==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 22-JUL-12 4G87 . COMPND 2 MOLECULE: BIFUNCTIONAL PROTEIN GLMU; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR P.A.JAGTAP,S.K.VERMA,B.PRAKASH . 452 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20977.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 338 74.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 118 26.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 42 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 16.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 1 1 0 0 1 1 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 12 10 1 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 . 1 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 1 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 6 A D 0 0 91 0, 0.0 101,-1.8 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 112.3 30.2 29.8 -20.1 2 7 A T E -a 102 0A 6 99,-0.2 44,-1.7 101,-0.1 43,-0.8 -0.917 360.0-157.2-129.1 145.9 26.5 29.4 -19.1 3 8 A A E -ab 103 46A 0 99,-2.7 101,-3.3 -2,-0.4 2,-0.5 -0.970 16.3-153.6-112.4 134.5 24.0 31.2 -17.0 4 9 A V E -ab 104 47A 0 42,-2.5 44,-2.8 -2,-0.4 2,-0.4 -0.948 5.4-163.1-113.0 126.2 20.9 29.1 -15.7 5 10 A L E -ab 105 48A 0 99,-3.3 101,-2.5 -2,-0.5 2,-0.6 -0.925 2.2-160.2-101.8 132.0 17.6 30.8 -15.0 6 11 A V E -ab 106 49A 0 42,-2.8 44,-2.5 -2,-0.4 2,-0.7 -0.957 12.6-143.6-113.0 122.6 15.0 29.0 -12.8 7 12 A L E +ab 107 50A 19 99,-2.2 101,-2.7 -2,-0.6 102,-0.2 -0.738 42.9 142.7 -89.4 114.0 11.5 30.4 -13.2 8 13 A A + 0 0 10 42,-1.9 44,-0.5 -2,-0.7 14,-0.2 0.001 39.3 94.5-141.2 25.8 9.9 30.2 -9.8 9 14 A A + 0 0 8 42,-0.3 44,-0.5 43,-0.1 42,-0.1 0.398 51.9 117.7-109.8 4.3 7.8 33.4 -9.6 10 15 A G S S- 0 0 57 42,-0.1 42,-0.2 1,-0.1 11,-0.1 -0.253 71.7-121.0 -67.4 158.9 4.4 32.1 -10.8 11 16 A P - 0 0 91 0, 0.0 10,-0.2 0, 0.0 -1,-0.1 0.656 29.6-141.2 -76.7 -19.3 1.4 32.1 -8.3 12 17 A G > + 0 0 18 8,-0.1 3,-1.4 1,-0.1 4,-0.4 0.874 37.5 164.6 65.9 37.8 0.9 28.3 -8.5 13 18 A T G > + 0 0 96 1,-0.3 3,-1.7 2,-0.2 -1,-0.1 0.837 65.2 62.6 -61.4 -33.0 -2.9 28.7 -8.5 14 19 A R G 3 S+ 0 0 134 1,-0.3 222,-0.4 2,-0.1 -1,-0.3 0.729 92.6 64.7 -72.0 -17.3 -3.6 25.1 -9.7 15 20 A M G < S- 0 0 2 -3,-1.4 -1,-0.3 220,-0.2 -2,-0.2 0.752 92.3-148.6 -70.5 -24.0 -2.0 23.7 -6.6 16 21 A R < + 0 0 209 -3,-1.7 2,-0.3 -4,-0.4 -3,-0.1 0.955 51.0 132.1 52.6 54.2 -4.8 25.3 -4.5 17 22 A S - 0 0 38 -5,-0.4 -1,-0.2 2,-0.1 4,-0.1 -0.977 67.5-143.3-137.5 149.3 -2.4 25.8 -1.7 18 23 A D S S+ 0 0 154 -2,-0.3 -1,-0.1 -3,-0.1 -2,-0.0 0.389 89.2 83.6 -89.5 4.3 -1.3 28.4 0.8 19 24 A T S S- 0 0 67 -4,-0.1 5,-0.1 2,-0.0 -2,-0.1 -0.929 99.1-103.1-101.8 130.1 2.2 27.0 0.4 20 25 A P > - 0 0 17 0, 0.0 3,-2.0 0, 0.0 4,-0.4 -0.232 32.0-120.6 -51.8 135.3 4.1 28.4 -2.7 21 26 A K G > S+ 0 0 34 1,-0.3 3,-1.8 2,-0.2 10,-0.3 0.808 109.4 57.0 -41.2 -48.7 4.1 25.7 -5.4 22 27 A V G 3 S+ 0 0 11 1,-0.3 10,-2.7 -14,-0.2 11,-0.3 0.639 100.4 59.5 -74.7 -8.6 7.8 25.4 -5.7 23 28 A L G < S+ 0 0 27 -3,-2.0 -1,-0.3 7,-0.2 -2,-0.2 0.510 77.0 112.9 -94.4 -7.7 8.1 24.5 -1.9 24 29 A H < - 0 0 20 -3,-1.8 7,-2.1 -4,-0.4 2,-0.2 -0.383 63.6-128.4 -65.2 150.1 5.9 21.4 -2.2 25 30 A T E +I 30 0B 94 5,-0.2 2,-0.3 6,-0.1 5,-0.3 -0.634 31.0 176.6-111.4 156.1 7.9 18.2 -1.6 26 31 A L E > S-I 29 0B 5 3,-2.4 3,-1.4 -2,-0.2 8,-0.1 -0.932 76.4 -6.8-150.1 133.1 8.7 14.9 -2.9 27 32 A A T 3 S- 0 0 18 -2,-0.3 244,-2.5 1,-0.3 245,-0.3 0.789 131.9 -47.0 61.1 33.3 11.2 12.3 -1.5 28 33 A G T 3 S+ 0 0 46 242,-0.2 2,-0.3 1,-0.1 -1,-0.3 0.473 121.5 80.1 95.1 -1.9 12.5 14.6 1.1 29 34 A R E < S-I 26 0B 52 -3,-1.4 -3,-2.4 -5,-0.0 -1,-0.1 -0.999 75.7-111.6-138.7 145.0 13.1 17.9 -0.9 30 35 A S E > -I 25 0B 23 -2,-0.3 4,-2.7 -5,-0.3 -5,-0.2 -0.216 37.6-110.4 -57.3 154.8 11.0 20.7 -2.3 31 36 A M H > S+ 0 0 0 -7,-2.1 4,-2.5 -10,-0.3 5,-0.2 0.933 122.7 53.0 -54.2 -40.7 10.7 20.9 -6.1 32 37 A L H > S+ 0 0 2 -10,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.938 107.8 49.6 -65.6 -39.7 12.9 24.0 -5.9 33 38 A S H > S+ 0 0 13 -11,-0.3 4,-2.7 2,-0.2 5,-0.2 0.930 110.5 50.7 -62.8 -41.8 15.6 22.1 -3.9 34 39 A H H X S+ 0 0 17 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.952 112.8 46.0 -57.4 -51.0 15.5 19.3 -6.5 35 40 A V H X S+ 0 0 2 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.935 113.8 47.4 -60.1 -49.2 15.9 21.7 -9.3 36 41 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 -2,-0.2 0.891 109.9 53.5 -63.1 -37.3 18.8 23.7 -7.7 37 42 A H H X S+ 0 0 38 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.920 110.2 48.3 -58.6 -46.1 20.7 20.4 -6.7 38 43 A A H X S+ 0 0 13 -4,-2.2 4,-0.8 -5,-0.2 -2,-0.2 0.929 115.7 42.8 -62.1 -44.8 20.6 19.2 -10.3 39 44 A I H >X S+ 0 0 0 -4,-2.1 4,-1.3 1,-0.2 3,-1.0 0.932 108.8 57.4 -69.9 -42.0 21.8 22.6 -11.6 40 45 A A H 3< S+ 0 0 18 -4,-2.9 -1,-0.2 1,-0.3 3,-0.2 0.839 104.3 53.4 -59.7 -33.6 24.5 23.0 -8.9 41 46 A K H 3< S+ 0 0 173 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.760 105.2 54.4 -68.2 -25.7 26.0 19.6 -10.0 42 47 A L H << S- 0 0 38 -3,-1.0 -1,-0.2 -4,-0.8 -2,-0.2 0.798 101.1-151.6 -79.2 -21.7 26.1 21.0 -13.5 43 48 A A < - 0 0 64 -4,-1.3 -3,-0.1 -3,-0.2 -2,-0.1 0.922 16.9-172.4 51.0 59.8 28.1 24.0 -12.0 44 49 A P - 0 0 5 0, 0.0 -41,-0.1 0, 0.0 -1,-0.1 -0.390 34.4-115.6 -71.4 159.0 27.2 26.9 -14.4 45 50 A Q S S+ 0 0 107 -43,-0.8 2,-0.4 1,-0.1 -42,-0.2 0.895 100.3 28.4 -62.7 -43.0 29.0 30.2 -14.0 46 51 A R E -b 3 0A 67 -44,-1.7 -42,-2.5 2,-0.0 2,-0.4 -0.959 62.3-173.1-126.1 147.0 25.8 32.0 -13.0 47 52 A L E -b 4 0A 1 -2,-0.4 27,-2.7 -44,-0.2 2,-0.4 -0.976 11.5-179.8-140.0 114.5 22.6 30.6 -11.3 48 53 A I E -bc 5 74A 0 -44,-2.8 -42,-2.8 -2,-0.4 2,-0.6 -0.978 12.6-160.3-127.9 128.5 19.6 32.9 -11.1 49 54 A V E -bc 6 75A 0 25,-3.1 27,-2.2 -2,-0.4 2,-0.6 -0.933 12.3-145.7-111.3 121.4 16.3 32.2 -9.5 50 55 A V E -bc 7 76A 0 -44,-2.5 -42,-1.9 -2,-0.6 2,-0.3 -0.721 23.2-177.3 -86.3 121.5 13.3 34.4 -10.5 51 56 A L E + c 0 77A 0 25,-2.4 27,-2.7 -2,-0.6 -42,-0.3 -0.826 8.3 176.0-121.0 158.1 10.9 34.9 -7.6 52 57 A G > - 0 0 6 1,-0.5 3,-1.3 -44,-0.5 4,-0.1 0.052 56.3 -0.0-124.4-134.5 7.5 36.7 -7.3 53 58 A H T 3 S+ 0 0 166 -44,-0.5 -1,-0.5 1,-0.3 27,-0.0 -0.414 131.4 30.2 -54.5 140.0 4.9 37.2 -4.6 54 59 A D T 3> S+ 0 0 49 -3,-0.1 4,-0.6 -2,-0.1 3,-0.3 0.767 74.0 136.9 75.4 16.8 6.0 35.4 -1.5 55 60 A H H <> + 0 0 61 -3,-1.3 4,-2.6 1,-0.2 3,-0.4 0.746 69.5 64.0 -62.0 -25.6 9.7 36.0 -2.5 56 61 A Q H 4 S+ 0 0 154 1,-0.2 -1,-0.2 2,-0.2 -3,-0.1 0.883 104.3 43.6 -60.7 -42.5 9.9 36.7 1.2 57 62 A R H 4 S+ 0 0 109 -3,-0.3 -1,-0.2 1,-0.1 -2,-0.2 0.536 124.1 34.3 -82.4 -10.0 9.0 33.1 2.1 58 63 A I H X S+ 0 0 6 -4,-0.6 4,-1.7 -3,-0.4 3,-0.5 0.737 98.8 70.8-115.1 -40.6 11.3 31.6 -0.6 59 64 A A H X S+ 0 0 29 -4,-2.6 4,-2.1 1,-0.2 5,-0.1 0.857 98.5 53.8 -52.9 -40.0 14.4 33.7 -1.0 60 65 A P H > S+ 0 0 70 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.897 106.3 52.6 -60.7 -38.2 15.7 32.6 2.5 61 66 A L H > S+ 0 0 66 -3,-0.5 4,-1.8 1,-0.2 -2,-0.2 0.878 108.7 51.2 -65.1 -32.2 15.3 28.9 1.4 62 67 A V H X S+ 0 0 1 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.894 108.1 51.0 -73.1 -40.3 17.4 29.8 -1.6 63 68 A G H X S+ 0 0 35 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.915 108.9 50.8 -59.6 -47.8 20.2 31.4 0.5 64 69 A E H X S+ 0 0 125 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.914 111.6 48.9 -55.5 -41.3 20.3 28.3 2.7 65 70 A L H X S+ 0 0 21 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.834 104.6 57.9 -71.6 -34.9 20.6 26.1 -0.5 66 71 A A H X>S+ 0 0 11 -4,-2.2 5,-1.9 2,-0.2 4,-0.6 0.926 110.8 44.0 -55.9 -46.3 23.4 28.4 -1.8 67 72 A D H ><5S+ 0 0 130 -4,-2.0 3,-1.1 2,-0.2 -2,-0.2 0.960 113.1 49.7 -62.0 -54.9 25.4 27.6 1.4 68 73 A T H 3<5S+ 0 0 107 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.836 117.4 40.5 -53.3 -39.5 24.7 23.9 1.4 69 74 A L H 3<5S- 0 0 48 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.563 108.7-131.7 -91.0 -6.1 25.7 23.7 -2.2 70 75 A G T <<5 + 0 0 63 -3,-1.1 2,-0.3 -4,-0.6 -3,-0.2 0.952 68.0 96.2 55.4 59.7 28.6 26.0 -1.6 71 76 A R S - 0 0 7 119,-0.3 4,-2.4 -3,-0.1 -1,-0.2 -0.540 50.0 -71.6 130.0 163.6 4.1 35.1 -18.0 84 89 A T H > S+ 0 0 59 2,-0.2 4,-2.0 1,-0.2 120,-0.2 0.826 127.5 53.5 -61.3 -30.9 7.2 32.9 -18.5 85 90 A G H > S+ 0 0 2 118,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.929 110.5 47.0 -71.2 -42.0 8.7 35.2 -21.2 86 91 A H H > S+ 0 0 38 117,-0.8 4,-2.6 1,-0.2 -2,-0.2 0.894 108.7 55.4 -59.4 -42.6 8.4 38.2 -18.8 87 92 A A H X S+ 0 0 5 -4,-2.4 4,-1.7 116,-0.3 -2,-0.2 0.915 107.5 49.4 -59.3 -42.6 10.0 36.0 -16.0 88 93 A V H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 3,-0.2 0.956 108.5 53.5 -62.2 -45.1 13.0 35.3 -18.3 89 94 A L H X S+ 0 0 85 -4,-2.3 4,-1.0 1,-0.3 -2,-0.2 0.928 110.2 47.3 -54.1 -41.5 13.3 39.1 -19.0 90 95 A C H < S+ 0 0 22 -4,-2.6 4,-0.4 1,-0.2 3,-0.3 0.867 110.3 53.5 -65.2 -31.6 13.4 39.7 -15.3 91 96 A G H >< S+ 0 0 0 -4,-1.7 3,-1.5 -3,-0.2 -2,-0.2 0.900 101.9 58.3 -72.5 -38.0 15.9 36.9 -14.9 92 97 A L H >< S+ 0 0 1 -4,-2.8 3,-1.9 1,-0.3 -1,-0.2 0.765 91.3 70.9 -65.6 -26.8 18.2 38.5 -17.5 93 98 A S T 3< S+ 0 0 93 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.752 88.8 61.7 -63.8 -24.5 18.5 41.7 -15.5 94 99 A A T < S+ 0 0 30 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.563 96.1 78.5 -75.1 -8.5 20.6 39.9 -12.9 95 100 A L S < S- 0 0 8 -3,-1.9 2,-0.1 -4,-0.2 -92,-0.0 -0.665 99.0 -93.5 -89.9 154.7 23.1 39.4 -15.7 96 101 A P > - 0 0 56 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 -0.436 36.0-113.5 -60.5 147.2 25.5 42.1 -16.9 97 102 A D T 3 S+ 0 0 155 1,-0.3 -2,-0.0 -4,-0.1 -4,-0.0 0.791 117.6 43.0 -46.6 -38.2 24.2 44.2 -19.9 98 103 A D T 3 S+ 0 0 138 2,-0.0 -1,-0.3 0, 0.0 2,-0.0 0.051 78.8 148.6-106.4 24.4 27.0 42.7 -22.0 99 104 A Y < - 0 0 32 -3,-2.2 -4,-0.0 1,-0.1 0, 0.0 -0.373 20.7-177.9 -56.8 137.3 26.9 39.0 -20.9 100 105 A A + 0 0 92 84,-0.1 84,-0.2 2,-0.1 -1,-0.1 0.407 42.9 103.4-120.5 -2.2 27.9 36.6 -23.8 101 106 A G S S- 0 0 11 1,-0.1 83,-0.4 82,-0.1 -99,-0.2 -0.200 81.1 -84.2 -70.0 171.4 27.5 33.1 -22.4 102 107 A N E -a 2 0A 27 -101,-1.8 -99,-2.7 81,-0.1 2,-0.5 -0.371 38.4-135.2 -69.2 156.4 24.6 30.8 -23.2 103 108 A V E -aD 3 182A 0 79,-2.1 79,-2.2 -101,-0.2 2,-0.5 -0.973 15.9-166.3-120.6 119.9 21.4 31.1 -21.2 104 109 A V E -aD 4 181A 0 -101,-3.3 -99,-3.3 -2,-0.5 2,-0.4 -0.878 6.8-166.6-103.2 137.0 19.6 28.0 -20.0 105 110 A V E +aD 5 180A 1 75,-2.1 75,-2.7 -2,-0.5 2,-0.3 -0.978 15.5 156.4-123.1 135.4 16.1 28.3 -18.8 106 111 A T E -a 6 0A 0 -101,-2.5 -99,-2.2 -2,-0.4 2,-0.2 -0.969 34.9-110.3-147.0 166.5 14.1 25.8 -16.8 107 112 A S E > -a 7 0A 27 71,-0.4 3,-0.9 -2,-0.3 -99,-0.2 -0.600 17.9-126.0 -94.0 160.1 11.1 25.9 -14.5 108 113 A G T 3 S+ 0 0 1 -101,-2.7 -73,-0.2 1,-0.2 -100,-0.1 0.469 105.5 64.0 -76.0 -4.3 10.9 25.3 -10.7 109 114 A D T 3 S+ 0 0 23 -102,-0.2 124,-1.7 1,-0.1 -1,-0.2 0.036 77.6 83.2-113.1 29.1 8.2 22.7 -11.3 110 115 A T X + 0 0 2 -3,-0.9 3,-1.3 122,-0.2 122,-0.2 -0.735 54.9 167.8-119.0 76.0 10.2 20.1 -13.3 111 116 A P T 3 + 0 0 4 0, 0.0 -73,-0.1 0, 0.0 -1,-0.1 0.625 63.2 58.0 -85.4 -5.7 11.8 18.4 -10.3 112 117 A L T 3 S+ 0 0 15 119,-0.4 118,-0.1 116,-0.3 117,-0.1 0.446 72.2 124.3 -91.7 -0.9 13.2 15.2 -11.9 113 118 A L < - 0 0 7 -3,-1.3 2,-0.3 118,-0.2 -75,-0.2 -0.350 49.3-157.4 -61.8 137.6 15.3 17.2 -14.3 114 119 A D > - 0 0 53 -76,-0.1 4,-1.9 115,-0.1 3,-0.3 -0.777 29.8-107.6-120.7 160.4 19.0 16.0 -13.8 115 120 A A H > S+ 0 0 11 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.833 116.5 55.6 -51.6 -38.2 22.5 17.4 -14.4 116 121 A D H > S+ 0 0 122 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.881 106.0 48.6 -63.4 -44.1 23.0 14.9 -17.3 117 122 A T H > S+ 0 0 13 -3,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.897 114.1 48.6 -61.9 -40.4 20.0 16.1 -19.3 118 123 A L H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 5,-0.2 0.937 111.1 48.5 -65.8 -46.7 21.1 19.7 -18.8 119 124 A A H X S+ 0 0 42 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.914 110.4 51.6 -63.1 -38.6 24.7 18.9 -19.9 120 125 A D H X S+ 0 0 110 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.862 109.0 52.6 -62.4 -37.4 23.4 17.1 -23.0 121 126 A L H X S+ 0 0 1 -4,-1.7 4,-3.0 2,-0.2 -2,-0.2 0.942 109.9 45.3 -61.8 -52.9 21.2 20.2 -23.8 122 127 A I H X S+ 0 0 14 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.941 113.3 53.1 -61.7 -42.2 24.1 22.6 -23.6 123 128 A A H X S+ 0 0 60 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.873 111.7 43.4 -59.3 -39.0 26.1 20.0 -25.7 124 129 A T H X S+ 0 0 38 -4,-2.5 4,-2.3 2,-0.2 6,-0.2 0.931 112.2 54.2 -75.2 -37.1 23.5 19.8 -28.5 125 130 A H H <>S+ 0 0 5 -4,-3.0 5,-1.6 1,-0.2 4,-0.3 0.911 113.3 41.9 -57.8 -48.1 23.0 23.6 -28.4 126 131 A R H ><5S+ 0 0 135 -4,-2.5 3,-0.6 -5,-0.2 -1,-0.2 0.880 113.7 53.4 -67.9 -37.7 26.8 24.2 -28.9 127 132 A A H 3<5S+ 0 0 80 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.866 115.4 36.8 -65.9 -44.5 27.1 21.4 -31.5 128 133 A V T 3<5S- 0 0 53 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.329 102.6-127.1 -93.1 4.0 24.4 22.6 -33.9 129 134 A S T < 5 - 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