==== 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 TRANSFERASE(AMINOTRANSFERASE) 01-JUL-94 1AMR . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR I.MIYAHARA,K.HIROTSU,H.HAYASHI,H.KAGAMIYAMA . 396 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18125.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 281 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 5.3 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 . 3 0.8 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 . 24 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 37.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.0 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 1 0 0 2 2 0 1 2 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 2 0 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 PARALLEL BRIDGES PER LADDER . 0 1 1 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 3 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 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 5 A M 0 0 192 0, 0.0 3,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -37.0 41.6 14.9 14.0 2 6 A F > + 0 0 159 1,-0.2 3,-2.2 2,-0.1 0, 0.0 0.540 360.0 97.0 -97.8 -8.4 39.4 16.9 11.5 3 7 A E T 3 S+ 0 0 162 1,-0.3 -1,-0.2 3,-0.0 0, 0.0 0.758 89.7 47.0 -49.9 -31.9 41.1 20.4 11.7 4 8 A N T 3 S+ 0 0 154 -3,-0.3 2,-0.3 2,-0.1 -1,-0.3 0.457 79.7 123.8 -93.4 -3.8 43.1 19.5 8.6 5 9 A I < - 0 0 119 -3,-2.2 2,-0.3 1,-0.0 -3,-0.1 -0.444 50.9-147.2 -69.5 123.6 40.4 18.1 6.4 6 10 A T - 0 0 123 -2,-0.3 2,-0.2 1,-0.1 -2,-0.1 -0.634 25.1-105.6 -84.4 145.9 40.1 19.9 3.1 7 11 A A - 0 0 91 -2,-0.3 -1,-0.1 1,-0.1 3,-0.0 -0.493 32.2-124.7 -72.9 138.2 36.7 20.2 1.5 8 12 A A - 0 0 90 -2,-0.2 2,-0.1 1,-0.1 3,-0.1 -0.535 31.6-104.3 -79.2 148.1 36.1 17.9 -1.5 9 13 A P - 0 0 123 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.470 48.2 -87.7 -71.1 153.4 35.0 19.7 -4.7 10 14 A A - 0 0 86 1,-0.1 5,-0.0 -2,-0.1 6,-0.0 -0.270 49.7 -95.5 -61.4 145.5 31.3 19.3 -5.5 11 15 A D > - 0 0 67 1,-0.2 4,-1.6 -3,-0.1 5,-0.2 -0.425 30.2-132.6 -60.8 130.3 30.3 16.3 -7.6 12 16 A P T 4 S+ 0 0 71 0, 0.0 359,-0.3 0, 0.0 -1,-0.2 0.772 101.3 24.6 -58.3 -27.2 30.3 17.4 -11.2 13 17 A I T >4 S+ 0 0 11 2,-0.1 3,-1.3 357,-0.1 4,-0.5 0.856 128.0 38.9-101.3 -62.1 26.9 15.7 -11.7 14 18 A L T >4 S+ 0 0 110 1,-0.3 3,-0.5 2,-0.2 4,-0.5 0.675 107.0 69.1 -64.7 -17.8 25.1 15.4 -8.3 15 19 A G T >X S+ 0 0 7 -4,-1.6 4,-1.5 1,-0.2 3,-0.8 0.775 85.7 66.5 -72.0 -27.2 26.4 18.9 -7.4 16 20 A L H <> S+ 0 0 12 -3,-1.3 4,-2.7 1,-0.2 -1,-0.2 0.814 89.7 67.5 -61.3 -31.5 24.2 20.6 -10.0 17 21 A A H <> S+ 0 0 46 -3,-0.5 4,-1.3 -4,-0.5 -1,-0.2 0.871 101.6 46.3 -57.4 -38.8 21.2 19.4 -7.9 18 22 A D H <4 S+ 0 0 123 -3,-0.8 3,-0.3 -4,-0.5 -2,-0.2 0.954 112.8 47.1 -68.8 -52.3 22.3 21.9 -5.2 19 23 A L H >X S+ 0 0 73 -4,-1.5 3,-1.8 1,-0.2 4,-1.2 0.897 107.4 59.6 -56.4 -43.4 22.9 24.9 -7.4 20 24 A F H 3< S+ 0 0 26 -4,-2.7 3,-0.3 1,-0.3 -1,-0.2 0.874 111.5 37.0 -58.0 -43.7 19.6 24.3 -9.2 21 25 A R T 3< S+ 0 0 216 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.152 107.4 69.6 -97.7 25.4 17.5 24.7 -6.1 22 26 A A T <4 S+ 0 0 78 -3,-1.8 2,-0.8 1,-0.2 -2,-0.2 0.660 88.6 67.0-106.2 -27.0 19.7 27.4 -4.7 23 27 A D < - 0 0 42 -4,-1.2 2,-1.3 -3,-0.3 -1,-0.2 -0.841 66.7-160.1-103.4 106.1 18.7 30.0 -7.3 24 28 A E + 0 0 166 -2,-0.8 3,-0.1 -3,-0.1 -3,-0.1 -0.746 39.9 138.1 -82.9 99.0 15.1 31.1 -7.1 25 29 A R > - 0 0 104 -2,-1.3 3,-0.9 1,-0.2 -2,-0.1 -0.896 56.9-123.8-148.0 107.4 14.7 32.5 -10.5 26 30 A P T 3 S+ 0 0 107 0, 0.0 2,-0.8 0, 0.0 -1,-0.2 0.698 95.9 40.5 -15.0 -74.2 11.4 31.7 -12.1 27 31 A G T 3 S+ 0 0 41 -3,-0.1 2,-0.1 2,-0.0 -3,-0.0 -0.224 72.6 155.5 -90.8 49.2 12.2 29.9 -15.4 28 32 A K < - 0 0 55 -3,-0.9 2,-0.4 -2,-0.8 339,-0.2 -0.400 27.1-154.2 -70.1 148.8 15.1 27.6 -14.6 29 33 A I E -a 367 0A 13 337,-2.7 339,-3.1 -2,-0.1 2,-0.7 -0.993 2.1-150.9-129.3 124.5 15.6 24.6 -16.8 30 34 A N E +a 368 0A 47 -2,-0.4 339,-0.1 337,-0.2 337,-0.1 -0.850 32.8 150.8-101.4 104.1 17.4 21.5 -15.5 31 35 A L + 0 0 0 337,-2.5 345,-2.2 -2,-0.7 339,-0.4 0.064 53.5 85.4-116.2 22.1 19.2 19.5 -18.2 32 36 A G + 0 0 0 337,-0.2 338,-0.2 343,-0.2 -18,-0.1 0.934 69.2 53.6 -86.6 -88.5 21.9 18.1 -15.9 33 37 A I S S- 0 0 39 -20,-0.2 2,-1.6 1,-0.1 -1,-0.0 -0.212 86.4-110.0 -55.9 139.2 21.3 14.9 -13.9 34 38 A G + 0 0 5 343,-0.0 2,-0.4 344,-0.0 -1,-0.1 -0.523 65.5 132.4 -77.4 84.8 20.1 11.8 -15.9 35 39 A V - 0 0 38 -2,-1.6 2,-0.2 312,-0.1 211,-0.1 -0.964 55.5-114.9-131.7 142.5 16.5 11.4 -14.8 36 40 A Y - 0 0 17 -2,-0.4 2,-0.3 210,-0.1 343,-0.1 -0.576 29.9-170.5 -78.3 145.8 13.5 10.8 -17.0 37 41 A K - 0 0 55 341,-1.2 6,-0.2 -2,-0.2 2,-0.2 -0.977 13.2-136.9-134.2 143.6 10.8 13.4 -17.2 38 42 A D > - 0 0 30 4,-2.3 3,-3.5 -2,-0.3 4,-0.4 -0.464 47.4 -75.7 -91.8 176.5 7.4 13.2 -18.9 39 43 A E T 3 S+ 0 0 90 1,-0.3 344,-0.3 -2,-0.2 -1,-0.0 0.596 133.2 51.3 -46.0 -20.3 5.6 15.8 -21.0 40 44 A T T 3 S- 0 0 98 2,-0.1 -1,-0.3 341,-0.1 3,-0.1 0.258 119.5-106.5-103.8 10.7 4.8 17.8 -17.9 41 45 A G S < S+ 0 0 33 -3,-3.5 2,-0.3 1,-0.3 -2,-0.1 0.842 77.0 131.2 68.6 35.3 8.3 17.8 -16.5 42 46 A K - 0 0 104 -4,-0.4 -4,-2.3 2,-0.0 -1,-0.3 -0.847 55.5-142.5-117.5 155.8 7.6 15.3 -13.8 43 47 A T - 0 0 59 -2,-0.3 -6,-0.1 -6,-0.2 2,-0.0 -0.812 34.6-170.1-116.2 82.5 9.5 12.1 -12.8 44 48 A P - 0 0 49 0, 0.0 2,-0.5 0, 0.0 -8,-0.1 -0.320 27.5-112.0 -75.2 156.1 6.6 9.8 -11.9 45 49 A V - 0 0 68 1,-0.1 204,-0.1 -2,-0.0 5,-0.1 -0.769 48.9-102.4 -84.6 130.6 6.7 6.5 -10.3 46 50 A L > - 0 0 8 -2,-0.5 4,-1.9 202,-0.3 5,-0.1 -0.180 19.2-124.9 -52.9 148.6 5.7 3.9 -12.9 47 51 A T H > S+ 0 0 83 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.916 112.0 52.6 -63.0 -44.4 2.2 2.4 -12.7 48 52 A S H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.837 108.4 52.7 -60.4 -32.8 3.5 -1.2 -12.6 49 53 A V H > S+ 0 0 3 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.891 108.2 49.4 -69.7 -41.4 5.7 -0.1 -9.7 50 54 A K H X S+ 0 0 128 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.918 113.8 47.1 -63.3 -40.5 2.7 1.3 -7.9 51 55 A K H X S+ 0 0 100 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.944 113.2 46.9 -65.8 -47.6 0.8 -2.0 -8.6 52 56 A A H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.893 110.8 53.3 -61.7 -40.1 3.8 -4.2 -7.4 53 57 A E H X S+ 0 0 50 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.853 107.5 50.7 -64.9 -36.6 4.2 -2.0 -4.3 54 58 A Q H X S+ 0 0 125 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.962 109.7 50.6 -65.1 -49.7 0.6 -2.5 -3.4 55 59 A Y H X S+ 0 0 131 -4,-2.3 4,-2.6 1,-0.2 3,-0.2 0.905 110.0 50.4 -52.6 -45.6 0.9 -6.2 -3.8 56 60 A L H X S+ 0 0 14 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.913 107.1 53.5 -61.1 -43.2 4.0 -6.2 -1.6 57 61 A L H < S+ 0 0 144 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.835 112.9 45.6 -60.6 -31.5 2.2 -4.2 1.1 58 62 A E H < S+ 0 0 133 -4,-1.8 -2,-0.2 -3,-0.2 -1,-0.2 0.912 123.5 31.1 -77.0 -44.7 -0.6 -6.9 1.1 59 63 A N H < S+ 0 0 88 -4,-2.6 2,-0.2 -5,-0.2 -2,-0.2 0.649 84.8 104.8 -95.5 -18.1 1.7 -9.9 1.1 60 64 A E < + 0 0 65 -4,-2.9 3,-0.1 -5,-0.2 -4,-0.0 -0.489 33.1 173.6 -68.7 132.7 4.9 -9.2 3.0 61 66 A T + 0 0 138 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.415 62.2 23.7-117.7 0.5 4.9 -10.8 6.4 62 67 A T - 0 0 94 2,-0.1 -1,-0.2 1,-0.0 0, 0.0 -0.994 45.4-153.2-163.2 154.3 8.5 -10.0 7.5 63 68 A K + 0 0 162 -2,-0.3 3,-0.1 -3,-0.1 225,-0.1 -0.119 49.6 150.4-117.6 27.8 11.5 -7.7 6.9 64 69 A N - 0 0 118 1,-0.2 -2,-0.1 2,-0.1 0, 0.0 -0.347 58.9 -70.6 -63.5 146.8 14.0 -10.5 8.0 65 70 A Y - 0 0 187 1,-0.1 -1,-0.2 220,-0.0 3,-0.1 -0.005 38.5-139.9 -42.3 139.6 17.5 -10.3 6.4 66 71 A L - 0 0 51 220,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.587 39.1-105.5 -82.4 -14.7 17.8 -11.1 2.8 67 72 A G > - 0 0 36 1,-0.1 3,-2.8 2,-0.1 -1,-0.1 0.197 43.5 -80.0 91.9 134.8 21.0 -13.2 2.6 68 73 A I T 3 S+ 0 0 48 1,-0.3 -1,-0.1 217,-0.2 31,-0.1 0.763 129.4 43.1 -42.5 -46.0 24.2 -11.7 1.1 69 74 A D T 3 S- 0 0 52 1,-0.3 30,-1.4 29,-0.1 -1,-0.3 0.372 105.9-135.4 -87.9 8.0 23.3 -12.1 -2.5 70 75 A G < + 0 0 5 -3,-2.8 -1,-0.3 28,-0.2 218,-0.1 -0.437 55.8 0.1 81.9-153.4 19.7 -10.9 -2.2 71 76 A I > - 0 0 32 1,-0.1 4,-2.1 -2,-0.1 3,-0.4 -0.687 58.2-146.1 -81.8 122.3 16.5 -12.3 -3.6 72 77 A P H > S+ 0 0 108 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.871 97.6 51.8 -52.5 -51.9 17.0 -15.5 -5.8 73 78 A E H > S+ 0 0 80 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.862 108.5 53.9 -57.7 -36.3 14.3 -14.8 -8.3 74 79 A F H > S+ 0 0 0 -3,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.983 110.2 45.8 -60.5 -55.1 15.7 -11.3 -8.8 75 80 A G H X S+ 0 0 10 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.862 115.3 47.9 -55.8 -37.7 19.1 -12.8 -9.6 76 81 A R H X S+ 0 0 122 -4,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.895 110.7 49.3 -72.6 -41.0 17.5 -15.3 -11.9 77 82 A C H X S+ 0 0 7 -4,-3.0 4,-1.3 1,-0.2 -2,-0.2 0.883 108.5 54.1 -67.8 -35.8 15.3 -12.8 -13.8 78 83 A T H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 3,-0.4 0.932 105.2 52.8 -65.9 -42.6 18.3 -10.4 -14.4 79 84 A Q H X>S+ 0 0 24 -4,-1.6 4,-3.0 1,-0.3 5,-0.6 0.845 108.3 51.0 -60.7 -37.9 20.4 -13.2 -16.0 80 85 A E H X5S+ 0 0 60 -4,-1.3 4,-0.8 3,-0.2 -1,-0.3 0.797 110.9 49.6 -69.1 -30.3 17.6 -14.0 -18.4 81 86 A L H <5S+ 0 0 7 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.960 118.9 37.5 -69.3 -51.6 17.4 -10.3 -19.2 82 87 A L H <5S+ 0 0 0 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.943 133.0 21.6 -64.9 -54.0 21.2 -10.0 -19.8 83 88 A F H <5S- 0 0 12 -4,-3.0 4,-0.3 -5,-0.2 -3,-0.2 0.686 108.6-107.4 -94.0 -22.2 21.9 -13.3 -21.5 84 89 A G << - 0 0 6 -4,-0.8 6,-0.2 -5,-0.6 -3,-0.1 0.033 28.2 -90.3 104.9 145.1 18.6 -14.5 -22.9 85 90 A K S S+ 0 0 154 -5,-0.2 -1,-0.1 1,-0.1 -4,-0.1 0.830 124.4 46.5 -59.9 -35.1 16.2 -17.2 -21.8 86 91 A G S S+ 0 0 45 -6,-0.1 5,-0.3 -3,-0.1 -1,-0.1 0.998 83.6 134.1 -66.6 -73.0 17.9 -19.8 -24.1 87 92 A S >> - 0 0 32 -4,-0.3 4,-1.8 3,-0.1 3,-0.6 0.798 56.2-139.4 21.0 123.6 21.5 -19.1 -23.2 88 93 A A H 3> S+ 0 0 58 1,-0.2 4,-3.0 2,-0.2 6,-0.2 0.770 100.3 67.1 -69.8 -27.0 24.2 -21.8 -22.4 89 94 A L H 34>S+ 0 0 8 2,-0.2 5,-2.4 1,-0.2 6,-0.7 0.893 105.8 42.1 -60.2 -41.2 25.6 -19.6 -19.6 90 95 A I H X45S+ 0 0 37 -3,-0.6 3,-1.0 -6,-0.2 -2,-0.2 0.923 116.4 47.3 -72.3 -45.7 22.4 -20.1 -17.7 91 96 A N H 3<5S+ 0 0 111 -4,-1.8 -2,-0.2 -5,-0.3 -1,-0.2 0.845 112.2 48.7 -66.2 -36.3 22.1 -23.8 -18.5 92 97 A D T 3<5S- 0 0 95 -4,-3.0 173,-0.5 -5,-0.1 -1,-0.3 0.413 108.8-125.8 -82.4 -0.7 25.7 -24.6 -17.6 93 98 A K T < 5 + 0 0 128 -3,-1.0 -3,-0.2 -5,-0.2 175,-0.1 0.878 65.3 140.1 55.9 43.0 25.3 -22.7 -14.4 94 99 A R < + 0 0 30 -5,-2.4 168,-1.9 -6,-0.2 2,-0.3 0.585 48.6 73.7 -89.9 -13.5 28.3 -20.5 -15.2 95 100 A A E -B 261 0B 6 -6,-0.7 2,-0.4 166,-0.2 166,-0.2 -0.805 54.5-172.1-109.0 146.1 26.8 -17.3 -13.9 96 101 A R E -B 260 0B 66 164,-2.3 164,-2.8 -2,-0.3 2,-0.4 -0.997 10.0-158.2-135.5 128.6 26.2 -16.0 -10.3 97 102 A T E -B 259 0B 10 -2,-0.4 2,-0.4 162,-0.2 162,-0.2 -0.874 6.4-165.6-114.3 139.6 24.3 -12.8 -9.5 98 103 A A E -B 258 0B 0 160,-1.6 160,-1.9 -2,-0.4 2,-0.5 -0.954 24.3-127.0-117.3 138.1 24.4 -10.7 -6.4 99 104 A Q E -B 257 0B 1 -30,-1.4 158,-0.3 -2,-0.4 156,-0.0 -0.788 38.6-177.0 -83.6 128.7 21.7 -8.0 -5.7 100 105 A T E -B 256 0B 0 156,-2.5 2,-1.8 -2,-0.5 156,-1.6 -0.831 39.5 -94.2-130.7 160.5 23.3 -4.7 -5.0 101 106 A P S > S- 0 0 33 0, 0.0 4,-1.1 0, 0.0 154,-0.3 -0.563 91.5 -48.0 -73.2 84.5 22.4 -1.1 -4.1 102 107 A G H > S- 0 0 0 -2,-1.8 4,-1.5 152,-0.2 154,-0.3 0.065 77.5 -67.8 77.8 171.8 22.3 0.3 -7.6 103 108 A G H > S+ 0 0 6 152,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.851 133.2 57.6 -65.3 -34.6 24.6 -0.0 -10.5 104 109 A T H > S+ 0 0 45 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.929 106.4 49.3 -61.9 -43.3 27.2 2.1 -8.7 105 110 A G H X S+ 0 0 13 -4,-1.1 4,-2.7 1,-0.2 -1,-0.2 0.844 108.6 52.5 -64.2 -35.7 27.1 -0.4 -5.9 106 111 A A H X S+ 0 0 0 -4,-1.5 4,-1.5 2,-0.2 -1,-0.2 0.857 108.7 50.9 -68.6 -35.3 27.6 -3.2 -8.3 107 112 A L H X S+ 0 0 1 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.924 112.1 47.3 -68.2 -42.6 30.7 -1.4 -9.8 108 113 A R H X S+ 0 0 82 -4,-2.4 4,-3.2 2,-0.2 5,-0.3 0.967 111.0 48.7 -64.5 -51.5 32.1 -1.0 -6.3 109 114 A V H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.3 -1,-0.2 0.825 113.0 49.6 -58.4 -32.6 31.6 -4.6 -5.2 110 115 A A H X S+ 0 0 0 -4,-1.5 4,-2.7 -5,-0.2 -1,-0.3 0.886 111.9 48.7 -71.0 -38.2 33.2 -5.8 -8.4 111 116 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.941 113.2 45.9 -65.5 -48.2 36.1 -3.4 -7.8 112 117 A D H X S+ 0 0 42 -4,-3.2 4,-1.6 1,-0.2 5,-0.2 0.875 113.7 51.1 -62.4 -38.5 36.6 -4.6 -4.3 113 118 A F H X S+ 0 0 16 -4,-1.8 4,-2.2 -5,-0.3 3,-0.4 0.964 111.8 43.8 -62.3 -57.2 36.3 -8.2 -5.4 114 119 A L H X S+ 0 0 3 -4,-2.7 4,-1.0 1,-0.2 6,-0.6 0.819 112.4 55.8 -57.4 -34.9 38.9 -7.9 -8.2 115 120 A A H < S+ 0 0 41 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.826 115.5 33.4 -70.4 -36.5 41.2 -6.0 -5.9 116 121 A K H < S+ 0 0 131 -4,-1.6 -2,-0.2 -3,-0.4 -1,-0.2 0.788 128.5 31.8 -93.0 -25.5 41.4 -8.5 -3.2 117 122 A N H < S+ 0 0 52 -4,-2.2 2,-0.2 -5,-0.2 -2,-0.2 0.321 112.9 52.0-117.3 11.1 41.2 -11.8 -5.1 118 123 A T S < S- 0 0 60 -4,-1.0 -4,-0.0 -5,-0.2 0, 0.0 -0.763 77.1-117.2-138.9 175.2 42.8 -11.1 -8.4 119 124 A S + 0 0 105 -2,-0.2 2,-0.2 53,-0.1 -4,-0.1 0.033 65.5 135.2-102.8 22.6 46.0 -9.8 -9.8 120 125 A V + 0 0 12 -6,-0.6 -2,-0.1 1,-0.2 53,-0.1 -0.544 19.0 163.2 -72.4 137.3 44.2 -6.9 -11.6 121 126 A K + 0 0 139 1,-0.3 22,-2.3 -2,-0.2 2,-0.4 0.582 59.6 40.3-124.7 -26.3 46.0 -3.6 -11.1 122 129 A R E -c 143 0B 41 20,-0.2 52,-1.9 50,-0.2 2,-0.4 -0.985 55.7-158.5-140.2 139.1 44.5 -1.4 -13.8 123 133 A V E -cd 144 174B 1 20,-3.7 22,-2.1 -2,-0.4 2,-0.5 -0.932 17.9-139.1-113.5 131.3 41.0 -0.8 -15.4 124 134 A W E -cd 145 175B 6 50,-3.1 52,-3.1 -2,-0.4 2,-0.4 -0.812 23.0-176.5 -94.9 121.9 40.6 0.8 -18.8 125 135 A V E -c 146 0B 0 20,-2.8 22,-1.9 -2,-0.5 52,-0.1 -0.927 27.4-108.0-119.8 140.5 37.8 3.4 -19.1 126 136 A S E -c 147 0B 1 -2,-0.4 22,-0.2 50,-0.3 23,-0.0 -0.249 39.5 -99.1 -64.9 157.0 36.6 5.2 -22.3 127 137 A N E S+c 148 0B 82 20,-2.0 23,-1.1 1,-0.1 22,-0.8 -0.978 110.1 23.8-123.1 112.2 37.4 8.8 -22.9 128 138 A P S S+ 0 0 32 0, 0.0 2,-0.3 0, 0.0 57,-0.2 0.658 91.2 148.2 -85.1 175.3 35.0 10.4 -22.2 129 139 A S - 0 0 10 -2,-0.1 -2,-0.0 -4,-0.1 -4,-0.0 -0.900 57.7 -57.6-153.3 176.4 32.9 8.4 -19.7 130 140 A W > - 0 0 53 53,-0.4 3,-2.0 -2,-0.3 4,-0.4 -0.558 53.8-130.4 -63.0 125.5 30.6 8.7 -16.7 131 141 A P T >> S+ 0 0 45 0, 0.0 4,-0.8 0, 0.0 3,-0.7 0.740 100.2 63.3 -50.6 -32.7 32.7 10.7 -14.2 132 142 A N H 3> S+ 0 0 41 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.589 81.7 80.8 -76.7 -7.7 32.1 8.4 -11.3 133 143 A H H <> S+ 0 0 0 -3,-2.0 4,-2.0 2,-0.2 5,-0.2 0.942 93.3 48.3 -60.0 -44.7 33.8 5.5 -13.0 134 144 A K H <> S+ 0 0 46 -3,-0.7 4,-2.8 -4,-0.4 5,-0.3 0.959 110.9 49.0 -60.8 -54.6 37.2 6.8 -11.9 135 145 A S H X S+ 0 0 60 -4,-0.8 4,-1.6 1,-0.2 -1,-0.2 0.850 109.5 51.7 -56.0 -40.1 36.3 7.4 -8.3 136 146 A V H X S+ 0 0 8 -4,-1.9 4,-0.9 2,-0.2 3,-0.3 0.971 114.3 41.5 -64.6 -51.7 34.8 4.0 -7.8 137 147 A F H ><>S+ 0 0 2 -4,-2.0 5,-2.3 1,-0.2 3,-0.7 0.880 114.3 52.1 -64.9 -34.8 37.8 2.1 -9.2 138 148 A N H ><5S+ 0 0 95 -4,-2.8 3,-1.4 1,-0.2 -1,-0.2 0.794 101.0 62.9 -70.9 -26.5 40.2 4.4 -7.3 139 149 A S H 3<5S+ 0 0 70 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.794 104.6 48.0 -65.3 -29.8 38.3 3.8 -4.1 140 150 A A T <<5S- 0 0 17 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.263 122.5-106.2 -94.0 7.1 39.3 0.1 -4.4 141 151 A G T < 5S+ 0 0 65 -3,-1.4 -3,-0.2 1,-0.3 2,-0.2 0.680 75.5 135.2 78.9 13.7 42.9 0.9 -5.1 142 152 A L < - 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