==== 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 09-NOV-05 2D65 . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Y.TANAKA,N.NAKAGAWA,H.TADA,T.YANO,R.MASUI,S.KURAMITSU . 396 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18086.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 275 69.4 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 . 23 5.8 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 . 22 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 151 38.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.3 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 0 0 1 2 1 0 2 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 . 1 2 0 0 0 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 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 0 190 0, 0.0 3,-0.2 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 -35.8 41.6 13.9 15.2 2 6 A F > + 0 0 162 1,-0.2 3,-1.2 2,-0.1 0, 0.0 0.376 360.0 102.9-101.7 3.6 39.6 16.0 12.8 3 7 A E T 3 S+ 0 0 153 1,-0.2 -1,-0.2 3,-0.0 0, 0.0 0.847 89.5 37.6 -54.2 -38.6 41.3 19.4 13.2 4 8 A N T 3 S+ 0 0 155 -3,-0.2 -1,-0.2 2,-0.1 2,-0.1 0.358 80.2 127.6 -99.8 5.8 43.3 19.0 10.0 5 9 A I < - 0 0 115 -3,-1.2 2,-0.3 1,-0.1 -3,-0.0 -0.425 53.9-135.8 -64.5 133.7 40.7 17.4 7.7 6 10 A T - 0 0 121 -2,-0.1 2,-0.1 1,-0.1 -1,-0.1 -0.643 23.6 -98.4 -91.6 149.0 40.4 19.4 4.5 7 11 A T - 0 0 131 -2,-0.3 -1,-0.1 1,-0.1 0, 0.0 -0.394 44.1-116.0 -64.1 139.9 37.1 20.2 2.8 8 12 A A - 0 0 80 1,-0.1 2,-0.1 -2,-0.1 -1,-0.1 -0.523 28.1-104.8 -80.9 147.0 36.3 17.8 -0.0 9 13 A P - 0 0 124 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 -0.434 43.8-103.9 -67.7 141.4 36.0 19.0 -3.6 10 14 A A - 0 0 88 -2,-0.1 6,-0.0 1,-0.1 4,-0.0 -0.339 33.9-108.6 -67.1 148.0 32.4 19.2 -4.8 11 15 A D > - 0 0 55 1,-0.1 4,-2.0 -3,-0.1 5,-0.2 -0.665 21.8-134.5 -78.4 128.3 31.2 16.5 -7.2 12 16 A P T 4 S+ 0 0 69 0, 0.0 359,-0.4 0, 0.0 -1,-0.1 0.717 101.1 24.3 -55.6 -24.1 30.8 18.0 -10.7 13 17 A I T >4 S+ 0 0 11 357,-0.1 3,-1.4 2,-0.1 4,-0.3 0.816 127.9 39.5-106.7 -58.4 27.4 16.2 -11.1 14 18 A L T >4 S+ 0 0 94 1,-0.3 3,-1.0 2,-0.2 4,-0.5 0.753 105.5 70.4 -66.9 -22.6 25.9 15.6 -7.6 15 19 A G T 3X S+ 0 0 11 -4,-2.0 4,-1.4 1,-0.2 3,-0.4 0.695 81.7 73.0 -67.9 -18.7 27.2 19.0 -6.5 16 20 A L H <> S+ 0 0 9 -3,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.820 86.5 64.5 -64.7 -31.5 24.6 20.7 -8.6 17 21 A A H <> S+ 0 0 42 -3,-1.0 4,-1.7 -4,-0.3 -1,-0.2 0.886 103.3 46.6 -59.2 -41.0 21.9 19.6 -6.2 18 22 A D H > S+ 0 0 96 -4,-0.5 4,-1.8 -3,-0.4 -1,-0.2 0.873 111.6 50.0 -70.8 -38.4 23.4 21.8 -3.4 19 23 A L H X S+ 0 0 74 -4,-1.4 4,-1.6 1,-0.2 -2,-0.2 0.873 110.0 51.2 -67.8 -37.0 23.9 24.8 -5.7 20 24 A L H < S+ 0 0 19 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.890 106.3 56.5 -65.3 -39.1 20.3 24.5 -6.8 21 25 A R H < S+ 0 0 183 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.933 109.2 44.6 -56.4 -50.9 19.2 24.4 -3.1 22 26 A A H < S+ 0 0 83 -4,-1.8 2,-0.5 -5,-0.1 -1,-0.2 0.793 92.2 90.8 -67.0 -32.7 20.9 27.7 -2.3 23 27 A D < - 0 0 20 -4,-1.6 5,-0.1 1,-0.2 -4,-0.0 -0.551 52.7-175.9 -70.0 118.5 19.6 29.6 -5.4 24 28 A E + 0 0 184 -2,-0.5 -1,-0.2 4,-0.0 -4,-0.0 0.419 38.5 125.5 -96.8 1.7 16.4 31.2 -4.4 25 29 A R > - 0 0 85 1,-0.1 3,-0.7 2,-0.1 -2,-0.0 -0.312 60.2-134.2 -60.9 143.4 15.5 32.6 -7.9 26 30 A P T 3 S+ 0 0 136 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.869 93.6 55.2 -67.5 -44.0 12.1 31.5 -9.1 27 31 A G T 3 S+ 0 0 57 2,-0.1 -2,-0.1 340,-0.0 2,-0.0 -0.010 70.8 153.6 -88.0 33.6 12.8 30.4 -12.7 28 32 A K < - 0 0 81 -3,-0.7 2,-0.5 -2,-0.2 339,-0.2 -0.332 28.4-157.9 -62.4 138.0 15.5 27.9 -12.1 29 33 A I E -a 367 0A 15 337,-2.5 339,-3.2 336,-0.1 2,-0.9 -0.967 3.8-152.9-122.4 113.9 15.8 25.2 -14.7 30 34 A D E +a 368 0A 80 -2,-0.5 339,-0.1 337,-0.2 337,-0.1 -0.766 34.2 149.3 -91.6 103.4 17.5 22.0 -13.6 31 35 A L + 0 0 0 337,-2.2 345,-1.6 -2,-0.9 339,-0.4 -0.036 49.1 93.5-118.8 27.9 19.2 20.2 -16.5 32 36 A G + 0 0 0 337,-0.2 338,-0.2 343,-0.2 -18,-0.1 0.939 68.6 47.1 -85.3 -86.1 22.0 18.6 -14.5 33 37 A M S S- 0 0 74 -20,-0.2 2,-1.9 1,-0.1 343,-0.1 -0.251 88.7-107.6 -62.0 147.5 21.4 15.1 -13.2 34 38 A G + 0 0 13 344,-0.0 2,-0.4 343,-0.0 -1,-0.1 -0.545 66.8 138.7 -78.8 81.0 20.1 12.5 -15.5 35 39 A V - 0 0 36 -2,-1.9 2,-0.2 312,-0.1 211,-0.1 -0.979 52.2-117.5-126.1 138.1 16.6 12.1 -14.2 36 40 A Y - 0 0 15 -2,-0.4 2,-0.3 210,-0.1 343,-0.1 -0.484 28.1-170.2 -75.8 144.0 13.5 11.8 -16.3 37 41 A N - 0 0 28 341,-1.2 6,-0.2 -2,-0.2 2,-0.1 -0.964 14.1-136.5-130.0 147.3 10.8 14.4 -16.1 38 42 A D > - 0 0 27 4,-2.4 3,-2.8 -2,-0.3 4,-0.1 -0.369 47.9 -77.9 -92.7-178.8 7.3 14.3 -17.6 39 43 A E T 3 S+ 0 0 108 1,-0.3 344,-0.4 2,-0.1 -1,-0.0 0.712 131.9 57.2 -51.3 -24.0 5.6 17.2 -19.5 40 44 A T T 3 S- 0 0 75 2,-0.1 -1,-0.3 341,-0.1 3,-0.1 0.372 117.0-110.1 -91.5 3.6 4.9 18.8 -16.1 41 45 A G S < S+ 0 0 35 -3,-2.8 2,-0.3 1,-0.3 -2,-0.1 0.694 78.7 124.1 77.1 18.1 8.5 18.9 -15.0 42 46 A K - 0 0 137 -4,-0.1 -4,-2.4 0, 0.0 -1,-0.3 -0.775 61.3-136.5-110.4 155.9 8.0 16.2 -12.3 43 47 A T - 0 0 64 -2,-0.3 -6,-0.1 -6,-0.2 -7,-0.0 -0.827 38.1-166.8-110.9 88.6 9.8 12.9 -11.8 44 48 A P - 0 0 56 0, 0.0 2,-0.5 0, 0.0 -8,-0.1 -0.232 26.3-105.2 -77.1 162.8 6.8 10.6 -11.1 45 49 A V - 0 0 70 1,-0.1 204,-0.1 205,-0.0 205,-0.1 -0.748 48.0-108.5 -84.0 127.6 6.7 7.1 -9.7 46 50 A L > - 0 0 7 -2,-0.5 4,-2.1 202,-0.4 5,-0.1 -0.217 18.1-127.7 -56.6 149.9 5.9 4.7 -12.6 47 51 A T H > S+ 0 0 83 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.877 111.4 53.6 -67.7 -38.2 2.4 3.3 -12.5 48 52 A S H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.859 109.1 51.3 -63.8 -34.2 3.7 -0.3 -12.8 49 53 A V H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.928 106.5 52.0 -67.8 -46.7 5.9 0.5 -9.8 50 54 A K H X S+ 0 0 120 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.903 110.6 49.3 -56.8 -42.0 3.0 1.8 -7.7 51 55 A K H X S+ 0 0 108 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.874 110.0 50.6 -66.9 -36.3 1.1 -1.5 -8.5 52 56 A A H X S+ 0 0 0 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.912 110.7 49.0 -67.2 -40.8 4.1 -3.6 -7.5 53 57 A E H X S+ 0 0 48 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.824 108.9 53.7 -67.2 -30.9 4.4 -1.7 -4.2 54 58 A Q H X S+ 0 0 104 -4,-1.8 4,-1.3 -5,-0.2 -1,-0.2 0.932 109.7 48.4 -66.3 -45.7 0.7 -2.2 -3.7 55 59 A Y H X S+ 0 0 119 -4,-2.2 4,-1.9 1,-0.2 3,-0.4 0.921 111.7 48.5 -60.5 -46.5 1.3 -6.0 -4.2 56 60 A L H X S+ 0 0 16 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.884 105.9 57.7 -63.2 -39.8 4.2 -6.0 -1.8 57 61 A L H < S+ 0 0 139 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.836 115.0 38.3 -60.1 -31.8 2.3 -4.1 0.9 58 62 A E H < S+ 0 0 135 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.732 125.6 31.9 -93.3 -24.9 -0.3 -6.9 0.8 59 63 A N H < S+ 0 0 89 -4,-1.9 2,-0.3 -5,-0.1 -3,-0.2 0.602 86.6 105.3-109.6 -13.9 1.7 -10.1 0.4 60 64 A E < + 0 0 69 -4,-2.3 3,-0.1 -5,-0.3 -4,-0.0 -0.537 36.7 172.7 -71.7 125.9 5.0 -9.3 2.2 61 66 A T + 0 0 138 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.465 59.0 22.8-113.4 -3.8 5.1 -11.2 5.5 62 67 A T - 0 0 92 2,-0.1 -1,-0.2 1,-0.0 0, 0.0 -0.993 45.5-152.8-158.6 156.8 8.7 -10.6 6.7 63 68 A K + 0 0 168 -2,-0.3 3,-0.1 -3,-0.1 225,-0.1 0.047 48.1 150.8-116.1 20.2 11.7 -8.2 6.4 64 69 A N - 0 0 119 1,-0.1 -2,-0.1 0, 0.0 0, 0.0 -0.222 57.8 -76.8 -56.9 141.0 14.2 -10.9 7.2 65 70 A Y - 0 0 193 1,-0.1 2,-0.2 220,-0.0 -1,-0.1 0.080 41.7-136.7 -37.8 139.8 17.7 -10.6 5.7 66 71 A L - 0 0 47 220,-0.3 5,-0.1 1,-0.2 -1,-0.1 -0.512 38.3 -87.0 -91.2 168.3 18.1 -11.5 2.0 67 72 A G > - 0 0 43 3,-0.5 3,-2.4 -2,-0.2 -1,-0.2 -0.292 48.1 -94.8 -70.3 165.9 21.2 -13.6 1.1 68 73 A I T 3 S+ 0 0 44 1,-0.3 -1,-0.1 217,-0.2 -2,-0.1 0.819 127.8 48.1 -51.3 -35.1 24.4 -11.6 0.4 69 74 A D T 3 S- 0 0 50 1,-0.3 30,-2.6 29,-0.1 -1,-0.3 0.380 109.5-131.0 -90.2 3.7 23.6 -11.7 -3.3 70 75 A G < - 0 0 4 -3,-2.4 -3,-0.5 28,-0.2 -1,-0.3 -0.418 56.5 -1.1 88.5-161.0 20.0 -10.6 -2.9 71 76 A I > - 0 0 19 1,-0.1 4,-1.5 -2,-0.1 3,-0.4 -0.578 58.3-146.4 -73.2 120.0 16.7 -11.9 -4.3 72 77 A P H > S+ 0 0 78 0, 0.0 4,-2.0 0, 0.0 3,-0.2 0.888 97.5 53.0 -54.3 -44.5 17.3 -14.9 -6.5 73 78 A E H > S+ 0 0 76 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.861 104.9 57.7 -59.5 -36.7 14.4 -14.1 -8.9 74 79 A F H > S+ 0 0 1 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.912 106.0 49.6 -59.8 -43.8 15.9 -10.7 -9.4 75 80 A G H X S+ 0 0 9 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.920 110.9 47.9 -63.1 -45.9 19.1 -12.2 -10.5 76 81 A R H X S+ 0 0 134 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.943 113.3 47.3 -61.6 -48.7 17.4 -14.5 -13.1 77 82 A C H X S+ 0 0 18 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.867 110.7 52.7 -61.0 -37.1 15.3 -11.7 -14.5 78 83 A T H X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.899 110.2 48.5 -65.5 -40.3 18.4 -9.5 -14.7 79 84 A Q H X>S+ 0 0 24 -4,-2.1 4,-3.1 2,-0.2 5,-0.6 0.912 111.3 48.9 -66.6 -43.2 20.3 -12.2 -16.6 80 85 A E H X5S+ 0 0 76 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.923 111.0 50.7 -61.9 -43.6 17.4 -12.8 -19.1 81 86 A L H <5S+ 0 0 2 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.870 118.4 39.5 -62.8 -35.5 17.1 -9.0 -19.7 82 87 A L H <5S+ 0 0 1 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.2 0.944 130.2 20.2 -80.8 -52.8 20.9 -8.8 -20.4 83 88 A F H <5S- 0 0 11 -4,-3.1 -3,-0.2 -5,-0.1 -2,-0.2 0.644 112.2 -96.6 -97.1 -15.7 21.7 -11.9 -22.4 84 89 A G ><< - 0 0 7 -4,-1.8 3,-2.4 -5,-0.6 6,-0.2 0.080 37.9 -78.7 107.8 139.5 18.4 -13.0 -23.8 85 90 A K T 3 S+ 0 0 110 1,-0.3 -1,-0.1 -5,-0.1 -4,-0.1 0.776 127.4 26.2 -36.7 -50.8 15.7 -15.5 -22.8 86 91 A G T 3 S+ 0 0 60 -3,-0.1 -1,-0.3 -6,-0.1 -2,-0.1 0.014 85.7 156.4-111.4 31.1 17.5 -18.6 -24.0 87 92 A S <> - 0 0 24 -3,-2.4 4,-2.0 1,-0.1 5,-0.1 -0.123 47.8-130.4 -54.6 149.9 21.1 -17.5 -23.9 88 93 A A H > S+ 0 0 55 1,-0.2 4,-3.2 2,-0.2 6,-0.2 0.785 106.9 62.4 -72.4 -29.3 23.8 -20.2 -23.6 89 94 A L H 4>S+ 0 0 5 2,-0.2 5,-2.5 1,-0.2 6,-0.6 0.885 108.0 43.6 -63.0 -38.4 25.4 -18.3 -20.7 90 95 A I H >45S+ 0 0 43 3,-0.2 3,-1.0 -6,-0.2 -2,-0.2 0.939 115.4 47.2 -72.5 -46.7 22.2 -18.9 -18.7 91 96 A N H 3<5S+ 0 0 106 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.2 0.915 114.7 45.8 -61.5 -44.1 21.9 -22.5 -19.8 92 97 A D T 3<5S- 0 0 96 -4,-3.2 173,-0.5 -5,-0.1 -1,-0.3 0.490 108.5-125.4 -78.9 -1.4 25.5 -23.4 -19.1 93 98 A K T < 5 + 0 0 137 -3,-1.0 -3,-0.2 -4,-0.3 175,-0.2 0.902 64.1 140.6 58.3 44.6 25.3 -21.6 -15.7 94 99 A R < + 0 0 37 -5,-2.5 168,-2.2 -6,-0.2 2,-0.4 0.430 50.5 74.5 -95.2 -1.7 28.3 -19.4 -16.5 95 100 A A E -B 261 0B 7 -6,-0.6 2,-0.4 166,-0.2 166,-0.2 -0.926 52.3-175.8-121.2 140.8 26.7 -16.3 -14.9 96 101 A R E -B 260 0B 79 164,-2.6 164,-3.3 -2,-0.4 2,-0.4 -0.998 11.5-160.1-129.9 132.8 26.2 -15.2 -11.3 97 102 A T E -B 259 0B 14 -2,-0.4 2,-0.5 162,-0.2 162,-0.2 -0.950 5.6-163.9-121.0 134.6 24.4 -12.0 -10.4 98 103 A A E -B 258 0B 0 160,-2.3 160,-2.4 -2,-0.4 2,-0.2 -0.963 24.0-127.5-115.4 127.4 24.5 -10.1 -7.1 99 104 A Q E -B 257 0B 2 -30,-2.6 158,-0.3 -2,-0.5 156,-0.0 -0.537 37.9-172.2 -68.9 135.2 21.8 -7.5 -6.4 100 105 A T E -B 256 0B 0 156,-2.3 2,-2.1 -2,-0.2 156,-2.0 -0.878 37.2 -94.4-132.4 164.3 23.6 -4.3 -5.5 101 106 A P E > S-B 255 0B 34 0, 0.0 4,-0.8 0, 0.0 154,-0.3 -0.522 92.7 -46.5 -78.2 79.8 22.7 -0.8 -4.1 102 107 A G H > S- 0 0 0 -2,-2.1 4,-1.6 152,-0.6 154,-0.3 -0.057 76.9 -70.6 84.4 172.0 22.4 0.9 -7.5 103 108 A G H > S+ 0 0 8 152,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.852 134.3 54.3 -69.7 -34.1 24.7 0.7 -10.6 104 109 A T H > S+ 0 0 53 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.922 107.7 50.0 -65.5 -41.6 27.3 2.8 -8.8 105 110 A G H X S+ 0 0 13 -4,-0.8 4,-2.4 1,-0.2 -1,-0.2 0.873 107.7 54.7 -62.8 -36.0 27.2 0.2 -6.0 106 111 A A H X S+ 0 0 0 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.914 107.1 50.2 -63.2 -42.3 27.6 -2.5 -8.6 107 112 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.887 109.8 50.7 -63.0 -40.1 30.8 -0.7 -9.9 108 113 A R H X S+ 0 0 101 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.936 110.0 49.0 -64.0 -47.0 32.2 -0.5 -6.4 109 114 A V H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.926 112.7 48.8 -58.9 -44.3 31.7 -4.2 -5.8 110 115 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.928 111.9 49.4 -61.5 -44.8 33.3 -5.0 -9.1 111 116 A A H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.921 112.8 45.1 -61.8 -46.3 36.2 -2.7 -8.3 112 117 A D H X S+ 0 0 18 -4,-2.8 4,-1.9 1,-0.2 5,-0.2 0.909 113.6 51.8 -63.5 -42.1 36.9 -4.2 -4.8 113 118 A F H X S+ 0 0 15 -4,-2.5 4,-1.9 -5,-0.3 -2,-0.2 0.923 113.2 44.6 -59.5 -45.8 36.5 -7.7 -6.3 114 119 A L H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 6,-0.3 0.946 111.6 50.5 -65.3 -50.5 39.0 -7.0 -9.0 115 120 A A H < S+ 0 0 38 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.860 118.9 37.0 -58.2 -39.1 41.6 -5.2 -6.8 116 121 A K H < S+ 0 0 134 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.779 125.5 32.5 -87.9 -27.3 41.7 -8.0 -4.2 117 122 A N H < S+ 0 0 63 -4,-1.9 2,-0.3 -5,-0.2 -2,-0.2 0.428 112.6 45.1-113.7 1.5 41.3 -11.2 -6.3 118 123 A T S < S- 0 0 56 -4,-1.7 0, 0.0 -5,-0.1 0, 0.0 -0.834 77.2-113.0-136.7 176.1 43.0 -10.5 -9.7 119 124 A S + 0 0 104 -2,-0.3 -4,-0.1 54,-0.0 -5,-0.1 0.368 65.5 138.1 -91.0 3.9 46.2 -9.1 -11.2 120 125 A V + 0 0 9 -6,-0.3 -2,-0.1 1,-0.2 53,-0.1 -0.258 17.0 162.5 -53.3 130.2 44.3 -6.2 -12.7 121 126 A K + 0 0 152 1,-0.2 22,-2.2 51,-0.2 2,-0.3 0.594 58.1 45.9-121.1 -27.9 46.2 -2.9 -12.3 122 129 A R E -c 143 0B 63 50,-0.2 52,-2.3 20,-0.2 2,-0.4 -0.927 53.4-165.4-126.9 148.4 44.5 -0.7 -14.9 123 133 A V E -cd 144 174B 0 20,-2.1 22,-2.4 -2,-0.3 2,-0.6 -0.997 17.4-145.2-127.3 128.9 41.0 0.2 -16.0 124 134 A W E +cd 145 175B 1 50,-2.9 52,-2.9 -2,-0.4 2,-0.3 -0.868 21.2 177.6-100.8 123.7 40.4 2.0 -19.3 125 135 A V E -c 146 0B 11 20,-2.4 22,-2.0 -2,-0.6 52,-0.1 -0.896 30.0-101.4-122.6 154.0 37.6 4.5 -19.5 126 136 A S E -c 147 0B 5 -2,-0.3 22,-0.2 50,-0.3 4,-0.1 -0.247 32.1-116.5 -71.9 158.3 36.5 6.7 -22.4 127 137 A N E S+c 148 0B 88 20,-1.6 22,-0.7 1,-0.2 23,-0.7 -0.953 107.3 36.3-141.2 115.9 37.2 10.4 -22.7 128 138 A P S S+ 0 0 30 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.537 103.1 129.7 -66.2 158.7 34.9 12.2 -22.7 129 139 A G - 0 0 22 -2,-0.2 -2,-0.1 55,-0.1 3,-0.1 -0.767 62.4 -57.3-155.1-159.5 33.2 10.0 -20.1 130 140 A W > - 0 0 48 -2,-0.2 3,-2.1 1,-0.1 4,-0.5 -0.885 39.4-146.5-102.3 112.0 31.4 9.8 -16.8 131 141 A P T >> S+ 0 0 57 0, 0.0 4,-1.5 0, 0.0 3,-0.6 0.779 92.0 69.0 -46.9 -36.7 33.6 11.2 -14.0 132 142 A T H 3> S+ 0 0 23 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.759 88.5 67.5 -58.5 -25.4 32.3 8.8 -11.3 133 143 A H H <> S+ 0 0 3 -3,-2.1 4,-2.2 2,-0.2 5,-0.3 0.945 102.1 43.0 -61.0 -50.1 34.1 6.0 -13.1 134 144 A K H <> S+ 0 0 101 -3,-0.6 4,-3.1 -4,-0.5 5,-0.3 0.956 113.7 53.3 -61.1 -48.7 37.6 7.3 -12.3 135 145 A S H X S+ 0 0 68 -4,-1.5 4,-1.9 1,-0.2 -2,-0.2 0.900 111.2 45.0 -52.3 -48.8 36.6 8.1 -8.7 136 146 A V H X S+ 0 0 15 -4,-2.5 4,-0.7 2,-0.2 -1,-0.2 0.941 117.3 41.8 -65.1 -49.7 35.2 4.6 -8.0 137 147 A F H ><>S+ 0 0 0 -4,-2.2 5,-2.1 1,-0.2 3,-0.9 0.905 114.2 52.3 -66.5 -40.9 38.1 2.6 -9.5 138 148 A N H ><5S+ 0 0 75 -4,-3.1 3,-1.7 -5,-0.3 -1,-0.2 0.883 104.1 57.7 -60.5 -39.8 40.7 5.0 -8.0 139 149 A S H 3<5S+ 0 0 70 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.727 103.8 53.3 -65.0 -20.1 39.2 4.6 -4.6 140 150 A A T <<5S- 0 0 22 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.440 125.2-102.7 -92.4 -1.5 39.8 0.8 -4.9 141 151 A G T < 5S+ 0 0 66 -3,-1.7 2,-0.3 1,-0.3 -3,-0.2 0.683 80.1 128.1 90.2 19.1 43.4 1.3 -5.7 142 152 A L < - 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