==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 13-MAR-00 1ELJ . COMPND 2 MOLECULE: MALTODEXTRIN-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR A.G.EVDOKIMOV,E.D.ANDERSON,K.M.ROUTZAHN,D.S.WAUGH . 380 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16150.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 270 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 2 0.5 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 . 18 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 129 33.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 2 0 3 0 2 1 0 3 0 2 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 0 0 0 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 PARALLEL BRIDGES PER LADDER . 4 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 1 0 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 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 0 240 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 158.2 36.9 44.6 45.9 2 2 A K - 0 0 164 3,-0.0 2,-0.3 0, 0.0 3,-0.0 -0.939 360.0-111.2-161.8-180.0 37.3 44.3 42.2 3 3 A I - 0 0 84 -2,-0.3 2,-0.4 32,-0.0 276,-0.1 -0.800 46.5 -90.1-119.0 163.9 36.3 43.4 38.7 4 4 A E - 0 0 46 -2,-0.3 2,-0.3 274,-0.1 31,-0.1 -0.607 59.0-179.8 -69.6 129.3 37.5 40.7 36.3 5 5 A E + 0 0 102 -2,-0.4 31,-0.2 2,-0.1 274,-0.2 -0.803 22.1 15.7-125.8 175.4 40.2 42.3 34.3 6 6 A G E S-a 36 0A 39 29,-0.9 31,-3.2 -2,-0.3 2,-0.3 -0.349 83.0 -8.7 82.3-143.6 42.7 41.7 31.5 7 7 A K E -a 37 0A 87 29,-0.2 2,-0.4 -2,-0.1 31,-0.2 -0.693 30.9-161.8-109.4 148.2 43.1 39.1 28.9 8 8 A V E -a 38 0A 0 29,-2.8 31,-3.8 -2,-0.3 2,-0.5 -0.969 18.0-160.3-124.5 110.6 41.7 35.8 27.9 9 9 A V E -a 39 0A 22 -2,-0.4 53,-2.3 29,-0.2 52,-2.0 -0.827 7.3-170.6 -96.9 124.5 43.9 33.8 25.5 10 10 A I E -ab 40 62A 0 29,-3.4 31,-2.5 -2,-0.5 53,-0.3 -0.945 8.6-152.7-122.0 115.8 42.3 31.1 23.5 11 11 A W E +ab 41 63A 16 51,-2.8 53,-1.9 -2,-0.5 2,-0.3 -0.601 27.6 154.3 -87.8 150.4 44.2 28.5 21.4 12 12 A H E -a 42 0A 1 29,-1.7 31,-2.4 -2,-0.2 53,-0.1 -0.977 46.3-136.8-163.0 168.8 42.6 27.0 18.4 13 13 A A + 0 0 35 51,-0.4 2,-0.2 -2,-0.3 29,-0.1 -0.061 54.7 135.9-126.6 29.0 43.1 25.3 15.0 14 14 A M - 0 0 11 1,-0.1 -2,-0.1 2,-0.1 29,-0.0 -0.536 54.2-121.5 -74.3 142.8 40.3 27.1 13.0 15 15 A Q > - 0 0 64 -2,-0.2 4,-2.8 215,-0.2 3,-0.5 -0.411 37.9 -94.7 -78.3 163.2 41.1 28.4 9.5 16 16 A P H > S+ 0 0 94 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.830 121.2 50.5 -50.6 -44.1 40.6 32.1 8.9 17 17 A N H > S+ 0 0 36 2,-0.2 4,-0.8 1,-0.2 214,-0.0 0.875 114.7 43.4 -70.4 -33.7 37.1 31.9 7.5 18 18 A E H >> S+ 0 0 14 -3,-0.5 4,-1.3 1,-0.2 3,-0.8 0.937 112.7 54.5 -69.6 -42.5 35.8 29.8 10.4 19 19 A L H 3X S+ 0 0 40 -4,-2.8 4,-3.3 1,-0.2 5,-0.3 0.865 94.6 68.6 -57.2 -35.6 37.7 32.0 12.8 20 20 A E H 3X S+ 0 0 96 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.876 99.0 50.4 -53.2 -41.4 36.0 35.2 11.5 21 21 A V H X S+ 0 0 84 -4,-2.0 4,-1.8 1,-0.2 3,-0.5 0.938 111.4 49.9 -53.0 -48.3 30.6 41.7 20.6 29 29 A Y H 3X S+ 0 0 8 -4,-2.7 4,-2.1 1,-0.3 3,-0.3 0.924 108.2 50.9 -63.1 -39.4 31.7 40.3 23.9 30 30 A M H 3< S+ 0 0 47 -4,-2.6 -1,-0.3 1,-0.3 6,-0.2 0.745 107.4 55.5 -69.8 -19.7 34.5 43.0 24.3 31 31 A A H << S+ 0 0 77 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 0.838 110.3 45.7 -75.4 -33.6 31.7 45.5 23.5 32 32 A L H < S+ 0 0 106 -4,-1.8 -2,-0.2 -3,-0.3 -1,-0.2 0.802 128.1 26.3 -76.1 -32.7 29.8 44.1 26.4 33 33 A X >< - 0 0 59 -4,-2.1 3,-1.9 -5,-0.2 -1,-0.3 -0.661 68.6-178.2-133.5 77.1 32.8 44.0 28.8 34 34 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.589 77.8 64.7 -57.4 -11.7 35.3 46.7 27.7 35 35 A E T 3 S+ 0 0 118 -31,-0.1 -29,-0.9 -30,-0.1 2,-0.5 0.310 91.6 75.1 -94.4 14.7 37.8 45.7 30.4 36 36 A V E < -a 6 0A 4 -3,-1.9 2,-0.6 -6,-0.2 -29,-0.2 -0.970 64.6-154.8-130.0 123.3 38.4 42.2 29.0 37 37 A E E -a 7 0A 92 -31,-3.2 -29,-2.8 -2,-0.5 2,-0.6 -0.857 6.3-156.1-100.7 128.3 40.5 41.4 25.9 38 38 A I E -a 8 0A 6 -2,-0.6 2,-0.5 -31,-0.2 -29,-0.2 -0.908 14.4-171.5 -99.4 119.1 39.6 38.2 24.1 39 39 A V E -a 9 0A 31 -31,-3.8 -29,-3.4 -2,-0.6 2,-0.4 -0.945 9.3-161.9-120.4 120.4 42.6 36.9 22.1 40 40 A F E -a 10 0A 25 -2,-0.5 2,-0.4 -31,-0.2 -29,-0.2 -0.809 8.0-171.2 -94.1 134.0 42.5 34.0 19.7 41 41 A E E -a 11 0A 75 -31,-2.5 -29,-1.7 -2,-0.4 2,-0.2 -0.972 15.2-138.9-132.3 118.8 45.8 32.3 18.7 42 42 A Q E -a 12 0A 101 -2,-0.4 -29,-0.2 -31,-0.2 -31,-0.1 -0.500 14.8-166.4 -73.6 132.9 46.0 29.7 15.9 43 43 A K > - 0 0 56 -31,-2.4 3,-0.7 -2,-0.2 4,-0.1 -0.993 16.7-150.0-124.1 123.2 48.2 26.6 16.4 44 44 A P T 3 S+ 0 0 101 0, 0.0 2,-0.5 0, 0.0 3,-0.1 0.916 102.1 25.3 -54.4 -48.4 49.2 24.4 13.4 45 45 A N T 3> S+ 0 0 103 1,-0.2 4,-3.1 2,-0.1 5,-0.3 -0.718 79.1 174.9-117.9 76.2 49.4 21.3 15.6 46 46 A L H <> S+ 0 0 6 -3,-0.7 4,-2.6 -2,-0.5 5,-0.3 0.893 75.6 49.7 -60.0 -42.0 47.1 22.4 18.4 47 47 A E H > S+ 0 0 50 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.952 115.8 43.8 -63.1 -45.9 47.1 19.1 20.4 48 48 A D H > S+ 0 0 107 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.892 112.9 52.4 -58.4 -47.1 51.0 19.0 20.3 49 49 A A H X S+ 0 0 24 -4,-3.1 4,-2.1 1,-0.2 5,-0.3 0.894 111.7 46.1 -61.2 -40.2 51.2 22.7 21.1 50 50 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.3 -1,-0.2 0.930 109.1 53.5 -70.1 -42.4 49.0 22.3 24.2 51 51 A K H < S+ 0 0 85 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.860 116.9 39.6 -59.1 -34.5 50.7 19.2 25.5 52 52 A A H < S+ 0 0 68 -4,-1.6 4,-0.4 -5,-0.2 -1,-0.2 0.851 122.2 37.1 -85.7 -35.7 54.0 21.0 25.4 53 53 A A H <>S+ 0 0 12 -4,-2.1 5,-2.0 -5,-0.2 6,-0.8 0.841 103.8 65.6 -91.5 -39.0 53.1 24.5 26.6 54 54 A I T ><5S+ 0 0 7 -4,-2.3 3,-1.7 -5,-0.3 5,-0.4 0.935 102.0 47.2 -52.2 -52.9 50.5 23.8 29.2 55 55 A P T 3 5S+ 0 0 90 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.843 110.2 54.1 -64.7 -27.7 52.8 22.0 31.7 56 56 A T T 3 5S- 0 0 86 -4,-0.4 -2,-0.2 -3,-0.4 -3,-0.1 0.353 116.3-108.5 -88.3 8.5 55.5 24.7 31.4 57 57 A G T < 5S+ 0 0 53 -3,-1.7 -3,-0.2 -4,-0.3 -4,-0.1 0.574 96.3 106.3 76.8 7.1 53.2 27.6 32.3 58 58 A Q < + 0 0 144 -5,-2.0 -4,-0.3 -6,-0.1 -5,-0.1 0.319 53.1 103.8-100.3 11.1 53.3 28.7 28.7 59 59 A G S S- 0 0 15 -6,-0.8 -50,-0.1 -5,-0.4 -9,-0.1 -0.282 70.3 -98.4 -91.7-176.2 49.8 27.7 27.6 60 60 A P - 0 0 3 0, 0.0 -50,-0.2 0, 0.0 -1,-0.1 -0.148 24.1-115.5 -89.6-176.6 46.6 29.6 27.1 61 61 A D S S+ 0 0 4 -52,-2.0 210,-2.3 1,-0.2 2,-0.3 0.891 95.5 3.3 -83.4 -41.5 43.6 30.2 29.3 62 62 A L E -bC 10 270A 0 -53,-2.3 -51,-2.8 208,-0.2 2,-0.3 -0.889 61.9-166.0-133.5 162.9 41.2 28.3 27.0 63 63 A F E -bC 11 269A 0 206,-1.7 206,-3.4 -2,-0.3 2,-0.5 -0.987 16.6-130.3-149.7 158.1 41.3 26.2 23.8 64 64 A I E + C 0 268A 6 -53,-1.9 -51,-0.4 -2,-0.3 2,-0.3 -0.911 41.9 123.6-112.2 128.3 38.7 24.9 21.4 65 65 A W E - C 0 267A 91 202,-1.6 202,-2.5 -2,-0.5 -2,-0.1 -0.972 61.0 -73.0-159.9 170.8 38.3 21.4 20.0 66 66 A A E > - C 0 266A 4 -2,-0.3 3,-0.9 200,-0.2 200,-0.2 -0.241 55.8-103.3 -58.6 161.2 35.8 18.5 19.8 67 67 A H G > S+ 0 0 3 198,-1.5 3,-2.0 1,-0.2 4,-0.3 0.565 99.8 87.8 -71.1 -14.5 35.1 16.7 23.0 68 68 A D G 3 S+ 0 0 13 1,-0.3 4,-0.5 2,-0.1 3,-0.3 0.662 80.8 61.6 -74.3 -9.7 37.2 13.5 22.5 69 69 A W G <> S+ 0 0 13 -3,-0.9 4,-2.8 1,-0.2 5,-0.4 0.672 80.3 87.8 -77.0 -13.9 40.4 15.0 23.9 70 70 A I H <> S+ 0 0 0 -3,-2.0 4,-1.9 1,-0.2 5,-0.2 0.864 86.2 49.2 -63.1 -35.6 38.8 15.6 27.3 71 71 A G H > S+ 0 0 0 -3,-0.3 4,-2.6 266,-0.3 5,-0.2 0.988 117.0 37.4 -63.3 -60.6 39.7 12.1 28.7 72 72 A K H > S+ 0 0 27 -4,-0.5 4,-1.7 265,-0.3 6,-0.2 0.903 116.9 52.1 -66.0 -37.3 43.3 12.0 27.8 73 73 A F H <>S+ 0 0 0 -4,-2.8 5,-2.8 1,-0.2 6,-0.5 0.947 112.0 46.4 -61.9 -43.0 43.9 15.7 28.5 74 74 A A H ><5S+ 0 0 15 -4,-1.9 3,-1.7 -5,-0.4 -1,-0.2 0.938 109.9 53.3 -66.2 -36.5 42.4 15.3 32.0 75 75 A E H 3<5S+ 0 0 115 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.856 108.7 51.1 -68.5 -24.0 44.4 12.2 32.6 76 76 A A T 3<5S- 0 0 66 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.476 115.7-117.7 -89.1 1.8 47.5 14.1 31.8 77 77 A G T < 5S+ 0 0 53 -3,-1.7 -3,-0.2 -4,-0.3 -2,-0.1 0.781 76.7 128.6 72.7 24.6 46.6 16.9 34.2 78 78 A L < + 0 0 11 -5,-2.8 194,-2.5 -6,-0.2 2,-0.3 0.514 51.9 73.6 -94.1 -0.7 46.3 19.4 31.3 79 79 A L B S-G 271 0B 11 -6,-0.5 192,-0.3 192,-0.3 194,-0.1 -0.773 71.9-131.1-112.5 161.0 42.9 20.7 32.1 80 80 A E - 0 0 52 190,-2.9 190,-0.3 -2,-0.3 2,-0.1 -0.920 27.2-127.9-103.9 125.1 41.5 23.0 34.8 81 81 A P - 0 0 50 0, 0.0 28,-0.2 0, 0.0 3,-0.1 -0.491 19.4-171.8 -75.6 145.3 38.4 21.7 36.6 82 82 A I >> + 0 0 0 26,-2.2 3,-1.9 -2,-0.1 4,-1.1 -0.043 41.8 128.4-123.4 26.1 35.4 24.1 36.7 83 83 A D T 34 S+ 0 0 57 25,-0.4 3,-0.3 1,-0.3 -1,-0.1 0.782 70.2 59.8 -52.7 -38.2 33.2 22.1 39.1 84 84 A E T 34 S+ 0 0 148 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.637 108.3 45.3 -64.9 -22.0 32.8 25.2 41.3 85 85 A Y T <4 S+ 0 0 40 -3,-1.9 2,-0.3 23,-0.1 -1,-0.2 0.702 95.2 89.3 -95.1 -20.3 31.2 27.0 38.4 86 86 A V < + 0 0 19 -4,-1.1 2,-0.3 -3,-0.3 3,-0.0 -0.608 51.7 172.8 -88.6 135.5 28.9 24.3 37.2 87 87 A T > - 0 0 77 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.904 46.0-109.2-132.1 161.8 25.4 24.0 38.6 88 88 A E H > S+ 0 0 113 -2,-0.3 4,-2.8 1,-0.2 5,-0.1 0.890 119.3 56.6 -61.0 -35.8 22.3 22.0 37.8 89 89 A D H 4 S+ 0 0 134 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.916 110.9 43.4 -62.5 -39.8 20.6 25.1 36.4 90 90 A L H >4 S+ 0 0 5 2,-0.2 3,-1.8 1,-0.2 4,-0.3 0.952 113.0 50.8 -67.2 -48.8 23.5 25.5 34.0 91 91 A L H >< S+ 0 0 6 -4,-2.8 3,-2.2 1,-0.3 -2,-0.2 0.898 103.3 60.7 -54.9 -42.9 23.7 21.9 33.0 92 92 A N T 3< S+ 0 0 98 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.640 91.2 69.0 -65.9 -10.4 20.0 21.8 32.4 93 93 A E T < S+ 0 0 70 -3,-1.8 215,-1.4 -4,-0.3 216,-0.3 0.657 96.7 66.9 -76.1 -14.4 20.5 24.5 29.7 94 94 A F B < S-H 307 0C 3 -3,-2.2 213,-0.2 -4,-0.3 5,-0.1 -0.749 92.6 -99.1-110.5 153.5 22.3 21.9 27.5 95 95 A A >> - 0 0 25 211,-2.4 4,-2.5 -2,-0.3 3,-1.1 -0.362 43.2-112.0 -60.2 147.3 21.4 18.7 25.7 96 96 A P H 3> S+ 0 0 99 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.894 116.8 53.3 -55.4 -44.9 22.3 15.7 27.8 97 97 A M H 3> S+ 0 0 75 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.829 111.0 47.7 -65.8 -25.6 25.1 14.5 25.4 98 98 A A H <> S+ 0 0 0 -3,-1.1 4,-1.5 2,-0.2 -1,-0.2 0.858 108.9 55.1 -74.6 -35.4 26.6 18.0 25.7 99 99 A Q H < S+ 0 0 44 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.889 114.1 40.5 -58.3 -39.5 26.2 17.7 29.4 100 100 A D H >< S+ 0 0 80 -4,-2.5 3,-1.2 -5,-0.2 -2,-0.2 0.840 109.3 58.3 -82.1 -33.9 28.2 14.4 29.3 101 101 A A H 3< S+ 0 0 1 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.814 98.6 61.1 -63.9 -29.6 30.8 15.6 26.7 102 102 A M T 3< S+ 0 0 0 -4,-1.5 7,-2.1 -5,-0.1 8,-0.9 0.452 102.9 55.3 -84.8 3.9 31.9 18.5 29.0 103 103 A Q E < -I 108 0D 37 -3,-1.2 2,-0.4 5,-0.2 5,-0.2 -0.938 58.9-159.1-133.3 159.0 33.0 16.3 31.9 104 104 A Y E > S-I 107 0D 29 3,-2.7 3,-1.6 -2,-0.3 -3,-0.0 -0.968 75.5 -21.2-142.6 124.9 35.4 13.4 32.5 105 105 A K T 3 S- 0 0 139 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.836 130.4 -41.1 43.2 46.9 35.1 11.0 35.5 106 106 A G T 3 S+ 0 0 50 1,-0.2 2,-0.4 -23,-0.0 -1,-0.3 0.414 116.7 100.3 100.4 -11.0 33.1 13.4 37.6 107 107 A H E < -I 104 0D 85 -3,-1.6 -3,-2.7 -26,-0.0 2,-0.3 -0.947 61.9-137.2-117.2 140.6 34.9 16.7 36.8 108 108 A Y E +I 103 0D 52 -2,-0.4 -26,-2.2 -5,-0.2 -25,-0.4 -0.695 28.5 163.2 -88.0 139.7 33.8 19.4 34.4 109 109 A Y + 0 0 31 -7,-2.1 161,-2.8 -2,-0.3 2,-0.3 0.279 58.5 17.4-138.8 3.7 36.5 21.0 32.3 110 110 A A E -D 269 0A 0 -8,-0.9 159,-0.2 159,-0.2 -1,-0.2 -0.965 62.2-117.1-162.4 172.8 34.7 22.8 29.5 111 111 A L E -D 268 0A 0 157,-1.8 157,-3.0 -2,-0.3 2,-0.3 -0.974 32.1-131.0-122.2 141.4 31.5 24.3 28.1 112 112 A P E +D 267 0A 0 0, 0.0 155,-0.3 0, 0.0 194,-0.1 -0.700 26.8 171.2 -94.2 145.5 29.9 22.9 25.0 113 113 A F E + 0 0 3 153,-2.7 2,-0.3 1,-0.3 193,-0.3 0.464 58.8 2.9-129.1 -8.9 28.7 25.0 22.0 114 114 A A E -D 266 0A 0 152,-0.9 152,-2.5 191,-0.2 2,-0.3 -0.994 50.1-127.0-165.6 162.2 27.7 22.7 19.2 115 115 A A E +DE 265 304A 3 189,-2.1 189,-1.8 -2,-0.3 2,-0.3 -0.873 39.0 170.9-109.2 155.1 27.2 19.2 17.8 116 116 A E E +D 264 0A 9 148,-2.0 148,-2.6 -2,-0.3 2,-0.2 -0.993 18.8 154.6-159.9 158.7 28.9 18.3 14.5 117 117 A T E -D 263 0A 0 -2,-0.3 2,-0.3 146,-0.2 146,-0.2 -0.920 47.6 -81.6-166.1-178.3 29.8 15.6 11.9 118 118 A V + 0 0 2 144,-0.5 129,-0.3 -2,-0.2 2,-0.3 -0.752 48.5 165.4 -97.1 153.2 30.6 15.5 8.2 119 119 A A E -J 227 0E 0 108,-2.2 108,-1.9 -2,-0.3 2,-0.7 -0.902 46.1 -75.6-148.9 170.6 27.9 15.4 5.6 120 120 A I E -JK 226 245E 0 125,-2.6 125,-2.3 -2,-0.3 2,-0.6 -0.722 39.7-167.1 -78.5 119.3 27.5 15.9 1.8 121 121 A I E -JK 225 244E 0 104,-3.3 104,-2.9 -2,-0.7 2,-0.4 -0.947 17.4-168.6-100.5 117.1 27.7 19.6 1.0 122 122 A Y E -JK 224 243E 22 121,-2.3 121,-1.8 -2,-0.6 2,-0.7 -0.884 25.4-121.9-123.3 148.9 26.5 19.8 -2.5 123 123 A N E >> - 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0 0 22 -3,-1.5 3,-0.3 -213,-0.2 -1,-0.2 -0.257 21.0-162.8 -55.1 138.0 45.0 29.2 33.2 275 275 A K S S+ 0 0 161 1,-0.2 2,-0.3 -3,-0.1 -1,-0.1 0.769 78.4 37.0 -97.4 -27.1 45.8 32.7 34.3 276 276 A N > + 0 0 42 1,-0.2 4,-2.4 -267,-0.1 5,-0.2 -0.549 67.3 162.6-126.2 66.3 42.5 34.5 34.1 277 277 A K H > S+ 0 0 39 -2,-0.3 4,-2.8 -3,-0.3 5,-0.2 0.923 72.0 41.8 -61.9 -54.1 39.9 32.0 35.4 278 278 A D H > S+ 0 0 84 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.892 117.1 48.2 -63.8 -39.6 36.9 34.1 36.3 279 279 A A H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.919 113.7 48.2 -63.6 -37.4 37.3 36.3 33.2 280 280 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.894 109.3 52.8 -74.0 -34.4 37.6 33.2 31.0 281 281 A W H X S+ 0 0 21 -4,-2.8 4,-3.2 -5,-0.2 5,-0.3 0.946 108.0 51.0 -58.7 -50.4 34.6 31.6 32.6 282 282 A K H X S+ 0 0 72 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.892 111.9 46.6 -58.0 -44.4 32.4 34.6 32.0 283 283 A F H X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.2 -1,-0.2 0.934 115.5 45.5 -63.6 -43.4 33.4 34.7 28.3 284 284 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.885 111.9 51.3 -67.0 -40.7 32.9 31.0 27.8 285 285 A K H X S+ 0 0 85 -4,-3.2 4,-2.3 2,-0.2 -1,-0.2 0.893 113.2 46.6 -63.0 -40.6 29.6 31.1 29.7 286 286 A W H X S+ 0 0 43 -4,-2.0 4,-1.9 -5,-0.3 -2,-0.2 0.938 112.1 49.9 -63.1 -49.4 28.5 33.9 27.4 287 287 A L H < S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.802 121.5 34.1 -62.0 -32.0 29.7 32.1 24.3 288 288 A T H < S+ 0 0 1 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.671 126.2 33.8-104.6 -17.1 27.9 28.9 25.1 289 289 A T H < S+ 0 0 28 -4,-2.3 2,-0.4 -5,-0.2 -3,-0.2 0.432 89.1 98.8-122.6 3.6 24.7 30.1 26.9 290 290 A S X - 0 0 24 -4,-1.9 4,-2.5 -5,-0.2 5,-0.3 -0.720 67.3-140.4 -88.3 132.6 23.8 33.4 25.2 291 291 A E H > S+ 0 0 79 -2,-0.4 4,-3.2 1,-0.2 5,-0.2 0.910 99.0 47.6 -62.6 -38.7 21.1 32.9 22.6 292 292 A E H > S+ 0 0 115 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.832 109.5 53.5 -79.4 -25.5 22.6 35.2 20.0 293 293 A S H > S+ 0 0 0 -7,-0.2 4,-2.3 2,-0.2 5,-0.2 0.994 115.4 39.3 -65.1 -57.5 26.0 33.8 20.4 294 294 A I H X S+ 0 0 2 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.916 114.0 54.4 -60.4 -40.8 24.8 30.3 19.7 295 295 A K H X S+ 0 0 13 -4,-3.2 4,-2.7 -5,-0.3 5,-0.3 0.891 108.1 51.9 -57.9 -36.7 22.3 31.5 17.0 296 296 A T H X S+ 0 0 31 -4,-2.0 4,-2.2 -3,-0.2 5,-0.4 0.932 109.2 47.2 -68.1 -44.5 25.2 33.1 15.3 297 297 A L H X S+ 0 0 1 -4,-2.3 4,-2.1 1,-0.2 6,-1.0 0.934 117.2 45.0 -60.0 -43.5 27.4 30.0 15.3 298 298 A A H X S+ 0 0 1 -4,-2.6 4,-1.8 -5,-0.2 -2,-0.2 0.932 116.7 41.5 -68.9 -42.9 24.5 28.0 14.0 299 299 A L H < S+ 0 0 41 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.867 120.8 42.1 -78.0 -28.9 23.2 30.3 11.3 300 300 A E H < S+ 0 0 81 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.904 133.1 16.4 -82.3 -37.2 26.6 31.3 10.0 301 301 A L H < S- 0 0 0 -4,-2.1 -69,-0.3 -5,-0.4 -3,-0.2 0.547 97.4-112.1-114.6 -12.8 28.3 27.9 10.0 302 302 A G < + 0 0 1 -4,-1.8 -4,-0.2 -5,-0.5 -3,-0.1 0.561 57.3 160.1 88.3 5.7 25.6 25.2 10.3 303 303 A Y - 0 0 1 -6,-1.0 -1,-0.3 -74,-0.2 -187,-0.1 -0.429 42.3-123.7 -60.6 136.3 26.7 24.2 13.8 304 304 A I B -E 115 0A 25 -189,-1.8 -189,-2.1 -2,-0.1 -1,-0.1 -0.710 27.9-120.7 -83.8 122.6 23.9 22.3 15.6 305 305 A P - 0 0 5 0, 0.0 -191,-0.2 0, 0.0 -192,-0.1 -0.243 25.7-174.4 -58.8 144.1 23.0 24.0 18.8 306 306 A V + 0 0 4 -193,-0.3 -211,-2.4 -18,-0.1 2,-1.0 0.264 63.5 101.8-113.6 3.0 23.3 22.0 22.0 307 307 A L B >> -H 94 0C 4 -213,-0.2 3,-1.6 -194,-0.2 4,-0.6 -0.823 69.7-152.0 -86.2 97.8 21.7 25.0 23.9 308 308 A T G >4 S+ 0 0 71 -215,-1.4 3,-2.1 -2,-1.0 4,-0.4 0.805 84.6 61.3 -45.1 -54.0 18.2 23.5 24.2 309 309 A K G >4 S+ 0 0 154 -216,-0.3 3,-1.4 1,-0.3 -1,-0.3 0.782 100.5 52.9 -42.9 -44.3 16.4 26.8 24.3 310 310 A V G X4 S+ 0 0 1 -3,-1.6 3,-1.4 1,-0.3 6,-0.3 0.691 90.1 76.2 -78.2 -13.6 17.5 28.0 20.8 311 311 A L G << S+ 0 0 77 -3,-2.1 -1,-0.3 -4,-0.6 -2,-0.2 0.708 94.8 52.7 -63.4 -20.1 16.4 24.7 19.1 312 312 A D G < S+ 0 0 115 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.421 82.8 113.7 -97.3 0.0 12.8 26.2 19.5 313 313 A D X> - 0 0 25 -3,-1.4 4,-3.5 1,-0.2 3,-1.1 -0.547 67.8-139.8 -73.7 126.7 13.8 29.4 17.8 314 314 A P H 3> S+ 0 0 75 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.878 103.6 61.7 -56.0 -37.2 12.0 29.7 14.4 315 315 A E H 34 S+ 0 0 103 1,-0.2 -4,-0.1 2,-0.2 -2,-0.0 0.864 114.0 36.2 -52.4 -39.5 15.3 31.1 12.9 316 316 A I H X4 S+ 0 0 8 -3,-1.1 3,-1.8 -6,-0.3 -1,-0.2 0.920 114.2 54.6 -82.8 -45.5 16.8 27.8 13.8 317 317 A K H 3< S+ 0 0 115 -4,-3.5 -2,-0.2 1,-0.3 -1,-0.1 0.747 111.6 45.0 -62.1 -24.5 13.8 25.6 13.1 318 318 A N T 3< S+ 0 0 131 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.1 0.238 86.5 113.3-104.8 17.2 13.5 26.9 9.5 319 319 A D <> - 0 0 34 -3,-1.8 4,-1.7 1,-0.1 5,-0.2 -0.759 52.0-157.9 -94.7 122.1 17.2 26.8 8.6 320 320 A P H > S+ 0 0 89 0, 0.0 4,-2.5 0, 0.0 -76,-0.2 0.898 87.4 51.6 -62.4 -43.1 18.2 24.2 5.9 321 321 A V H > S+ 0 0 22 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.929 110.6 46.7 -67.8 -43.3 21.9 23.8 6.8 322 322 A I H > S+ 0 0 12 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.932 112.5 52.3 -62.9 -40.8 21.4 23.1 10.5 323 323 A Y H X S+ 0 0 156 -4,-1.7 4,-3.0 1,-0.2 5,-0.2 0.946 109.4 48.9 -57.6 -48.2 18.6 20.6 9.6 324 324 A G H X S+ 0 0 3 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.918 112.9 45.5 -61.1 -44.6 20.9 18.8 7.1 325 325 A F H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 -1,-0.2 0.883 112.1 54.6 -65.0 -34.5 23.8 18.5 9.6 326 326 A G H X S+ 0 0 21 -4,-2.4 4,-1.6 -5,-0.3 -2,-0.2 0.952 106.5 49.8 -63.7 -42.9 21.2 17.4 12.2 327 327 A Q H X S+ 0 0 52 -4,-3.0 4,-0.7 1,-0.2 -1,-0.2 0.900 111.9 49.4 -61.0 -38.4 20.0 14.7 9.8 328 328 A A H >< S+ 0 0 3 -4,-2.0 3,-1.3 1,-0.2 4,-0.4 0.941 106.3 54.9 -67.2 -41.8 23.7 13.6 9.4 329 329 A V H >< S+ 0 0 35 -4,-3.0 3,-1.4 1,-0.3 -1,-0.2 0.844 95.0 69.3 -61.2 -29.7 24.3 13.6 13.1 330 330 A Q H 3< S+ 0 0 126 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.856 105.4 40.0 -58.1 -33.2 21.4 11.2 13.6 331 331 A H T << S+ 0 0 39 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.413 100.9 105.3 -92.0 2.0 23.4 8.5 11.8 332 332 A A < - 0 0 21 -3,-1.4 2,-0.5 -4,-0.4 -70,-0.2 -0.490 66.3-131.7 -84.0 156.4 26.7 9.5 13.6 333 333 A Y E -f 262 0A 70 -72,-2.1 -70,-2.5 -73,-0.2 2,-0.3 -0.930 27.3-121.7 -97.3 125.8 28.6 7.8 16.4 334 334 A L E -f 263 0A 72 -2,-0.5 -70,-0.2 -72,-0.2 -72,-0.1 -0.528 35.2-108.6 -67.0 128.6 29.6 10.1 19.2 335 335 A M - 0 0 8 -72,-2.2 -70,-0.1 -2,-0.3 -1,-0.1 -0.345 36.5-113.3 -58.0 138.9 33.4 9.9 19.6 336 336 A P - 0 0 14 0, 0.0 -265,-0.1 0, 0.0 -1,-0.1 -0.333 9.8-143.7 -66.7 154.2 34.4 8.0 22.8 337 337 A K + 0 0 33 -267,-0.1 -265,-0.3 -266,-0.1 -266,-0.3 0.574 62.1 122.7 -90.5 -8.4 36.1 10.0 25.5 338 338 A S > - 0 0 20 1,-0.2 3,-1.8 -267,-0.1 4,-0.3 -0.245 67.8-134.8 -54.6 131.2 38.4 7.0 26.4 339 339 A P T > S+ 0 0 22 0, 0.0 3,-1.5 0, 0.0 4,-0.5 0.720 101.5 77.2 -56.3 -18.9 42.1 7.7 26.2 340 340 A K T >> S+ 0 0 57 1,-0.3 4,-1.2 2,-0.2 3,-0.6 0.816 78.4 70.8 -59.8 -27.4 42.3 4.4 24.3 341 341 A M H <> S+ 0 0 4 -3,-1.8 4,-2.6 1,-0.2 -1,-0.3 0.799 81.9 74.2 -63.9 -23.8 40.9 6.1 21.3 342 342 A S H <> S+ 0 0 41 -3,-1.5 4,-1.8 -4,-0.3 -1,-0.2 0.936 100.7 39.8 -54.8 -51.6 44.3 8.0 20.9 343 343 A A H <> S+ 0 0 16 -3,-0.6 4,-2.6 -4,-0.5 -1,-0.2 0.774 110.6 61.2 -70.6 -26.0 46.0 4.9 19.6 344 344 A V H X S+ 0 0 0 -4,-1.2 4,-2.8 2,-0.2 5,-0.3 0.964 105.5 45.8 -62.8 -47.9 43.0 3.9 17.5 345 345 A W H X S+ 0 0 33 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.941 113.4 50.2 -62.0 -43.1 43.2 7.1 15.6 346 346 A G H X S+ 0 0 45 -4,-1.8 4,-2.0 -5,-0.2 -1,-0.2 0.918 111.0 49.8 -57.0 -42.6 47.0 6.6 15.1 347 347 A G H X S+ 0 0 4 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.925 112.9 44.9 -64.4 -46.2 46.3 3.0 13.9 348 348 A V H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.916 113.0 49.5 -68.7 -41.1 43.7 4.0 11.4 349 349 A D H X S+ 0 0 53 -4,-2.9 4,-2.1 -5,-0.3 -1,-0.2 0.864 109.9 53.8 -65.9 -31.3 45.7 6.9 10.1 350 350 A G H X S+ 0 0 9 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.907 108.9 47.6 -65.0 -42.2 48.7 4.6 9.8 351 351 A A H X S+ 0 0 0 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.933 111.5 50.6 -63.8 -43.2 46.7 2.1 7.7 352 352 A I H X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.903 105.8 56.5 -63.7 -37.9 45.4 4.9 5.5 353 353 A N H X S+ 0 0 98 -4,-2.1 4,-0.6 1,-0.2 -1,-0.2 0.933 112.2 41.9 -61.5 -43.0 49.0 6.1 4.9 354 354 A E H >< S+ 0 0 60 -4,-1.9 3,-1.1 2,-0.2 4,-0.5 0.925 112.5 52.9 -70.4 -39.4 50.0 2.7 3.6 355 355 A I H >< S+ 0 0 0 -4,-3.0 3,-1.8 1,-0.3 7,-0.2 0.920 105.7 56.0 -60.2 -38.0 46.8 2.3 1.6 356 356 A L H 3< S+ 0 0 46 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.674 91.7 70.6 -70.6 -15.6 47.5 5.6 -0.1 357 357 A Q T << S- 0 0 157 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.773 128.8 -0.9 -67.7 -19.2 50.9 4.5 -1.2 358 358 A D S X> S+ 0 0 65 -3,-1.8 4,-1.6 -4,-0.5 3,-0.9 -0.319 74.6 171.5-169.9 62.9 49.1 2.2 -3.7 359 359 A P T 34 S+ 0 0 19 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 0.836 76.8 53.3 -62.1 -33.7 45.4 2.6 -3.3 360 360 A Q T 34 S+ 0 0 125 1,-0.2 -4,-0.1 -4,-0.1 -5,-0.0 0.838 124.6 23.1 -75.5 -24.6 44.4 0.5 -6.3 361 361 A N T <4 S+ 0 0 122 -3,-0.9 -1,-0.2 -6,-0.2 -6,-0.0 0.345 86.6 131.1-117.4 3.8 46.5 -2.5 -5.3 362 362 A A < - 0 0 22 -4,-1.6 2,-1.5 -7,-0.2 3,-0.2 -0.284 61.3-125.2 -67.1 149.9 46.9 -2.3 -1.6 363 363 A D > + 0 0 109 1,-0.2 4,-2.7 2,-0.1 5,-0.3 -0.678 34.9 177.7 -88.5 85.3 46.1 -5.3 0.6 364 364 A I H > S+ 0 0 14 -2,-1.5 4,-2.9 1,-0.2 5,-0.2 0.914 73.5 55.1 -63.0 -39.1 43.7 -3.5 2.7 365 365 A E H > S+ 0 0 75 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.935 112.0 41.7 -58.2 -49.6 42.8 -6.6 4.8 366 366 A G H > S+ 0 0 25 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.869 114.3 51.9 -70.3 -37.8 46.4 -7.3 5.8 367 367 A I H X S+ 0 0 20 -4,-2.7 4,-2.2 2,-0.2 5,-0.3 0.960 110.9 48.2 -59.1 -48.3 47.2 -3.7 6.4 368 368 A L H X S+ 0 0 0 -4,-2.9 4,-2.2 -5,-0.3 -2,-0.2 0.937 110.8 50.7 -62.2 -44.0 44.2 -3.4 8.7 369 369 A K H X S+ 0 0 103 -4,-2.5 4,-1.5 -5,-0.2 -1,-0.2 0.936 109.1 53.2 -56.4 -43.5 45.2 -6.6 10.5 370 370 A K H X S+ 0 0 98 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.910 113.0 42.1 -57.1 -42.0 48.7 -5.1 10.9 371 371 A Y H X S+ 0 0 25 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.730 103.7 65.1 -85.1 -20.8 47.3 -1.9 12.5 372 372 A Q H X S+ 0 0 10 -4,-2.2 4,-2.7 -5,-0.3 -1,-0.2 0.940 106.1 45.7 -58.6 -44.2 44.8 -3.6 14.6 373 373 A Q H X S+ 0 0 98 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.881 109.3 53.4 -70.6 -36.3 47.7 -5.2 16.5 374 374 A E H X S+ 0 0 71 -4,-1.3 4,-1.5 2,-0.2 -1,-0.2 0.925 110.9 47.2 -66.8 -38.5 49.6 -1.9 16.7 375 375 A I H >X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 3,-0.5 0.950 108.5 55.0 -63.7 -47.8 46.6 -0.3 18.3 376 376 A L H 3< S+ 0 0 57 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.843 112.5 44.7 -56.2 -30.5 46.2 -3.3 20.6 377 377 A N H 3< S+ 0 0 122 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.766 118.9 39.7 -86.3 -20.9 49.8 -2.7 21.7 378 378 A N H << S+ 0 0 100 -4,-1.5 -2,-0.2 -3,-0.5 -3,-0.2 0.631 84.3 117.3-105.1 -9.1 49.6 1.1 22.1 379 379 A M < 0 0 32 -4,-2.4 -39,-0.2 -5,-0.1 -38,-0.1 -0.324 360.0 360.0 -58.2 128.7 46.1 1.5 23.6 380 380 A Q 0 0 184 -41,-0.3 -38,-0.2 -2,-0.1 -37,-0.2 -0.961 360.0 360.0-147.3 360.0 46.1 3.0 27.1