3,-2.3 -31,-0.1 -33,-0.3 -0.907 28.5 -95.0-118.0 146.1 14.3 16.7 32.7 175 181 A V T 3 S+ 0 0 109 -2,-0.3 -33,-0.2 1,-0.3 3,-0.1 -0.345 115.4 21.6 -58.3 129.2 17.8 17.4 34.0 176 182 A G T 3 S+ 0 0 46 -35,-3.0 -1,-0.3 1,-0.3 -34,-0.1 0.240 87.1 144.1 93.2 -12.3 19.2 14.0 35.1 177 183 A Q < - 0 0 51 -3,-2.3 -36,-3.1 -37,-0.1 2,-0.6 -0.397 48.2-131.3 -60.4 132.2 16.8 11.9 33.1 178 184 A Q E +F 140 0F 122 -38,-0.2 2,-0.3 -3,-0.1 -38,-0.2 -0.809 33.0 171.6 -85.6 123.1 18.5 8.8 31.7 179 185 A I E -F 139 0F 0 -40,-2.8 -40,-2.1 -2,-0.6 2,-0.5 -0.782 36.0-111.6-119.2 170.3 17.9 8.2 28.0 180 186 A I E -F 138 0F 50 -2,-0.3 -42,-0.2 -42,-0.2 -16,-0.1 -0.904 36.2-168.8-103.1 126.6 19.4 5.6 25.6 181 187 A L E -F 137 0F 6 -44,-2.9 -44,-1.8 -2,-0.5 2,-0.2 -0.960 11.3-152.6-125.5 117.2 21.7 7.2 23.1 182 188 A P - 0 0 0 0, 0.0 2,-0.4 0, 0.0 3,-0.1 -0.671 19.6-158.0 -82.4 153.5 23.1 5.6 20.0 183 189 A Q + 0 0 73 -2,-0.2 -49,-2.1 1,-0.2 -48,-0.8 -0.983 53.5 4.8-135.2 146.6 26.4 7.0 18.6 184 190 A D - 0 0 52 -30,-3.0 -50,-0.6 -2,-0.4 2,-0.6 0.964 67.8-171.7 56.3 60.3 28.4 7.1 15.5 185 191 A d E +E 133 0E 15 -30,-2.6 2,-0.3 -31,-0.2 -52,-0.3 -0.777 23.6 135.1 -89.1 123.2 25.9 5.4 13.2 186 192 A K E -E 132 0E 71 -54,-2.6 -54,-2.3 -2,-0.6 2,-0.2 -0.993 57.8 -88.1-157.6 162.2 27.4 4.6 9.8 187 193 A N E -E 131 0E 102 -2,-0.3 2,-0.3 -56,-0.2 -56,-0.3 -0.504 45.4-157.5 -70.4 146.9 27.8 2.2 7.0 188 194 A V 0 0 48 -58,-2.4 -1,-0.0 -59,-0.2 0, 0.0 -0.903 360.0 360.0-125.2 160.8 30.8 -0.1 7.5 189 195 A T 0 0 184 -2,-0.3 -58,-0.0 -58,-0.0 -2,-0.0 -0.703 360.0 360.0 78.9 360.0 33.0 -2.1 5.0