==== 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 HYDROLASE 12-APR-06 2GO4 . COMPND 2 MOLECULE: UDP-3-O-[3-HYDROXYMYRISTOYL] N-ACETYLGLUCOSAMINE . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR H.A.GENNADIOS,D.A.WHITTINGTON,X.LI,C.A.FIERKE,D.W.CHRISTIANS . 532 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22022.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 375 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 110 20.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 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 1.5 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 . 52 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 17.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 2 2 2 0 0 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 2 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 PARALLEL BRIDGES PER LADDER . 2 2 2 4 4 4 2 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 . 4 4 0 4 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 2 A G 0 0 40 0, 0.0 119,-4.4 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 144.3 -1.5 87.1 -4.6 2 3 A L E -A 119 0A 72 117,-0.3 117,-0.2 1,-0.1 115,-0.1 -0.617 360.0 -99.8 -92.5 153.8 0.1 83.7 -5.5 3 4 A E E - 0 0 19 115,-2.8 113,-2.8 -2,-0.2 2,-0.3 -0.386 49.0-159.6 -65.9 152.5 -2.0 80.6 -6.2 4 5 A K E +A 115 0A 22 78,-0.4 81,-2.1 111,-0.2 80,-1.5 -0.931 22.5 171.0-138.2 162.9 -2.1 78.3 -3.2 5 6 A T E -A 114 0A 3 109,-1.7 109,-1.9 -2,-0.3 2,-0.3 -0.744 42.6 -75.5-147.2-168.2 -2.7 74.8 -2.1 6 7 A V E -A 113 0A 1 79,-0.3 107,-0.2 -2,-0.2 3,-0.1 -0.780 23.9-134.0-104.9 149.0 -2.3 72.7 1.0 7 8 A K S S- 0 0 152 105,-2.8 2,-0.3 -2,-0.3 -1,-0.1 0.859 90.2 -2.6 -63.9 -36.1 0.9 71.4 2.5 8 9 A E S S- 0 0 116 104,-0.3 -1,-0.2 -3,-0.0 2,-0.1 -0.964 93.7 -72.2-151.9 164.0 -0.7 68.1 3.0 9 10 A K - 0 0 132 -2,-0.3 2,-0.4 -3,-0.1 19,-0.2 -0.376 48.5-152.4 -62.7 133.8 -4.0 66.3 2.7 10 11 A L E -B 27 0B 16 17,-1.5 17,-2.6 -2,-0.1 2,-0.4 -0.877 3.0-149.4-112.4 143.5 -6.6 67.4 5.2 11 12 A S E +B 26 0B 62 -2,-0.4 2,-0.4 15,-0.2 15,-0.2 -0.930 17.8 170.1-119.4 137.2 -9.5 65.4 6.6 12 13 A F E +B 25 0B 9 13,-1.9 13,-3.8 -2,-0.4 2,-0.3 -0.997 9.1 172.6-140.0 134.0 -12.9 66.5 7.9 13 14 A E E +B 24 0B 103 -2,-0.4 2,-0.3 11,-0.3 11,-0.2 -0.961 17.8 105.6-141.3 160.7 -15.7 64.2 8.7 14 15 A G E -B 23 0B 19 9,-2.4 9,-3.1 -2,-0.3 2,-0.1 -0.902 66.1 -46.6 154.9-179.7 -19.2 64.5 10.2 15 16 A V E -B 22 0B 51 -2,-0.3 82,-2.1 7,-0.3 83,-0.7 -0.470 50.4-121.1 -80.4 148.7 -22.8 64.4 9.3 16 17 A G > - 0 0 0 5,-2.7 4,-1.7 80,-0.3 -1,-0.1 -0.745 19.2-131.5 -87.2 137.5 -24.2 66.5 6.4 17 18 A I T 4 S+ 0 0 12 78,-0.4 179,-2.2 -2,-0.4 180,-0.5 0.801 101.3 31.6 -61.5 -29.3 -26.9 68.9 7.6 18 19 A H T 4 S+ 0 0 14 176,-0.2 177,-1.8 177,-0.2 -1,-0.2 0.873 121.5 43.0 -97.1 -41.5 -29.4 67.9 4.9 19 20 A T T 4 S- 0 0 21 176,-0.2 -2,-0.2 2,-0.2 3,-0.1 0.737 86.6-142.4 -77.7 -22.8 -28.8 64.2 4.2 20 21 A G < + 0 0 33 -4,-1.7 2,-0.2 1,-0.3 -3,-0.1 0.414 62.7 125.9 74.5 -6.0 -28.4 63.3 7.8 21 22 A E - 0 0 90 -6,-0.1 -5,-2.7 1,-0.1 2,-0.3 -0.501 67.5-111.9 -86.0 154.7 -25.7 60.9 6.5 22 23 A Y E +B 15 0B 130 -7,-0.3 2,-0.3 -2,-0.2 -7,-0.3 -0.667 43.9 174.5 -85.1 138.1 -22.2 60.8 7.8 23 24 A S E -B 14 0B 1 -9,-3.1 -9,-2.4 -2,-0.3 2,-0.4 -0.908 20.6-143.1-141.8 168.6 -19.6 62.0 5.3 24 25 A K E -BC 13 91B 67 67,-1.8 67,-3.0 -2,-0.3 2,-0.4 -0.998 4.0-155.7-140.4 141.0 -15.9 62.7 4.9 25 26 A L E -BC 12 90B 0 -13,-3.8 -13,-1.9 -2,-0.4 2,-0.4 -0.905 4.1-170.9-114.0 140.5 -13.8 65.2 3.0 26 27 A I E -BC 11 89B 11 63,-1.7 63,-2.7 -2,-0.4 2,-0.8 -0.932 11.7-154.8-132.8 107.4 -10.2 64.8 1.9 27 28 A I E -BC 10 88B 0 -17,-2.6 -17,-1.5 -2,-0.4 61,-0.2 -0.761 16.2-163.8 -86.4 113.4 -8.5 68.0 0.6 28 29 A H E - C 0 87B 40 59,-3.1 59,-2.1 -2,-0.8 -19,-0.0 -0.816 20.3-113.7-102.7 136.5 -5.8 66.9 -1.7 29 30 A P E - C 0 86B 51 0, 0.0 2,-0.3 0, 0.0 57,-0.2 -0.344 36.4-175.1 -65.3 143.9 -2.9 69.2 -2.9 30 31 A E - 0 0 51 55,-1.1 55,-0.1 -26,-0.1 3,-0.1 -0.914 22.3-103.9-136.4 163.2 -2.9 70.1 -6.6 31 32 A K > - 0 0 141 -2,-0.3 3,-1.7 1,-0.2 4,-0.3 -0.266 53.3 -62.6 -85.3 173.4 -0.5 72.0 -8.9 32 33 A E T 3 S+ 0 0 37 1,-0.3 -1,-0.2 2,-0.1 -27,-0.0 -0.109 120.5 17.7 -51.7 148.0 -0.7 75.5 -10.4 33 34 A G T 3 S+ 0 0 44 1,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.477 91.4 111.9 66.1 2.3 -3.6 76.1 -12.7 34 35 A T < - 0 0 33 -3,-1.7 51,-0.1 1,-0.1 -2,-0.1 0.914 61.0-162.4 -71.1 -42.3 -5.5 73.0 -11.5 35 36 A G - 0 0 23 -4,-0.3 51,-1.7 49,-0.2 2,-0.5 -0.375 32.7 -50.9 88.1-171.4 -8.3 75.1 -9.9 36 37 A I E +d 86 0B 20 202,-0.2 11,-2.3 49,-0.2 2,-0.3 -0.913 65.4 160.3-106.2 125.9 -10.7 73.9 -7.3 37 38 A R E -dE 87 46B 58 49,-2.2 51,-3.0 -2,-0.5 2,-0.2 -0.999 31.0-133.3-146.9 147.4 -12.6 70.7 -8.0 38 39 A F E -dE 88 45B 0 7,-3.8 7,-2.9 -2,-0.3 2,-0.4 -0.634 16.1-151.0 -94.7 157.2 -14.5 68.1 -6.1 39 40 A F E +dE 89 44B 44 49,-3.3 51,-3.5 5,-0.2 2,-0.3 -0.985 23.0 158.7-133.6 124.1 -14.1 64.3 -6.5 40 41 A K E > - E 0 43B 12 3,-2.4 3,-3.0 -2,-0.4 51,-0.1 -0.987 67.4 -17.3-147.4 133.7 -16.8 61.7 -5.9 41 42 A N T 3 S- 0 0 121 49,-0.4 -1,-0.1 -2,-0.3 3,-0.1 0.869 128.5 -46.3 36.2 59.7 -17.2 58.2 -7.2 42 43 A G T 3 S+ 0 0 57 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.280 115.8 110.7 74.8 -12.0 -14.7 58.7 -10.0 43 44 A V E < -E 40 0B 28 -3,-3.0 -3,-2.4 20,-0.1 2,-0.6 -0.769 57.6-143.7-103.6 145.0 -16.0 62.0 -11.2 44 45 A Y E -E 39 0B 105 -2,-0.3 -5,-0.2 -5,-0.2 22,-0.1 -0.903 14.3-166.2-102.1 122.7 -14.4 65.4 -10.9 45 46 A I E -E 38 0B 0 -7,-2.9 -7,-3.8 -2,-0.6 2,-0.1 -0.931 16.0-137.0-113.9 111.7 -16.8 68.2 -10.3 46 47 A P E -E 37 0B 34 0, 0.0 2,-2.9 0, 0.0 -9,-0.3 -0.401 19.9-120.2 -65.7 137.0 -15.4 71.8 -10.9 47 48 A A S S+ 0 0 4 -11,-2.3 191,-0.4 -2,-0.1 2,-0.3 -0.412 76.0 121.0 -76.5 66.8 -16.3 74.3 -8.3 48 49 A R S > S- 0 0 90 -2,-2.9 3,-1.8 189,-0.1 189,-0.2 -0.933 76.8-113.8-131.3 155.3 -17.9 76.4 -11.0 49 50 A H G > S+ 0 0 22 187,-1.9 3,-2.0 -2,-0.3 188,-0.1 0.773 107.7 72.7 -59.4 -30.2 -21.5 77.7 -11.6 50 51 A E G 3 S+ 0 0 101 1,-0.3 -1,-0.3 186,-0.2 -3,-0.1 0.747 99.8 49.0 -58.4 -20.4 -22.0 75.5 -14.7 51 52 A F G < S+ 0 0 33 -3,-1.8 11,-2.9 -5,-0.2 -1,-0.3 0.322 78.1 120.1-103.8 7.9 -22.2 72.6 -12.3 52 53 A V E < +F 61 0C 20 -3,-2.0 9,-0.3 9,-0.2 3,-0.1 -0.539 27.5 167.6 -71.6 135.7 -24.7 74.0 -9.8 53 54 A V E + 0 0 59 7,-3.0 2,-0.3 1,-0.4 8,-0.2 0.493 62.2 27.0-126.9 -10.0 -27.8 71.7 -9.6 54 55 A H E +F 60 0C 51 6,-1.1 6,-2.5 1,-0.1 -1,-0.4 -0.978 43.5 171.3-155.0 139.9 -29.7 73.0 -6.5 55 56 A T + 0 0 28 -2,-0.3 198,-0.8 4,-0.2 2,-0.7 0.175 46.5 112.0-136.6 17.1 -29.8 76.3 -4.7 56 57 A N S S- 0 0 82 1,-0.2 195,-0.0 196,-0.1 3,-0.0 -0.848 101.6 -18.6 -97.1 114.7 -32.6 75.8 -2.2 57 58 A H S S+ 0 0 63 -2,-0.7 2,-0.3 136,-0.0 -1,-0.2 0.463 140.5 16.2 71.7 0.1 -31.3 75.7 1.4 58 59 A S S S- 0 0 0 2,-0.0 2,-0.6 14,-0.0 195,-0.0 -0.928 82.6-101.9 176.2 166.2 -27.8 75.0 0.1 59 60 A T - 0 0 0 -2,-0.3 12,-2.3 -4,-0.1 13,-0.5 -0.952 38.6-171.4-111.0 122.0 -25.7 75.1 -3.0 60 61 A D E -F 54 0C 2 -6,-2.5 -7,-3.0 -2,-0.6 -6,-1.1 -0.914 8.2-157.3-116.6 142.2 -25.2 71.8 -4.7 61 62 A L E +FG 52 68C 0 7,-2.3 7,-3.0 -2,-0.4 2,-0.3 -0.869 17.1 171.3-115.4 148.5 -22.9 70.8 -7.5 62 63 A G E + G 0 67C 6 -11,-2.9 2,-0.3 -2,-0.3 5,-0.2 -0.987 12.1 171.8-153.6 162.5 -23.2 67.9 -9.8 63 69 A F E > - G 0 66C 85 3,-2.2 3,-1.8 -2,-0.3 -20,-0.1 -0.846 68.2 -0.9-173.9 135.2 -21.9 66.3 -13.0 64 70 A K T 3 S- 0 0 157 1,-0.3 3,-0.1 -2,-0.3 -21,-0.0 0.879 131.9 -45.8 48.6 47.7 -22.4 63.0 -14.8 65 71 A G T 3 S+ 0 0 73 1,-0.2 2,-0.5 -22,-0.0 -1,-0.3 0.490 114.7 113.1 79.1 2.6 -24.8 61.6 -12.2 66 72 A Q E < -G 63 0C 41 -3,-1.8 -3,-2.2 -22,-0.1 2,-0.3 -0.932 43.5-173.3-112.4 127.0 -22.7 62.6 -9.2 67 73 A R E -G 62 0C 127 -2,-0.5 2,-0.4 -5,-0.2 -5,-0.2 -0.894 11.1-166.9-119.7 148.0 -24.1 65.3 -6.8 68 74 A I E -G 61 0C 0 -7,-3.0 -7,-2.3 -2,-0.3 3,-0.3 -0.970 16.1-147.8-134.5 117.8 -22.5 67.0 -3.8 69 75 A K B +h 94 0D 35 24,-3.5 26,-2.4 -2,-0.4 -9,-0.2 -0.633 67.1 11.5 -90.8 146.0 -24.7 69.0 -1.5 70 76 A T + 0 0 5 -2,-0.3 4,-0.3 -11,-0.2 3,-0.2 0.956 60.6 156.3 59.2 65.0 -23.7 72.1 0.5 71 77 A V > + 0 0 0 -12,-2.3 4,-2.5 -3,-0.3 5,-0.2 0.576 51.0 90.5 -91.7 -9.5 -20.3 73.1 -1.0 72 78 A E H > S+ 0 0 5 -13,-0.5 4,-2.4 1,-0.2 5,-0.2 0.818 81.2 49.6 -58.3 -41.3 -20.7 76.7 0.0 73 79 A H H > S+ 0 0 6 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.922 116.2 40.7 -70.5 -40.8 -19.1 76.7 3.5 74 80 A I H > S+ 0 0 0 -4,-0.3 4,-2.9 2,-0.2 5,-0.2 0.930 116.9 51.3 -70.1 -42.4 -15.9 74.9 2.3 75 81 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.894 109.1 50.6 -60.2 -39.9 -15.9 77.0 -0.8 76 82 A S H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.948 111.8 46.5 -63.5 -49.9 -16.2 80.2 1.2 77 83 A V H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.919 113.9 49.0 -59.3 -43.4 -13.4 79.3 3.5 78 84 A L H X>S+ 0 0 0 -4,-2.9 5,-1.9 1,-0.2 4,-0.6 0.934 110.9 50.0 -62.4 -44.8 -11.3 78.3 0.5 79 85 A H H ><5S+ 0 0 7 -4,-2.9 3,-0.7 1,-0.2 -1,-0.2 0.890 109.7 51.6 -60.6 -39.6 -12.1 81.6 -1.2 80 86 A L H 3<5S+ 0 0 18 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.814 113.6 42.6 -69.2 -29.8 -11.2 83.5 1.9 81 87 A L H 3<5S- 0 0 16 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.391 109.0-122.9 -96.2 2.8 -7.8 81.9 2.2 82 88 A E T <<5 + 0 0 37 -3,-0.7 2,-0.6 -4,-0.6 -78,-0.4 0.801 48.4 165.5 60.3 32.4 -7.1 82.1 -1.5 83 89 A I < + 0 0 0 -5,-1.9 -1,-0.2 -6,-0.2 -78,-0.2 -0.719 4.5 171.2 -77.7 120.6 -6.6 78.4 -1.9 84 90 A T + 0 0 9 -80,-1.5 2,-0.4 -2,-0.6 -79,-0.2 0.607 56.0 48.4-109.3 -14.8 -6.8 78.0 -5.7 85 91 A N + 0 0 1 -81,-2.1 -55,-1.1 -51,-0.1 -79,-0.3 -0.885 69.2 113.6-136.7 105.7 -5.7 74.5 -6.4 86 92 A V E -Cd 29 36B 0 -51,-1.7 -49,-2.2 -2,-0.4 2,-0.5 -0.972 49.0-132.6-162.9 153.6 -7.1 71.4 -4.6 87 93 A T E -Cd 28 37B 3 -59,-2.1 -59,-3.1 -2,-0.3 2,-0.8 -0.953 19.0-150.8-111.1 127.4 -9.2 68.4 -5.2 88 94 A I E -Cd 27 38B 0 -51,-3.0 -49,-3.3 -2,-0.5 2,-0.6 -0.861 8.7-155.4-104.1 102.0 -11.9 67.8 -2.6 89 95 A E E -Cd 26 39B 66 -63,-2.7 -63,-1.7 -2,-0.8 2,-0.6 -0.658 12.0-159.1 -77.1 119.0 -12.6 64.1 -2.3 90 96 A V E -C 25 0B 7 -51,-3.5 2,-0.9 -2,-0.6 -49,-0.4 -0.897 16.2-170.4-109.1 121.8 -16.1 63.6 -1.0 91 97 A I E S+C 24 0B 98 -67,-3.0 -67,-1.8 -2,-0.6 2,-0.3 -0.862 72.3 18.5-105.9 93.9 -17.2 60.4 0.6 92 98 A G S S- 0 0 19 -2,-0.9 -69,-0.1 -69,-0.2 -2,-0.1 -0.930 97.5 -81.6 141.3-161.7 -20.9 60.9 0.8 93 99 A N S S+ 0 0 57 -2,-0.3 -24,-3.5 1,-0.2 2,-0.3 0.420 104.2 40.7-119.1 -2.9 -23.4 63.2 -0.9 94 100 A E B S-h 69 0D 1 -26,-0.3 -24,-0.2 -3,-0.1 -1,-0.2 -0.989 83.2-106.3-146.9 151.1 -22.9 66.3 1.2 95 101 A I - 0 0 3 -26,-2.4 -78,-0.4 -2,-0.3 2,-0.1 -0.504 52.4 -97.5 -72.8 145.1 -20.0 68.2 2.8 96 102 A P - 0 0 3 0, 0.0 -80,-0.3 0, 0.0 -81,-0.1 -0.465 27.2-152.0 -64.2 134.9 -19.9 67.8 6.6 97 103 A I > + 0 0 5 -82,-2.1 3,-2.3 1,-0.2 -81,-0.1 0.790 27.1 176.8 -78.7 -25.7 -21.7 70.7 8.2 98 104 A L T 3 S- 0 0 29 -83,-0.7 -1,-0.2 1,-0.3 -83,-0.1 -0.384 70.7 -11.8 57.3-124.9 -19.6 70.4 11.3 99 105 A D T 3 S- 0 0 31 2,-0.1 -1,-0.3 -2,-0.1 3,-0.1 0.443 101.0-103.8 -86.1 2.8 -20.5 73.2 13.7 100 106 A G S < S+ 0 0 0 -3,-2.3 78,-0.5 1,-0.4 -2,-0.1 0.270 96.8 71.5 96.4 -13.0 -22.5 75.1 11.0 101 107 A S S S- 0 0 2 76,-0.2 -1,-0.4 -4,-0.1 74,-0.2 -0.320 92.4-102.7-115.5-159.5 -19.8 77.7 10.3 102 108 A G S > S+ 0 0 0 72,-2.5 4,-3.0 71,-0.2 73,-0.2 0.215 83.9 108.4-114.2 14.4 -16.4 77.6 8.6 103 109 A W H > S+ 0 0 86 71,-0.7 4,-3.1 2,-0.2 5,-0.3 0.939 79.4 44.1 -56.6 -58.4 -14.3 77.7 11.8 104 110 A E H > S+ 0 0 95 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.870 118.6 47.0 -57.7 -36.8 -13.0 74.1 11.8 105 111 A F H > S+ 0 0 2 2,-0.2 4,-2.3 3,-0.1 5,-0.3 0.921 114.3 46.6 -68.4 -47.9 -12.3 74.4 8.0 106 112 A Y H X S+ 0 0 15 -4,-3.0 4,-2.9 2,-0.2 5,-0.3 0.958 110.6 50.9 -59.7 -56.7 -10.6 77.8 8.3 107 113 A E H X S+ 0 0 39 -4,-3.1 4,-1.7 1,-0.2 -2,-0.2 0.931 115.8 41.1 -48.0 -56.7 -8.4 76.8 11.3 108 114 A A H < S+ 0 0 28 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.956 118.7 42.6 -59.1 -58.0 -7.0 73.7 9.6 109 115 A I H >< S+ 0 0 0 -4,-2.3 3,-1.3 1,-0.2 -1,-0.2 0.871 110.3 58.4 -59.2 -39.3 -6.6 75.0 6.1 110 116 A R H >< S+ 0 0 70 -4,-2.9 3,-1.0 1,-0.3 2,-0.3 0.925 105.5 48.1 -57.1 -49.6 -5.1 78.3 7.3 111 117 A K T 3< S+ 0 0 129 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.1 -0.090 113.9 50.0 -85.4 36.9 -2.3 76.6 9.2 112 118 A N T < S+ 0 0 29 -3,-1.3 -105,-2.8 -2,-0.3 -104,-0.3 0.152 74.3 141.4-158.2 21.6 -1.5 74.5 6.1 113 120 A I E < -A 6 0A 43 -3,-1.0 2,-0.4 -107,-0.2 -107,-0.2 -0.328 31.2-161.6 -73.2 154.3 -1.2 76.8 3.2 114 121 A L E -A 5 0A 76 -109,-1.9 -109,-1.7 -2,-0.0 2,-0.1 -0.909 12.3-142.9-138.7 107.1 1.4 76.4 0.4 115 122 A N E -A 4 0A 96 -2,-0.4 -111,-0.2 -111,-0.2 2,-0.2 -0.479 24.7-161.6 -69.0 141.5 2.2 79.3 -1.8 116 123 A Q E - 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