==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-JUN-04 1WL6 . COMPND 2 MOLECULE: XAA-PRO AMINOPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.C.GRAHAM,C.S.BOND,H.C.FREEMAN,J.M.GUSS . 440 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20059.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 297 67.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 57 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 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-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 . 22 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 135 30.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.4 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 1 2 0 3 0 0 1 0 2 1 0 0 1 0 1 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 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 . 3 3 0 4 0 3 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 1 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 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 S 0 0 88 0, 0.0 2,-0.3 0, 0.0 178,-0.0 0.000 360.0 360.0 360.0 126.4 80.4 64.2 42.8 2 2 A E - 0 0 119 264,-0.0 2,-0.5 0, 0.0 180,-0.1 -0.897 360.0 -94.0-150.0-179.1 77.9 66.9 43.7 3 3 A I - 0 0 15 -2,-0.3 2,-0.1 263,-0.1 263,-0.0 -0.917 45.1-144.3-105.7 127.5 75.2 69.1 42.2 4 4 A S >> - 0 0 45 -2,-0.5 4,-2.1 1,-0.1 3,-0.6 -0.415 25.0-104.0 -92.5 168.1 76.5 72.5 41.2 5 5 A R H 3> S+ 0 0 109 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.848 120.4 55.7 -52.3 -41.2 75.0 76.0 41.2 6 6 A Q H 3> S+ 0 0 90 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.860 105.6 50.3 -67.4 -33.3 74.5 75.8 37.4 7 7 A E H <> S+ 0 0 6 -3,-0.6 4,-2.3 2,-0.2 -2,-0.2 0.924 108.0 51.8 -74.2 -40.5 72.4 72.7 37.8 8 8 A F H X S+ 0 0 15 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.927 111.6 49.5 -56.3 -41.5 70.2 74.2 40.4 9 9 A Q H X S+ 0 0 59 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.902 107.3 53.5 -63.5 -43.2 69.7 77.1 38.0 10 10 A R H X S+ 0 0 134 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.898 109.1 49.7 -57.6 -43.2 68.9 74.8 35.1 11 11 A R H X S+ 0 0 13 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.917 108.5 52.0 -60.3 -47.6 66.2 73.2 37.3 12 12 A R H X S+ 0 0 2 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.936 112.1 47.0 -53.9 -46.7 64.7 76.6 38.1 13 13 A Q H X S+ 0 0 75 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.859 107.4 55.1 -65.1 -37.5 64.6 77.5 34.4 14 14 A A H X S+ 0 0 41 -4,-2.1 4,-1.0 2,-0.2 -1,-0.2 0.868 110.2 47.3 -64.6 -37.0 63.0 74.2 33.5 15 15 A L H >X S+ 0 0 4 -4,-2.1 3,-0.9 2,-0.2 4,-0.7 0.949 111.2 50.4 -63.8 -49.1 60.3 74.9 36.0 16 16 A V H >< S+ 0 0 5 -4,-2.5 3,-1.2 1,-0.3 -2,-0.2 0.879 104.4 58.6 -57.8 -40.1 59.8 78.4 34.7 17 17 A E H 3< S+ 0 0 145 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.822 108.2 46.4 -59.5 -32.8 59.6 77.0 31.1 18 18 A Q H << S+ 0 0 99 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.539 96.6 97.0 -83.7 -10.4 56.5 75.0 32.3 19 19 A M S << S- 0 0 7 -3,-1.2 3,-0.1 -4,-0.7 4,-0.1 -0.483 79.6-110.3 -84.5 151.6 54.9 77.9 34.1 20 20 A Q - 0 0 95 -2,-0.2 3,-0.2 1,-0.1 46,-0.2 -0.457 40.7 -99.3 -69.4 149.6 52.1 80.1 32.7 21 21 A P S S+ 0 0 50 0, 0.0 46,-0.2 0, 0.0 47,-0.2 -0.427 110.1 37.9 -64.8 148.7 53.0 83.7 31.8 22 22 A G S S+ 0 0 12 44,-1.6 103,-2.8 1,-0.3 104,-1.7 0.927 99.8 115.1 73.2 50.2 51.9 86.1 34.5 23 23 A S E -Ab 66 126A 0 43,-2.3 43,-3.4 -3,-0.2 2,-0.4 -0.946 49.7-152.5-150.6 159.9 52.8 83.7 37.4 24 24 A A E -Ab 65 127A 0 102,-1.7 104,-3.3 -2,-0.3 2,-0.5 -0.999 9.2-150.0-138.4 137.0 55.0 83.0 40.4 25 25 A A E -Ab 64 128A 0 39,-2.6 39,-2.7 -2,-0.4 2,-0.5 -0.930 12.5-158.1-106.5 133.1 56.1 79.8 42.0 26 26 A L E -A 63 0A 1 102,-2.6 2,-0.5 -2,-0.5 104,-0.5 -0.943 9.8-177.6-114.6 123.1 56.8 79.8 45.8 27 27 A I E -A 62 0A 0 35,-2.6 35,-3.2 -2,-0.5 2,-0.3 -0.978 12.5-155.5-128.3 122.3 59.1 77.2 47.3 28 28 A F E -A 61 0A 11 -2,-0.5 21,-0.3 33,-0.2 33,-0.2 -0.720 12.9-121.7-105.0 141.9 59.5 77.2 51.1 29 29 A A - 0 0 0 31,-2.6 30,-0.1 -2,-0.3 16,-0.1 -0.316 39.4 -94.7 -72.0 156.4 62.3 75.9 53.3 30 30 A A - 0 0 7 27,-0.1 29,-0.3 1,-0.1 2,-0.1 -0.421 40.9-114.8 -66.3 144.2 61.7 73.3 56.0 31 31 A P - 0 0 56 0, 0.0 13,-0.3 0, 0.0 2,-0.2 -0.461 33.5-101.3 -72.0 156.0 61.1 74.5 59.5 32 32 A E - 0 0 81 -2,-0.1 2,-0.4 11,-0.1 11,-0.0 -0.519 40.3-137.7 -70.5 153.7 63.6 73.8 62.2 33 33 A V - 0 0 82 8,-0.3 8,-2.7 -2,-0.2 2,-0.2 -0.973 4.8-126.8-129.0 124.3 62.4 70.9 64.5 34 34 A T E -F 40 0B 93 -2,-0.4 6,-0.3 6,-0.3 3,-0.1 -0.426 19.7-178.7 -65.7 132.2 62.6 70.6 68.3 35 35 A R E S- 0 0 156 4,-2.9 2,-0.3 1,-0.3 5,-0.2 0.816 74.9 -21.3 -92.3 -51.1 64.3 67.4 69.7 36 36 A S E > S-F 39 0B 73 3,-1.6 3,-3.0 1,-0.1 -1,-0.3 -0.867 107.0 -43.4-160.6 131.0 63.7 68.3 73.3 37 37 A A T 3 S- 0 0 85 1,-0.3 -1,-0.1 -2,-0.3 -2,-0.1 -0.253 128.7 -9.1 50.4-120.6 63.1 71.6 75.1 38 38 A D T 3 S+ 0 0 155 -4,-0.1 2,-0.3 -3,-0.1 -1,-0.3 0.425 116.3 96.4 -87.1 3.2 65.5 74.1 73.6 39 39 A S E < -F 36 0B 50 -3,-3.0 -4,-2.9 -5,-0.0 -3,-1.6 -0.734 58.3-157.4 -98.4 143.3 67.5 71.6 71.6 40 40 A E E -F 34 0B 99 -2,-0.3 -6,-0.3 -6,-0.3 3,-0.1 -0.802 21.6-106.3-115.7 155.3 66.7 70.9 67.9 41 41 A Y - 0 0 120 -8,-2.7 -8,-0.3 -2,-0.3 2,-0.1 -0.379 57.2 -81.2 -65.4 154.3 67.3 68.0 65.5 42 42 A P - 0 0 74 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.449 63.9 -96.2 -59.9 138.1 70.1 68.6 63.0 43 43 A Y - 0 0 44 -2,-0.1 2,-0.5 -3,-0.1 -11,-0.1 -0.251 38.4-169.7 -68.4 134.2 68.5 70.6 60.2 44 44 A R - 0 0 87 -13,-0.3 3,-0.1 -3,-0.1 -1,-0.0 -0.972 19.5-134.9-123.2 115.6 67.2 68.8 57.1 45 45 A Q - 0 0 3 -2,-0.5 -16,-0.1 1,-0.1 11,-0.1 -0.333 32.5 -93.7 -66.0 147.4 66.2 71.0 54.2 46 46 A N > - 0 0 18 1,-0.1 4,-2.8 -18,-0.1 5,-0.2 -0.398 35.3-130.2 -56.3 133.4 62.9 70.4 52.4 47 47 A S H > S+ 0 0 9 1,-0.2 4,-2.5 2,-0.2 -1,-0.1 0.865 105.4 46.5 -61.7 -41.2 63.8 68.1 49.4 48 48 A D H > S+ 0 0 5 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.910 113.4 48.5 -69.9 -41.7 62.0 70.3 46.8 49 49 A F H > S+ 0 0 1 -21,-0.3 4,-0.6 1,-0.2 3,-0.4 0.933 113.8 48.3 -58.0 -46.9 63.5 73.5 48.2 50 50 A W H >X S+ 0 0 54 -4,-2.8 4,-2.1 1,-0.2 3,-1.6 0.934 103.2 61.6 -57.4 -46.2 66.9 71.8 48.1 51 51 A Y H 3< S+ 0 0 11 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.812 113.1 36.5 -50.8 -35.6 66.3 70.5 44.5 52 52 A F H 3< S+ 0 0 0 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.465 133.9 17.7 -97.6 -2.3 66.0 74.2 43.3 53 53 A T H << - 0 0 5 -3,-1.6 -3,-0.2 -4,-0.6 -2,-0.2 0.662 68.0-140.2-138.0 -36.3 68.7 75.8 45.6 54 54 A G < + 0 0 24 -4,-2.1 2,-0.5 -5,-0.2 -4,-0.1 0.745 59.6 141.4 62.4 25.6 71.3 73.6 47.3 55 55 A F - 0 0 12 -6,-0.3 -1,-0.2 -5,-0.1 -2,-0.1 -0.889 38.8-166.9-111.6 121.2 70.7 76.0 50.2 56 56 A N + 0 0 89 -2,-0.5 -1,-0.1 -3,-0.1 -13,-0.1 -0.059 48.6 105.4-104.7 32.3 70.6 74.6 53.7 57 57 A E - 0 0 28 1,-0.0 -27,-0.1 -13,-0.0 3,-0.1 -0.848 60.2-130.5-108.8 148.5 69.2 77.4 55.9 58 58 A P S S+ 0 0 10 0, 0.0 21,-0.5 0, 0.0 3,-0.1 -0.251 83.7 49.8 -78.2 177.4 65.7 77.7 57.4 59 59 A E S S+ 0 0 82 -29,-0.3 2,-0.3 1,-0.2 20,-0.3 0.962 85.1 124.3 51.5 60.3 63.5 80.8 57.1 60 60 A A - 0 0 0 18,-0.2 -31,-2.6 -3,-0.1 2,-0.4 -0.991 39.4-170.3-148.7 145.4 63.9 81.0 53.4 61 61 A V E -AC 28 77A 0 16,-1.9 16,-2.8 -2,-0.3 2,-0.5 -0.990 13.9-146.5-141.5 127.0 61.6 81.1 50.4 62 62 A L E -AC 27 76A 0 -35,-3.2 -35,-2.6 -2,-0.4 2,-0.5 -0.850 16.0-169.2 -92.6 126.0 62.4 80.9 46.7 63 63 A V E -AC 26 75A 0 12,-2.8 12,-2.7 -2,-0.5 2,-0.6 -0.970 3.6-168.6-119.7 116.6 60.1 83.0 44.5 64 64 A L E -AC 25 74A 2 -39,-2.7 -39,-2.6 -2,-0.5 2,-0.5 -0.937 8.8-163.7-106.8 118.2 60.3 82.4 40.7 65 65 A I E -AC 24 73A 8 8,-3.3 8,-2.4 -2,-0.6 2,-0.7 -0.898 12.2-169.7-110.2 125.7 58.4 85.1 38.7 66 66 A K E +AC 23 72A 17 -43,-3.4 -43,-2.3 -2,-0.5 -44,-1.6 -0.918 6.3 180.0-113.0 98.2 57.4 84.6 35.1 67 67 A S - 0 0 62 4,-1.6 2,-0.3 -2,-0.7 5,-0.2 0.885 66.8 -34.4 -70.6 -38.6 56.3 88.0 34.0 68 68 A D S S- 0 0 55 3,-1.6 -1,-0.2 -47,-0.2 -45,-0.1 -0.871 86.0 -61.5-165.0-168.0 55.5 86.8 30.5 69 69 A D S S+ 0 0 124 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 0.640 131.6 26.5 -70.8 -18.2 56.9 84.3 27.9 70 70 A T S S+ 0 0 101 1,-0.1 2,-0.5 -4,-0.0 -1,-0.2 0.709 111.8 69.7-109.0 -32.7 60.4 86.0 27.6 71 71 A H + 0 0 117 2,-0.0 -3,-1.6 -5,-0.0 -4,-1.6 -0.798 53.3 142.8-101.6 126.2 60.8 87.7 31.0 72 72 A N E +C 66 0A 52 -2,-0.5 2,-0.3 -6,-0.2 -6,-0.2 -0.985 15.4 177.7-152.7 157.5 61.4 86.0 34.3 73 73 A H E -C 65 0A 60 -8,-2.4 -8,-3.3 -2,-0.3 2,-0.4 -0.972 20.3-124.7-158.3 164.7 63.4 86.4 37.5 74 74 A S E -C 64 0A 7 -2,-0.3 32,-1.3 -10,-0.2 2,-0.4 -0.922 14.2-169.8-122.5 141.8 64.1 85.0 40.9 75 75 A V E -Cd 63 106A 0 -12,-2.7 -12,-2.8 -2,-0.4 2,-0.5 -0.999 7.4-159.0-128.4 128.8 63.8 86.4 44.4 76 76 A L E -Cd 62 107A 0 30,-2.7 32,-3.0 -2,-0.4 2,-0.5 -0.931 3.9-158.3-106.4 130.5 65.1 84.7 47.6 77 77 A F E +Cd 61 108A 0 -16,-2.8 -16,-1.9 -2,-0.5 2,-0.3 -0.916 32.8 151.4 -94.5 131.6 63.9 85.5 51.0 78 78 A N E - d 0 109A 0 30,-2.2 32,-1.7 -2,-0.5 33,-0.2 -0.975 48.8 -68.9-156.4 163.3 66.5 84.5 53.6 79 79 A R - 0 0 49 -21,-0.5 15,-0.6 -20,-0.3 3,-0.1 -0.332 51.6-120.3 -62.0 138.3 67.8 85.4 57.1 80 80 A V - 0 0 62 14,-0.2 2,-0.1 1,-0.1 14,-0.1 -0.349 34.1 -90.5 -68.0 149.5 69.7 88.6 57.4 81 81 A R + 0 0 138 12,-0.1 2,-0.3 -2,-0.1 -1,-0.1 -0.453 51.2 177.3 -52.6 137.5 73.3 88.9 58.6 82 82 A D > - 0 0 69 -2,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.857 24.8-151.8-156.6 108.6 73.1 89.3 62.3 83 83 A L H > S+ 0 0 143 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.871 95.6 43.3 -52.7 -48.8 76.3 89.5 64.4 84 84 A T H > S+ 0 0 95 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.898 114.2 48.7 -68.8 -44.7 74.9 88.1 67.6 85 85 A A H > S+ 0 0 16 1,-0.2 4,-3.4 2,-0.2 5,-0.4 0.893 114.4 47.6 -61.6 -40.4 72.9 85.2 66.0 86 86 A E H X S+ 0 0 27 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.871 105.8 55.7 -74.1 -38.3 75.9 84.2 64.0 87 87 A I H < S+ 0 0 129 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.877 121.1 34.1 -56.7 -36.4 78.4 84.3 67.0 88 88 A W H < S+ 0 0 187 -4,-1.5 -2,-0.2 -5,-0.2 -3,-0.2 0.966 134.9 14.9 -79.7 -57.5 76.0 81.8 68.6 89 89 A F H < S- 0 0 174 -4,-3.4 -3,-0.2 1,-0.3 -2,-0.1 0.488 109.8 -86.7-112.2 -7.0 74.5 79.6 66.0 90 90 A G < - 0 0 34 -4,-1.4 -1,-0.3 -5,-0.4 -2,-0.1 -0.397 53.3 -42.9 120.5 166.4 76.5 80.0 62.8 91 91 A R - 0 0 225 -2,-0.1 2,-0.4 -4,-0.1 3,-0.1 -0.233 44.9-153.2 -68.9 146.6 77.1 81.9 59.7 92 92 A R - 0 0 50 1,-0.1 -10,-0.1 -35,-0.0 -1,-0.0 -0.951 17.9-134.6-119.6 145.2 74.3 83.1 57.5 93 93 A L > - 0 0 31 -2,-0.4 4,-0.6 1,-0.1 -1,-0.1 0.913 43.8-171.0 -62.5 -45.9 74.5 83.7 53.7 94 94 A G H > - 0 0 0 -15,-0.6 4,-0.6 1,-0.1 -14,-0.2 -0.063 36.2 -71.5 75.4-177.5 72.6 87.0 54.0 95 95 A Q H 4 S+ 0 0 37 2,-0.2 -1,-0.1 1,-0.1 12,-0.1 0.836 120.7 56.2 -85.0 -36.2 71.2 89.2 51.2 96 96 A D H 4 S+ 0 0 165 1,-0.2 4,-0.4 2,-0.1 -1,-0.1 0.907 115.5 36.2 -66.3 -41.2 74.4 90.7 49.7 97 97 A A H X S+ 0 0 49 -4,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.625 98.0 82.2 -87.5 -16.8 76.1 87.4 48.9 98 98 A A H X>S+ 0 0 0 -4,-0.6 4,-3.2 2,-0.2 5,-0.7 0.893 83.6 55.8 -61.8 -46.5 73.0 85.4 48.0 99 99 A P H >>S+ 0 0 36 0, 0.0 4,-1.8 0, 0.0 5,-0.6 0.930 117.0 36.1 -54.7 -46.9 72.6 86.4 44.3 100 100 A E H 45S+ 0 0 139 -4,-0.4 -2,-0.2 2,-0.2 -3,-0.1 0.914 120.0 48.4 -70.3 -44.3 76.1 85.4 43.3 101 101 A K H <5S+ 0 0 134 -4,-2.3 -3,-0.2 1,-0.2 -1,-0.2 0.944 127.8 22.8 -63.4 -48.8 76.3 82.4 45.6 102 102 A L H <5S- 0 0 15 -4,-3.2 -1,-0.2 -5,-0.2 -2,-0.2 0.681 102.8-119.2 -94.2 -22.6 73.0 80.8 44.6 103 103 A G T << + 0 0 23 -4,-1.8 2,-0.3 -5,-0.7 -3,-0.2 0.822 63.5 139.6 82.8 34.2 72.5 82.4 41.2 104 104 A V < - 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0 0 30 -5,-2.3 2,-0.3 -8,-0.1 -1,-0.2 -0.723 26.1-171.5 -93.5 147.2 45.9 95.4 44.2 157 157 A T - 0 0 79 -2,-0.3 -34,-2.2 -7,-0.1 -33,-0.4 -0.998 13.8-139.3-138.7 138.8 44.6 92.2 42.6 158 158 A A - 0 0 24 -2,-0.3 2,-0.2 -36,-0.2 -36,-0.1 -0.715 29.6-105.6 -90.6 144.5 45.1 88.6 43.6 159 159 A P - 0 0 9 0, 0.0 -34,-0.2 0, 0.0 -33,-0.2 -0.493 25.0-151.1 -61.3 137.1 45.8 85.8 41.2 160 160 A A S S+ 0 0 104 -35,-0.5 2,-0.4 -2,-0.2 -34,-0.1 0.603 73.7 68.6 -86.1 -12.9 42.6 83.7 41.0 161 161 A T E -e 126 0A 67 -36,-1.5 -34,-2.5 2,-0.0 2,-0.4 -0.915 55.9-174.5-116.5 130.5 44.4 80.4 40.2 162 162 A M E -e 127 0A 61 -2,-0.4 2,-0.5 -36,-0.2 -34,-0.2 -0.997 9.5-168.4-121.3 129.5 46.6 78.4 42.5 163 163 A I E -e 128 0A 55 -36,-2.4 -34,-1.7 -2,-0.4 2,-0.6 -0.958 23.5-126.4-122.4 130.5 48.4 75.4 41.0 164 164 A D - 0 0 63 -2,-0.5 4,-0.4 -36,-0.2 -34,-0.2 -0.661 18.0-164.1 -69.4 115.6 50.2 72.7 43.0 165 165 A W > + 0 0 12 -2,-0.6 4,-3.1 1,-0.2 5,-0.3 0.586 69.3 90.9 -75.5 -10.8 53.7 72.5 41.5 166 166 A R H > S+ 0 0 49 1,-0.2 4,-3.3 2,-0.2 5,-0.4 0.911 80.9 53.1 -58.0 -46.9 54.4 69.2 43.2 167 167 A P H > S+ 0 0 88 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.942 116.5 40.0 -52.9 -45.9 53.2 67.0 40.3 168 168 A V H > S+ 0 0 53 -4,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.929 119.5 44.9 -67.4 -46.4 55.4 68.8 37.8 169 169 A V H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 -1,-0.2 0.881 112.4 51.0 -66.4 -39.0 58.4 69.1 40.2 170 170 A H H X S+ 0 0 35 -4,-3.3 4,-1.4 -5,-0.3 -1,-0.2 0.884 107.3 53.6 -70.0 -33.3 58.1 65.4 41.3 171 171 A E H X S+ 0 0 70 -4,-1.8 4,-0.7 -5,-0.4 -1,-0.2 0.862 108.8 50.9 -64.9 -35.4 58.1 64.3 37.7 172 172 A M H >< S+ 0 0 30 -4,-1.6 3,-1.3 1,-0.2 -2,-0.2 0.959 109.7 49.1 -62.5 -52.1 61.3 66.3 37.2 173 173 A R H 3< S+ 0 0 4 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.744 100.0 67.7 -57.1 -28.1 62.8 64.6 40.3 174 174 A L H 3< S+ 0 0 0 -4,-1.4 2,-0.7 1,-0.2 205,-0.4 0.788 96.0 58.4 -67.5 -27.8 61.8 61.2 38.9 175 175 A F S << S- 0 0 57 -3,-1.3 2,-0.2 -4,-0.7 203,-0.2 -0.903 84.3-146.7-109.1 111.8 64.3 61.4 36.0 176 176 A K - 0 0 15 201,-2.8 -3,-0.1 -2,-0.7 -2,-0.1 -0.519 7.0-130.2 -81.4 141.5 67.8 61.9 37.2 177 177 A S > - 0 0 28 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.366 34.8-103.8 -72.2 161.4 70.5 64.0 35.4 178 178 A P H > S+ 0 0 97 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.906 125.6 54.3 -56.4 -35.1 73.8 62.3 34.8 179 179 A E H > S+ 0 0 92 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.902 107.6 49.3 -64.6 -41.0 75.2 64.4 37.7 180 180 A E H > S+ 0 0 4 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.888 108.9 52.8 -63.9 -39.7 72.5 63.2 40.0 181 181 A I H X S+ 0 0 24 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.905 106.3 53.1 -64.2 -39.8 73.2 59.6 39.0 182 182 A A H X S+ 0 0 22 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.885 110.5 47.7 -60.7 -37.2 76.9 60.2 39.9 183 183 A V H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.944 113.5 46.7 -70.0 -46.4 75.9 61.4 43.3 184 184 A L H X S+ 0 0 3 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.839 109.4 55.5 -60.9 -35.5 73.6 58.4 43.8 185 185 A R H X S+ 0 0 96 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.927 109.8 46.1 -62.4 -43.7 76.4 56.1 42.5 186 186 A R H X S+ 0 0 64 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.909 110.8 52.0 -66.1 -42.7 78.6 57.6 45.3 187 187 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 76,-0.3 0.897 110.1 50.2 -56.6 -43.0 75.9 57.2 47.9 188 188 A G H X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.903 111.9 47.1 -62.9 -41.9 75.5 53.5 46.8 189 189 A E H X S+ 0 0 90 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.916 113.5 47.4 -66.3 -44.5 79.3 53.0 47.1 190 190 A I H X S+ 0 0 0 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.936 114.7 46.7 -62.9 -45.0 79.5 54.6 50.5 191 191 A T H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.913 110.9 52.4 -64.2 -42.2 76.5 52.6 51.8 192 192 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.905 107.2 52.0 -60.0 -44.0 77.9 49.4 50.3 193 193 A M H X S+ 0 0 51 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.873 109.1 52.1 -61.0 -35.7 81.3 50.0 52.2 194 194 A A H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.924 109.7 46.8 -65.8 -46.0 79.3 50.4 55.4 195 195 A H H X S+ 0 0 1 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.843 111.1 52.2 -65.9 -36.0 77.4 47.2 55.0 196 196 A T H X S+ 0 0 32 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.930 109.7 50.4 -62.2 -44.9 80.7 45.3 54.1 197 197 A R H X S+ 0 0 42 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.894 107.6 53.2 -61.1 -42.6 82.2 46.8 57.3 198 198 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.929 109.8 47.8 -59.2 -45.4 79.1 45.6 59.4 199 199 A M H < S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.897 112.9 48.9 -61.4 -40.6 79.5 42.0 58.0 200 200 A E H < S+ 0 0 79 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.746 116.9 41.7 -71.8 -23.1 83.3 42.1 58.8 201 201 A K H < S+ 0 0 103 -4,-1.6 -2,-0.2 -3,-0.2 -1,-0.2 0.769 86.5 111.5 -93.6 -28.7 82.7 43.4 62.4 202 202 A C < + 0 0 0 -4,-2.2 -4,-0.0 -5,-0.2 236,-0.0 -0.220 36.2 161.7 -57.5 129.4 79.7 41.3 63.4 203 203 A R > - 0 0 59 76,-0.0 3,-1.9 77,-0.0 48,-0.2 -0.988 47.8 -91.1-141.7 148.7 80.3 38.7 66.1 204 204 A P T 3 S+ 0 0 47 0, 0.0 48,-0.2 0, 0.0 3,-0.1 -0.288 113.1 35.5 -54.4 138.5 77.9 36.8 68.5 205 205 A G T 3 S+ 0 0 36 46,-3.2 2,-0.1 1,-0.5 47,-0.1 0.076 88.1 114.1 99.2 -25.9 77.5 38.8 71.7 206 206 A M S < S- 0 0 42 -3,-1.9 45,-3.5 45,-0.2 -1,-0.5 -0.458 70.6-113.6 -64.2 153.6 77.6 42.2 70.1 207 207 A F B >> -G 250 0C 63 43,-0.3 3,-1.3 -2,-0.1 4,-0.8 -0.611 19.2-116.1 -88.5 150.9 74.5 44.3 70.3 208 208 A E H >> S+ 0 0 0 41,-2.5 4,-1.3 1,-0.3 3,-1.2 0.903 116.7 60.5 -48.8 -44.7 72.5 45.2 67.2 209 209 A Y H 3> S+ 0 0 112 38,-1.3 4,-2.2 1,-0.3 -1,-0.3 0.764 92.0 67.4 -61.3 -24.8 73.3 48.9 67.9 210 210 A H H <> S+ 0 0 79 -3,-1.3 4,-1.8 2,-0.2 -1,-0.3 0.868 100.8 47.3 -61.5 -37.2 77.0 48.1 67.6 211 211 A L H <>S+ 0 0 1 -4,-2.5 5,-2.3 1,-0.2 3,-0.7 0.958 112.0 48.3 -53.1 -53.0 79.0 56.9 56.3 220 220 A N H ><5S+ 0 0 89 -4,-2.3 3,-2.3 1,-0.2 -2,-0.2 0.885 102.8 59.3 -59.6 -43.1 80.6 59.8 58.1 221 221 A R H 3<5S+ 0 0 146 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.814 106.2 48.6 -66.0 -22.4 84.1 59.1 57.1 222 222 A H T <<5S- 0 0 38 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.274 128.5 -95.8 -93.2 6.5 83.2 59.5 53.4 223 223 A G T < 5S+ 0 0 54 -3,-2.3 2,-0.7 1,-0.2 43,-0.3 0.672 90.4 121.6 88.5 20.0 81.4 62.8 54.0 224 224 A A < + 0 0 1 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.2 -0.881 36.4 179.1-107.3 93.4 77.8 61.5 54.4 225 225 A R + 0 0 175 -2,-0.7 -5,-0.2 39,-0.1 -1,-0.1 0.823 59.6 38.5 -66.6 -37.3 77.1 62.7 58.0 226 226 A Y E S-H 264 0D 85 38,-0.6 38,-2.3 -7,-0.1 2,-0.1 -0.879 79.9-116.6-118.2 147.5 73.6 61.5 58.3 227 227 A P E -H 263 0D 36 0, 0.0 36,-0.3 0, 0.0 3,-0.1 -0.472 23.4-127.7 -70.2 156.0 71.7 58.3 57.3 228 228 A S S S+ 0 0 19 34,-2.3 132,-0.4 42,-0.2 2,-0.3 0.539 92.1 3.2 -81.0 -11.2 68.8 58.8 54.8 229 229 A Y S S- 0 0 42 33,-0.6 33,-0.4 131,-0.1 2,-0.2 -0.949 101.4 -68.4-163.9 163.6 66.5 56.9 57.2 230 230 A N - 0 0 127 -2,-0.3 30,-0.1 1,-0.1 -2,-0.0 -0.395 60.6-110.6 -66.3 122.8 66.8 55.3 60.7 231 231 A T - 0 0 5 -2,-0.2 2,-0.5 14,-0.1 30,-0.2 -0.290 26.5-149.3 -60.9 136.1 69.1 52.3 60.6 232 232 A I E +J 260 0E 5 28,-2.7 28,-2.3 -3,-0.1 2,-0.4 -0.932 20.7 171.2-109.9 122.1 67.5 48.9 61.0 233 233 A V E +J 259 0E 0 -2,-0.5 2,-0.8 11,-0.5 26,-0.2 -0.814 11.8 174.6-131.9 91.6 69.5 46.1 62.6 234 234 A G E -J 258 0E 1 24,-3.0 24,-1.9 -2,-0.4 2,-0.3 -0.836 4.8-177.1-109.2 100.7 67.1 43.2 63.2 235 235 A S E > -J 257 0E 5 -2,-0.8 3,-2.0 22,-0.3 22,-0.3 -0.659 57.2 -19.8 -95.0 148.5 68.7 40.0 64.5 236 236 A G G > S- 0 0 11 20,-2.9 3,-1.8 1,-0.3 166,-0.3 -0.292 137.8 -3.0 59.3-135.1 66.7 36.8 65.0 237 237 A E G > S+ 0 0 122 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.690 125.7 72.6 -59.8 -22.0 62.9 37.4 65.3 238 238 A N G X S+ 0 0 34 -3,-2.0 3,-1.9 1,-0.3 -1,-0.3 0.786 83.4 70.3 -65.7 -24.9 63.6 41.1 65.0 239 239 A G G < S+ 0 0 2 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.674 87.5 64.2 -65.0 -18.4 64.3 40.5 61.4 240 240 A C G < S+ 0 0 29 -3,-1.5 2,-0.6 -4,-0.2 -1,-0.3 0.453 83.9 85.8 -83.2 -2.4 60.6 39.8 60.8 241 241 A I S X S- 0 0 91 -3,-1.9 3,-1.6 1,-0.2 161,-0.0 -0.914 75.9-148.1-100.3 116.1 59.8 43.5 61.8 242 242 A L T 3 S+ 0 0 47 -2,-0.6 -1,-0.2 1,-0.3 -8,-0.1 0.866 91.0 22.0 -59.9 -47.6 60.2 45.4 58.6 243 243 A H T 3 S+ 0 0 124 -3,-0.1 2,-0.4 -10,-0.0 -1,-0.3 -0.359 81.1 166.7-114.3 49.6 61.4 48.7 60.0 244 244 A Y < + 0 0 8 -3,-1.6 -11,-0.5 -6,-0.2 -6,-0.0 -0.528 3.4 160.1 -64.0 118.7 62.8 47.5 63.4 245 245 A T + 0 0 62 -2,-0.4 -1,-0.2 -13,-0.2 -14,-0.1 0.394 47.0 91.3-124.1 -0.3 64.9 50.3 64.8 246 246 A E - 0 0 119 1,-0.1 -37,-0.1 2,-0.0 -12,-0.1 0.889 57.9-177.2 -60.4 -38.5 65.2 49.6 68.5 247 247 A N + 0 0 1 1,-0.1 -38,-1.3 -14,-0.1 -35,-0.1 0.820 35.1 131.3 44.1 42.9 68.4 47.7 67.7 248 248 A E + 0 0 124 -40,-0.2 2,-0.2 -41,-0.1 -1,-0.1 0.435 34.0 96.6-107.7 -4.2 68.6 46.9 71.4 249 249 A C S S- 0 0 42 1,-0.1 -41,-2.5 -14,-0.0 2,-0.4 -0.618 74.2-111.6 -98.2 154.5 69.3 43.1 71.5 250 250 A E B -G 207 0C 73 -2,-0.2 2,-0.4 -43,-0.2 -43,-0.3 -0.610 39.7-118.2 -76.1 128.3 72.3 41.1 71.9 251 251 A M - 0 0 0 -45,-3.5 -46,-3.2 -2,-0.4 2,-0.3 -0.616 32.2-138.5 -77.2 126.3 73.0 39.2 68.6 252 252 A R > - 0 0 132 -2,-0.4 3,-2.3 -48,-0.2 26,-0.2 -0.663 15.3-111.0 -94.4 136.1 72.9 35.4 69.1 253 253 A D T 3 S+ 0 0 110 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 -0.441 110.2 29.6 -51.1 119.1 75.1 32.7 67.8 254 254 A G T 3 S+ 0 0 26 1,-0.4 -1,-0.3 -2,-0.2 2,-0.2 0.180 99.9 102.6 106.2 -13.9 72.8 30.9 65.3 255 255 A D < - 0 0 57 -3,-2.3 23,-2.6 27,-0.1 -1,-0.4 -0.613 66.0-125.5 -94.1 158.5 70.6 33.8 64.3 256 256 A L E - K 0 277E 9 21,-0.2 -20,-2.9 -2,-0.2 2,-0.4 -0.625 17.4-146.4 -88.4 159.8 70.6 35.9 61.2 257 257 A V E -JK 235 276E 0 19,-2.5 19,-2.3 -22,-0.3 2,-0.6 -0.999 4.0-155.2-128.2 132.9 70.9 39.7 61.3 258 258 A L E -JK 234 275E 2 -24,-1.9 -24,-3.0 -2,-0.4 2,-0.5 -0.955 10.1-167.7-108.3 117.8 69.1 41.9 58.8 259 259 A I E +JK 233 274E 0 15,-3.2 15,-2.1 -2,-0.6 2,-0.5 -0.949 9.9 178.5-109.5 120.3 70.7 45.3 58.2 260 260 A D E +JK 232 273E 6 -28,-2.3 -28,-2.7 -2,-0.5 2,-0.3 -0.970 26.1 143.2-119.5 107.4 68.8 48.0 56.3 261 261 A A E + K 0 272E 0 11,-2.4 11,-1.5 -2,-0.5 2,-0.3 -0.996 21.5 177.7-149.4 144.5 70.9 51.2 56.2 262 262 A G - 0 0 0 -33,-0.4 -34,-2.3 -2,-0.3 -33,-0.6 -0.991 20.7-130.2-151.5 144.3 71.6 54.0 53.8 263 263 A C E -H 227 0D 0 -76,-0.3 7,-2.4 -2,-0.3 2,-0.6 -0.396 14.4-132.6 -87.8 163.8 73.6 57.2 53.8 264 264 A E E -HI 226 269D 35 -38,-2.3 -38,-0.6 5,-0.2 2,-0.5 -0.978 29.7-178.6-116.9 112.9 72.4 60.6 52.8 265 265 A Y E > - I 0 268D 25 3,-2.9 3,-2.3 -2,-0.6 -78,-0.1 -0.966 69.1 -21.4-121.3 116.0 75.1 62.1 50.5 266 266 A K T 3 S- 0 0 89 -2,-0.5 -1,-0.2 -43,-0.3 -263,-0.1 0.838 130.0 -50.4 50.2 37.3 74.7 65.6 49.1 267 267 A G T 3 S+ 0 0 16 1,-0.3 -1,-0.3 -84,-0.1 2,-0.3 0.145 115.7 114.8 95.2 -20.1 71.0 65.2 49.8 268 268 A Y E < -I 265 0D 0 -3,-2.3 -3,-2.9 1,-0.0 2,-0.3 -0.655 57.8-128.3 -99.2 143.7 70.6 61.8 48.0 269 269 A A E -I 264 0D 1 88,-2.8 2,-0.3 -2,-0.3 -5,-0.2 -0.663 11.4-162.6 -92.6 134.0 69.7 58.5 49.6 270 270 A G - 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