==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 08-SEP-08 3EF7 . COMPND 2 MOLECULE: MALTOSE-BINDING PERIPLASMIC PROTEIN, LINKER, ZONA . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI, UNDEFINED, MUS MUSCU . AUTHOR M.MONNE,L.JOVINE . 934 4 4 2 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39533.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 668 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 158 16.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.3 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 . 72 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 102 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 256 27.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.2 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 6 0 5 3 2 3 5 2 1 0 2 4 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 3 1 1 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 PARALLEL BRIDGES PER LADDER . 7 7 4 8 6 0 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 5 4 5 1 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 M 0 0 79 0, 0.0 55,-0.1 0, 0.0 54,-0.0 0.000 360.0 360.0 360.0 136.4 -16.5 -20.4 32.5 2 2 A K + 0 0 53 1,-0.1 2,-0.9 55,-0.1 54,-0.1 0.936 360.0 77.7 -60.9 -44.7 -14.7 -18.4 35.1 3 3 A T + 0 0 10 54,-0.7 2,-0.2 52,-0.2 -1,-0.1 -0.562 68.3 173.4 -71.1 100.9 -12.9 -21.6 35.7 4 4 A E > - 0 0 30 -2,-0.9 3,-0.7 3,-0.3 2,-0.4 -0.460 36.9 -90.3 -98.2 176.7 -10.3 -22.1 32.9 5 5 A E T 3 S+ 0 0 146 1,-0.2 268,-0.1 -2,-0.2 3,-0.1 -0.757 106.4 14.0 -97.4 140.0 -7.6 -24.7 32.6 6 6 A G T 3 S+ 0 0 41 -2,-0.4 29,-0.5 266,-0.1 2,-0.3 0.698 112.5 91.8 70.3 23.0 -4.1 -24.2 34.0 7 7 A K < - 0 0 62 -3,-0.7 -3,-0.3 27,-0.2 2,-0.3 -0.963 64.8-141.5-151.9 131.0 -5.5 -21.2 36.0 8 8 A L E -a 36 0A 0 27,-2.1 29,-2.3 -2,-0.3 2,-0.4 -0.722 12.3-172.7 -98.7 139.9 -6.9 -20.9 39.6 9 9 A V E -a 37 0A 9 -2,-0.3 50,-2.5 27,-0.2 51,-1.7 -0.986 7.5-169.3-132.4 120.1 -9.8 -18.6 40.6 10 10 A I E -ab 38 60A 0 27,-2.9 29,-3.1 -2,-0.4 2,-0.5 -0.905 10.1-156.8-117.4 138.1 -10.7 -18.1 44.3 11 11 A W E +ab 39 61A 2 49,-2.7 51,-3.2 -2,-0.4 2,-0.4 -0.962 20.6 167.2-112.9 122.4 -13.8 -16.5 45.8 12 12 A I E - b 0 62A 4 27,-1.6 51,-0.1 -2,-0.5 6,-0.1 -0.980 42.9 -93.7-134.0 145.6 -13.5 -15.2 49.4 13 13 A N > - 0 0 33 49,-0.5 3,-1.7 -2,-0.4 5,-0.1 -0.282 36.4-118.3 -60.0 142.8 -15.8 -12.9 51.3 14 14 A G T 3 S+ 0 0 28 27,-0.3 4,-0.3 1,-0.3 -1,-0.1 0.754 108.6 58.8 -54.6 -32.8 -14.9 -9.3 51.1 15 15 A D T 3 S+ 0 0 40 2,-0.1 -1,-0.3 3,-0.1 -2,-0.1 0.694 93.1 83.5 -74.7 -16.6 -14.3 -8.9 54.9 16 16 A K S < S- 0 0 24 -3,-1.7 2,-1.7 1,-0.1 3,-0.2 -0.065 102.7 -79.1 -79.6-179.0 -11.6 -11.6 55.0 17 17 A G > + 0 0 1 281,-0.4 4,-1.2 1,-0.2 280,-0.1 -0.588 63.3 155.3 -85.4 79.4 -7.9 -11.2 54.2 18 18 A Y H > + 0 0 75 -2,-1.7 4,-1.6 -4,-0.3 -1,-0.2 0.924 69.2 49.4 -76.7 -46.1 -8.1 -11.3 50.4 19 19 A N H > S+ 0 0 86 -3,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.840 110.5 52.9 -60.7 -36.7 -4.9 -9.4 49.5 20 20 A G H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.832 107.0 50.8 -68.4 -35.4 -2.9 -11.6 51.9 21 21 A L H X S+ 0 0 2 -4,-1.2 4,-1.0 2,-0.2 -1,-0.2 0.814 105.7 58.7 -65.8 -32.1 -4.3 -14.7 50.2 22 22 A A H X S+ 0 0 28 -4,-1.6 4,-3.0 2,-0.2 -2,-0.2 0.842 101.7 52.4 -64.1 -36.2 -3.1 -13.0 47.0 23 23 A E H X S+ 0 0 101 -4,-1.3 4,-2.1 2,-0.3 -1,-0.2 0.898 109.0 49.0 -65.2 -42.1 0.4 -13.0 48.3 24 24 A V H < S+ 0 0 2 -4,-1.5 -2,-0.2 2,-0.2 -1,-0.2 0.729 111.2 54.8 -67.3 -23.7 0.0 -16.7 49.0 25 25 A G H >X S+ 0 0 2 -4,-1.0 3,-2.3 2,-0.2 4,-1.1 0.970 106.7 45.6 -66.4 -59.1 -1.2 -16.7 45.4 26 26 A K H 3X S+ 0 0 134 -4,-3.0 4,-2.6 1,-0.3 3,-0.5 0.847 107.4 58.6 -59.3 -34.8 1.8 -15.0 43.9 27 27 A K H 3< S+ 0 0 93 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.608 106.2 51.2 -68.0 -12.0 4.2 -17.3 45.9 28 28 A F H <> S+ 0 0 2 -3,-2.3 4,-0.7 -5,-0.1 6,-0.4 0.637 109.3 48.9 -96.4 -21.5 2.4 -20.2 44.0 29 29 A E H >X S+ 0 0 56 -4,-1.1 4,-3.6 -3,-0.5 3,-0.6 0.908 106.9 54.0 -79.6 -44.6 2.9 -18.6 40.6 30 30 A K H 3< S+ 0 0 149 -4,-2.6 -1,-0.2 1,-0.2 -3,-0.1 0.592 117.2 41.1 -64.4 -10.2 6.6 -18.0 41.2 31 31 A D H 34 S+ 0 0 96 -5,-0.2 -1,-0.2 3,-0.2 -2,-0.2 0.586 136.2 9.6-110.5 -18.3 6.8 -21.7 42.0 32 32 A T H << S- 0 0 64 -4,-0.7 -3,-0.2 -3,-0.6 -2,-0.2 0.435 85.9-122.8-140.1 -6.5 4.5 -23.2 39.3 33 33 A G < + 0 0 55 -4,-3.6 2,-0.4 1,-0.3 -4,-0.2 0.145 69.9 130.4 78.2 -22.1 3.6 -20.5 36.8 34 34 A I - 0 0 29 -6,-0.4 -1,-0.3 -5,-0.1 2,-0.2 -0.536 57.6-133.0 -65.4 118.7 -0.1 -21.1 37.5 35 35 A K - 0 0 97 -29,-0.5 -27,-2.1 -2,-0.4 2,-0.5 -0.540 13.4-149.8 -76.6 138.9 -1.6 -17.7 38.1 36 36 A V E -a 8 0A 24 -2,-0.2 2,-0.5 -29,-0.2 -27,-0.2 -0.961 10.7-170.6-112.3 124.2 -3.9 -17.4 41.1 37 37 A T E -a 9 0A 51 -29,-2.3 -27,-2.9 -2,-0.5 2,-0.5 -0.975 2.4-169.3-115.4 121.7 -6.7 -14.8 40.9 38 38 A V E +a 10 0A 29 -2,-0.5 2,-0.3 -29,-0.2 -27,-0.2 -0.947 10.6 176.0-113.7 126.1 -8.7 -14.1 44.1 39 39 A E E -a 11 0A 49 -29,-3.1 -27,-1.6 -2,-0.5 -2,-0.0 -0.947 24.9-146.5-134.5 159.6 -11.9 -12.1 43.9 40 40 A H - 0 0 85 -2,-0.3 -26,-0.1 -29,-0.2 -29,-0.1 -0.656 19.9-172.4-130.1 73.3 -14.5 -11.0 46.4 41 41 A P > - 0 0 21 0, 0.0 3,-0.9 0, 0.0 -27,-0.3 -0.246 32.2-103.1 -64.0 151.7 -18.0 -10.8 44.8 42 42 A D T 3 S+ 0 0 147 1,-0.3 5,-0.2 2,-0.1 4,-0.1 -0.439 103.6 6.5 -72.4 151.4 -20.9 -9.3 46.8 43 43 A K T >> S+ 0 0 111 1,-0.1 4,-2.1 -2,-0.1 3,-1.8 0.849 82.4 163.1 44.7 40.7 -23.4 -11.8 48.3 44 44 A L H <> + 0 0 0 -3,-0.9 4,-2.2 1,-0.3 -1,-0.1 0.739 63.1 67.7 -68.5 -20.1 -21.0 -14.5 47.1 45 45 A E H 34 S+ 0 0 15 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.800 112.8 33.9 -62.6 -27.5 -22.5 -17.1 49.4 46 46 A E H <> S+ 0 0 71 -3,-1.8 4,-0.6 2,-0.1 -2,-0.2 0.766 113.5 57.8 -99.7 -30.8 -25.6 -16.8 47.2 47 47 A K H >X S+ 0 0 66 -4,-2.1 4,-2.0 -5,-0.2 3,-1.2 0.931 99.9 60.9 -62.9 -47.8 -23.8 -16.1 43.8 48 48 A F H 3X S+ 0 0 1 -4,-2.2 4,-2.2 1,-0.2 5,-0.2 0.891 100.8 49.5 -47.9 -55.8 -21.9 -19.4 44.1 49 49 A P H 34 S+ 0 0 45 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.711 112.6 50.2 -63.5 -16.8 -24.8 -21.8 44.1 50 50 A Q H X< S+ 0 0 92 -3,-1.2 3,-0.5 -4,-0.6 4,-0.5 0.924 116.5 36.1 -82.5 -49.5 -26.4 -20.1 41.0 51 51 A V H ><>S+ 0 0 2 -4,-2.0 3,-2.1 1,-0.2 5,-1.9 0.959 113.8 55.0 -71.8 -48.6 -23.4 -20.0 38.7 52 52 A A G ><5S+ 0 0 7 -4,-2.2 3,-0.8 1,-0.3 -1,-0.2 0.517 91.7 77.4 -67.6 -3.6 -21.9 -23.4 39.8 53 53 A A G < 5S+ 0 0 44 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.2 0.870 104.2 34.6 -62.4 -40.8 -25.3 -24.8 38.9 54 54 A T G < 5S- 0 0 96 -3,-2.1 -1,-0.2 -4,-0.5 -2,-0.2 -0.149 130.1 -93.4-107.6 31.8 -24.2 -24.6 35.3 55 55 A G T < 5S+ 0 0 18 -3,-0.8 -3,-0.3 1,-0.2 -52,-0.2 0.462 90.5 122.8 72.1 2.0 -20.6 -25.4 36.0 56 56 A D < + 0 0 14 -5,-1.9 214,-0.2 -6,-0.2 -1,-0.2 0.042 35.0 62.1 -79.9-169.9 -19.7 -21.7 36.2 57 57 A G S S- 0 0 0 -6,-0.1 -54,-0.7 -3,-0.1 -55,-0.1 -0.145 84.9 -29.5 86.6-175.0 -18.0 -20.0 39.2 58 58 A P - 0 0 0 0, 0.0 -48,-0.2 0, 0.0 3,-0.2 0.018 40.0-126.8 -76.9 174.5 -14.6 -20.3 40.9 59 59 A D S S+ 0 0 0 -50,-2.5 209,-3.2 1,-0.3 2,-0.4 0.843 101.1 27.6 -79.6 -40.2 -12.3 -23.2 41.5 60 60 A I E -bC 10 267A 0 -51,-1.7 -49,-2.7 207,-0.2 2,-0.5 -0.986 68.6-163.4-131.7 120.0 -12.2 -22.6 45.2 61 61 A I E -bC 11 266A 1 205,-2.9 205,-2.6 -2,-0.4 2,-0.6 -0.928 7.1-156.1-108.0 127.9 -15.0 -21.0 47.4 62 62 A F E +bC 12 265A 4 -51,-3.2 -49,-0.5 -2,-0.5 2,-0.3 -0.877 34.8 126.9-100.8 120.6 -14.2 -19.7 50.9 63 63 A W E - C 0 264A 45 201,-2.4 201,-2.5 -2,-0.6 5,-0.1 -0.983 64.8 -70.0-162.5 161.2 -17.1 -19.5 53.4 64 64 A A E > - C 0 263A 15 -2,-0.3 3,-1.7 199,-0.2 4,-0.3 -0.351 55.4-113.2 -54.0 131.7 -18.2 -20.5 56.9 65 65 A H G >> S+ 0 0 4 197,-2.3 3,-0.7 1,-0.3 4,-0.5 0.554 102.4 82.6 -49.0 -13.9 -18.8 -24.2 56.8 66 66 A D G 34 S+ 0 0 9 1,-0.2 3,-0.4 2,-0.2 4,-0.4 0.815 89.9 47.8 -69.6 -30.5 -22.6 -23.8 57.3 67 67 A R G <> S+ 0 0 32 -3,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.656 93.9 79.1 -82.2 -14.7 -23.4 -23.2 53.7 68 68 A F H <> S+ 0 0 2 -3,-0.7 4,-2.6 -4,-0.3 -1,-0.2 0.763 83.1 59.8 -71.4 -28.6 -21.4 -26.1 52.4 69 69 A G H X S+ 0 0 0 -4,-0.5 4,-2.4 264,-0.4 -1,-0.2 0.922 108.7 46.2 -64.1 -41.5 -23.9 -28.9 53.2 70 70 A G H > S+ 0 0 19 263,-0.5 4,-2.1 264,-0.4 -2,-0.2 0.938 111.9 51.0 -62.1 -48.1 -26.4 -27.2 50.9 71 71 A Y H <>S+ 0 0 9 -4,-1.9 5,-1.5 1,-0.2 6,-0.2 0.945 112.5 46.5 -54.0 -48.5 -23.8 -26.7 48.2 72 72 A A H ><5S+ 0 0 20 -4,-2.6 3,-1.8 1,-0.2 5,-0.3 0.864 106.8 57.3 -65.3 -44.6 -22.8 -30.4 48.4 73 73 A Q H 3<5S+ 0 0 111 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.945 103.9 52.7 -45.2 -55.9 -26.4 -31.6 48.3 74 74 A S T 3<5S- 0 0 85 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.358 119.7-114.9 -71.3 8.5 -27.0 -29.8 45.1 75 75 A G T < 5S+ 0 0 56 -3,-1.8 -3,-0.2 -5,-0.1 -2,-0.1 0.893 80.9 123.5 63.0 45.2 -23.9 -31.6 43.7 76 76 A L < + 0 0 12 -5,-1.5 193,-1.3 193,-0.1 2,-0.4 0.187 52.9 81.8-118.2 12.8 -21.8 -28.5 43.2 77 77 A L B -F 268 0B 21 -5,-0.3 2,-0.2 191,-0.2 191,-0.2 -0.971 68.8-134.5-125.7 135.2 -18.9 -29.6 45.4 78 78 A A - 0 0 10 189,-3.2 2,-0.5 -2,-0.4 189,-0.4 -0.569 27.9-118.9 -74.7 143.0 -15.9 -31.9 44.8 79 79 A E - 0 0 104 -2,-0.2 26,-0.2 187,-0.1 2,-0.1 -0.773 34.2-128.4 -79.8 127.0 -15.0 -34.4 47.5 80 80 A I - 0 0 7 24,-0.9 24,-0.3 -2,-0.5 26,-0.1 -0.417 10.8-148.7 -79.6 154.0 -11.5 -33.6 48.7 81 81 A T + 0 0 89 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.629 28.9 159.2-126.9 71.2 -8.8 -36.3 48.9 82 82 A P - 0 0 17 0, 0.0 2,-0.0 0, 0.0 -2,-0.0 -0.744 33.7-127.6 -91.2 143.6 -6.3 -35.6 51.8 83 83 A D > - 0 0 96 -2,-0.3 4,-2.0 1,-0.1 3,-0.4 -0.220 28.7 -96.6 -82.5 173.5 -4.2 -38.4 53.1 84 84 A K H > S+ 0 0 146 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.834 121.0 62.2 -55.4 -36.6 -3.8 -39.7 56.7 85 85 A A H 4 S+ 0 0 68 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.908 109.2 38.9 -57.3 -44.5 -0.6 -37.6 57.0 86 86 A F H >4 S+ 0 0 8 -3,-0.4 3,-2.3 1,-0.2 4,-0.4 0.921 106.5 61.9 -77.1 -46.8 -2.4 -34.3 56.5 87 87 A Q H >< S+ 0 0 63 -4,-2.0 3,-0.9 1,-0.3 -1,-0.2 0.790 101.2 55.2 -51.2 -34.4 -5.6 -35.0 58.5 88 88 A D T 3< S+ 0 0 91 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.750 96.0 69.7 -69.3 -21.1 -3.5 -35.4 61.6 89 89 A K T < S+ 0 0 97 -3,-2.3 217,-1.0 -4,-0.4 218,-0.6 0.552 98.4 49.9 -79.1 -10.5 -2.1 -31.9 60.9 90 90 A L B < S-G 305 0C 1 -3,-0.9 215,-0.2 -4,-0.4 214,-0.1 -0.809 100.7 -82.3-121.3 167.7 -5.4 -30.0 61.7 91 91 A Y >> - 0 0 61 213,-1.6 3,-2.1 -2,-0.3 4,-1.2 -0.546 28.8-136.8 -76.0 127.7 -7.8 -30.2 64.7 92 92 A P H 3> S+ 0 0 76 0, 0.0 4,-2.1 0, 0.0 3,-0.3 0.867 103.5 69.3 -46.9 -42.5 -10.3 -33.1 64.5 93 93 A F H 3> S+ 0 0 98 1,-0.2 4,-0.7 2,-0.2 -2,-0.0 0.847 102.3 43.9 -40.4 -43.5 -12.9 -30.5 65.6 94 94 A T H <> S+ 0 0 0 -3,-2.1 4,-1.2 2,-0.2 -1,-0.2 0.824 107.1 56.1 -83.1 -34.5 -12.6 -28.8 62.3 95 95 A W H >< S+ 0 0 9 -4,-1.2 3,-0.6 -3,-0.3 4,-0.2 0.927 104.4 55.0 -59.5 -45.9 -12.6 -31.8 60.0 96 96 A D H >< S+ 0 0 104 -4,-2.1 3,-0.9 1,-0.2 -1,-0.2 0.812 102.8 58.2 -58.8 -31.2 -15.9 -32.9 61.4 97 97 A A H 3< S+ 0 0 9 -4,-0.7 -1,-0.2 -5,-0.3 -2,-0.2 0.868 106.1 47.4 -65.2 -38.9 -17.3 -29.5 60.5 98 98 A V T << S+ 0 0 3 -4,-1.2 7,-2.5 -3,-0.6 8,-0.4 0.261 92.4 104.1 -88.5 12.0 -16.5 -30.0 56.8 99 99 A R E < +H 104 0D 79 -3,-0.9 2,-0.3 5,-0.2 5,-0.2 -0.702 40.3 170.3 -97.9 146.3 -18.0 -33.5 56.6 100 100 A Y E > S-H 103 0D 37 3,-2.9 3,-1.9 -2,-0.3 -3,-0.0 -0.931 70.5 -3.5-156.9 132.2 -21.4 -34.3 55.0 101 101 A N T 3 S- 0 0 143 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.758 130.0 -59.1 50.0 30.9 -22.9 -37.7 54.2 102 102 A G T 3 S+ 0 0 66 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.581 117.8 110.1 77.0 11.3 -19.6 -39.2 55.5 103 103 A K E < S-H 100 0D 97 -3,-1.9 -3,-2.9 -5,-0.0 2,-0.4 -0.917 71.8-124.1-115.4 144.6 -17.6 -37.3 52.9 104 104 A L E +H 99 0D 13 -2,-0.4 -24,-0.9 -24,-0.3 -5,-0.2 -0.754 30.4 175.9 -76.4 129.6 -15.2 -34.5 53.3 105 105 A I + 0 0 8 -7,-2.5 2,-0.3 -2,-0.4 162,-0.3 0.297 58.3 11.2-123.0 6.8 -16.5 -31.7 51.1 106 106 A A S S- 0 0 1 -8,-0.4 -1,-0.2 160,-0.1 160,-0.2 -0.973 73.0-100.9-169.5 169.0 -14.1 -28.9 52.0 107 107 A Y E -D 265 0A 0 158,-3.0 158,-2.3 -2,-0.3 2,-0.1 -0.872 35.9-132.0 -98.1 116.0 -10.8 -27.9 53.8 108 108 A P E +D 264 0A 0 0, 0.0 156,-0.3 0, 0.0 3,-0.1 -0.421 29.5 172.6 -66.5 139.9 -11.2 -26.3 57.2 109 109 A I E - 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0 0 21 -5,-0.9 2,-0.8 -22,-0.1 -1,-0.2 -0.551 47.5-119.9 -71.0 133.9 -8.5 2.9 69.6 242 242 A N + 0 0 73 -2,-0.2 -122,-1.3 -3,-0.1 -121,-0.8 -0.715 52.7 160.8 -85.1 107.9 -7.4 1.2 72.8 243 243 A Y E -J 119 0E 30 -2,-0.8 2,-0.3 -124,-0.2 -124,-0.2 -0.813 31.3-159.6-134.3 158.8 -9.4 -1.9 73.0 244 244 A G E -J 118 0E 9 -126,-1.8 -126,-2.1 -2,-0.3 2,-0.5 -0.903 17.8-133.3-133.7 167.4 -9.8 -5.4 74.4 245 245 A V E +J 117 0E 17 -2,-0.3 -128,-0.2 -128,-0.2 2,-0.2 -0.979 37.4 159.1-127.8 115.4 -11.6 -8.5 73.4 246 246 A T E -J 116 0E 32 -130,-2.6 -130,-2.2 -2,-0.5 74,-0.0 -0.707 44.3 -63.2-133.2 177.3 -13.7 -10.3 76.1 247 247 A V - 0 0 22 -2,-0.2 -1,-0.1 -132,-0.2 -132,-0.1 -0.347 59.2-106.6 -65.1 140.6 -16.5 -12.7 76.8 248 248 A L - 0 0 3 -134,-0.2 8,-0.3 72,-0.1 -1,-0.1 -0.251 46.1 -88.2 -60.8 153.4 -19.9 -11.6 75.6 249 249 A P - 0 0 3 0, 0.0 7,-0.9 0, 0.0 -120,-0.3 -0.108 42.0-117.4 -56.3 164.9 -22.4 -10.4 78.3 250 250 A T E -lM 129 255F 37 -122,-1.5 -120,-3.9 5,-0.2 -119,-0.5 -0.698 18.0-146.3-104.9 160.1 -24.7 -12.9 80.0 251 251 A F E > S- M 0 254F 10 3,-4.1 3,-2.1 -2,-0.3 -59,-0.1 -0.996 77.1 -11.5-134.0 128.1 -28.5 -12.9 79.9 252 252 A K T 3 S- 0 0 112 -2,-0.4 -1,-0.2 1,-0.3 2,-0.1 0.906 131.3 -55.7 48.7 43.8 -30.8 -14.0 82.8 253 253 A G T 3 S+ 0 0 66 1,-0.2 -1,-0.3 -3,-0.1 -88,-0.0 -0.042 120.5 106.5 85.2 -31.8 -27.6 -15.4 84.3 254 254 A Q E < S-M 251 0F 87 -3,-2.1 -3,-4.1 -2,-0.1 -1,-0.2 -0.429 70.8-107.9 -88.8 158.1 -26.7 -17.5 81.3 255 255 A P E -M 250 0F 52 0, 0.0 -5,-0.2 0, 0.0 2,-0.2 -0.404 33.0 -98.8 -85.0 156.8 -24.0 -16.9 78.8 256 256 A S - 0 0 2 -7,-0.9 -95,-0.2 -8,-0.3 -8,-0.1 -0.486 31.4-147.6 -69.3 138.4 -24.3 -15.8 75.2 257 257 A K - 0 0 52 -97,-1.9 71,-0.2 -98,-0.2 -94,-0.2 -0.794 15.6-168.3-113.5 85.3 -24.1 -18.7 72.8 258 258 A P - 0 0 1 0, 0.0 71,-1.2 0, 0.0 2,-0.5 -0.384 29.9-108.8 -63.8 152.2 -22.5 -17.5 69.5 259 259 A F E -o 329 0H 8 -103,-0.3 2,-0.4 69,-0.2 -145,-0.4 -0.735 32.5-137.5 -74.4 129.7 -22.6 -19.8 66.6 260 260 A V E -o 330 0H 7 69,-2.2 71,-1.8 -2,-0.5 2,-0.3 -0.754 22.3-165.4 -87.6 137.6 -19.1 -21.1 66.0 261 261 A G E - D 0 112A 0 -149,-2.2 -149,-3.3 -2,-0.4 2,-0.6 -0.950 15.0-146.2-125.6 147.6 -18.1 -21.1 62.3 262 262 A V E - D 0 111A 0 -2,-0.3 -197,-2.3 -151,-0.2 2,-0.4 -0.946 21.4-132.0-115.0 109.0 -15.3 -22.9 60.6 263 263 A L E -CD 64 110A 4 -153,-2.2 -154,-3.5 -2,-0.6 -153,-1.1 -0.477 37.5-174.4 -58.0 113.6 -13.9 -20.9 57.6 264 264 A S E -CD 63 108A 0 -201,-2.5 -201,-2.4 -2,-0.4 2,-0.5 -0.867 23.8-144.9-117.3 151.1 -13.7 -23.6 54.9 265 265 A A E -CD 62 107A 0 -158,-2.3 -158,-3.0 -2,-0.3 2,-0.4 -0.971 21.7-163.9-112.9 127.3 -12.4 -23.7 51.4 266 266 A G E -C 61 0A 0 -205,-2.6 -205,-2.9 -2,-0.5 2,-0.5 -0.910 14.2-132.6-120.6 141.4 -14.3 -25.8 48.8 267 267 A I E -C 60 0A 5 -189,-0.4 -189,-3.2 -2,-0.4 -207,-0.2 -0.801 30.3-113.1 -98.6 129.6 -13.4 -27.1 45.4 268 268 A N B > -F 77 0B 2 -209,-3.2 3,-1.2 -2,-0.5 -191,-0.2 -0.308 11.4-140.7 -64.5 132.1 -15.8 -26.7 42.6 269 269 A A T 3 S+ 0 0 34 -193,-1.3 -192,-0.2 1,-0.3 -1,-0.1 0.733 105.3 47.6 -63.8 -24.4 -17.3 -29.9 41.3 270 270 A A T 3 S+ 0 0 47 -194,-0.3 -1,-0.3 -214,-0.2 -2,-0.1 0.451 85.9 117.9 -95.1 -2.1 -17.1 -28.4 37.7 271 271 A S X - 0 0 4 -3,-1.2 3,-0.5 -212,-0.2 -266,-0.1 -0.469 52.5-156.8 -71.9 134.2 -13.5 -27.2 38.1 272 272 A P T 3 S+ 0 0 49 0, 0.0 3,-0.2 0, 0.0 -266,-0.1 0.270 90.0 63.8 -82.8 6.6 -10.8 -28.7 35.7 273 273 A N T 3> + 0 0 3 -5,-0.1 4,-2.9 1,-0.1 5,-0.3 -0.001 56.6 134.6-120.5 30.0 -8.1 -27.8 38.2 274 274 A K H <> S+ 0 0 71 -3,-0.5 4,-1.2 1,-0.2 -1,-0.1 0.677 79.1 42.3 -57.3 -20.0 -9.1 -30.0 41.2 275 275 A E H > S+ 0 0 131 2,-0.2 4,-2.3 -3,-0.2 -1,-0.2 0.866 111.5 51.3 -95.5 -46.4 -5.6 -31.2 41.7 276 276 A L H > S+ 0 0 50 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.894 115.8 45.3 -52.9 -43.2 -3.8 -27.8 41.2 277 277 A A H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 5,-0.4 0.976 106.6 57.4 -62.8 -56.9 -6.3 -26.5 43.8 278 278 A K H X S+ 0 0 49 -4,-1.2 4,-2.0 -5,-0.3 -2,-0.2 0.843 111.2 46.1 -40.8 -41.5 -5.7 -29.5 46.1 279 279 A E H X S+ 0 0 87 -4,-2.3 4,-2.5 2,-0.2 5,-0.5 0.914 108.9 52.6 -70.3 -46.9 -2.1 -28.4 46.0 280 280 A F H X>S+ 0 0 0 -4,-2.1 5,-2.2 1,-0.2 4,-1.9 0.967 116.7 38.8 -53.5 -57.1 -2.6 -24.7 46.6 281 281 A L H <>S+ 0 0 0 -4,-2.4 5,-3.5 3,-0.2 -2,-0.2 0.944 120.6 43.8 -60.2 -51.0 -4.7 -25.3 49.7 282 282 A E H <5S+ 0 0 14 -4,-2.0 -1,-0.2 -5,-0.4 -2,-0.2 0.785 128.1 20.8 -70.9 -32.9 -2.7 -28.2 51.1 283 283 A N H <5S+ 0 0 72 -4,-2.5 -1,-0.2 -5,-0.2 -3,-0.2 0.486 133.3 28.2-121.0 -5.6 0.8 -27.0 50.7 284 284 A Y T <5S+ 0 0 37 -4,-1.9 3,-0.3 -5,-0.5 -3,-0.2 0.649 128.6 29.8-121.6 -41.9 0.8 -23.2 50.3 285 285 A L T S- 0 0 21 -2,-2.1 4,-2.0 -3,-0.3 5,-0.3 -0.943 85.6-111.5-141.5 159.4 0.9 -24.1 56.1 288 288 A D H > S+ 0 0 37 -2,-0.3 4,-0.7 1,-0.2 -1,-0.1 0.855 121.1 45.0 -60.7 -32.0 2.5 -22.2 59.0 289 289 A E H > S+ 0 0 133 2,-0.1 4,-0.8 3,-0.1 -1,-0.2 0.878 115.1 45.4 -80.0 -39.3 4.0 -19.8 56.5 290 290 A G H >> S+ 0 0 0 2,-0.2 4,-1.2 1,-0.2 3,-1.1 0.946 107.4 53.1 -74.2 -52.9 0.8 -19.3 54.4 291 291 A L H 3X S+ 0 0 0 -4,-2.0 4,-3.1 -6,-0.5 5,-0.3 0.833 103.9 61.4 -48.0 -38.5 -1.8 -18.8 57.1 292 292 A E H 3X S+ 0 0 81 -4,-0.7 4,-1.9 -5,-0.3 -1,-0.3 0.876 97.5 58.3 -57.7 -40.0 0.4 -16.1 58.4 293 293 A A H X S+ 0 0 5 -4,-1.2 4,-2.3 2,-0.2 3,-1.1 0.977 114.8 54.3 -72.1 -57.4 -3.8 -14.1 55.5 295 295 A N H 3< S+ 0 0 30 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.771 107.0 56.2 -50.6 -29.8 -3.9 -13.7 59.3 296 296 A K H 3< S+ 0 0 138 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.909 111.5 41.5 -63.6 -45.8 -1.6 -10.7 58.8 297 297 A D H << S- 0 0 43 -4,-1.1 -2,-0.2 -3,-1.1 -3,-0.1 0.986 142.4 -6.4 -67.8 -60.7 -4.1 -9.1 56.4 298 298 A K S < S- 0 0 32 -4,-2.3 -281,-0.4 -281,-0.1 -1,-0.3 -0.976 89.1-107.0-137.7 123.5 -7.2 -9.9 58.4 299 299 A P - 0 0 11 0, 0.0 -66,-0.1 0, 0.0 -4,-0.1 -0.250 21.2-154.5 -55.9 127.9 -6.9 -12.1 61.4 300 300 A L - 0 0 8 1,-0.2 2,-0.4 -9,-0.2 -69,-0.2 0.749 33.0-133.0 -72.5 -26.6 -8.4 -15.6 60.7 301 301 A G S S+ 0 0 1 -71,-0.2 2,-1.1 -191,-0.1 -1,-0.2 -0.940 71.2 2.1 113.0-132.0 -9.1 -16.2 64.4 302 302 A A E S-E 111 0A 7 -191,-2.0 -191,-1.5 -2,-0.4 7,-0.1 -0.789 86.1-140.5 -93.2 91.0 -8.2 -19.5 66.0 303 303 A V E -E 110 0A 1 -2,-1.1 -193,-0.3 -193,-0.2 6,-0.1 -0.215 3.3-138.3 -60.9 137.2 -6.5 -21.1 63.0 304 304 A A S S+ 0 0 2 -195,-1.2 -213,-1.6 4,-0.1 2,-1.0 0.639 76.5 99.9 -76.1 -16.8 -7.2 -24.9 62.5 305 305 A L B >> -G 90 0C 4 -196,-0.4 4,-2.8 -215,-0.2 3,-0.7 -0.652 68.0-150.2 -71.4 104.1 -3.6 -25.8 61.6 306 306 A K H 3> S+ 0 0 75 -217,-1.0 4,-2.0 -2,-1.0 5,-0.3 0.871 91.1 62.4 -39.3 -53.0 -2.4 -27.2 64.9 307 307 A S H 3> S+ 0 0 51 -218,-0.6 4,-0.9 1,-0.2 -1,-0.2 0.880 116.2 25.0 -36.6 -62.3 1.1 -26.1 64.1 308 308 A Y H <> S+ 0 0 13 -3,-0.7 4,-1.3 2,-0.2 -1,-0.2 0.808 112.3 67.1 -84.7 -36.5 0.4 -22.3 63.9 309 309 A E H X S+ 0 0 33 -4,-2.8 4,-1.8 1,-0.2 3,-0.2 0.874 104.8 47.0 -47.8 -44.3 -2.7 -22.2 66.2 310 310 A E H < S+ 0 0 120 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.881 109.7 51.2 -67.3 -42.8 -0.3 -23.1 69.0 311 311 A E H < S+ 0 0 123 -4,-0.9 -1,-0.2 -5,-0.3 -2,-0.2 0.721 121.3 36.7 -64.1 -18.1 2.3 -20.5 68.0 312 312 A L H >< S+ 0 0 34 -4,-1.3 3,-0.8 -3,-0.2 -2,-0.2 0.631 88.2 88.5-113.8 -23.0 -0.5 -18.0 68.0 313 313 A A T 3< + 0 0 40 -4,-1.8 -1,-0.1 1,-0.3 -2,-0.1 0.365 67.0 86.1 -71.8 7.9 -2.9 -18.9 70.8 314 314 A K T 3 + 0 0 182 -4,-0.1 -1,-0.3 -3,-0.1 -4,-0.1 0.162 65.5 107.9 -89.0 18.0 -1.0 -16.7 73.3 315 315 A D <> - 0 0 39 -3,-0.8 4,-2.4 1,-0.1 3,-0.1 -0.847 67.8-145.0 -98.1 129.5 -3.0 -13.7 72.1 316 316 A P H > S+ 0 0 99 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.765 100.4 58.6 -63.7 -24.8 -5.6 -12.5 74.7 317 317 A R H > S+ 0 0 60 2,-0.2 4,-2.2 1,-0.2 3,-0.1 0.926 109.4 40.3 -69.0 -47.8 -7.9 -11.7 71.8 318 318 A I H > S+ 0 0 7 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.852 110.1 62.9 -68.3 -35.2 -8.0 -15.2 70.4 319 319 A A H X S+ 0 0 51 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.879 107.1 42.0 -50.7 -45.5 -8.2 -16.3 74.1 320 320 A A H X S+ 0 0 5 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.903 110.3 57.6 -68.9 -43.3 -11.5 -14.5 74.3 321 321 A T H X S+ 0 0 1 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.894 108.9 46.2 -52.8 -43.4 -12.5 -15.8 70.9 322 322 A M H X S+ 0 0 70 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.823 108.5 54.3 -71.2 -36.3 -12.1 -19.4 72.2 323 323 A E H X S+ 0 0 90 -4,-1.4 4,-1.6 -5,-0.2 -1,-0.2 0.921 110.6 47.3 -62.8 -41.7 -13.9 -18.7 75.5 324 324 A N H X S+ 0 0 2 -4,-2.5 4,-0.8 1,-0.2 -2,-0.2 0.876 107.8 54.7 -71.2 -36.0 -16.9 -17.5 73.4 325 325 A A H >< S+ 0 0 14 -4,-1.9 3,-1.1 -5,-0.2 -1,-0.2 0.937 104.3 58.2 -54.8 -48.0 -16.7 -20.5 71.1 326 326 A Q H 3< S+ 0 0 156 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.924 107.7 42.8 -47.0 -57.1 -16.9 -22.6 74.3 327 327 A K H 3< S+ 0 0 72 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.574 110.1 79.9 -73.8 -8.4 -20.2 -21.1 75.4 328 328 A G S << S- 0 0 14 -3,-1.1 2,-0.3 -4,-0.8 -69,-0.2 -0.194 75.0-131.0 -79.0-178.3 -21.4 -21.4 71.8 329 329 A E E -o 259 0H 103 -71,-1.2 -69,-2.2 -72,-0.1 2,-0.3 -0.881 31.5-104.2-125.7 161.0 -22.8 -24.3 69.8 330 330 A I E -o 260 0H 56 -2,-0.3 -69,-0.1 -71,-0.2 -71,-0.1 -0.632 37.4-100.9 -92.7 146.9 -21.5 -25.2 66.3 331 331 A M - 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