==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/ANTIBIOTIC 21-JUN-13 4LCF . COMPND 2 MOLECULE: UDP-3-O-[3-HYDROXYMYRISTOYL] N-ACETYLGLUCOSAMINE . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR C.-J.LEE,P.ZHOU . 298 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13769.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 199 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 55 18.5 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 . 3 1.0 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 . 23 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 51 17.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 1 0 0 0 0 2 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 0 1 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 . 2 0 1 3 4 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 ANTIPARALLEL BRIDGES PER LADDER . 1 3 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 1 A M 0 0 82 0, 0.0 2,-0.6 0, 0.0 286,-0.2 0.000 360.0 360.0 360.0 156.9 -6.1 10.2 -9.8 2 2 A I - 0 0 23 284,-2.2 124,-2.7 124,-0.2 284,-0.3 -0.764 360.0-149.7 -78.2 119.6 -3.3 7.7 -9.4 3 3 A K E -A 125 0A 62 -2,-0.6 122,-0.2 122,-0.3 120,-0.1 -0.555 13.3-105.5 -95.3 155.9 -2.3 8.2 -5.7 4 4 A Q E - 0 0 7 120,-2.7 118,-3.0 118,-0.4 2,-0.3 -0.377 41.4-150.2 -65.4 154.6 1.0 7.8 -4.0 5 5 A R E +A 121 0A 16 82,-0.3 85,-2.0 116,-0.2 84,-1.7 -0.970 23.2 166.5-136.2 154.7 1.2 4.7 -1.8 6 6 A T E -A 120 0A 5 114,-2.4 114,-2.8 -2,-0.3 2,-0.2 -0.666 46.2 -68.2-137.7-167.9 2.9 3.5 1.4 7 7 A L E -A 119 0A 2 83,-0.4 112,-0.2 112,-0.2 111,-0.1 -0.648 26.1-145.1 -90.9 152.8 2.5 0.6 3.8 8 8 A K S S+ 0 0 118 110,-2.0 2,-0.3 -2,-0.2 110,-0.2 0.769 81.2 15.0 -83.0 -29.1 -0.5 0.2 6.1 9 9 A N S S- 0 0 98 108,-0.4 2,-0.3 109,-0.4 -1,-0.1 -0.918 81.3 -98.9-141.2 163.6 1.6 -1.4 8.9 10 10 A I - 0 0 90 -2,-0.3 2,-0.3 19,-0.1 19,-0.2 -0.640 43.5-176.8 -80.0 142.7 5.1 -1.9 10.2 11 11 A I E -B 28 0B 37 17,-2.1 17,-3.1 -2,-0.3 2,-0.3 -0.991 7.0-158.8-145.1 152.4 6.5 -5.3 9.4 12 12 A R E +B 27 0B 159 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.916 12.9 168.9-134.6 154.3 9.7 -7.1 10.2 13 13 A A E -B 26 0B 20 13,-2.0 13,-2.9 -2,-0.3 2,-0.3 -0.965 18.7-141.0-153.0 164.1 12.0 -10.0 9.0 14 14 A T E +B 25 0B 72 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.918 31.0 134.6-127.0 156.9 15.5 -11.3 9.8 15 15 A G E -B 24 0B 15 9,-1.9 9,-3.2 -2,-0.3 2,-0.3 -0.922 45.6 -83.2-171.0-165.6 18.2 -12.8 7.6 16 16 A V E -B 23 0B 55 -2,-0.3 86,-2.9 7,-0.3 87,-0.4 -0.920 37.9-108.3-122.6 150.1 21.9 -12.7 6.8 17 17 A G > - 0 0 0 5,-2.1 4,-2.4 -2,-0.3 191,-0.2 -0.591 20.3-143.7 -74.7 134.0 24.0 -10.4 4.6 18 18 A L T 4 S+ 0 0 32 82,-0.5 190,-2.2 -2,-0.3 191,-0.7 0.934 100.3 34.0 -61.4 -48.7 25.1 -12.1 1.4 19 19 A H T 4 S+ 0 0 42 187,-0.2 188,-1.4 188,-0.2 187,-0.5 0.898 131.0 31.9 -74.9 -40.9 28.5 -10.3 1.4 20 20 A S T 4 S- 0 0 43 186,-0.2 -2,-0.2 2,-0.1 -1,-0.1 0.778 84.5-140.1 -91.4 -30.9 29.0 -10.1 5.2 21 21 A G < + 0 0 31 -4,-2.4 2,-0.3 1,-0.3 -3,-0.1 0.491 55.0 147.0 76.3 3.5 27.3 -13.3 6.5 22 22 A E - 0 0 99 -6,-0.1 -5,-2.1 1,-0.1 -1,-0.3 -0.564 55.0-118.5 -79.7 128.8 26.1 -11.0 9.3 23 23 A K E -B 16 0B 102 -2,-0.3 2,-0.4 -7,-0.2 -7,-0.3 -0.463 40.9-170.7 -62.2 132.3 22.7 -11.6 10.9 24 24 A V E -B 15 0B 1 -9,-3.2 -9,-1.9 -2,-0.2 2,-0.5 -0.983 23.0-138.1-137.9 141.3 20.6 -8.5 10.3 25 25 A Y E -B 14 0B 137 -2,-0.4 71,-1.3 -11,-0.2 2,-0.4 -0.853 22.0-162.7 -97.1 129.4 17.2 -7.2 11.4 26 26 A L E -BC 13 95B 1 -13,-2.9 -13,-2.0 -2,-0.5 2,-0.4 -0.924 8.4-177.5-115.1 135.9 15.0 -5.6 8.8 27 27 A T E -BC 12 94B 11 67,-2.2 67,-2.6 -2,-0.4 2,-0.5 -0.997 9.9-161.4-133.0 130.3 12.0 -3.3 9.4 28 28 A L E -BC 11 93B 1 -17,-3.1 -17,-2.1 -2,-0.4 65,-0.2 -0.943 19.2-179.9-107.9 132.5 9.6 -1.8 6.8 29 29 A K E - C 0 92B 56 63,-2.7 63,-2.2 -2,-0.5 -22,-0.1 -0.939 30.8-103.5-131.7 150.8 7.6 1.2 7.9 30 30 A P E - C 0 91B 45 0, 0.0 61,-0.2 0, 0.0 -22,-0.1 -0.302 38.7-166.2 -61.3 157.1 5.0 3.6 6.4 31 31 A A - 0 0 6 59,-0.5 59,-0.1 -24,-0.1 3,-0.1 -0.986 21.8 -96.4-146.5 153.6 6.2 7.0 5.5 32 32 A P > - 0 0 77 0, 0.0 3,-1.4 0, 0.0 4,-0.3 -0.108 57.1 -69.8 -66.1 164.5 4.5 10.4 4.6 33 33 A V T 3 S+ 0 0 48 1,-0.2 -27,-0.0 2,-0.1 90,-0.0 -0.178 118.8 15.9 -49.4 141.1 3.8 11.7 1.1 34 34 A D T 3 S+ 0 0 106 -3,-0.1 -1,-0.2 1,-0.1 56,-0.0 0.642 90.8 114.5 65.7 18.7 6.9 12.7 -0.9 35 35 A T < - 0 0 41 -3,-1.4 -2,-0.1 1,-0.2 55,-0.1 0.856 55.2-164.6 -79.4 -38.6 9.3 10.8 1.4 36 36 A G - 0 0 20 -4,-0.3 55,-2.0 -5,-0.1 2,-0.5 -0.413 48.0 -39.6 75.3-165.9 10.5 8.3 -1.1 37 37 A I E -d 91 0B 11 15,-0.3 15,-3.0 53,-0.2 2,-0.4 -0.839 64.8-172.9 -93.6 128.0 12.3 5.3 0.2 38 38 A V E -dE 92 51B 10 53,-2.3 55,-3.0 -2,-0.5 2,-0.4 -0.987 11.1-151.5-125.7 126.7 14.7 6.1 3.1 39 39 A F E -dE 93 50B 0 11,-2.5 11,-3.2 -2,-0.4 2,-0.4 -0.764 12.4-166.4 -92.5 140.7 17.1 3.6 4.7 40 40 A S E -dE 94 49B 6 53,-3.0 55,-2.6 -2,-0.4 2,-1.1 -0.991 19.3-145.5-131.8 128.5 18.1 4.0 8.3 41 41 A R E > +dE 95 48B 24 7,-2.8 7,-1.2 -2,-0.4 3,-0.8 -0.776 21.5 178.9 -87.1 96.4 21.0 2.3 10.1 42 42 A T T 3 S+ 0 0 60 53,-1.7 54,-0.2 -2,-1.1 -1,-0.2 0.525 71.5 68.6 -80.3 -7.0 19.4 2.0 13.5 43 43 A D T 3 S+ 0 0 74 52,-0.8 -1,-0.2 5,-0.1 2,-0.1 0.728 87.2 84.2 -80.4 -23.1 22.4 0.3 15.0 44 44 A L S < S- 0 0 52 -3,-0.8 53,-0.0 4,-0.1 4,-0.0 -0.413 83.6-111.6 -82.9 156.5 24.5 3.4 14.8 45 45 A D S S+ 0 0 159 1,-0.2 2,-0.2 -2,-0.1 -3,-0.0 -0.927 111.5 25.9-133.2 107.4 24.6 6.3 17.3 46 46 A P S S- 0 0 101 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.538 111.4-113.7 -73.2 164.0 23.4 8.6 16.1 47 47 A V - 0 0 77 -2,-0.2 2,-0.5 -5,-0.1 -5,-0.2 -0.414 29.4-141.2 -64.5 136.5 21.1 6.8 13.6 48 48 A V E -E 41 0B 27 -7,-1.2 -7,-2.8 -2,-0.1 2,-0.4 -0.908 11.7-159.8-108.7 126.1 22.1 7.5 10.0 49 49 A E E -E 40 0B 106 -2,-0.5 -9,-0.2 -9,-0.2 -11,-0.0 -0.841 7.3-175.1-103.2 138.3 19.5 7.9 7.3 50 50 A I E -E 39 0B 0 -11,-3.2 -11,-2.5 -2,-0.4 2,-0.1 -0.931 20.5-136.9-133.0 110.8 20.3 7.5 3.6 51 51 A P E -E 38 0B 48 0, 0.0 2,-2.0 0, 0.0 -13,-0.2 -0.384 25.7-116.4 -62.6 140.1 17.6 8.3 1.0 52 52 A A + 0 0 5 -15,-3.0 2,-0.3 -2,-0.1 -15,-0.3 -0.550 66.9 134.8 -79.7 79.2 17.3 5.7 -1.8 53 53 A R > - 0 0 109 -2,-2.0 3,-2.0 196,-0.1 196,-0.2 -0.931 67.3-115.1-129.1 154.2 18.4 8.0 -4.6 54 54 A A G > S+ 0 0 2 194,-1.9 3,-1.5 -2,-0.3 218,-0.1 0.820 111.9 61.7 -56.4 -35.9 20.8 7.6 -7.5 55 55 A E G 3 S+ 0 0 143 1,-0.3 -1,-0.3 193,-0.2 -3,-0.1 0.611 99.0 57.2 -69.9 -12.9 23.1 10.3 -6.2 56 56 A N G < S+ 0 0 32 -3,-2.0 11,-2.9 192,-0.1 2,-0.4 0.313 77.7 116.5-100.4 7.8 23.8 8.4 -3.0 57 57 A V B < +F 66 0C 8 -3,-1.5 9,-0.2 9,-0.2 3,-0.1 -0.648 35.5 171.0 -81.2 127.3 25.0 5.2 -4.8 58 58 A G + 0 0 35 7,-2.8 -1,-0.1 -2,-0.4 8,-0.1 0.530 55.2 12.1 -98.0-113.2 28.7 4.4 -4.0 59 59 A E + 0 0 144 1,-0.1 6,-1.5 5,-0.1 -1,-0.4 -0.346 52.4 177.4 -70.4 149.0 30.3 1.2 -5.1 60 60 A T + 0 0 26 4,-0.2 205,-0.5 -3,-0.1 204,-0.3 0.165 43.6 111.8-137.7 14.7 28.4 -1.0 -7.6 61 61 A T S S+ 0 0 116 203,-0.1 203,-0.2 1,-0.1 204,-0.1 0.956 98.7 3.6 -61.8 -56.4 30.8 -3.9 -8.2 62 62 A M S S- 0 0 105 1,-0.3 2,-0.2 202,-0.1 202,-0.1 0.866 137.9 -7.2 -96.7 -49.1 28.8 -6.8 -6.6 63 63 A S S S- 0 0 4 200,-0.1 2,-0.6 201,-0.0 -1,-0.3 -0.789 83.5 -82.4-135.1 177.5 25.6 -5.0 -5.5 64 64 A T - 0 0 1 -2,-0.2 12,-1.9 -3,-0.1 2,-0.4 -0.803 48.1-166.3 -86.7 124.7 24.2 -1.5 -5.4 65 65 A T - 0 0 13 -6,-1.5 -7,-2.8 -2,-0.6 2,-0.4 -0.944 13.0-148.1-117.1 131.4 25.4 0.3 -2.2 66 66 A L E -FG 57 73C 0 7,-2.8 7,-2.4 -2,-0.4 2,-0.4 -0.776 23.4-168.0 -91.6 142.1 24.0 3.5 -0.7 67 67 A V E + G 0 72C 52 -11,-2.9 2,-0.3 -2,-0.4 5,-0.2 -0.981 26.0 176.7-135.9 142.6 26.6 5.6 1.0 68 68 A K E > S- G 0 71C 89 3,-2.6 3,-1.9 -2,-0.4 2,-0.4 -0.827 74.3 -54.3-139.2 102.7 26.7 8.6 3.4 69 69 A G T 3 S- 0 0 66 -2,-0.3 -1,-0.0 1,-0.3 0, 0.0 -0.535 122.0 -18.3 66.2-120.9 30.2 9.4 4.4 70 70 A D T 3 S+ 0 0 176 -2,-0.4 2,-0.4 -3,-0.1 -1,-0.3 0.392 119.2 96.8 -97.3 2.2 31.7 6.3 5.9 71 71 A V E < -G 68 0C 30 -3,-1.9 -3,-2.6 2,-0.0 2,-0.3 -0.789 53.8-175.2 -99.3 132.5 28.3 4.7 6.5 72 72 A K E -G 67 0C 95 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.889 26.5-159.7-126.7 155.1 26.9 2.2 3.9 73 73 A V E -G 66 0C 0 -7,-2.4 -7,-2.8 -2,-0.3 3,-0.3 -0.950 30.1-160.2-126.9 111.2 23.8 0.2 3.2 74 74 A D B +h 99 0D 9 24,-2.5 26,-2.4 -2,-0.4 -9,-0.2 -0.557 57.4 19.2 -96.2 154.6 24.7 -2.7 0.8 75 75 A T + 0 0 6 -11,-0.3 4,-0.3 -2,-0.2 3,-0.2 0.936 64.0 151.6 60.1 56.7 22.7 -4.8 -1.5 76 76 A V > + 0 0 0 -12,-1.9 4,-2.5 -3,-0.3 5,-0.2 0.616 45.4 90.1 -88.6 -11.3 19.6 -2.6 -1.8 77 77 A E H > S+ 0 0 7 -13,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.789 83.5 46.6 -64.3 -37.5 18.6 -3.8 -5.3 78 78 A H H > S+ 0 0 7 -3,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.917 115.7 45.2 -75.3 -40.5 16.3 -6.8 -4.5 79 79 A L H > S+ 0 0 0 -4,-0.3 4,-2.2 1,-0.2 -2,-0.2 0.935 114.4 49.2 -63.3 -45.3 14.3 -4.9 -1.8 80 80 A L H X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.837 105.3 58.8 -65.0 -32.1 14.0 -1.9 -4.1 81 81 A S H X S+ 0 0 0 -4,-1.7 4,-2.6 -5,-0.2 -1,-0.2 0.917 107.0 47.0 -61.0 -43.0 12.9 -4.1 -6.9 82 82 A A H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 6,-0.2 0.911 110.8 51.5 -64.2 -44.6 9.9 -5.2 -4.8 83 83 A M H <>S+ 0 0 0 -4,-2.2 5,-2.6 1,-0.2 4,-0.3 0.912 113.6 45.6 -55.8 -44.5 9.1 -1.6 -3.8 84 84 A A H ><5S+ 0 0 8 -4,-2.5 3,-0.9 3,-0.2 -2,-0.2 0.911 111.3 51.3 -65.2 -44.5 9.2 -0.7 -7.5 85 85 A G H 3<5S+ 0 0 10 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.806 114.9 42.1 -66.0 -31.4 7.1 -3.6 -8.6 86 86 A L T 3<5S- 0 0 1 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.396 112.7-119.9 -96.7 0.9 4.4 -3.0 -6.0 87 87 A G T < 5 + 0 0 1 -3,-0.9 2,-0.7 -4,-0.3 -82,-0.3 0.782 47.1 171.0 69.3 30.6 4.5 0.8 -6.7 88 88 A I < + 0 0 0 -5,-2.6 -1,-0.2 -6,-0.2 -82,-0.2 -0.640 10.0 177.7 -77.5 114.4 5.5 1.8 -3.2 89 89 A D + 0 0 8 -84,-1.7 2,-0.4 -2,-0.7 -83,-0.2 0.892 64.3 33.8 -81.3 -42.8 6.3 5.5 -3.2 90 90 A N + 0 0 3 -85,-2.0 -59,-0.5 -59,-0.1 -83,-0.4 -0.961 67.6 131.1-128.4 125.1 7.1 6.1 0.5 91 91 A A E -Cd 30 37B 0 -55,-2.0 -53,-2.3 -2,-0.4 2,-0.4 -0.955 41.3-130.6-163.3 151.6 8.6 3.9 3.1 92 92 A Y E -Cd 29 38B 68 -63,-2.2 -63,-2.7 -2,-0.3 2,-0.5 -0.891 19.5-161.0-100.5 137.1 11.2 3.7 5.8 93 93 A V E -Cd 28 39B 0 -55,-3.0 -53,-3.0 -2,-0.4 2,-0.4 -0.958 6.6-163.2-120.0 112.5 13.6 0.8 5.8 94 94 A E E -Cd 27 40B 39 -67,-2.6 -67,-2.2 -2,-0.5 2,-0.4 -0.790 8.0-175.9 -98.7 138.6 15.4 0.1 9.1 95 95 A L E -Cd 26 41B 0 -55,-2.6 -53,-1.7 -2,-0.4 -52,-0.8 -0.992 27.4-154.9-134.6 141.5 18.5 -2.1 9.3 96 96 A S S S+ 0 0 33 -71,-1.3 2,-0.3 -2,-0.4 -70,-0.1 0.352 84.5 26.6 -92.2 3.8 20.6 -3.3 12.2 97 97 A A S S- 0 0 3 -72,-0.3 -55,-0.1 2,-0.1 -73,-0.1 -0.941 94.0 -87.6-158.0 175.5 23.7 -3.7 10.0 98 98 A S S S+ 0 0 25 -2,-0.3 -24,-2.5 -25,-0.1 2,-0.3 0.162 101.1 55.4 -83.3 17.4 25.3 -2.5 6.8 99 99 A E B S-h 74 0D 4 -26,-0.2 -24,-0.2 -77,-0.1 -3,-0.1 -0.967 79.3-119.5-151.5 134.5 23.6 -4.9 4.4 100 100 A V - 0 0 3 -26,-2.4 -82,-0.5 -2,-0.3 -22,-0.1 -0.502 51.0 -98.3 -62.0 135.2 20.0 -5.8 3.5 101 101 A P - 0 0 2 0, 0.0 -84,-0.3 0, 0.0 -1,-0.1 -0.312 23.2-137.9 -58.9 141.8 19.4 -9.5 4.2 102 102 A I > + 0 0 1 -86,-2.9 3,-2.3 1,-0.2 4,-0.2 0.769 33.7 177.2 -73.7 -24.8 19.8 -11.7 1.2 103 103 A M T 3 S- 0 0 50 -87,-0.4 -1,-0.2 1,-0.3 -87,-0.1 -0.383 71.5 -19.2 55.9-122.2 16.7 -13.8 2.1 104 104 A D T 3 S- 0 0 29 2,-0.2 -1,-0.3 -2,-0.2 3,-0.1 0.340 96.9-102.6 -98.6 8.0 16.2 -16.3 -0.7 105 105 A G S < S+ 0 0 0 -3,-2.3 85,-1.3 1,-0.3 2,-0.2 0.350 94.7 82.3 92.3 -5.6 18.2 -14.3 -3.2 106 106 A S S S- 0 0 0 83,-0.2 -1,-0.3 -4,-0.2 -2,-0.2 -0.438 90.0-106.3-116.0-170.2 15.1 -12.9 -5.0 107 107 A A S >> S+ 0 0 0 79,-2.6 4,-2.3 81,-0.2 3,-0.6 0.483 94.6 95.8 -95.1 -6.1 12.7 -10.1 -4.5 108 108 A G H 3> S+ 0 0 11 78,-1.1 4,-2.8 1,-0.2 5,-0.2 0.877 78.1 51.2 -53.4 -51.0 10.0 -12.5 -3.4 109 109 A P H 3> S+ 0 0 24 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.818 112.8 48.7 -60.6 -28.5 10.4 -12.3 0.4 110 110 A F H <> S+ 0 0 2 -3,-0.6 4,-2.8 2,-0.2 -2,-0.2 0.883 109.4 50.0 -78.6 -39.4 10.2 -8.5 0.1 111 111 A V H X S+ 0 0 5 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.933 111.7 51.9 -56.9 -44.8 7.1 -8.6 -2.1 112 112 A F H X S+ 0 0 134 -4,-2.8 4,-2.1 -5,-0.2 -2,-0.2 0.925 111.1 45.7 -56.4 -50.0 5.7 -11.0 0.6 113 113 A L H X S+ 0 0 11 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.906 114.1 48.1 -62.5 -43.6 6.6 -8.5 3.4 114 114 A I H X S+ 0 0 0 -4,-2.8 4,-1.3 2,-0.2 -2,-0.2 0.942 113.8 45.7 -64.9 -48.0 5.1 -5.5 1.6 115 115 A Q H < S+ 0 0 105 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.869 113.1 51.4 -62.1 -36.0 1.9 -7.3 0.7 116 116 A S H < S+ 0 0 67 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.823 106.4 53.7 -72.1 -32.0 1.6 -8.6 4.2 117 117 A A H < S- 0 0 2 -4,-1.9 -108,-0.4 -5,-0.2 -1,-0.2 0.786 114.9-125.7 -69.1 -29.1 2.1 -5.1 5.6 118 118 A G < - 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0 0 19 -3,-1.0 -142,-0.0 -4,-0.3 -6,-0.0 -0.513 67.7-146.9 -80.5 142.6 -2.5 6.1 -17.8 293 293 A P S S+ 0 0 34 0, 0.0 2,-0.3 0, 0.0 -141,-0.3 0.473 87.8 56.9 -80.1 -4.2 -0.4 3.6 -19.8 294 294 A I - 0 0 17 -143,-0.2 2,-0.3 -5,-0.1 -2,-0.1 -0.892 65.9-167.3-127.5 154.7 0.5 2.1 -16.5 295 295 A S - 0 0 81 -2,-0.3 -5,-0.0 -119,-0.1 -293,-0.0 -0.981 18.2-172.0-147.3 130.1 -1.5 0.6 -13.6 296 296 A Y + 0 0 27 -2,-0.3 -1,-0.0 -209,-0.1 -2,-0.0 -0.172 34.2 157.7-111.4 38.7 -0.6 -0.3 -10.1 297 297 A M 0 0 146 1,-0.1 -2,-0.1 0, 0.0 0, 0.0 -0.324 360.0 360.0 -62.5 147.6 -3.9 -2.0 -9.5 298 298 A R 0 0 157 -179,-0.0 -1,-0.1 -2,-0.0 -212,-0.0 0.299 360.0 360.0-132.8 360.0 -3.7 -4.4 -6.7