==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-SEP-09 2WSA . COMPND 2 MOLECULE: GLYCYLPEPTIDE N-TETRADECANOYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LEISHMANIA MAJOR; . AUTHOR D.A.ROBINSON,S.BRAND,A.H.FAIRLAMB,M.A.J.FERGUSON, . 409 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18993.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 257 62.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 81 19.8 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 . 21 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 21.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.5 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 1 0 2 2 0 0 1 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 PARALLEL BRIDGES PER LADDER . 3 1 2 1 3 1 1 0 1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 A 0 0 144 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 157.0 40.7 -9.5 -4.4 2 12 A H > - 0 0 90 1,-0.1 4,-2.5 2,-0.1 5,-0.2 -0.795 360.0-172.7-132.9 90.5 37.4 -10.8 -3.1 3 13 A A T 4 S+ 0 0 77 -2,-0.4 -1,-0.1 1,-0.2 4,-0.1 0.767 90.4 28.2 -55.8 -29.9 37.5 -14.7 -2.8 4 14 A F T >4 S+ 0 0 12 2,-0.1 3,-2.1 -3,-0.1 4,-0.3 0.890 120.2 48.5 -95.1 -56.6 33.8 -14.7 -1.9 5 15 A W G >4 S+ 0 0 30 1,-0.3 3,-1.4 2,-0.2 5,-0.3 0.800 102.8 64.9 -60.2 -28.1 32.3 -11.6 -3.6 6 16 A S G 3< S+ 0 0 69 -4,-2.5 -1,-0.3 1,-0.2 -3,-0.1 0.701 101.3 51.6 -64.8 -18.0 34.0 -12.5 -6.9 7 17 A T G < S+ 0 0 88 -3,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.411 97.4 88.0 -93.4 -2.5 31.8 -15.7 -7.0 8 18 A Q S < S- 0 0 24 -3,-1.4 2,-2.2 -4,-0.3 -4,-0.0 -0.652 87.8-105.9-108.8 156.7 28.5 -13.9 -6.4 9 19 A P S S+ 0 0 13 0, 0.0 386,-2.1 0, 0.0 387,-0.3 -0.464 79.6 110.1 -84.5 71.0 25.9 -12.4 -8.8 10 20 A V S S- 0 0 3 -2,-2.2 190,-0.1 -5,-0.3 387,-0.1 -0.944 82.2 -86.1-132.6 153.7 26.8 -8.7 -8.0 11 21 A P - 0 0 6 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.401 38.3-151.4 -59.2 139.8 28.5 -6.1 -10.2 12 22 A Q + 0 0 66 1,-0.1 2,-0.3 187,-0.1 3,-0.0 0.792 64.4 15.7 -93.4 -27.3 32.2 -6.5 -9.7 13 23 A T S > S- 0 0 73 1,-0.1 4,-1.8 187,-0.1 -1,-0.1 -0.910 70.1-113.0-140.2 164.2 33.6 -3.0 -10.3 14 24 A E H > S+ 0 0 77 -2,-0.3 4,-1.7 2,-0.2 5,-0.2 0.873 118.5 57.9 -60.6 -42.6 32.6 0.6 -10.5 15 25 A D H > S+ 0 0 104 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.893 106.6 48.3 -54.2 -42.4 33.5 0.5 -14.2 16 26 A E H >4 S+ 0 0 67 1,-0.2 3,-1.1 2,-0.2 4,-0.4 0.919 108.1 55.1 -63.7 -42.9 31.0 -2.3 -14.6 17 27 A D H >< S+ 0 0 4 -4,-1.8 3,-0.7 1,-0.3 383,-0.5 0.781 101.5 58.3 -60.7 -31.4 28.4 -0.3 -12.8 18 28 A E H 3< S+ 0 0 141 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.736 101.9 54.7 -70.6 -24.7 28.9 2.6 -15.2 19 29 A K T << S+ 0 0 150 -3,-1.1 2,-0.5 -4,-0.7 -1,-0.2 0.528 84.0 104.9 -85.7 -7.4 27.9 0.3 -18.1 20 30 A I < + 0 0 22 -3,-0.7 380,-0.2 -4,-0.4 3,-0.1 -0.640 33.4 159.0 -78.3 124.9 24.6 -0.7 -16.5 21 31 A V + 0 0 56 -2,-0.5 2,-0.4 1,-0.2 -1,-0.2 0.572 58.1 43.6-121.1 -22.3 21.7 1.1 -18.2 22 32 A F S S- 0 0 43 105,-0.1 -1,-0.2 2,-0.0 2,-0.2 -0.983 78.8-115.8-125.7 145.7 18.7 -1.1 -17.2 23 33 A A + 0 0 4 -2,-0.4 124,-0.2 121,-0.3 104,-0.2 -0.504 59.4 118.1 -67.9 143.1 17.5 -2.7 -14.0 24 34 A G B -A 397 0A 9 373,-1.3 373,-3.5 -2,-0.2 -2,-0.0 -0.894 62.3 -62.5 170.6 170.2 17.4 -6.5 -14.2 25 35 A P - 0 0 50 0, 0.0 371,-0.2 0, 0.0 370,-0.1 -0.235 27.5-154.3 -67.3 156.6 18.8 -9.8 -12.8 26 36 A M S S+ 0 0 63 369,-0.2 -16,-0.1 -17,-0.2 370,-0.1 0.878 71.1 58.3 -88.0 -48.2 22.5 -10.6 -13.0 27 37 A D S S- 0 0 67 -18,-0.2 3,-0.1 1,-0.2 -19,-0.0 -0.077 95.6 -76.6 -81.8 173.0 22.3 -14.5 -12.9 28 38 A E - 0 0 124 1,-0.1 -1,-0.2 -2,-0.0 -2,-0.1 -0.451 54.9-101.4 -64.5 135.1 20.6 -17.2 -14.9 29 39 A P - 0 0 131 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.449 54.0-178.8 -57.4 133.5 16.9 -17.6 -14.3 30 40 A K - 0 0 70 -3,-0.1 2,-0.3 -2,-0.0 3,-0.0 -0.886 19.4-126.7-130.5 163.4 16.6 -20.6 -11.9 31 41 A T > - 0 0 68 -2,-0.3 3,-0.7 1,-0.1 4,-0.4 -0.761 25.0-114.9-109.6 161.8 13.8 -22.6 -10.2 32 42 A V G > S+ 0 0 38 -2,-0.3 3,-1.8 1,-0.2 -1,-0.1 0.889 119.0 59.9 -54.3 -39.9 13.0 -23.5 -6.6 33 43 A A G 3 S+ 0 0 87 1,-0.3 -1,-0.2 -3,-0.0 4,-0.1 0.821 97.2 59.5 -60.4 -32.9 13.5 -27.2 -7.7 34 44 A D G < S+ 0 0 103 -3,-0.7 -1,-0.3 2,-0.1 -2,-0.2 0.636 89.6 92.9 -63.8 -18.1 17.1 -26.3 -8.8 35 45 A I S < S- 0 0 11 -3,-1.8 145,-0.0 -4,-0.4 -3,-0.0 -0.715 86.5-109.4 -92.8 127.0 17.9 -25.3 -5.2 36 46 A P - 0 0 85 0, 0.0 -1,-0.1 0, 0.0 148,-0.1 -0.149 18.1-155.6 -47.9 131.3 19.4 -27.8 -2.7 37 47 A E S S+ 0 0 151 -4,-0.1 -2,-0.0 2,-0.1 -4,-0.0 0.742 74.6 81.5 -79.2 -22.7 16.9 -28.9 -0.1 38 48 A E S S- 0 0 161 1,-0.1 0, 0.0 3,-0.0 0, 0.0 -0.603 94.1-102.2 -81.7 143.7 19.7 -29.8 2.3 39 49 A P - 0 0 61 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.165 48.8 -83.2 -56.7 153.7 21.3 -27.0 4.3 40 50 A Y - 0 0 90 1,-0.1 137,-0.1 133,-0.1 133,-0.0 -0.326 59.8 -94.5 -55.4 139.6 24.6 -25.6 3.2 41 51 A P - 0 0 99 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.257 49.0-179.8 -60.8 145.0 27.5 -27.8 4.5 42 52 A I - 0 0 40 4,-0.1 6,-0.1 -3,-0.1 4,-0.0 -0.982 38.5 -76.3-145.7 151.7 29.1 -26.7 7.8 43 53 A A > - 0 0 57 -2,-0.3 3,-2.4 1,-0.1 -1,-0.0 -0.070 45.1-115.3 -52.9 145.0 31.9 -28.0 10.0 44 54 A S T 3 S+ 0 0 110 1,-0.3 -1,-0.1 3,-0.0 63,-0.0 0.713 114.1 59.5 -60.2 -22.0 30.8 -31.0 12.1 45 55 A T T 3 S+ 0 0 83 62,-0.1 62,-2.5 61,-0.1 63,-0.4 0.485 103.9 62.8 -83.8 -4.4 31.3 -29.1 15.3 46 56 A F E < -B 106 0B 41 -3,-2.4 2,-0.3 60,-0.3 60,-0.2 -0.760 62.6-167.2-114.3 165.2 28.7 -26.5 14.3 47 57 A E E -B 105 0B 47 58,-1.9 58,-2.6 -2,-0.3 2,-0.2 -0.994 26.0-111.4-150.3 148.7 25.0 -26.6 13.5 48 58 A W E -B 104 0B 41 -2,-0.3 2,-0.3 56,-0.2 56,-0.2 -0.565 34.5-171.7 -72.2 140.3 22.4 -24.4 11.9 49 59 A W E -B 103 0B 42 54,-2.4 54,-2.7 -2,-0.2 -2,-0.0 -0.997 16.3-152.7-136.5 135.5 19.8 -23.1 14.3 50 60 A T - 0 0 53 -2,-0.3 52,-0.2 52,-0.2 2,-0.1 -0.880 19.8-152.3-106.5 102.1 16.6 -21.1 13.4 51 61 A P - 0 0 2 0, 0.0 2,-0.9 0, 0.0 50,-0.1 -0.423 16.9-122.4 -73.0 149.5 15.7 -18.9 16.4 52 62 A N 0 0 86 1,-0.1 7,-0.4 3,-0.1 6,-0.3 -0.837 360.0 360.0 -88.8 105.2 12.1 -18.0 16.9 53 63 A M 0 0 3 -2,-0.9 38,-0.1 5,-0.1 -1,-0.1 0.320 360.0 360.0 -74.8 360.0 12.2 -14.2 16.8 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 65 A A >> 0 0 48 0, 0.0 4,-2.8 0, 0.0 3,-0.9 0.000 360.0 360.0 360.0 115.7 9.9 -16.0 21.5 56 66 A A H 3> + 0 0 80 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.787 360.0 47.1 -42.1 -49.2 11.5 -14.0 24.3 57 67 A D H 3> S+ 0 0 109 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.874 114.0 46.1 -63.3 -43.1 14.4 -16.5 25.1 58 68 A D H <> S+ 0 0 31 -3,-0.9 4,-2.2 -6,-0.3 5,-0.2 0.913 113.1 50.5 -68.4 -41.4 15.4 -16.9 21.5 59 69 A I H X S+ 0 0 5 -4,-2.8 4,-3.2 -7,-0.4 -2,-0.2 0.942 110.8 50.5 -58.1 -44.8 15.2 -13.1 21.0 60 70 A H H X S+ 0 0 65 -4,-2.5 4,-2.3 -5,-0.3 -2,-0.2 0.901 107.8 52.5 -61.3 -41.9 17.4 -12.7 24.2 61 71 A A H X S+ 0 0 16 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.929 113.6 42.3 -56.8 -49.5 20.0 -15.2 22.9 62 72 A I H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.921 111.3 57.9 -66.5 -42.9 20.3 -13.3 19.5 63 73 A Y H X S+ 0 0 30 -4,-3.2 4,-3.1 -5,-0.2 -1,-0.2 0.882 105.2 49.7 -49.1 -47.3 20.3 -10.0 21.5 64 74 A E H X S+ 0 0 78 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.915 109.3 51.2 -63.7 -44.3 23.3 -11.1 23.5 65 75 A L H X S+ 0 0 8 -4,-1.7 4,-1.5 2,-0.2 -2,-0.2 0.936 115.6 41.7 -55.0 -51.3 25.3 -12.1 20.4 66 76 A L H X S+ 0 0 3 -4,-2.5 4,-2.5 1,-0.2 3,-0.3 0.921 111.1 55.9 -65.8 -43.0 24.6 -8.7 18.8 67 77 A R H < S+ 0 0 72 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.881 119.7 31.8 -52.8 -41.0 25.2 -6.7 22.0 68 78 A D H < S+ 0 0 66 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.617 134.6 23.4 -95.1 -14.0 28.7 -8.2 22.4 69 79 A N H < S+ 0 0 10 -4,-1.5 92,-0.3 -3,-0.3 -3,-0.2 0.342 92.0 102.3-140.0 1.7 29.7 -8.7 18.7 70 80 A Y S < S- 0 0 27 -4,-2.5 90,-0.1 10,-0.3 -4,-0.0 0.007 81.3 -27.8 -84.8-163.0 27.8 -6.4 16.4 71 81 A V + 0 0 72 8,-0.1 9,-2.4 1,-0.0 2,-0.3 -0.140 62.1 174.5 -55.5 127.2 28.9 -3.2 14.6 72 82 A E B -C 79 0B 45 7,-0.2 7,-0.2 -3,-0.1 -1,-0.0 -0.893 33.8-107.1-119.8 159.5 31.5 -1.1 16.4 73 83 A D > - 0 0 51 5,-1.5 3,-1.2 -2,-0.3 -1,-0.1 -0.256 42.9 -99.3 -70.1 174.5 33.3 2.1 15.3 74 84 A D T 3 S+ 0 0 166 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.786 122.3 51.8 -70.8 -26.2 37.0 1.7 14.3 75 85 A D T 3 S- 0 0 128 3,-0.0 -1,-0.2 0, 0.0 -2,-0.0 0.265 109.3-120.0 -94.0 14.3 38.3 2.9 17.7 76 86 A S S < S+ 0 0 62 -3,-1.2 -2,-0.1 2,-0.1 3,-0.1 0.897 77.8 123.0 45.1 52.2 36.1 0.4 19.7 77 87 A M S S+ 0 0 43 1,-0.3 246,-2.6 246,-0.1 247,-0.5 0.720 70.0 29.6-100.4 -35.7 34.4 3.2 21.5 78 88 A F E - D 0 322B 26 244,-0.2 -5,-1.5 245,-0.1 2,-0.4 -0.980 57.1-175.7-134.1 142.8 30.8 2.4 20.5 79 89 A R E -CD 72 321B 37 242,-1.7 242,-3.0 -2,-0.4 -7,-0.2 -0.994 36.4-106.4-138.2 133.0 28.9 -0.8 19.7 80 90 A F E - D 0 320B 42 -9,-2.4 -10,-0.3 -2,-0.4 240,-0.2 -0.243 28.0-169.6 -55.6 140.5 25.3 -1.1 18.6 81 91 A N - 0 0 19 238,-2.8 -1,-0.1 -13,-0.1 -14,-0.1 -0.512 7.0-172.8-130.6 60.9 23.0 -2.4 21.3 82 92 A Y - 0 0 8 236,-0.2 -15,-0.1 1,-0.1 236,-0.1 -0.341 27.5-120.8 -51.5 132.4 19.7 -3.1 19.5 83 93 A S > - 0 0 16 234,-0.3 4,-2.7 213,-0.2 5,-0.2 -0.279 13.8-112.1 -78.0 164.1 17.1 -4.0 22.1 84 94 A E H > S+ 0 0 66 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.902 120.8 50.3 -55.7 -41.9 15.1 -7.2 22.3 85 95 A E H > S+ 0 0 118 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.912 109.7 51.4 -68.0 -37.5 11.9 -5.3 21.5 86 96 A F H > S+ 0 0 0 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.927 108.3 50.9 -62.9 -47.1 13.6 -3.7 18.5 87 97 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 5,-0.2 0.929 110.2 48.3 -61.2 -41.4 14.8 -7.1 17.2 88 98 A Q H X S+ 0 0 95 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.935 115.0 47.3 -64.6 -41.3 11.3 -8.6 17.4 89 99 A W H < S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.2 3,-0.2 0.946 115.6 42.8 -61.8 -50.8 9.9 -5.5 15.6 90 100 A A H < S+ 0 0 5 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.843 120.9 40.2 -63.9 -35.5 12.5 -5.4 12.8 91 101 A L H < S+ 0 0 4 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.601 110.7 52.7 -99.1 -10.2 12.5 -9.1 12.1 92 102 A C < + 0 0 22 -4,-1.4 -1,-0.2 -5,-0.2 3,-0.1 -0.322 68.9 147.5-122.3 51.2 8.9 -10.1 12.4 93 103 A P > - 0 0 4 0, 0.0 3,-1.8 0, 0.0 193,-0.1 -0.174 64.9 -49.8 -71.3 177.8 7.0 -7.7 10.0 94 104 A P T 3 S+ 0 0 26 0, 0.0 192,-0.0 0, 0.0 191,-0.0 -0.213 127.4 2.5 -54.0 130.6 3.9 -8.8 8.1 95 105 A N T 3 S+ 0 0 143 1,-0.2 -3,-0.0 -3,-0.1 0, 0.0 0.704 89.1 169.2 63.8 28.8 4.3 -12.1 6.3 96 106 A Y < - 0 0 69 -3,-1.8 -1,-0.2 23,-0.1 23,-0.1 -0.245 34.1-126.0 -66.6 158.0 7.9 -12.6 7.6 97 107 A I > - 0 0 42 21,-0.2 3,-2.0 1,-0.1 21,-0.2 -0.935 9.8-156.3-111.2 110.1 9.4 -15.9 7.0 98 108 A P G > S+ 0 0 68 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 0.872 91.6 64.7 -53.2 -36.8 10.8 -17.5 10.2 99 109 A D G 3 S+ 0 0 70 1,-0.3 82,-0.1 -3,-0.1 83,-0.1 0.665 88.1 69.8 -64.6 -17.5 13.2 -19.7 8.1 100 110 A W G < S+ 0 0 6 -3,-2.0 18,-2.5 18,-0.1 2,-0.8 0.431 77.1 88.0 -80.1 3.0 15.0 -16.5 7.0 101 111 A H E < - E 0 117B 0 -3,-2.0 2,-0.5 16,-0.2 16,-0.2 -0.896 68.1-174.8-101.9 105.3 16.4 -16.0 10.6 102 112 A V E + E 0 116B 0 14,-2.8 14,-1.8 -2,-0.8 2,-0.3 -0.905 11.3 170.8-118.9 121.9 19.6 -18.0 10.5 103 113 A A E -BE 49 115B 0 -54,-2.7 -54,-2.4 -2,-0.5 2,-0.4 -0.849 21.7-145.0-122.2 160.3 22.0 -18.8 13.3 104 114 A V E -BE 48 114B 0 10,-2.0 9,-3.0 -2,-0.3 10,-1.3 -0.996 20.1-176.7-116.7 135.3 25.0 -21.0 13.9 105 115 A R E -BE 47 112B 41 -58,-2.6 -58,-1.9 -2,-0.4 2,-0.4 -0.933 35.7-106.0-125.2 153.9 25.7 -22.6 17.2 106 116 A R E > -B 46 0B 92 5,-2.8 4,-1.4 -2,-0.3 5,-0.4 -0.678 33.8-139.5 -74.1 125.7 28.6 -24.7 18.5 107 117 A K T 4 S+ 0 0 121 -62,-2.5 -1,-0.1 -2,-0.4 -61,-0.1 0.824 90.0 57.2 -58.8 -40.3 27.0 -28.3 18.7 108 118 A A T 4 S+ 0 0 97 -63,-0.4 -1,-0.2 1,-0.2 -62,-0.1 0.909 130.4 4.0 -62.1 -50.1 28.5 -29.4 22.0 109 119 A D T 4 S- 0 0 92 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.172 97.5-115.0-127.4 9.4 27.3 -26.8 24.3 110 120 A K < + 0 0 127 -4,-1.4 2,-0.2 1,-0.2 -3,-0.2 0.752 47.1 176.2 57.6 29.7 25.1 -24.7 22.0 111 121 A K - 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0 0 50 0, 0.0 3,-2.3 0, 0.0 4,-0.3 -0.335 17.1-114.8 -68.4 144.8 35.0 22.4 17.6 227 237 A A G > S+ 0 0 71 1,-0.3 3,-1.8 2,-0.2 4,-0.2 0.780 111.8 65.5 -42.9 -40.2 38.1 24.7 17.4 228 238 A Q G > S+ 0 0 140 1,-0.3 3,-1.1 2,-0.2 -1,-0.3 0.787 93.1 61.5 -58.1 -32.7 36.0 27.7 16.6 229 239 A Y G X S+ 0 0 35 -3,-2.3 3,-1.6 1,-0.2 -1,-0.3 0.593 82.1 80.2 -75.0 -12.9 34.5 27.6 20.1 230 240 A Q G < S+ 0 0 115 -3,-1.8 -1,-0.2 -4,-0.3 -2,-0.2 0.606 77.6 72.1 -71.5 -11.9 37.8 28.1 21.9 231 241 A K G < S+ 0 0 118 -3,-1.1 2,-0.3 -4,-0.2 -1,-0.3 0.524 88.2 83.8 -77.6 -4.1 37.5 31.8 21.1 232 242 A F S < S- 0 0 102 -3,-1.6 -3,-0.0 1,-0.1 6,-0.0 -0.707 83.9-127.8 -97.8 154.6 34.8 31.8 23.8 233 243 A Q S S+ 0 0 212 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.0 0.827 108.3 26.6 -66.8 -32.0 35.3 32.1 27.6 234 244 A N > - 0 0 84 1,-0.2 4,-1.9 -5,-0.1 -1,-0.3 -0.773 69.9-179.4-132.7 91.8 33.1 29.0 28.1 235 245 A P H > S+ 0 0 22 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.912 82.6 49.2 -61.0 -42.5 33.3 26.8 25.1 236 246 A M H > S+ 0 0 24 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.885 108.1 53.4 -67.8 -40.4 30.9 24.1 26.5 237 247 A A H > S+ 0 0 28 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.896 111.6 46.3 -58.0 -41.0 28.3 26.7 27.5 238 248 A M H X S+ 0 0 39 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.853 111.2 52.0 -68.4 -36.0 28.2 28.1 24.0 239 249 A L H X S+ 0 0 5 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.922 110.6 48.0 -64.6 -45.6 28.1 24.6 22.5 240 250 A K H X S+ 0 0 79 -4,-2.7 4,-0.7 1,-0.2 3,-0.3 0.926 112.8 49.5 -60.4 -44.2 25.1 23.8 24.7 241 251 A R H >< S+ 0 0 150 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.912 105.9 56.4 -57.6 -45.5 23.5 27.0 23.7 242 252 A N H 3< S+ 0 0 46 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.847 114.5 39.1 -55.9 -37.5 24.1 26.3 20.0 243 253 A Y H 3< S+ 0 0 44 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.438 84.5 131.7-101.0 1.7 22.2 23.0 20.3 244 254 A Q << - 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