==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 15-JUL-12 4G3S . COMPND 2 MOLECULE: BIFUNCTIONAL PROTEIN GLMU; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR P.A.JAGTAP,S.K.VERMA,B.PRAKASH . 462 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21457.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 344 74.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 116 25.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 5.0 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 . 40 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 16.7 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 0 2 0 0 2 1 0 1 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 13 9 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 0 103 0, 0.0 101,-2.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 121.2 30.3 29.5 -21.1 2 7 A T E -a 102 0A 11 99,-0.2 44,-1.9 101,-0.0 43,-0.7 -0.990 360.0-160.3-142.6 140.1 26.6 29.3 -19.9 3 8 A A E -ab 103 46A 0 99,-2.5 101,-3.0 -2,-0.4 2,-0.5 -0.958 19.2-155.1-106.9 134.1 24.0 31.1 -17.8 4 9 A V E -ab 104 47A 0 42,-2.1 44,-2.7 -2,-0.4 2,-0.4 -0.954 5.1-162.2-111.3 126.0 21.0 29.0 -16.6 5 10 A L E -ab 105 48A 0 99,-3.2 101,-2.5 -2,-0.5 2,-0.6 -0.912 2.4-158.8-103.7 139.8 17.7 30.7 -15.8 6 11 A V E -ab 106 49A 0 42,-2.7 44,-2.4 -2,-0.4 2,-0.8 -0.961 12.1-143.9-118.8 116.3 15.1 28.9 -13.7 7 12 A L E +ab 107 50A 19 99,-2.5 101,-2.5 -2,-0.6 102,-0.3 -0.740 41.9 143.9 -86.5 112.1 11.5 30.3 -14.1 8 13 A A + 0 0 11 42,-1.8 44,-0.5 -2,-0.8 14,-0.1 -0.065 39.4 93.5-136.8 32.2 9.9 30.1 -10.8 9 14 A A + 0 0 8 42,-0.3 44,-0.5 43,-0.1 42,-0.1 0.296 49.9 117.9-115.4 13.9 7.7 33.2 -10.5 10 15 A G S S- 0 0 49 1,-0.1 42,-0.2 42,-0.1 11,-0.2 -0.314 73.9-116.1 -76.3 161.1 4.3 32.0 -11.8 11 16 A P - 0 0 84 0, 0.0 10,-0.3 0, 0.0 -1,-0.1 0.794 30.4-142.6 -66.6 -31.4 1.4 32.1 -9.4 12 17 A G > + 0 0 16 8,-0.1 3,-1.8 9,-0.1 4,-0.4 0.791 39.5 160.2 75.7 29.3 0.9 28.3 -9.4 13 18 A T G > + 0 0 99 1,-0.3 3,-1.8 2,-0.2 4,-0.1 0.815 63.1 63.4 -60.5 -32.3 -2.9 28.6 -9.2 14 19 A R G 3 S+ 0 0 144 1,-0.3 222,-0.4 2,-0.1 -1,-0.3 0.722 92.8 64.6 -70.6 -17.4 -3.6 25.1 -10.5 15 20 A M G < S- 0 0 3 -3,-1.8 -1,-0.3 220,-0.2 -2,-0.2 0.734 93.8-147.7 -69.8 -24.1 -1.9 23.6 -7.3 16 21 A R < + 0 0 219 -3,-1.8 2,-0.3 -4,-0.4 -3,-0.1 0.949 50.3 133.8 52.8 55.2 -4.8 25.3 -5.2 17 22 A S - 0 0 40 -5,-0.3 -1,-0.2 1,-0.1 4,-0.1 -0.971 67.2-145.0-137.6 149.0 -2.3 25.8 -2.4 18 23 A D S S+ 0 0 162 -2,-0.3 -1,-0.1 -3,-0.1 -2,-0.0 0.530 89.2 81.6 -85.7 -3.3 -1.2 28.4 0.1 19 24 A T S S- 0 0 55 -4,-0.1 5,-0.1 1,-0.0 -2,-0.1 -0.881 99.7-101.8 -98.3 125.8 2.4 27.0 -0.3 20 25 A P > - 0 0 7 0, 0.0 3,-2.0 0, 0.0 4,-0.5 -0.206 31.5-119.7 -49.9 138.9 4.2 28.3 -3.3 21 26 A K G > S+ 0 0 36 1,-0.3 3,-2.0 -10,-0.3 10,-0.3 0.837 109.7 54.3 -46.5 -54.2 4.2 25.7 -6.1 22 27 A V G 3 S+ 0 0 11 1,-0.3 10,-2.7 -14,-0.1 11,-0.4 0.625 101.6 62.7 -68.0 -9.8 7.9 25.2 -6.4 23 28 A L G < S+ 0 0 24 -3,-2.0 -1,-0.3 7,-0.2 -2,-0.2 0.596 76.5 110.0 -89.7 -11.6 8.1 24.5 -2.6 24 29 A H < - 0 0 20 -3,-2.0 7,-2.1 -4,-0.5 2,-0.2 -0.376 63.9-132.7 -64.9 148.9 6.0 21.4 -2.9 25 30 A T E +I 30 0B 90 5,-0.2 2,-0.3 6,-0.1 5,-0.3 -0.593 30.0 176.5-112.8 156.3 8.0 18.2 -2.3 26 31 A L E > S+I 29 0B 6 3,-2.3 3,-1.7 -2,-0.2 8,-0.1 -0.935 79.0 0.2-150.0 136.8 8.7 14.8 -3.6 27 32 A A T 3 S- 0 0 18 -2,-0.3 244,-2.5 1,-0.3 245,-0.3 0.767 131.9 -54.2 60.8 26.7 11.3 12.3 -2.2 28 33 A G T 3 S+ 0 0 51 242,-0.2 2,-0.3 1,-0.2 -1,-0.3 0.566 120.0 87.1 89.0 4.0 12.3 14.7 0.5 29 34 A R E < S-I 26 0B 54 -3,-1.7 -3,-2.3 -5,-0.0 -1,-0.2 -0.996 75.7-114.8-130.3 144.7 13.2 17.8 -1.7 30 35 A S E > -I 25 0B 22 -2,-0.3 4,-2.5 -5,-0.3 -5,-0.2 -0.253 36.1-109.4 -61.4 155.9 11.0 20.7 -3.0 31 36 A M H > S+ 0 0 0 -7,-2.1 4,-2.4 -10,-0.3 5,-0.2 0.923 121.9 52.0 -58.2 -39.9 10.7 20.9 -6.8 32 37 A L H > S+ 0 0 2 -10,-2.7 4,-3.1 2,-0.2 5,-0.2 0.952 108.4 51.6 -65.9 -42.4 12.9 24.0 -6.8 33 38 A S H > S+ 0 0 12 -11,-0.4 4,-2.9 1,-0.2 -2,-0.2 0.947 109.2 49.5 -53.8 -50.1 15.6 22.1 -4.7 34 39 A H H X S+ 0 0 16 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.943 113.3 47.2 -49.4 -51.2 15.6 19.2 -7.2 35 40 A V H X S+ 0 0 1 -4,-2.4 4,-1.8 73,-0.2 -2,-0.2 0.961 113.3 47.3 -65.4 -44.1 16.0 21.6 -10.1 36 41 A L H X S+ 0 0 0 -4,-3.1 4,-3.2 1,-0.2 -1,-0.2 0.892 110.3 53.5 -65.6 -39.4 18.8 23.6 -8.4 37 42 A H H X S+ 0 0 43 -4,-2.9 4,-1.3 -5,-0.2 -1,-0.2 0.906 109.2 47.7 -52.2 -50.7 20.7 20.4 -7.4 38 43 A A H X S+ 0 0 15 -4,-2.3 4,-1.0 -5,-0.2 -2,-0.2 0.863 115.9 45.3 -62.8 -35.5 20.7 19.1 -11.0 39 44 A I H X S+ 0 0 1 -4,-1.8 4,-1.4 -5,-0.2 3,-0.4 0.915 107.2 55.5 -78.7 -43.2 21.9 22.5 -12.3 40 45 A A H < S+ 0 0 17 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.826 105.9 55.0 -51.6 -33.1 24.7 23.0 -9.6 41 46 A K H < S+ 0 0 161 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.840 103.9 52.5 -74.0 -34.9 26.1 19.7 -10.8 42 47 A L H < S- 0 0 40 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.821 100.0-152.5 -67.7 -26.3 26.2 21.0 -14.3 43 48 A A < - 0 0 71 -4,-1.4 -3,-0.1 1,-0.1 2,-0.1 0.937 17.9-175.1 50.4 62.7 28.2 23.9 -12.8 44 49 A P - 0 0 11 0, 0.0 -41,-0.1 0, 0.0 -1,-0.1 -0.402 37.9-110.5 -74.6 162.6 27.4 26.8 -15.3 45 50 A Q S S+ 0 0 110 -43,-0.7 2,-0.3 -2,-0.1 -42,-0.2 0.876 101.3 25.4 -64.0 -39.8 29.1 30.1 -14.9 46 51 A R E -b 3 0A 59 -44,-1.9 -42,-2.1 2,-0.0 2,-0.4 -0.951 60.4-171.3-128.1 154.4 25.8 31.8 -13.9 47 52 A L E -b 4 0A 0 -2,-0.3 27,-2.3 -44,-0.2 2,-0.4 -0.959 12.2-178.0-146.7 110.0 22.6 30.5 -12.2 48 53 A I E -bc 5 74A 0 -44,-2.7 -42,-2.7 -2,-0.4 2,-0.5 -0.975 11.3-161.4-119.9 133.1 19.6 32.8 -12.0 49 54 A V E -bc 6 75A 0 25,-2.6 27,-2.1 -2,-0.4 2,-0.6 -0.966 12.5-146.0-115.5 124.1 16.3 32.1 -10.4 50 55 A V E -bc 7 76A 0 -44,-2.4 -42,-1.8 -2,-0.5 2,-0.3 -0.797 21.7-174.1 -90.9 122.4 13.4 34.3 -11.3 51 56 A L E - c 0 77A 0 25,-2.6 27,-3.1 -2,-0.6 -42,-0.3 -0.821 5.2-176.8-120.2 155.4 11.0 34.8 -8.4 52 57 A G > - 0 0 7 -44,-0.5 3,-1.5 -2,-0.3 4,-0.2 0.033 56.8 -20.7-123.6-137.2 7.6 36.6 -8.3 53 58 A H G > S+ 0 0 170 -44,-0.5 3,-0.6 1,-0.3 2,-0.2 0.882 131.2 48.2 -50.4 -51.6 5.0 37.4 -5.7 54 59 A D G > S+ 0 0 57 1,-0.2 3,-1.0 2,-0.1 4,-0.5 0.069 76.0 122.4 -81.6 29.1 5.9 34.9 -3.0 55 60 A H G X> + 0 0 64 -3,-1.5 4,-2.9 1,-0.3 3,-1.3 0.864 63.7 62.7 -65.1 -36.9 9.6 35.9 -3.3 56 61 A Q G <4 S+ 0 0 159 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.853 110.0 42.0 -45.1 -43.2 9.9 36.9 0.4 57 62 A R G <4 S+ 0 0 126 -3,-1.0 -1,-0.2 2,-0.1 -2,-0.2 0.440 121.7 37.4 -90.1 -1.8 9.2 33.2 1.2 58 63 A I T X> S+ 0 0 6 -3,-1.3 4,-2.0 -4,-0.5 3,-0.5 0.698 99.6 70.1-115.1 -38.2 11.4 31.6 -1.5 59 64 A A H 3X S+ 0 0 31 -4,-2.9 4,-1.9 1,-0.2 5,-0.2 0.879 97.3 52.7 -55.1 -43.0 14.5 33.7 -1.7 60 65 A P H 3> S+ 0 0 73 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.904 108.0 51.9 -60.5 -34.9 15.9 32.7 1.7 61 66 A L H <> S+ 0 0 60 -3,-0.5 4,-1.9 1,-0.2 -2,-0.2 0.908 107.1 53.1 -66.9 -37.2 15.5 29.0 0.7 62 67 A V H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.866 108.9 50.0 -64.8 -35.4 17.5 29.7 -2.5 63 68 A G H X S+ 0 0 33 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.925 107.8 51.9 -72.4 -45.3 20.3 31.3 -0.4 64 69 A E H X S+ 0 0 116 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.880 112.6 48.1 -52.1 -38.9 20.5 28.3 2.0 65 70 A L H X S+ 0 0 26 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.848 106.5 54.1 -76.6 -35.9 20.8 26.2 -1.2 66 71 A A H X>S+ 0 0 10 -4,-2.1 5,-1.7 2,-0.2 4,-0.6 0.937 112.5 46.0 -56.4 -48.1 23.5 28.3 -2.7 67 72 A D H ><5S+ 0 0 133 -4,-2.5 3,-1.1 3,-0.2 -2,-0.2 0.946 112.9 50.0 -55.4 -54.7 25.4 27.9 0.6 68 73 A T H 3<5S+ 0 0 106 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.866 115.7 41.2 -53.4 -44.6 24.7 24.1 0.6 69 74 A L H 3<5S- 0 0 49 -4,-2.5 -1,-0.3 2,-0.2 -2,-0.2 0.456 109.3-122.9 -88.5 0.6 25.9 23.6 -3.0 70 75 A G T <<5S+ 0 0 67 -3,-1.1 2,-0.3 -4,-0.6 -3,-0.2 0.980 75.5 92.8 56.1 62.4 28.9 26.0 -2.6 71 76 A R S - 0 0 7 119,-0.2 4,-2.7 -3,-0.1 -1,-0.3 -0.593 50.2 -77.6 136.2 159.5 4.2 35.0 -19.0 84 89 A T H > S+ 0 0 59 2,-0.2 4,-2.0 1,-0.2 120,-0.2 0.849 127.3 54.6 -59.5 -32.7 7.3 32.7 -19.4 85 90 A G H > S+ 0 0 0 118,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.944 110.6 45.9 -67.6 -46.1 8.7 35.1 -22.1 86 91 A H H > S+ 0 0 37 117,-0.8 4,-2.5 2,-0.2 -2,-0.2 0.898 108.4 55.9 -60.7 -41.5 8.5 38.0 -19.7 87 92 A A H X S+ 0 0 5 -4,-2.7 4,-2.0 116,-0.3 -2,-0.2 0.912 107.6 50.0 -55.9 -44.0 10.1 35.8 -16.9 88 93 A V H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.934 107.8 53.5 -63.9 -38.1 13.1 35.2 -19.1 89 94 A L H X S+ 0 0 73 -4,-2.0 4,-0.9 1,-0.2 -2,-0.2 0.929 110.4 47.2 -58.2 -43.8 13.3 39.0 -19.9 90 95 A C H < S+ 0 0 23 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.858 110.9 52.7 -65.8 -32.6 13.4 39.6 -16.1 91 96 A G H >< S+ 0 0 0 -4,-2.0 3,-1.9 1,-0.2 -2,-0.2 0.906 102.6 56.8 -69.4 -42.0 16.0 36.8 -15.8 92 97 A L H >< S+ 0 0 2 -4,-2.7 3,-1.9 1,-0.3 -1,-0.2 0.749 92.9 71.5 -61.5 -25.9 18.4 38.3 -18.4 93 98 A S T 3< S+ 0 0 89 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.629 87.5 61.9 -68.3 -17.7 18.5 41.5 -16.5 94 99 A A T < S+ 0 0 31 -3,-1.9 -1,-0.3 -4,-0.2 -2,-0.2 0.441 95.6 79.6 -84.4 -3.1 20.6 39.8 -13.8 95 100 A L S < S- 0 0 8 -3,-1.9 -92,-0.0 -4,-0.1 -49,-0.0 -0.710 98.4 -90.0 -95.4 153.3 23.3 39.2 -16.5 96 101 A P > - 0 0 57 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.299 36.7-115.8 -55.3 149.0 25.8 41.9 -17.8 97 102 A D T 3 S+ 0 0 159 1,-0.3 -2,-0.0 -4,-0.1 -3,-0.0 0.827 117.7 44.0 -50.2 -36.9 24.5 44.0 -20.7 98 103 A D T 3 S+ 0 0 136 2,-0.0 -1,-0.3 0, 0.0 0, 0.0 0.193 79.9 147.4-101.8 13.5 27.3 42.6 -22.8 99 104 A Y < - 0 0 19 -3,-1.9 -4,-0.0 1,-0.1 0, 0.0 -0.218 20.7-179.4 -50.4 141.0 27.0 38.9 -21.7 100 105 A A + 0 0 87 84,-0.1 84,-0.2 2,-0.1 -1,-0.1 0.472 39.6 104.0-130.4 -8.0 27.9 36.6 -24.5 101 106 A G S S- 0 0 11 1,-0.1 83,-0.4 82,-0.1 -99,-0.2 -0.146 80.0 -79.5 -66.3 170.0 27.6 33.0 -23.2 102 107 A N E -a 2 0A 31 -101,-2.2 -99,-2.5 81,-0.1 2,-0.5 -0.312 40.4-136.2 -58.2 153.0 24.7 30.5 -24.0 103 108 A V E -aD 3 182A 0 79,-2.1 79,-2.8 -101,-0.2 2,-0.5 -0.976 16.3-167.3-121.1 117.1 21.4 30.9 -22.2 104 109 A V E -aD 4 181A 0 -101,-3.0 -99,-3.2 -2,-0.5 2,-0.4 -0.901 6.7-164.3-100.2 137.3 19.7 27.8 -20.9 105 110 A V E +aD 5 180A 1 75,-2.5 75,-2.4 -2,-0.5 2,-0.3 -0.969 15.5 158.7-123.0 133.8 16.1 28.1 -19.7 106 111 A T E -a 6 0A 0 -101,-2.5 -99,-2.5 -2,-0.4 2,-0.2 -0.967 33.6-111.1-146.0 167.8 14.2 25.7 -17.6 107 112 A S E > -a 7 0A 25 -2,-0.3 3,-0.8 -101,-0.2 -99,-0.2 -0.590 16.1-131.5 -95.4 152.8 11.1 25.7 -15.3 108 113 A G T 3 S+ 0 0 1 -101,-2.5 -73,-0.2 -2,-0.2 -100,-0.1 0.539 105.3 63.8 -71.2 -10.9 11.0 25.2 -11.5 109 114 A D T 3 S+ 0 0 24 -102,-0.3 124,-1.8 1,-0.1 -1,-0.2 0.085 79.7 82.4-103.4 23.9 8.2 22.6 -12.1 110 115 A T X + 0 0 3 -3,-0.8 3,-1.0 122,-0.2 122,-0.1 -0.768 54.7 165.2-118.4 76.6 10.3 20.1 -14.0 111 116 A P T 3 + 0 0 3 0, 0.0 -1,-0.1 0, 0.0 -73,-0.1 0.613 61.5 58.6 -88.4 -7.6 11.9 18.3 -11.1 112 117 A L T 3 S+ 0 0 17 119,-0.4 2,-0.1 116,-0.3 118,-0.1 0.377 73.0 124.6 -92.9 2.3 13.4 15.1 -12.6 113 118 A L < - 0 0 6 -3,-1.0 2,-0.3 118,-0.2 -75,-0.2 -0.417 48.6-159.1 -64.2 131.2 15.5 17.0 -15.0 114 119 A D > - 0 0 54 -2,-0.1 4,-1.9 115,-0.1 3,-0.2 -0.732 30.2-105.7-119.6 162.4 19.1 15.9 -14.5 115 120 A A H > S+ 0 0 16 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.830 116.1 55.7 -50.6 -37.2 22.6 17.2 -15.1 116 121 A D H > S+ 0 0 118 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.925 105.9 49.4 -67.3 -50.7 23.2 14.8 -18.0 117 122 A T H > S+ 0 0 13 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.904 113.5 48.7 -50.0 -46.3 20.1 15.9 -20.0 118 123 A L H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.918 111.5 48.6 -63.8 -42.1 21.2 19.5 -19.5 119 124 A A H X S+ 0 0 41 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.948 110.6 50.2 -63.4 -47.3 24.8 18.8 -20.6 120 125 A D H X S+ 0 0 104 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.791 108.9 53.9 -62.1 -35.1 23.6 16.9 -23.7 121 126 A L H X S+ 0 0 1 -4,-1.7 4,-2.7 -5,-0.2 -1,-0.2 0.920 109.3 46.1 -61.5 -51.1 21.3 19.9 -24.6 122 127 A I H X S+ 0 0 15 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.916 113.8 50.5 -62.1 -39.8 24.2 22.4 -24.4 123 128 A A H X S+ 0 0 59 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.888 112.5 45.6 -64.7 -43.5 26.4 20.0 -26.5 124 129 A T H X S+ 0 0 37 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.910 111.5 53.0 -62.6 -46.3 23.6 19.6 -29.2 125 130 A H H <>S+ 0 0 7 -4,-2.7 5,-1.9 1,-0.2 -2,-0.2 0.869 114.4 41.5 -55.5 -46.8 23.0 23.4 -29.3 126 131 A R H ><5S+ 0 0 125 -4,-2.2 3,-0.6 3,-0.2 -1,-0.2 0.821 111.5 56.6 -72.2 -32.6 26.7 24.1 -29.9 127 132 A A H 3<5S+ 0 0 82 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.783 115.4 34.8 -72.3 -32.2 27.1 21.2 -32.3 128 133 A V T 3<5S- 0 0 56 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.263 103.3-127.8-103.5 8.1 24.4 22.4 -34.7 129 134 A S T < 5 - 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