==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 07-MAY-11 3AYJ . COMPND 2 MOLECULE: PRO-ENZYME OF L-PHENYLALANINE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS; . AUTHOR K.IDA,M.SUGURO,H.SUZUKI . 1370 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42561.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 946 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 195 14.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.1 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 . 99 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 181 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 330 24.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.3 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 4 0 0 6 5 7 2 2 2 2 4 4 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 2 4 0 2 2 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 . 17 14 0 8 4 3 1 0 2 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 . 8 6 2 2 0 0 0 2 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 16 A K 0 0 238 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 136.5 109.1 72.3 81.9 2 17 A I - 0 0 115 1,-0.0 2,-0.3 2,-0.0 7,-0.0 -0.676 360.0-126.6 -78.7 126.9 109.7 68.6 82.4 3 18 A A - 0 0 8 -2,-0.4 3,-0.1 1,-0.1 -1,-0.0 -0.549 25.6-178.0 -72.1 142.4 111.8 67.8 85.5 4 19 A T + 0 0 75 -2,-0.3 143,-1.7 1,-0.1 2,-0.3 0.517 59.6 39.1-120.6 -10.6 114.8 65.7 84.7 5 20 A T B > S-A 146 0A 30 141,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.942 81.8-108.9-136.7 161.5 116.4 65.1 88.1 6 21 A V H > S+ 0 0 0 139,-2.5 4,-3.1 -2,-0.3 137,-0.2 0.896 119.6 52.6 -51.4 -45.7 115.3 64.4 91.7 7 22 A G H > S+ 0 0 5 136,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.873 106.0 52.3 -66.7 -36.6 116.4 67.8 92.7 8 23 A E H > S+ 0 0 90 135,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.937 114.3 42.7 -64.2 -44.9 114.3 69.5 90.0 9 24 A A H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 3,-0.3 0.939 112.2 55.8 -61.6 -45.5 111.2 67.6 91.1 10 25 A R H < S+ 0 0 47 -4,-3.1 4,-0.4 1,-0.2 3,-0.3 0.898 109.8 44.7 -53.6 -50.2 112.1 68.3 94.7 11 26 A L H < S+ 0 0 100 -4,-2.5 3,-0.5 1,-0.2 4,-0.3 0.785 104.1 65.1 -66.0 -30.6 112.3 72.1 94.2 12 27 A S H < S+ 0 0 42 -4,-1.4 3,-0.2 -3,-0.3 -1,-0.2 0.901 116.3 25.1 -59.8 -40.8 109.1 72.1 92.2 13 28 A G S >< S+ 0 0 1 -4,-1.4 3,-1.1 115,-0.4 118,-0.4 0.208 86.4 113.1-108.4 11.0 106.9 71.0 95.1 14 29 A I T 3 S+ 0 0 42 -3,-0.5 14,-0.4 -4,-0.4 -1,-0.2 0.772 85.8 36.6 -58.8 -30.1 108.9 72.2 98.0 15 30 A N T 3 S+ 0 0 45 -4,-0.3 -1,-0.3 -3,-0.2 208,-0.1 0.543 84.4 126.4 -99.3 -5.3 106.4 74.8 99.1 16 31 A Y < - 0 0 8 -3,-1.1 10,-0.4 206,-0.2 2,-0.4 -0.317 39.1-165.8 -66.1 130.9 103.2 73.0 98.3 17 32 A R - 0 0 21 204,-1.7 5,-0.2 8,-0.2 8,-0.1 -0.944 17.3-130.0-113.8 131.5 100.7 72.8 101.2 18 33 A H > - 0 0 11 -2,-0.4 3,-1.9 6,-0.4 6,-0.2 -0.473 25.9-114.1 -79.4 152.3 97.8 70.4 101.2 19 34 A P G > S+ 0 0 1 0, 0.0 3,-0.5 0, 0.0 220,-0.1 0.702 115.1 51.7 -70.2 -21.7 94.4 72.0 102.1 20 35 A D G 3 S+ 0 0 9 1,-0.2 3,-0.0 2,-0.1 -2,-0.0 0.462 124.7 29.9 -86.0 -3.4 93.9 70.0 105.3 21 36 A S G X S+ 0 0 4 -3,-1.9 3,-1.8 3,-0.1 -3,-0.3 -0.280 77.2 148.1-144.4 49.5 97.4 71.1 106.4 22 37 A A T < + 0 0 0 -3,-0.5 -5,-0.1 1,-0.3 210,-0.1 0.613 61.3 66.7 -72.5 -15.1 97.6 74.4 104.7 23 38 A L T 3 S+ 0 0 61 653,-0.2 2,-0.4 649,-0.1 -1,-0.3 0.451 100.9 51.5 -82.1 -1.4 99.8 76.1 107.3 24 39 A V < - 0 0 10 -3,-1.8 2,-0.7 -6,-0.2 -6,-0.4 -0.988 61.9-147.8-143.6 135.7 102.8 73.9 106.7 25 40 A S >> - 0 0 6 -2,-0.4 4,-2.4 1,-0.2 3,-0.6 -0.878 21.3-151.3 -89.0 110.2 105.0 72.8 103.8 26 41 A Y H 3> S+ 0 0 6 -2,-0.7 4,-1.9 -10,-0.4 -1,-0.2 0.887 93.2 55.4 -55.7 -41.9 106.0 69.3 104.9 27 42 A P H 34 S+ 0 0 8 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.857 109.0 48.0 -57.0 -37.5 109.3 69.5 103.0 28 43 A V H X> S+ 0 0 52 -3,-0.6 3,-1.4 -14,-0.4 4,-0.5 0.926 110.9 50.3 -69.1 -42.9 110.2 72.7 104.8 29 44 A A H 3< S+ 0 0 1 -4,-2.4 3,-0.2 1,-0.3 -1,-0.2 0.820 112.6 48.7 -57.1 -35.9 109.3 71.1 108.1 30 45 A A T 3< S+ 0 0 0 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.423 84.9 91.9 -86.1 -2.5 111.5 68.1 107.2 31 46 A A T <4 S+ 0 0 62 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.1 0.952 96.1 23.6 -63.9 -45.6 114.6 70.2 106.2 32 47 A A S < S- 0 0 47 -4,-0.5 635,-0.1 -3,-0.2 30,-0.1 -0.616 113.7 -67.0-107.4 165.8 116.2 70.1 109.6 33 48 A P - 0 0 30 0, 0.0 -1,-0.2 0, 0.0 637,-0.2 -0.231 52.5-118.1 -49.7 147.6 115.6 67.6 112.4 34 49 A L - 0 0 0 25,-0.2 633,-2.4 632,-0.1 2,-0.3 0.719 69.9 -56.3 -69.4 -25.4 112.1 68.0 113.6 35 50 A G B -B 666 0B 3 631,-0.3 2,-0.3 635,-0.0 631,-0.2 -0.944 62.2 -67.5 177.9-156.2 113.0 69.0 117.2 36 51 A R - 0 0 131 629,-1.8 28,-0.1 -2,-0.3 27,-0.1 -0.953 27.7-150.3-131.3 146.7 114.9 68.0 120.3 37 52 A L - 0 0 16 -2,-0.3 3,-0.1 26,-0.2 622,-0.1 -0.871 28.8-105.9-109.3 149.4 114.5 65.3 122.9 38 53 A P - 0 0 53 0, 0.0 -1,-0.0 0, 0.0 29,-0.0 -0.319 55.6 -80.1 -58.8 154.9 115.5 65.4 126.6 39 54 A A S S+ 0 0 74 32,-0.1 2,-0.3 28,-0.1 30,-0.0 -0.257 80.9 108.5 -53.3 145.6 118.7 63.5 127.5 40 55 A G S S- 0 0 22 28,-0.2 32,-2.3 -3,-0.1 2,-0.6 -0.906 71.9 -96.5 161.9 172.1 118.0 59.8 127.9 41 56 A N E -c 72 0C 118 -2,-0.3 2,-0.2 30,-0.3 32,-0.2 -0.935 49.7-158.0-118.4 96.7 118.3 56.3 126.5 42 57 A Y E -c 73 0C 23 30,-2.6 32,-2.8 -2,-0.6 2,-0.5 -0.569 15.7-156.5 -86.0 144.4 115.0 55.8 124.7 43 58 A R E +c 74 0C 106 -2,-0.2 343,-2.4 30,-0.2 344,-1.1 -0.966 25.8 170.9-119.4 109.6 113.4 52.5 123.8 44 59 A I E -cd 75 387C 0 30,-3.0 32,-2.2 -2,-0.5 2,-0.4 -0.896 19.9-153.7-122.4 146.6 111.1 52.9 120.8 45 60 A A E -cd 76 388C 0 342,-1.8 344,-2.6 -2,-0.3 2,-0.5 -0.974 1.5-163.4-114.4 142.4 109.2 50.4 118.6 46 61 A I E -cd 77 389C 1 30,-2.5 32,-2.7 -2,-0.4 2,-0.8 -0.996 10.2-154.2-119.8 121.5 108.1 50.9 115.1 47 62 A V E +cd 78 390C 8 342,-2.9 344,-2.4 -2,-0.5 32,-0.1 -0.890 68.0 28.1 -96.7 109.1 105.5 48.4 113.9 48 63 A G - 0 0 7 30,-2.9 31,-0.2 -2,-0.8 30,-0.1 0.318 60.8-141.5 107.4 126.5 105.9 48.1 110.1 49 64 A G + 0 0 0 4,-0.1 36,-0.1 28,-0.1 37,-0.1 -0.244 63.7 110.9-109.3 41.5 108.8 48.6 107.8 50 65 A G S > S- 0 0 14 341,-0.4 4,-2.8 49,-0.1 5,-0.3 -0.185 92.3 -68.1 -91.9-166.0 107.0 50.3 104.9 51 66 A A H > S+ 0 0 9 48,-0.4 4,-2.3 1,-0.2 5,-0.2 0.882 133.9 48.8 -55.1 -42.7 107.4 53.8 103.8 52 67 A G H > S+ 0 0 6 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.955 115.1 41.9 -64.1 -48.8 105.7 55.2 106.9 53 68 A G H > S+ 0 0 1 338,-0.4 4,-2.3 1,-0.2 -2,-0.2 0.887 116.6 47.8 -68.3 -38.4 107.8 53.2 109.4 54 69 A I H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.899 110.9 50.0 -73.4 -38.9 111.1 53.7 107.5 55 70 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.3 -2,-0.2 0.920 111.3 50.8 -61.1 -42.7 110.6 57.5 107.1 56 71 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.932 109.3 50.8 -60.4 -44.1 109.8 57.6 110.9 57 72 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.902 108.9 52.0 -56.0 -47.2 113.0 55.6 111.5 58 73 A Y H X S+ 0 0 17 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.935 110.3 47.2 -56.0 -47.8 114.9 58.1 109.4 59 74 A E H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.883 110.7 52.5 -65.5 -34.7 113.5 61.1 111.4 60 75 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.876 107.3 53.3 -65.6 -35.1 114.4 59.3 114.6 61 76 A G H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.919 107.2 50.5 -64.4 -41.9 117.9 58.8 113.4 62 77 A R H < S+ 0 0 50 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.893 113.1 46.5 -62.5 -40.8 118.2 62.5 112.7 63 78 A L H >< S+ 0 0 1 -4,-2.0 3,-1.6 1,-0.2 4,-0.4 0.915 108.4 56.0 -63.2 -43.7 116.9 63.2 116.2 64 79 A A H >< S+ 0 0 0 -4,-2.8 3,-1.8 1,-0.3 -2,-0.2 0.879 98.6 60.7 -59.4 -38.0 119.3 60.7 117.7 65 80 A A T 3< S+ 0 0 42 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.716 101.4 54.8 -65.2 -20.9 122.2 62.4 116.2 66 81 A T T < S+ 0 0 47 -3,-1.6 -1,-0.3 -4,-0.5 -2,-0.2 0.489 83.9 109.0 -88.0 -7.2 121.4 65.5 118.2 67 82 A L S < S- 0 0 8 -3,-1.8 3,-0.1 -4,-0.4 -28,-0.1 -0.382 73.8-109.1 -70.9 151.8 121.4 63.8 121.5 68 83 A P > - 0 0 67 0, 0.0 3,-2.3 0, 0.0 -28,-0.2 -0.252 50.2 -68.5 -74.4 168.8 124.2 64.5 124.0 69 84 A A T 3 S+ 0 0 97 1,-0.3 3,-0.1 -30,-0.0 277,-0.0 -0.251 125.3 28.0 -55.1 135.1 127.0 62.0 124.9 70 85 A G T 3 S+ 0 0 64 1,-0.4 -1,-0.3 -3,-0.1 2,-0.2 0.286 103.9 97.2 97.2 -14.8 125.5 59.2 126.9 71 86 A S < + 0 0 15 -3,-2.3 -1,-0.4 -7,-0.1 2,-0.3 -0.665 43.8 141.4-101.6 162.3 122.1 59.5 125.3 72 87 A G E -c 41 0C 10 -32,-2.3 -30,-2.6 -2,-0.2 2,-0.4 -0.986 40.6-108.0 179.7 177.2 120.6 57.4 122.4 73 88 A I E -ce 42 347C 6 273,-2.8 275,-2.3 -2,-0.3 2,-0.5 -0.997 16.4-162.9-128.2 129.2 117.7 55.7 120.8 74 89 A D E -ce 43 348C 45 -32,-2.8 -30,-3.0 -2,-0.4 2,-0.5 -0.953 13.7-166.1-104.5 128.4 117.1 52.0 120.4 75 90 A V E -ce 44 349C 0 273,-2.8 275,-2.4 -2,-0.5 2,-0.6 -0.985 12.4-162.3-119.3 128.4 114.5 51.0 117.9 76 91 A Q E -ce 45 350C 19 -32,-2.2 -30,-2.5 -2,-0.5 2,-0.6 -0.940 15.0-159.6 -97.3 119.6 112.9 47.6 117.5 77 92 A I E -ce 46 351C 0 273,-2.8 275,-3.1 -2,-0.6 2,-0.5 -0.920 2.6-153.6-105.4 120.2 111.2 47.4 114.1 78 93 A Y E +ce 47 352C 2 -32,-2.7 -30,-2.9 -2,-0.6 2,-0.4 -0.811 19.4 170.9 -91.7 128.6 108.6 44.8 113.8 79 94 A E - 0 0 20 273,-2.8 276,-0.1 -2,-0.5 5,-0.1 -0.885 13.7-179.0-144.8 104.6 108.1 43.5 110.2 80 95 A A + 0 0 49 -2,-0.4 275,-0.1 273,-0.2 -1,-0.1 0.610 53.7 101.7 -76.0 -22.4 105.9 40.5 109.6 81 96 A D > - 0 0 36 1,-0.2 3,-1.9 273,-0.1 6,-0.2 -0.599 60.0-155.3 -72.5 117.7 106.3 40.2 105.8 82 97 A P T 3 S+ 0 0 78 0, 0.0 -1,-0.2 0, 0.0 14,-0.1 0.733 93.3 56.6 -65.3 -19.7 108.8 37.4 105.1 83 98 A D T 3 S+ 0 0 40 12,-0.1 15,-1.5 13,-0.1 13,-0.8 0.381 78.6 127.6 -90.8 2.8 109.5 39.1 101.8 84 99 A S B X -g 98 0D 1 -3,-1.9 3,-1.9 13,-0.2 4,-0.3 -0.265 68.9-126.8 -58.4 142.4 110.5 42.4 103.3 85 100 A F G > S+ 0 0 4 13,-2.7 3,-1.2 1,-0.3 -1,-0.1 0.757 107.4 72.1 -55.7 -24.8 113.9 43.9 102.3 86 101 A L G 3 S+ 0 0 12 12,-0.3 3,-0.4 1,-0.3 -1,-0.3 0.737 96.9 47.6 -67.1 -22.9 114.6 44.0 106.1 87 102 A H G < S+ 0 0 54 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.345 102.1 65.6-100.3 5.0 114.9 40.2 106.3 88 103 A D < 0 0 58 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 -0.209 360.0 360.0-113.6 37.4 117.3 40.0 103.3 89 104 A R 0 0 212 -3,-0.4 -1,-0.3 0, 0.0 7,-0.0 -0.689 360.0 360.0 76.5 360.0 120.2 41.9 104.8 90 ! 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 91 109 A A 0 0 22 0, 0.0 17,-2.5 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 151.3 111.0 32.8 87.3 92 110 A I E -I 107 0E 2 446,-2.5 2,-0.5 15,-0.2 15,-0.2 -0.970 360.0-164.7-126.3 113.1 109.6 35.5 89.5 93 111 A K E +I 106 0E 36 13,-2.9 13,-2.9 -2,-0.5 444,-0.0 -0.839 23.6 156.7 -98.7 132.6 111.4 36.5 92.6 94 112 A V > + 0 0 16 -2,-0.5 3,-2.4 11,-0.2 4,-0.2 0.488 37.1 117.5-121.2 -16.9 109.7 38.6 95.3 95 113 A R T 3 S+ 0 0 112 1,-0.3 -12,-0.1 2,-0.2 -11,-0.1 -0.348 91.6 3.0 -63.8 126.2 111.9 37.7 98.4 96 114 A G T 3 S+ 0 0 6 -13,-0.8 -1,-0.3 -2,-0.2 -12,-0.1 0.433 109.3 97.9 83.0 -1.0 113.6 40.8 99.7 97 115 A L < + 0 0 20 -3,-2.4 7,-2.5 7,-0.2 2,-0.4 0.197 62.6 87.3-108.9 15.0 111.9 43.0 97.1 98 116 A K E +gH 84 103D 13 -15,-1.5 -13,-2.7 5,-0.2 -12,-0.3 -0.925 37.2 174.7-114.6 143.4 109.1 44.4 99.3 99 117 A A E > S- H 0 102D 1 3,-3.1 3,-1.9 -2,-0.4 -48,-0.4 -0.762 74.0 -78.0-131.7 78.4 108.8 47.4 101.6 100 118 A G T 3 S- 0 0 26 1,-0.3 -1,-0.2 -2,-0.2 -50,-0.0 -0.438 115.3 -2.7 65.5-121.9 105.1 47.0 102.3 101 119 A R T 3 S+ 0 0 52 -2,-0.3 22,-1.8 -3,-0.1 2,-0.8 0.381 116.6 87.4 -88.0 2.9 103.1 48.3 99.3 102 120 A V E < S+H 99 0D 5 -3,-1.9 -3,-3.1 20,-0.2 2,-0.4 -0.928 70.2 163.6 -91.1 105.6 106.4 49.4 97.5 103 121 A S E -H 98 0D 2 -2,-0.8 18,-2.6 -5,-0.2 19,-0.9 -0.977 25.4-170.6-145.8 118.1 106.7 45.9 96.0 104 122 A A E - J 0 120E 0 -7,-2.5 2,-0.5 -2,-0.4 16,-0.2 -0.854 9.8-157.3-109.8 148.7 108.8 44.6 93.1 105 123 A A E - J 0 119E 0 14,-2.1 14,-2.8 -2,-0.3 2,-0.6 -0.994 15.5-147.6-121.4 122.6 108.8 41.3 91.3 106 124 A L E -IJ 93 118E 11 -13,-2.9 -13,-2.9 -2,-0.5 2,-0.5 -0.831 5.3-153.3 -95.5 118.8 112.0 40.4 89.5 107 125 A V E +IJ 92 117E 0 10,-2.7 9,-3.2 -2,-0.6 10,-1.0 -0.813 32.8 149.5 -93.8 123.7 111.5 38.3 86.3 108 126 A H - 0 0 10 -17,-2.5 7,-0.1 -2,-0.5 473,-0.0 -0.936 51.1-126.0-148.7 169.4 114.6 36.2 85.6 109 127 A N S S- 0 0 113 5,-0.5 6,-0.1 2,-0.4 -17,-0.1 0.047 85.1 -53.2-111.6 19.9 115.7 32.9 84.1 110 128 A G S S+ 0 0 60 -19,-0.1 5,-0.1 1,-0.0 3,-0.1 0.045 125.6 73.2 138.0 -29.2 117.7 31.4 87.0 111 129 A D > - 0 0 92 3,-0.3 3,-2.3 1,-0.1 -2,-0.4 -0.914 58.4-166.7-114.6 102.4 120.2 34.2 87.8 112 130 A P G > S+ 0 0 46 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.706 87.4 65.8 -63.6 -17.3 118.4 37.0 89.6 113 131 A A G 3 S+ 0 0 94 1,-0.3 2,-0.1 -3,-0.1 -5,-0.0 0.581 106.3 44.9 -77.9 -6.3 121.4 39.3 89.1 114 132 A S G < S+ 0 0 83 -3,-2.3 -5,-0.5 388,-0.0 -3,-0.3 -0.562 87.1 165.9-133.0 65.9 120.7 39.1 85.3 115 133 A G < - 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0 0 46 0, 0.0 2,-0.4 0, 0.0 5,-0.2 -0.256 13.6-148.2 -67.8 158.5 84.5 77.0 94.0 209 227 A I B > S-V 212 0I 2 3,-2.5 3,-2.0 1,-0.1 30,-0.1 -0.997 90.1 -4.6-119.9 127.6 86.8 77.2 97.0 210 228 A A T 3 S- 0 0 25 -2,-0.4 -1,-0.1 28,-0.3 3,-0.1 0.874 131.1 -63.1 55.0 37.1 86.8 80.7 98.6 211 229 A N T 3 S+ 0 0 133 1,-0.2 2,-0.3 27,-0.1 -1,-0.3 0.581 119.8 92.3 66.7 12.8 84.5 81.8 95.8 212 230 A V B < S-V 209 0I 38 -3,-2.0 -3,-2.5 -5,-0.1 -1,-0.2 -0.835 85.8 -78.4-132.3 167.9 87.1 81.1 93.1 213 231 A D >> - 0 0 1 -2,-0.3 3,-1.7 -15,-0.2 4,-1.1 -0.349 39.9-119.1 -63.2 145.3 88.2 78.3 90.8 214 232 A P H 3> S+ 0 0 1 0, 0.0 4,-2.7 0, 0.0 3,-0.3 0.848 112.2 66.0 -51.3 -37.2 90.3 75.6 92.4 215 233 A A H 3> S+ 0 0 16 -19,-2.4 4,-1.3 1,-0.3 -18,-0.1 0.848 99.7 51.8 -52.9 -37.9 93.1 76.4 90.0 216 234 A K H <> S+ 0 0 38 -3,-1.7 4,-1.0 -18,-0.3 -1,-0.3 0.867 109.8 48.1 -70.2 -37.2 93.4 79.8 91.7 217 235 A I H X S+ 0 0 7 -4,-1.1 4,-2.7 -3,-0.3 3,-0.4 0.891 106.0 58.1 -70.8 -39.1 93.7 78.1 95.2 218 236 A A H X S+ 0 0 22 -4,-2.7 4,-1.5 1,-0.3 -1,-0.2 0.885 102.6 54.1 -56.7 -39.2 96.3 75.7 93.9 219 237 A A H < S+ 0 0 62 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.848 110.1 47.0 -66.0 -34.6 98.5 78.6 92.9 220 238 A I H >< S+ 0 0 53 -4,-1.0 3,-1.6 -3,-0.4 -2,-0.2 0.922 110.2 52.1 -70.0 -46.4 98.3 80.0 96.5 221 239 A L H 3< S+ 0 0 0 -4,-2.7 -204,-1.7 1,-0.3 -2,-0.2 0.753 114.2 44.9 -59.6 -30.2 99.0 76.6 98.1 222 240 A N T 3< S+ 0 0 60 -4,-1.5 -1,-0.3 -206,-0.2 2,-0.2 0.316 89.2 109.8 -98.2 8.6 102.0 76.3 95.9 223 241 A A < - 0 0 31 -3,-1.6 -3,-0.0 1,-0.1 -206,-0.0 -0.548 64.3-139.9 -76.5 154.2 103.4 79.9 96.5 224 242 A A S S+ 0 0 67 1,-0.3 -1,-0.1 -2,-0.2 -4,-0.0 0.942 100.7 21.5 -70.1 -43.0 106.7 80.5 98.6 225 243 A T S S+ 0 0 131 -3,-0.0 -1,-0.3 3,-0.0 3,-0.1 -0.515 82.6 159.7-133.9 82.1 105.1 83.6 100.2 226 244 A P - 0 0 18 0, 0.0 2,-0.7 0, 0.0 3,-0.1 -0.033 62.1 -68.2 -70.0 173.0 101.5 83.6 100.0 227 245 A P > - 0 0 85 0, 0.0 4,-2.6 0, 0.0 5,-0.2 -0.426 39.9-151.6 -49.4 120.3 99.4 85.5 102.2 228 246 A A H > S+ 0 0 80 -2,-0.7 4,-2.4 2,-0.2 5,-0.1 0.922 106.2 53.6 -50.2 -41.5 100.0 83.9 105.7 229 247 A D H > S+ 0 0 109 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.867 104.1 54.9 -63.8 -38.7 96.5 85.2 106.1 230 248 A A H > S+ 0 0 20 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.908 108.2 47.0 -63.5 -41.7 95.5 83.4 103.0 231 249 A L H X S+ 0 0 13 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.925 112.6 49.4 -67.8 -39.2 96.8 80.0 104.3 232 250 A E H X S+ 0 0 60 -4,-2.4 4,-2.7 -5,-0.2 5,-0.4 0.892 110.7 50.7 -63.2 -42.6 95.1 80.4 107.6 233 251 A R H X>S+ 0 0 77 -4,-2.4 5,-2.6 2,-0.2 4,-2.0 0.902 112.0 46.7 -66.9 -36.6 91.8 81.3 105.9 234 252 A I H <>S+ 0 0 5 -4,-2.3 5,-2.4 3,-0.2 -2,-0.2 0.949 115.8 46.6 -61.8 -48.9 92.0 78.3 103.7 235 253 A Q H <5S+ 0 0 26 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.883 126.7 24.3 -61.8 -43.4 92.9 76.1 106.6 236 254 A T H <5S+ 0 0 67 -4,-2.7 -3,-0.2 -5,-0.2 -1,-0.2 0.742 136.5 13.0-100.3 -26.2 90.2 77.3 109.1 237 255 A K T X5S+ 0 0 73 -4,-2.0 4,-2.2 -5,-0.4 -3,-0.2 0.784 120.6 39.6-117.6 -66.3 87.5 78.8 106.9 238 256 A Y H > S+ 0 0 52 0, 0.0 4,-2.6 0, 0.0 -2,-0.2 0.893 110.3 51.5 -55.7 -37.2 86.3 73.5 105.9 241 259 A E H X S+ 0 0 85 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.896 108.5 50.9 -67.5 -37.4 83.4 75.2 104.1 242 260 A F H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.931 111.2 48.2 -61.1 -45.4 84.1 73.2 101.0 243 261 A I H X S+ 0 0 15 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.919 109.4 52.8 -58.9 -47.4 84.1 70.0 103.0 244 262 A A H < S+ 0 0 88 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.892 117.4 38.2 -59.0 -38.8 80.8 71.1 104.7 245 263 A Q H < S+ 0 0 115 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.868 130.5 23.0 -76.8 -37.8 79.2 71.6 101.3 246 264 A Y H >< S+ 0 0 36 -4,-2.7 3,-2.1 -5,-0.1 60,-0.6 0.395 86.5 94.4-122.5 -2.9 80.7 68.8 99.3 247 265 A D T 3< S+ 0 0 6 -4,-2.4 355,-1.3 1,-0.3 356,-0.2 0.745 92.2 54.0 -64.3 -18.2 81.8 65.9 101.5 248 266 A G T 3 S+ 0 0 22 -5,-0.2 689,-0.6 353,-0.2 2,-0.5 0.230 93.9 86.9 -90.4 8.2 78.4 64.5 100.8 249 267 A L B < S-W 936 0J 19 -3,-2.1 57,-3.0 687,-0.1 58,-0.3 -0.961 70.6-140.3-113.4 122.8 78.8 64.7 97.0 250 268 A T B > -X 305 0K 0 685,-0.6 4,-2.4 -2,-0.5 55,-0.2 -0.393 21.9-117.0 -75.5 159.0 80.5 61.9 95.1 251 269 A L H > S+ 0 0 0 53,-2.7 4,-2.9 50,-0.3 5,-0.2 0.921 117.3 53.5 -56.3 -46.0 82.8 62.4 92.2 252 270 A G H > S+ 0 0 4 50,-2.8 4,-2.0 52,-0.2 -1,-0.2 0.892 108.4 48.9 -61.2 -38.5 80.4 60.7 89.9 253 271 A A H > S+ 0 0 6 49,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.900 111.1 50.8 -66.1 -39.7 77.6 62.9 91.0 254 272 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.914 108.2 51.4 -65.3 -43.9 79.7 66.0 90.4 255 273 A V H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.932 110.5 50.0 -56.5 -45.5 80.7 64.9 86.9 256 274 A R H X S+ 0 0 23 -4,-2.0 4,-2.6 -5,-0.2 -2,-0.2 0.905 109.0 51.1 -62.5 -39.7 77.0 64.4 86.1 257 275 A E H X S+ 0 0 89 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.926 112.7 46.2 -59.7 -46.5 76.1 67.8 87.4 258 276 A I H X S+ 0 0 6 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.940 114.0 47.3 -62.3 -47.9 78.9 69.4 85.2 259 277 A V H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.891 109.5 55.2 -62.7 -39.5 77.9 67.4 82.1 260 278 A T H X S+ 0 0 36 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.922 109.4 45.1 -60.3 -47.4 74.2 68.3 82.6 261 279 A V H X S+ 0 0 71 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.917 114.3 49.3 -64.8 -42.8 74.8 72.0 82.7 262 280 A A H X>S+ 0 0 10 -4,-2.2 5,-2.0 1,-0.2 6,-1.0 0.895 111.4 49.7 -63.2 -40.1 77.2 71.8 79.6 263 281 A F H ><5S+ 0 0 27 -4,-2.7 3,-0.7 1,-0.2 -2,-0.2 0.929 110.3 49.4 -65.2 -43.6 74.6 69.8 77.7 264 282 A E H 3<5S+ 0 0 149 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.858 111.0 50.6 -59.4 -37.8 71.8 72.3 78.5 265 283 A K H 3<5S- 0 0 179 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.676 116.8-116.6 -74.6 -17.4 74.1 75.2 77.4 266 284 A G T <<5S+ 0 0 56 -4,-0.9 -3,-0.2 -3,-0.7 -2,-0.1 0.498 81.0 123.9 87.1 11.8 74.8 73.3 74.1 267 285 A T S - 0 0 66 0, 0.0 3,-1.4 0, 0.0 2,-0.3 -0.394 59.0-103.6 -57.3 140.9 73.4 65.0 71.5 271 289 A V G >> S- 0 0 9 1,-0.3 4,-2.4 5,-0.2 3,-1.9 -0.448 99.1 -6.1 -71.7 131.0 75.4 61.8 71.1 272 290 A D G 34 S- 0 0 85 1,-0.3 -1,-0.3 -2,-0.3 857,-0.0 0.484 112.2 -89.0 65.9 0.3 75.1 60.2 67.6 273 291 A G G <4 S+ 0 0 63 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.452 124.4 71.9 77.4 -1.9 72.6 63.1 67.0 274 292 A V T <4 + 0 0 75 -3,-1.9 -2,-0.2 2,-0.1 2,-0.1 0.649 60.3 96.6-126.1 -33.8 70.1 60.4 68.3 275 293 A L S < S- 0 0 15 -4,-2.4 -4,-0.1 4,-0.1 -2,-0.1 -0.501 73.7-116.1 -67.6 147.3 70.3 59.7 72.0 276 294 A D > - 0 0 63 -2,-0.1 4,-2.8 -6,-0.1 -5,-0.2 0.007 39.2 -85.5 -73.8 178.8 67.8 61.6 74.2 277 295 A V H > S+ 0 0 85 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.959 127.4 40.3 -56.7 -51.2 68.8 64.1 76.8 278 296 A D H > S+ 0 0 62 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.899 115.8 51.3 -70.6 -33.9 69.4 61.7 79.7 279 297 A E H > S+ 0 0 20 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.895 111.3 48.3 -66.2 -40.6 71.0 59.1 77.5 280 298 A S H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.946 113.1 46.6 -63.4 -50.2 73.4 61.7 76.0 281 299 A I H X S+ 0 0 8 -4,-2.8 4,-2.6 -5,-0.2 -2,-0.2 0.933 113.9 49.4 -56.8 -46.5 74.3 63.0 79.5 282 300 A S H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 5,-0.2 0.916 108.9 51.8 -62.4 -42.4 74.8 59.5 80.8 283 301 A Y H X S+ 0 0 6 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.946 112.1 46.6 -57.0 -48.3 77.0 58.5 77.8 284 302 A Y H X S+ 0 0 5 -4,-2.4 4,-2.7 1,-0.2 5,-0.3 0.887 110.9 51.5 -63.5 -41.6 79.2 61.5 78.4 285 303 A V H X S+ 0 0 2 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.909 115.5 42.0 -58.1 -45.1 79.4 60.8 82.1 286 304 A E H X S+ 0 0 5 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.856 112.1 54.3 -75.0 -34.7 80.4 57.3 81.5 287 305 A L H X S+ 0 0 0 -4,-2.8 4,-1.7 -5,-0.2 -2,-0.2 0.951 112.5 43.5 -59.2 -53.7 82.8 58.2 78.6 288 306 A F H X S+ 0 0 1 -4,-2.7 4,-2.4 1,-0.2 10,-0.4 0.910 108.6 61.3 -58.7 -39.7 84.6 60.6 80.9 289 307 A G H < S+ 0 0 0 -4,-1.9 10,-2.8 -5,-0.3 9,-0.5 0.905 109.2 40.2 -55.0 -43.2 84.5 58.0 83.6 290 308 A R H < S+ 0 0 7 -4,-2.0 7,-0.7 7,-0.2 -1,-0.2 0.801 116.3 51.8 -77.1 -27.3 86.5 55.6 81.4 291 309 A F H < S+ 0 0 12 -4,-1.7 5,-0.4 -5,-0.2 3,-0.3 0.960 87.9 179.3 -75.9 -55.5 88.9 58.3 80.1 292 310 A G < - 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