==== 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 24-NOV-05 2C7I . COMPND 2 MOLECULE: PUTATIVE LIPOATE PROTEIN LIGASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA ACIDOPHILUM; . AUTHOR E.MCMANUS,R.N.PERHAM,B.F.LUISI . 963 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40834.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 697 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 77 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 151 15.7 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 . 8 0.8 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 . 83 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 268 27.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 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 5 4 1 4 0 0 0 0 0 5 3 1 3 0 1 3 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 0 2 7 3 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 . 1 4 7 1 4 0 1 3 3 1 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 4 0 0 0 0 0 4 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 1 A M 0 0 160 0, 0.0 211,-3.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 142.6 28.1 9.4 -1.2 2 2 A E E -a 212 0A 81 209,-0.2 2,-0.3 211,-0.0 211,-0.2 -0.763 360.0-172.1-100.7 136.5 25.7 6.5 -1.7 3 3 A G E -a 213 0A 1 209,-2.5 211,-2.5 -2,-0.4 2,-0.6 -0.771 25.4-112.9-118.1 170.8 22.4 6.0 0.1 4 4 A R E -ab 214 35A 25 30,-3.1 32,-2.6 -2,-0.3 2,-0.7 -0.909 20.3-159.5-104.5 120.8 19.8 3.3 0.3 5 5 A L E -ab 215 36A 15 209,-3.1 211,-2.4 -2,-0.6 2,-0.7 -0.907 12.1-165.7 -98.5 109.4 16.4 4.1 -1.1 6 6 A L E -ab 216 37A 2 30,-2.3 32,-2.3 -2,-0.7 2,-0.9 -0.863 16.8-170.0-102.8 116.5 13.9 1.6 0.5 7 7 A L + 0 0 52 -2,-0.7 2,-0.7 209,-0.5 30,-0.1 -0.351 38.3 149.8 -93.2 56.0 10.5 1.4 -1.2 8 8 A L + 0 0 18 -2,-0.9 2,-0.3 31,-0.1 -2,-0.1 -0.792 12.1 152.4-105.3 113.3 9.3 -0.7 1.8 9 9 A E - 0 0 44 -2,-0.7 280,-0.2 30,-0.1 3,-0.1 -0.998 30.9-177.0-142.9 142.7 5.6 -0.6 2.8 10 10 A T > + 0 0 24 -2,-0.3 3,-2.2 30,-0.2 7,-0.4 -0.722 17.9 170.4-129.6 75.4 3.0 -2.7 4.5 11 11 A P T 3 S+ 0 0 4 0, 0.0 31,-2.1 0, 0.0 3,-0.3 0.788 75.7 59.8 -61.5 -27.5 -0.0 -0.4 4.2 12 12 A G T 3 S+ 0 0 13 1,-0.2 246,-0.6 245,-0.2 2,-0.2 0.487 111.5 42.6 -77.9 -3.4 -2.3 -3.2 5.4 13 13 A N X> + 0 0 30 -3,-2.2 4,-1.9 244,-0.1 3,-0.6 -0.646 60.2 173.4-144.8 83.0 -0.3 -3.3 8.7 14 14 A T H 3> S+ 0 0 1 -3,-0.3 4,-2.2 1,-0.3 5,-0.2 0.879 81.6 58.9 -61.4 -37.3 0.6 0.1 10.1 15 15 A R H 3> S+ 0 0 32 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.856 108.5 45.1 -63.1 -34.1 2.0 -1.5 13.3 16 16 A M H <> S+ 0 0 18 -3,-0.6 4,-2.3 2,-0.2 -1,-0.2 0.827 108.3 57.2 -74.5 -36.1 4.5 -3.5 11.2 17 17 A S H X S+ 0 0 0 -4,-1.9 4,-1.3 -7,-0.4 -2,-0.2 0.889 109.2 46.1 -58.1 -43.2 5.3 -0.4 9.1 18 18 A L H X S+ 0 0 8 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.825 107.3 57.5 -69.6 -37.3 6.3 1.4 12.3 19 19 A A H X S+ 0 0 0 -4,-1.4 4,-3.0 -5,-0.2 -2,-0.2 0.913 103.4 55.3 -55.3 -47.9 8.3 -1.6 13.5 20 20 A Y H X S+ 0 0 10 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.894 107.3 48.1 -50.3 -47.0 10.3 -1.3 10.2 21 21 A D H X S+ 0 0 10 -4,-1.3 4,-2.3 2,-0.2 5,-0.2 0.942 114.4 45.5 -63.1 -50.3 11.3 2.3 11.0 22 22 A E H X S+ 0 0 6 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.896 113.8 50.6 -59.8 -39.8 12.3 1.5 14.5 23 23 A A H X S+ 0 0 0 -4,-3.0 4,-2.0 2,-0.2 -2,-0.2 0.922 112.3 45.4 -64.0 -46.9 14.2 -1.6 13.3 24 24 A I H X S+ 0 0 3 -4,-2.8 4,-0.7 1,-0.2 -1,-0.2 0.876 116.0 46.9 -64.4 -35.7 16.1 0.4 10.6 25 25 A Y H < S+ 0 0 1 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.874 115.4 45.5 -72.0 -36.8 16.9 3.2 13.0 26 26 A R H < S+ 0 0 104 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.746 112.1 47.3 -85.4 -27.0 18.0 0.9 15.8 27 27 A S H < S+ 0 0 35 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.606 86.7 116.0 -89.1 -10.1 20.2 -1.5 13.8 28 28 A F < - 0 0 5 -4,-0.7 2,-0.4 -5,-0.2 64,-0.1 -0.308 52.2-156.3 -56.2 133.8 21.9 1.5 12.1 29 29 A Q > - 0 0 140 64,-0.0 3,-3.0 127,-0.0 64,-0.1 -0.966 32.1 -94.8-115.2 134.8 25.6 1.8 12.9 30 30 A Y T 3 S+ 0 0 133 -2,-0.4 127,-0.1 1,-0.3 3,-0.1 -0.143 115.8 31.1 -43.5 127.4 27.5 5.1 12.6 31 31 A G T 3 S+ 0 0 62 1,-0.3 -1,-0.3 125,-0.2 -3,-0.0 0.136 88.1 128.3 104.0 -19.3 29.1 5.1 9.1 32 32 A D S < S- 0 0 68 -3,-3.0 -1,-0.3 1,-0.1 61,-0.3 -0.141 73.3 -83.0 -59.5 165.6 26.4 3.0 7.4 33 33 A K - 0 0 94 1,-0.1 -30,-0.2 59,-0.1 -1,-0.1 -0.473 52.4-103.1 -68.3 141.8 24.8 4.4 4.2 34 34 A P - 0 0 8 0, 0.0 -30,-3.1 0, 0.0 2,-0.5 -0.346 37.1-139.8 -64.6 148.9 22.0 6.9 4.8 35 35 A I E -bC 4 91A 1 56,-2.6 56,-2.0 -32,-0.2 2,-0.5 -0.958 19.0-173.7-121.9 125.9 18.5 5.5 4.4 36 36 A L E -bC 5 90A 0 -32,-2.6 -30,-2.3 -2,-0.5 2,-0.4 -0.979 15.5-170.5-112.3 113.5 15.5 7.2 2.7 37 37 A R E -bC 6 89A 0 52,-2.8 52,-2.0 -2,-0.5 2,-0.4 -0.901 6.7-163.5-108.0 135.5 12.3 5.0 3.1 38 38 A F E + C 0 88A 6 -32,-2.3 2,-0.3 -2,-0.4 50,-0.2 -0.945 25.4 142.4-113.6 136.4 9.0 5.7 1.3 39 39 A Y E - C 0 87A 2 48,-2.4 48,-3.1 -2,-0.4 2,-0.3 -0.985 33.0-142.2-159.8 160.6 5.7 4.1 2.4 40 40 A R - 0 0 58 -2,-0.3 2,-0.3 46,-0.2 -30,-0.2 -0.945 10.8-148.8-121.1 155.2 2.0 4.6 2.9 41 41 A H - 0 0 0 41,-0.5 44,-0.3 44,-0.4 3,-0.2 -0.899 16.5-129.0-108.5 152.9 -0.4 3.4 5.6 42 42 A D S S- 0 0 25 -31,-2.1 39,-0.2 -2,-0.3 26,-0.1 -0.418 72.7 -30.9 -84.6 174.9 -4.0 2.6 5.1 43 43 A R S S+ 0 0 85 -2,-0.2 25,-2.0 24,-0.1 2,-0.3 0.073 90.6 141.8 -38.4 112.3 -6.5 4.1 7.5 44 44 A S E -iJ 68 81B 2 37,-2.3 37,-2.9 23,-0.2 2,-0.5 -0.990 46.9-144.0-153.1 146.9 -4.6 4.5 10.7 45 45 A V E -iJ 69 80B 0 23,-3.4 25,-2.3 -2,-0.3 2,-0.5 -0.988 22.1-161.8-109.9 128.0 -4.2 7.0 13.6 46 46 A I E -iJ 70 79B 3 33,-2.6 33,-2.1 -2,-0.5 2,-0.3 -0.962 5.7-161.5-111.9 119.2 -0.6 7.0 14.8 47 47 A I E -i 71 0B 0 23,-2.5 25,-2.3 -2,-0.5 31,-0.1 -0.714 24.2-102.1 -96.8 154.2 -0.1 8.4 18.3 48 48 A G > - 0 0 0 -2,-0.3 3,-1.7 28,-0.3 27,-0.2 -0.288 35.9-103.9 -69.8 158.9 3.2 9.7 19.7 49 49 A Y T 3 S+ 0 0 5 25,-2.6 26,-0.2 1,-0.3 -1,-0.1 0.776 119.3 41.9 -47.6 -40.2 5.2 7.6 22.2 50 50 A F T 3 S+ 0 0 13 26,-0.3 -1,-0.3 24,-0.1 2,-0.2 0.320 93.1 117.1 -96.6 7.7 4.2 9.7 25.3 51 51 A Q < - 0 0 20 -3,-1.7 2,-0.7 25,-0.1 823,-0.3 -0.487 62.3-134.9 -87.6 147.0 0.5 10.0 24.4 52 52 A V 0 0 48 -2,-0.2 4,-0.9 1,-0.2 5,-0.2 -0.870 360.0 360.0 -89.6 117.9 -2.6 8.8 26.1 53 53 A A 0 0 11 -2,-0.7 4,-2.7 188,-0.2 3,-1.3 0.899 360.0 360.0 -55.3 360.0 -4.7 7.3 23.3 54 ! 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 55 55 A E 0 0 164 0, 0.0 -2,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -24.2 -7.2 11.7 25.3 56 56 A E + 0 0 59 -3,-1.3 122,-1.2 -4,-0.9 2,-0.4 0.737 360.0 30.4-104.0 -31.6 -6.0 12.1 21.7 57 57 A V B S-K 177 0C 11 -4,-2.7 2,-1.1 120,-0.2 -1,-0.2 -0.966 74.2-112.9-137.4 151.5 -8.4 10.1 19.6 58 58 A D > - 0 0 67 118,-2.0 4,-0.8 -2,-0.4 -5,-0.0 -0.714 34.9-176.7 -77.8 102.8 -12.0 9.1 19.4 59 59 A L H > S+ 0 0 67 -2,-1.1 4,-2.1 2,-0.2 -1,-0.2 0.817 76.9 56.2 -76.9 -31.9 -11.4 5.4 19.9 60 60 A D H > S+ 0 0 129 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.929 109.6 45.5 -63.3 -48.0 -15.1 4.4 19.5 61 61 A Y H > S+ 0 0 60 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.636 108.6 59.5 -70.2 -19.9 -15.3 6.1 16.1 62 62 A M H <>S+ 0 0 7 -4,-0.8 5,-2.9 2,-0.2 3,-0.3 0.956 106.6 44.6 -71.3 -55.3 -12.0 4.5 15.1 63 63 A K H ><5S+ 0 0 78 -4,-2.1 3,-3.5 1,-0.2 -2,-0.2 0.981 113.4 51.6 -44.8 -66.7 -13.3 0.9 15.6 64 64 A K H 3<5S+ 0 0 84 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.752 115.0 42.1 -45.8 -34.1 -16.6 1.8 13.8 65 65 A N T 3<5S- 0 0 58 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.243 114.0-113.3-100.8 14.1 -14.6 3.2 10.8 66 66 A G T < 5 + 0 0 61 -3,-3.5 2,-0.6 -4,-0.2 -3,-0.2 0.853 59.9 159.9 57.9 36.7 -12.0 0.4 10.7 67 67 A I < - 0 0 10 -5,-2.9 2,-0.3 -6,-0.1 -23,-0.2 -0.818 35.2-134.3 -94.8 122.0 -9.2 2.8 11.7 68 68 A M E -i 44 0B 59 -25,-2.0 -23,-3.4 -2,-0.6 2,-0.5 -0.558 10.2-145.5 -74.0 131.3 -6.1 1.2 13.1 69 69 A L E +i 45 0B 10 -2,-0.3 2,-0.3 -25,-0.2 -23,-0.2 -0.864 26.0 170.2 -90.2 130.2 -4.6 2.7 16.3 70 70 A A E -i 46 0B 0 -25,-2.3 -23,-2.5 -2,-0.5 2,-0.4 -0.999 25.5-144.9-136.6 142.0 -0.8 2.4 16.4 71 71 A R E -i 47 0B 3 -2,-0.3 2,-0.2 -25,-0.2 -23,-0.2 -0.908 21.1-153.8 -99.9 136.6 1.8 4.0 18.7 72 72 A R - 0 0 15 -25,-2.3 -53,-0.1 -2,-0.4 -57,-0.0 -0.549 23.1-115.4-102.2 173.3 5.1 5.0 17.2 73 73 A Y S S+ 0 0 46 -2,-0.2 -1,-0.1 -55,-0.2 2,-0.1 0.814 89.8 74.2 -77.0 -32.9 8.6 5.3 18.7 74 74 A T S S- 0 0 2 1,-0.1 -25,-2.6 -25,-0.1 -2,-0.2 -0.345 79.6-119.7 -79.9 165.2 9.0 9.1 18.2 75 75 A G + 0 0 8 76,-0.6 2,-0.2 -27,-0.2 -1,-0.1 -0.019 62.0 90.4 -82.2-164.4 7.3 11.8 20.2 76 76 A G S S- 0 0 30 74,-0.1 -28,-0.3 -28,-0.1 -26,-0.3 -0.482 74.6 -53.9 100.6-174.0 5.0 14.4 18.9 77 77 A G - 0 0 39 -2,-0.2 2,-0.2 1,-0.1 -28,-0.1 -0.152 60.0 -71.6-100.4-171.2 1.3 14.3 18.5 78 78 A A - 0 0 21 -31,-0.1 2,-0.3 -30,-0.1 -31,-0.2 -0.472 44.7-177.6 -85.9 144.6 -1.4 12.2 16.9 79 79 A V E -J 46 0B 40 -33,-2.1 -33,-2.6 -2,-0.2 2,-0.4 -0.999 22.5-133.1-143.9 144.8 -2.0 12.0 13.1 80 80 A Y E -J 45 0B 4 -2,-0.3 2,-0.3 -35,-0.2 -35,-0.2 -0.837 25.5-171.7 -98.0 134.6 -4.4 10.3 10.7 81 81 A H E +J 44 0B 8 -37,-2.9 -37,-2.3 -2,-0.4 2,-0.3 -0.944 12.6 160.6-118.7 147.9 -2.9 8.4 7.7 82 82 A D > - 0 0 21 -2,-0.3 3,-2.2 -39,-0.2 -41,-0.5 -0.838 61.6 -76.7-148.2-172.9 -4.6 6.9 4.7 83 83 A L T 3 S+ 0 0 29 1,-0.3 -41,-0.1 -2,-0.3 85,-0.1 0.617 125.2 66.7 -71.0 -10.0 -3.4 5.9 1.3 84 84 A G T 3 S+ 0 0 3 83,-0.1 83,-2.7 82,-0.1 82,-2.3 0.410 87.3 82.0 -83.1 -3.2 -3.4 9.5 0.2 85 85 A D E < S- D 0 165A 1 -3,-2.2 2,-0.6 -44,-0.3 -44,-0.4 -0.928 70.6-149.3-100.6 129.8 -0.6 10.4 2.7 86 86 A L E - D 0 164A 7 78,-2.4 78,-3.0 -2,-0.5 2,-0.3 -0.892 13.6-161.5 -97.1 118.3 3.0 9.7 1.6 87 87 A N E +CD 39 163A 2 -48,-3.1 -48,-2.4 -2,-0.6 2,-0.3 -0.731 12.5 173.9 -92.0 148.7 5.3 8.8 4.5 88 88 A F E -CD 38 162A 0 74,-2.1 74,-3.0 -2,-0.3 2,-0.3 -0.978 8.7-166.1-150.2 146.2 9.1 8.9 4.3 89 89 A S E -CD 37 161A 3 -52,-2.0 -52,-2.8 -2,-0.3 2,-0.4 -0.965 5.6-156.1-132.9 149.9 11.8 8.4 6.9 90 90 A V E -CD 36 160A 3 70,-3.2 70,-2.3 -2,-0.3 2,-0.5 -0.996 7.1-175.7-128.5 126.8 15.5 9.2 6.9 91 91 A V E +CD 35 159A 1 -56,-2.0 -56,-2.6 -2,-0.4 2,-0.3 -0.995 20.2 157.7-119.5 125.9 18.1 7.5 9.1 92 92 A R E - D 0 158A 53 66,-1.8 66,-2.4 -2,-0.5 -59,-0.1 -0.947 46.9 -82.7-139.2 161.8 21.6 8.8 9.0 93 93 A S E - D 0 157A 35 -61,-0.3 2,-0.4 -2,-0.3 64,-0.3 -0.328 46.1-152.3 -58.2 145.1 24.8 8.9 11.0 94 94 A S E - D 0 156A 6 62,-1.5 62,-0.5 60,-0.1 -64,-0.1 -0.986 25.6-177.9-132.7 134.6 24.8 11.6 13.7 95 95 A D S S+ 0 0 128 -2,-0.4 2,-0.2 60,-0.1 -1,-0.1 0.417 75.1 23.0-105.7 -2.4 27.8 13.5 15.3 96 96 A D S S- 0 0 73 58,-0.1 58,-0.1 2,-0.1 60,-0.1 -0.839 72.8-114.8-151.2 179.9 25.7 15.6 17.6 97 97 A M + 0 0 72 -2,-0.2 2,-1.6 56,-0.1 3,-0.2 -0.099 63.1 135.6-114.7 30.8 22.3 15.8 19.5 98 98 A D > + 0 0 70 1,-0.2 4,-1.2 2,-0.1 3,-0.2 -0.615 19.5 166.3 -86.4 86.3 21.2 18.9 17.6 99 99 A I H > S+ 0 0 64 -2,-1.6 4,-2.4 1,-0.2 5,-0.2 0.843 71.2 63.1 -73.1 -31.8 17.6 17.9 16.8 100 100 A T H > S+ 0 0 83 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.893 105.2 45.8 -56.3 -42.6 16.8 21.5 15.8 101 101 A S H > S+ 0 0 28 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.771 107.6 58.0 -76.4 -28.1 19.2 21.3 12.8 102 102 A M H X S+ 0 0 6 -4,-1.2 4,-2.6 2,-0.2 5,-0.3 0.963 110.0 43.1 -62.7 -52.3 18.0 17.9 11.8 103 103 A F H X S+ 0 0 20 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.935 115.1 50.0 -58.7 -44.0 14.5 19.2 11.4 104 104 A R H X S+ 0 0 139 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 0.923 112.7 46.7 -61.3 -42.7 15.8 22.3 9.7 105 105 A T H X S+ 0 0 42 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.925 114.7 45.4 -67.1 -41.3 17.9 20.3 7.3 106 106 A M H X S+ 0 0 2 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.899 111.5 53.6 -69.5 -37.1 15.2 17.8 6.4 107 107 A N H X S+ 0 0 1 -4,-2.7 4,-3.0 -5,-0.3 -1,-0.2 0.880 105.3 53.8 -64.2 -39.9 12.7 20.6 6.0 108 108 A E H X S+ 0 0 108 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.927 108.4 49.9 -57.4 -46.2 15.1 22.3 3.5 109 109 A A H X S+ 0 0 0 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.889 112.3 47.6 -63.5 -40.3 15.2 19.1 1.5 110 110 A V H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.951 110.9 50.3 -62.0 -47.9 11.4 18.9 1.5 111 111 A V H X S+ 0 0 19 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.905 112.3 47.9 -57.9 -41.9 11.0 22.6 0.5 112 112 A N H X S+ 0 0 57 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.873 110.8 51.7 -67.1 -40.2 13.4 22.0 -2.4 113 113 A S H X S+ 0 0 0 -4,-2.0 4,-0.8 -5,-0.2 3,-0.4 0.913 109.5 48.5 -61.7 -44.8 11.5 18.9 -3.4 114 114 A L H >X>S+ 0 0 1 -4,-2.8 5,-2.4 1,-0.2 3,-0.7 0.857 102.5 62.1 -67.3 -37.0 8.2 20.7 -3.5 115 115 A R H ><5S+ 0 0 173 -4,-1.9 3,-1.3 1,-0.2 -1,-0.2 0.871 97.0 60.1 -51.8 -37.2 9.6 23.5 -5.5 116 116 A I H 3<5S+ 0 0 60 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.876 106.3 47.0 -61.2 -35.2 10.3 20.9 -8.2 117 117 A L H <<5S- 0 0 34 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.486 122.9-106.7 -82.7 -6.4 6.5 20.2 -8.3 118 118 A G T <<5S+ 0 0 61 -3,-1.3 2,-0.5 -4,-0.5 -3,-0.2 0.686 78.6 131.7 85.3 18.8 5.8 24.0 -8.4 119 119 A L < - 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