==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-MAY-13 4KQ8 . COMPND 2 MOLECULE: CYTOCHROME P450 19A1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.GHOSH,G.DI NARDO,J.GRISWOLD . 452 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19737.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 331 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 6.2 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 . 3 0.7 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 . 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 . 34 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 196 43.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 2 0 1 1 1 1 1 2 0 0 1 3 0 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 0 0 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 0 0 PARALLEL BRIDGES PER LADDER . 2 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 45 A S 0 0 136 0, 0.0 341,-0.1 0, 0.0 340,-0.0 0.000 360.0 360.0 360.0 -53.5 74.5 81.4 33.2 2 46 A S - 0 0 95 339,-0.3 0, 0.0 1,-0.1 0, 0.0 0.366 360.0 -75.1 72.3 152.8 77.0 82.1 36.1 3 47 A I - 0 0 50 1,-0.1 38,-0.1 38,-0.0 -1,-0.1 -0.683 38.0-144.3 -99.4 116.7 77.8 79.8 39.0 4 48 A P + 0 0 43 0, 0.0 38,-2.6 0, 0.0 -1,-0.1 -0.125 45.1 94.5 -66.4 164.9 75.5 79.1 42.1 5 49 A G S S- 0 0 22 36,-0.2 38,-0.1 31,-0.0 36,-0.0 -0.749 71.7 -37.3 138.1 174.9 76.7 78.6 45.7 6 50 A P S S- 0 0 8 0, 0.0 36,-0.1 0, 0.0 2,-0.0 -0.222 71.2 -89.1 -66.6 159.4 77.4 80.3 49.0 7 51 A G - 0 0 51 1,-0.1 2,-0.5 6,-0.1 0, 0.0 -0.319 29.2-122.6 -69.6 147.5 78.8 83.8 49.1 8 52 A Y + 0 0 152 5,-0.1 -1,-0.1 1,-0.1 0, 0.0 -0.812 28.4 179.8 -82.6 126.8 82.5 84.6 49.2 9 53 A C - 0 0 82 -2,-0.5 -1,-0.1 0, 0.0 -2,-0.0 0.033 58.6 -87.0-117.8 29.5 83.2 86.6 52.3 10 54 A M S S- 0 0 155 1,-0.2 -2,-0.0 2,-0.1 0, 0.0 0.964 106.1 -16.0 51.3 92.8 86.9 87.2 51.9 11 55 A G S S+ 0 0 30 1,-0.1 4,-0.2 4,-0.0 -1,-0.2 0.131 129.3 79.4 78.0 -22.1 88.4 84.0 53.5 12 56 A I S >> S+ 0 0 89 2,-0.2 4,-2.9 3,-0.1 3,-1.3 0.931 83.5 56.4 -84.0 -49.2 85.1 83.2 55.3 13 57 A G H 3> S+ 0 0 1 1,-0.3 4,-2.1 2,-0.2 31,-0.2 0.930 112.4 43.1 -44.5 -61.8 83.1 81.6 52.5 14 58 A P H 3> S+ 0 0 20 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.598 115.7 52.5 -57.6 -17.6 85.9 79.0 51.9 15 59 A L H <> S+ 0 0 118 -3,-1.3 4,-1.7 -4,-0.2 -2,-0.2 0.821 110.1 42.8 -92.4 -37.1 86.2 78.5 55.7 16 60 A I H X S+ 0 0 89 -4,-2.9 4,-2.4 -3,-0.2 -3,-0.2 0.869 117.6 49.1 -71.2 -35.8 82.5 77.9 56.6 17 61 A S H X S+ 0 0 0 -4,-2.1 4,-1.5 -5,-0.4 -2,-0.2 0.916 113.3 43.7 -73.2 -44.5 82.2 75.6 53.5 18 62 A H H X S+ 0 0 11 -4,-0.9 4,-2.0 2,-0.2 3,-0.3 0.927 114.4 52.6 -61.3 -46.1 85.4 73.5 54.3 19 63 A G H X S+ 0 0 31 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.908 104.9 54.7 -53.8 -46.2 84.2 73.5 57.9 20 64 A R H X S+ 0 0 83 -4,-2.4 4,-2.4 1,-0.2 5,-0.4 0.849 108.9 49.1 -56.6 -38.1 80.8 72.1 56.9 21 65 A F H X S+ 0 0 1 -4,-1.5 4,-1.2 -3,-0.3 -1,-0.2 0.851 113.0 45.7 -70.9 -38.2 82.6 69.3 55.0 22 66 A L H < S+ 0 0 74 -4,-2.0 -2,-0.2 2,-0.1 -1,-0.2 0.842 118.2 43.6 -72.9 -33.9 84.8 68.4 58.1 23 67 A W H < S+ 0 0 221 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.966 126.1 26.3 -76.8 -55.4 81.9 68.6 60.4 24 68 A M H < S- 0 0 60 -4,-2.4 407,-0.3 -5,-0.2 4,-0.3 0.811 110.0-111.6 -80.2 -32.6 79.1 66.8 58.5 25 69 A G X - 0 0 7 -4,-1.2 4,-3.0 -5,-0.4 3,-0.3 0.155 31.7 -85.5 98.0 137.8 81.3 64.5 56.4 26 70 A I H > S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 406,-0.2 0.828 122.9 53.2 -42.4 -54.4 81.7 64.7 52.6 27 71 A G H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 405,-0.3 0.925 117.9 32.9 -48.8 -59.2 78.6 62.6 51.7 28 72 A S H > S+ 0 0 33 403,-2.0 4,-2.6 -3,-0.3 -1,-0.2 0.844 116.2 58.1 -72.8 -33.3 76.0 64.6 53.8 29 73 A A H X S+ 0 0 0 -4,-3.0 4,-2.0 402,-0.4 -2,-0.2 0.886 108.2 47.4 -59.8 -40.4 77.9 67.9 53.2 30 74 A C H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.3 5,-0.2 0.928 111.7 48.7 -68.0 -47.4 77.4 67.4 49.4 31 75 A N H X S+ 0 0 36 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.906 108.9 55.8 -58.1 -42.1 73.8 66.5 49.7 32 76 A Y H X S+ 0 0 64 -4,-2.6 4,-2.8 2,-0.2 3,-0.5 0.973 111.1 41.4 -51.2 -63.8 73.2 69.5 51.9 33 77 A Y H X S+ 0 0 2 -4,-2.0 4,-2.1 1,-0.3 -1,-0.2 0.862 114.6 51.8 -56.8 -43.0 74.6 72.0 49.4 34 78 A N H < S+ 0 0 0 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.862 113.1 46.0 -60.1 -36.8 72.9 70.2 46.5 35 79 A R H < S+ 0 0 153 -4,-2.4 -2,-0.2 -3,-0.5 -1,-0.2 0.882 117.9 41.6 -77.8 -39.2 69.6 70.4 48.4 36 80 A V H < S+ 0 0 73 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.996 127.2 17.7 -68.5 -67.1 70.1 74.1 49.4 37 81 A Y S < S- 0 0 82 -4,-2.1 4,-0.1 1,-0.2 0, 0.0 0.183 108.6 -48.1 -86.4-154.4 71.5 75.5 46.1 38 82 A G - 0 0 30 2,-0.3 -1,-0.2 1,-0.1 3,-0.1 0.006 48.3-106.2 -71.0 179.5 71.3 74.0 42.5 39 83 A E S S+ 0 0 46 1,-0.2 15,-2.7 14,-0.1 16,-0.9 0.517 119.3 47.8 -81.1 -8.4 72.2 70.5 41.2 40 84 A F E S+A 53 0A 10 13,-0.2 2,-0.3 14,-0.2 -2,-0.3 -0.981 84.5 145.2-129.8 118.4 75.3 72.3 39.9 41 85 A M E -A 52 0A 0 11,-1.0 11,-3.0 -2,-0.4 2,-0.3 -0.997 40.9-117.6-159.5 158.0 77.0 74.5 42.4 42 86 A R E +A 51 0A 34 -38,-2.6 2,-0.2 -2,-0.3 9,-0.2 -0.711 32.0 156.7-105.0 145.1 80.4 75.8 43.7 43 87 A V E -A 50 0A 0 7,-2.6 7,-2.0 -2,-0.3 2,-0.4 -0.752 34.2-114.7-142.4-172.3 82.1 75.3 47.1 44 88 A W E -A 49 0A 11 5,-0.2 2,-0.4 -2,-0.2 5,-0.2 -0.953 20.7-179.5-137.0 120.9 85.6 75.5 48.6 45 89 A I S S- 0 0 5 3,-1.5 304,-0.1 -2,-0.4 -30,-0.1 -0.961 77.8 -24.7-109.3 139.8 87.6 72.6 50.1 46 90 A S S S- 0 0 36 -2,-0.4 -28,-0.1 139,-0.2 139,-0.0 -0.250 122.3 -43.9 45.9-145.9 91.0 73.8 51.2 47 91 A G S S+ 0 0 63 -3,-0.1 -1,-0.2 2,-0.1 -29,-0.0 0.978 117.5 96.5 -63.8 -55.0 91.8 76.9 49.1 48 92 A E S S- 0 0 79 -4,-0.1 -3,-1.5 1,-0.1 2,-0.2 0.109 77.0-117.1 -52.3 138.2 90.7 75.4 45.8 49 93 A E E -A 44 0A 85 -5,-0.2 300,-2.0 -7,-0.0 2,-0.3 -0.485 35.3-173.5 -64.1 138.4 87.3 75.9 44.2 50 94 A T E -Ab 43 349A 0 -7,-2.0 -7,-2.6 298,-0.2 2,-0.3 -0.993 15.0-141.9-142.2 136.3 85.3 72.7 43.9 51 95 A L E -Ab 42 350A 7 298,-2.8 300,-2.8 -2,-0.3 2,-0.5 -0.752 4.6-155.7 -96.7 139.4 82.0 72.0 42.2 52 96 A I E +Ab 41 351A 0 -11,-3.0 -11,-1.0 -2,-0.3 2,-0.4 -0.959 23.9 178.1-117.6 114.3 79.4 69.6 43.5 53 97 A I E +Ab 40 352A 1 298,-2.6 300,-2.4 -2,-0.5 -13,-0.2 -0.934 32.0 165.2-125.7 133.4 77.2 68.2 40.8 54 98 A S + 0 0 4 -15,-2.7 2,-0.4 -2,-0.4 -14,-0.2 0.318 43.6 124.9-120.6 0.9 74.3 65.8 40.5 55 99 A K >> - 0 0 95 -16,-0.9 4,-2.7 1,-0.2 3,-0.5 -0.499 57.5-144.8 -63.8 116.0 73.1 66.8 37.1 56 100 A S H 3> S+ 0 0 0 -2,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.815 98.2 53.5 -52.7 -37.2 73.1 63.6 35.0 57 101 A S H 3> S+ 0 0 36 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.861 111.0 45.4 -68.5 -38.6 74.2 65.4 31.9 58 102 A S H <> S+ 0 0 0 -3,-0.5 4,-3.0 2,-0.2 -2,-0.2 0.928 112.0 52.2 -66.0 -49.0 77.2 67.0 33.7 59 103 A M H X S+ 0 0 1 -4,-2.7 4,-2.4 1,-0.2 5,-0.3 0.931 111.7 47.2 -49.8 -49.2 78.1 63.6 35.2 60 104 A F H X S+ 0 0 47 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.876 112.2 48.3 -65.7 -39.9 78.0 62.0 31.8 61 105 A H H X S+ 0 0 43 -4,-1.9 4,-1.5 2,-0.2 -1,-0.2 0.913 113.8 48.3 -64.4 -43.7 80.1 64.8 30.2 62 106 A I H < S+ 0 0 0 -4,-3.0 -2,-0.2 1,-0.2 6,-0.2 0.913 113.6 42.9 -65.4 -47.8 82.7 64.6 33.0 63 107 A M H < S+ 0 0 1 -4,-2.4 328,-0.5 -5,-0.2 -1,-0.2 0.804 111.9 56.4 -73.2 -28.2 83.2 60.8 33.1 64 108 A K H < S+ 0 0 105 -4,-1.5 2,-0.3 -5,-0.3 -1,-0.2 0.886 94.3 74.7 -69.4 -44.0 83.3 60.5 29.3 65 109 A H S >< S- 0 0 60 -4,-1.5 3,-1.4 -5,-0.1 4,-0.0 -0.543 73.3-137.7 -85.0 137.6 86.1 62.9 28.6 66 110 A N G > S+ 0 0 97 1,-0.3 3,-1.3 -2,-0.3 -1,-0.1 0.657 96.5 73.9 -60.8 -18.9 89.8 62.1 29.2 67 111 A H G 3 S+ 0 0 40 1,-0.3 267,-3.2 2,-0.1 268,-0.7 0.263 93.4 52.7 -90.0 15.8 90.4 65.6 30.6 68 112 A Y G < S+ 0 0 0 -3,-1.4 2,-1.9 265,-0.2 264,-0.6 0.150 71.5 119.9-121.5 15.3 88.6 64.7 33.8 69 113 A S < + 0 0 5 -3,-1.3 2,-0.3 262,-0.1 264,-0.1 -0.204 58.1 83.2 -76.9 47.5 90.7 61.5 34.5 70 114 A S - 0 0 3 -2,-1.9 262,-1.4 262,-0.5 2,-0.2 -0.956 57.1-158.3-140.3 161.0 92.0 62.8 37.8 71 115 A R - 0 0 39 -2,-0.3 2,-0.3 260,-0.3 260,-0.2 -0.494 17.1-138.6-116.6-166.9 90.8 63.0 41.4 72 116 A F + 0 0 5 -2,-0.2 2,-0.2 278,-0.1 258,-0.1 -0.966 28.1 137.3-150.2 168.2 91.9 65.3 44.2 73 117 A G - 0 0 17 -2,-0.3 112,-0.2 112,-0.0 111,-0.1 -0.880 60.2 -46.4 168.0 165.8 92.8 65.4 47.9 74 118 A S > - 0 0 8 110,-2.8 4,-2.5 -2,-0.2 5,-0.2 -0.320 44.9-146.4 -47.2 121.9 95.1 66.7 50.6 75 119 A K H > S+ 0 0 114 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.918 103.4 44.2 -57.3 -42.4 98.6 66.1 49.2 76 120 A L H > S+ 0 0 69 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.854 112.3 52.8 -72.3 -34.8 99.8 65.5 52.8 77 121 A G H > S+ 0 0 0 109,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.867 113.6 43.4 -64.4 -39.6 96.7 63.3 53.4 78 122 A L H X>S+ 0 0 2 -4,-2.5 5,-2.1 2,-0.2 4,-1.2 0.889 110.1 54.3 -73.5 -42.3 97.5 61.3 50.4 79 123 A Q H <5S+ 0 0 102 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.843 107.5 54.4 -59.6 -34.5 101.3 61.1 51.1 80 124 A C H <5S+ 0 0 22 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.936 112.9 38.3 -64.2 -51.7 100.3 59.7 54.5 81 125 A I H <5S- 0 0 0 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.566 113.9-118.3 -77.6 -8.7 98.1 56.9 53.2 82 126 A G T <5S+ 0 0 6 -4,-1.2 5,-0.3 -5,-0.1 -3,-0.2 0.732 85.4 113.4 77.5 24.4 100.6 56.4 50.4 83 127 A M > < + 0 0 0 -5,-2.1 3,-1.3 3,-0.2 2,-1.0 0.487 36.1 118.6 -99.1 -7.2 98.2 57.1 47.6 84 128 A H T 3 S- 0 0 46 -6,-1.1 7,-0.2 1,-0.3 -9,-0.0 -0.470 104.6 -28.9 -65.8 100.4 100.0 60.3 46.5 85 129 A E T 3 S+ 0 0 82 -2,-1.0 -1,-0.3 5,-0.5 6,-0.1 0.877 128.2 85.5 57.4 43.5 100.9 59.5 42.9 86 130 A K S < S+ 0 0 40 -3,-1.3 -3,-0.2 168,-0.1 169,-0.1 0.593 76.9 32.5-132.8 -65.5 101.2 55.7 43.6 87 131 A G S S- 0 0 0 -5,-0.3 168,-0.1 167,-0.1 14,-0.1 0.637 82.5-112.5 -68.7-128.1 98.2 53.4 43.5 88 132 A I S > S+ 0 0 12 166,-0.1 3,-0.7 12,-0.1 -1,-0.1 0.393 99.4 75.9-129.0 -36.6 95.5 54.1 41.0 89 133 A I T 3 S+ 0 0 41 1,-0.3 -6,-0.0 3,-0.0 8,-0.0 0.863 124.1 4.2 -46.7 -54.6 92.5 55.0 43.2 90 134 A F T 3 S+ 0 0 11 -7,-0.1 2,-0.8 -19,-0.1 -5,-0.5 0.075 91.1 132.8-120.5 21.6 93.9 58.5 44.0 91 135 A N < + 0 0 0 -3,-0.7 -7,-0.1 -7,-0.2 -20,-0.0 -0.665 29.2 178.0 -69.4 107.4 97.0 58.5 41.8 92 136 A N + 0 0 36 -2,-0.8 -1,-0.2 -9,-0.2 3,-0.1 0.371 45.3 106.0-103.6 0.8 96.5 61.9 40.3 93 137 A N >> - 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0 0 87 4,-3.4 3,-0.8 -2,-0.4 -2,-0.1 -0.124 27.9-106.4 -73.4 171.8 76.5 34.9 68.6 137 181 A E T 3 S+ 0 0 183 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.885 125.6 50.0 -65.9 -40.8 75.1 32.8 71.4 138 182 A S T 3 S- 0 0 70 2,-0.1 -1,-0.2 1,-0.0 -2,-0.0 0.294 131.4 -99.2 -82.2 11.1 71.6 34.0 70.5 139 183 A G S < S+ 0 0 26 -3,-0.8 2,-0.5 1,-0.3 309,-0.5 0.690 70.4 153.9 83.4 22.4 72.4 33.2 66.9 140 184 A Y - 0 0 81 307,-0.1 -4,-3.4 305,-0.1 2,-0.4 -0.728 30.8-151.2 -84.7 123.3 73.4 36.6 65.7 141 185 A V B -DE 135 446B 2 305,-3.6 305,-2.0 -2,-0.5 2,-1.5 -0.768 14.9-134.1 -90.2 140.3 75.8 36.6 62.7 142 186 A D >> - 0 0 45 -8,-1.6 4,-2.2 -2,-0.4 3,-0.5 -0.647 28.7-178.0 -90.0 75.4 78.2 39.5 62.3 143 187 A V H 3> S+ 0 0 0 -2,-1.5 4,-3.2 1,-0.2 5,-0.2 0.850 74.2 57.7 -45.0 -48.7 77.5 39.8 58.6 144 188 A L H 3> S+ 0 0 1 300,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.920 109.7 41.6 -47.6 -56.2 80.0 42.6 58.2 145 189 A T H <> S+ 0 0 30 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.900 114.8 52.0 -67.5 -39.1 83.0 40.7 59.5 146 190 A L H X S+ 0 0 4 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.973 111.7 46.7 -54.7 -54.7 82.0 37.6 57.7 147 191 A L H X S+ 0 0 4 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.847 112.2 49.9 -61.4 -38.5 81.7 39.5 54.4 148 192 A R H X S+ 0 0 13 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.920 110.1 51.6 -65.1 -42.1 85.0 41.3 54.9 149 193 A R H X S+ 0 0 45 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.947 113.8 41.4 -62.9 -49.9 86.7 38.0 55.6 150 194 A V H X S+ 0 0 1 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.966 113.2 54.4 -62.9 -51.6 85.5 36.2 52.5 151 195 A M H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.867 111.6 45.0 -45.3 -47.8 86.1 39.3 50.4 152 196 A L H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 -1,-0.2 0.934 112.0 52.4 -63.0 -47.4 89.7 39.4 51.5 153 197 A D H X S+ 0 0 27 -4,-2.6 4,-2.7 -5,-0.2 -2,-0.2 0.903 111.5 46.9 -54.1 -44.6 90.0 35.7 51.0 154 198 A T H X S+ 0 0 0 -4,-3.1 4,-1.7 2,-0.2 5,-0.2 0.966 112.8 47.8 -63.9 -54.6 88.7 36.1 47.4 155 199 A S H X S+ 0 0 2 -4,-2.5 4,-2.7 2,-0.2 5,-0.5 0.877 114.7 47.8 -51.9 -45.7 91.0 39.0 46.6 156 200 A N H X>S+ 0 0 11 -4,-3.0 5,-3.9 1,-0.2 4,-2.5 0.983 111.2 47.1 -61.6 -59.0 94.0 37.2 48.0 157 201 A T H <5S+ 0 0 46 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.722 121.6 39.7 -60.4 -20.4 93.4 33.8 46.3 158 202 A L H <5S+ 0 0 17 -4,-1.7 76,-0.4 -5,-0.2 -1,-0.2 0.838 129.2 20.7 -95.0 -36.5 92.9 35.7 43.0 159 203 A F H <5S+ 0 0 10 -4,-2.7 76,-2.7 -5,-0.2 77,-0.2 0.628 139.6 3.8-112.1 -20.0 95.5 38.5 43.0 160 204 A L T <5 - 0 0 0 -4,-2.5 -3,-0.2 -5,-0.5 -4,-0.1 0.607 67.7-166.3-133.0 -43.7 98.2 37.6 45.4 161 205 A R < + 0 0 98 -5,-3.9 -4,-0.1 1,-0.2 -5,-0.1 0.899 35.1 137.0 34.3 68.9 97.7 34.1 46.9 162 206 A I - 0 0 5 0, 0.0 -1,-0.2 0, 0.0 52,-0.1 -0.989 63.9-101.0-125.5 130.9 100.1 34.1 49.8 163 207 A P + 0 0 95 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.287 55.9 162.0 -51.7 133.1 98.9 32.6 53.1 164 208 A L - 0 0 43 50,-0.0 2,-1.0 0, 0.0 -8,-0.0 -0.848 48.1 -88.2-144.0 175.3 97.9 35.4 55.5 165 209 A D > - 0 0 89 -2,-0.3 4,-2.4 1,-0.2 5,-0.3 -0.818 34.7-167.3 -95.2 99.3 95.9 36.0 58.7 166 210 A E H > S+ 0 0 45 -2,-1.0 4,-2.4 1,-0.2 5,-0.2 0.936 83.9 46.9 -44.8 -60.7 92.3 36.8 57.5 167 211 A S H > S+ 0 0 46 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.855 115.3 43.9 -56.0 -46.6 91.1 38.0 60.9 168 212 A A H >> S+ 0 0 32 2,-0.2 4,-1.9 1,-0.2 3,-0.5 0.957 114.1 48.8 -64.7 -51.8 94.0 40.3 61.7 169 213 A I H 3X S+ 0 0 11 -4,-2.4 4,-3.2 1,-0.2 5,-0.3 0.849 104.1 59.3 -60.6 -41.1 94.3 41.8 58.1 170 214 A V H 3X S+ 0 0 8 -4,-2.4 4,-2.1 -5,-0.3 -1,-0.2 0.889 108.2 46.5 -56.0 -41.0 90.6 42.6 57.9 171 215 A V H < S+ 0 0 12 -4,-2.2 3,-0.8 1,-0.2 -2,-0.2 0.988 116.7 42.0 -68.0 -61.7 89.8 60.9 57.6 183 227 A L H >< S+ 0 0 0 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.521 88.2 95.2 -64.2 -9.6 93.0 62.5 56.1 184 228 A L T 3< S+ 0 0 0 -4,-1.0 -110,-2.8 -5,-0.3 -1,-0.2 0.820 103.2 12.6 -63.7 -36.8 91.6 62.8 52.6 185 229 A I T < S+ 0 0 9 -3,-0.8 -1,-0.3 -4,-0.3 -139,-0.2 -0.050 87.2 138.4-130.8 32.7 90.4 66.4 52.8 186 230 A K < - 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