==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-JAN-99 2YPN . COMPND 2 MOLECULE: PROTEIN (HYDROXYMETHYLBILANE SYNTHASE); . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Y.P.NIEH,J.RAFTERY,S.WEISGERBER,J.HABASH,F.SCHOTTE,T.URSBY,M . 294 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12868.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 208 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 1 0.3 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 . 21 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.4 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 1 1 1 1 1 1 0 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 1 0 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 . 0 0 0 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 D 0 0 136 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 154.5 7.5 19.1 -1.1 2 4 A N + 0 0 83 30,-0.1 31,-3.0 2,-0.0 2,-0.5 0.289 360.0 98.2-112.2 6.6 11.3 19.1 -0.8 3 5 A V E -a 33 0A 25 29,-0.2 2,-0.5 31,-0.1 31,-0.2 -0.836 51.9-169.1 -99.7 133.6 11.4 19.7 2.9 4 6 A L E -a 34 0A 1 29,-3.1 31,-2.7 -2,-0.5 2,-0.6 -0.977 7.2-157.7-125.2 115.1 11.8 16.8 5.3 5 7 A R E -a 35 0A 52 -2,-0.5 53,-3.0 29,-0.2 54,-1.7 -0.844 3.8-157.7 -98.5 121.6 11.3 17.6 9.0 6 8 A I E -ab 36 59A 0 29,-3.2 31,-3.4 -2,-0.6 2,-0.3 -0.857 2.1-155.9-103.5 118.1 12.9 15.3 11.5 7 9 A A E +ab 37 60A 0 52,-2.8 54,-1.6 -2,-0.6 2,-0.3 -0.726 28.3 156.4 -88.7 139.3 11.4 15.1 15.1 8 10 A T E -a 38 0A 0 29,-1.0 31,-2.7 -2,-0.3 54,-0.1 -0.987 44.2 -95.5-158.9 160.6 13.9 13.9 17.7 9 11 A R - 0 0 83 52,-0.4 31,-0.2 -2,-0.3 9,-0.1 -0.253 37.8-122.3 -68.3 172.7 14.7 14.0 21.5 10 12 A Q + 0 0 109 29,-0.2 30,-0.1 28,-0.1 -1,-0.1 0.171 68.5 115.0-110.5 20.9 17.1 16.7 22.6 11 13 A S S > S- 0 0 6 1,-0.1 4,-2.5 123,-0.0 5,-0.2 -0.389 79.7-107.1 -83.7 162.4 19.9 14.7 24.3 12 14 A P H > S+ 0 0 84 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.947 121.7 46.1 -53.7 -45.5 23.4 14.7 22.8 13 15 A L H > S+ 0 0 30 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.899 110.3 50.8 -65.2 -45.0 22.9 11.2 21.6 14 16 A A H > S+ 0 0 3 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.932 111.4 49.4 -60.6 -41.7 19.5 11.7 20.1 15 17 A L H X S+ 0 0 51 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.776 106.9 56.3 -69.2 -25.0 20.8 14.8 18.2 16 18 A W H X S+ 0 0 92 -4,-1.3 4,-2.2 -5,-0.2 -1,-0.2 0.945 108.8 46.0 -70.1 -46.0 23.7 12.6 17.0 17 19 A Q H X S+ 0 0 6 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.859 109.5 55.2 -64.3 -35.8 21.3 10.1 15.5 18 20 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.957 110.4 45.4 -61.4 -48.2 19.2 13.0 14.0 19 21 A H H X S+ 0 0 90 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.864 108.8 57.8 -61.8 -39.4 22.4 14.3 12.2 20 22 A Y H X S+ 0 0 43 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.950 110.6 41.5 -56.8 -50.5 23.3 10.7 11.2 21 23 A V H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.900 113.3 53.7 -65.7 -42.1 19.9 10.3 9.3 22 24 A K H X S+ 0 0 64 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.944 108.8 49.1 -57.8 -49.2 20.1 13.8 7.9 23 25 A D H X S+ 0 0 98 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.913 111.5 48.8 -57.5 -45.6 23.5 13.2 6.4 24 26 A K H X S+ 0 0 97 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.899 112.5 49.0 -62.8 -39.5 22.4 9.9 4.9 25 27 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.926 110.6 49.7 -65.1 -46.1 19.4 11.7 3.4 26 28 A M H < S+ 0 0 62 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.865 109.1 52.8 -60.9 -39.1 21.4 14.5 2.0 27 29 A A H < S+ 0 0 84 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.857 115.0 40.2 -67.1 -35.5 23.9 12.1 0.4 28 30 A S H < S+ 0 0 57 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.734 130.9 27.3 -84.8 -26.2 21.1 10.2 -1.4 29 31 A H >< - 0 0 53 -4,-2.1 3,-1.7 -5,-0.2 -1,-0.3 -0.729 64.6-175.7-138.6 90.3 19.1 13.3 -2.3 30 32 A P T 3 S+ 0 0 113 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.558 84.5 55.4 -62.1 -12.1 21.3 16.5 -2.6 31 33 A G T 3 S+ 0 0 59 2,-0.1 2,-0.2 -5,-0.0 -5,-0.1 0.497 80.3 109.0-101.0 -5.0 18.2 18.6 -3.2 32 34 A L < - 0 0 13 -3,-1.7 2,-0.6 -7,-0.2 -29,-0.2 -0.493 60.0-144.2 -75.0 137.9 16.3 17.7 -0.0 33 35 A V E -a 3 0A 67 -31,-3.0 -29,-3.1 -2,-0.2 2,-0.5 -0.930 18.3-161.2-103.3 117.8 16.1 20.4 2.7 34 36 A V E -a 4 0A 17 -2,-0.6 2,-0.4 -31,-0.2 -29,-0.2 -0.897 6.9-171.2-105.0 126.0 16.2 18.7 6.0 35 37 A E E -a 5 0A 88 -31,-2.7 -29,-3.2 -2,-0.5 2,-0.5 -0.901 16.2-137.8-115.2 143.2 14.9 20.5 9.1 36 38 A L E -a 6 0A 54 -2,-0.4 -29,-0.2 -31,-0.2 -31,-0.1 -0.874 15.7-175.9-100.8 132.9 15.4 19.3 12.7 37 39 A V E -a 7 0A 38 -31,-3.4 -29,-1.0 -2,-0.5 -32,-0.0 -0.664 15.6-173.9-123.7 70.7 12.3 19.7 15.0 38 40 A P E +a 8 0A 50 0, 0.0 2,-0.3 0, 0.0 -29,-0.2 -0.363 4.6 178.5 -66.7 153.2 13.7 18.5 18.4 39 41 A M 0 0 21 -31,-2.7 -29,-0.2 -2,-0.0 9,-0.1 -0.991 360.0 360.0-156.3 145.0 11.4 18.2 21.3 40 42 A V 0 0 137 -2,-0.3 7,-0.1 -31,-0.2 -31,-0.0 -0.252 360.0 360.0 -59.9 360.0 11.5 17.1 24.9 41 ! 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 42 60 A G >> 0 0 81 0, 0.0 4,-1.7 0, 0.0 3,-1.0 0.000 360.0 360.0 360.0 155.9 6.6 5.2 26.6 43 61 A L H 3> + 0 0 76 1,-0.2 4,-0.7 2,-0.2 0, 0.0 0.760 360.0 68.1 -73.1 -22.6 7.0 8.9 27.3 44 62 A F H 34 S+ 0 0 54 1,-0.2 -1,-0.2 2,-0.1 -35,-0.1 0.278 115.9 24.4 -80.8 12.1 10.3 9.0 25.2 45 63 A V H <> S+ 0 0 4 -3,-1.0 4,-1.9 17,-0.1 -2,-0.2 0.457 102.1 80.5-144.7 -25.6 8.4 8.3 22.0 46 64 A K H X S+ 0 0 94 -4,-1.7 4,-1.9 1,-0.2 5,-0.1 0.861 94.1 49.3 -59.4 -41.3 4.8 9.5 22.6 47 65 A E H X S+ 0 0 81 -4,-0.7 4,-2.2 1,-0.2 -1,-0.2 0.902 110.4 50.7 -66.5 -39.3 5.5 13.2 22.0 48 66 A L H > S+ 0 0 4 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.850 110.1 51.3 -66.8 -34.0 7.4 12.4 18.7 49 67 A E H X S+ 0 0 8 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.868 106.8 52.1 -71.8 -35.6 4.4 10.4 17.6 50 68 A V H X S+ 0 0 50 -4,-1.9 4,-2.2 2,-0.2 6,-0.2 0.925 107.3 54.0 -65.0 -40.1 2.0 13.2 18.4 51 69 A A H <>S+ 0 0 0 -4,-2.2 5,-2.9 1,-0.2 6,-1.0 0.901 110.1 47.8 -60.3 -38.6 4.2 15.4 16.3 52 70 A L H ><5S+ 0 0 0 -4,-1.6 3,-1.2 1,-0.2 -1,-0.2 0.912 110.9 49.4 -68.9 -43.4 3.8 12.9 13.4 53 71 A L H 3<5S+ 0 0 92 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.805 114.3 44.4 -67.6 -32.1 0.1 12.6 13.7 54 72 A E T 3<5S- 0 0 112 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.112 115.1-113.1-100.9 23.6 -0.5 16.4 13.7 55 73 A N T < 5S+ 0 0 84 -3,-1.2 -3,-0.2 2,-0.1 -4,-0.1 0.720 80.0 125.8 53.7 35.9 2.0 17.0 10.8 56 74 A R S > - C 0 183A 24 -2,-0.3 3,-2.8 120,-0.2 4,-0.7 -0.834 43.2-123.0 -92.3 122.5 17.1 4.0 18.9 64 82 A M G >4 S+ 0 0 0 118,-2.3 3,-1.8 -2,-0.6 116,-0.2 0.867 108.1 60.0 -34.5 -46.2 15.5 0.8 17.9 65 83 A K G 34 S+ 0 0 53 114,-0.4 -1,-0.3 117,-0.3 113,-0.1 0.594 103.8 51.9 -67.0 -6.9 15.4 -0.6 21.5 66 84 A D G <4 S+ 0 0 59 -3,-2.8 -1,-0.3 113,-0.1 -2,-0.2 0.529 83.9 106.3-102.6 -12.1 13.3 2.4 22.6 67 85 A V S << S- 0 0 10 -3,-1.8 -22,-0.0 -4,-0.7 10,-0.0 -0.549 73.2-125.2 -71.0 126.1 10.7 1.9 19.9 68 86 A P - 0 0 30 0, 0.0 155,-0.1 0, 0.0 -1,-0.1 -0.234 9.8-124.3 -67.9 163.8 7.5 0.5 21.4 69 87 A V S S+ 0 0 27 153,-0.4 2,-0.4 148,-0.1 154,-0.1 0.665 93.9 55.8 -83.9 -16.0 5.9 -2.7 20.0 70 88 A E - 0 0 157 151,-0.0 6,-0.1 6,-0.0 -1,-0.0 -0.926 67.9-164.0-120.6 142.7 2.6 -1.1 19.3 71 89 A F - 0 0 62 -2,-0.4 2,-0.1 4,-0.1 3,-0.1 -0.911 28.0-106.8-125.2 147.2 1.9 2.0 17.1 72 90 A P > - 0 0 41 0, 0.0 3,-2.3 0, 0.0 0, 0.0 -0.487 58.8 -82.8 -68.3 149.1 -1.1 4.3 16.8 73 91 A Q T 3 S+ 0 0 187 1,-0.3 3,-0.1 -2,-0.1 115,-0.0 -0.243 119.6 30.9 -54.6 132.7 -2.9 3.6 13.6 74 92 A G T 3 S+ 0 0 36 1,-0.3 115,-2.8 -3,-0.1 116,-0.4 0.076 106.4 87.9 105.1 -21.9 -1.3 5.5 10.7 75 93 A L E < +D 188 0A 7 -3,-2.3 -1,-0.3 113,-0.3 2,-0.3 -0.728 46.7 141.9-108.7 163.4 2.2 5.2 12.2 76 94 A G E -D 187 0A 7 111,-1.3 111,-2.0 -2,-0.3 2,-0.5 -0.977 51.2 -84.0 176.2 166.6 4.9 2.6 11.9 77 95 A L E +D 186 0A 42 -2,-0.3 109,-0.2 109,-0.2 3,-0.1 -0.793 44.1 160.8 -87.4 128.7 8.5 1.7 11.6 78 96 A V E + 0 0 38 107,-2.5 2,-0.4 -2,-0.5 108,-0.2 0.631 56.6 45.4-122.9 -21.5 9.6 1.8 8.0 79 97 A T E -D 185 0A 3 106,-1.5 106,-2.7 123,-0.1 2,-0.5 -0.977 50.6-174.0-133.4 136.0 13.4 2.1 8.0 80 98 A I E -D 184 0A 13 -2,-0.4 123,-3.0 104,-0.2 127,-0.2 -0.985 22.6-147.3-127.8 114.8 16.1 0.3 10.0 81 99 A C - 0 0 2 102,-3.0 102,-0.3 -2,-0.5 121,-0.1 -0.330 38.7 -62.0 -81.7 165.8 19.6 1.6 9.6 82 100 A E - 0 0 112 119,-0.4 -1,-0.2 100,-0.1 101,-0.1 -0.190 60.8-118.4 -49.0 123.5 22.9 -0.2 9.6 83 101 A R - 0 0 20 99,-0.1 99,-0.2 120,-0.1 2,-0.1 -0.383 25.1-156.8 -72.7 137.0 23.5 -1.8 13.0 84 102 A E - 0 0 75 97,-2.6 70,-0.1 1,-0.2 -1,-0.1 -0.238 56.2 -41.3 -93.8-167.8 26.4 -0.7 15.2 85 103 A D - 0 0 25 1,-0.2 69,-0.8 -2,-0.1 -1,-0.2 -0.428 56.4-163.9 -61.7 114.4 28.1 -2.7 17.9 86 104 A P + 0 0 14 0, 0.0 91,-0.2 0, 0.0 -1,-0.2 0.439 49.6 113.0 -83.0 0.3 25.0 -4.2 19.7 87 105 A R - 0 0 81 89,-0.1 66,-3.0 1,-0.1 67,-0.5 -0.310 67.8-118.4 -78.6 155.2 26.9 -5.2 22.8 88 106 A D E -EF 152 169B 0 81,-0.6 81,-2.4 86,-0.4 2,-0.4 -0.581 31.4-140.2 -83.4 154.7 26.7 -3.9 26.4 89 107 A A E -EF 151 168B 0 62,-4.0 62,-1.7 79,-0.2 2,-0.6 -0.897 5.8-134.0-123.6 146.5 29.8 -2.3 27.7 90 108 A F E -EF 150 167B 0 77,-3.0 76,-2.4 -2,-0.4 77,-1.4 -0.897 27.9-172.7 -98.2 118.9 31.5 -2.4 31.1 91 109 A V E +EF 149 165B 0 58,-2.2 58,-2.2 -2,-0.6 2,-0.3 -0.978 19.3 136.2-118.4 131.9 32.5 1.1 32.2 92 110 A S - 0 0 3 72,-0.5 56,-0.2 -2,-0.4 55,-0.1 -0.970 40.6-150.5-165.4 158.3 34.5 1.7 35.3 93 111 A N S S+ 0 0 72 54,-0.5 55,-0.1 -2,-0.3 -1,-0.1 0.719 97.3 36.2-106.0 -32.5 37.5 3.9 36.5 94 112 A N S S+ 0 0 114 53,-0.5 2,-0.3 1,-0.0 54,-0.1 0.775 114.6 50.1 -92.7 -31.3 39.0 1.7 39.2 95 113 A Y - 0 0 60 52,-0.4 -3,-0.1 1,-0.1 3,-0.1 -0.795 59.2-151.9-113.1 156.1 38.5 -1.8 37.8 96 114 A D S S+ 0 0 104 -2,-0.3 2,-0.3 1,-0.1 -6,-0.1 0.529 76.1 5.2-101.7 -10.2 39.3 -3.4 34.4 97 115 A S S S- 0 0 41 1,-0.1 4,-0.3 -6,-0.0 -1,-0.1 -0.970 73.1-101.3-161.3 173.1 36.6 -6.1 34.3 98 116 A L S > S+ 0 0 18 -2,-0.3 3,-1.6 1,-0.2 -1,-0.1 0.892 119.1 55.8 -70.0 -41.7 33.5 -7.5 36.1 99 117 A D T 3 S+ 0 0 144 1,-0.3 -1,-0.2 -3,-0.1 0, 0.0 0.838 102.3 59.3 -59.5 -30.6 35.5 -10.4 37.6 100 118 A A T 3 S+ 0 0 49 2,-0.0 -1,-0.3 0, 0.0 -2,-0.2 0.603 80.0 104.6 -73.6 -16.6 37.8 -7.8 39.1 101 119 A L < - 0 0 2 -3,-1.6 3,-0.1 -4,-0.3 4,-0.0 -0.562 70.0-135.7 -70.8 122.2 35.0 -6.2 41.0 102 120 A P > - 0 0 63 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 -0.246 36.8 -75.7 -72.8 166.1 35.2 -7.2 44.7 103 121 A A T 3 S+ 0 0 77 1,-0.2 22,-0.2 22,-0.1 21,-0.0 -0.341 118.8 31.9 -61.7 143.7 32.1 -8.3 46.7 104 122 A G T 3 S+ 0 0 41 20,-2.0 -1,-0.2 1,-0.3 21,-0.1 0.446 82.6 149.5 89.3 -1.4 29.8 -5.4 47.7 105 123 A S < - 0 0 4 -3,-1.4 21,-3.1 19,-0.1 2,-0.7 -0.388 45.4-127.7 -67.3 145.2 30.6 -3.3 44.6 106 124 A I E -g 126 0B 41 19,-0.2 41,-2.6 -2,-0.1 42,-1.4 -0.851 23.9-171.9-100.8 114.8 27.9 -1.1 43.3 107 125 A V E -gh 127 148B 0 19,-2.9 21,-3.2 -2,-0.7 2,-0.5 -0.913 16.0-139.8-104.8 134.0 27.1 -1.5 39.6 108 126 A G E +gh 128 149B 0 40,-2.4 42,-1.8 -2,-0.5 2,-0.3 -0.829 44.1 115.5-105.0 133.6 24.7 1.0 38.2 109 127 A T - 0 0 1 19,-2.7 22,-0.1 -2,-0.5 42,-0.1 -0.830 41.2-155.5 178.1 143.1 21.9 0.3 35.7 110 128 A S + 0 0 39 20,-0.5 2,-0.5 19,-0.3 19,-0.1 0.273 63.9 112.8-110.5 5.8 18.1 0.6 35.8 111 129 A S > - 0 0 22 1,-0.2 4,-2.2 19,-0.1 5,-0.1 -0.693 55.7-157.4 -81.5 121.6 17.7 -2.0 33.0 112 130 A L H > S+ 0 0 38 -2,-0.5 4,-2.8 112,-0.4 5,-0.3 0.820 93.8 58.5 -68.1 -29.3 16.1 -5.2 34.3 113 131 A R H > S+ 0 0 5 113,-0.4 4,-1.4 111,-0.3 -1,-0.2 0.952 110.6 40.3 -62.9 -50.3 17.6 -7.1 31.4 114 132 A R H > S+ 0 0 14 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.878 117.3 51.1 -67.1 -37.4 21.2 -6.1 32.4 115 133 A Q H X S+ 0 0 50 -4,-2.2 4,-3.3 2,-0.2 5,-0.3 0.943 105.9 50.1 -67.2 -52.7 20.4 -6.6 36.1 116 134 A C H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.907 115.3 45.7 -55.3 -40.1 18.9 -10.1 36.0 117 135 A Q H X S+ 0 0 1 -4,-1.4 4,-1.2 -5,-0.3 -1,-0.2 0.865 113.3 49.7 -70.6 -36.8 21.9 -11.3 34.0 118 136 A L H X S+ 0 0 1 -4,-1.7 4,-2.3 1,-0.2 3,-0.3 0.952 113.5 45.5 -65.0 -49.8 24.4 -9.5 36.3 119 137 A A H < S+ 0 0 12 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.765 103.9 64.0 -66.5 -28.0 22.8 -11.0 39.4 120 138 A E H < S+ 0 0 66 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.918 115.5 29.4 -62.4 -44.8 22.7 -14.5 37.9 121 139 A R H < S+ 0 0 80 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.793 133.9 29.4 -86.1 -31.2 26.5 -14.7 37.7 122 140 A R >< + 0 0 38 -4,-2.3 3,-1.9 -5,-0.2 -1,-0.2 -0.614 55.2 168.0-134.1 81.2 27.4 -12.5 40.6 123 141 A P T 3 S+ 0 0 110 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.592 77.0 70.7 -66.0 -12.1 24.8 -12.4 43.5 124 142 A D T 3 S+ 0 0 64 -3,-0.1 -20,-2.0 2,-0.1 2,-0.2 0.479 81.5 88.7 -82.7 -9.8 27.4 -10.6 45.6 125 143 A L S < S- 0 0 13 -3,-1.9 2,-0.7 -22,-0.2 -19,-0.2 -0.606 75.2-127.7 -90.3 155.4 27.2 -7.4 43.6 126 144 A I E -g 106 0B 72 -21,-3.1 -19,-2.9 -2,-0.2 2,-0.6 -0.903 18.4-157.9-105.7 109.6 24.8 -4.5 44.4 127 145 A I E -g 107 0B 28 -2,-0.7 2,-0.4 -21,-0.2 -19,-0.2 -0.812 15.9-172.7 -87.2 121.0 22.9 -3.5 41.3 128 146 A R E -g 108 0B 126 -21,-3.2 -19,-2.7 -2,-0.6 -2,-0.0 -0.925 27.9-103.6-118.5 141.6 21.7 0.1 41.8 129 147 A S - 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