==== 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 AMINOTRANSFERASE 27-AUG-93 1ASA . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.SCHUMACHER,D.RINGE . 396 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17938.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 280 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 5.8 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 . 2 0.5 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 . 1 0.3 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 . 28 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 149 37.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 2 1 2 1 0 3 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 1 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 . 2 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 13 A M > 0 0 185 0, 0.0 3,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -52.2 -116.0 14.8 92.0 2 14 A F G > + 0 0 160 1,-0.2 3,-1.0 2,-0.1 0, 0.0 0.342 360.0 95.8 -89.4 11.2 -118.2 16.7 89.6 3 15 A E G 3 S+ 0 0 158 1,-0.3 -1,-0.2 3,-0.0 0, 0.0 0.589 87.6 41.2 -84.4 -12.0 -116.5 20.2 89.4 4 16 A N G < S+ 0 0 156 -3,-0.5 2,-0.7 2,-0.1 -1,-0.3 0.096 81.0 121.9-116.5 15.9 -114.3 19.7 86.3 5 17 A I < - 0 0 121 -3,-1.0 2,-0.2 3,-0.0 3,-0.1 -0.732 55.5-148.6 -81.3 119.4 -117.0 18.0 84.3 6 18 A T - 0 0 120 -2,-0.7 2,-0.1 1,-0.1 -2,-0.1 -0.586 25.4 -94.6 -82.3 156.5 -117.4 20.1 81.3 7 19 A A - 0 0 88 -2,-0.2 -1,-0.1 1,-0.1 0, 0.0 -0.441 37.8-122.9 -71.6 141.9 -120.8 20.3 79.7 8 20 A A - 0 0 88 -2,-0.1 -1,-0.1 1,-0.1 3,-0.1 -0.584 28.6-107.9 -76.5 148.7 -121.4 18.0 76.8 9 21 A P - 0 0 124 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.377 46.7 -93.6 -63.2 158.3 -122.5 19.5 73.4 10 22 A A - 0 0 71 1,-0.1 6,-0.0 2,-0.1 4,-0.0 -0.441 42.7 -98.7 -74.3 151.3 -126.1 18.9 72.6 11 23 A D > - 0 0 59 1,-0.1 4,-2.6 -2,-0.1 5,-0.4 -0.517 31.2-126.9 -63.9 132.9 -127.1 15.9 70.4 12 24 A P T 4 S+ 0 0 67 0, 0.0 359,-0.3 0, 0.0 4,-0.1 0.751 103.8 26.8 -52.2 -30.6 -127.5 17.0 66.7 13 25 A I T >> S+ 0 0 12 2,-0.1 4,-0.8 357,-0.1 3,-0.7 0.852 127.2 41.2 -98.5 -53.6 -131.0 15.4 66.4 14 26 A L H 3> S+ 0 0 98 1,-0.2 4,-1.2 2,-0.2 3,-0.3 0.774 106.2 63.3 -68.4 -27.9 -132.3 15.4 69.9 15 27 A G H 3X S+ 0 0 6 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.817 95.9 62.2 -64.7 -31.6 -131.0 18.9 70.8 16 28 A L H <> S+ 0 0 9 -3,-0.7 4,-2.6 -5,-0.4 -1,-0.2 0.860 99.2 53.0 -58.3 -41.6 -133.3 20.3 68.0 17 29 A A H X S+ 0 0 31 -4,-0.8 4,-2.3 -3,-0.3 -1,-0.2 0.925 105.6 57.3 -61.9 -37.6 -136.3 19.1 69.9 18 30 A D H < S+ 0 0 120 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.869 113.7 36.6 -57.2 -43.7 -134.8 21.0 72.9 19 31 A L H >X S+ 0 0 89 -4,-1.6 3,-1.1 1,-0.1 4,-1.0 0.829 114.0 54.5 -83.4 -36.7 -134.8 24.3 71.1 20 32 A F H >< S+ 0 0 26 -4,-2.6 3,-1.3 1,-0.3 -2,-0.2 0.955 102.8 58.1 -56.3 -51.7 -138.0 23.9 69.1 21 33 A R T 3< S+ 0 0 194 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.1 0.172 111.3 43.8 -68.9 23.0 -139.9 23.2 72.3 22 34 A A T <4 S+ 0 0 62 -3,-1.1 -1,-0.3 -2,-0.2 2,-0.2 0.473 84.6 108.8-138.2 -20.7 -138.7 26.6 73.5 23 35 A D << - 0 0 28 -3,-1.3 5,-0.1 -4,-1.0 -3,-0.0 -0.469 48.8-166.2 -68.9 127.6 -139.3 28.7 70.4 24 36 A E + 0 0 181 -2,-0.2 -1,-0.1 3,-0.0 -4,-0.0 0.244 47.7 120.1-102.0 2.1 -142.3 31.0 71.0 25 37 A R > - 0 0 85 1,-0.1 3,-1.2 2,-0.0 -2,-0.0 -0.607 62.5-139.6 -68.4 131.4 -142.7 31.9 67.3 26 38 A P T 3 S+ 0 0 143 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.871 96.4 46.9 -59.8 -37.5 -146.3 30.8 66.3 27 39 A G T 3 S+ 0 0 55 2,-0.0 -3,-0.0 -3,-0.0 -2,-0.0 0.051 74.0 140.2 -97.9 23.1 -145.2 29.5 62.9 28 40 A K < - 0 0 48 -3,-1.2 2,-0.4 -8,-0.1 339,-0.2 -0.171 38.4-148.6 -63.3 159.4 -142.1 27.4 63.7 29 41 A I B -a 367 0A 15 337,-2.5 339,-3.1 1,-0.1 351,-0.1 -0.984 3.2-149.5-133.4 124.5 -141.8 24.1 61.6 30 42 A N + 0 0 30 -2,-0.4 2,-1.1 337,-0.2 -1,-0.1 0.869 34.3 151.8 -75.2 -45.9 -140.0 21.0 63.1 31 43 A L + 0 0 2 345,-0.2 345,-1.6 1,-0.2 339,-0.5 0.492 55.7 87.5 40.9 8.0 -138.4 19.1 60.1 32 44 A G + 0 0 0 -2,-1.1 338,-0.2 337,-0.2 -1,-0.2 0.891 67.6 54.8-108.4 -77.5 -135.7 17.7 62.4 33 45 A I S S- 0 0 48 -20,-0.2 2,-2.2 -3,-0.1 -1,-0.1 -0.350 85.5-112.4 -72.3 142.6 -136.4 14.5 64.3 34 46 A G + 0 0 8 -2,-0.1 2,-0.4 -3,-0.0 -1,-0.1 -0.389 68.8 129.6 -71.5 63.3 -137.4 11.4 62.4 35 47 A V - 0 0 27 -2,-2.2 2,-0.3 312,-0.1 211,-0.1 -0.939 59.3-118.9-118.0 136.1 -141.0 11.1 63.6 36 48 A Y - 0 0 25 -2,-0.4 2,-0.4 210,-0.1 343,-0.1 -0.584 26.0-162.4 -71.0 137.0 -143.8 10.7 61.1 37 49 A K - 0 0 30 341,-1.3 6,-0.2 -2,-0.3 2,-0.1 -0.923 12.2-137.0-118.7 146.7 -146.5 13.5 61.1 38 50 A D > - 0 0 18 4,-3.0 3,-2.8 -2,-0.4 4,-0.2 -0.410 43.1 -71.9 -92.1 179.2 -149.8 12.9 59.5 39 51 A E T 3 S+ 0 0 131 1,-0.3 344,-0.3 2,-0.1 -1,-0.0 0.654 133.9 46.0 -36.0 -33.5 -151.9 15.3 57.3 40 52 A T T 3 S- 0 0 80 2,-0.1 -1,-0.3 341,-0.1 3,-0.1 0.268 120.5-101.8-100.1 1.6 -152.7 17.5 60.4 41 53 A G S < S+ 0 0 42 -3,-2.8 2,-0.3 1,-0.3 -2,-0.1 0.631 83.5 126.1 82.3 14.4 -149.2 17.7 61.9 42 54 A K - 0 0 104 -4,-0.2 -4,-3.0 0, 0.0 -1,-0.3 -0.708 57.7-146.6-100.0 149.3 -150.0 15.1 64.5 43 55 A T - 0 0 58 -2,-0.3 -6,-0.1 -6,-0.2 3,-0.0 -0.842 35.0-164.0-109.4 88.3 -148.0 11.9 65.2 44 56 A P - 0 0 50 0, 0.0 2,-0.6 0, 0.0 -8,-0.1 -0.226 26.0-109.4 -72.0 159.2 -151.1 9.9 66.2 45 57 A V - 0 0 69 1,-0.1 204,-0.1 205,-0.0 205,-0.1 -0.837 50.9-108.6 -85.9 125.8 -150.8 6.6 68.1 46 58 A L > - 0 0 19 -2,-0.6 4,-1.8 202,-0.4 5,-0.1 -0.034 15.1-125.7 -49.2 159.6 -151.9 4.0 65.4 47 59 A T H > S+ 0 0 81 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.836 108.9 55.9 -84.0 -31.0 -155.2 2.4 65.6 48 60 A S H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.939 110.9 45.9 -71.2 -33.1 -153.8 -1.2 65.4 49 61 A V H > S+ 0 0 1 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.901 111.5 51.6 -76.2 -32.9 -151.6 -0.4 68.4 50 62 A K H X S+ 0 0 123 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.906 110.9 48.4 -66.3 -38.7 -154.5 1.2 70.3 51 63 A K H X S+ 0 0 127 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.937 111.9 49.4 -64.0 -43.9 -156.7 -1.9 69.7 52 64 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.829 107.9 55.2 -62.1 -33.0 -153.8 -4.2 70.8 53 65 A E H X S+ 0 0 46 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.913 104.1 52.5 -69.0 -40.8 -153.4 -2.0 73.9 54 66 A Q H X S+ 0 0 102 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.922 110.1 51.4 -55.3 -45.4 -157.1 -2.6 74.8 55 67 A Y H X S+ 0 0 111 -4,-1.8 4,-3.0 2,-0.2 -1,-0.2 0.900 109.2 47.3 -51.6 -57.6 -156.4 -6.2 74.5 56 68 A L H < S+ 0 0 15 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.904 108.4 56.9 -64.1 -37.0 -153.4 -6.1 76.8 57 69 A L H < S+ 0 0 127 -4,-2.8 3,-0.4 1,-0.2 -1,-0.2 0.908 116.3 33.9 -60.6 -41.6 -155.4 -4.1 79.3 58 70 A E H < S+ 0 0 121 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.855 123.5 43.9 -80.2 -33.9 -158.1 -6.8 79.6 59 71 A N S < S+ 0 0 104 -4,-3.0 2,-0.4 -5,-0.2 -1,-0.2 0.034 83.8 104.8-106.6 33.6 -155.9 -9.8 79.2 60 72 A E + 0 0 73 -4,-0.5 3,-0.1 -3,-0.4 -4,-0.0 -0.907 33.4 174.3-121.6 129.5 -152.9 -9.2 81.3 61 73 A T + 0 0 148 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.766 62.6 16.4-104.7 -34.0 -152.4 -11.1 84.6 62 74 A T - 0 0 91 2,-0.1 -1,-0.2 1,-0.0 0, 0.0 -0.928 42.7-150.4-142.5 160.0 -148.9 -10.1 85.8 63 75 A K + 0 0 163 -2,-0.3 3,-0.1 -3,-0.1 225,-0.1 0.089 52.0 148.4-111.5 18.1 -146.1 -7.7 85.3 64 76 A N - 0 0 121 1,-0.1 -2,-0.1 0, 0.0 0, 0.0 -0.183 58.6 -72.3 -57.1 144.0 -143.6 -10.3 86.3 65 77 A Y - 0 0 184 1,-0.1 2,-0.2 220,-0.0 -1,-0.1 0.029 40.6-136.7 -49.6 133.8 -140.1 -10.1 84.7 66 78 A L - 0 0 42 220,-0.3 5,-0.1 -3,-0.1 -1,-0.1 -0.448 36.2 -95.2 -76.8 155.2 -139.6 -11.0 81.2 67 79 A G > - 0 0 43 3,-0.4 3,-2.5 -2,-0.2 -1,-0.1 -0.414 44.9 -94.0 -72.4 166.6 -136.5 -13.2 80.4 68 80 A I T 3 S+ 0 0 51 1,-0.3 -1,-0.1 217,-0.2 -2,-0.0 0.726 129.7 43.7 -51.4 -32.3 -133.3 -11.4 79.3 69 81 A D T 3 S- 0 0 36 1,-0.3 30,-1.6 29,-0.1 -1,-0.3 0.362 106.1-146.0 -96.8 0.6 -134.2 -11.9 75.7 70 82 A G < + 0 0 6 -3,-2.5 -3,-0.4 28,-0.2 -1,-0.3 -0.419 53.7 8.1 76.7-139.0 -137.8 -10.9 76.2 71 83 A I > - 0 0 22 -2,-0.2 4,-1.8 1,-0.1 -5,-0.0 -0.666 53.0-157.0 -86.1 126.7 -140.8 -12.3 74.4 72 84 A P H > S+ 0 0 65 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.795 94.6 59.5 -73.1 -30.0 -140.1 -15.4 72.1 73 85 A E H > S+ 0 0 95 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.976 107.6 47.4 -58.4 -48.7 -143.2 -14.7 70.1 74 86 A F H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.923 109.6 52.7 -52.7 -54.0 -141.7 -11.3 69.3 75 87 A G H X S+ 0 0 8 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.879 112.0 46.3 -52.7 -41.8 -138.4 -13.0 68.5 76 88 A R H X S+ 0 0 166 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.927 112.5 48.1 -67.5 -48.5 -140.1 -15.3 66.0 77 89 A C H X S+ 0 0 19 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.899 110.5 52.3 -58.3 -45.0 -142.2 -12.7 64.3 78 90 A T H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.892 108.8 50.3 -59.4 -48.5 -139.1 -10.4 63.9 79 91 A Q H X S+ 0 0 26 -4,-1.8 4,-2.9 2,-0.2 5,-0.4 0.859 110.1 50.9 -58.5 -39.5 -137.1 -13.3 62.3 80 92 A E H X S+ 0 0 81 -4,-2.0 4,-2.1 3,-0.2 -2,-0.2 0.933 112.1 46.1 -63.5 -45.2 -140.0 -13.9 59.9 81 93 A L H < S+ 0 0 2 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.912 121.2 38.3 -63.5 -41.7 -140.2 -10.2 58.9 82 94 A L H < S+ 0 0 0 -4,-2.7 -2,-0.2 -5,-0.1 -3,-0.2 0.969 131.9 20.9 -75.2 -51.2 -136.4 -10.0 58.5 83 95 A F H < S- 0 0 9 -4,-2.9 -3,-0.2 1,-0.2 5,-0.2 0.520 112.0 -85.7-101.6 -9.4 -135.6 -13.3 56.9 84 96 A G >< - 0 0 8 -4,-2.1 3,-2.2 -5,-0.4 2,-1.0 0.078 38.1 -88.3 102.0 138.9 -138.7 -14.8 55.4 85 97 A K T 3 S+ 0 0 107 1,-0.3 -5,-0.1 -5,-0.1 -8,-0.0 -0.703 123.8 17.5 -87.6 99.1 -141.5 -16.8 56.5 86 98 A G T 3 S+ 0 0 53 -2,-1.0 -1,-0.3 1,-0.2 -2,-0.1 0.557 93.1 162.5 107.2 19.2 -140.0 -20.2 55.9 87 99 A S <> - 0 0 22 -3,-2.2 4,-2.2 1,-0.1 -1,-0.2 -0.165 48.4-121.0 -66.2 162.1 -136.4 -19.2 55.7 88 100 A A H > S+ 0 0 57 2,-0.2 4,-1.8 1,-0.2 6,-0.2 0.720 111.5 55.7 -70.6 -26.9 -133.4 -21.5 56.1 89 101 A L H 4>S+ 0 0 7 2,-0.2 5,-2.2 -6,-0.2 6,-1.3 0.804 112.0 45.1 -77.4 -27.6 -131.9 -19.5 59.1 90 102 A I H >45S+ 0 0 39 3,-0.2 3,-1.4 4,-0.2 -2,-0.2 0.930 116.4 45.7 -72.5 -52.9 -135.2 -20.0 60.9 91 103 A N H 3<5S+ 0 0 114 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.2 0.751 112.5 47.9 -67.4 -26.4 -135.4 -23.6 59.9 92 104 A D T 3<5S- 0 0 98 -4,-1.8 173,-0.6 -5,-0.1 -1,-0.3 0.343 110.2-119.2 -93.4 10.1 -131.7 -24.5 60.8 93 105 A K T < 5S+ 0 0 146 -3,-1.4 -3,-0.2 171,-0.1 -2,-0.1 0.843 72.5 137.9 47.3 42.4 -132.2 -22.8 64.2 94 106 A R < + 0 0 33 -5,-2.2 168,-1.6 -6,-0.2 2,-0.3 0.677 47.0 64.8 -85.5 -25.1 -129.4 -20.5 63.0 95 107 A A E -B 261 0B 5 -6,-1.3 2,-0.3 166,-0.2 166,-0.2 -0.746 57.1-175.2-100.7 147.3 -130.7 -17.1 64.2 96 108 A R E -B 260 0B 73 164,-2.2 164,-2.6 -2,-0.3 2,-0.4 -0.987 10.5-162.4-135.8 132.2 -131.3 -16.1 67.9 97 109 A T E -B 259 0B 11 -2,-0.3 2,-0.4 162,-0.2 162,-0.2 -0.977 10.5-160.4-127.4 138.7 -132.9 -12.7 68.8 98 110 A A E -B 258 0B 0 160,-2.5 160,-2.7 -2,-0.4 2,-0.4 -0.884 25.7-123.3-104.8 138.7 -133.1 -10.7 72.0 99 111 A Q E -B 257 0B 1 -30,-1.6 158,-0.2 -2,-0.4 156,-0.1 -0.706 39.3-177.8 -80.6 129.6 -135.7 -8.0 72.5 100 112 A T E -B 256 0B 0 156,-2.6 156,-1.8 -2,-0.4 2,-1.3 -0.799 40.0 -92.3-126.1 163.7 -134.0 -4.6 73.2 101 113 A P S > S- 0 0 32 0, 0.0 4,-1.6 0, 0.0 154,-0.3 -0.737 92.1 -46.7 -81.5 92.5 -135.1 -1.0 74.1 102 114 A G H > S- 0 0 0 -2,-1.3 4,-2.1 152,-0.3 154,-0.3 0.155 80.8 -65.3 71.4 174.7 -135.2 0.2 70.5 103 115 A G H > S+ 0 0 7 152,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.799 135.5 58.7 -63.6 -27.5 -132.8 -0.1 67.7 104 116 A T H > S+ 0 0 47 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.958 105.4 47.3 -67.7 -47.6 -130.3 2.0 69.8 105 117 A G H X S+ 0 0 13 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.863 113.6 50.1 -60.8 -38.7 -130.5 -0.6 72.6 106 118 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.905 109.6 49.1 -60.9 -42.4 -129.9 -3.3 69.9 107 119 A L H X S+ 0 0 1 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.877 112.8 48.2 -71.2 -35.0 -126.9 -1.6 68.4 108 120 A R H X S+ 0 0 83 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.923 109.3 52.1 -70.8 -41.9 -125.4 -1.1 71.8 109 121 A V H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.897 109.7 50.1 -60.4 -40.5 -125.9 -4.8 72.8 110 122 A A H X S+ 0 0 2 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.918 113.1 47.2 -61.0 -42.8 -124.2 -5.8 69.6 111 123 A A H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.868 111.3 48.1 -69.3 -44.3 -121.3 -3.5 70.4 112 124 A D H X S+ 0 0 37 -4,-2.9 4,-2.1 2,-0.2 -1,-0.2 0.945 115.2 47.1 -58.4 -48.4 -120.9 -4.6 74.0 113 125 A F H X S+ 0 0 16 -4,-2.3 4,-2.5 -5,-0.2 5,-0.3 0.927 114.1 45.2 -62.7 -52.1 -121.0 -8.2 72.9 114 126 A L H X S+ 0 0 5 -4,-2.7 4,-1.3 1,-0.2 6,-0.3 0.900 112.2 52.9 -60.4 -36.7 -118.5 -7.8 70.0 115 127 A A H < S+ 0 0 37 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.898 119.7 32.2 -65.9 -42.3 -116.2 -5.8 72.1 116 128 A K H < S+ 0 0 99 -4,-2.1 -2,-0.2 1,-0.1 -1,-0.2 0.745 129.1 32.0 -89.7 -25.4 -116.0 -8.4 74.9 117 129 A N H < S+ 0 0 62 -4,-2.5 2,-0.2 -5,-0.2 -3,-0.2 0.418 112.0 62.4-111.4 -3.6 -116.4 -11.8 73.0 118 130 A T S < S- 0 0 57 -4,-1.3 -4,-0.0 -5,-0.3 0, 0.0 -0.736 73.2-127.2-128.6 164.7 -114.7 -11.0 69.7 119 131 A S + 0 0 95 -2,-0.2 -4,-0.1 53,-0.1 -1,-0.1 0.511 69.9 124.7 -82.6 -10.5 -111.4 -10.0 68.2 120 132 A V + 0 0 9 -6,-0.3 -2,-0.2 1,-0.2 53,-0.1 -0.265 23.9 161.6 -73.6 139.9 -113.1 -7.0 66.4 121 133 A K + 0 0 111 1,-0.2 22,-2.4 51,-0.1 2,-0.4 0.486 58.1 58.4-120.2 -34.7 -111.7 -3.6 67.0 122 134 A R E -c 143 0B 52 20,-0.2 52,-2.1 50,-0.1 2,-0.4 -0.887 52.0-168.5-114.0 144.0 -113.1 -1.6 64.1 123 135 A V E -cd 144 174B 0 20,-2.8 22,-2.6 -2,-0.4 2,-0.6 -0.990 17.5-145.8-123.8 130.1 -116.6 -0.8 62.9 124 136 A W E -cd 145 175B 3 50,-2.0 52,-2.6 -2,-0.4 2,-0.3 -0.887 19.8-177.5-102.4 117.5 -117.0 0.8 59.4 125 137 A V E -c 146 0B 6 20,-2.8 22,-1.8 -2,-0.6 4,-0.1 -0.872 29.2 -99.0-116.3 146.5 -119.9 3.3 59.1 126 138 A S E -c 147 0B 2 -2,-0.3 22,-0.2 50,-0.3 23,-0.1 -0.273 38.5-100.6 -66.7 146.1 -121.0 5.2 56.0 127 139 A N E S+c 148 0B 76 20,-2.1 23,-1.3 1,-0.2 22,-0.8 -0.947 114.4 20.8-103.2 107.8 -120.1 8.7 55.2 128 140 A P S S+ 0 0 30 0, 0.0 -1,-0.2 0, 0.0 57,-0.2 0.657 92.9 148.2 -91.4 162.3 -122.6 10.2 56.0 129 141 A S - 0 0 16 -2,-0.1 -4,-0.0 -4,-0.1 -2,-0.0 -0.720 59.6 -54.2-135.1-171.5 -124.6 8.0 58.4 130 142 A W > - 0 0 47 -2,-0.2 3,-1.8 53,-0.2 4,-0.4 -0.585 55.2-131.3 -60.2 124.6 -126.9 8.4 61.5 131 143 A P T >> S+ 0 0 56 0, 0.0 3,-0.7 0, 0.0 4,-0.7 0.803 100.7 61.6 -55.7 -32.2 -124.8 10.6 63.9 132 144 A N H 3> S+ 0 0 35 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.579 82.8 80.5 -77.1 -5.0 -125.4 8.4 66.9 133 145 A H H <> S+ 0 0 1 -3,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.947 93.0 49.2 -60.4 -43.7 -123.7 5.4 65.3 134 146 A K H <> S+ 0 0 92 -3,-0.7 4,-2.6 -4,-0.4 5,-0.2 0.890 110.0 51.3 -61.6 -40.0 -120.3 6.7 66.2 135 147 A S H X S+ 0 0 73 -4,-0.7 4,-1.0 2,-0.2 -1,-0.2 0.825 108.8 49.0 -71.7 -37.0 -121.3 7.4 69.7 136 148 A V H X S+ 0 0 9 -4,-1.8 4,-1.0 2,-0.2 -2,-0.2 0.958 115.4 43.8 -66.6 -49.8 -122.7 3.9 70.5 137 149 A F H >X>S+ 0 0 1 -4,-2.2 5,-1.9 2,-0.2 4,-0.9 0.890 112.5 49.7 -68.0 -41.4 -119.7 2.1 69.1 138 150 A N H 3<5S+ 0 0 64 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.812 107.5 58.1 -65.7 -25.3 -117.0 4.4 70.8 139 151 A S H 3<5S+ 0 0 66 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.813 102.8 52.4 -68.6 -32.7 -119.0 3.8 74.0 140 152 A A H <<5S- 0 0 19 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.702 125.2-105.6 -75.0 -19.1 -118.4 0.0 73.5 141 153 A G T <5S+ 0 0 65 -4,-0.9 -3,-0.2 1,-0.4 2,-0.2 0.340 81.1 127.1 108.8 0.2 -114.7 0.7 73.2 142 154 A L < - 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