==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER AMINOTRANSFERASE 04-OCT-93 1TAS . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR E.HOHENESTER,J.N.JANSONIUS . 804 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30169.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 600 74.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 45 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 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 0.1 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 . 53 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 89 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 306 38.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 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 4 2 0 2 4 3 2 1 6 1 1 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 0 4 0 2 2 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 PARALLEL BRIDGES PER LADDER . 2 2 2 0 2 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 . 6 0 0 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 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 3 A S 0 0 158 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 123.8 7.6 0.9 81.8 2 4 A S - 0 0 43 1,-0.0 3,-0.3 0, 0.0 4,-0.2 -0.222 360.0 -79.6-107.7-160.6 9.4 4.2 82.3 3 5 A W S S+ 0 0 20 1,-0.2 520,-0.2 -2,-0.1 3,-0.2 0.775 123.4 33.0 -73.3 -39.9 12.7 5.3 83.7 4 6 A W S > S+ 0 0 1 1,-0.1 3,-1.3 2,-0.1 -1,-0.2 0.134 76.6 112.2-111.6 19.9 11.8 5.1 87.3 5 7 A S T 3 S+ 0 0 63 1,-0.3 -1,-0.1 -3,-0.3 -2,-0.1 0.890 80.9 52.7 -60.1 -37.3 9.4 2.3 87.6 6 8 A H T 3 S+ 0 0 55 -3,-0.2 2,-0.7 -4,-0.2 -1,-0.3 0.558 79.0 113.8 -74.8 -10.2 11.9 0.2 89.6 7 9 A V < - 0 0 1 -3,-1.3 669,-0.1 1,-0.1 670,-0.1 -0.576 58.4-152.6 -71.3 111.4 12.5 3.0 92.1 8 10 A E - 0 0 152 -2,-0.7 2,-0.5 1,-0.1 672,-0.1 -0.129 24.2 -91.6 -78.6 170.6 11.1 1.6 95.4 9 11 A M - 0 0 112 670,-0.1 -1,-0.1 671,-0.0 667,-0.1 -0.759 44.3-147.1 -87.4 131.0 9.7 3.5 98.2 10 12 A G - 0 0 7 -2,-0.5 670,-0.1 666,-0.3 669,-0.1 -0.678 18.5-104.0 -97.1 153.1 12.4 4.3 100.8 11 13 A P - 0 0 100 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.301 36.2-104.0 -75.9 160.9 12.0 4.5 104.5 12 14 A P - 0 0 91 0, 0.0 4,-0.0 0, 0.0 667,-0.0 -0.415 51.4 -81.3 -78.0 160.0 11.8 7.7 106.3 13 15 A D > - 0 0 35 1,-0.1 4,-0.9 -2,-0.1 5,-0.4 -0.414 28.8-129.9 -71.4 137.7 14.8 8.7 108.3 14 16 A P T 4 S+ 0 0 98 0, 0.0 361,-0.3 0, 0.0 -1,-0.1 0.665 103.5 15.4 -61.8 -20.0 15.3 7.3 111.6 15 17 A I T >> S+ 0 0 12 359,-0.1 3,-1.6 3,-0.1 4,-0.8 0.671 132.0 39.6-116.0 -68.4 15.9 10.7 113.1 16 18 A L H 3> S+ 0 0 21 1,-0.3 4,-1.0 2,-0.2 3,-0.4 0.837 107.5 65.1 -55.4 -31.6 14.7 13.3 110.8 17 19 A G H 3X S+ 0 0 8 -4,-0.9 4,-2.1 1,-0.2 -1,-0.3 0.788 91.2 66.5 -64.1 -24.7 11.6 11.3 109.7 18 20 A V H <> S+ 0 0 8 -3,-1.6 4,-1.9 -5,-0.4 -1,-0.2 0.971 94.5 56.0 -62.3 -47.9 10.3 11.6 113.2 19 21 A T H X S+ 0 0 33 -4,-0.8 4,-2.0 -3,-0.4 -1,-0.2 0.836 104.8 55.0 -53.5 -28.5 9.9 15.3 112.8 20 22 A E H X S+ 0 0 64 -4,-1.0 4,-0.9 1,-0.2 -1,-0.2 0.992 107.5 47.7 -66.4 -53.7 7.8 14.5 109.8 21 23 A A H < S+ 0 0 26 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.697 109.2 53.9 -58.4 -25.7 5.5 12.3 111.8 22 24 A F H >< S+ 0 0 44 -4,-1.9 3,-2.0 -5,-0.2 -1,-0.2 0.986 97.4 62.7 -75.7 -47.9 5.1 14.7 114.4 23 25 A K H 3< S+ 0 0 152 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.691 103.4 53.7 -40.2 -33.3 4.1 17.5 112.1 24 26 A R T 3< S+ 0 0 194 -4,-0.9 2,-0.5 2,-0.0 -1,-0.3 -0.087 84.8 98.9 -95.5 28.3 1.0 15.3 111.3 25 27 A D < - 0 0 28 -3,-2.0 5,-0.1 1,-0.1 -3,-0.0 -0.981 51.3-166.3-120.3 136.0 -0.3 14.8 114.7 26 28 A T + 0 0 144 -2,-0.5 2,-0.1 3,-0.0 -1,-0.1 0.421 45.6 123.8 -99.3 -5.0 -3.1 16.9 115.9 27 29 A N > - 0 0 52 1,-0.2 3,-1.5 2,-0.1 -2,-0.1 -0.428 60.5-140.1 -60.0 129.0 -2.9 16.2 119.5 28 30 A S T 3 S+ 0 0 121 1,-0.3 -1,-0.2 -2,-0.1 -2,-0.0 0.332 100.2 57.8 -72.6 2.1 -2.5 19.6 121.3 29 31 A K T 3 S+ 0 0 122 340,-0.0 -1,-0.3 2,-0.0 -2,-0.1 0.017 74.8 139.9-120.2 15.3 -0.2 17.9 123.6 30 32 A K < - 0 0 57 -3,-1.5 2,-0.4 -5,-0.1 341,-0.2 -0.313 31.8-162.6 -71.4 151.3 2.3 16.6 121.2 31 33 A M E -a 371 0A 8 339,-2.1 341,-3.3 -2,-0.0 2,-0.9 -0.978 8.9-154.9-134.9 119.7 6.1 16.7 122.0 32 34 A N E +a 372 0A 34 -2,-0.4 341,-0.1 351,-0.2 339,-0.1 -0.851 31.3 151.4-100.2 109.0 8.8 16.3 119.5 33 35 A L + 0 0 0 339,-2.3 347,-0.7 -2,-0.9 341,-0.4 -0.245 44.9 97.9-126.1 37.2 11.8 15.0 121.3 34 36 A G S S+ 0 0 0 339,-0.2 2,-0.3 1,-0.2 340,-0.2 0.883 75.9 41.4 -92.0 -65.1 13.3 13.2 118.3 35 37 A V S S- 0 0 12 -20,-0.1 2,-1.4 -19,-0.1 -1,-0.2 -0.710 92.4-104.4 -90.8 149.6 16.0 15.4 116.8 36 38 A G + 0 0 0 769,-1.7 2,-0.4 -2,-0.3 -1,-0.1 -0.490 64.6 138.8 -71.9 84.4 18.4 17.4 119.0 37 39 A A - 0 0 5 -2,-1.4 2,-0.4 314,-0.1 213,-0.1 -0.996 48.0-121.0-137.1 134.0 17.1 20.9 118.8 38 40 A Y - 0 0 18 -2,-0.4 8,-0.7 8,-0.1 2,-0.3 -0.608 23.8-172.3 -84.1 137.1 16.9 23.2 121.5 39 41 A R B -B 45 0B 53 343,-2.1 345,-0.1 -2,-0.4 4,-0.0 -0.864 23.5-119.7-118.1 152.0 13.8 24.9 122.7 40 42 A D > - 0 0 39 4,-4.3 3,-0.8 -2,-0.3 -1,-0.2 0.049 46.5 -84.0 -74.4-161.9 13.5 27.6 125.2 41 43 A D T 3 S+ 0 0 61 1,-0.3 345,-1.1 2,-0.1 346,-0.7 0.761 129.4 58.6 -77.7 -27.1 11.5 27.1 128.5 42 44 A N T 3 S- 0 0 119 343,-0.2 -1,-0.3 2,-0.1 343,-0.1 0.313 124.2-105.8 -81.8 7.4 8.3 27.9 126.8 43 45 A G S < S+ 0 0 31 -3,-0.8 -2,-0.1 1,-0.3 342,-0.1 0.788 81.9 126.0 72.5 30.7 9.0 25.0 124.6 44 46 A K - 0 0 127 1,-0.1 -4,-4.3 0, 0.0 -1,-0.3 -0.841 66.3 -86.3-120.3 155.6 9.9 27.4 121.6 45 47 A P B -B 39 0B 45 0, 0.0 2,-0.5 0, 0.0 -6,-0.2 -0.178 39.2-142.5 -59.7 150.3 12.8 27.9 119.3 46 48 A Y - 0 0 68 -8,-0.7 2,-0.7 -6,-0.1 -8,-0.1 -0.952 11.3-164.3-124.3 117.8 15.6 30.1 120.4 47 49 A V - 0 0 25 -2,-0.5 5,-0.1 419,-0.0 206,-0.1 -0.907 37.7-113.8 -99.4 115.9 17.5 32.4 118.2 48 50 A L > - 0 0 2 -2,-0.7 4,-2.0 204,-0.4 5,-0.2 -0.156 14.1-132.4 -51.7 138.2 20.6 33.4 120.1 49 51 A N H > S+ 0 0 77 1,-0.2 4,-1.9 2,-0.2 3,-0.2 0.930 109.2 55.2 -56.0 -44.7 20.7 37.0 121.1 50 52 A C H > S+ 0 0 0 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.893 106.9 52.5 -58.6 -38.3 24.2 37.3 119.8 51 53 A V H > S+ 0 0 1 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.821 104.3 53.8 -69.5 -31.9 22.9 35.9 116.5 52 54 A R H X S+ 0 0 56 -4,-2.0 4,-1.9 -3,-0.2 -1,-0.2 0.883 111.0 48.9 -70.1 -31.3 20.2 38.4 116.2 53 55 A K H < S+ 0 0 95 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.898 108.4 49.7 -71.2 -42.7 22.8 41.1 116.7 54 56 A A H >X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 3,-1.6 0.886 109.6 57.1 -60.9 -38.3 25.3 39.8 114.1 55 57 A E H >X S+ 0 0 43 -4,-1.8 4,-2.2 1,-0.3 3,-0.8 0.963 102.5 51.1 -52.9 -60.2 22.3 39.6 111.8 56 58 A A H 3X S+ 0 0 63 -4,-1.9 4,-1.0 1,-0.3 -1,-0.3 0.435 108.9 54.1 -58.9 -1.1 21.5 43.2 112.1 57 59 A M H <> S+ 0 0 69 -3,-1.6 4,-1.0 2,-0.2 -1,-0.3 0.778 103.4 51.5-103.2 -34.5 25.1 44.0 111.4 58 60 A I H <<>S+ 0 0 20 -4,-1.9 5,-1.2 -3,-0.8 4,-0.5 0.901 113.7 50.4 -62.1 -36.8 25.4 42.2 108.2 59 61 A A H ><5S+ 0 0 49 -4,-2.2 3,-2.0 1,-0.2 -2,-0.2 0.975 110.1 43.4 -61.9 -65.5 22.3 44.0 107.3 60 62 A A H 3<5S+ 0 0 83 -4,-1.0 -1,-0.2 1,-0.3 -2,-0.2 0.577 107.5 64.1 -63.1 -9.0 23.3 47.5 108.2 61 63 A K T 3<5S- 0 0 130 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.2 0.622 99.5-140.1 -87.6 -15.4 26.7 46.8 106.5 62 64 A K T < 5 - 0 0 144 -3,-2.0 -3,-0.2 -4,-0.5 2,-0.2 0.941 31.5-170.5 54.7 58.4 24.9 46.4 103.2 63 66 A M < - 0 0 55 -5,-1.2 -1,-0.2 1,-0.1 -2,-0.0 -0.452 17.4-118.1 -86.5 157.5 26.9 43.4 102.0 64 67 A D - 0 0 61 -2,-0.2 -1,-0.1 1,-0.1 385,-0.0 -0.040 8.4-136.7 -73.5-179.3 26.9 41.7 98.7 65 68 A K + 0 0 3 590,-0.1 593,-3.7 383,-0.1 594,-0.3 -0.041 49.0 146.9-131.0 21.8 26.1 38.1 98.0 66 69 A E - 0 0 22 591,-0.2 373,-0.0 1,-0.1 -2,-0.0 -0.315 60.9 -77.8 -63.2 147.5 28.9 37.3 95.6 67 70 A Y - 0 0 33 1,-0.1 591,-0.1 584,-0.1 -1,-0.1 0.159 45.4-136.4 -40.0 145.9 30.4 33.8 95.6 68 71 A L - 0 0 14 222,-0.3 5,-0.1 1,-0.2 -1,-0.1 -0.820 38.7 -80.3-106.0 157.7 32.7 33.0 98.5 69 72 A P > - 0 0 76 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.084 47.1-102.2 -50.9 163.4 35.9 31.2 97.8 70 73 A I T 3 S+ 0 0 8 1,-0.2 3,-0.1 219,-0.2 -2,-0.0 0.849 125.1 47.2 -63.1 -25.4 35.7 27.4 97.3 71 74 A A T 3 S- 0 0 13 1,-0.3 30,-2.8 218,-0.1 -1,-0.2 0.512 114.7-118.0 -94.2 -1.2 36.9 27.0 100.8 72 75 A G < - 0 0 4 -3,-1.1 2,-0.8 28,-0.2 -1,-0.3 -0.576 54.5 -17.3 108.2-170.3 34.7 29.5 102.4 73 76 A L >> - 0 0 31 -2,-0.2 4,-2.3 1,-0.2 3,-1.4 -0.730 55.6-146.1 -82.6 111.7 34.9 32.7 104.3 74 77 A A H 3> S+ 0 0 55 -2,-0.8 4,-2.2 1,-0.3 5,-0.2 0.875 95.8 53.2 -45.8 -53.2 38.4 33.0 105.4 75 78 A D H 3> S+ 0 0 75 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.700 112.0 45.9 -58.9 -24.2 37.5 34.8 108.7 76 79 A F H <> S+ 0 0 0 -3,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.842 111.7 51.5 -85.5 -35.1 35.1 32.0 109.6 77 80 A T H X S+ 0 0 26 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.841 110.2 48.4 -69.0 -36.3 37.4 29.4 108.7 78 81 A R H X S+ 0 0 106 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.925 111.3 49.1 -69.3 -48.8 40.2 30.8 110.8 79 82 A A H X S+ 0 0 2 -4,-1.2 4,-3.2 2,-0.2 -2,-0.2 0.789 107.4 56.7 -60.2 -36.4 38.0 31.3 113.9 80 83 A S H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.910 109.1 45.1 -63.4 -45.9 36.7 27.8 113.6 81 84 A A H X S+ 0 0 0 -4,-1.4 4,-2.7 2,-0.2 5,-0.4 0.863 113.9 48.9 -63.7 -45.0 40.1 26.4 113.8 82 85 A E H X S+ 0 0 49 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.963 109.5 52.7 -65.5 -42.4 41.0 28.6 116.6 83 86 A L H < S+ 0 0 5 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.935 116.6 39.3 -54.0 -51.6 37.9 27.7 118.5 84 87 A A H < S+ 0 0 0 -4,-2.5 149,-0.3 1,-0.2 -1,-0.2 0.906 125.1 33.2 -66.4 -45.6 38.6 24.0 118.2 85 88 A L H < S- 0 0 5 -4,-2.7 -2,-0.2 -5,-0.1 -3,-0.2 0.717 106.1-116.3 -83.4 -30.5 42.4 24.0 118.7 86 89 A G >< - 0 0 11 -4,-2.8 3,-0.7 -5,-0.4 6,-0.2 0.160 23.1 -95.5 95.5 143.7 42.9 26.8 121.2 87 90 A E T 3 S+ 0 0 144 1,-0.2 -1,-0.1 -4,-0.1 -4,-0.1 0.380 121.7 48.7 -68.6 -10.9 44.8 30.1 120.5 88 91 A N T 3 S+ 0 0 154 -3,-0.1 -1,-0.2 5,-0.0 -2,-0.1 0.335 83.2 128.7-109.0 -11.8 48.1 28.9 122.1 89 92 A S <> - 0 0 22 -3,-0.7 4,-2.7 1,-0.1 5,-0.3 -0.204 57.3-145.1 -51.4 130.5 48.1 25.7 120.2 90 93 A E H >> S+ 0 0 113 2,-0.2 4,-4.3 1,-0.2 3,-0.7 0.995 101.4 55.8 -61.9 -59.1 51.2 25.0 118.3 91 94 A A H 34>S+ 0 0 0 1,-0.3 5,-1.2 2,-0.2 4,-0.5 0.792 116.7 41.2 -39.7 -33.5 49.3 23.4 115.4 92 95 A F H 345S+ 0 0 31 -6,-0.2 -1,-0.3 3,-0.2 -2,-0.2 0.812 114.0 46.8 -90.7 -34.2 47.5 26.6 115.3 93 96 A K H <<5S+ 0 0 176 -4,-2.7 -2,-0.2 -3,-0.7 -3,-0.2 0.858 116.6 46.2 -77.5 -27.7 50.3 29.1 115.8 94 97 A S T <5S- 0 0 57 -4,-4.3 -1,-0.2 -5,-0.3 175,-0.2 0.740 106.9-125.8 -85.6 -14.5 52.4 27.4 113.4 95 98 A G T 5 + 0 0 24 -4,-0.5 -3,-0.2 -5,-0.5 -4,-0.1 0.745 58.3 145.3 81.7 22.3 49.7 27.0 110.8 96 99 A R < + 0 0 22 -5,-1.2 170,-3.7 -6,-0.2 2,-0.4 0.183 52.0 89.3 -78.4 23.2 50.0 23.2 110.3 97 100 A Y E -C 265 0C 44 -6,-0.3 2,-0.5 168,-0.2 168,-0.2 -0.893 58.4-156.9-125.6 158.4 46.2 23.0 109.7 98 101 A V E +C 264 0C 6 166,-3.1 166,-2.0 -2,-0.4 2,-0.4 -0.936 15.7 177.8-133.4 112.9 43.7 23.2 107.0 99 102 A T E -C 263 0C 9 -2,-0.5 2,-0.4 164,-0.2 164,-0.2 -0.897 4.0-173.9-110.6 139.8 40.1 24.2 107.7 100 103 A V E -C 262 0C 2 162,-2.1 162,-2.1 -2,-0.4 2,-0.2 -0.992 29.7-108.6-137.6 140.2 37.6 24.5 105.2 101 104 A Q E -C 261 0C 0 -30,-2.8 160,-0.3 -2,-0.4 2,-0.2 -0.492 44.0-176.9 -67.7 131.5 34.1 25.7 105.5 102 105 A G E -C 260 0C 1 158,-2.2 2,-2.0 -2,-0.2 158,-1.3 -0.671 41.7 -87.3-124.7 178.7 31.5 23.0 105.1 103 106 A I S > S- 0 0 1 -2,-0.2 4,-2.3 156,-0.2 3,-0.2 -0.470 86.7 -69.4 -85.6 70.3 27.8 22.4 104.9 104 107 A S H > S- 0 0 0 -2,-2.0 4,-2.5 154,-0.4 156,-0.2 -0.142 82.5 -50.6 70.8-172.0 27.4 22.0 108.7 105 108 A G H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.860 140.1 54.9 -66.9 -31.9 28.8 19.0 110.5 106 109 A T H > S+ 0 0 0 -3,-0.2 4,-2.0 583,-0.2 -2,-0.2 0.975 111.9 40.7 -68.1 -50.6 27.2 16.7 108.1 107 110 A G H X S+ 0 0 4 -4,-2.3 4,-3.0 582,-0.3 5,-0.2 0.948 115.5 52.1 -58.4 -50.2 28.7 18.3 105.0 108 111 A S H X S+ 0 0 1 -4,-2.5 4,-2.4 1,-0.3 5,-0.3 0.953 109.3 50.1 -47.4 -57.9 32.0 18.7 106.8 109 112 A L H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -1,-0.3 0.862 111.6 49.2 -50.7 -39.5 31.9 15.0 107.7 110 113 A R H X S+ 0 0 20 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.907 106.8 52.8 -74.7 -37.4 31.2 14.1 104.1 111 114 A V H X S+ 0 0 3 -4,-3.0 4,-3.2 1,-0.2 5,-0.3 0.955 112.1 46.8 -61.5 -43.4 33.9 16.1 102.6 112 115 A G H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.3 -1,-0.2 0.868 111.7 51.6 -67.8 -30.6 36.4 14.4 105.0 113 116 A A H X S+ 0 0 0 -4,-1.8 4,-2.3 -5,-0.3 -1,-0.3 0.903 110.9 47.5 -73.4 -33.2 34.9 11.1 104.2 114 117 A N H X S+ 0 0 22 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.945 111.9 49.2 -70.2 -43.3 35.4 11.9 100.5 115 118 A F H X S+ 0 0 0 -4,-3.2 4,-2.6 2,-0.2 5,-0.4 0.894 111.4 50.3 -58.8 -42.1 38.9 13.0 101.0 116 119 A L H X S+ 0 0 0 -4,-1.9 4,-2.8 -5,-0.3 -1,-0.2 0.986 107.4 52.2 -63.6 -52.8 39.8 10.0 102.9 117 120 A Q H < S+ 0 0 72 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.805 119.9 38.6 -53.1 -32.0 38.3 7.8 100.3 118 121 A R H < S+ 0 0 99 -4,-1.9 -2,-0.2 -5,-0.1 -3,-0.2 0.969 131.3 18.8 -81.9 -71.7 40.5 9.6 97.9 119 122 A F H < S+ 0 0 31 -4,-2.6 2,-1.5 1,-0.1 -3,-0.2 0.396 93.7 95.8 -83.5 -3.0 43.8 10.2 99.6 120 123 A F >< + 0 0 0 -4,-2.8 3,-0.8 -5,-0.4 -1,-0.1 -0.607 45.3 171.3 -93.1 81.1 43.9 7.7 102.6 121 124 A K T 3 + 0 0 133 -2,-1.5 -1,-0.2 284,-0.2 3,-0.1 0.415 61.6 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113.6 48.1 -61.6 -45.7 14.1 40.1 109.4 462 62 B A H 3<5S+ 0 0 80 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.514 101.8 60.5 -76.2 -16.0 10.9 41.6 110.5 463 63 B K T 3<5S- 0 0 119 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.416 102.7-130.6 -93.2 3.1 9.0 38.4 110.9 464 64 B K T < 5 - 0 0 142 -3,-0.8 2,-0.2 1,-0.1 -3,-0.2 0.944 36.2-159.2 45.7 61.9 11.6 37.4 113.5 465 66 B M < - 0 0 54 -5,-1.2 -1,-0.1 1,-0.1 -5,-0.0 -0.508 9.0-123.2 -79.1 143.9 12.1 33.9 111.8 466 67 B D - 0 0 63 -2,-0.2 -1,-0.1 1,-0.1 -419,-0.0 -0.106 6.9-136.5 -70.4 174.0 13.5 30.9 113.5 467 68 B K + 0 0 7 -214,-0.1 -211,-2.4 -421,-0.1 -210,-0.3 -0.041 49.6 146.1-124.7 27.2 16.5 29.0 112.3 468 69 B E - 0 0 26 -213,-0.2 2,-0.2 1,-0.1 -212,-0.1 -0.127 59.2 -79.3 -60.8 162.8 15.2 25.5 112.8 469 70 B Y - 0 0 35 -214,-0.1 -1,-0.1 1,-0.1 3,-0.1 -0.487 42.0-135.5 -70.4 129.0 16.2 22.7 110.4 470 71 B L - 0 0 20 222,-0.3 5,-0.1 -2,-0.2 2,-0.1 -0.158 36.8 -85.1 -73.2 173.4 14.5 22.5 107.0 471 72 B P > - 0 0 69 0, 0.0 3,-1.7 0, 0.0 -1,-0.2 -0.488 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