==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 27-JUN-12 4FSA . COMPND 2 MOLECULE: QUEUINE TRNA-RIBOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ZYMOMONAS MOBILIS SUBSP. MOBILIS; . AUTHOR F.IMMEKUS,G.KLEBE . 347 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13836.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 233 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 5.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 . 14 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 127 36.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.9 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 4 1 0 2 0 2 1 0 1 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 3 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 PARALLEL 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 0 0 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 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 11 A R 0 0 168 0, 0.0 22,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 157.7 8.6 -10.2 25.9 2 12 A P - 0 0 53 0, 0.0 3,-0.2 0, 0.0 163,-0.0 -0.368 360.0-106.9 -73.3 165.4 10.1 -8.3 28.9 3 13 A R S S- 0 0 69 1,-0.3 20,-0.5 19,-0.2 2,-0.3 0.911 101.6 -10.8 -55.3 -45.1 9.4 -4.6 29.6 4 14 A F + 0 0 27 18,-0.2 2,-0.3 19,-0.1 -1,-0.3 -0.875 65.7 162.3-163.9 125.4 12.9 -3.9 28.4 5 15 A S E -A 21 0A 51 16,-1.6 16,-3.0 -2,-0.3 2,-0.5 -0.938 13.1-167.7-143.6 123.3 16.0 -5.9 27.6 6 16 A F E +A 20 0A 29 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.936 11.3 179.4-109.7 126.9 19.0 -4.7 25.6 7 17 A S E -A 19 0A 53 12,-2.6 12,-2.1 -2,-0.5 2,-0.6 -0.988 19.9-144.1-128.5 135.5 21.5 -7.4 24.5 8 18 A I E +A 18 0A 51 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.851 17.4 177.7 -97.1 123.5 24.6 -6.8 22.5 9 19 A A E + 0 0 86 8,-2.5 2,-0.3 -2,-0.6 9,-0.2 0.702 64.4 8.8 -98.8 -22.8 25.4 -9.6 20.0 10 20 A A E -A 17 0A 23 7,-1.7 7,-2.5 2,-0.0 2,-0.3 -0.987 59.1-164.6-158.6 152.6 28.5 -8.3 18.3 11 21 A R E -A 16 0A 118 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.962 11.2-176.7-138.3 153.9 31.1 -5.5 18.5 12 22 A E E > S-A 15 0A 46 3,-2.3 3,-2.1 -2,-0.3 2,-0.2 -0.825 72.2 -49.4-151.7 107.9 33.7 -3.9 16.5 13 23 A G T 3 S- 0 0 74 -2,-0.3 -1,-0.1 1,-0.3 231,-0.1 -0.475 124.2 -20.8 60.4-128.6 35.7 -1.2 18.2 14 24 A K T 3 S+ 0 0 88 229,-0.5 -1,-0.3 -2,-0.2 2,-0.2 0.571 118.0 102.8 -84.4 -11.6 33.1 1.2 19.8 15 25 A A E < -A 12 0A 1 -3,-2.1 -3,-2.3 228,-0.2 2,-0.3 -0.474 50.7-173.1 -80.0 144.8 30.4 -0.1 17.4 16 26 A R E -A 11 0A 3 230,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.969 12.6-165.4-133.8 149.6 27.7 -2.5 18.7 17 27 A T E +A 10 0A 7 -7,-2.5 -8,-2.5 -2,-0.3 -7,-1.7 -0.995 35.4 104.6-134.7 143.7 24.9 -4.5 17.2 18 28 A G E -AB 8 29A 6 11,-2.0 11,-2.8 -2,-0.4 2,-0.3 -0.875 54.6 -77.0-179.7-152.4 22.1 -6.2 19.1 19 29 A T E -AB 7 28A 40 -12,-2.1 -12,-2.6 -2,-0.3 2,-0.5 -0.996 12.2-149.6-144.1 142.9 18.4 -6.0 20.0 20 30 A I E -AB 6 27A 0 7,-2.8 7,-2.8 -2,-0.3 2,-0.5 -0.966 22.2-156.2-106.1 124.0 16.1 -4.2 22.4 21 31 A E E +AB 5 26A 69 -16,-3.0 -16,-1.6 -2,-0.5 2,-0.3 -0.910 20.8 164.4-101.0 131.5 13.2 -6.4 23.4 22 32 A M E > - B 0 25A 1 3,-1.9 3,-1.3 -2,-0.5 -19,-0.2 -0.858 51.6 -97.3-134.8 169.7 10.0 -4.7 24.6 23 33 A K T 3 S+ 0 0 86 -20,-0.5 3,-0.1 142,-0.3 -20,-0.1 0.911 122.7 46.4 -58.3 -40.5 6.4 -5.8 25.1 24 34 A R T 3 S- 0 0 98 1,-0.2 -1,-0.3 -21,-0.2 2,-0.3 0.486 126.2 -59.7 -83.9 -1.6 5.3 -4.4 21.7 25 35 A G E < -B 22 0A 1 -3,-1.3 -3,-1.9 61,-0.2 2,-0.4 -0.853 57.4 -63.7 150.3 178.4 8.2 -5.9 19.8 26 36 A V E -B 21 0A 47 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.814 33.8-153.7-101.8 138.8 11.9 -6.2 19.1 27 37 A I E -B 20 0A 0 -7,-2.8 -7,-2.8 -2,-0.4 2,-0.3 -0.976 10.4-142.9-113.5 118.5 14.1 -3.4 18.0 28 38 A R E -B 19 0A 80 -2,-0.5 -9,-0.2 -9,-0.2 26,-0.1 -0.642 32.5-110.4 -80.6 131.6 17.3 -4.2 16.0 29 39 A T E S+B 18 0A 0 -11,-2.8 -11,-2.0 -2,-0.3 2,-0.2 -0.910 99.2 48.2-118.1 147.1 20.2 -1.9 16.8 30 40 A P S S- 0 0 0 0, 0.0 2,-0.4 0, 0.0 218,-0.2 0.481 93.1-174.8 -59.7 136.3 21.8 0.3 15.4 31 41 A A E -c 248 0B 4 216,-2.1 218,-1.8 -2,-0.2 2,-0.5 -0.919 27.5-152.2-115.2 140.7 18.2 1.5 14.7 32 42 A F E -c 249 0B 3 -2,-0.4 22,-0.3 216,-0.2 23,-0.3 -0.984 14.5-155.3-110.1 125.6 16.8 4.4 12.8 33 43 A M E -c 250 0B 0 216,-3.0 218,-0.8 -2,-0.5 23,-0.2 -0.891 11.4-138.5-102.5 106.9 13.5 5.7 14.0 34 44 A P - 0 0 1 0, 0.0 23,-2.8 0, 0.0 2,-0.4 -0.392 26.1-120.2 -60.0 146.0 11.3 7.5 11.4 35 45 A V B d 57 0B 22 216,-0.5 6,-0.5 21,-0.2 23,-0.2 -0.750 360.0 360.0 -95.4 130.0 9.7 10.6 12.8 36 46 A G 0 0 31 21,-2.7 4,-0.3 -2,-0.4 23,-0.1 -0.809 360.0 360.0 -97.0 360.0 5.9 11.0 13.0 37 ! 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 38 49 A A 0 0 49 0, 0.0 2,-0.3 0, 0.0 20,-0.1 0.000 360.0 360.0 360.0 52.6 0.6 11.2 14.7 39 50 A T - 0 0 71 5,-0.0 2,-0.7 6,-0.0 5,-0.1 -0.944 360.0-123.1-158.9 142.0 1.7 10.2 11.3 40 51 A V > - 0 0 4 3,-0.5 3,-2.3 -4,-0.3 -4,-0.2 -0.850 64.4 -98.2 -82.7 114.5 5.0 9.5 9.5 41 52 A K T 3 S- 0 0 118 -2,-0.7 -1,-0.1 -6,-0.5 3,-0.1 -0.075 96.0 -3.8 -58.7 129.5 4.3 12.1 6.8 42 53 A A T 3 S+ 0 0 42 1,-0.1 2,-0.4 275,-0.1 -1,-0.3 0.507 112.3 101.2 71.7 13.6 2.8 10.7 3.6 43 54 A L < - 0 0 15 -3,-2.3 -3,-0.5 274,-0.1 -1,-0.1 -0.983 66.1-134.0-129.9 135.5 3.1 7.0 4.7 44 55 A K >> - 0 0 139 -2,-0.4 4,-2.1 1,-0.1 3,-0.9 -0.511 35.7-114.9 -68.2 147.1 0.6 4.5 6.0 45 56 A P H 3> S+ 0 0 33 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.833 117.0 59.1 -56.3 -32.7 2.1 2.6 9.0 46 57 A E H 3> S+ 0 0 134 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.850 106.1 48.9 -64.7 -31.2 2.1 -0.6 7.1 47 58 A T H <> S+ 0 0 31 -3,-0.9 4,-1.6 2,-0.2 -1,-0.2 0.914 108.6 52.9 -71.3 -43.3 4.4 1.1 4.5 48 59 A V H <>S+ 0 0 2 -4,-2.1 5,-1.4 1,-0.2 4,-0.4 0.943 111.9 46.1 -57.7 -45.6 6.6 2.3 7.3 49 60 A R H ><5S+ 0 0 83 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.903 106.2 59.1 -64.5 -39.0 6.9 -1.2 8.6 50 61 A A H 3<5S+ 0 0 80 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.784 97.9 59.7 -63.4 -27.7 7.6 -2.6 5.1 51 62 A T T 3<5S- 0 0 19 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.656 127.1 -99.7 -70.4 -16.4 10.6 -0.4 4.8 52 63 A G T < 5 + 0 0 17 -3,-1.7 -3,-0.2 -4,-0.4 -2,-0.1 0.300 67.3 154.0 114.9 0.3 12.0 -2.2 7.9 53 64 A A < - 0 0 0 -5,-1.4 -1,-0.3 1,-0.1 3,-0.1 -0.304 21.6-175.6 -61.9 135.6 11.3 0.2 10.7 54 65 A D S S+ 0 0 8 -22,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.598 72.0 13.5-100.0 -18.6 11.0 -1.5 14.1 55 66 A I - 0 0 1 -23,-0.3 -1,-0.3 31,-0.1 2,-0.3 -0.991 64.9-155.6-157.2 148.3 10.0 1.7 16.1 56 67 A I E - e 0 88B 2 31,-1.4 33,-2.4 -2,-0.3 2,-0.4 -0.869 19.0-119.7-124.2 164.6 8.9 5.2 15.3 57 68 A L E -de 35 89B 9 -23,-2.8 -21,-2.7 -2,-0.3 2,-0.3 -0.853 22.8-173.5-106.4 141.1 9.1 8.5 17.1 58 69 A G E - e 0 90B 7 31,-2.6 33,-1.9 -2,-0.4 2,-0.4 -0.800 22.9-120.1-116.5 168.0 6.1 10.6 18.2 59 70 A N E > - e 0 91B 30 -2,-0.3 4,-1.3 31,-0.2 5,-0.2 -0.921 9.1-157.9-116.4 134.7 6.3 14.1 19.8 60 71 A T H > S+ 0 0 1 31,-0.9 4,-1.7 -2,-0.4 -1,-0.2 0.918 95.4 52.4 -69.6 -38.7 5.0 15.3 23.2 61 72 A Y H > S+ 0 0 158 2,-0.2 4,-1.3 1,-0.2 5,-0.2 0.955 113.7 36.9 -62.0 -57.0 4.9 18.9 22.0 62 73 A H H > S+ 0 0 54 1,-0.2 4,-3.2 2,-0.2 3,-0.5 0.955 119.3 48.2 -65.0 -45.6 2.9 18.6 18.8 63 74 A L H <>S+ 0 0 6 -4,-1.3 5,-2.4 1,-0.3 -1,-0.2 0.851 106.7 55.8 -68.1 -31.2 0.5 15.9 20.1 64 75 A M H <5S+ 0 0 59 -4,-1.7 5,-0.4 -5,-0.2 -1,-0.3 0.867 113.7 42.4 -70.1 -27.9 -0.2 17.7 23.3 65 76 A L H <5S+ 0 0 77 -4,-1.3 -2,-0.2 -3,-0.5 -1,-0.2 0.883 118.4 47.0 -78.9 -49.8 -1.3 20.7 21.2 66 77 A R T <5S- 0 0 70 -4,-3.2 -1,-0.3 -5,-0.2 -2,-0.1 -0.924 131.6 -6.4-151.0 123.0 -3.2 18.8 18.6 67 78 A P T 5S- 0 0 39 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 -0.983 105.0-116.5 -89.5 3.4 -5.2 16.6 19.0 68 79 A G >< - 0 0 13 -5,-2.4 4,-2.1 -6,-0.2 -4,-0.2 0.113 11.0-111.9 107.6 137.2 -4.4 16.6 22.8 69 80 A A H > S+ 0 0 0 -5,-0.4 4,-2.6 1,-0.2 5,-0.2 0.923 116.4 49.2 -69.4 -42.6 -2.9 14.0 25.0 70 81 A E H > S+ 0 0 94 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.904 110.0 51.6 -64.1 -38.7 -6.1 13.4 27.0 71 82 A R H > S+ 0 0 158 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.931 109.9 49.6 -63.8 -45.2 -8.1 13.0 23.8 72 83 A I H <>S+ 0 0 0 -4,-2.1 5,-2.8 1,-0.2 4,-0.4 0.948 110.9 49.3 -62.1 -41.9 -5.7 10.5 22.4 73 84 A A H ><5S+ 0 0 38 -4,-2.6 3,-1.5 1,-0.2 -1,-0.2 0.927 108.5 53.2 -63.5 -38.4 -5.9 8.5 25.7 74 85 A K H 3<5S+ 0 0 88 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.860 108.1 52.6 -60.1 -32.9 -9.7 8.6 25.5 75 86 A L T 3<5S- 0 0 92 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.484 133.6 -87.8 -86.1 -0.9 -9.4 7.2 22.0 76 87 A G T < 5S- 0 0 54 -3,-1.5 4,-0.4 -4,-0.4 -3,-0.2 0.456 72.4 -73.6 114.4 2.5 -7.3 4.3 23.1 77 88 A G >< - 0 0 11 -5,-2.8 4,-2.4 -6,-0.2 41,-0.2 -0.109 59.3 -66.6 94.7 169.3 -3.8 5.7 22.9 78 89 A L H > S+ 0 0 1 39,-2.6 4,-2.6 1,-0.2 5,-0.3 0.829 125.0 56.8 -64.8 -36.6 -1.4 6.6 20.1 79 90 A H H >>S+ 0 0 11 38,-0.4 4,-1.6 1,-0.2 5,-1.5 0.948 114.4 38.1 -61.1 -50.3 -0.8 3.1 18.8 80 91 A S H 45S+ 0 0 85 -4,-0.4 -2,-0.2 2,-0.2 -1,-0.2 0.901 114.9 55.8 -67.6 -39.6 -4.5 2.5 18.2 81 92 A F H <5S+ 0 0 92 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.938 120.1 27.7 -55.9 -53.5 -5.1 6.0 17.0 82 93 A M H <5S- 0 0 31 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.607 107.9-115.2 -95.7 -8.5 -2.5 5.9 14.2 83 94 A G T <5S+ 0 0 52 -4,-1.6 2,-0.5 -5,-0.3 -3,-0.2 0.828 70.5 129.5 82.2 29.3 -2.5 2.2 13.5 84 95 A W < - 0 0 9 -5,-1.5 -1,-0.2 -6,-0.3 -2,-0.2 -0.977 29.9-179.9-118.0 116.8 1.1 1.4 14.6 85 96 A D + 0 0 114 -2,-0.5 3,-0.1 -3,-0.1 -1,-0.1 0.399 55.2 82.1-100.6 3.0 1.3 -1.5 16.9 86 97 A R S S- 0 0 69 1,-0.2 -61,-0.2 -7,-0.1 -31,-0.1 -0.257 95.5 -52.6 -96.5-176.9 5.0 -1.7 17.5 87 98 A P - 0 0 0 0, 0.0 -31,-1.4 0, 0.0 2,-0.4 -0.248 49.0-162.0 -59.5 147.2 7.1 0.4 19.9 88 99 A I E -e 56 0B 1 -33,-0.2 32,-2.2 30,-0.2 33,-2.0 -0.998 5.1-155.3-126.3 131.2 6.9 4.2 19.9 89 100 A L E -ef 57 121B 0 -33,-2.4 -31,-2.6 -2,-0.4 2,-0.5 -0.916 12.8-158.0-100.0 132.4 9.5 6.5 21.4 90 101 A T E -ef 58 122B 0 31,-2.5 33,-1.0 -2,-0.4 -31,-0.2 -0.943 10.8-135.7-113.4 132.4 8.2 9.9 22.4 91 102 A D E -e 59 0B 32 -33,-1.9 -31,-0.9 -2,-0.5 34,-0.1 -0.431 24.2-121.2 -75.9 164.4 10.4 13.0 22.8 92 103 A S 0 0 0 32,-0.3 -1,-0.1 -33,-0.1 21,-0.1 0.538 360.0 360.0 -88.3 -9.2 9.7 15.0 26.0 93 104 A G 0 0 22 2,-0.0 -1,-0.1 32,-0.0 32,-0.1 0.122 360.0 360.0 85.3 360.0 8.8 18.3 24.4 94 ! 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 95 106 A Y 0 0 235 0, 0.0 -34,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 360.0 13.2 20.7 22.2 96 ! 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 97 117 A Q 0 0 114 0, 0.0 2,-0.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 139.6 11.5 29.3 31.6 98 118 A S - 0 0 59 3,-2.4 3,-0.4 1,-0.0 0, 0.0 -0.859 360.0-101.4-133.9 172.8 11.6 28.5 35.3 99 119 A E S S+ 0 0 66 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.746 122.5 62.3 -63.0 -23.0 13.0 25.7 37.5 100 120 A E S S- 0 0 56 1,-0.3 2,-0.3 6,-0.1 -1,-0.2 0.880 120.8 -89.4 -71.1 -37.9 9.4 24.4 37.5 101 121 A G - 0 0 3 -3,-0.4 -3,-2.4 5,-0.2 2,-0.4 -0.976 55.4 -50.3 156.9-151.4 9.3 23.8 33.7 102 122 A V 0 0 44 3,-4.3 -3,-0.0 -2,-0.3 0, 0.0 -0.974 360.0 360.0-124.6 132.7 8.4 25.9 30.6 103 123 A T 0 0 150 -2,-0.4 -2,-0.0 0, 0.0 0, 0.0 -0.783 360.0 360.0-115.2 360.0 5.2 27.9 29.8 104 ! 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 0.0 105 135 A L 0 0 48 0, 0.0 -3,-4.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 118.2 5.4 21.9 30.4 106 136 A S > - 0 0 29 -5,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.791 360.0 -95.9-122.4 169.5 7.3 20.5 33.4 107 137 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.927 124.5 50.1 -51.9 -46.2 9.0 17.2 33.9 108 138 A E H > S+ 0 0 76 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.932 113.2 43.8 -62.7 -43.5 5.9 15.8 35.6 109 139 A R H > S+ 0 0 68 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.902 111.7 55.1 -66.5 -43.0 3.4 16.9 32.9 110 140 A S H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.937 110.3 44.9 -55.9 -50.8 5.8 15.7 30.2 111 141 A I H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.879 113.4 51.9 -63.6 -36.9 5.9 12.2 31.7 112 142 A E H X S+ 0 0 67 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.932 108.4 49.6 -65.1 -44.1 2.2 12.3 32.1 113 143 A I H X S+ 0 0 0 -4,-3.1 4,-2.6 2,-0.2 -1,-0.2 0.907 109.7 51.4 -59.5 -43.2 1.6 13.2 28.5 114 144 A Q H X>S+ 0 0 0 -4,-2.2 5,-2.5 1,-0.2 4,-0.9 0.898 110.6 50.1 -65.2 -34.4 3.8 10.4 27.4 115 145 A H H ><5S+ 0 0 65 -4,-2.1 3,-0.7 2,-0.2 -2,-0.2 0.931 109.0 50.6 -61.9 -48.0 1.8 8.1 29.5 116 146 A L H 3<5S+ 0 0 33 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.865 110.6 49.1 -61.1 -38.2 -1.5 9.3 28.1 117 147 A L H 3<5S- 0 0 0 -4,-2.6 -39,-2.6 -5,-0.2 -38,-0.4 0.750 113.4-124.8 -69.9 -23.0 -0.1 8.8 24.6 118 148 A G T <<5 - 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0 0 110 -5,-2.7 4,-1.2 -6,-0.2 3,-1.0 -0.513 42.9-133.7 -81.1 139.6 1.5 16.0 -6.7 310 340 A I H 3> S+ 0 0 127 1,-0.2 4,-2.5 -2,-0.2 3,-0.2 0.890 105.1 62.6 -57.7 -36.6 0.9 14.2 -3.4 311 341 A L H 3> S+ 0 0 51 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.842 97.0 60.0 -61.8 -28.2 2.1 10.9 -4.9 312 342 A G H <> S+ 0 0 0 -3,-1.0 4,-2.6 -8,-0.2 5,-0.3 0.945 106.9 45.1 -60.2 -48.1 5.5 12.5 -5.5 313 343 A A H X S+ 0 0 20 -4,-1.2 4,-2.3 -3,-0.2 5,-0.2 0.939 113.0 52.1 -61.2 -44.8 5.8 13.1 -1.7 314 344 A M H X S+ 0 0 74 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.934 113.7 41.2 -56.5 -49.8 4.6 9.6 -1.0 315 345 A L H X S+ 0 0 6 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.897 114.5 50.1 -71.4 -41.6 7.1 7.9 -3.3 316 346 A M H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.927 113.6 47.3 -60.4 -41.9 10.1 10.1 -2.4 317 347 A T H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.3 5,-0.3 0.931 110.3 50.7 -69.8 -43.3 9.4 9.5 1.3 318 348 A E H X S+ 0 0 38 -4,-2.4 4,-2.3 -5,-0.2 5,-0.2 0.943 113.0 47.2 -59.6 -46.0 9.0 5.7 1.0 319 349 A H H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.940 112.6 48.2 -59.1 -49.4 12.2 5.5 -0.9 320 350 A N H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.918 112.8 46.3 -65.6 -39.8 14.2 7.7 1.6 321 351 A I H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.910 113.8 50.0 -67.9 -35.2 13.0 5.9 4.7 322 352 A A H X S+ 0 0 5 -4,-2.3 4,-2.7 -5,-0.3 -2,-0.2 0.905 108.2 53.3 -64.1 -41.3 13.7 2.5 3.0 323 353 A F H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.945 109.3 48.6 -55.5 -51.2 17.2 3.8 2.1 324 354 A Y H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.918 111.2 49.5 -59.0 -40.9 17.8 4.7 5.7 325 355 A Q H X S+ 0 0 8 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.902 110.4 50.8 -67.6 -36.9 16.6 1.2 6.9 326 356 A Q H X S+ 0 0 45 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.885 109.0 52.6 -65.1 -37.4 18.8 -0.5 4.3 327 357 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.944 109.4 48.2 -60.8 -48.1 21.7 1.6 5.6 328 358 A M H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.866 110.5 52.1 -64.7 -36.1 21.0 0.5 9.1 329 359 A Q H X S+ 0 0 59 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.899 108.8 49.4 -66.6 -38.3 20.8 -3.1 8.0 330 360 A K H X S+ 0 0 79 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.870 112.0 49.7 -68.0 -34.8 24.2 -2.9 6.2 331 361 A I H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.2 5,-0.2 0.957 112.2 47.2 -63.3 -51.0 25.6 -1.4 9.4 332 362 A R H X S+ 0 0 12 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.925 115.3 45.2 -57.5 -48.0 24.2 -4.2 11.6 333 363 A D H X S+ 0 0 65 -4,-2.7 4,-1.5 2,-0.2 -1,-0.2 0.896 111.8 51.2 -66.3 -38.0 25.4 -6.9 9.2 334 364 A S H <>S+ 0 0 0 -4,-2.3 5,-3.0 1,-0.2 6,-0.6 0.882 111.7 47.5 -71.2 -36.7 28.9 -5.4 8.8 335 365 A I H ><5S+ 0 0 2 -4,-2.5 3,-1.4 4,-0.2 -1,-0.2 0.931 110.2 52.5 -64.6 -44.6 29.3 -5.2 12.6 336 366 A S H 3<5S+ 0 0 70 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.779 114.4 44.0 -61.6 -26.5 28.1 -8.7 13.1 337 367 A E T 3<5S- 0 0 124 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.314 113.1-116.3-100.3 4.6 30.7 -9.8 10.5 338 368 A G T < 5S+ 0 0 48 -3,-1.4 -3,-0.2 -4,-0.3 4,-0.1 0.816 89.8 102.1 68.7 26.8 33.5 -7.7 11.9 339 369 A R >< + 0 0 105 -5,-3.0 4,-2.4 -6,-0.2 -4,-0.2 0.050 34.8 114.7-130.8 27.5 33.8 -5.6 8.7 340 370 A F H > S+ 0 0 5 -6,-0.6 4,-2.9 2,-0.2 5,-0.2 0.898 75.1 55.0 -69.2 -38.2 32.1 -2.4 9.7 341 371 A S H > S+ 0 0 70 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.964 111.0 46.7 -60.6 -39.8 35.2 -0.3 9.5 342 372 A Q H > S+ 0 0 111 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.931 112.5 50.4 -61.0 -47.0 35.7 -1.5 5.9 343 373 A F H X S+ 0 0 26 -4,-2.4 4,-3.2 2,-0.2 5,-0.2 0.919 108.9 51.7 -55.7 -44.0 32.0 -0.8 5.2 344 374 A A H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.938 112.4 45.4 -63.7 -45.3 32.3 2.8 6.7 345 375 A Q H X S+ 0 0 49 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.914 115.7 45.6 -61.4 -46.1 35.3 3.5 4.5 346 376 A D H X S+ 0 0 87 -4,-2.8 4,-2.3 2,-0.2 5,-0.2 0.910 112.2 52.6 -65.6 -44.2 33.7 2.0 1.3 347 377 A F H X S+ 0 0 9 -4,-3.2 4,-3.3 -5,-0.3 5,-0.3 0.938 111.9 44.7 -52.7 -53.4 30.4 3.8 2.1 348 378 A R H X S+ 0 0 75 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.904 109.5 55.4 -64.4 -39.3 32.1 7.2 2.4 349 379 A A H < S+ 0 0 78 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.929 118.1 34.6 -60.3 -44.8 34.2 6.7 -0.7 350 380 A R H < S+ 0 0 50 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.927 116.2 53.0 -76.0 -43.5 31.2 6.1 -2.9 351 381 A Y H < 0 0 14 -4,-3.3 -2,-0.2 -5,-0.2 -3,-0.2 0.854 360.0 360.0 -62.0 -35.9 28.7 8.4 -1.1 352 382 A F < 0 0 142 -4,-2.4 0, 0.0 -5,-0.3 0, 0.0 -0.316 360.0 360.0 -95.4 360.0 31.1 11.3 -1.5