==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 11-MAY-00 1EZP . COMPND 2 MOLECULE: MALTODEXTRIN BINDING PERIPLASMIC PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR G.A.MUELLER,W.Y.CHOY,D.YANG,J.D.FORMAN-KAY,R.A.VENTERS, . 370 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24812.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 224 60.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 15 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 24 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 3.0 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 2 3 1 0 1 2 2 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 PARALLEL BRIDGES PER LADDER . 3 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 256 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 95.0 -37.7 -9.3 5.4 2 2 A T - 0 0 121 2,-0.0 2,-0.3 0, 0.0 270,-0.3 -0.937 360.0-157.6-130.2 153.0 -36.7 -6.6 8.0 3 3 A E - 0 0 156 -2,-0.3 2,-0.3 268,-0.1 269,-0.0 -0.901 9.0-177.7-128.7 157.5 -35.7 -3.0 7.7 4 4 A E - 0 0 143 -2,-0.3 3,-0.0 267,-0.1 -2,-0.0 -0.887 27.1-138.2-144.5 174.2 -33.7 -0.6 9.9 5 5 A G S S+ 0 0 52 -2,-0.3 29,-0.9 28,-0.0 2,-0.3 -0.175 73.9 73.6-132.5 42.5 -32.6 3.1 10.2 6 6 A K E -a 34 0A 118 27,-0.1 2,-0.3 2,-0.0 29,-0.2 -0.990 48.2-172.9-155.1 146.0 -29.0 2.9 11.4 7 7 A L E -a 35 0A 44 27,-1.3 29,-3.0 -2,-0.3 2,-0.5 -0.997 16.0-140.7-144.6 136.1 -25.6 1.9 9.9 8 8 A V E -a 36 0A 27 -2,-0.3 51,-0.9 27,-0.2 50,-0.8 -0.856 16.1-148.2-103.0 129.0 -22.2 1.5 11.6 9 9 A I E -ab 37 59A 4 27,-3.8 29,-0.9 -2,-0.5 2,-0.4 -0.595 6.1-161.9 -91.0 153.9 -19.0 2.7 9.8 10 10 A W E +ab 38 60A 25 49,-0.5 51,-2.7 -2,-0.2 2,-0.4 -0.932 16.2 167.4-139.5 111.0 -15.6 1.1 10.1 11 11 A I E + b 0 61A 8 27,-1.6 2,-0.2 -2,-0.4 51,-0.1 -0.987 15.5 179.1-128.5 134.5 -12.5 3.1 9.1 12 12 A N S S+ 0 0 54 49,-0.5 27,-0.1 -2,-0.4 29,-0.0 -0.565 85.2 4.4-132.6 69.8 -8.8 2.3 9.8 13 13 A G S S+ 0 0 50 -2,-0.2 3,-0.1 49,-0.0 49,-0.0 0.367 97.3 100.9 135.8 3.0 -6.8 5.0 8.2 14 14 A D - 0 0 21 1,-0.2 2,-1.2 47,-0.1 286,-0.1 0.782 54.0-175.2 -82.5 -29.8 -9.4 7.5 6.8 15 15 A K + 0 0 145 1,-0.2 -1,-0.2 2,-0.0 -4,-0.1 -0.567 20.5 151.9 72.4 -92.8 -8.9 9.9 9.8 16 16 A G > + 0 0 15 -2,-1.2 4,-0.6 277,-0.3 -1,-0.2 0.844 8.8 165.1 30.5 76.8 -11.6 12.4 9.0 17 17 A Y H > S+ 0 0 183 2,-0.1 4,-0.8 3,-0.1 -1,-0.1 0.966 79.2 22.1 -79.7 -60.1 -12.5 13.7 12.4 18 18 A N H > S+ 0 0 122 2,-0.2 4,-1.4 1,-0.1 275,-0.1 0.800 118.9 65.5 -77.5 -31.9 -14.4 16.9 11.6 19 19 A G H >> S+ 0 0 0 1,-0.2 4,-1.3 273,-0.2 3,-0.6 0.968 110.1 32.1 -55.6 -61.9 -15.3 15.7 8.1 20 20 A L H 3X S+ 0 0 5 -4,-0.6 4,-2.1 1,-0.2 5,-0.2 0.767 108.1 74.9 -68.3 -25.6 -17.5 12.8 9.0 21 21 A A H 3X S+ 0 0 60 -4,-0.8 4,-0.9 2,-0.2 -1,-0.2 0.895 103.9 34.9 -53.2 -46.2 -18.6 14.6 12.1 22 22 A E H XX S+ 0 0 109 -4,-1.4 4,-2.7 -3,-0.6 3,-0.8 0.972 114.2 53.9 -74.0 -59.2 -20.9 17.0 10.1 23 23 A V H 3X S+ 0 0 7 -4,-1.3 4,-1.2 1,-0.3 -2,-0.2 0.801 107.0 55.4 -46.5 -35.6 -22.1 14.6 7.4 24 24 A G H 3X S+ 0 0 7 -4,-2.1 4,-1.1 1,-0.2 11,-0.3 0.907 113.5 37.8 -67.4 -43.0 -23.3 12.2 10.1 25 25 A K H X S+ 0 0 34 -4,-1.2 3,-2.6 -5,-0.2 4,-0.6 0.984 109.8 46.7 -70.3 -58.0 -28.5 13.3 7.5 28 28 A E H 3< S+ 0 0 64 5,-1.1 4,-0.5 -4,-1.1 -1,-0.2 0.793 99.6 75.5 -52.6 -27.8 -30.4 12.5 10.7 29 29 A K T 3< S+ 0 0 157 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.801 86.7 59.8 -55.5 -31.7 -31.3 16.1 10.7 30 30 A D T <4 S- 0 0 112 -3,-2.6 -1,-0.2 -4,-0.4 -2,-0.2 0.989 131.1 -82.9 -61.6 -57.6 -33.8 15.4 7.9 31 31 A T S < S+ 0 0 141 -4,-0.6 -2,-0.2 2,-0.0 -3,-0.2 0.344 106.8 21.3 158.1 35.8 -35.8 13.0 10.0 32 32 A G S S+ 0 0 53 -4,-0.5 2,-0.4 -5,-0.4 -4,-0.2 0.484 75.7 111.7 156.3 41.1 -34.2 9.5 10.1 33 33 A I + 0 0 25 -8,-0.1 -5,-1.1 -9,-0.1 2,-0.5 -0.788 29.2 164.4-137.8 95.3 -30.6 9.1 9.2 34 34 A K E -a 6 0A 109 -29,-0.9 -27,-1.3 -2,-0.4 2,-0.4 -0.943 10.9-173.6-115.8 123.2 -28.2 8.0 12.0 35 35 A V E -a 7 0A 31 -2,-0.5 2,-0.6 -11,-0.3 -27,-0.2 -0.934 18.1-137.9-116.8 136.6 -24.7 6.6 11.3 36 36 A T E -a 8 0A 47 -29,-3.0 -27,-3.8 -2,-0.4 2,-0.8 -0.829 13.8-146.5 -96.5 118.9 -22.3 5.2 13.9 37 37 A V E +a 9 0A 75 -2,-0.6 2,-0.3 -29,-0.2 -27,-0.1 -0.749 31.9 158.9 -88.6 110.9 -18.7 6.3 13.5 38 38 A E E -a 10 0A 88 -29,-0.9 -27,-1.6 -2,-0.8 -2,-0.0 -0.951 21.8-163.4-131.7 151.1 -16.4 3.5 14.5 39 39 A H - 0 0 118 -2,-0.3 -27,-0.2 -29,-0.3 -29,-0.1 -0.999 10.8-145.4-137.1 133.7 -12.7 2.7 13.8 40 40 A P + 0 0 24 0, 0.0 -29,-0.0 0, 0.0 -30,-0.0 -0.180 25.8 161.0 -87.5-176.1 -10.8 -0.6 14.2 41 41 A D S S+ 0 0 127 -29,-0.0 3,-0.0 -2,-0.0 -29,-0.0 0.138 87.2 13.4-166.7 -51.0 -7.2 -1.3 15.2 42 42 A K S >> S+ 0 0 159 1,-0.1 3,-1.7 2,-0.1 4,-0.6 0.350 95.3 100.5-119.8 -0.8 -6.9 -4.9 16.4 43 43 A L H 3> + 0 0 43 1,-0.3 4,-2.3 2,-0.2 7,-0.2 0.618 58.9 90.9 -61.2 -11.6 -10.3 -6.1 15.2 44 44 A E H 34 S+ 0 0 96 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.821 94.4 36.9 -54.0 -33.2 -8.4 -7.6 12.3 45 45 A E H <4 S+ 0 0 144 -3,-1.7 4,-0.3 2,-0.1 -1,-0.2 0.729 113.7 56.1 -91.2 -26.2 -8.1 -10.8 14.4 46 46 A K H >X S+ 0 0 84 -4,-0.6 4,-3.8 1,-0.2 3,-1.5 0.741 86.4 84.9 -76.2 -24.9 -11.6 -10.6 16.0 47 47 A F H 3X S+ 0 0 81 -4,-2.3 4,-2.0 1,-0.3 5,-0.2 0.907 89.5 46.0 -42.2 -61.4 -13.2 -10.4 12.5 48 48 A P H 3> S+ 0 0 90 0, 0.0 4,-0.5 0, 0.0 -1,-0.3 0.704 120.1 44.0 -59.3 -18.5 -13.3 -14.3 12.1 49 49 A Q H <4 S+ 0 0 153 -3,-1.5 3,-0.3 -4,-0.3 -2,-0.2 0.899 118.7 38.2 -90.2 -52.1 -14.6 -14.5 15.6 50 50 A V H <>S+ 0 0 62 -4,-3.8 5,-0.7 1,-0.2 3,-0.4 0.565 111.2 64.4 -75.5 -9.5 -17.2 -11.6 15.6 51 51 A A H ><5S+ 0 0 16 -4,-2.0 3,-2.3 -5,-0.5 4,-0.4 0.866 83.3 71.6 -81.1 -38.8 -18.1 -12.6 12.0 52 52 A A T 3<5S+ 0 0 93 -4,-0.5 -1,-0.2 1,-0.3 -2,-0.1 0.634 93.6 60.7 -52.0 -13.8 -19.5 -16.0 12.9 53 53 A T T 3 5S- 0 0 117 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.2 0.769 128.8 -92.4 -86.0 -27.6 -22.4 -14.1 14.4 54 54 A G T < 5 - 0 0 35 -3,-2.3 -3,-0.2 -4,-0.3 -2,-0.2 0.521 62.8 -77.7 125.6 15.8 -23.4 -12.5 11.2 55 55 A D < - 0 0 24 -5,-0.7 -4,-0.1 -4,-0.4 212,-0.1 0.938 42.3-144.8 60.4 98.8 -21.5 -9.2 11.2 56 56 A G S S+ 0 0 65 -6,-0.3 -48,-0.1 2,-0.0 -5,-0.0 0.970 78.6 32.8 -54.1 -83.6 -23.2 -6.7 13.4 57 57 A P - 0 0 27 0, 0.0 210,-0.2 0, 0.0 -48,-0.1 0.162 69.8-148.5 -61.1-172.3 -22.6 -3.3 11.6 58 58 A D + 0 0 20 -50,-0.8 2,-0.3 1,-0.1 -49,-0.1 0.059 64.0 82.9-155.9 36.4 -22.4 -3.1 7.8 59 59 A I E +b 9 0A 16 -51,-0.9 -49,-0.5 207,-0.1 2,-0.3 -0.865 47.4 141.7-148.1 106.4 -20.1 -0.3 6.8 60 60 A I E -bC 10 265A 23 205,-0.7 205,-1.1 -2,-0.3 2,-0.5 -0.998 32.8-148.1-149.2 143.5 -16.3 -0.8 6.6 61 61 A F E +bC 11 264A 13 -51,-2.7 -49,-0.5 -2,-0.3 2,-0.3 -0.956 31.1 145.4-117.4 125.8 -13.4 0.2 4.4 62 62 A W E - C 0 263A 78 201,-1.5 201,-2.8 -2,-0.5 46,-0.1 -0.963 53.6 -70.2-150.5 161.3 -10.3 -2.0 3.8 63 63 A A E - C 0 262A 10 199,-0.4 199,-0.3 -2,-0.3 -1,-0.2 0.088 46.0-115.7 -50.0 163.9 -7.9 -2.7 1.0 64 64 A H S >>>S+ 0 0 20 197,-2.5 4,-1.9 3,-0.2 3,-0.8 0.771 105.7 66.1 -77.5 -29.2 -9.2 -4.7 -2.0 65 65 A D T 345S+ 0 0 14 196,-0.3 4,-0.4 1,-0.2 -1,-0.1 0.931 112.8 29.6 -59.0 -51.1 -7.0 -7.7 -1.5 66 66 A R T 345S+ 0 0 122 3,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.199 125.2 50.4 -96.3 15.8 -8.5 -8.8 1.8 67 67 A F T <>5S+ 0 0 18 -3,-0.8 4,-1.2 3,-0.1 -2,-0.2 0.744 119.2 24.8-114.2 -60.0 -11.9 -7.4 1.0 68 68 A G T <5S+ 0 0 1 -4,-1.9 36,-0.2 1,-0.2 -3,-0.2 0.568 129.5 46.2 -85.1 -9.1 -13.1 -8.6 -2.4 69 69 A G T 4> S+ 0 0 166 -5,-0.1 3,-1.6 2,-0.1 4,-1.2 0.818 113.7 57.5 -94.5 -38.8 -11.7 -12.9 1.3 71 71 A A T 3<>S+ 0 0 20 -4,-1.2 5,-0.7 1,-0.3 -3,-0.1 0.756 88.2 78.3 -63.0 -26.3 -15.3 -11.8 1.5 72 72 A Q T 345S+ 0 0 109 1,-0.2 -1,-0.3 3,-0.1 -2,-0.1 0.678 106.4 31.8 -58.5 -16.9 -16.1 -13.8 -1.6 73 73 A S T <45S+ 0 0 103 -3,-1.6 -1,-0.2 2,-0.0 -2,-0.2 0.677 121.8 47.8-111.0 -29.0 -16.0 -16.9 0.7 74 74 A G T <5S- 0 0 50 -4,-1.2 -3,-0.1 1,-0.0 -2,-0.1 0.926 120.3 -60.8 -76.0 -91.8 -17.3 -15.5 3.9 75 75 A L T 5S+ 0 0 73 2,-0.0 193,-1.3 -4,-0.0 2,-0.4 -0.437 72.1 141.2-165.4 81.1 -20.4 -13.3 3.5 76 76 A L B < -E 267 0B 29 -5,-0.7 191,-0.2 191,-0.3 2,-0.2 -0.993 38.2-137.1-131.4 131.4 -20.2 -10.2 1.3 77 77 A A - 0 0 40 189,-2.1 189,-0.5 -2,-0.4 192,-0.1 -0.593 26.3-111.1 -86.7 147.0 -22.8 -8.9 -1.1 78 78 A E - 0 0 77 -2,-0.2 2,-0.3 187,-0.1 26,-0.3 -0.262 29.6-123.2 -71.5 161.1 -21.9 -7.6 -4.5 79 79 A I - 0 0 65 24,-2.3 24,-0.2 26,-0.1 26,-0.1 -0.813 12.7-131.9-109.1 149.6 -22.2 -3.9 -5.4 80 80 A T - 0 0 77 -2,-0.3 2,-0.1 24,-0.0 24,-0.0 -0.833 21.8-133.9-101.7 134.6 -24.2 -2.3 -8.2 81 81 A P - 0 0 79 0, 0.0 2,-0.1 0, 0.0 -1,-0.0 -0.450 17.1-161.1 -85.7 159.7 -22.6 0.3 -10.6 82 82 A D >> - 0 0 45 -2,-0.1 3,-0.7 199,-0.0 4,-0.7 -0.210 46.4 -70.0-116.8-153.1 -24.1 3.6 -11.6 83 83 A K H 3> S+ 0 0 163 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.635 115.7 81.0 -81.5 -14.8 -23.4 6.1 -14.5 84 84 A A H 3> S+ 0 0 30 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.753 92.7 51.8 -62.1 -22.7 -20.0 7.1 -12.9 85 85 A F H <> S+ 0 0 58 -3,-0.7 4,-1.3 2,-0.2 3,-0.3 0.966 113.1 38.6 -77.6 -58.1 -18.7 3.9 -14.6 86 86 A Q H < S+ 0 0 184 -4,-0.7 -2,-0.2 1,-0.2 -1,-0.1 0.795 108.3 70.1 -61.5 -29.6 -19.9 4.4 -18.1 87 87 A D H < S- 0 0 121 -4,-2.4 -1,-0.2 1,-0.1 -2,-0.2 0.945 130.1 -54.7 -54.6 -54.7 -19.0 8.1 -17.7 88 88 A K H < + 0 0 143 -4,-1.0 217,-0.5 -3,-0.3 2,-0.4 -0.025 69.0 170.0 168.9 72.7 -15.3 7.7 -17.6 89 89 A L < - 0 0 25 -4,-1.3 215,-0.1 215,-0.1 -4,-0.1 -0.780 45.8-101.1 -99.7 142.0 -13.8 5.2 -15.1 90 90 A Y >> - 0 0 92 -2,-0.4 3,-2.2 1,-0.2 4,-1.4 -0.440 27.5-155.5 -61.6 109.3 -10.1 4.2 -15.2 91 91 A P H 3> S+ 0 0 77 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.794 92.8 63.2 -57.5 -28.4 -10.2 0.7 -16.9 92 92 A F H 34 S+ 0 0 154 1,-0.2 4,-0.1 2,-0.2 -2,-0.1 0.637 104.8 48.4 -71.3 -14.0 -6.9 -0.1 -15.1 93 93 A T H <> S+ 0 0 45 -3,-2.2 4,-0.6 2,-0.1 3,-0.3 0.894 119.0 30.9 -92.1 -50.1 -8.7 0.3 -11.8 94 94 A W H < S+ 0 0 61 -4,-1.4 3,-0.2 1,-0.2 -2,-0.2 0.788 109.5 67.5 -81.2 -28.4 -11.9 -1.8 -12.2 95 95 A D T < S+ 0 0 81 -4,-1.9 3,-0.3 -5,-0.3 -1,-0.2 0.761 108.8 39.8 -62.0 -24.2 -10.3 -4.3 -14.6 96 96 A A T 4 S+ 0 0 39 -3,-0.3 -1,-0.2 -5,-0.2 -2,-0.2 0.626 103.9 68.5 -98.1 -18.0 -8.2 -5.5 -11.7 97 97 A V S < S+ 0 0 12 -4,-0.6 2,-0.3 -3,-0.2 -1,-0.2 -0.165 78.9 110.7 -95.0 41.3 -10.9 -5.2 -9.0 98 98 A R - 0 0 100 -3,-0.3 2,-0.3 75,-0.2 5,-0.2 -0.888 42.5-175.3-116.3 147.2 -12.9 -8.2 -10.5 99 99 A Y B > S-F 102 0C 32 3,-1.8 3,-0.8 -2,-0.3 5,-0.1 -0.895 74.1 -18.9-146.0 110.9 -13.4 -11.6 -9.0 100 100 A N T 3 S- 0 0 154 -2,-0.3 3,-0.1 1,-0.2 74,-0.0 0.799 123.9 -59.5 63.8 28.5 -15.2 -14.5 -10.8 101 101 A G T 3 S+ 0 0 73 1,-0.3 2,-0.3 0, 0.0 -1,-0.2 0.764 115.8 113.0 71.6 25.9 -16.8 -11.9 -13.1 102 102 A K B < -F 99 0C 104 -3,-0.8 -3,-1.8 2,-0.0 2,-0.9 -0.969 64.2-138.3-131.4 146.3 -18.4 -10.1 -10.2 103 103 A L + 0 0 32 -2,-0.3 -24,-2.3 -24,-0.2 2,-0.1 -0.680 39.6 151.0-104.3 78.8 -17.8 -6.7 -8.6 104 104 A I + 0 0 20 -2,-0.9 2,-0.2 -26,-0.3 -1,-0.1 -0.251 62.2 42.3-101.5 44.8 -18.0 -7.4 -4.9 105 105 A A - 0 0 3 -8,-0.2 160,-0.1 -2,-0.1 158,-0.1 -0.821 59.8-157.4 177.1 142.3 -15.7 -4.5 -3.9 106 106 A Y E -D 264 0A 34 158,-0.9 158,-2.9 -2,-0.2 2,-0.3 -0.996 21.6-126.4-134.7 131.1 -15.0 -0.9 -4.7 107 107 A P E +D 263 0A 14 0, 0.0 196,-0.3 0, 0.0 156,-0.3 -0.578 36.1 156.6 -78.9 133.2 -11.7 1.1 -4.1 108 108 A I E + 0 0 33 154,-2.4 2,-0.2 -2,-0.3 155,-0.1 -0.110 60.4 47.2-146.7 38.9 -11.9 4.4 -2.2 109 109 A A E - 0 0 19 153,-0.1 153,-1.7 -47,-0.0 2,-0.7 -0.685 61.6-148.2 179.4 123.2 -8.4 4.9 -0.8 110 110 A V E -D 261 0A 48 191,-0.4 2,-0.5 151,-0.2 191,-0.2 -0.877 17.3-175.8-104.3 115.0 -4.9 4.7 -2.3 111 111 A E E +D 260 0A 47 149,-2.2 149,-0.7 -2,-0.7 2,-0.3 -0.930 27.3 111.8-113.2 126.8 -2.2 3.6 0.1 112 112 A A - 0 0 9 -2,-0.5 2,-0.3 147,-0.2 118,-0.2 -0.955 50.7 -88.9-171.9-177.4 1.5 3.5 -1.1 113 113 A L - 0 0 55 145,-0.5 2,-0.3 -2,-0.3 115,-0.2 -0.789 17.1-150.8-117.6 162.5 5.0 5.0 -0.8 114 114 A S E -G 227 0D 26 113,-1.5 113,-0.7 -2,-0.3 2,-0.7 -0.823 26.1-116.7-117.9 162.4 7.2 7.8 -2.2 115 115 A L E -GH 226 245D 8 130,-2.4 130,-3.0 -2,-0.3 2,-0.2 -0.882 35.4-137.5-100.8 114.8 10.9 8.0 -2.6 116 116 A I E - 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0 0 45 -2,-1.5 4,-2.3 1,-0.1 5,-0.2 -0.980 52.5-161.6-132.8 120.9 -12.4 9.7 -10.2 305 305 A K H > S+ 0 0 89 -217,-0.5 4,-1.1 -2,-0.4 -1,-0.1 0.851 94.7 53.6 -66.8 -35.9 -11.0 11.2 -13.3 306 306 A S H > S+ 0 0 91 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.909 112.7 42.1 -66.4 -43.8 -13.0 14.4 -12.9 307 307 A Y H >> S+ 0 0 70 1,-0.2 4,-1.7 2,-0.2 3,-1.3 0.940 114.1 49.9 -69.0 -49.2 -11.7 15.0 -9.4 308 308 A E H 3< S+ 0 0 37 -4,-2.3 -1,-0.2 1,-0.2 4,-0.2 0.725 96.4 73.9 -61.6 -23.3 -8.1 14.1 -10.1 309 309 A E H 3< S+ 0 0 141 -4,-1.1 3,-0.3 1,-0.2 -1,-0.2 0.836 108.7 30.7 -62.6 -30.2 -8.2 16.4 -13.1 310 310 A E H X< S+ 0 0 166 -3,-1.3 3,-1.3 -4,-0.6 -1,-0.2 0.737 101.4 86.3 -92.7 -29.7 -8.0 19.4 -10.7 311 311 A L G >< + 0 0 32 -4,-1.7 3,-1.2 1,-0.3 7,-0.2 0.476 53.6 108.5 -48.1 -5.6 -6.0 17.3 -8.3 312 312 A A G 3 S+ 0 0 84 1,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 0.725 71.9 61.2 -50.3 -22.0 -3.0 18.4 -10.3 313 313 A K G < S+ 0 0 188 -3,-1.3 -1,-0.3 2,-0.0 -2,-0.1 0.898 91.1 73.4 -74.2 -41.5 -2.2 20.5 -7.2 314 314 A D <> - 0 0 51 -3,-1.2 4,-0.5 1,-0.1 -15,-0.0 -0.581 64.2-161.2 -77.0 132.7 -1.8 17.5 -4.8 315 315 A P H > S+ 0 0 67 0, 0.0 4,-1.6 0, 0.0 5,-0.3 0.340 75.8 82.0 -94.6 5.7 1.3 15.4 -5.3 316 316 A R H > S+ 0 0 101 2,-0.2 4,-1.7 3,-0.2 5,-0.2 0.979 99.9 32.1 -72.4 -59.1 -0.0 12.4 -3.5 317 317 A I H > S+ 0 0 15 2,-0.2 4,-0.8 1,-0.2 -1,-0.1 0.800 123.1 50.6 -67.9 -31.6 -2.0 10.9 -6.4 318 318 A A H X S+ 0 0 48 -4,-0.5 4,-0.6 -7,-0.2 -2,-0.2 0.959 111.6 43.0 -73.4 -53.8 0.4 12.2 -9.0 319 319 A A H >X S+ 0 0 17 -4,-1.6 3,-1.4 1,-0.2 4,-0.7 0.946 118.6 44.6 -58.1 -51.1 3.7 10.9 -7.5 320 320 A T H 3X S+ 0 0 22 -4,-1.7 4,-2.4 -5,-0.3 -1,-0.2 0.772 99.7 73.2 -64.7 -25.8 2.3 7.5 -6.6 321 321 A M H 3X S+ 0 0 75 -4,-0.8 4,-1.4 1,-0.2 -1,-0.3 0.763 90.6 60.1 -59.7 -25.3 0.7 7.4 -10.1 322 322 A E H < S+ 0 0 42 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.904 100.5 50.3 -58.5 -44.0 1.1 2.6 -9.9 325 325 A Q H 3< S+ 0 0 135 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.840 124.0 30.8 -64.1 -34.2 1.4 2.4 -13.7 326 326 A K T 3< S+ 0 0 158 -4,-0.9 -1,-0.3 -5,-0.1 2,-0.2 -0.314 106.4 96.7-120.5 48.2 4.5 0.2 -13.4 327 327 A G < - 0 0 30 -3,-1.1 2,-0.4 -71,-0.1 -71,-0.1 -0.782 66.6-114.1-129.8 174.5 3.8 -1.6 -10.1 328 328 A E E -l 258 0H 84 -71,-0.7 -69,-0.8 -2,-0.2 2,-0.2 -0.893 27.4-118.6-113.9 142.7 2.4 -4.9 -8.8 329 329 A I E -l 259 0H 77 -2,-0.4 -69,-0.1 -71,-0.1 -71,-0.1 -0.552 42.4 -95.3 -78.2 138.8 -0.9 -5.4 -6.8 330 330 A M - 0 0 61 -71,-0.9 -1,-0.1 -2,-0.2 -72,-0.0 0.003 48.8 -96.5 -48.0 157.6 -0.5 -6.9 -3.3 331 331 A P - 0 0 60 0, 0.0 -1,-0.1 0, 0.0 -266,-0.0 -0.272 26.5-168.9 -76.6 165.7 -0.9 -10.7 -3.0 332 332 A N + 0 0 58 -266,-0.0 -2,-0.0 -263,-0.0 0, 0.0 0.007 51.0 106.9-144.1 28.5 -4.1 -12.5 -1.9 333 333 A I - 0 0 16 1,-0.1 3,-0.4 0, 0.0 4,-0.3 -0.906 58.1-147.9-114.3 140.6 -2.9 -16.1 -1.3 334 334 A P S > S+ 0 0 106 0, 0.0 3,-1.1 0, 0.0 4,-0.2 0.777 98.2 64.0 -74.4 -26.6 -2.5 -17.8 2.1 335 335 A Q G > S+ 0 0 108 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.778 88.3 69.9 -67.0 -27.0 0.4 -19.9 0.8 336 336 A M G > S+ 0 0 41 -3,-0.4 3,-1.6 1,-0.3 4,-0.3 0.776 83.1 71.7 -61.8 -26.3 2.4 -16.7 0.3 337 337 A S G X S+ 0 0 69 -3,-1.1 3,-1.1 -4,-0.3 -1,-0.3 0.730 84.3 69.6 -62.2 -21.4 2.6 -16.4 4.0 338 338 A A G X S+ 0 0 40 -3,-1.8 3,-2.0 1,-0.2 4,-0.4 0.775 79.9 75.7 -67.3 -27.3 5.0 -19.4 3.9 339 339 A F G X> S+ 0 0 44 -3,-1.6 4,-2.2 -4,-0.3 3,-1.9 0.782 77.5 75.1 -55.7 -28.1 7.6 -17.1 2.2 340 340 A W H <> S+ 0 0 187 -3,-1.1 4,-1.2 -4,-0.3 -1,-0.3 0.838 93.1 53.3 -53.9 -32.7 8.3 -15.5 5.6 341 341 A Y H <> S+ 0 0 167 -3,-2.0 4,-0.8 -4,-0.2 -1,-0.3 0.680 109.4 50.5 -75.1 -19.2 10.1 -18.7 6.5 342 342 A A H <> S+ 0 0 7 -3,-1.9 4,-2.7 -4,-0.4 3,-0.2 0.931 105.4 50.8 -82.6 -54.5 12.2 -18.2 3.3 343 343 A V H X>S+ 0 0 36 -4,-2.2 4,-2.0 1,-0.2 5,-0.8 0.824 110.5 52.0 -54.8 -35.4 13.3 -14.6 3.8 344 344 A R H <>S+ 0 0 121 -4,-1.2 5,-2.0 -5,-0.3 4,-0.3 0.891 115.5 39.3 -70.8 -39.9 14.5 -15.4 7.3 345 345 A T H <>S+ 0 0 38 -4,-0.8 5,-0.6 -3,-0.2 -2,-0.2 0.758 118.1 50.9 -80.1 -26.5 16.6 -18.4 6.2 346 346 A A H <5S+ 0 0 2 -4,-2.7 4,-0.5 3,-0.2 -2,-0.2 0.974 127.3 15.1 -74.8 -60.6 17.8 -16.6 3.1 347 347 A V T X5S+ 0 0 27 -4,-2.0 4,-1.9 -5,-0.2 -3,-0.2 0.946 134.9 38.1 -80.7 -56.3 19.1 -13.3 4.4 348 348 A I H >>XS+ 0 0 68 -5,-2.0 3,-1.0 1,-0.2 4,-0.9 0.922 119.2 45.3 -55.9 -48.1 20.7 -17.5 8.0 350 350 A A H 34 - 0 0 71 -2,-0.3 4,-3.2 1,-0.1 5,-0.3 -0.730 23.1-129.5 -94.2 139.7 25.1 -20.2 1.4 357 357 A V H >>S+ 0 0 44 -2,-0.4 4,-2.0 1,-0.2 5,-1.1 0.776 107.5 61.8 -54.6 -27.6 22.7 -18.4 -1.0 358 358 A D H >>S+ 0 0 109 3,-0.2 4,-0.9 1,-0.2 5,-0.7 0.973 117.1 24.5 -64.2 -57.0 22.9 -21.5 -3.2 359 359 A E H 45S+ 0 0 117 -3,-0.2 -2,-0.2 3,-0.2 -1,-0.2 0.728 126.6 52.0 -80.9 -24.6 21.5 -24.0 -0.7 360 360 A A H <5S+ 0 0 5 -4,-3.2 4,-0.4 3,-0.1 -3,-0.2 0.941 123.2 22.8 -77.6 -51.6 19.6 -21.3 1.3 361 361 A L H X5S+ 0 0 21 -4,-2.0 4,-0.9 -5,-0.3 -3,-0.2 0.914 128.2 44.0 -82.6 -49.1 17.7 -19.6 -1.5 362 362 A K H >X S+ 0 0 17 -4,-0.4 4,-2.0 1,-0.2 -1,-0.3 0.826 95.1 56.3 -62.3 -31.4 14.3 -23.0 -0.1 365 365 A Q H