==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 19-JUL-05 2BWS . COMPND 2 MOLECULE: XAA-PRO AMINOPEPTIDASE P; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.C.GRAHAM,J.M.GUSS . 440 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20030.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 300 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 3.2 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 . 25 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 134 30.5 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 1 1 1 0 3 0 0 1 0 2 1 0 0 0 1 1 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 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 0.000 360.0 360.0 360.0 134.8 80.2 64.0 42.8 2 2 A E - 0 0 122 264,-0.0 2,-0.5 0, 0.0 181,-0.1 -0.895 360.0 -95.7-148.6 178.5 77.7 66.7 43.7 3 3 A I - 0 0 15 -2,-0.3 2,-0.1 263,-0.1 263,-0.0 -0.939 44.8-146.1-104.8 129.0 75.0 68.9 42.2 4 4 A S >> - 0 0 49 -2,-0.5 4,-2.1 1,-0.1 3,-0.7 -0.456 25.6-103.1 -94.8 163.5 76.3 72.3 41.2 5 5 A R H 3> S+ 0 0 108 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.865 120.2 56.4 -45.7 -44.9 74.8 75.8 41.2 6 6 A Q H 3> S+ 0 0 95 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.861 106.0 49.8 -66.3 -33.7 74.3 75.6 37.4 7 7 A E H <> S+ 0 0 7 -3,-0.7 4,-2.4 2,-0.2 -1,-0.2 0.910 108.5 51.4 -71.0 -41.5 72.2 72.5 37.7 8 8 A F H X S+ 0 0 14 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.930 111.4 49.8 -58.0 -42.5 70.0 74.0 40.4 9 9 A Q H X S+ 0 0 49 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.900 108.0 52.5 -60.3 -44.4 69.5 76.9 38.0 10 10 A R H X S+ 0 0 133 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.899 108.9 50.8 -58.0 -41.8 68.6 74.5 35.1 11 11 A R H X S+ 0 0 12 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.931 109.3 49.8 -61.6 -47.1 66.0 72.9 37.3 12 12 A R H X S+ 0 0 2 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.941 112.6 48.1 -57.4 -45.3 64.5 76.3 38.2 13 13 A Q H X S+ 0 0 73 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.869 108.1 54.5 -64.4 -36.5 64.4 77.2 34.5 14 14 A A H X S+ 0 0 39 -4,-2.4 4,-1.0 2,-0.2 -1,-0.2 0.864 110.2 46.7 -65.4 -37.4 62.8 73.8 33.6 15 15 A L H >X S+ 0 0 3 -4,-2.1 4,-1.0 2,-0.2 3,-0.7 0.934 110.9 52.1 -66.2 -47.2 60.0 74.5 36.1 16 16 A V H >< S+ 0 0 6 -4,-2.6 3,-0.9 1,-0.3 -2,-0.2 0.895 103.5 58.6 -57.6 -39.8 59.6 78.1 34.7 17 17 A E H 3< S+ 0 0 140 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.854 107.9 46.8 -57.7 -35.6 59.3 76.6 31.2 18 18 A Q H << S+ 0 0 92 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.610 96.3 96.1 -81.0 -16.8 56.2 74.5 32.5 19 19 A M S << S- 0 0 7 -4,-1.0 3,-0.1 -3,-0.9 4,-0.1 -0.416 80.0-108.1 -77.9 150.1 54.6 77.5 34.2 20 20 A Q - 0 0 95 -2,-0.1 3,-0.2 1,-0.1 46,-0.2 -0.434 42.3 -97.8 -67.1 148.5 51.8 79.7 32.7 21 21 A P S S+ 0 0 53 0, 0.0 47,-0.2 0, 0.0 46,-0.2 -0.392 110.6 35.2 -62.7 146.8 52.8 83.2 31.7 22 22 A G S S+ 0 0 11 44,-1.5 103,-2.6 1,-0.3 104,-1.5 0.946 99.3 114.9 72.3 51.4 51.8 85.7 34.5 23 23 A S E -Ab 66 126A 0 43,-2.1 43,-3.3 -3,-0.2 2,-0.3 -0.947 49.9-149.9-146.0 163.3 52.6 83.4 37.4 24 24 A A E -Ab 65 127A 0 102,-1.7 104,-3.1 -2,-0.3 2,-0.4 -0.998 8.8-149.0-136.9 140.2 54.8 82.7 40.4 25 25 A A E -Ab 64 128A 0 39,-2.4 39,-2.4 -2,-0.3 2,-0.5 -0.923 11.4-157.7-106.1 134.1 56.0 79.5 42.1 26 26 A L E -Ab 63 129A 1 102,-2.8 104,-0.5 -2,-0.4 2,-0.5 -0.950 9.9-177.7-116.5 118.3 56.6 79.5 45.8 27 27 A I E -A 62 0A 0 35,-2.8 35,-3.0 -2,-0.5 2,-0.3 -0.974 13.0-155.9-122.7 118.3 58.9 76.9 47.3 28 28 A F E -A 61 0A 12 -2,-0.5 21,-0.3 33,-0.2 33,-0.2 -0.738 12.0-123.2-101.2 142.1 59.4 76.9 51.1 29 29 A A - 0 0 0 31,-2.8 30,-0.1 -2,-0.3 108,-0.1 -0.306 38.5 -93.9 -72.1 158.8 62.2 75.6 53.3 30 30 A A - 0 0 7 27,-0.1 29,-0.3 1,-0.1 -1,-0.1 -0.436 40.4-115.5 -68.5 144.9 61.6 73.1 56.0 31 31 A P - 0 0 54 0, 0.0 13,-0.3 0, 0.0 2,-0.1 -0.472 33.4-101.3 -71.4 153.3 61.1 74.3 59.6 32 32 A E - 0 0 82 -2,-0.1 2,-0.4 11,-0.1 11,-0.0 -0.457 41.9-138.1 -65.9 155.0 63.6 73.5 62.3 33 33 A V - 0 0 79 8,-0.4 8,-2.4 -2,-0.1 2,-0.2 -0.982 5.1-124.6-130.9 125.0 62.3 70.7 64.4 34 34 A T E -F 40 0B 91 -2,-0.4 6,-0.3 6,-0.2 3,-0.1 -0.445 21.4-179.9 -67.5 134.0 62.5 70.3 68.2 35 35 A R E S- 0 0 160 4,-3.0 2,-0.3 1,-0.3 5,-0.2 0.834 75.3 -19.8 -92.3 -57.1 64.2 67.2 69.6 36 36 A S E > S-F 39 0B 72 3,-1.6 3,-2.9 1,-0.1 -1,-0.3 -0.906 107.5 -45.7-153.7 128.5 63.7 68.0 73.3 37 37 A A T 3 S- 0 0 84 -2,-0.3 -2,-0.1 1,-0.3 -1,-0.1 -0.261 128.2 -8.4 55.1-121.8 63.0 71.3 75.0 38 38 A D T 3 S+ 0 0 155 -4,-0.1 2,-0.4 -3,-0.1 -1,-0.3 0.383 115.6 96.9 -90.5 6.6 65.4 73.9 73.5 39 39 A S E < -F 36 0B 50 -3,-2.9 -4,-3.0 -5,-0.0 -3,-1.6 -0.786 59.2-154.7 -98.5 140.0 67.4 71.3 71.5 40 40 A E E -F 34 0B 96 -2,-0.4 -6,-0.2 -6,-0.3 3,-0.1 -0.751 20.0-109.2-108.4 152.3 66.7 70.7 67.8 41 41 A Y - 0 0 119 -8,-2.4 -8,-0.4 -2,-0.3 3,-0.1 -0.454 57.4 -79.4 -64.8 155.5 67.3 67.7 65.6 42 42 A P - 0 0 74 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 -0.357 64.1 -96.5 -58.5 137.1 70.0 68.2 63.0 43 43 A Y - 0 0 45 -3,-0.1 2,-0.5 13,-0.1 -11,-0.1 -0.321 38.8-170.5 -66.8 136.4 68.4 70.3 60.2 44 44 A R - 0 0 92 -13,-0.3 3,-0.1 -3,-0.1 2,-0.0 -0.975 19.2-136.0-126.0 113.3 67.1 68.5 57.1 45 45 A Q - 0 0 3 -2,-0.5 2,-0.1 1,-0.1 -16,-0.1 -0.371 32.5 -94.7 -63.0 145.2 66.1 70.7 54.2 46 46 A N > - 0 0 13 1,-0.1 4,-2.9 -18,-0.1 5,-0.2 -0.403 34.6-129.6 -53.7 132.1 62.8 70.0 52.4 47 47 A S H > S+ 0 0 9 2,-0.2 4,-2.7 1,-0.2 -1,-0.1 0.879 105.7 46.9 -61.4 -41.8 63.6 67.8 49.4 48 48 A D H > S+ 0 0 5 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.923 114.1 47.6 -68.3 -41.8 61.8 70.0 46.8 49 49 A F H 4 S+ 0 0 0 -21,-0.3 4,-0.5 1,-0.2 3,-0.4 0.942 114.0 47.6 -62.1 -46.8 63.3 73.2 48.2 50 50 A W H >X S+ 0 0 54 -4,-2.9 4,-2.4 1,-0.2 3,-1.7 0.915 104.6 61.3 -55.8 -47.2 66.8 71.5 48.2 51 51 A Y H 3< S+ 0 0 11 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.828 112.3 37.3 -51.7 -37.6 66.1 70.3 44.6 52 52 A F T 3< S+ 0 0 0 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.402 134.9 15.2 -94.7 1.2 65.8 73.9 43.4 53 53 A T T <4 - 0 0 4 -3,-1.7 -3,-0.2 -4,-0.5 -2,-0.2 0.615 68.7-139.7-142.4 -35.4 68.5 75.5 45.6 54 54 A G < + 0 0 22 -4,-2.4 2,-0.5 -5,-0.2 -4,-0.1 0.793 59.1 143.0 57.4 29.5 71.1 73.3 47.4 55 55 A F - 0 0 11 -6,-0.3 -1,-0.2 2,-0.1 -2,-0.1 -0.900 39.7-163.4-108.9 122.3 70.5 75.8 50.2 56 56 A N + 0 0 91 -2,-0.5 -13,-0.1 -3,-0.1 -1,-0.1 -0.139 50.1 103.9-105.1 37.7 70.5 74.3 53.7 57 57 A E - 0 0 27 -2,-0.1 3,-0.1 -13,-0.0 -27,-0.1 -0.909 60.1-132.1-115.2 148.9 68.9 77.0 55.9 58 58 A P S S+ 0 0 9 0, 0.0 21,-0.4 0, 0.0 3,-0.1 -0.228 85.3 49.7 -78.2 178.8 65.4 77.3 57.4 59 59 A E S S+ 0 0 81 -29,-0.3 2,-0.3 1,-0.2 51,-0.2 0.931 85.4 125.8 49.9 55.2 63.3 80.5 57.1 60 60 A A - 0 0 0 18,-0.2 -31,-2.8 -3,-0.1 2,-0.4 -0.991 38.3-172.4-142.3 143.1 63.9 80.7 53.3 61 61 A V E -AC 28 77A 0 16,-2.2 16,-2.8 -2,-0.3 2,-0.5 -0.989 13.4-148.4-140.8 127.7 61.5 80.9 50.4 62 62 A L E -AC 27 76A 0 -35,-3.0 -35,-2.8 -2,-0.4 2,-0.5 -0.864 14.6-167.9 -96.6 127.2 62.3 80.6 46.7 63 63 A V E -AC 26 75A 0 12,-2.9 12,-2.8 -2,-0.5 2,-0.6 -0.978 3.8-167.4-120.1 117.1 60.0 82.7 44.4 64 64 A L E -AC 25 74A 3 -39,-2.4 -39,-2.4 -2,-0.5 2,-0.6 -0.932 8.7-162.8-105.5 117.1 60.1 82.1 40.7 65 65 A I E -AC 24 73A 9 8,-3.1 8,-2.2 -2,-0.6 2,-0.8 -0.891 11.8-170.4-107.5 121.5 58.2 84.8 38.7 66 66 A K E +AC 23 72A 16 -43,-3.3 -43,-2.1 -2,-0.6 -44,-1.5 -0.870 7.3 178.2-108.4 94.0 57.2 84.2 35.1 67 67 A S - 0 0 64 4,-1.0 2,-0.2 -2,-0.8 -1,-0.2 0.900 67.3 -33.0 -66.0 -42.5 56.1 87.6 34.0 68 68 A D S S- 0 0 63 3,-1.6 -1,-0.2 -47,-0.2 -45,-0.1 -0.867 86.2 -62.6-159.1-167.0 55.4 86.4 30.5 69 69 A D S S+ 0 0 122 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.621 131.0 25.7 -70.1 -14.0 56.7 83.8 28.0 70 70 A T S S+ 0 0 107 1,-0.1 2,-0.5 -4,-0.0 -1,-0.2 0.667 111.6 69.6-113.7 -30.1 60.2 85.4 27.6 71 71 A H + 0 0 116 2,-0.0 -3,-1.6 -5,-0.0 -4,-1.0 -0.817 54.1 142.8-102.5 127.2 60.7 87.3 30.9 72 72 A N E +C 66 0A 51 -2,-0.5 2,-0.3 -6,-0.2 -6,-0.2 -0.981 15.7 176.8-153.1 156.3 61.2 85.6 34.3 73 73 A H E -C 65 0A 56 -8,-2.2 -8,-3.1 -2,-0.3 2,-0.4 -0.967 20.8-123.6-156.3 168.1 63.3 86.1 37.4 74 74 A S E -C 64 0A 5 -2,-0.3 32,-1.3 -10,-0.2 31,-0.4 -0.947 13.6-169.4-122.7 142.1 63.9 84.6 40.9 75 75 A V E -Cd 63 106A 0 -12,-2.8 -12,-2.9 -2,-0.4 2,-0.5 -0.999 7.8-159.4-127.3 130.5 63.7 86.1 44.4 76 76 A L E -Cd 62 107A 0 30,-2.4 32,-2.9 -2,-0.4 2,-0.5 -0.941 3.2-159.1-106.9 130.1 65.0 84.4 47.5 77 77 A F E +Cd 61 108A 0 -16,-2.8 -16,-2.2 -2,-0.5 2,-0.3 -0.926 32.7 150.8 -96.8 129.9 63.8 85.3 51.0 78 78 A N E - d 0 109A 0 30,-2.2 32,-2.0 -2,-0.5 33,-0.3 -0.967 49.6 -66.1-154.2 167.1 66.3 84.1 53.5 79 79 A R - 0 0 42 -21,-0.4 15,-0.7 -2,-0.3 3,-0.1 -0.348 52.9-119.5 -63.6 137.1 67.7 85.0 57.0 80 80 A V - 0 0 62 14,-0.2 2,-0.2 1,-0.1 14,-0.1 -0.282 33.2 -92.8 -66.2 151.9 69.5 88.3 57.3 81 81 A R + 0 0 131 12,-0.1 2,-0.3 4,-0.0 -1,-0.1 -0.493 51.0 174.6 -56.1 136.0 73.2 88.6 58.4 82 82 A D > - 0 0 70 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.820 26.8-152.9-155.0 112.0 73.2 89.1 62.1 83 83 A L H > S+ 0 0 137 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.896 95.7 43.6 -53.5 -50.6 76.4 89.2 64.1 84 84 A T H > S+ 0 0 92 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.933 114.2 47.9 -65.1 -49.3 74.8 88.0 67.4 85 85 A A H > S+ 0 0 19 1,-0.2 4,-2.8 2,-0.2 5,-0.4 0.871 115.2 48.3 -58.3 -35.7 72.7 85.2 66.0 86 86 A E H X S+ 0 0 22 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.895 106.2 53.8 -76.6 -42.4 75.7 84.0 64.0 87 87 A I H < S+ 0 0 123 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.891 120.1 36.9 -52.5 -42.1 78.1 84.0 66.9 88 88 A W H < S+ 0 0 192 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.956 134.8 13.0 -77.0 -49.8 75.6 81.8 68.8 89 89 A F H < S- 0 0 178 -4,-2.8 -3,-0.2 1,-0.3 2,-0.2 0.491 110.9 -81.1-118.7 -10.0 74.1 79.5 66.2 90 90 A G < - 0 0 34 -4,-1.7 -1,-0.3 -5,-0.4 -2,-0.1 -0.451 54.8 -49.3 125.9 166.0 76.2 79.7 63.0 91 91 A R - 0 0 227 -2,-0.2 2,-0.4 -4,-0.1 3,-0.1 -0.242 44.0-152.3 -70.8 153.5 76.8 81.6 59.9 92 92 A R - 0 0 50 1,-0.1 -10,-0.1 -35,-0.0 -2,-0.0 -0.960 17.3-134.4-124.4 146.0 74.0 82.7 57.6 93 93 A L > - 0 0 35 -2,-0.4 4,-0.6 1,-0.1 -1,-0.1 0.923 43.5-171.7 -63.8 -46.4 74.3 83.3 53.9 94 94 A G H > - 0 0 0 -15,-0.7 4,-0.6 1,-0.1 -14,-0.2 -0.090 36.7 -71.0 75.8-177.1 72.4 86.6 54.0 95 95 A Q H 4 S+ 0 0 36 2,-0.2 -1,-0.1 1,-0.1 12,-0.1 0.827 120.1 57.8 -86.3 -35.3 71.2 88.8 51.2 96 96 A D H 4 S+ 0 0 156 1,-0.2 4,-0.4 2,-0.1 -1,-0.1 0.916 115.0 34.8 -63.8 -43.3 74.4 90.3 49.7 97 97 A A H X S+ 0 0 45 -4,-0.6 4,-2.4 1,-0.2 5,-0.2 0.644 98.8 81.6 -86.9 -19.2 76.0 86.9 48.9 98 98 A A H X>S+ 0 0 0 -4,-0.6 4,-2.8 1,-0.2 5,-0.6 0.878 83.7 56.7 -62.9 -45.6 72.9 84.9 47.9 99 99 A P H >>S+ 0 0 37 0, 0.0 4,-1.6 0, 0.0 5,-0.5 0.944 117.3 35.0 -53.7 -46.7 72.5 86.0 44.3 100 100 A E H 45S+ 0 0 131 -4,-0.4 -2,-0.2 2,-0.2 -3,-0.1 0.914 120.4 48.8 -71.4 -44.0 76.1 84.9 43.3 101 101 A K H <5S+ 0 0 126 -4,-2.4 -3,-0.2 1,-0.2 -1,-0.2 0.913 127.6 22.6 -63.2 -47.5 76.2 81.9 45.6 102 102 A L H <5S- 0 0 14 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.615 102.8-119.2 -97.6 -18.3 72.9 80.4 44.6 103 103 A G T << + 0 0 23 -4,-1.6 2,-0.3 -5,-0.6 -3,-0.2 0.805 63.2 140.9 78.8 31.6 72.4 82.0 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 -0.755 25.6-173.7 -97.5 145.3 45.7 95.2 44.2 157 157 A T - 0 0 80 -2,-0.3 -34,-2.2 -7,-0.1 -33,-0.4 -0.999 14.9-138.2-138.8 140.2 44.5 91.9 42.7 158 158 A A - 0 0 25 -2,-0.3 2,-0.3 -36,-0.2 -36,-0.1 -0.726 30.0-105.3 -92.6 144.3 45.1 88.3 43.7 159 159 A P - 0 0 5 0, 0.0 -34,-0.2 0, 0.0 -33,-0.2 -0.554 27.4-154.4 -62.2 128.0 45.8 85.4 41.3 160 160 A A S S+ 0 0 103 -35,-0.4 2,-0.5 -2,-0.3 -34,-0.1 0.681 72.8 71.3 -78.4 -19.4 42.5 83.4 41.2 161 161 A T E -e 126 0A 67 -36,-1.5 -34,-2.7 2,-0.0 2,-0.5 -0.880 58.0-174.3-108.0 126.0 44.2 80.2 40.3 162 162 A M E -e 127 0A 59 -2,-0.5 2,-0.5 -36,-0.2 -34,-0.2 -0.985 8.4-168.8-118.0 124.1 46.4 78.2 42.7 163 163 A I E -e 128 0A 54 -36,-2.5 -34,-1.7 -2,-0.5 2,-0.6 -0.939 23.4-128.0-117.9 129.9 48.2 75.1 41.3 164 164 A D - 0 0 60 -2,-0.5 4,-0.4 -36,-0.2 -34,-0.2 -0.665 18.1-165.0 -69.9 115.2 50.0 72.5 43.3 165 165 A W > + 0 0 7 -2,-0.6 4,-2.8 1,-0.2 5,-0.3 0.548 67.9 93.1 -80.1 -6.6 53.5 72.3 41.8 166 166 A R H > S+ 0 0 49 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.922 82.4 50.4 -57.6 -48.1 54.2 69.0 43.5 167 167 A P H > S+ 0 0 88 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.934 115.1 43.4 -55.7 -43.8 53.0 66.8 40.6 168 168 A V H > S+ 0 0 52 -4,-0.4 4,-1.5 2,-0.2 -2,-0.2 0.922 118.2 44.6 -64.5 -45.0 55.1 68.7 38.1 169 169 A V H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.885 111.6 52.0 -70.8 -37.5 58.2 68.8 40.4 170 170 A H H X S+ 0 0 38 -4,-3.2 4,-1.6 -5,-0.3 -1,-0.2 0.874 106.6 53.4 -70.3 -32.7 57.9 65.2 41.4 171 171 A E H X S+ 0 0 74 -4,-1.8 4,-0.6 -5,-0.3 -1,-0.2 0.856 109.6 50.0 -65.5 -35.5 57.8 64.1 37.7 172 172 A M H >< S+ 0 0 28 -4,-1.5 3,-1.3 1,-0.2 -2,-0.2 0.959 110.5 48.6 -62.6 -51.1 61.0 66.1 37.3 173 173 A R H 3< S+ 0 0 4 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.758 99.8 68.2 -60.6 -28.9 62.6 64.3 40.3 174 174 A L H 3< S+ 0 0 1 -4,-1.6 2,-0.6 -5,-0.2 205,-0.4 0.775 96.3 58.1 -62.6 -29.4 61.5 60.9 39.0 175 175 A F S << S- 0 0 58 -3,-1.3 2,-0.2 -4,-0.6 203,-0.2 -0.919 84.3-147.7-108.7 111.0 64.0 61.3 36.0 176 176 A K - 0 0 16 201,-2.5 -3,-0.1 -2,-0.6 -2,-0.1 -0.529 7.2-129.8 -82.5 140.7 67.6 61.7 37.2 177 177 A S > - 0 0 27 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.353 34.3-103.8 -71.0 163.9 70.2 63.7 35.4 178 178 A P H > S+ 0 0 98 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.900 125.9 53.8 -56.4 -36.3 73.6 62.1 34.8 179 179 A E H > S+ 0 0 89 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.903 108.2 48.6 -65.2 -42.8 75.0 64.2 37.7 180 180 A E H > S+ 0 0 4 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.912 110.1 51.7 -62.1 -41.8 72.2 62.9 40.0 181 181 A I H X S+ 0 0 24 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.906 107.7 52.9 -62.7 -39.0 73.0 59.4 38.9 182 182 A A H X S+ 0 0 23 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.905 110.5 47.4 -61.1 -40.6 76.7 60.0 39.8 183 183 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.945 113.2 47.7 -66.0 -45.9 75.7 61.2 43.2 184 184 A L H X S+ 0 0 5 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.858 108.1 56.2 -63.1 -35.3 73.4 58.2 43.7 185 185 A R H X S+ 0 0 83 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.913 109.5 45.7 -61.0 -43.0 76.2 55.9 42.5 186 186 A R H X S+ 0 0 67 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.912 110.5 53.0 -68.0 -41.2 78.5 57.3 45.2 187 187 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 76,-0.3 0.922 109.9 50.2 -57.5 -43.9 75.7 56.9 47.8 188 188 A G H X S+ 0 0 1 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.908 111.4 47.2 -60.2 -43.3 75.4 53.3 46.7 189 189 A E H X S+ 0 0 77 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.910 113.7 47.4 -64.4 -47.2 79.2 52.7 47.1 190 190 A I H X S+ 0 0 0 -4,-2.9 4,-1.9 2,-0.2 -2,-0.2 0.925 114.2 47.1 -59.9 -46.6 79.3 54.4 50.5 191 191 A T H X S+ 0 0 0 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.913 111.2 51.5 -64.5 -43.4 76.3 52.4 51.7 192 192 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.908 107.6 52.6 -59.5 -44.0 77.8 49.1 50.3 193 193 A M H X S+ 0 0 61 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.908 108.9 51.0 -58.9 -39.7 81.1 49.8 52.2 194 194 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.915 110.9 47.5 -64.4 -43.3 79.1 50.2 55.4 195 195 A H H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.883 110.5 51.1 -66.1 -41.0 77.2 46.9 54.8 196 196 A T H X S+ 0 0 32 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.928 110.5 50.8 -57.7 -46.9 80.4 45.0 54.1 197 197 A R H X S+ 0 0 35 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.903 107.0 53.0 -57.1 -45.3 81.9 46.5 57.3 198 198 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.910 110.4 48.0 -59.5 -45.0 78.8 45.3 59.3 199 199 A M H < S+ 0 0 1 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.895 113.2 47.8 -60.2 -42.2 79.3 41.8 58.0 200 200 A E H < S+ 0 0 81 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.719 117.4 42.2 -72.4 -22.2 83.0 41.8 58.8 201 201 A K H < S+ 0 0 87 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.710 86.2 111.2 -95.2 -25.1 82.4 43.2 62.3 202 202 A C < + 0 0 0 -4,-1.9 236,-0.0 -5,-0.2 -4,-0.0 -0.303 36.7 161.6 -63.0 128.6 79.4 41.1 63.4 203 203 A R > - 0 0 72 -2,-0.1 3,-1.8 76,-0.0 48,-0.2 -0.985 47.7 -90.2-139.3 149.9 80.0 38.5 66.1 204 204 A P T 3 S+ 0 0 47 0, 0.0 48,-0.2 0, 0.0 3,-0.1 -0.341 113.3 34.0 -54.2 137.0 77.7 36.6 68.5 205 205 A G T 3 S+ 0 0 33 46,-2.9 2,-0.1 1,-0.5 47,-0.1 0.091 88.1 116.5 99.4 -23.9 77.2 38.7 71.7 206 206 A M < - 0 0 43 -3,-1.8 45,-3.2 45,-0.2 -1,-0.5 -0.461 70.0-112.8 -65.1 149.7 77.4 42.1 70.0 207 207 A F B >> -G 250 0C 66 43,-0.3 3,-1.2 -2,-0.1 4,-0.8 -0.576 19.1-116.5 -82.2 151.8 74.2 44.2 70.3 208 208 A E H >> S+ 0 0 0 41,-2.6 4,-1.3 1,-0.3 3,-1.1 0.915 116.9 59.2 -51.4 -43.4 72.2 45.0 67.2 209 209 A Y H 3> S+ 0 0 110 38,-1.3 4,-2.2 1,-0.3 -1,-0.3 0.774 91.8 68.4 -63.3 -25.2 73.0 48.7 67.8 210 210 A H H <> S+ 0 0 78 -3,-1.2 4,-2.0 2,-0.2 -1,-0.3 0.896 99.8 48.3 -58.1 -39.7 76.8 47.9 67.5 211 211 A L H <>S+ 0 0 1 -4,-2.5 5,-2.3 1,-0.2 3,-0.8 0.957 111.8 49.0 -52.6 -53.3 78.8 56.7 56.3 220 220 A N H ><5S+ 0 0 87 -4,-2.3 3,-2.1 1,-0.2 -2,-0.2 0.886 102.5 58.9 -58.4 -43.5 80.5 59.6 58.1 221 221 A R H 3<5S+ 0 0 143 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.814 107.0 48.3 -64.1 -24.5 84.0 58.8 57.0 222 222 A H T <<5S- 0 0 36 -4,-1.2 -1,-0.3 -3,-0.8 -2,-0.2 0.313 127.5 -96.9 -93.2 6.5 83.0 59.2 53.3 223 223 A G T < 5S+ 0 0 51 -3,-2.1 2,-0.8 1,-0.2 43,-0.3 0.630 89.7 122.5 89.4 13.9 81.2 62.5 54.0 224 224 A A < + 0 0 1 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.2 -0.850 36.7 179.1-101.9 88.1 77.7 61.2 54.4 225 225 A R + 0 0 174 -2,-0.8 -5,-0.2 39,-0.1 -1,-0.2 0.834 59.3 39.2 -63.0 -36.7 77.1 62.6 57.9 226 226 A Y E S-H 264 0D 84 38,-0.6 38,-2.0 -3,-0.1 2,-0.1 -0.895 80.5-116.8-120.1 145.4 73.5 61.3 58.2 227 227 A P E -H 263 0D 37 0, 0.0 36,-0.3 0, 0.0 3,-0.1 -0.420 23.6-128.0 -68.3 156.6 71.6 58.2 57.3 228 228 A S S S- 0 0 18 34,-2.4 132,-0.4 42,-0.2 2,-0.3 0.581 90.0 -0.3 -81.3 -12.1 68.7 58.6 54.8 229 229 A Y S S- 0 0 42 33,-0.6 33,-0.4 130,-0.1 2,-0.3 -0.947 101.1 -65.5-165.0 165.7 66.4 56.8 57.2 230 230 A N - 0 0 130 -2,-0.3 30,-0.1 1,-0.1 -2,-0.0 -0.447 60.3-112.1 -67.9 122.7 66.5 55.1 60.6 231 231 A T - 0 0 5 -2,-0.3 2,-0.5 14,-0.1 30,-0.2 -0.279 25.3-149.8 -59.6 134.2 68.8 52.1 60.5 232 232 A I E +J 260 0E 10 28,-2.7 28,-2.1 -3,-0.1 2,-0.4 -0.929 20.0 172.3-109.5 122.0 67.2 48.7 61.0 233 233 A V E +J 259 0E 0 11,-0.6 2,-0.8 -2,-0.5 26,-0.2 -0.814 11.9 175.2-129.4 89.4 69.3 45.9 62.6 234 234 A G E -J 258 0E 1 24,-3.1 24,-2.1 -2,-0.4 2,-0.3 -0.825 4.7-176.3-107.9 100.4 66.8 43.0 63.1 235 235 A S E > -J 257 0E 5 -2,-0.8 3,-2.0 22,-0.3 22,-0.3 -0.670 56.2 -23.2 -95.1 149.7 68.4 39.8 64.4 236 236 A G G > S- 0 0 8 20,-2.9 3,-1.9 -2,-0.3 4,-0.3 -0.264 137.8 -0.8 53.4-131.3 66.4 36.6 65.0 237 237 A E G > S+ 0 0 124 1,-0.3 3,-1.6 2,-0.2 -1,-0.3 0.734 126.1 71.1 -61.1 -23.1 62.7 37.2 65.4 238 238 A N G X S+ 0 0 35 -3,-2.0 3,-1.8 1,-0.3 -1,-0.3 0.776 83.9 69.4 -64.3 -25.6 63.3 40.9 65.0 239 239 A G G < S+ 0 0 2 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.686 88.7 64.9 -65.6 -18.6 64.1 40.4 61.3 240 240 A C G < S+ 0 0 30 -3,-1.6 2,-0.6 -4,-0.3 -1,-0.3 0.426 84.6 83.5 -83.8 -1.0 60.3 39.6 60.9 241 241 A I S X S- 0 0 92 -3,-1.8 3,-1.3 1,-0.1 161,-0.0 -0.934 77.5-146.3-102.3 118.5 59.5 43.2 61.8 242 242 A L T 3 S+ 0 0 64 -2,-0.6 -1,-0.1 1,-0.3 -8,-0.1 0.853 90.6 20.9 -60.0 -47.7 59.9 45.2 58.6 243 243 A A T 3 S+ 0 0 71 -10,-0.0 2,-0.6 -12,-0.0 -1,-0.3 -0.468 79.8 166.2-118.1 54.9 61.2 48.6 60.1 244 244 A Y < + 0 0 8 -3,-1.3 -11,-0.6 -6,-0.2 -3,-0.0 -0.635 2.7 161.1 -68.0 114.0 62.5 47.3 63.4 245 245 A T + 0 0 58 -2,-0.6 -1,-0.2 -13,-0.2 -14,-0.1 0.421 47.3 91.8-119.8 0.3 64.6 50.2 64.7 246 246 A E - 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