==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE,HYDROLASE 14-FEB-11 3QPW . COMPND 2 MOLECULE: 6-PHOSPHOFRUCTO-2-KINASE/FRUCTOSE-2,6-BISPHOSPHAT . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.C.CAVALIER,S.G.KIM,D.NEAU,Y.H.LEE . 431 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22133.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 305 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 27 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 149 34.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.3 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 1 0 1 1 2 1 1 1 0 2 0 1 2 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 2 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 . 2 0 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 E 0 0 172 0, 0.0 13,-2.1 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 106.8 -26.4 99.6 8.0 2 4 A L E -A 13 0A 106 11,-0.3 2,-0.3 13,-0.0 9,-0.1 -0.930 360.0-159.1-118.9 145.9 -26.9 95.9 8.1 3 5 A T E -A 12 0A 76 9,-2.4 9,-2.4 -2,-0.4 2,-0.7 -0.950 21.2-121.1-119.4 147.3 -29.5 93.8 6.5 4 6 A Q E -A 11 0A 77 -2,-0.3 7,-0.3 7,-0.2 5,-0.1 -0.768 29.9-119.9 -85.9 118.8 -30.6 90.3 7.6 5 7 A S > - 0 0 38 5,-3.0 4,-0.9 -2,-0.7 -1,-0.0 -0.213 22.4-130.5 -51.5 143.2 -30.3 87.6 4.8 6 8 A R T 4 S+ 0 0 139 2,-0.1 342,-0.1 3,-0.1 -1,-0.1 0.875 95.9 33.4 -72.5 -40.8 -33.7 86.1 4.0 7 9 A V T 4 S+ 0 0 25 340,-0.1 341,-3.1 1,-0.1 -1,-0.1 0.976 132.1 25.1 -81.2 -61.6 -33.0 82.4 4.2 8 10 A Q T 4 S- 0 0 69 339,-0.2 -2,-0.1 2,-0.1 -1,-0.1 0.579 93.5-133.5 -84.6 -10.5 -30.3 82.0 6.9 9 11 A K < + 0 0 15 -4,-0.9 2,-0.5 1,-0.2 -3,-0.1 0.879 48.3 157.3 60.5 41.1 -31.2 85.3 8.8 10 12 A I - 0 0 71 -7,-0.0 -5,-3.0 1,-0.0 2,-0.4 -0.854 44.6-123.7 -99.5 129.3 -27.6 86.3 9.1 11 13 A W E +A 4 0A 157 -2,-0.5 -7,-0.2 -7,-0.3 -9,-0.0 -0.605 39.2 173.8 -70.4 123.1 -26.8 90.1 9.6 12 14 A V E -A 3 0A 58 -9,-2.4 -9,-2.4 -2,-0.4 2,-0.3 -0.940 40.5 -94.8-131.3 146.7 -24.5 91.3 6.7 13 15 A P E -A 2 0A 99 0, 0.0 -11,-0.3 0, 0.0 -9,-0.0 -0.575 52.4-102.0 -62.5 125.5 -23.2 94.8 5.8 14 16 A V - 0 0 39 -13,-2.1 2,-1.2 -2,-0.3 -12,-0.0 -0.255 34.1-143.9 -43.4 119.9 -25.6 96.3 3.1 15 17 A D - 0 0 109 -3,-0.1 2,-2.6 1,-0.1 -1,-0.1 -0.731 18.1-173.7 -97.1 79.8 -23.6 95.8 0.0 16 18 A H - 0 0 146 -2,-1.2 -2,-0.1 0, 0.0 -1,-0.1 -0.538 25.6-151.0 -71.2 71.9 -24.5 98.9 -1.9 17 19 A R - 0 0 135 -2,-2.6 -2,-0.0 1,-0.1 -3,-0.0 -0.130 9.2-115.6 -44.8 134.7 -22.5 97.6 -4.8 18 20 A P - 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.187 41.8 -89.2 -64.9 169.2 -20.9 100.1 -7.2 19 21 A S S S+ 0 0 123 1,-0.3 -2,-0.1 2,-0.1 0, 0.0 0.783 127.9 50.2 -61.2 -29.9 -22.2 100.3 -10.8 20 22 A L S S- 0 0 138 2,-0.0 -1,-0.3 0, 0.0 2,-0.0 -0.804 89.5-152.6-100.3 84.9 -19.5 97.6 -11.8 21 23 A P - 0 0 70 0, 0.0 2,-0.4 0, 0.0 -2,-0.1 -0.346 12.0-151.2 -56.9 130.5 -20.1 94.9 -9.1 22 24 A R 0 0 229 1,-0.2 -2,-0.0 -2,-0.0 -5,-0.0 -0.928 360.0 360.0-106.2 133.2 -16.9 93.0 -8.5 23 25 A S 0 0 165 -2,-0.4 -1,-0.2 0, 0.0 0, 0.0 0.576 360.0 360.0-105.1 360.0 -16.6 89.4 -7.3 24 ! 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 25 32 A N 0 0 203 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-128.2 -7.5 78.5 4.5 26 33 A S - 0 0 29 1,-0.1 112,-0.1 112,-0.1 111,-0.1 0.277 360.0-123.1 -32.8 128.7 -5.2 75.6 3.1 27 34 A P - 0 0 25 0, 0.0 112,-2.8 0, 0.0 2,-0.4 -0.286 29.3-131.6 -64.0 157.6 -6.9 72.4 1.9 28 35 A T E -bc 113 139B 2 84,-3.0 86,-2.6 110,-0.2 2,-0.6 -0.960 11.6-154.5-121.9 135.5 -5.7 69.2 3.5 29 36 A V E -bc 114 140B 0 110,-3.1 112,-2.2 -2,-0.4 2,-0.6 -0.933 13.9-155.0 -99.5 117.5 -4.6 65.9 2.2 30 37 A I E -bc 115 141B 0 84,-2.7 86,-3.3 -2,-0.6 2,-0.7 -0.832 10.6-154.0 -90.4 124.5 -5.1 63.1 4.7 31 38 A V E -bc 116 142B 0 110,-2.7 112,-2.2 -2,-0.6 2,-0.2 -0.866 2.5-148.8-106.9 108.4 -2.7 60.3 3.9 32 39 A M E - c 0 143B 0 84,-2.2 2,-0.3 -2,-0.7 86,-0.3 -0.526 17.7-171.0 -68.1 140.5 -3.7 56.8 5.0 33 40 A V E + c 0 144B 0 110,-2.4 112,-2.3 -2,-0.2 87,-0.2 -1.000 26.9 76.3-136.4 134.6 -0.8 54.5 6.0 34 41 A G - 0 0 0 85,-2.3 87,-0.1 -2,-0.3 112,-0.1 -0.634 69.4 -61.1 148.7 163.7 -0.7 50.8 6.7 35 42 A L S > S- 0 0 5 110,-0.3 3,-0.6 -2,-0.2 5,-0.3 -0.130 70.7 -78.1 -59.0 157.8 -0.7 47.1 5.7 36 43 A P T 3 S+ 0 0 11 0, 0.0 -1,-0.1 0, 0.0 150,-0.0 -0.312 115.9 25.9 -57.2 147.9 -3.8 45.8 3.9 37 44 A A T 3 S+ 0 0 6 -3,-0.1 119,-0.2 119,-0.1 120,-0.1 0.845 82.8 120.1 64.0 38.6 -6.8 44.9 6.2 38 45 A R S < S- 0 0 20 -3,-0.6 172,-0.1 -4,-0.1 -1,-0.1 0.206 91.5 -97.5-107.4 5.9 -5.8 47.5 8.9 39 46 A G S > S+ 0 0 23 3,-0.1 4,-3.0 -5,-0.1 5,-0.2 0.593 80.0 136.5 92.0 9.2 -9.1 49.5 8.6 40 47 A K H > S+ 0 0 17 -5,-0.3 4,-2.1 1,-0.2 5,-0.1 0.898 78.2 39.2 -58.9 -43.4 -7.7 52.2 6.3 41 48 A T H > S+ 0 0 18 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.835 114.2 53.5 -74.7 -40.3 -10.7 52.3 4.0 42 49 A Y H > S+ 0 0 53 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.946 114.3 43.6 -56.4 -51.3 -13.2 51.9 7.0 43 50 A I H X S+ 0 0 15 -4,-3.0 4,-2.7 1,-0.2 5,-0.3 0.898 111.4 53.9 -59.6 -46.0 -11.5 54.9 8.6 44 51 A S H X S+ 0 0 0 -4,-2.1 4,-1.6 -5,-0.2 -1,-0.2 0.919 114.7 40.2 -58.7 -46.5 -11.4 56.9 5.4 45 52 A K H X S+ 0 0 80 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.882 117.3 46.5 -72.0 -43.5 -15.1 56.5 4.8 46 53 A K H X S+ 0 0 20 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.948 114.1 48.2 -69.9 -45.2 -16.3 57.0 8.4 47 54 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 -5,-0.3 -1,-0.2 0.906 112.9 48.8 -55.0 -43.0 -14.2 60.0 8.9 48 55 A T H X S+ 0 0 13 -4,-1.6 4,-2.6 -5,-0.3 5,-0.2 0.864 108.9 53.3 -66.4 -39.6 -15.4 61.5 5.6 49 56 A R H X S+ 0 0 18 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.931 112.9 45.3 -56.8 -51.6 -19.0 60.7 6.6 50 57 A Y H X S+ 0 0 1 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.908 113.3 47.9 -56.4 -51.0 -18.3 62.7 9.8 51 58 A L H <>S+ 0 0 0 -4,-2.8 5,-3.4 1,-0.2 -2,-0.2 0.879 112.9 47.9 -67.1 -39.9 -16.6 65.6 8.2 52 59 A N H ><5S+ 0 0 59 -4,-2.6 3,-1.8 3,-0.2 -1,-0.2 0.913 109.1 53.8 -65.2 -41.5 -19.2 66.1 5.5 53 60 A W H 3<5S+ 0 0 15 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.926 108.6 49.0 -64.0 -41.1 -22.1 65.9 8.1 54 61 A I T 3<5S- 0 0 25 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.310 128.9 -98.6 -79.2 11.1 -20.4 68.7 10.2 55 62 A G T < 5S+ 0 0 55 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.648 82.5 128.9 86.4 14.8 -20.1 70.8 6.9 56 63 A V < - 0 0 25 -5,-3.4 -1,-0.2 -6,-0.2 2,-0.2 -0.880 61.9-126.3-101.1 108.3 -16.4 70.2 5.9 57 64 A P + 0 0 48 0, 0.0 56,-2.3 0, 0.0 55,-2.3 -0.304 43.8 170.0 -57.0 115.1 -16.4 69.1 2.1 58 65 A T E -d 113 0B 7 -10,-0.2 2,-0.4 54,-0.2 56,-0.2 -0.978 17.4-173.7-133.8 143.3 -14.5 65.8 2.2 59 66 A K E -d 114 0B 96 54,-1.9 56,-3.1 -2,-0.4 2,-0.3 -0.999 20.2-130.4-141.9 140.8 -13.9 63.1 -0.4 60 67 A V E -d 115 0B 36 -2,-0.4 2,-0.6 54,-0.2 56,-0.2 -0.707 11.2-164.7 -88.6 133.5 -12.2 59.6 -0.4 61 68 A F E -d 116 0B 5 54,-3.3 56,-2.4 -2,-0.3 2,-0.9 -0.928 11.0-169.3-116.0 93.8 -9.6 58.8 -3.1 62 69 A N E >> -d 117 0B 14 -2,-0.6 4,-1.4 1,-0.2 3,-1.1 -0.802 9.5-163.9 -92.8 102.0 -9.4 55.0 -2.8 63 70 A V H 3> S+ 0 0 14 54,-2.2 4,-2.4 -2,-0.9 5,-0.2 0.873 88.0 62.4 -53.4 -40.1 -6.3 54.0 -5.0 64 71 A G H 3> S+ 0 0 20 53,-0.5 4,-2.5 1,-0.2 -1,-0.3 0.833 102.2 51.2 -52.6 -37.8 -7.5 50.3 -5.0 65 72 A E H <> S+ 0 0 99 -3,-1.1 4,-1.7 2,-0.2 -1,-0.2 0.855 107.7 51.5 -71.2 -36.9 -10.7 51.5 -6.8 66 73 A Y H X S+ 0 0 60 -4,-1.4 4,-1.2 2,-0.2 -2,-0.2 0.885 112.6 47.6 -59.7 -39.5 -8.6 53.3 -9.4 67 74 A R H X S+ 0 0 11 -4,-2.4 4,-1.9 2,-0.2 5,-0.3 0.902 109.0 52.7 -69.7 -43.3 -6.6 50.0 -9.8 68 75 A R H X S+ 0 0 70 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.865 113.2 45.1 -56.6 -38.7 -9.9 47.9 -10.1 69 76 A E H < S+ 0 0 158 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.753 115.0 47.5 -77.3 -26.7 -11.0 50.2 -12.8 70 77 A A H < S+ 0 0 45 -4,-1.2 -2,-0.2 -3,-0.2 -1,-0.2 0.780 120.8 33.7 -84.5 -27.6 -7.6 50.2 -14.6 71 78 A V H < S- 0 0 45 -4,-1.9 2,-1.8 -5,-0.1 -3,-0.2 0.598 85.9-151.7-116.1 -19.9 -7.0 46.5 -14.6 72 79 A K < + 0 0 172 -4,-1.5 2,-0.4 -5,-0.3 -1,-0.1 -0.349 68.0 34.1 86.7 -59.9 -10.5 45.1 -15.0 73 80 A Q - 0 0 76 -2,-1.8 2,-0.4 -4,-0.0 93,-0.1 -0.975 66.3-144.6-135.9 132.3 -10.3 41.6 -13.2 74 81 A Y + 0 0 17 -2,-0.4 3,-0.1 91,-0.2 94,-0.1 -0.722 24.4 164.0 -83.1 129.1 -8.3 40.5 -10.2 75 82 A S - 0 0 110 -2,-0.4 2,-0.3 1,-0.3 -1,-0.2 0.762 56.7 -9.9-110.3 -44.5 -6.9 36.9 -10.2 76 83 A S > - 0 0 25 1,-0.1 3,-2.0 102,-0.0 -1,-0.3 -0.995 60.8 -99.5-155.8 165.0 -4.3 36.7 -7.5 77 84 A Y G > S+ 0 0 63 -2,-0.3 3,-1.6 1,-0.3 4,-0.3 0.619 102.4 89.0 -52.6 -15.4 -1.9 38.3 -5.0 78 85 A N G > S+ 0 0 57 1,-0.3 3,-1.2 2,-0.2 -1,-0.3 0.794 76.1 65.5 -55.1 -29.9 0.7 37.9 -7.7 79 86 A F G < S+ 0 0 37 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.864 101.8 49.1 -60.1 -33.5 -0.3 41.4 -8.9 80 87 A F G < S+ 0 0 14 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.2 0.393 78.8 126.5 -92.6 5.2 1.0 42.8 -5.5 81 88 A R X - 0 0 105 -3,-1.2 3,-1.6 -4,-0.3 7,-0.1 -0.367 63.1-134.3 -59.6 136.5 4.5 41.1 -5.6 82 89 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.702 105.9 58.9 -66.7 -15.6 7.2 43.6 -5.2 83 90 A D T 3 S+ 0 0 111 1,-0.1 2,-1.2 5,-0.0 -2,-0.1 0.369 78.2 106.7 -88.8 4.5 9.1 41.9 -8.1 84 91 A N <> - 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0 0 50 -20,-2.3 3,-1.2 -2,-0.4 -18,-0.4 -0.988 18.3-158.1-118.7 124.1 -30.3 65.9 26.4 311 318 A K G > S+ 0 0 140 -2,-0.4 3,-1.8 1,-0.2 -19,-0.2 0.844 96.2 68.0 -64.5 -32.6 -31.4 69.5 25.6 312 319 A A G 3 S+ 0 0 24 1,-0.3 -1,-0.2 -21,-0.1 -21,-0.1 0.700 94.1 58.7 -61.1 -17.3 -29.4 69.0 22.4 313 320 A L G < S+ 0 0 0 -3,-1.2 -1,-0.3 -23,-0.2 67,-0.2 0.445 78.5 120.7 -90.1 -3.0 -32.1 66.4 21.3 314 321 A N S < S- 0 0 23 -3,-1.8 3,-0.1 -4,-0.1 66,-0.1 -0.278 74.4 -90.9 -61.9 156.1 -35.0 68.9 21.5 315 322 A E - 0 0 38 1,-0.2 -1,-0.1 -56,-0.2 -56,-0.1 -0.118 57.1 -74.7 -66.1 155.1 -36.9 69.5 18.3 316 323 A I - 0 0 15 1,-0.1 2,-0.8 -3,-0.1 -1,-0.2 -0.193 51.2-116.3 -48.4 138.7 -35.9 72.3 15.9 317 324 A D - 0 0 68 37,-0.2 36,-3.3 1,-0.1 32,-0.3 -0.760 22.8-166.0 -85.1 110.5 -36.9 75.7 17.3 318 325 A A > - 0 0 2 -2,-0.8 3,-2.5 34,-0.2 34,-0.2 0.402 20.3-163.3 -78.1 3.9 -39.5 77.3 14.9 319 326 A G G > S+ 0 0 13 1,-0.3 3,-1.8 32,-0.3 -1,-0.2 -0.220 74.2 7.7 56.5-123.4 -39.0 80.7 16.6 320 327 A V G 3 S+ 0 0 56 30,-2.6 -1,-0.3 1,-0.3 31,-0.1 0.712 132.6 57.5 -61.5 -18.9 -41.9 83.0 15.7 321 328 A C G X S+ 0 0 0 -3,-2.5 3,-1.8 29,-0.2 -64,-0.3 0.442 75.3 129.9 -90.3 -0.2 -43.7 80.0 14.0 322 329 A E T < S+ 0 0 53 -3,-1.8 -64,-0.2 1,-0.2 3,-0.1 -0.326 78.1 8.4 -58.4 134.1 -43.7 77.9 17.2 323 330 A E T 3 S+ 0 0 92 -66,-3.0 -1,-0.2 1,-0.3 2,-0.2 0.367 100.0 123.5 81.0 -3.6 -47.2 76.5 18.0 324 331 A L < - 0 0 39 -3,-1.8 -67,-2.7 -67,-0.2 -1,-0.3 -0.541 62.8-119.6 -81.6 152.0 -48.7 77.6 14.7 325 332 A T B > -M 256 0E 28 -69,-0.3 4,-1.5 -2,-0.2 -69,-0.2 -0.523 29.9-109.7 -82.6 162.1 -50.4 75.2 12.2 326 333 A Y H > S+ 0 0 106 -71,-0.7 4,-2.3 1,-0.2 5,-0.1 0.809 121.7 56.1 -63.5 -25.9 -48.9 75.0 8.7 327 334 A E H > S+ 0 0 133 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.932 106.5 47.0 -68.9 -47.2 -52.0 76.8 7.5 328 335 A E H > S+ 0 0 65 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.776 111.4 53.7 -63.0 -27.6 -51.5 79.7 9.8 329 336 A I H X S+ 0 0 5 -4,-1.5 4,-2.8 2,-0.2 8,-0.3 0.969 108.6 47.0 -69.9 -56.2 -47.8 79.8 8.7 330 337 A R H < S+ 0 0 146 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.1 0.879 119.2 43.3 -46.0 -42.0 -48.8 80.0 5.0 331 338 A D H < S+ 0 0 106 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.924 122.9 32.3 -78.6 -46.4 -51.3 82.8 5.8 332 339 A T H < S+ 0 0 88 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.744 135.9 23.6 -81.4 -27.2 -49.2 84.9 8.3 333 340 A Y X + 0 0 73 -4,-2.8 4,-2.7 -5,-0.2 -1,-0.2 -0.407 65.3 154.3-138.5 53.3 -45.8 84.3 6.8 334 341 A P H > S+ 0 0 78 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.863 80.8 52.3 -53.6 -37.0 -46.3 83.4 3.1 335 342 A E H > S+ 0 0 115 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.905 110.7 45.5 -66.1 -45.1 -42.8 84.7 2.4 336 343 A E H > S+ 0 0 27 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.890 110.7 55.1 -64.2 -42.3 -41.2 82.6 5.2 337 344 A Y H X S+ 0 0 46 -4,-2.7 4,-2.2 -8,-0.3 -2,-0.2 0.930 111.5 43.6 -55.1 -46.7 -43.1 79.5 4.0 338 345 A A H X S+ 0 0 56 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.836 110.3 54.1 -73.4 -37.0 -41.8 79.9 0.5 339 346 A L H X S+ 0 0 13 -4,-2.1 4,-0.7 2,-0.2 -1,-0.2 0.921 111.0 48.1 -60.9 -43.4 -38.1 80.6 1.5 340 347 A R H >< S+ 0 0 29 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.926 107.4 54.3 -62.1 -50.0 -38.2 77.4 3.6 341 348 A E H 3< S+ 0 0 112 -4,-2.2 3,-0.3 1,-0.2 -1,-0.2 0.831 112.5 44.3 -56.0 -33.6 -39.6 75.3 0.8 342 349 A Q H 3< S+ 0 0 124 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.532 130.4 19.6 -90.6 -8.8 -36.9 76.3 -1.6 343 350 A D S - 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