==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING, METAL BINDING PROTEIN 10-MAY-05 1ZMG . COMPND 2 MOLECULE: MALTOSE-BINDING PERIPLASMIC PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR P.G.TELMER,B.H.SHILTON . 369 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16646.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 260 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 11.1 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 0.8 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 . 15 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 33.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.4 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 1 0 2 1 3 3 0 2 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 3 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 0 PARALLEL BRIDGES PER LADDER . 3 4 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 3 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 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 K 0 0 197 0, 0.0 2,-0.3 0, 0.0 55,-0.2 0.000 360.0 360.0 360.0 44.4 31.3 -21.4 -10.4 2 2 A I - 0 0 25 267,-0.2 53,-0.1 53,-0.1 56,-0.0 -0.753 360.0 -96.6-108.9 154.5 31.3 -17.6 -10.8 3 3 A E - 0 0 46 -2,-0.3 -1,-0.1 2,-0.0 4,-0.1 0.772 30.7-170.3 -26.2 -97.8 30.3 -15.5 -13.8 4 4 A E S S+ 0 0 131 2,-0.2 3,-0.1 268,-0.0 268,-0.1 0.762 75.7 45.5 84.7 99.7 33.1 -14.3 -16.0 5 5 A G S S+ 0 0 30 1,-0.4 29,-0.3 28,-0.0 2,-0.2 0.186 114.8 26.0 125.1 -14.3 31.6 -11.8 -18.3 6 6 A K S S- 0 0 71 27,-0.1 -1,-0.4 2,-0.0 2,-0.3 -0.585 74.7-105.4-147.2-149.6 29.6 -9.7 -16.0 7 7 A L E -a 35 0A 0 27,-1.1 29,-3.3 -2,-0.2 2,-0.5 -0.867 15.8-166.3-159.8 121.2 29.2 -8.5 -12.4 8 8 A V E -a 36 0A 15 -2,-0.3 50,-1.7 27,-0.2 51,-1.4 -0.927 14.8-163.1-109.5 134.8 26.8 -9.4 -9.6 9 9 A I E -ab 37 59A 0 27,-3.5 29,-2.8 -2,-0.5 2,-0.6 -0.971 9.0-156.2-124.2 129.9 26.6 -7.1 -6.6 10 10 A W E +ab 38 60A 26 49,-1.8 51,-2.0 -2,-0.4 2,-0.3 -0.916 25.8 158.4-107.3 121.6 25.2 -7.9 -3.2 11 11 A I - 0 0 4 27,-1.8 51,-0.1 -2,-0.6 2,-0.1 -0.966 46.1 -93.4-138.5 151.9 24.2 -4.9 -1.2 12 12 A N > - 0 0 57 -2,-0.3 3,-1.6 49,-0.2 5,-0.2 -0.390 32.6-123.8 -67.5 143.3 21.7 -4.4 1.7 13 13 A G T 3 S+ 0 0 41 1,-0.3 -1,-0.1 27,-0.2 4,-0.1 0.535 106.3 65.1 -65.4 -8.5 18.2 -3.4 0.7 14 14 A D T 3 S+ 0 0 86 2,-0.1 -1,-0.3 3,-0.0 2,-0.2 0.281 94.0 77.3 -97.2 10.8 18.2 -0.3 3.0 15 15 A K S < S- 0 0 76 -3,-1.6 2,-2.4 -4,-0.0 3,-0.1 -0.619 104.8 -83.3-110.2 171.8 21.0 1.2 0.8 16 16 A G > + 0 0 0 281,-0.6 4,-1.8 -2,-0.2 3,-0.4 -0.357 58.9 156.6 -77.0 65.3 20.8 2.9 -2.6 17 17 A Y T 4 S+ 0 0 76 -2,-2.4 4,-0.2 1,-0.2 -1,-0.2 0.514 70.8 59.9 -68.8 -1.5 20.9 -0.3 -4.6 18 18 A N T > S+ 0 0 80 2,-0.2 4,-2.2 275,-0.1 -1,-0.2 0.848 105.7 41.5 -91.4 -44.8 19.2 1.7 -7.4 19 19 A G H > S+ 0 0 5 -3,-0.4 4,-3.2 2,-0.3 274,-0.3 0.796 113.2 56.0 -71.4 -27.6 21.8 4.4 -7.9 20 20 A L H X S+ 0 0 1 -4,-1.8 4,-0.9 2,-0.2 -1,-0.2 0.856 109.7 46.6 -67.5 -34.6 24.3 1.5 -7.6 21 21 A A H > S+ 0 0 33 -4,-0.2 4,-1.7 -5,-0.2 -2,-0.3 0.844 110.2 52.6 -73.2 -38.2 22.3 0.1 -10.4 22 22 A E H >X S+ 0 0 107 -4,-2.2 4,-1.4 2,-0.2 3,-0.5 0.963 106.0 51.4 -62.0 -52.6 22.4 3.4 -12.3 23 23 A V H 3X S+ 0 0 12 -4,-3.2 4,-1.7 1,-0.3 -1,-0.2 0.840 107.5 58.2 -53.3 -30.8 26.2 3.6 -12.0 24 24 A G H 3X S+ 0 0 2 -4,-0.9 4,-3.1 1,-0.2 -1,-0.3 0.926 98.2 56.6 -65.0 -44.5 25.9 0.1 -13.4 25 25 A K H S+ 0 0 0 -4,-1.7 4,-3.0 -5,-0.2 5,-0.6 0.965 111.0 49.4 -59.6 -50.1 29.4 0.9 -16.9 28 28 A E H X5S+ 0 0 88 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.890 109.8 50.4 -55.9 -44.1 27.4 -1.2 -19.3 29 29 A K H <5S+ 0 0 161 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.844 118.2 38.9 -64.3 -34.4 27.2 1.6 -21.9 30 30 A D H <5S+ 0 0 91 -4,-2.0 -2,-0.2 -3,-0.3 -1,-0.2 0.785 134.8 19.5 -86.7 -31.1 31.0 2.1 -21.7 31 31 A T H <5S- 0 0 66 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.650 92.6-128.0-112.1 -23.1 32.1 -1.5 -21.4 32 32 A G << + 0 0 54 -4,-2.4 2,-0.5 -5,-0.6 -4,-0.2 0.409 66.2 132.1 87.2 -2.4 29.1 -3.4 -22.7 33 33 A I - 0 0 34 -6,-0.4 -1,-0.3 -9,-0.1 2,-0.3 -0.737 54.8-131.2 -89.2 127.0 29.2 -5.5 -19.5 34 34 A K - 0 0 105 -2,-0.5 -27,-1.1 -29,-0.3 2,-0.4 -0.566 16.7-152.5 -80.0 136.1 25.9 -5.9 -17.7 35 35 A V E -a 7 0A 28 -2,-0.3 2,-0.5 -29,-0.2 -27,-0.2 -0.895 3.9-158.5-110.8 136.3 25.8 -5.3 -13.9 36 36 A T E -a 8 0A 46 -29,-3.3 -27,-3.5 -2,-0.4 2,-0.6 -0.962 1.6-163.8-119.9 124.7 23.3 -7.0 -11.6 37 37 A V E +a 9 0A 30 -2,-0.5 2,-0.3 -29,-0.2 -27,-0.2 -0.915 17.3 174.2-108.4 112.8 22.4 -5.6 -8.2 38 38 A E E -a 10 0A 92 -29,-2.8 -27,-1.8 -2,-0.6 -2,-0.0 -0.815 24.8-157.2-117.4 159.2 20.7 -8.1 -5.8 39 39 A H - 0 0 103 -2,-0.3 -26,-0.1 -29,-0.2 3,-0.1 -0.501 18.7-172.1-131.7 63.2 19.6 -7.9 -2.2 40 40 A P > - 0 0 34 0, 0.0 3,-0.8 0, 0.0 -27,-0.2 -0.147 39.0 -90.5 -56.5 154.3 19.3 -11.4 -0.8 41 41 A D T 3 S- 0 0 131 1,-0.3 5,-0.1 2,-0.1 -29,-0.0 -0.445 105.9 -3.6 -66.3 136.3 17.8 -11.8 2.7 42 42 A K T >> S+ 0 0 114 -2,-0.1 3,-1.2 1,-0.1 4,-0.6 0.911 77.8 174.9 46.1 58.4 20.5 -11.6 5.4 43 43 A L H <> + 0 0 4 -3,-0.8 4,-2.2 1,-0.2 3,-0.2 0.700 65.7 73.0 -68.3 -22.2 23.4 -11.4 3.0 44 44 A E H 34 S+ 0 0 42 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.777 105.8 40.0 -63.9 -22.9 26.1 -10.9 5.7 45 45 A E H <> S+ 0 0 103 -3,-1.2 4,-0.7 2,-0.1 -1,-0.2 0.622 113.5 52.9 -99.0 -18.0 25.6 -14.6 6.5 46 46 A K H X S+ 0 0 68 -4,-0.6 4,-3.1 2,-0.2 5,-0.4 0.896 96.9 62.8 -85.0 -43.8 25.2 -15.9 3.0 47 47 A F H X S+ 0 0 1 -4,-2.2 4,-3.3 1,-0.3 5,-0.3 0.913 105.0 49.7 -46.1 -50.3 28.4 -14.4 1.5 48 48 A P H > S+ 0 0 43 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.882 114.7 44.3 -57.3 -40.7 30.5 -16.5 3.9 49 49 A Q H < S+ 0 0 136 -4,-0.7 4,-0.3 -3,-0.4 -2,-0.2 0.961 121.1 37.4 -68.4 -53.4 28.5 -19.7 3.0 50 50 A V H ><>S+ 0 0 40 -4,-3.1 5,-2.1 1,-0.2 3,-0.9 0.844 114.9 52.4 -70.1 -36.8 28.5 -19.2 -0.7 51 51 A A H ><5S+ 0 0 8 -4,-3.3 3,-1.4 -5,-0.4 -1,-0.2 0.760 96.6 68.6 -73.4 -23.1 32.1 -17.7 -1.1 52 52 A A T 3<5S+ 0 0 75 -4,-0.9 -1,-0.2 -5,-0.3 -2,-0.2 0.717 103.6 45.5 -67.8 -18.0 33.6 -20.6 0.8 53 53 A T T < 5S- 0 0 100 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.2 0.265 126.6 -96.0-106.8 9.4 32.7 -22.9 -2.2 54 54 A G T < 5S+ 0 0 21 -3,-1.4 -3,-0.2 1,-0.3 2,-0.2 0.667 92.9 103.2 85.1 17.6 33.9 -20.5 -4.9 55 55 A D < + 0 0 42 -5,-2.1 -1,-0.3 -8,-0.1 214,-0.1 -0.561 36.5 70.6-120.8-174.8 30.5 -19.0 -5.5 56 56 A G S S- 0 0 23 -55,-0.2 2,-0.1 -2,-0.2 -48,-0.1 -0.688 82.4 -24.2 107.3-160.3 28.6 -15.8 -4.8 57 57 A P - 0 0 0 0, 0.0 -48,-0.2 0, 0.0 213,-0.2 -0.384 45.1-128.6 -87.2 166.7 28.9 -12.2 -6.1 58 58 A D S S+ 0 0 0 -50,-1.7 209,-2.1 1,-0.2 2,-0.4 0.798 97.3 30.0 -82.1 -33.1 32.0 -10.5 -7.5 59 59 A I E -bC 9 266A 1 -51,-1.4 -49,-1.8 207,-0.2 2,-0.4 -0.986 67.3-165.9-130.6 139.9 31.6 -7.6 -5.1 60 60 A I E -bC 10 265A 0 205,-1.6 205,-1.9 -2,-0.4 2,-0.4 -0.981 8.8-151.5-126.3 135.8 30.1 -7.4 -1.6 61 61 A F E + C 0 264A 5 -51,-2.0 2,-0.3 -2,-0.4 203,-0.2 -0.916 38.7 115.5-108.1 133.9 29.2 -4.2 0.3 62 62 A W E - C 0 263A 40 201,-1.9 201,-3.4 -2,-0.4 -2,-0.1 -0.974 65.3 -57.8 178.9 169.5 29.3 -4.1 4.0 63 63 A H E > - C 0 262A 62 -2,-0.3 3,-0.8 199,-0.2 4,-0.3 -0.361 48.7-126.9 -61.1 141.4 30.8 -2.7 7.3 64 64 A H T >> S+ 0 0 0 197,-1.0 3,-1.2 1,-0.2 4,-0.6 0.678 97.5 78.0 -67.6 -22.2 34.6 -3.3 7.4 65 65 A D H >> S+ 0 0 45 1,-0.3 3,-0.8 2,-0.2 4,-0.5 0.882 93.9 50.0 -57.6 -39.1 34.6 -5.0 10.8 66 66 A H H <> S+ 0 0 77 -3,-0.8 4,-1.5 1,-0.2 -1,-0.3 0.632 97.1 75.6 -72.0 -15.2 33.4 -8.3 9.3 67 67 A F H <> S+ 0 0 1 -3,-1.2 4,-1.8 -4,-0.3 -1,-0.2 0.760 82.8 61.3 -71.6 -25.9 36.1 -8.0 6.7 68 68 A G H <>S+ 0 0 17 -4,-1.5 5,-2.1 1,-0.2 3,-0.6 0.899 110.4 46.2 -55.9 -41.6 36.7 -12.8 5.7 71 71 A A H ><5S+ 0 0 20 -4,-1.8 3,-1.9 1,-0.2 -1,-0.2 0.784 99.6 64.6 -73.2 -29.4 40.4 -12.3 5.1 72 72 A Q H 3<5S+ 0 0 93 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.779 110.0 44.3 -64.3 -21.0 41.5 -14.7 7.9 73 73 A S T <<5S- 0 0 88 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.235 113.8-120.1-102.5 6.8 39.7 -17.2 5.5 74 74 A G T < 5S+ 0 0 52 -3,-1.9 -3,-0.2 1,-0.1 -2,-0.1 0.858 70.9 133.8 55.9 39.0 41.2 -15.9 2.3 75 75 A L < + 0 0 22 -5,-2.1 193,-3.2 -6,-0.1 194,-0.4 0.672 57.4 61.8 -90.5 -20.5 37.8 -15.0 0.8 76 76 A L B S-F 267 0B 17 191,-0.3 2,-0.4 -6,-0.2 191,-0.2 -0.601 80.4-121.4-104.4 165.7 38.8 -11.6 -0.4 77 77 A A - 0 0 14 189,-1.5 2,-0.9 27,-0.2 189,-0.4 -0.848 28.8-110.6-106.9 143.4 41.4 -10.5 -2.9 78 78 A E - 0 0 104 -2,-0.4 26,-0.2 190,-0.1 25,-0.1 -0.613 39.8-138.6 -73.5 108.5 44.3 -8.1 -2.1 79 79 A I - 0 0 11 -2,-0.9 24,-0.2 24,-0.6 26,-0.0 -0.132 7.6-145.7 -63.1 165.2 43.4 -5.0 -3.9 80 80 A T + 0 0 89 24,-0.0 -1,-0.1 2,-0.0 2,-0.1 -0.273 27.5 160.9-134.6 55.5 46.1 -3.0 -5.8 81 81 A P - 0 0 12 0, 0.0 2,-0.1 0, 0.0 22,-0.1 -0.426 34.0-128.7 -73.0 153.5 45.8 0.7 -5.8 82 82 A D > - 0 0 88 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.324 32.1 -89.1 -90.6 179.6 48.9 2.7 -6.7 83 83 A K H > S+ 0 0 178 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.936 126.0 49.0 -53.9 -50.2 50.5 5.6 -4.7 84 84 A A H >4 S+ 0 0 55 1,-0.2 3,-0.6 2,-0.2 -1,-0.2 0.913 110.8 47.3 -58.1 -49.7 48.5 8.2 -6.7 85 85 A F H >4 S+ 0 0 13 1,-0.2 3,-2.0 2,-0.2 4,-0.4 0.904 107.9 57.1 -61.4 -41.2 45.1 6.5 -6.3 86 86 A Q H >< S+ 0 0 66 -4,-2.3 3,-1.0 1,-0.3 -1,-0.2 0.787 97.4 63.2 -60.4 -27.6 45.7 6.0 -2.5 87 87 A D T << S+ 0 0 117 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.338 88.1 72.0 -80.5 10.1 46.2 9.8 -2.2 88 88 A K T < S+ 0 0 111 -3,-2.0 217,-1.8 2,-0.1 218,-0.4 0.646 96.9 55.0 -93.3 -20.7 42.5 10.3 -3.3 89 89 A L B < S-G 304 0C 1 -3,-1.0 215,-0.2 -4,-0.4 214,-0.1 -0.738 101.3 -84.7-112.3 162.7 41.2 9.0 0.0 90 90 A Y >> - 0 0 37 213,-1.3 3,-3.1 -2,-0.3 4,-0.7 -0.485 38.0-127.0 -68.8 121.8 41.8 9.9 3.7 91 91 A P H >> S+ 0 0 93 0, 0.0 3,-1.0 0, 0.0 4,-0.7 0.799 106.0 58.1 -33.8 -47.7 44.9 8.1 5.0 92 92 A F H 3> S+ 0 0 39 1,-0.2 4,-0.7 2,-0.2 -2,-0.1 0.652 94.7 63.7 -66.4 -16.8 43.0 6.7 8.0 93 93 A T H <4 S+ 0 0 0 -3,-3.1 4,-0.5 1,-0.2 -1,-0.2 0.793 95.7 59.3 -78.1 -25.6 40.4 4.9 5.9 94 94 A W H X< S+ 0 0 8 -3,-1.0 3,-0.8 -4,-0.7 -1,-0.2 0.825 98.6 58.2 -69.4 -29.9 43.1 2.6 4.4 95 95 A D H >< S+ 0 0 53 -4,-0.7 3,-1.2 1,-0.2 -1,-0.2 0.850 99.3 59.9 -66.6 -31.8 44.0 1.4 7.9 96 96 A A T 3< S+ 0 0 2 -4,-0.7 -1,-0.2 1,-0.3 -2,-0.2 0.687 107.7 45.1 -68.3 -20.4 40.3 0.3 8.2 97 97 A V T < S+ 0 0 2 -3,-0.8 7,-2.5 -4,-0.5 8,-0.5 -0.156 93.3 110.7-117.2 38.5 40.8 -2.0 5.2 98 98 A R E < +H 103 0D 93 -3,-1.2 2,-0.3 5,-0.2 5,-0.2 -0.707 37.1 178.3-110.9 163.2 44.1 -3.6 6.2 99 99 A Y E > S-H 102 0D 51 3,-1.0 3,-3.5 -2,-0.2 76,-0.1 -0.874 70.2 -15.9-166.1 128.5 45.2 -7.0 7.2 100 100 A N T 3 S- 0 0 94 1,-0.3 75,-0.1 -2,-0.3 3,-0.1 0.837 132.8 -47.1 41.0 40.6 48.6 -8.5 8.1 101 101 A G T 3 S+ 0 0 65 73,-0.7 2,-0.4 1,-0.2 -1,-0.3 0.524 120.1 106.3 84.3 5.9 50.1 -5.5 6.4 102 102 A K E < -H 99 0D 100 -3,-3.5 -3,-1.0 72,-0.2 2,-0.2 -0.955 67.5-118.9-131.8 145.0 47.9 -5.7 3.3 103 103 A L E +H 98 0D 30 -2,-0.4 -24,-0.6 -5,-0.2 -5,-0.2 -0.492 31.8 165.5 -72.0 134.6 44.9 -3.9 1.7 104 104 A I + 0 0 10 -7,-2.5 162,-0.3 -26,-0.2 2,-0.3 0.322 54.2 25.0-135.8 8.7 41.7 -5.9 1.2 105 105 A A - 0 0 0 -8,-0.5 160,-0.2 160,-0.1 -1,-0.2 -0.986 68.5-109.4-164.9 166.4 38.8 -3.6 0.4 106 106 A Y E -D 264 0A 1 158,-1.7 158,-1.8 -2,-0.3 2,-0.2 -0.931 32.4-128.9-109.6 119.9 37.7 -0.2 -0.9 107 107 A P E +D 263 0A 0 0, 0.0 156,-0.2 0, 0.0 196,-0.1 -0.467 37.7 161.3 -65.9 129.5 36.4 2.4 1.6 108 108 A I E + 0 0 4 154,-3.3 195,-1.5 1,-0.4 196,-0.4 0.719 57.9 17.7-111.8 -70.1 33.0 3.7 0.5 109 109 A A E -DE 262 302A 2 153,-1.0 153,-1.8 193,-0.2 2,-0.5 -0.799 61.1-149.6-110.9 151.6 31.1 5.3 3.3 110 110 A V E -DE 261 301A 1 191,-3.3 191,-0.9 -2,-0.3 2,-0.3 -0.974 17.4-175.7-121.8 121.7 32.3 6.5 6.8 111 111 A M E +D 260 0A 47 149,-3.4 149,-2.2 -2,-0.5 2,-0.3 -0.856 13.3 148.6-119.6 156.2 30.0 6.5 9.8 112 112 A A - 0 0 6 -2,-0.3 212,-0.1 147,-0.2 147,-0.1 -0.892 45.5 -92.8-175.0 148.4 30.3 7.6 13.4 113 113 A L - 0 0 6 145,-0.3 2,-0.3 -2,-0.3 134,-0.2 -0.090 39.8-171.5 -64.0 167.1 27.9 9.0 16.1 114 114 A S E -I 227 0E 2 113,-0.9 113,-1.7 132,-0.1 2,-0.5 -0.960 30.4 -97.1-152.7 167.0 27.3 12.7 16.6 115 115 A L E -IJ 226 245E 4 130,-1.6 130,-2.0 -2,-0.3 2,-0.4 -0.803 38.8-165.4 -92.4 128.3 25.6 15.0 19.1 116 116 A I E -IJ 225 244E 1 109,-3.2 109,-2.0 -2,-0.5 2,-0.3 -0.937 10.0-177.7-115.8 139.1 22.1 16.0 18.0 117 117 A Y E -IJ 224 243E 30 126,-2.4 126,-1.3 -2,-0.4 2,-0.8 -0.975 33.4-116.3-144.1 155.0 20.2 18.9 19.5 118 118 A N E >> - 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0 0 96 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.065 21.2-163.1 -46.6 135.5 21.7 8.8 1.4 299 299 A L - 0 0 22 1,-0.3 2,-0.6 -9,-0.2 -69,-0.1 0.768 21.6-143.1 -92.8 -32.3 25.1 7.5 2.3 300 300 A G + 0 0 5 -71,-0.1 2,-0.3 -6,-0.1 -1,-0.3 -0.914 63.1 2.2 104.9-120.8 26.2 10.0 5.0 301 301 A A E S-E 110 0A 0 -191,-0.9 -191,-3.3 -2,-0.6 2,-0.2 -0.812 70.9-148.4-106.4 148.2 29.9 10.9 4.9 302 302 A V E -E 109 0A 0 -2,-0.3 -193,-0.2 -193,-0.3 -194,-0.1 -0.679 21.1-135.3-116.6 168.4 32.5 9.5 2.4 303 303 A A S S+ 0 0 0 -195,-1.5 -213,-1.3 -2,-0.2 2,-0.9 0.557 77.7 98.1 -93.7 -12.6 36.1 8.6 2.1 304 304 A L B > -G 89 0C 10 -196,-0.4 4,-2.5 -215,-0.2 3,-0.4 -0.711 64.7-152.0 -83.2 109.3 36.7 10.3 -1.3 305 305 A K H > S+ 0 0 67 -217,-1.8 4,-2.2 -2,-0.9 3,-0.3 0.904 89.1 53.6 -42.5 -63.6 38.3 13.7 -0.5 306 306 A S H 4 S+ 0 0 51 -218,-0.4 4,-0.3 1,-0.2 -1,-0.2 0.853 118.4 34.6 -44.2 -49.4 37.1 15.5 -3.6 307 307 A Y H >> S+ 0 0 20 -3,-0.4 4,-2.3 1,-0.2 3,-0.5 0.744 110.4 62.7 -81.2 -25.6 33.4 14.6 -3.0 308 308 A E H 3X S+ 0 0 6 -4,-2.5 4,-2.6 -3,-0.3 -2,-0.2 0.874 98.1 58.2 -65.9 -35.3 33.6 14.8 0.8 309 309 A E H 3< S+ 0 0 138 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.768 110.1 44.9 -66.3 -22.7 34.5 18.4 0.5 310 310 A E H X4 S+ 0 0 104 -3,-0.5 3,-1.1 -4,-0.3 -2,-0.2 0.871 113.7 45.0 -87.7 -43.0 31.2 18.9 -1.4 311 311 A L H >< S+ 0 0 21 -4,-2.3 3,-2.3 1,-0.3 6,-0.3 0.872 98.1 75.9 -66.3 -35.2 28.9 16.8 0.9 312 312 A A T 3< + 0 0 35 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.1 0.315 69.5 87.2 -59.8 10.6 30.5 18.5 3.8 313 313 A K T < S+ 0 0 162 -3,-1.1 -1,-0.3 1,-0.1 -2,-0.1 0.500 76.4 75.3 -86.4 -8.3 28.4 21.6 2.9 314 314 A D S X> S- 0 0 41 -3,-2.3 4,-1.9 1,-0.1 3,-1.9 -0.926 80.8-148.7-100.6 107.8 25.8 20.0 5.1 315 315 A P H 3> S+ 0 0 89 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.824 95.9 65.2 -45.9 -35.2 26.9 20.6 8.7 316 316 A R H 3> S+ 0 0 68 1,-0.2 4,-1.1 2,-0.2 -4,-0.1 0.902 110.2 38.0 -55.2 -40.7 25.3 17.3 9.7 317 317 A I H <> S+ 0 0 11 -3,-1.9 4,-2.0 -6,-0.3 -1,-0.2 0.868 111.2 55.9 -79.3 -40.0 27.8 15.5 7.5 318 318 A A H X S+ 0 0 40 -4,-1.9 4,-2.1 -7,-0.2 -2,-0.2 0.906 108.4 51.8 -59.1 -38.7 30.9 17.7 8.3 319 319 A A H X S+ 0 0 6 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.907 104.8 55.5 -63.4 -43.3 30.3 16.8 11.9 320 320 A T H X S+ 0 0 1 -4,-1.1 4,-1.5 -5,-0.2 -2,-0.2 0.937 110.1 45.0 -55.7 -51.4 30.2 13.1 11.2 321 321 A M H X S+ 0 0 10 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.911 111.9 51.4 -61.7 -44.9 33.6 13.2 9.5 322 322 A E H X S+ 0 0 86 -4,-2.1 4,-0.6 1,-0.3 -1,-0.2 0.895 110.1 49.9 -60.7 -38.6 35.2 15.3 12.2 323 323 A N H X S+ 0 0 2 -4,-2.5 4,-0.8 1,-0.2 -1,-0.3 0.816 111.0 51.4 -68.6 -28.6 33.9 12.9 14.8 324 324 A A H < S+ 0 0 1 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.849 102.7 56.5 -76.7 -35.8 35.4 10.1 12.8 325 325 A Q H < S+ 0 0 116 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.654 113.0 43.1 -71.0 -13.5 38.9 11.6 12.5 326 326 A K H < S+ 0 0 81 -4,-0.6 -1,-0.2 -3,-0.2 -2,-0.2 0.598 104.0 85.4-103.4 -17.6 39.1 11.7 16.2 327 327 A G S < S- 0 0 13 -4,-0.8 2,-0.6 -3,-0.1 -69,-0.2 -0.042 83.8 -97.1 -79.9-177.9 37.6 8.3 16.9 328 328 A E E -p 258 0I 20 -71,-2.1 -69,-1.8 -72,-0.2 -1,-0.1 -0.888 37.4-117.5-104.9 120.4 39.1 4.8 17.0 329 329 A I E -p 259 0I 31 -2,-0.6 -69,-0.1 -71,-0.2 -71,-0.1 -0.354 37.6-107.9 -56.2 127.2 38.8 2.7 13.9 330 330 A M - 0 0 14 -71,-1.9 2,-0.2 1,-0.1 -1,-0.1 -0.382 38.2-113.2 -57.6 127.2 36.6 -0.4 14.7 331 331 A P - 0 0 0 0, 0.0 2,-1.1 0, 0.0 5,-0.1 -0.473 17.3-142.5 -67.2 131.8 39.0 -3.4 14.9 332 332 A N + 0 0 10 -2,-0.2 -2,-0.0 -234,-0.1 -267,-0.0 -0.381 62.4 111.2 -93.3 56.8 38.3 -5.9 12.0 333 333 A I S > S- 0 0 16 -2,-1.1 3,-2.1 -265,-0.1 4,-0.1 -0.967 76.1-120.5-130.5 147.1 38.9 -9.0 14.1 334 334 A P T > S+ 0 0 69 0, 0.0 3,-1.3 0, 0.0 4,-0.3 0.677 105.6 73.8 -57.1 -19.3 36.5 -11.7 15.3 335 335 A Q T >> S+ 0 0 65 1,-0.3 4,-1.7 2,-0.2 3,-0.6 0.628 70.5 86.0 -73.0 -11.1 37.5 -11.0 18.9 336 336 A M H <> S+ 0 0 16 -3,-2.1 4,-2.9 1,-0.2 -1,-0.3 0.699 81.9 63.3 -61.7 -16.5 35.4 -7.8 18.8 337 337 A S H <> S+ 0 0 85 -3,-1.3 4,-2.8 2,-0.2 5,-0.3 0.911 99.7 50.4 -71.2 -43.9 32.5 -10.0 19.8 338 338 A A H <> S+ 0 0 34 -3,-0.6 4,-2.7 -4,-0.3 5,-0.2 0.923 112.9 49.8 -57.3 -42.9 34.2 -10.8 23.1 339 339 A F H X S+ 0 0 0 -4,-1.7 4,-2.8 2,-0.2 5,-0.3 0.958 111.7 43.8 -62.4 -55.5 34.6 -7.0 23.4 340 340 A E H X S+ 0 0 75 -4,-2.9 4,-2.3 1,-0.2 5,-0.2 0.919 116.4 48.5 -59.7 -41.5 31.0 -6.0 22.7 341 341 A Y H X S+ 0 0 135 -4,-2.8 4,-1.6 2,-0.2 -2,-0.2 0.964 115.9 42.5 -61.2 -53.3 29.6 -8.9 24.9 342 342 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 -5,-0.3 -2,-0.2 0.892 117.6 44.7 -61.6 -45.7 31.9 -8.0 27.8 343 343 A V H X S+ 0 0 8 -4,-2.8 4,-2.8 -5,-0.2 5,-0.3 0.869 107.9 57.0 -69.5 -38.7 31.5 -4.2 27.7 344 344 A R H X S+ 0 0 79 -4,-2.3 4,-1.7 -5,-0.3 -1,-0.2 0.910 113.3 42.3 -58.6 -42.2 27.7 -4.3 27.2 345 345 A T H X S+ 0 0 38 -4,-1.6 4,-3.3 -5,-0.2 5,-0.4 0.934 111.2 54.0 -69.6 -49.3 27.5 -6.2 30.4 346 346 A A H X S+ 0 0 3 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.927 112.1 44.9 -52.2 -49.5 30.1 -4.1 32.3 347 347 A V H X S+ 0 0 11 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.886 114.9 48.4 -63.7 -39.8 28.1 -0.9 31.5 348 348 A I H X S+ 0 0 58 -4,-1.7 4,-1.2 -5,-0.3 6,-0.2 0.951 114.2 44.3 -66.1 -49.1 24.8 -2.5 32.4 349 349 A N H X S+ 0 0 27 -4,-3.3 6,-1.5 1,-0.2 4,-1.3 0.862 114.5 50.2 -65.2 -34.3 25.9 -3.9 35.7 350 350 A A H < S+ 0 0 7 -4,-2.3 -1,-0.2 -5,-0.4 -2,-0.2 0.849 112.1 47.5 -72.1 -31.8 27.7 -0.7 36.6 351 351 A A H < S+ 0 0 25 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.646 113.2 48.3 -83.1 -15.4 24.6 1.4 35.8 352 352 A S H < S- 0 0 77 -4,-1.2 -2,-0.2 -5,-0.1 -1,-0.2 0.679 113.5-113.5 -95.5 -22.0 22.3 -0.9 37.8 353 353 A G S < S+ 0 0 59 -4,-1.3 -3,-0.1 2,-0.3 -4,-0.1 0.048 84.4 120.5 110.5 -23.0 24.6 -1.0 40.8 354 354 A R S S+ 0 0 195 -5,-0.2 2,-0.3 -6,-0.2 -4,-0.2 0.676 83.5 12.7 -45.7 -26.8 25.3 -4.7 40.4 355 355 A Q S S- 0 0 39 -6,-1.5 -2,-0.3 -9,-0.1 2,-0.2 -0.989 76.7-117.2-151.8 154.6 29.1 -3.8 40.2 356 356 A T > - 0 0 70 -2,-0.3 4,-2.8 1,-0.1 3,-0.3 -0.487 39.2-106.2 -85.9 163.6 31.4 -0.8 40.8 357 357 A V H > S+ 0 0 18 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.944 119.3 51.2 -55.1 -53.3 33.3 0.6 37.8 358 358 A D H > S+ 0 0 91 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.806 114.9 43.1 -55.6 -34.6 36.6 -0.8 38.9 359 359 A E H > S+ 0 0 102 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.893 112.3 51.9 -79.2 -43.4 35.1 -4.3 39.3 360 360 A A H X S+ 0 0 1 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.904 112.8 44.5 -60.3 -43.7 33.0 -4.2 36.1 361 361 A L H X S+ 0 0 11 -4,-2.6 4,-1.8 -5,-0.2 -1,-0.2 0.728 108.5 58.0 -75.9 -20.9 36.0 -3.2 33.9 362 362 A K H X S+ 0 0 112 -4,-0.6 4,-2.0 -5,-0.3 -1,-0.2 0.916 108.4 46.5 -73.1 -41.4 38.3 -5.8 35.6 363 363 A D H X S+ 0 0 47 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.947 114.3 44.8 -63.8 -52.6 35.9 -8.6 34.6 364 364 A A H X S+ 0 0 1 -4,-1.9 4,-3.2 2,-0.2 5,-0.3 0.964 111.5 54.1 -55.6 -54.8 35.4 -7.5 31.0 365 365 A Q H X S+ 0 0 30 -4,-1.8 4,-2.4 1,-0.3 -1,-0.2 0.904 113.6 41.8 -44.4 -53.5 39.2 -6.9 30.6 366 366 A T H < S+ 0 0 89 -4,-2.0 -1,-0.3 2,-0.2 -2,-0.2 0.854 113.6 54.8 -65.0 -37.5 40.0 -10.4 31.8 367 367 A R H < S+ 0 0 121 -4,-2.7 -2,-0.2 2,-0.2 -1,-0.2 0.976 113.3 39.9 -58.4 -58.5 37.1 -11.7 29.7 368 368 A I H < 0 0 18 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.954 360.0 360.0 -57.2 -59.1 38.3 -10.2 26.4 369 369 A T < 0 0 52 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.563 360.0 360.0 -64.8 360.0 42.0 -10.9 26.9