==== 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 LIGASE 19-FEB-08 2VOS . COMPND 2 MOLECULE: FOLYLPOLYGLUTAMATE SYNTHASE PROTEIN FOLC; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR P.G.YOUNG,E.N.BAKER,P.METCALF,C.A.SMITH . 448 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18467.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 315 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 10.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 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-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 21 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 154 34.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 0 0 0 0 1 3 1 0 2 2 1 1 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 7 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 PARALLEL BRIDGES PER LADDER . 2 1 2 0 0 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 . 0 1 0 0 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 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 24 A D > 0 0 159 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -28.9 -2.6 15.7 75.0 2 25 A E H > + 0 0 84 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.941 360.0 42.9 -59.6 -53.3 -0.2 13.1 73.8 3 26 A I H > S+ 0 0 102 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.847 113.5 52.5 -60.8 -38.0 1.7 16.0 72.1 4 27 A A H > S+ 0 0 49 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.933 108.5 48.7 -68.5 -43.9 1.2 18.1 75.2 5 28 A S H X S+ 0 0 29 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.917 109.5 53.9 -59.5 -43.6 2.7 15.3 77.5 6 29 A L H X S+ 0 0 10 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.928 107.1 50.7 -57.0 -43.2 5.6 15.0 75.1 7 30 A L H X S+ 0 0 105 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.901 107.4 54.1 -62.4 -39.0 6.2 18.8 75.4 8 31 A Q H X S+ 0 0 129 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.938 109.1 48.1 -58.3 -49.2 6.2 18.5 79.2 9 32 A V H X S+ 0 0 10 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.925 111.7 48.8 -57.7 -43.9 8.9 15.8 79.0 10 33 A E H X S+ 0 0 17 -4,-2.2 4,-2.9 1,-0.2 -1,-0.2 0.859 105.7 58.2 -66.9 -38.0 11.1 17.9 76.7 11 34 A H H < S+ 0 0 129 -4,-2.4 4,-0.4 2,-0.2 -1,-0.2 0.915 111.3 42.9 -56.1 -44.0 10.8 21.0 78.9 12 35 A L H >< S+ 0 0 77 -4,-1.8 3,-1.6 1,-0.2 4,-0.3 0.935 113.6 49.5 -65.3 -50.4 12.2 19.0 81.8 13 36 A L H >X S+ 0 0 0 -4,-2.5 3,-1.7 1,-0.3 4,-0.6 0.863 105.6 59.0 -60.9 -35.7 15.0 17.3 79.7 14 37 A D T 3< S+ 0 0 98 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.632 95.5 64.0 -69.2 -12.4 15.9 20.7 78.3 15 38 A Q T <4 S+ 0 0 114 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.530 96.0 61.1 -86.2 -5.7 16.6 21.9 81.8 16 39 A R T <4 0 0 41 -3,-1.7 -2,-0.2 -4,-0.3 -1,-0.2 0.919 360.0 360.0 -77.9 -43.0 19.4 19.4 82.2 17 40 A W < 0 0 235 -4,-0.6 107,-2.4 106,-0.0 108,-0.4 -0.727 360.0 360.0 53.2 360.0 21.8 20.5 79.4 18 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 19 44 A R 0 0 91 0, 0.0 104,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 153.7 29.4 18.0 82.9 20 45 A I - 0 0 90 1,-0.1 3,-0.1 2,-0.0 0, 0.0 -0.105 360.0-162.3 -51.7 150.6 31.1 15.4 80.6 21 46 A D > + 0 0 23 133,-0.3 3,-3.1 1,-0.1 4,-0.2 -0.501 15.1 171.7-139.5 68.3 31.6 11.9 82.0 22 47 A P T 3 S+ 0 0 65 0, 0.0 -1,-0.1 0, 0.0 133,-0.1 0.630 78.4 62.5 -47.3 -23.1 34.2 10.2 79.9 23 48 A S T 3 S- 0 0 83 -3,-0.1 -3,-0.0 131,-0.1 131,-0.0 0.556 105.1-131.0 -84.1 -5.0 34.3 7.2 82.3 24 49 A L <> + 0 0 22 -3,-3.1 4,-2.4 130,-0.2 5,-0.2 0.741 57.3 147.3 64.6 28.1 30.6 6.6 81.4 25 50 A T H > + 0 0 83 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.905 63.6 42.8 -63.4 -48.1 29.9 6.3 85.1 26 51 A R H > S+ 0 0 16 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.945 117.3 43.0 -67.5 -51.8 26.4 7.8 85.2 27 52 A I H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.911 115.6 51.4 -67.7 -37.9 25.0 6.0 82.1 28 53 A S H X S+ 0 0 45 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.933 110.8 47.9 -58.8 -46.4 26.6 2.7 83.2 29 54 A A H X S+ 0 0 33 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.903 111.7 50.0 -58.7 -46.3 25.1 3.1 86.7 30 55 A L H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.930 108.7 51.6 -60.0 -47.3 21.7 3.8 85.2 31 56 A X H <>S+ 0 0 0 -4,-2.6 5,-3.6 1,-0.2 4,-0.5 0.918 108.4 53.6 -56.6 -43.7 21.9 0.7 82.9 32 57 A D H ><5S+ 0 0 114 -4,-2.3 3,-1.2 1,-0.2 -1,-0.2 0.933 109.3 46.8 -53.7 -50.4 22.8 -1.4 86.0 33 58 A L H 3<5S+ 0 0 74 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.812 110.6 54.0 -58.5 -34.7 19.7 -0.2 87.9 34 59 A L T 3<5S- 0 0 43 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.494 124.0-102.7 -78.5 -7.4 17.5 -0.8 84.7 35 60 A G T < 5 - 0 0 61 -3,-1.2 -3,-0.2 -4,-0.5 -2,-0.1 0.668 58.9 -77.8 89.4 18.1 18.7 -4.4 84.5 36 61 A S > < + 0 0 35 -5,-3.6 3,-2.1 -6,-0.2 4,-0.2 0.924 65.3 172.0 56.7 47.7 21.2 -3.8 81.6 37 62 A P G > S+ 0 0 12 0, 0.0 3,-2.2 0, 0.0 4,-0.2 0.838 71.3 66.9 -54.9 -30.7 18.5 -3.7 78.9 38 63 A Q G 3 S+ 0 0 6 1,-0.3 3,-0.3 2,-0.2 -2,-0.1 0.618 97.8 53.6 -76.2 -4.9 21.2 -2.6 76.4 39 64 A R G < S+ 0 0 139 -3,-2.1 -1,-0.3 1,-0.1 -3,-0.1 0.383 88.5 80.3-102.9 7.4 22.8 -6.0 76.8 40 65 A S S < S+ 0 0 81 -3,-2.2 -2,-0.2 -4,-0.2 -1,-0.1 0.443 98.8 30.6-100.8 9.3 19.7 -8.0 76.0 41 66 A Y S S- 0 0 17 -3,-0.3 2,-0.2 -4,-0.2 102,-0.1 -0.961 88.2-107.0-151.1 157.3 19.9 -7.7 72.2 42 67 A P - 0 0 54 0, 0.0 102,-2.4 0, 0.0 2,-0.3 -0.567 37.4-154.7 -82.9 154.5 22.8 -7.3 69.8 43 68 A S E -a 144 0A 2 100,-0.2 121,-1.0 117,-0.2 2,-0.5 -0.918 20.2-140.5-128.6 156.8 23.5 -3.9 68.2 44 69 A I E -ab 145 164A 0 100,-2.6 102,-3.3 -2,-0.3 2,-0.4 -0.992 31.4-154.7-115.4 126.3 25.2 -2.5 65.2 45 70 A H E -ab 146 165A 0 119,-2.5 121,-3.5 -2,-0.5 2,-0.5 -0.860 6.7-160.1-118.3 126.2 26.9 0.6 66.4 46 71 A I E +ab 147 166A 0 100,-3.0 102,-2.9 -2,-0.4 2,-0.3 -0.923 17.1 159.6-124.3 125.5 27.7 3.5 64.1 47 72 A A E + b 0 167A 0 119,-3.1 121,-2.8 -2,-0.5 2,-0.3 -0.788 22.2 99.6-129.4 167.8 30.3 6.4 64.4 48 73 A G - 0 0 2 103,-0.4 122,-0.2 -2,-0.3 103,-0.2 -0.803 68.6 -90.5 143.9-175.1 31.9 8.8 61.9 49 74 A T S S+ 0 0 9 120,-1.9 2,-0.4 119,-0.3 121,-0.2 0.838 99.5 23.6-100.8 -45.8 31.5 12.4 60.7 50 75 A N S S+ 0 0 39 119,-1.8 -1,-0.3 1,-0.1 -3,-0.0 -0.978 116.5 22.4-124.8 145.8 29.2 12.2 57.8 51 76 A G S > S+ 0 0 18 -2,-0.4 4,-2.9 117,-0.1 5,-0.3 0.452 74.6 125.4 87.8 3.1 26.5 9.6 56.8 52 77 A K H > S+ 0 0 34 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.958 79.3 39.2 -58.5 -55.0 25.9 8.2 60.3 53 78 A T H > S+ 0 0 15 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.922 117.5 49.2 -61.2 -46.2 22.1 8.8 60.4 54 79 A S H > S+ 0 0 6 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.922 113.6 46.6 -61.0 -43.0 21.7 7.8 56.7 55 80 A V H X S+ 0 0 0 -4,-2.9 4,-2.9 2,-0.2 5,-0.2 0.907 110.0 54.6 -63.6 -40.6 23.7 4.6 57.2 56 81 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.3 -2,-0.2 0.929 110.1 46.2 -59.2 -46.5 21.7 3.8 60.4 57 82 A R H X S+ 0 0 20 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.834 111.8 51.1 -67.4 -32.2 18.5 4.1 58.5 58 83 A X H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.918 109.9 49.6 -66.9 -48.6 19.9 1.9 55.6 59 84 A V H X S+ 0 0 0 -4,-2.9 4,-2.7 2,-0.2 5,-0.3 0.924 111.8 49.5 -52.2 -49.3 20.9 -0.8 58.1 60 85 A D H X S+ 0 0 2 -4,-2.3 4,-2.8 -5,-0.2 5,-0.3 0.950 111.2 48.8 -56.6 -50.9 17.4 -0.6 59.7 61 86 A A H X S+ 0 0 16 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.920 113.7 46.1 -55.9 -47.1 15.8 -1.0 56.2 62 87 A L H X S+ 0 0 4 -4,-2.6 4,-1.2 2,-0.2 -2,-0.2 0.931 114.0 47.2 -63.6 -45.9 18.0 -4.0 55.2 63 88 A V H <>S+ 0 0 0 -4,-2.7 5,-2.2 1,-0.2 -2,-0.2 0.912 113.5 49.3 -65.4 -36.7 17.5 -5.8 58.6 64 89 A T H ><5S+ 0 0 54 -4,-2.8 3,-1.7 -5,-0.3 -1,-0.2 0.880 106.8 54.3 -67.1 -41.2 13.8 -5.2 58.4 65 90 A A H 3<5S+ 0 0 17 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.737 105.6 54.8 -61.8 -25.3 13.7 -6.5 54.7 66 91 A L T 3<5S- 0 0 21 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.271 122.8-115.5 -90.9 7.7 15.3 -9.6 56.2 67 92 A H T < 5 + 0 0 164 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.636 69.5 134.4 67.8 21.6 12.4 -9.7 58.6 68 93 A R < - 0 0 114 -5,-2.2 2,-0.4 74,-0.0 -1,-0.2 -0.773 61.3-112.7 -93.6 147.3 14.1 -9.1 62.0 69 94 A R - 0 0 85 -2,-0.3 73,-2.8 18,-0.0 74,-1.7 -0.646 40.3-158.5 -84.6 126.5 12.4 -6.6 64.2 70 95 A T E -c 143 0A 0 -2,-0.4 18,-2.3 71,-0.2 2,-0.4 -0.731 21.3-163.4-107.1 156.3 14.6 -3.6 64.7 71 96 A G E -cD 144 87A 0 72,-2.2 74,-2.9 -2,-0.3 2,-0.4 -0.983 19.0-171.1-122.4 146.3 15.1 -0.7 67.1 72 97 A R E -cD 145 86A 5 14,-2.6 14,-2.7 -2,-0.4 2,-0.5 -0.997 12.4-167.6-140.2 132.8 17.0 2.3 65.9 73 98 A T E +cD 146 85A 8 72,-2.7 74,-2.3 -2,-0.4 2,-0.3 -0.984 19.3 167.4-121.9 126.5 18.3 5.3 67.8 74 99 A T - 0 0 7 10,-0.6 75,-0.1 -2,-0.5 3,-0.1 -0.855 19.7-103.5-131.5 167.1 19.6 8.2 65.8 75 100 A S S S+ 0 0 8 -2,-0.3 -22,-0.1 73,-0.2 2,-0.1 -0.971 72.7 14.9-161.3 158.8 20.5 11.9 66.4 76 101 A P S S- 0 0 63 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.825 74.8-130.5 -73.5 178.8 20.0 14.6 66.3 77 102 A H - 0 0 48 1,-0.1 365,-0.1 -2,-0.1 -2,-0.0 -0.639 7.9-153.8 -84.8 150.7 16.2 14.8 65.6 78 103 A L S S- 0 0 14 2,-0.2 -1,-0.1 -2,-0.2 368,-0.1 0.902 82.6 -7.2 -82.6 -55.8 15.0 17.0 62.7 79 104 A Q S S+ 0 0 35 1,-0.4 -2,-0.1 366,-0.1 372,-0.0 0.765 129.1 17.5-114.7 -41.6 11.4 17.8 63.8 80 105 A S > - 0 0 23 1,-0.1 3,-2.0 0, 0.0 -1,-0.4 -0.992 64.9-125.6-139.8 143.0 10.4 15.9 66.9 81 106 A P G > S+ 0 0 10 0, 0.0 3,-2.4 0, 0.0 4,-0.2 0.733 102.3 78.5 -65.8 -17.5 12.4 14.0 69.5 82 107 A V G > S+ 0 0 9 1,-0.3 3,-1.7 2,-0.2 10,-0.7 0.784 80.3 72.8 -54.0 -23.1 10.3 10.8 68.8 83 108 A E G < S+ 0 0 17 -3,-2.0 -1,-0.3 1,-0.3 -9,-0.2 0.717 83.1 68.5 -64.3 -22.1 12.5 10.5 65.8 84 109 A R G < S+ 0 0 31 -3,-2.4 -10,-0.6 1,-0.2 2,-0.4 0.634 101.5 46.1 -74.6 -14.9 15.3 9.4 68.1 85 110 A I E < S+D 73 0A 1 -3,-1.7 7,-2.6 -4,-0.2 2,-0.4 -0.939 70.5 171.4-133.5 112.3 13.7 6.1 69.0 86 111 A S E -DE 72 91A 0 -14,-2.7 -14,-2.6 -2,-0.4 2,-0.4 -0.912 13.8-168.2-120.9 143.8 12.3 4.0 66.3 87 112 A I E > S+DE 71 90A 23 3,-2.3 3,-1.4 -2,-0.4 -16,-0.2 -0.990 79.1 2.8-129.2 133.9 10.9 0.4 66.3 88 113 A D T 3 S- 0 0 73 -18,-2.3 -17,-0.1 -2,-0.4 -1,-0.1 0.777 133.8 -56.7 63.2 29.4 10.2 -1.5 63.1 89 114 A G T 3 S+ 0 0 29 -19,-0.2 -1,-0.3 1,-0.2 -18,-0.1 0.538 119.1 95.8 85.9 5.8 11.5 1.4 61.0 90 115 A K E < S-E 87 0A 156 -3,-1.4 -3,-2.3 -18,-0.0 -1,-0.2 -0.983 79.6-104.1-132.0 142.5 9.1 4.0 62.5 91 116 A P E -E 86 0A 33 0, 0.0 -5,-0.3 0, 0.0 -8,-0.2 -0.289 43.6-110.5 -56.9 145.8 9.4 6.6 65.2 92 117 A I - 0 0 13 -7,-2.6 -7,-0.1 -10,-0.7 -8,-0.1 -0.266 42.1 -94.5 -67.0 166.0 7.6 5.6 68.4 93 118 A S > - 0 0 36 1,-0.1 4,-2.2 -3,-0.1 5,-0.2 -0.381 29.8-109.2 -80.5 161.2 4.5 7.7 69.2 94 119 A P H > S+ 0 0 22 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.908 120.7 55.1 -53.8 -38.6 4.5 10.7 71.5 95 120 A A H > S+ 0 0 52 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.941 109.1 45.6 -61.9 -43.0 2.6 8.5 74.1 96 121 A Q H > S+ 0 0 105 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.839 110.4 54.8 -67.9 -34.6 5.2 5.7 74.0 97 122 A Y H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.936 112.0 43.3 -65.8 -47.9 8.1 8.3 74.3 98 123 A V H X S+ 0 0 14 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.927 113.2 51.5 -59.8 -47.7 6.5 9.8 77.5 99 124 A A H X S+ 0 0 53 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.872 109.7 51.4 -60.4 -37.1 5.7 6.3 78.9 100 125 A T H X S+ 0 0 10 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.944 111.8 45.5 -65.0 -45.1 9.4 5.3 78.3 101 126 A Y H X S+ 0 0 10 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.956 114.0 49.3 -60.8 -49.6 10.7 8.4 80.1 102 127 A R H < S+ 0 0 158 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.885 108.2 54.1 -59.7 -39.7 8.2 7.9 83.0 103 128 A E H < S+ 0 0 90 -4,-2.3 -1,-0.2 -5,-0.2 4,-0.2 0.914 118.3 33.3 -68.0 -37.9 9.2 4.3 83.4 104 129 A I H >X S+ 0 0 2 -4,-1.9 4,-2.1 1,-0.2 3,-1.5 0.725 95.6 91.7 -84.8 -15.3 12.9 5.1 83.7 105 130 A E H 3X S+ 0 0 65 -4,-2.4 4,-3.4 1,-0.3 5,-0.3 0.810 80.2 54.9 -54.7 -44.2 12.5 8.4 85.5 106 131 A P H 3> S+ 0 0 83 0, 0.0 4,-1.3 0, 0.0 -1,-0.3 0.892 113.2 44.3 -59.2 -30.7 12.7 7.1 89.1 107 132 A L H <> S+ 0 0 49 -3,-1.5 4,-2.1 -4,-0.2 -2,-0.2 0.861 112.5 51.4 -79.3 -37.0 16.0 5.4 88.3 108 133 A V H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 14,-0.2 0.927 108.9 51.5 -59.1 -47.8 17.3 8.5 86.5 109 134 A A H X S+ 0 0 33 -4,-3.4 4,-2.2 -5,-0.2 -2,-0.2 0.874 108.7 52.4 -55.6 -38.2 16.3 10.6 89.6 110 135 A L H X S+ 0 0 66 -4,-1.3 4,-2.8 -5,-0.3 5,-0.2 0.936 111.2 44.3 -69.6 -43.9 18.3 8.2 91.8 111 136 A I H X S+ 0 0 6 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.910 111.0 55.5 -62.9 -42.1 21.4 8.5 89.6 112 137 A D H X S+ 0 0 29 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.901 114.6 40.1 -54.9 -44.7 21.0 12.3 89.5 113 138 A Q H X S+ 0 0 135 -4,-2.2 4,-0.6 2,-0.2 -2,-0.2 0.901 115.0 48.9 -74.2 -44.9 20.9 12.3 93.4 114 139 A Q H X S+ 0 0 102 -4,-2.8 4,-0.5 2,-0.2 3,-0.2 0.848 114.4 49.6 -63.5 -33.7 23.7 9.8 93.9 115 140 A S H >< S+ 0 0 25 -4,-2.7 3,-1.2 -5,-0.2 -2,-0.2 0.962 110.7 46.4 -67.4 -53.4 25.8 11.7 91.4 116 141 A Q H 3< S+ 0 0 78 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.485 117.1 46.9 -71.9 -1.0 25.2 15.1 93.0 117 142 A A H 3< 0 0 87 -4,-0.6 -1,-0.2 -3,-0.2 -2,-0.2 0.469 360.0 360.0-111.2 -5.5 26.0 13.6 96.5 118 143 A S << 0 0 141 -3,-1.2 -4,-0.0 -4,-0.5 -3,-0.0 -0.547 360.0 360.0 -80.2 360.0 29.2 11.7 95.5 119 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 120 149 A P 0 0 79 0, 0.0 -4,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 134.6 26.4 16.8 87.9 121 150 A A - 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