==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-JAN-11 3Q8N . COMPND 2 MOLECULE: 4-AMINOBUTYRATE TRANSAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM SMEGMATIS; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 1754 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 50558.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1261 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 98 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 180 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.2 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 . 107 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 169 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 576 32.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 44 2.5 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 12 0 4 0 0 0 0 0 4 16 0 4 8 4 0 0 0 0 4 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 4 8 8 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 PARALLEL BRIDGES PER LADDER . 12 0 8 12 0 8 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 . 0 0 4 3 1 0 4 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 11 A T 0 0 167 0, 0.0 2,-0.3 0, 0.0 43,-0.0 0.000 360.0 360.0 360.0 32.3 -5.5 52.2 -52.1 2 12 A L - 0 0 43 45,-0.0 2,-0.2 40,-0.0 45,-0.1 -0.997 360.0-109.9-139.7 135.1 -6.6 49.8 -49.4 3 13 A T - 0 0 81 -2,-0.3 2,-2.1 1,-0.1 0, 0.0 -0.486 23.1-127.9 -75.7 132.8 -10.2 48.9 -48.6 4 14 A Q + 0 0 53 -2,-0.2 2,-0.3 43,-0.0 -1,-0.1 -0.513 69.4 119.0 -80.4 78.1 -11.5 50.2 -45.2 5 15 A E - 0 0 91 -2,-2.1 2,-0.3 51,-0.1 -2,-0.0 -1.000 67.5-122.0-150.8 132.9 -12.7 46.9 -44.1 6 16 A R + 0 0 80 -2,-0.3 2,-0.3 41,-0.1 50,-0.2 -0.633 39.4 179.3 -74.8 136.8 -12.0 44.4 -41.3 7 17 A R B -A 55 0A 93 48,-2.6 48,-2.8 -2,-0.3 2,-0.6 -0.939 22.9-173.3-151.0 120.0 -10.9 41.2 -42.8 8 18 A L + 0 0 74 -2,-0.3 46,-0.1 46,-0.2 4,-0.1 -0.868 20.2 155.4-115.3 94.3 -9.8 37.9 -41.1 9 19 A V S S+ 0 0 94 -2,-0.6 2,-0.3 2,-0.1 -1,-0.1 0.753 71.1 19.6 -88.0 -29.3 -8.5 35.5 -43.8 10 20 A T S S- 0 0 42 1,-0.1 4,-0.1 4,-0.0 2,-0.1 -0.778 97.4 -78.2-124.1 174.3 -6.3 33.5 -41.4 11 21 A A S S- 0 0 78 -2,-0.3 -1,-0.1 2,-0.1 43,-0.1 -0.352 72.1 -76.1 -57.7 153.6 -6.1 32.8 -37.7 12 22 A I S S+ 0 0 37 1,-0.2 2,-0.1 384,-0.2 26,-0.1 -0.915 124.8 23.7-111.4 119.7 -4.4 35.7 -35.8 13 23 A P S S- 0 0 33 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.611 97.9-151.3 -80.3 155.6 -1.5 35.8 -36.2 14 24 A G > - 0 0 0 -4,-0.1 4,-2.2 -2,-0.1 5,-0.2 -0.120 32.7 -84.3 -83.9 179.4 -1.3 33.9 -39.5 15 25 A P H > S+ 0 0 88 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.814 124.8 48.9 -58.6 -39.1 1.5 31.7 -40.8 16 26 A I H > S+ 0 0 89 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.891 112.3 49.6 -72.3 -38.7 3.7 34.4 -42.4 17 27 A S H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.902 109.6 51.8 -62.2 -42.4 3.5 36.5 -39.2 18 28 A Q H X S+ 0 0 110 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.853 110.0 48.6 -65.7 -35.4 4.5 33.5 -37.0 19 29 A E H X S+ 0 0 124 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.935 111.7 49.7 -66.4 -45.7 7.5 32.9 -39.3 20 30 A L H X S+ 0 0 4 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.905 109.5 52.4 -59.6 -41.6 8.4 36.6 -39.0 21 31 A Q H X S+ 0 0 32 -4,-2.9 4,-2.6 2,-0.2 -1,-0.2 0.876 105.6 53.1 -61.6 -37.7 8.1 36.4 -35.2 22 32 A A H X S+ 0 0 45 -4,-1.8 4,-1.1 1,-0.2 -1,-0.2 0.897 110.6 49.1 -63.3 -36.5 10.4 33.3 -35.1 23 33 A R H >X S+ 0 0 61 -4,-1.9 4,-1.2 2,-0.2 3,-0.6 0.922 109.6 51.0 -63.2 -44.7 12.9 35.5 -37.0 24 34 A K H >X S+ 0 0 12 -4,-2.4 4,-3.0 1,-0.2 3,-0.7 0.902 107.4 53.5 -58.0 -45.1 12.3 38.3 -34.5 25 35 A Q H 3< S+ 0 0 127 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.750 113.9 42.7 -67.7 -23.2 13.0 36.0 -31.6 26 36 A S H << S+ 0 0 81 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.563 126.5 29.5 -92.8 -15.3 16.3 34.9 -33.2 27 37 A A H << S+ 0 0 3 -4,-1.2 969,-1.7 -3,-0.7 2,-0.4 0.651 109.0 65.6-116.3 -26.7 17.5 38.4 -34.3 28 38 A V B < S-f 996 0B 2 -4,-3.0 969,-0.2 967,-0.3 -1,-0.1 -0.848 85.5-101.1-113.8 138.6 16.0 40.9 -31.9 29 39 A A > - 0 0 0 967,-1.5 3,-1.6 -2,-0.4 1151,-0.1 -0.290 27.7-126.7 -53.5 137.7 16.7 41.4 -28.1 30 40 A A T 3 S+ 0 0 44 1,-0.3 1155,-0.4 -5,-0.1 -1,-0.1 0.773 103.5 73.8 -54.7 -33.1 14.1 39.9 -25.8 31 41 A G T 3 S+ 0 0 0 1148,-0.4 1156,-1.9 1153,-0.2 2,-1.3 0.706 78.9 77.9 -59.7 -23.2 13.7 43.3 -24.1 32 42 A V S < S- 0 0 5 -3,-1.6 2,-0.3 1152,-0.2 -1,-0.2 -0.744 77.8-167.2 -86.8 88.8 11.8 44.6 -27.1 33 43 A G - 0 0 13 -2,-1.3 2,-0.5 1154,-0.4 -2,-0.1 -0.604 12.0-142.1 -86.9 146.4 8.5 43.0 -26.4 34 44 A V - 0 0 28 -2,-0.3 937,-0.2 1,-0.2 936,-0.1 -0.923 6.3-161.8-113.7 120.5 5.7 42.9 -29.0 35 45 A T S S+ 0 0 76 935,-3.0 936,-0.2 -2,-0.5 -1,-0.2 0.950 85.5 12.3 -65.9 -49.6 2.1 43.3 -27.9 36 46 A L S S- 0 0 10 935,-2.5 2,-2.2 934,-0.1 -1,-0.3 -0.929 71.7-149.2-136.7 103.3 0.5 41.8 -31.0 37 47 A P + 0 0 32 0, 0.0 2,-0.5 0, 0.0 -16,-0.2 -0.171 49.8 130.5 -79.2 51.3 2.7 39.9 -33.4 38 48 A V - 0 0 2 -2,-2.2 2,-0.5 -25,-0.1 -2,-0.1 -0.878 57.1-130.4 -98.6 131.0 0.9 40.6 -36.7 39 49 A Y - 0 0 1 -2,-0.5 12,-2.0 933,-0.1 935,-0.3 -0.735 19.6-139.1 -93.0 123.1 3.4 41.9 -39.2 40 50 A V E +Bc 50 974A 5 933,-2.5 935,-0.5 -2,-0.5 10,-0.2 -0.545 32.0 163.9 -89.3 140.0 2.3 45.1 -41.0 41 51 A V E S+ 0 0 74 8,-2.4 2,-0.3 1,-0.5 9,-0.2 0.500 72.1 5.4-123.4 -25.3 2.8 45.6 -44.7 42 52 A A E +B 49 0A 30 7,-1.6 7,-2.6 2,-0.0 -1,-0.5 -0.968 61.9 179.5-152.6 159.5 0.4 48.6 -45.4 43 53 A A E +B 48 0A 8 920,-2.2 2,-0.3 -2,-0.3 5,-0.2 -0.961 12.7 139.1-161.1 146.3 -1.8 50.9 -43.3 44 54 A G E > +B 47 0A 14 3,-2.3 3,-2.6 -2,-0.3 2,-0.4 -0.918 57.4 8.3 180.0 161.9 -4.2 53.8 -43.8 45 55 A G T 3 S- 0 0 25 25,-0.5 25,-0.3 -2,-0.3 373,-0.3 -0.492 130.2 -30.0 61.8-114.4 -7.5 55.3 -42.7 46 56 A G T 3 S+ 0 0 0 -2,-0.4 12,-2.3 372,-0.2 2,-0.4 0.115 119.4 94.1-115.6 18.6 -8.5 53.1 -39.8 47 57 A V E < -BD 44 57A 3 -3,-2.6 -3,-2.3 10,-0.2 2,-0.5 -0.904 49.6-164.3-127.0 143.0 -6.8 49.9 -41.0 48 58 A L E -BD 43 56A 4 8,-2.2 8,-2.8 -2,-0.4 2,-0.5 -0.990 18.2-157.0-115.0 125.1 -3.6 47.9 -40.6 49 59 A A E -BD 42 55A 11 -7,-2.6 -8,-2.4 -2,-0.5 -7,-1.6 -0.914 14.2-153.0-106.0 129.9 -3.1 45.2 -43.3 50 60 A D E > -B 40 0A 5 4,-2.6 3,-1.9 -2,-0.5 -10,-0.2 -0.426 30.0 -96.3-104.6 177.9 -0.8 42.4 -42.3 51 61 A A T 3 S+ 0 0 28 -12,-2.0 -11,-0.1 1,-0.3 -1,-0.0 0.731 119.9 56.1 -71.2 -22.3 1.5 39.9 -44.1 52 62 A D T 3 S- 0 0 21 -13,-0.2 -1,-0.3 -38,-0.1 -43,-0.1 0.288 123.2 -98.3 -86.3 10.2 -1.2 37.2 -44.2 53 63 A G S < S+ 0 0 39 -3,-1.9 2,-0.1 1,-0.3 -2,-0.1 0.456 78.7 139.3 85.7 1.2 -3.9 39.3 -45.9 54 64 A N - 0 0 0 -46,-0.1 -4,-2.6 -43,-0.1 2,-0.5 -0.482 40.3-154.2 -74.5 149.1 -5.7 40.3 -42.7 55 65 A Q E -AD 7 49A 15 -48,-2.8 -48,-2.6 -6,-0.2 2,-0.3 -0.997 14.7-169.5-123.4 122.5 -7.0 43.8 -42.1 56 66 A L E - D 0 48A 2 -8,-2.8 -8,-2.2 -2,-0.5 2,-0.4 -0.837 26.3-112.1-111.6 150.3 -7.3 44.8 -38.4 57 67 A I E -eD 399 47A 0 341,-2.5 343,-2.9 -2,-0.3 2,-1.0 -0.713 30.9-134.4 -85.4 127.5 -9.0 47.9 -37.0 58 68 A D E +e 400 0A 8 -12,-2.3 343,-0.1 -2,-0.4 341,-0.1 -0.680 39.3 157.7 -92.3 98.6 -6.5 50.3 -35.4 59 69 A F S S+ 0 0 1 341,-1.6 355,-3.2 -2,-1.0 343,-0.4 0.145 73.5 59.3 -99.5 23.1 -7.5 51.6 -32.0 60 70 A G S >> S- 0 0 0 353,-0.2 4,-2.1 341,-0.1 3,-1.4 0.680 75.2-153.0-119.4 -32.2 -3.9 52.4 -31.1 61 71 A S H 3>>S- 0 0 0 1,-0.3 4,-2.8 2,-0.2 5,-2.2 0.746 76.1 -65.4 55.6 26.3 -2.4 54.9 -33.7 62 72 A G H 345S- 0 0 5 3,-0.2 -1,-0.3 2,-0.2 905,-0.1 0.841 108.7 -39.6 66.9 34.5 1.0 53.4 -32.9 63 73 A I H <45S- 0 0 16 -3,-1.4 -2,-0.2 351,-0.1 -1,-0.2 0.907 119.4 -44.7 69.1 53.3 0.6 54.8 -29.4 64 74 A A H <5S+ 0 0 1 -4,-2.1 220,-0.5 350,-0.3 3,-0.2 0.794 115.1 108.8 71.5 33.8 -1.0 58.1 -30.4 65 75 A V T <5 + 0 0 0 -4,-2.8 2,-1.7 -5,-0.2 3,-0.4 0.863 65.5 55.4-107.8 -50.9 1.4 58.8 -33.3 66 76 A T > < + 0 0 0 -5,-2.2 3,-1.8 1,-0.2 -1,-0.2 -0.242 64.0 145.6 -82.0 51.6 -0.5 58.4 -36.5 67 77 A T T 3 S+ 0 0 3 -2,-1.7 350,-2.3 1,-0.3 351,-0.5 0.839 74.1 44.7 -58.3 -35.6 -3.2 60.9 -35.4 68 78 A V T 3 S- 0 0 11 -3,-0.4 -1,-0.3 1,-0.3 -23,-0.1 0.461 130.5 -84.3 -86.6 -0.2 -3.7 62.1 -39.0 69 79 A G X - 0 0 3 -3,-1.8 3,-1.0 3,-0.1 -1,-0.3 -0.159 50.5 -71.9 107.7 147.4 -3.7 58.5 -40.4 70 80 A N T 3 S+ 0 0 10 -25,-0.3 -25,-0.5 1,-0.3 218,-0.1 -0.595 119.7 1.2 -70.5 139.1 -1.0 56.2 -41.4 71 81 A S T 3 S- 0 0 19 216,-0.4 -1,-0.3 -2,-0.3 217,-0.1 0.852 88.4-161.9 40.9 48.0 0.6 57.4 -44.6 72 82 A A <> - 0 0 6 -3,-1.0 4,-2.7 215,-0.3 3,-0.3 -0.313 24.5-117.6 -52.0 134.4 -1.6 60.4 -44.8 73 83 A P H > S+ 0 0 114 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.866 112.2 47.9 -51.1 -45.8 -1.6 61.8 -48.4 74 84 A A H > S+ 0 0 34 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.912 113.5 48.6 -63.5 -43.5 -0.1 65.2 -47.5 75 85 A V H > S+ 0 0 0 -3,-0.3 4,-2.8 2,-0.2 5,-0.3 0.940 111.6 49.6 -56.5 -50.0 2.6 63.6 -45.4 76 86 A V H X S+ 0 0 30 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.934 112.5 46.8 -55.3 -50.1 3.4 61.1 -48.2 77 87 A D H X S+ 0 0 115 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.923 114.9 46.3 -60.3 -48.6 3.7 63.8 -50.9 78 88 A A H X S+ 0 0 24 -4,-2.3 4,-2.7 -5,-0.2 -1,-0.2 0.872 114.8 45.8 -63.3 -41.0 5.9 66.0 -48.6 79 89 A V H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 5,-0.2 0.949 112.4 51.7 -71.2 -41.6 8.2 63.2 -47.6 80 90 A T H X S+ 0 0 48 -4,-2.8 4,-0.9 -5,-0.3 -2,-0.2 0.919 114.0 43.8 -61.4 -43.0 8.5 62.0 -51.2 81 91 A Q H X S+ 0 0 147 -4,-2.7 4,-0.6 -5,-0.2 3,-0.5 0.936 115.4 47.8 -66.7 -45.3 9.4 65.5 -52.3 82 92 A Q H >X S+ 0 0 36 -4,-2.7 4,-2.1 1,-0.2 3,-1.3 0.908 104.8 57.9 -65.3 -39.5 11.8 66.1 -49.4 83 93 A V H 3< S+ 0 0 0 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.795 102.7 54.6 -67.9 -23.9 13.7 62.8 -49.7 84 94 A A H 3< S+ 0 0 66 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.705 112.2 44.6 -78.6 -18.2 14.7 63.5 -53.3 85 95 A A H << S- 0 0 28 -3,-1.3 836,-2.1 -4,-0.6 2,-0.3 0.917 130.6 -30.1 -90.5 -57.0 16.3 66.9 -52.3 86 96 A F < - 0 0 9 -4,-2.1 -1,-0.3 834,-0.2 3,-0.1 -0.949 38.1-158.9-162.1 147.5 18.2 66.0 -49.2 87 97 A T S S- 0 0 0 1,-0.3 231,-0.4 -2,-0.3 2,-0.3 0.741 77.0 -9.7 -95.4 -27.3 18.0 63.5 -46.4 88 98 A H + 0 0 0 228,-0.1 -1,-0.3 229,-0.1 856,-0.1 -0.904 41.0 164.8-173.8 138.2 20.2 65.2 -43.7 89 99 A T - 0 0 3 -2,-0.3 5,-0.5 223,-0.1 851,-0.2 0.493 57.8-109.5-126.1 -13.9 22.6 68.0 -43.2 90 100 A C >> - 0 0 1 3,-0.1 3,-2.9 1076,-0.1 4,-1.6 0.857 26.2-130.0 62.1 105.9 22.7 68.3 -39.4 91 101 A F T 34 S+ 0 0 6 223,-0.4 221,-0.1 1,-0.3 222,-0.1 0.788 106.1 57.0 -58.6 -30.1 20.9 71.6 -38.7 92 102 A M T 34 S+ 0 0 27 219,-0.3 821,-3.1 220,-0.2 -1,-0.3 0.544 110.8 42.4 -77.5 -12.5 23.7 72.9 -36.5 93 103 A V T <4 S- 0 0 8 -3,-2.9 821,-2.2 1,-0.3 -2,-0.2 0.856 139.4 -4.9 -93.6 -65.9 26.3 72.4 -39.3 94 104 A T S < S- 0 0 2 -4,-1.6 -1,-0.3 -5,-0.5 -2,-0.1 -0.984 82.5-144.0-130.0 123.0 24.3 73.8 -42.2 95 105 A P - 0 0 0 0, 0.0 823,-2.4 0, 0.0 2,-0.3 -0.010 9.1-155.6 -84.9-177.6 20.7 74.7 -41.6 96 106 A Y >> - 0 0 4 821,-0.3 4,-1.1 1,-0.1 3,-0.6 -0.981 27.6-114.0-157.3 154.2 17.6 74.5 -43.7 97 107 A E H 3> S+ 0 0 82 821,-0.4 4,-2.7 -2,-0.3 5,-0.2 0.828 104.5 68.5 -67.3 -35.0 14.2 76.2 -43.9 98 108 A G H 3> S+ 0 0 22 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.883 100.3 49.8 -50.3 -47.2 12.0 73.3 -42.9 99 109 A Y H <> S+ 0 0 6 -3,-0.6 4,-2.4 1,-0.2 -1,-0.2 0.937 111.9 48.8 -56.3 -49.2 13.4 73.4 -39.3 100 110 A V H X S+ 0 0 0 -4,-1.1 4,-2.1 1,-0.2 -2,-0.2 0.904 110.7 49.8 -63.4 -42.3 12.7 77.1 -39.1 101 111 A K H X S+ 0 0 70 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.856 109.2 51.1 -64.7 -39.7 9.1 76.8 -40.4 102 112 A V H X S+ 0 0 0 -4,-2.1 4,-2.6 -5,-0.2 5,-0.2 0.956 110.5 50.0 -60.8 -47.0 8.2 74.1 -38.0 103 113 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.881 110.4 50.9 -56.8 -41.4 9.6 76.3 -35.1 104 114 A E H X S+ 0 0 59 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.904 111.6 46.3 -64.4 -44.8 7.5 79.2 -36.4 105 115 A H H X S+ 0 0 51 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.901 113.3 48.6 -66.9 -42.2 4.3 77.2 -36.5 106 116 A L H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.969 111.8 49.1 -60.3 -51.7 4.9 75.7 -33.0 107 117 A N H < S+ 0 0 21 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.916 116.8 44.3 -53.0 -46.1 5.6 79.2 -31.6 108 118 A R H < S+ 0 0 152 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.862 119.1 38.9 -61.9 -42.2 2.4 80.4 -33.2 109 119 A L H < S+ 0 0 40 -4,-2.4 -2,-0.2 -5,-0.1 -3,-0.2 0.728 91.8 87.9 -95.8 -28.4 0.1 77.5 -32.3 110 120 A T S < S- 0 0 5 -4,-2.5 186,-0.0 -5,-0.2 165,-0.0 -0.226 93.3 -70.2 -64.6 166.6 1.0 76.5 -28.8 111 121 A P S S+ 0 0 18 0, 0.0 -1,-0.1 0, 0.0 164,-0.1 -0.170 90.7 38.2 -64.7 151.9 -0.8 78.3 -25.9 112 122 A G - 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