==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 15-DEC-08 3FJZ . COMPND 2 MOLECULE: 3-PHOSPHOSHIKIMATE 1-CARBOXYVINYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR E.SCHONBRUNN . 427 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15227.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 331 77.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 41 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 101 23.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.2 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 1 3 1 2 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 2 2 0 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 . 1 1 2 8 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 5 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 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 0 179 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 119.2 80.8 -1.0 34.8 2 2 A E + 0 0 106 402,-0.0 403,-2.9 2,-0.0 2,-0.3 -0.401 360.0 173.1 -73.7 155.8 80.7 2.4 36.5 3 3 A S E -A 404 0A 63 401,-0.3 2,-0.4 402,-0.2 401,-0.2 -0.981 22.5-150.1-158.1 162.0 79.0 2.6 39.9 4 4 A L E -A 403 0A 44 399,-1.9 399,-3.4 -2,-0.3 2,-0.5 -0.997 10.8-147.9-136.9 138.0 78.4 5.1 42.7 5 5 A T E -A 402 0A 72 -2,-0.4 2,-0.6 397,-0.3 397,-0.2 -0.942 10.4-151.0-111.6 126.2 77.9 4.2 46.3 6 6 A L E -A 401 0A 27 395,-3.1 395,-1.5 -2,-0.5 3,-0.1 -0.866 11.4-139.2 -98.5 124.5 75.7 6.5 48.4 7 7 A Q - 0 0 132 -2,-0.6 392,-0.1 393,-0.2 388,-0.0 -0.422 42.1 -79.1 -74.2 154.1 76.4 6.8 52.1 8 8 A P - 0 0 56 0, 0.0 2,-0.6 0, 0.0 388,-0.2 -0.255 45.2-140.2 -54.6 139.3 73.4 6.8 54.6 9 9 A I - 0 0 16 386,-3.2 417,-0.1 388,-0.3 3,-0.1 -0.926 10.3-163.0-108.1 118.2 71.8 10.2 54.6 10 10 A A - 0 0 56 415,-0.7 2,-0.3 -2,-0.6 416,-0.2 0.826 69.5 -14.4 -71.6 -32.3 70.8 11.3 58.1 11 11 A R E -C 425 0B 88 414,-1.3 414,-3.2 2,-0.1 2,-0.4 -0.978 57.9-140.3-164.8 152.3 68.4 14.1 57.1 12 12 A V E +C 424 0B 0 244,-1.7 246,-0.5 -2,-0.3 2,-0.3 -0.972 30.9 148.4-122.9 147.0 67.5 16.1 54.0 13 13 A D + 0 0 57 410,-2.0 2,-0.3 -2,-0.4 247,-0.2 -0.898 27.0 65.9-170.1 140.5 66.7 19.8 54.0 14 14 A G E -d 260 0C 22 245,-2.6 247,-2.8 -2,-0.3 2,-0.4 -0.936 68.3 -61.3 144.6-164.5 67.2 22.7 51.6 15 15 A T E -d 261 0C 72 -2,-0.3 2,-0.4 245,-0.2 247,-0.2 -0.983 30.1-165.2-130.3 136.8 66.3 24.2 48.2 16 16 A I E -d 262 0C 1 245,-2.8 247,-2.9 -2,-0.4 2,-0.8 -0.984 14.2-147.1-121.0 127.8 66.8 22.8 44.7 17 17 A N E -d 263 0C 108 -2,-0.4 247,-0.2 245,-0.2 245,-0.1 -0.838 37.3-125.6 -93.0 111.5 66.5 25.0 41.6 18 18 A L - 0 0 7 245,-2.3 3,-0.1 -2,-0.8 2,-0.1 -0.174 9.0-119.2 -64.0 149.2 65.1 22.4 39.2 19 19 A P - 0 0 28 0, 0.0 223,-2.9 0, 0.0 26,-0.2 -0.415 53.7 -77.7 -76.2 163.1 66.6 21.6 35.8 20 20 A G B -G 241 0D 2 24,-0.3 2,-0.3 221,-0.3 221,-0.3 -0.169 52.4 -91.9 -63.7 155.9 64.2 22.3 32.9 21 21 A S > - 0 0 0 219,-2.7 4,-2.5 22,-0.2 24,-0.4 -0.506 24.5-152.5 -70.1 129.1 61.3 20.1 32.0 22 22 A K H > S+ 0 0 16 -2,-0.3 4,-2.4 2,-0.2 5,-0.3 0.916 96.5 51.9 -66.2 -44.1 62.2 17.4 29.4 23 23 A S H > S+ 0 0 12 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.920 116.2 38.8 -59.3 -47.1 58.5 17.3 28.2 24 24 A V H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.917 113.0 57.7 -71.7 -41.7 58.3 21.1 27.7 25 25 A S H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.922 109.1 42.0 -55.5 -51.2 61.8 21.4 26.4 26 26 A N H X S+ 0 0 1 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.865 115.5 49.2 -70.6 -31.9 61.4 19.1 23.4 27 27 A R H X S+ 0 0 3 -4,-1.3 4,-2.8 -5,-0.3 5,-0.3 0.933 112.3 49.3 -68.3 -44.0 58.0 20.3 22.5 28 28 A A H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.893 111.0 49.9 -63.0 -39.8 59.2 23.9 22.6 29 29 A L H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.940 112.8 45.0 -65.0 -46.3 62.2 23.2 20.5 30 30 A L H X S+ 0 0 2 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.944 116.6 45.3 -64.0 -44.7 60.2 21.4 17.8 31 31 A L H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.897 111.9 52.3 -66.7 -38.6 57.5 24.0 17.7 32 32 A A H < S+ 0 0 0 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.898 109.5 50.7 -62.4 -37.9 60.2 26.8 17.7 33 33 A A H < S+ 0 0 0 -4,-2.2 45,-3.3 1,-0.2 46,-0.3 0.886 114.3 42.7 -66.1 -39.0 61.8 25.1 14.7 34 34 A L H < S+ 0 0 4 -4,-2.0 46,-2.1 43,-0.2 197,-0.3 0.751 103.1 89.2 -77.5 -25.7 58.6 24.9 12.8 35 35 A A S < S- 0 0 0 -4,-2.0 44,-2.4 44,-0.2 2,-0.4 -0.106 80.4-111.0 -73.4 167.7 57.5 28.4 13.7 36 36 A H B S+h 232 0E 75 195,-1.9 197,-2.9 42,-0.2 2,-0.1 -0.840 80.8 23.4 -97.5 133.4 58.0 31.8 12.0 37 37 A G S S- 0 0 44 -2,-0.4 40,-2.1 40,-0.4 2,-0.5 -0.323 97.1 -57.4 104.0 174.6 60.3 34.1 13.9 38 38 A K E -I 76 0F 95 38,-0.2 2,-0.4 -2,-0.1 197,-0.2 -0.826 45.6-161.7-100.2 127.7 63.0 33.8 16.5 39 39 A T E -I 75 0F 0 36,-2.4 36,-3.0 -2,-0.5 2,-0.6 -0.891 4.9-156.6-108.6 135.8 62.2 32.1 19.8 40 40 A V E -Ij 74 236F 7 195,-2.9 197,-3.1 -2,-0.4 2,-0.5 -0.956 11.3-165.9-111.9 114.8 64.3 32.5 22.9 41 41 A L E -Ij 73 237F 0 32,-3.2 32,-2.6 -2,-0.6 2,-0.3 -0.873 4.6-170.1 -99.3 132.5 63.9 29.6 25.3 42 42 A T E + j 0 238F 45 195,-2.4 197,-3.0 -2,-0.5 30,-0.2 -0.904 67.7 25.6-120.6 155.0 65.3 30.0 28.8 43 43 A N S S+ 0 0 51 28,-0.5 29,-0.2 -2,-0.3 -22,-0.2 0.759 81.8 169.5 64.5 27.5 65.6 27.3 31.5 44 44 A L - 0 0 1 27,-2.9 -24,-0.3 -3,-0.2 2,-0.3 -0.404 38.0-108.8 -65.6 144.8 65.9 24.7 28.7 45 45 A L - 0 0 4 -24,-0.4 2,-0.7 -26,-0.2 -1,-0.1 -0.599 20.2-152.4 -78.3 135.7 66.9 21.3 30.0 46 46 A D + 0 0 62 -2,-0.3 2,-0.3 366,-0.1 25,-0.1 -0.936 50.0 115.9-105.3 105.4 70.4 20.1 29.1 47 47 A S S > S- 0 0 2 -2,-0.7 4,-2.9 366,-0.1 3,-0.2 -0.944 79.9 -87.3-157.4 171.6 70.1 16.3 29.0 48 48 A D H > S+ 0 0 47 362,-2.8 4,-2.5 -2,-0.3 5,-0.2 0.912 122.6 54.0 -54.9 -45.4 70.4 13.4 26.5 49 49 A D H > S+ 0 0 1 362,-1.9 4,-1.1 361,-0.2 -1,-0.2 0.882 114.2 40.5 -60.8 -37.4 66.8 13.7 25.4 50 50 A V H > S+ 0 0 0 361,-0.3 4,-2.9 -3,-0.2 -1,-0.2 0.896 111.5 56.9 -78.3 -38.6 67.1 17.4 24.6 51 51 A R H X S+ 0 0 89 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.901 105.5 51.8 -59.3 -37.9 70.5 17.0 23.1 52 52 A H H X S+ 0 0 10 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.2 0.888 110.5 48.0 -67.3 -36.7 69.1 14.4 20.6 53 53 A M H X S+ 0 0 0 -4,-1.1 4,-2.5 -5,-0.2 -2,-0.2 0.932 112.3 49.3 -67.0 -45.5 66.4 16.8 19.6 54 54 A L H X S+ 0 0 3 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.931 111.5 48.8 -59.5 -43.8 68.9 19.7 19.2 55 55 A N H X S+ 0 0 75 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.865 109.8 52.3 -63.4 -36.7 71.1 17.4 17.1 56 56 A A H X S+ 0 0 3 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.930 109.7 48.6 -64.8 -45.0 68.1 16.4 15.0 57 57 A L H <>S+ 0 0 0 -4,-2.5 5,-2.7 1,-0.2 4,-0.3 0.924 110.4 51.1 -62.2 -43.4 67.3 20.1 14.4 58 58 A T H ><5S+ 0 0 77 -4,-2.6 3,-1.5 1,-0.2 -1,-0.2 0.932 110.4 49.5 -57.5 -44.9 70.9 20.8 13.4 59 59 A A H 3<5S+ 0 0 49 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.814 107.6 54.4 -65.3 -30.4 70.8 17.9 11.0 60 60 A L T 3<5S- 0 0 15 -4,-1.9 23,-0.5 -5,-0.1 -1,-0.3 0.411 124.3-103.9 -83.9 0.8 67.6 19.2 9.5 61 61 A G T < 5 + 0 0 60 -3,-1.5 2,-0.3 -4,-0.3 -3,-0.2 0.581 67.8 150.5 92.5 7.8 69.2 22.6 8.9 62 62 A V < - 0 0 11 -5,-2.7 2,-0.4 -6,-0.2 -1,-0.3 -0.593 38.4-138.2 -77.4 136.1 67.6 24.6 11.7 63 63 A S E +K 76 0F 74 13,-0.5 13,-2.7 -2,-0.3 2,-0.3 -0.790 37.6 141.8 -96.5 133.0 69.9 27.4 12.9 64 64 A Y E -K 75 0F 42 -2,-0.4 2,-0.3 11,-0.2 11,-0.2 -0.983 34.1-139.7-159.8 164.7 70.2 28.1 16.7 65 65 A T E -K 74 0F 81 9,-1.7 9,-2.2 -2,-0.3 2,-0.4 -0.960 12.9-150.3-131.1 151.6 72.6 29.1 19.4 66 66 A L E -K 73 0F 47 -2,-0.3 7,-0.2 7,-0.2 -2,-0.0 -0.940 17.3-120.3-123.7 145.9 73.0 27.9 22.9 67 67 A S > - 0 0 41 5,-2.3 3,-1.8 -2,-0.4 -1,-0.0 -0.200 43.9 -91.4 -72.5 171.9 74.3 29.7 26.0 68 68 A A T 3 S+ 0 0 112 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.866 129.5 42.7 -55.5 -39.7 77.4 28.3 27.9 69 69 A D T 3 S- 0 0 96 1,-0.0 -1,-0.3 3,-0.0 -23,-0.1 0.386 109.5-123.2 -90.9 8.3 75.2 26.1 30.2 70 70 A R S < S+ 0 0 74 -3,-1.8 -2,-0.1 2,-0.2 3,-0.0 0.659 85.3 108.1 60.9 21.8 73.0 25.0 27.3 71 71 A T + 0 0 42 1,-0.1 -27,-2.9 -25,-0.1 -28,-0.5 0.489 66.6 61.6-104.5 -7.2 69.9 26.3 29.1 72 72 A R - 0 0 109 -30,-0.2 -5,-2.3 -29,-0.2 2,-0.4 -0.988 65.8-178.5-118.5 128.2 69.2 29.4 26.9 73 73 A C E -IK 41 66F 0 -32,-2.6 -32,-3.2 -2,-0.5 2,-0.7 -0.990 17.5-160.6-132.4 126.8 68.5 28.7 23.2 74 74 A E E -IK 40 65F 56 -9,-2.2 -9,-1.7 -2,-0.4 2,-0.5 -0.920 21.1-166.9-106.9 107.7 67.9 31.2 20.5 75 75 A I E -IK 39 64F 0 -36,-3.0 -36,-2.4 -2,-0.7 2,-0.8 -0.860 18.0-145.4-103.1 130.2 66.1 29.4 17.7 76 76 A I E -IK 38 63F 83 -13,-2.7 -13,-0.5 -2,-0.5 -38,-0.2 -0.817 31.7-128.4 -90.9 109.0 65.6 30.8 14.2 77 77 A G - 0 0 16 -40,-2.1 -40,-0.4 -2,-0.8 -44,-0.2 -0.261 3.4-141.1 -61.7 143.1 62.3 29.4 13.1 78 78 A N - 0 0 83 -45,-3.3 -42,-0.2 -46,-0.2 -44,-0.2 0.634 31.1-129.7 -77.0 -16.9 62.0 27.6 9.8 79 79 A G S S+ 0 0 28 -44,-2.4 -44,-0.2 -46,-0.3 -43,-0.2 0.924 76.0 3.7 67.8 41.5 58.6 29.1 9.0 80 80 A G S S- 0 0 13 -46,-2.1 -2,-0.2 -47,-0.2 -1,-0.1 -0.792 109.4 -13.8 140.8 177.3 57.1 25.7 8.1 81 81 A P - 0 0 35 0, 0.0 2,-0.2 0, 0.0 25,-0.1 -0.069 66.4-116.6 -48.0 143.3 57.7 21.9 8.0 82 82 A L - 0 0 5 23,-0.1 2,-0.3 27,-0.0 26,-0.1 -0.555 34.6-159.7 -83.6 149.3 61.3 20.8 8.3 83 83 A H + 0 0 83 -23,-0.5 2,-0.3 -2,-0.2 28,-0.1 -0.977 24.2 149.3-139.8 149.4 62.9 18.9 5.4 84 84 A A - 0 0 11 -2,-0.3 28,-1.9 26,-0.2 2,-0.2 -0.951 16.8-165.2-163.6 153.8 65.7 16.6 4.4 85 85 A E > + 0 0 138 -2,-0.3 3,-0.7 26,-0.2 69,-0.0 -0.639 56.6 72.0-130.1-169.3 66.2 13.9 1.8 86 86 A G T 3 S- 0 0 64 1,-0.2 3,-0.1 -2,-0.2 -1,-0.1 0.773 117.4 -73.6 68.1 29.3 68.6 11.1 1.0 87 87 A A T 3 - 0 0 33 25,-0.7 26,-0.3 1,-0.2 -1,-0.2 0.881 69.3-160.1 50.5 41.3 67.3 8.9 3.8 88 88 A L E < -l 113 0G 54 24,-1.4 26,-3.1 -3,-0.7 2,-0.6 -0.284 11.0-131.7 -51.9 127.3 69.1 11.2 6.2 89 89 A E E -l 114 0G 124 24,-0.2 2,-0.6 -3,-0.1 26,-0.2 -0.776 19.8-166.9 -94.8 125.9 69.5 9.3 9.5 90 90 A L E -l 115 0G 4 24,-3.1 26,-2.5 -2,-0.6 2,-0.6 -0.947 10.9-150.3-109.1 120.1 68.5 11.1 12.7 91 91 A F E +l 116 0G 97 -2,-0.6 26,-0.2 24,-0.2 -35,-0.1 -0.819 16.7 178.5 -93.1 121.5 69.8 9.3 15.8 92 92 A L > - 0 0 0 24,-2.8 3,-2.6 -2,-0.6 7,-0.2 0.122 22.7-145.6-113.8 23.5 67.4 9.9 18.8 93 93 A G T 3 - 0 0 0 1,-0.3 25,-2.4 -41,-0.1 -1,-0.3 -0.278 67.5 -44.0 51.6-122.2 68.9 7.9 21.6 94 94 A N T 3 S+ 0 0 7 23,-0.2 2,-1.1 26,-0.1 -1,-0.3 -0.116 94.6 138.9-129.6 36.2 66.0 6.6 23.6 95 95 A A X> - 0 0 0 -3,-2.6 4,-3.0 1,-0.2 3,-1.6 -0.680 27.8-178.4 -86.9 96.3 64.0 9.9 23.6 96 96 A G H 3> S+ 0 0 3 -2,-1.1 4,-2.9 1,-0.3 -1,-0.2 0.892 82.8 56.9 -60.9 -38.6 60.4 9.0 23.1 97 97 A I H 34 S+ 0 0 5 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.428 114.0 40.1 -78.1 5.0 59.4 12.7 23.1 98 98 A A H <> S+ 0 0 0 -3,-1.6 4,-2.4 -6,-0.2 5,-0.3 0.675 118.6 46.6-106.4 -50.2 61.8 13.3 20.2 99 99 A M H X S+ 0 0 0 -4,-3.0 4,-2.2 -7,-0.2 -2,-0.2 0.933 115.1 42.7 -57.4 -53.0 61.1 10.1 18.3 100 100 A R H X S+ 0 0 4 -4,-2.9 4,-1.6 -5,-0.2 5,-0.2 0.975 117.5 44.2 -64.5 -53.1 57.3 10.2 18.5 101 101 A P H > S+ 0 0 1 0, 0.0 4,-2.9 0, 0.0 -1,-0.2 0.908 116.7 46.5 -58.5 -42.4 56.8 14.0 17.7 102 102 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.874 104.4 61.0 -69.3 -32.8 59.4 13.9 14.9 103 103 A A H < S+ 0 0 0 -4,-2.2 -1,-0.2 -5,-0.3 -3,-0.1 0.901 114.8 36.2 -60.5 -37.6 58.0 10.8 13.3 104 104 A A H >< S+ 0 0 0 -4,-1.6 3,-1.9 -5,-0.2 -2,-0.2 0.940 116.5 50.5 -77.6 -49.8 54.8 12.7 12.8 105 105 A A H >< S+ 0 0 4 -4,-2.9 3,-1.7 1,-0.3 -2,-0.2 0.872 105.2 56.1 -59.8 -39.5 56.1 16.1 12.0 106 106 A L T 3< S+ 0 0 1 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.1 0.431 90.1 75.6 -76.1 2.2 58.5 14.9 9.3 107 107 A C T < S+ 0 0 0 -3,-1.9 50,-2.4 -5,-0.1 49,-0.4 0.510 72.0 108.2 -85.4 -7.0 55.6 13.3 7.5 108 108 A L B < S-o 157 0H 2 -3,-1.7 2,-0.1 -4,-0.2 50,-0.1 -0.573 89.4 -24.1 -75.7 129.7 54.6 16.8 6.3 109 109 A G S S- 0 0 42 48,-0.5 47,-2.6 -2,-0.3 2,-0.3 -0.453 113.6 -29.1 73.6-144.8 55.2 17.4 2.6 110 110 A S E S+ M 0 155G 99 45,-0.2 2,-0.3 -2,-0.1 45,-0.2 -0.785 73.4 142.1-106.7 151.9 57.9 15.3 0.9 111 111 A N E - 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0 0 42 0, 0.0 -23,-0.4 0, 0.0 2,-0.3 -0.328 22.8-151.8 -77.0 170.9 74.4 2.5 51.9 401 401 A V E -A 6 0A 0 -395,-1.5 -395,-3.1 -25,-0.2 2,-0.5 -0.988 6.4-141.4-144.5 143.8 73.3 1.6 48.4 402 402 A T E -Ab 5 378A 10 -25,-2.2 -23,-3.3 -2,-0.3 2,-0.6 -0.944 14.7-157.8-109.4 128.1 75.5 1.1 45.3 403 403 A I E -Ab 4 379A 0 -399,-3.4 -399,-1.9 -2,-0.5 2,-0.1 -0.935 11.7-138.9-107.7 118.3 73.9 2.3 42.1 404 404 A L E S+A 3 0A 21 -25,-2.6 -401,-0.3 -2,-0.6 4,-0.2 -0.493 80.2 3.5 -75.7 147.7 75.3 0.8 38.8 405 405 A D S > S- 0 0 43 -403,-2.9 3,-2.2 -2,-0.1 -1,-0.2 0.901 72.0-179.6 46.7 55.7 75.9 3.1 35.8 406 406 A P G > S+ 0 0 10 0, 0.0 3,-1.6 0, 0.0 11,-0.1 0.739 70.6 72.9 -58.1 -24.5 74.9 6.3 37.7 407 407 A K G > S+ 0 0 133 1,-0.3 3,-2.0 2,-0.2 -2,-0.1 0.560 72.0 86.5 -68.0 -6.1 75.5 8.4 34.5 408 408 A C G X S+ 0 0 16 -3,-2.2 3,-1.6 1,-0.3 -23,-0.4 0.707 71.2 76.7 -66.4 -15.0 72.3 6.9 33.1 409 409 A T G X> S+ 0 0 2 -3,-1.6 4,-3.2 1,-0.3 3,-1.5 0.714 71.9 85.2 -66.0 -16.3 70.5 9.8 35.0 410 410 A A G <4 + 0 0 20 -3,-2.0 -362,-2.8 1,-0.3 -1,-0.3 0.628 64.5 83.8 -61.0 -14.4 71.8 12.0 32.1 411 411 A K G <4 S- 0 0 12 -3,-1.6 -362,-1.9 -364,-0.2 -361,-0.3 0.918 124.9 -11.9 -55.2 -40.4 68.8 11.1 30.0 412 412 A T T <4 S+ 0 0 0 -3,-1.5 -2,-0.2 -4,-0.2 -1,-0.2 0.481 143.7 32.9-135.0 -9.8 66.9 13.8 31.9 413 413 A F >< + 0 0 4 -4,-3.2 3,-1.9 -5,-0.1 4,-0.2 -0.486 51.2 172.8-156.9 74.8 69.0 15.0 34.9 414 414 A P T 3 S+ 0 0 53 0, 0.0 3,-0.3 0, 0.0 -4,-0.2 0.840 85.1 47.9 -53.2 -38.8 72.8 14.9 34.5 415 415 A D T 3> S+ 0 0 104 1,-0.2 4,-2.3 -6,-0.1 3,-0.3 0.189 75.3 121.8 -92.3 19.2 73.4 16.6 37.8 416 416 A Y H <> S+ 0 0 0 -3,-1.9 4,-2.6 1,-0.2 5,-0.2 0.893 72.9 45.1 -48.3 -54.0 71.1 14.5 39.8 417 417 A F H > S+ 0 0 31 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.862 112.0 50.7 -66.1 -33.9 73.6 13.1 42.4 418 418 A E H > S+ 0 0 92 -3,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.909 112.3 49.1 -68.6 -36.2 75.2 16.5 43.0 419 419 A Q H X S+ 0 0 18 -4,-2.3 4,-1.1 2,-0.2 -2,-0.2 0.907 110.0 49.6 -68.6 -40.5 71.7 18.0 43.6 420 420 A L H >X S+ 0 0 2 -4,-2.6 4,-0.7 -5,-0.2 3,-0.5 0.914 110.2 52.4 -62.9 -40.5 70.7 15.1 46.0 421 421 A A H >< S+ 0 0 58 -4,-2.2 3,-0.9 1,-0.2 -1,-0.2 0.873 99.6 64.8 -61.9 -36.2 74.0 15.7 47.9 422 422 A R H 3< S+ 0 0 133 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.863 110.6 35.2 -56.8 -38.7 73.1 19.4 48.1 423 423 A I H << S+ 0 0 0 -4,-1.1 -410,-2.0 -3,-0.5 2,-0.4 0.473 94.5 106.7 -95.8 -0.6 70.1 18.7 50.3 424 424 A S E << -C 12 0B 31 -3,-0.9 2,-0.3 -4,-0.7 -412,-0.2 -0.662 52.4-168.4 -81.1 126.2 71.8 15.7 52.1 425 425 A Q E -C 11 0B 67 -414,-3.2 -414,-1.3 -2,-0.4 -415,-0.7 -0.869 27.6-150.9-118.6 149.8 72.7 16.6 55.7 426 426 A A 0 0 101 -2,-0.3 -1,-0.1 -416,-0.2 -414,-0.1 0.761 360.0 360.0 -85.8 -27.2 74.9 14.8 58.2 427 427 A A 0 0 99 -416,-0.1 -2,-0.1 -417,-0.0 -415,-0.1 0.687 360.0 360.0-121.4 360.0 72.9 16.3 61.1