==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 24-NOV-11 4A95 . COMPND 2 MOLECULE: GLYCYLPEPTIDE N-TETRADECANOYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM VIVAX; . AUTHOR V.GONCALVES,J.A.BRANNIGAN,D.WHALLEY,K.H.ANSELL,B.SAXTY,A.A.H . 1134 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53695.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 735 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 254 22.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.7 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 . 87 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 111 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 217 19.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.6 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 3 0 3 0 8 0 0 0 3 0 9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 6 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 . 6 12 9 0 9 6 1 2 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 0 3 0 0 0 0 0 0 0 0 0 0 0 3 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 27 A D 0 0 164 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -24.5 48.3 41.0 55.2 2 28 A Y > + 0 0 79 1,-0.1 4,-2.9 3,-0.1 5,-0.2 0.911 360.0 171.8 44.0 56.4 46.8 39.8 58.5 3 29 A K T 4 S+ 0 0 147 1,-0.2 4,-0.3 2,-0.2 -1,-0.1 0.873 77.2 35.6 -66.0 -34.0 50.2 40.3 60.2 4 30 A F T >4 S+ 0 0 19 2,-0.1 3,-1.7 1,-0.1 4,-0.4 0.953 118.5 49.2 -81.5 -47.1 48.6 39.6 63.7 5 31 A W G >4 S+ 0 0 32 1,-0.3 3,-2.0 2,-0.2 5,-0.3 0.877 102.4 61.7 -63.4 -35.9 46.1 37.0 62.6 6 32 A Y G 3< S+ 0 0 75 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.1 0.715 98.6 58.5 -63.6 -16.5 48.6 34.9 60.7 7 33 A T G < S+ 0 0 98 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.626 96.5 80.7 -79.8 -13.2 50.5 34.4 63.9 8 34 A Q S < S- 0 0 27 -3,-2.0 2,-2.3 -4,-0.4 -4,-0.0 -0.528 96.5 -99.3 -97.9 159.2 47.5 32.8 65.6 9 35 A P S S+ 0 0 24 0, 0.0 359,-1.9 0, 0.0 360,-0.3 -0.459 84.3 113.5 -73.6 67.8 46.1 29.1 65.4 10 36 A V S S- 0 0 5 -2,-2.3 168,-0.1 -5,-0.3 357,-0.1 -0.899 74.8 -84.7-133.1 163.5 43.3 30.1 62.8 11 37 A P - 0 0 11 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.335 42.8-114.5 -67.1 149.1 42.9 29.2 59.2 12 38 A K > - 0 0 82 165,-0.1 3,-1.8 1,-0.1 166,-0.1 -0.477 36.2 -98.4 -69.9 159.4 44.7 31.0 56.4 13 39 A I T 3 S+ 0 0 50 1,-0.3 165,-0.1 -2,-0.2 -1,-0.1 0.810 126.2 41.0 -43.4 -40.6 42.6 33.1 53.9 14 40 A N T 3 S+ 0 0 141 2,-0.0 -1,-0.3 164,-0.0 2,-0.2 0.466 85.2 122.7 -91.2 -5.8 42.9 30.1 51.4 15 41 A D < + 0 0 53 -3,-1.8 2,-0.3 2,-0.0 163,-0.1 -0.402 31.3 172.6 -69.4 127.4 42.4 27.2 53.9 16 42 A E - 0 0 83 -2,-0.2 2,-0.4 356,-0.1 356,-0.1 -0.995 12.4-160.2-133.9 131.8 39.4 24.8 53.1 17 43 A F - 0 0 43 -2,-0.3 356,-0.2 354,-0.2 685,-0.1 -0.926 20.4-108.6-120.3 144.8 38.8 21.6 55.0 18 44 A N > - 0 0 40 -2,-0.4 3,-1.9 1,-0.1 354,-0.5 -0.218 35.8-108.3 -62.1 159.4 37.0 18.5 54.3 19 45 A E T 3 S+ 0 0 109 683,-0.4 353,-0.2 1,-0.3 -1,-0.1 0.760 117.7 58.7 -62.8 -22.8 33.8 17.8 56.2 20 46 A S T 3 S+ 0 0 97 680,-0.1 2,-0.4 351,-0.1 -1,-0.3 0.578 82.9 97.0 -84.7 -10.6 35.5 15.0 58.2 21 47 A V < + 0 0 34 -3,-1.9 351,-0.8 1,-0.0 2,-0.1 -0.676 39.7 146.3 -79.8 125.1 38.1 17.4 59.6 22 48 A N E +A 371 0A 15 -2,-0.4 349,-0.2 349,-0.2 102,-0.0 -0.492 29.5 97.4-164.3 82.9 37.2 18.6 63.0 23 49 A E E S-A 370 0A 85 347,-1.9 347,-3.2 -2,-0.1 4,-0.0 -0.977 70.6 -72.9-165.2 162.3 40.0 19.2 65.5 24 50 A P - 0 0 19 0, 0.0 345,-0.3 0, 0.0 3,-0.2 -0.294 27.6-134.9 -63.5 150.6 42.2 21.8 67.0 25 51 A F S S+ 0 0 57 1,-0.3 2,-0.5 -16,-0.2 344,-0.1 0.899 103.2 29.0 -61.4 -45.3 45.1 23.5 65.0 26 52 A I S S+ 0 0 85 342,-0.2 -1,-0.3 -17,-0.1 3,-0.2 -0.962 80.3 177.7-124.3 114.4 47.2 22.9 68.1 27 53 A S + 0 0 63 -2,-0.5 -4,-0.0 -3,-0.2 341,-0.0 -0.462 53.9 47.8-102.0 177.6 46.5 20.0 70.4 28 54 A D S S+ 0 0 144 1,-0.2 -1,-0.2 -2,-0.2 2,-0.1 0.821 71.3 172.9 63.7 34.0 48.2 18.7 73.6 29 55 A N - 0 0 46 -3,-0.2 2,-0.5 135,-0.0 -1,-0.2 -0.422 20.0-145.1 -77.6 147.1 48.4 22.1 75.2 30 56 A K > - 0 0 117 1,-0.1 3,-1.6 -2,-0.1 4,-0.5 -0.959 14.2-151.6-122.2 128.4 49.5 22.3 78.8 31 57 A V G > S+ 0 0 57 -2,-0.5 3,-1.3 1,-0.3 -1,-0.1 0.858 98.4 64.5 -60.7 -37.2 48.3 24.8 81.5 32 58 A E G 3 S+ 0 0 180 1,-0.2 -1,-0.3 -3,-0.1 130,-0.0 0.760 100.4 51.8 -56.4 -24.3 51.7 24.5 83.2 33 59 A D G < S+ 0 0 123 -3,-1.6 -1,-0.2 2,-0.1 -2,-0.2 0.545 81.8 116.2 -90.8 -12.5 53.4 26.1 80.1 34 60 A V S < S- 0 0 17 -3,-1.3 -3,-0.0 -4,-0.5 124,-0.0 -0.333 77.7-102.0 -64.7 137.7 51.1 29.1 79.9 35 61 A R - 0 0 134 1,-0.1 -1,-0.1 -2,-0.1 127,-0.1 -0.323 27.0-161.8 -59.3 136.8 52.8 32.5 80.4 36 62 A K + 0 0 189 -3,-0.1 2,-0.3 2,-0.1 -1,-0.1 0.555 63.7 87.9 -98.2 -10.4 52.1 33.8 83.9 37 63 A D S S- 0 0 82 1,-0.1 3,-0.1 3,-0.0 -2,-0.0 -0.708 82.3-113.0 -90.5 139.1 53.0 37.4 83.1 38 64 A E - 0 0 105 -2,-0.3 -2,-0.1 1,-0.1 -1,-0.1 -0.346 41.2 -98.2 -63.4 146.8 50.6 40.0 81.8 39 65 A Y - 0 0 65 112,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.386 46.6-102.3 -63.4 139.9 51.2 41.2 78.2 40 66 A K - 0 0 177 -3,-0.1 -1,-0.1 -2,-0.1 6,-0.1 -0.564 34.2-157.4 -70.5 131.7 53.0 44.5 78.1 41 67 A L - 0 0 18 -2,-0.3 3,-0.1 4,-0.2 4,-0.1 -0.721 33.4 -86.8-100.1 155.6 51.0 47.6 77.4 42 68 A P > - 0 0 53 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 -0.171 65.7 -72.9 -56.1 157.9 52.5 50.9 76.0 43 69 A P T 3 S+ 0 0 120 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.225 120.1 28.1 -57.0 137.1 53.9 53.3 78.5 44 70 A G T 3 S+ 0 0 33 1,-0.3 62,-2.8 -3,-0.1 63,-0.4 0.415 101.1 98.0 97.9 -0.3 51.2 55.1 80.6 45 71 A Y E < -B 105 0B 42 -3,-1.6 2,-0.3 60,-0.2 -1,-0.3 -0.912 48.9-170.9-126.1 147.3 48.6 52.3 80.3 46 72 A S E -B 104 0B 49 58,-2.0 58,-2.5 -2,-0.3 -6,-0.0 -0.984 28.0-106.9-136.7 148.7 47.7 49.6 82.8 47 73 A W E -B 103 0B 36 -2,-0.3 2,-0.4 56,-0.2 56,-0.2 -0.391 34.6-167.4 -65.4 149.4 45.5 46.5 83.0 48 74 A Y E -B 102 0B 65 54,-2.2 54,-2.9 -2,-0.0 2,-0.7 -0.995 17.3-139.6-137.7 128.9 42.4 46.9 85.1 49 75 A V E -B 101 0B 52 -2,-0.4 2,-0.3 52,-0.2 52,-0.2 -0.859 26.0-144.6 -90.5 119.8 40.1 44.0 86.3 50 76 A C - 0 0 1 50,-2.0 2,-0.8 -2,-0.7 50,-0.2 -0.571 6.6-149.1 -82.8 134.0 36.6 45.2 85.9 51 77 A D > - 0 0 52 -2,-0.3 3,-1.9 1,-0.1 7,-0.4 -0.881 12.8-173.3-100.4 96.6 34.0 44.2 88.5 52 78 A V T 3 S+ 0 0 0 -2,-0.8 -1,-0.1 1,-0.3 39,-0.1 0.694 82.7 61.3 -65.5 -23.1 30.7 44.1 86.3 53 79 A K T 3 S+ 0 0 119 -3,-0.1 2,-0.5 4,-0.0 -1,-0.3 0.534 86.7 86.2 -76.3 -6.2 28.6 43.5 89.4 54 80 A D S <> S- 0 0 69 -3,-1.9 4,-2.8 1,-0.2 5,-0.2 -0.855 78.5-143.1 -92.6 127.3 29.8 46.8 90.8 55 81 A E H > S+ 0 0 122 -2,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.892 97.7 48.5 -63.9 -36.6 27.5 49.5 89.4 56 82 A K H > S+ 0 0 145 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.952 112.4 45.0 -75.8 -39.0 30.3 52.0 89.0 57 83 A D H > S+ 0 0 20 -6,-0.2 4,-1.9 1,-0.2 3,-0.4 0.930 115.4 51.6 -62.8 -39.6 32.8 49.7 87.2 58 84 A R H X S+ 0 0 37 -4,-2.8 4,-2.1 -7,-0.4 -1,-0.2 0.863 105.7 52.8 -65.0 -40.6 29.9 48.6 85.1 59 85 A S H X S+ 0 0 35 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.3 0.797 105.3 56.3 -62.7 -30.1 29.0 52.2 84.2 60 86 A E H X S+ 0 0 47 -4,-1.4 4,-2.1 -3,-0.4 -2,-0.2 0.896 108.7 46.3 -69.5 -44.5 32.6 52.8 83.1 61 87 A I H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.936 111.3 53.4 -57.6 -46.6 32.4 49.9 80.7 62 88 A Y H X S+ 0 0 71 -4,-2.1 4,-3.3 1,-0.2 -2,-0.2 0.912 109.0 48.9 -53.7 -44.7 29.0 51.3 79.5 63 89 A T H X S+ 0 0 73 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.923 109.6 50.7 -63.9 -50.8 30.5 54.7 78.8 64 90 A L H X S+ 0 0 6 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.962 116.3 41.8 -51.4 -51.4 33.4 53.3 76.8 65 91 A L H X S+ 0 0 2 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.931 110.3 55.8 -67.9 -43.4 31.1 51.2 74.7 66 92 A T H < S+ 0 0 16 -4,-3.3 -1,-0.2 -5,-0.2 -2,-0.2 0.914 119.7 33.4 -48.2 -48.4 28.4 54.0 74.3 67 93 A D H < S+ 0 0 79 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.736 134.1 22.0 -81.9 -23.7 31.1 56.3 72.9 68 94 A N H < S+ 0 0 5 -4,-2.3 71,-0.3 -5,-0.2 -3,-0.2 0.355 88.3 106.6-134.2 9.5 33.4 53.9 71.1 69 95 A Y S < S- 0 0 25 -4,-2.2 69,-0.1 10,-0.3 -4,-0.0 -0.027 77.2 -38.4 -90.7-169.8 31.7 50.6 70.1 70 96 A V - 0 0 73 8,-0.1 9,-2.2 1,-0.0 2,-0.3 -0.159 51.4-169.2 -53.9 136.6 30.6 49.4 66.6 71 97 A E B -Q 78 0C 39 7,-0.2 7,-0.2 -3,-0.1 -1,-0.0 -0.893 29.5-104.8-120.6 152.5 29.0 51.6 64.0 72 98 A D > - 0 0 47 5,-1.3 3,-2.6 -2,-0.3 5,-0.1 -0.343 41.0 -99.4 -71.3 159.5 27.3 50.6 60.8 73 99 A D T 3 S+ 0 0 160 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.794 126.5 47.9 -45.3 -38.8 29.2 51.1 57.5 74 100 A D T 3 S- 0 0 113 1,-0.0 -1,-0.3 3,-0.0 -2,-0.1 0.384 107.5-127.4 -87.7 5.6 27.2 54.3 56.8 75 101 A N S < S+ 0 0 92 -3,-2.6 -2,-0.1 2,-0.1 3,-0.1 0.836 72.7 125.4 42.3 43.3 27.8 55.7 60.4 76 102 A I S S+ 0 0 45 1,-0.2 220,-2.6 219,-0.1 2,-0.3 0.765 72.7 26.5 -81.8 -38.0 24.1 56.2 60.9 77 103 A F E - R 0 295C 23 218,-0.2 -5,-1.3 -5,-0.1 2,-0.4 -0.908 54.9-162.5-127.7 155.4 24.1 54.1 64.2 78 104 A R E -QR 71 294C 29 216,-2.0 216,-2.8 -2,-0.3 -7,-0.2 -0.991 37.5-111.0-131.5 130.0 26.3 53.0 67.0 79 105 A F E - R 0 293C 40 -9,-2.2 214,-0.3 -2,-0.4 -10,-0.3 -0.257 28.0-164.7 -56.4 143.0 25.2 50.0 69.1 80 106 A N - 0 0 21 212,-2.9 -1,-0.1 -13,-0.0 -14,-0.1 -0.565 4.3-171.0-133.6 67.4 24.3 51.1 72.7 81 107 A Y - 0 0 9 210,-0.2 -15,-0.1 -2,-0.1 210,-0.1 -0.383 28.0-120.9 -55.8 134.6 24.2 48.0 74.9 82 108 A S > - 0 0 34 208,-0.3 4,-2.4 187,-0.2 5,-0.1 -0.368 14.0-113.3 -78.8 164.4 22.7 49.0 78.2 83 109 A A H > S+ 0 0 30 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.900 119.6 49.7 -59.9 -44.9 24.5 48.7 81.6 84 110 A E H > S+ 0 0 122 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.867 107.8 52.6 -66.7 -31.6 21.9 46.0 82.6 85 111 A F H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.908 107.1 53.3 -65.8 -43.8 22.4 44.1 79.4 86 112 A L H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.920 107.3 51.8 -59.4 -40.9 26.2 44.1 80.1 87 113 A L H X S+ 0 0 48 -4,-2.1 4,-1.1 1,-0.2 -1,-0.2 0.944 113.3 44.3 -55.5 -48.6 25.6 42.6 83.5 88 114 A W H < S+ 0 0 6 -4,-1.9 3,-0.5 1,-0.2 -2,-0.2 0.931 113.9 49.1 -61.1 -47.4 23.4 39.9 82.0 89 115 A A H < S+ 0 0 4 -4,-3.1 3,-0.3 1,-0.2 -1,-0.2 0.771 117.6 40.5 -68.4 -23.1 25.8 39.1 79.2 90 116 A L H < S+ 0 0 3 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.545 107.3 56.9-107.3 -8.1 28.9 38.9 81.4 91 117 A T < + 0 0 23 -4,-1.1 -1,-0.2 -3,-0.5 3,-0.2 -0.082 67.9 140.0-120.5 31.2 27.7 37.1 84.6 92 118 A S > - 0 0 1 -3,-0.3 3,-2.3 1,-0.2 167,-0.1 -0.171 69.8 -49.9 -60.4 170.3 26.4 33.8 83.2 93 119 A P T 3 S+ 0 0 32 0, 0.0 -1,-0.2 0, 0.0 166,-0.0 -0.060 126.6 3.4 -56.2 137.8 27.0 30.6 85.1 94 120 A N T 3 S+ 0 0 143 1,-0.2 -2,-0.1 -3,-0.2 -3,-0.0 0.574 88.2 166.1 66.7 13.1 30.7 30.0 86.1 95 121 A Y < - 0 0 70 -3,-2.3 2,-0.5 23,-0.1 -1,-0.2 -0.186 31.3-133.2 -54.2 153.0 31.8 33.4 84.7 96 122 A L > - 0 0 36 21,-0.4 3,-1.9 1,-0.1 21,-0.2 -0.942 6.6-153.8-109.7 118.9 35.3 34.6 85.6 97 123 A K G > S+ 0 0 101 -2,-0.5 3,-1.8 1,-0.3 -47,-0.2 0.857 97.9 65.3 -58.1 -31.5 35.7 38.2 86.8 98 124 A T G 3 S+ 0 0 67 1,-0.3 -1,-0.3 -49,-0.1 61,-0.1 0.596 91.4 62.0 -71.8 -4.2 39.3 37.9 85.6 99 125 A W G < S+ 0 0 1 -3,-1.9 18,-1.4 18,-0.2 2,-0.7 0.238 83.8 83.4-102.2 17.3 38.0 37.5 82.0 100 126 A H E < S- C 0 116B 0 -3,-1.8 -50,-2.0 16,-0.2 2,-0.5 -0.870 72.2-176.0-119.8 95.2 36.5 41.0 82.0 101 127 A I E -BC 49 115B 0 14,-2.3 14,-1.9 -2,-0.7 2,-0.2 -0.849 12.6-177.2-113.3 122.8 39.6 42.9 81.2 102 128 A G E -BC 48 114B 0 -54,-2.9 -54,-2.2 -2,-0.5 2,-0.4 -0.650 16.2-147.4-103.8 167.7 40.1 46.7 81.0 103 129 A V E -BC 47 113B 1 10,-2.0 9,-3.2 -56,-0.2 10,-1.4 -0.993 17.7-162.5-134.8 126.5 42.9 49.0 80.1 104 130 A K E -BC 46 111B 16 -58,-2.5 -58,-2.0 -2,-0.4 2,-0.7 -0.824 23.4-126.9-102.6 145.7 43.2 52.4 81.8 105 131 A Y E >>> -BC 45 110B 99 5,-2.3 4,-2.1 -2,-0.3 5,-0.9 -0.880 27.5-144.4 -80.4 120.8 45.2 55.5 80.9 106 132 A D T 345S+ 0 0 79 -62,-2.8 -1,-0.1 -2,-0.7 -61,-0.1 0.856 90.6 52.6 -60.1 -44.8 47.1 56.0 84.1 107 133 A A T 345S+ 0 0 90 -63,-0.4 -1,-0.2 1,-0.2 -62,-0.1 0.832 122.5 28.8 -67.7 -32.1 47.1 59.9 84.1 108 134 A S T <45S- 0 0 51 -3,-0.5 -1,-0.2 2,-0.1 -2,-0.2 0.622 94.3-136.0 -96.5 -17.2 43.4 60.2 83.7 109 135 A N T <5 + 0 0 104 -4,-2.1 2,-0.4 1,-0.2 -3,-0.2 0.790 57.4 144.4 59.0 29.6 42.4 57.0 85.4 110 136 A K E < -C 105 0B 141 -5,-0.9 -5,-2.3 2,-0.0 2,-0.4 -0.796 56.8-117.5-103.8 138.0 40.0 56.5 82.5 111 137 A L E +C 104 0B 13 -2,-0.4 -7,-0.3 -7,-0.2 3,-0.1 -0.586 39.2 164.9 -68.1 125.3 39.1 53.1 80.9 112 138 A I E + 0 0 14 -9,-3.2 28,-3.2 -2,-0.4 2,-0.3 0.428 59.8 34.5-123.4 -2.0 40.2 53.2 77.2 113 139 A G E +CD 103 139B 0 -10,-1.4 -10,-2.0 26,-0.2 2,-0.3 -0.993 57.3 174.9-152.0 154.9 40.0 49.6 76.3 114 140 A F E +CD 102 138B 0 24,-2.1 24,-2.6 -2,-0.3 2,-0.3 -0.992 6.8 171.6-156.2 148.4 38.0 46.4 77.1 115 141 A I E -C 101 0B 3 -14,-1.9 -14,-2.3 -2,-0.3 2,-0.3 -0.945 14.7-170.1-152.4 149.8 37.6 42.8 76.1 116 142 A S E -CD 100 135B 1 19,-1.6 19,-2.2 -2,-0.3 2,-0.3 -0.964 9.9-175.2-140.4 156.0 35.5 40.0 77.7 117 143 A A E - 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G 0 365B 27 195,-2.0 195,-3.1 -2,-0.4 2,-0.3 -0.955 23.7-147.3-159.5 161.7 33.4 35.0 68.4 171 197 A T E + G 0 364B 28 -37,-0.4 2,-0.3 -2,-0.3 193,-0.2 -0.952 16.8 171.0-131.1 155.9 31.6 37.0 65.7 172 198 A A E - G 0 363B 23 191,-1.7 191,-3.0 -2,-0.3 4,-0.1 -0.963 39.2-131.1-160.6 153.4 32.4 40.2 63.9 173 199 A G S S+ 0 0 46 -2,-0.3 188,-0.3 189,-0.2 2,-0.2 0.599 89.5 83.6 -75.5 -19.4 31.0 42.2 61.0 174 200 A V S S- 0 0 93 189,-0.1 2,-0.6 -3,-0.0 189,-0.2 -0.597 88.0-113.0 -86.4 150.7 34.5 42.4 59.6 175 201 A Y + 0 0 101 -2,-0.2 -2,-0.1 187,-0.0 -1,-0.0 -0.730 46.9 159.0 -84.2 124.4 36.1 39.7 57.6 176 202 A L - 0 0 33 -2,-0.6 2,-0.5 -4,-0.1 -4,-0.0 -0.836 52.6 -41.8-133.7 163.4 39.1 38.0 59.4 177 203 A P S S- 0 0 0 0, 0.0 -164,-0.1 0, 0.0 -165,-0.1 -0.678 112.4 -20.5 -69.9 120.0 40.8 34.7 58.9 178 204 A K - 0 0 37 -2,-0.5 188,-0.4 1,-0.2 -3,-0.0 0.533 54.5-146.3-143.9 134.9 38.6 32.8 58.4 179 205 A P - 0 0 19 0, 0.0 186,-0.2 0, 0.0 -1,-0.2 -0.258 6.0-158.6 -60.4 145.6 34.8 32.5 59.0 180 206 A V S S- 0 0 11 184,-3.1 194,-2.4 1,-0.3 2,-0.3 0.656 84.2 -8.0 -88.6 -18.0 33.2 29.1 59.7 181 207 A S E -H 364 0B 6 183,-1.0 183,-2.6 192,-0.2 -1,-0.3 -0.947 62.2-146.7-164.1 167.2 29.9 30.7 58.5 182 208 A D E -H 363 0B 63 192,-0.3 2,-0.4 -2,-0.3 181,-0.2 -0.977 13.4-172.5-146.4 125.0 28.5 34.0 57.5 183 209 A A E -H 362 0B 0 179,-2.6 179,-2.6 -2,-0.3 160,-0.1 -0.980 17.0-134.5-125.5 126.8 24.9 35.2 58.0 184 210 A R E -H 361 0B 82 -2,-0.4 158,-1.9 177,-0.3 2,-0.3 -0.366 22.2-117.4 -73.8 153.5 23.3 38.4 56.7 185 211 A Y E - I 0 341B 51 175,-1.7 173,-2.7 156,-0.2 2,-0.3 -0.681 27.6-167.9 -75.7 136.0 21.1 40.6 58.9 186 212 A Y E -HI 357 340B 14 154,-2.7 154,-2.2 -2,-0.3 2,-0.4 -0.973 7.5-151.5-128.1 149.8 17.4 41.1 57.9 187 213 A H E -HI 356 339B 34 169,-2.7 169,-2.9 -2,-0.3 2,-0.7 -0.949 10.2-157.7-125.7 136.8 15.2 43.8 59.4 188 214 A R E - I 0 338B 14 150,-3.1 150,-2.0 -2,-0.4 167,-0.2 -0.909 24.2-136.3-113.8 102.7 11.4 44.0 60.0 189 215 A S E + I 0 337B 12 -2,-0.7 148,-0.2 165,-0.5 3,-0.2 -0.378 33.9 162.2 -55.2 136.3 10.2 47.5 60.3 190 216 A I S S+ 0 0 16 146,-2.2 2,-1.1 1,-0.2 147,-0.2 0.687 77.3 40.8-117.3 -60.2 7.8 48.1 63.2 191 217 A N S > S+ 0 0 61 145,-2.3 4,-2.0 1,-0.2 -1,-0.2 -0.749 73.7 174.5 -93.6 82.4 7.9 51.9 63.6 192 218 A V H > S+ 0 0 10 -2,-1.1 4,-2.0 1,-0.2 5,-0.2 0.879 71.7 54.1 -62.0 -45.5 7.9 52.7 59.9 193 219 A K H > S+ 0 0 79 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.927 109.1 46.7 -64.0 -44.9 7.7 56.4 60.3 194 220 A K H > S+ 0 0 18 1,-0.2 4,-1.7 2,-0.2 6,-0.3 0.929 110.4 53.3 -60.1 -46.7 10.7 56.7 62.6 195 221 A L H <>S+ 0 0 2 -4,-2.0 6,-1.8 1,-0.2 5,-0.9 0.843 111.4 46.5 -58.1 -34.2 12.8 54.5 60.4 196 222 A I H ><5S+ 0 0 33 -4,-2.0 3,-1.8 4,-0.2 -2,-0.2 0.918 109.5 54.6 -69.7 -49.1 11.9 56.8 57.4 197 223 A E H 3<5S+ 0 0 80 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.782 105.7 51.9 -59.9 -28.9 12.7 60.0 59.4 198 224 A I T 3<5S- 0 0 15 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.410 117.9-108.6 -90.9 4.3 16.2 58.9 60.4 199 225 A G T < 5S+ 0 0 56 -3,-1.8 -3,-0.2 2,-0.2 -2,-0.1 0.433 90.1 110.9 89.4 -3.6 17.2 58.1 56.8 200 226 A F S - 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