==== 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/HYDROLASE INHIBITOR 22-DEC-97 1A16 . COMPND 2 MOLECULE: AMINOPEPTIDASE P; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.C.WILCE,C.S.BOND,P.E.LILLEY,N.E.DIXON,H.C.FREEMAN,J.M.GUSS . 441 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20020.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 301 68.3 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 . 56 12.7 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 . 28 6.3 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 . 132 29.9 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 1 0 1 2 1 3 0 0 1 0 2 0 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 . 4 2 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 . 3 0 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 0.000 360.0 360.0 360.0 152.2 80.4 64.1 43.0 2 2 A E - 0 0 115 0, 0.0 2,-0.6 0, 0.0 180,-0.1 -0.931 360.0 -90.0-160.0-177.0 77.7 66.7 43.6 3 3 A I - 0 0 12 -2,-0.3 2,-0.1 263,-0.1 263,-0.0 -0.940 45.1-151.6-108.8 116.4 75.0 69.0 42.1 4 4 A S > - 0 0 51 -2,-0.6 4,-1.4 1,-0.1 3,-0.3 -0.281 29.7 -98.1 -83.3 176.7 76.5 72.4 41.3 5 5 A R H > S+ 0 0 97 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.830 119.7 60.1 -60.4 -39.0 74.8 75.8 41.2 6 6 A Q H > S+ 0 0 79 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.909 104.3 48.5 -60.1 -42.6 74.4 75.6 37.4 7 7 A E H > S+ 0 0 7 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.860 108.1 53.8 -67.6 -35.8 72.2 72.5 37.7 8 8 A F H X S+ 0 0 16 -4,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.920 110.1 49.3 -63.6 -38.3 70.0 74.1 40.4 9 9 A Q H X S+ 0 0 63 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.895 107.9 52.8 -65.9 -42.3 69.5 77.0 38.0 10 10 A R H X S+ 0 0 136 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.902 108.0 51.5 -59.8 -42.4 68.6 74.7 35.1 11 11 A R H X S+ 0 0 12 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.883 109.4 50.1 -61.7 -40.3 66.0 73.0 37.3 12 12 A R H X S+ 0 0 6 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.916 111.7 48.2 -66.1 -40.1 64.5 76.4 38.1 13 13 A Q H X S+ 0 0 94 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.860 107.8 55.3 -68.0 -34.6 64.4 77.3 34.4 14 14 A A H X S+ 0 0 40 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.824 109.9 46.3 -68.0 -30.2 62.8 74.0 33.6 15 15 A L H X S+ 0 0 4 -4,-1.4 4,-0.8 -3,-0.2 3,-0.2 0.931 112.2 49.4 -74.9 -48.6 60.0 74.8 36.1 16 16 A V H >< S+ 0 0 6 -4,-2.4 3,-0.7 1,-0.2 -2,-0.2 0.860 105.4 59.6 -56.5 -37.3 59.6 78.3 34.8 17 17 A E H 3< S+ 0 0 145 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.937 108.8 43.3 -58.6 -44.5 59.4 76.9 31.3 18 18 A Q H 3< S+ 0 0 103 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.579 98.4 97.6 -77.8 -11.8 56.4 74.8 32.3 19 19 A M S << S- 0 0 6 -4,-0.8 3,-0.1 -3,-0.7 4,-0.1 -0.484 79.6-111.7 -79.2 152.1 54.8 77.7 34.2 20 20 A Q - 0 0 95 -2,-0.1 3,-0.2 1,-0.1 46,-0.2 -0.404 40.5 -97.2 -76.5 154.7 52.1 79.9 32.7 21 21 A P S S+ 0 0 59 0, 0.0 46,-0.2 0, 0.0 47,-0.2 -0.496 109.7 35.1 -72.7 148.0 53.0 83.6 31.9 22 22 A G S S+ 0 0 12 44,-2.4 103,-2.9 1,-0.3 104,-1.4 0.953 100.0 115.0 73.1 48.9 51.9 86.0 34.6 23 23 A S E -Ab 66 126A 0 43,-1.9 43,-2.9 -3,-0.2 2,-0.3 -0.926 51.1-148.1-144.8 168.0 52.6 83.5 37.5 24 24 A A E -Ab 65 127A 0 102,-1.5 104,-3.2 -2,-0.3 2,-0.5 -0.990 7.7-150.2-143.5 132.5 54.8 82.9 40.5 25 25 A A E -Ab 64 128A 0 39,-3.0 39,-2.5 -2,-0.3 2,-0.5 -0.885 13.1-157.6-102.7 130.3 56.0 79.6 42.1 26 26 A L E -Ab 63 129A 1 102,-2.7 104,-0.5 -2,-0.5 2,-0.5 -0.952 11.2-179.4-113.3 121.9 56.6 79.6 45.9 27 27 A I E -A 62 0A 0 35,-2.5 35,-3.3 -2,-0.5 2,-0.3 -0.972 12.4-157.3-125.1 116.0 58.9 77.0 47.4 28 28 A F E -A 61 0A 10 -2,-0.5 21,-0.3 33,-0.2 33,-0.2 -0.699 13.8-121.5 -97.2 145.7 59.4 77.0 51.2 29 29 A A - 0 0 0 31,-2.5 30,-0.1 -2,-0.3 16,-0.1 -0.335 39.5 -94.5 -76.7 157.9 62.2 75.7 53.4 30 30 A A - 0 0 7 27,-0.1 29,-0.4 1,-0.1 2,-0.2 -0.391 42.4-115.2 -69.9 145.2 61.6 73.1 56.0 31 31 A P - 0 0 58 0, 0.0 13,-0.2 0, 0.0 -1,-0.1 -0.528 34.4 -99.2 -78.9 157.4 61.0 74.5 59.5 32 32 A E - 0 0 75 -2,-0.2 2,-0.4 11,-0.1 11,-0.0 -0.435 42.7-137.4 -68.6 155.9 63.5 73.7 62.2 33 33 A V - 0 0 78 8,-0.3 8,-2.8 -2,-0.1 2,-0.2 -0.970 2.3-126.6-130.5 132.7 62.4 70.9 64.5 34 34 A T E +F 40 0B 90 -2,-0.4 6,-0.3 6,-0.3 3,-0.1 -0.453 19.6 179.2 -70.5 135.1 62.5 70.4 68.3 35 35 A R E S- 0 0 159 4,-3.5 2,-0.3 1,-0.3 5,-0.2 0.781 76.2 -18.9 -99.2 -48.1 64.1 67.2 69.7 36 36 A S E > S-F 39 0B 73 3,-1.7 3,-3.0 1,-0.0 -1,-0.3 -0.893 108.2 -44.5-162.8 129.0 63.6 68.1 73.3 37 37 A A T 3 S- 0 0 84 -2,-0.3 -2,-0.1 1,-0.3 -1,-0.0 -0.240 128.4 -9.9 50.1-114.1 62.9 71.3 75.1 38 38 A D T 3 S+ 0 0 154 -4,-0.1 2,-0.4 -3,-0.1 -1,-0.3 0.202 115.3 95.7 -99.1 13.7 65.3 73.9 73.5 39 39 A S E < -F 36 0B 51 -3,-3.0 -4,-3.5 0, 0.0 -3,-1.7 -0.867 59.7-154.5-105.1 141.8 67.4 71.4 71.6 40 40 A E E -F 34 0B 101 -2,-0.4 -6,-0.3 -6,-0.3 3,-0.1 -0.770 20.0-105.5-115.5 157.2 66.6 70.7 67.9 41 41 A Y - 0 0 124 -8,-2.8 -8,-0.3 -2,-0.3 2,-0.1 -0.332 57.9 -79.2 -70.9 159.1 67.2 67.8 65.6 42 42 A P - 0 0 74 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.476 65.3 -96.0 -59.4 132.7 70.0 68.3 63.0 43 43 A Y - 0 0 48 -2,-0.1 2,-0.5 -3,-0.1 -11,-0.1 -0.243 40.1-169.8 -59.6 132.0 68.5 70.4 60.2 44 44 A R - 0 0 91 -13,-0.2 3,-0.1 -3,-0.1 -1,-0.1 -0.971 18.0-136.4-124.3 112.9 67.0 68.6 57.2 45 45 A Q - 0 0 3 -2,-0.5 11,-0.1 1,-0.1 -16,-0.1 -0.344 31.7 -94.8 -68.8 147.4 66.1 70.8 54.3 46 46 A N > - 0 0 14 1,-0.1 4,-2.4 -18,-0.1 5,-0.2 -0.412 34.4-129.2 -57.4 135.4 62.8 70.1 52.4 47 47 A S H > S+ 0 0 8 1,-0.2 4,-2.8 2,-0.2 -1,-0.1 0.894 105.3 46.0 -58.1 -44.4 63.6 67.9 49.4 48 48 A D H > S+ 0 0 7 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.868 113.6 47.9 -69.3 -36.9 61.8 70.1 46.9 49 49 A F H > S+ 0 0 0 -21,-0.3 4,-0.8 2,-0.2 3,-0.4 0.885 113.8 48.7 -69.6 -37.6 63.3 73.3 48.2 50 50 A W H >X S+ 0 0 56 -4,-2.4 4,-2.2 1,-0.2 3,-1.5 0.948 102.3 62.4 -64.5 -48.8 66.7 71.6 48.2 51 51 A Y H 3< S+ 0 0 10 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.761 112.8 36.7 -47.3 -30.1 66.2 70.3 44.6 52 52 A F H 3< S+ 0 0 0 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.527 134.3 16.1-103.5 -7.7 66.0 74.0 43.4 53 53 A T H << - 0 0 5 -3,-1.5 -3,-0.2 -4,-0.8 -2,-0.2 0.660 68.9-141.7-135.2 -35.5 68.6 75.7 45.6 54 54 A G < + 0 0 24 -4,-2.2 2,-0.5 -5,-0.3 -4,-0.1 0.754 57.6 142.9 67.0 23.4 71.0 73.4 47.4 55 55 A F - 0 0 14 -6,-0.3 -1,-0.3 -5,-0.1 -2,-0.1 -0.882 39.9-163.2-103.3 122.0 70.6 75.9 50.3 56 56 A N + 0 0 87 -2,-0.5 -1,-0.1 -3,-0.1 -13,-0.1 -0.092 49.9 107.6 -99.7 34.9 70.5 74.4 53.8 57 57 A E - 0 0 27 1,-0.0 -27,-0.1 -13,-0.0 3,-0.1 -0.852 59.3-133.4-113.9 145.7 69.0 77.2 55.9 58 58 A P S S+ 0 0 9 0, 0.0 21,-0.5 0, 0.0 3,-0.1 -0.256 83.6 47.9 -82.3-179.7 65.5 77.4 57.4 59 59 A E S S+ 0 0 80 -29,-0.4 20,-0.5 1,-0.2 2,-0.3 0.962 84.7 124.4 49.9 59.4 63.3 80.4 57.1 60 60 A A - 0 0 0 18,-0.2 -31,-2.5 -3,-0.1 2,-0.4 -0.989 40.3-166.9-147.7 143.7 63.8 80.8 53.4 61 61 A V E -AC 28 77A 0 16,-1.9 16,-2.3 -2,-0.3 2,-0.6 -0.998 12.1-147.1-136.8 128.3 61.4 81.0 50.5 62 62 A L E -AC 27 76A 0 -35,-3.3 -35,-2.5 -2,-0.4 2,-0.6 -0.875 15.5-167.4 -96.0 125.3 62.2 80.7 46.7 63 63 A V E -AC 26 75A 0 12,-2.8 12,-2.2 -2,-0.6 2,-0.7 -0.949 4.4-168.8-117.3 113.9 59.9 82.8 44.5 64 64 A L E -AC 25 74A 4 -39,-2.5 -39,-3.0 -2,-0.6 2,-0.5 -0.921 9.1-165.6-105.8 115.3 60.0 82.2 40.8 65 65 A I E -AC 24 73A 9 8,-2.8 8,-2.1 -2,-0.7 2,-0.8 -0.903 11.4-168.4-105.7 121.0 58.2 84.9 38.8 66 66 A K E +AC 23 72A 17 -43,-2.9 -44,-2.4 -2,-0.5 -43,-1.9 -0.865 8.1 177.0-108.9 92.0 57.2 84.4 35.2 67 67 A S - 0 0 62 4,-0.8 2,-0.2 -2,-0.8 5,-0.2 0.913 68.4 -33.2 -59.6 -46.0 56.1 87.8 34.0 68 68 A D S S- 0 0 56 3,-1.9 -1,-0.1 -47,-0.2 -45,-0.1 -0.818 83.9 -65.0-155.8-165.7 55.6 86.5 30.4 69 69 A D S S+ 0 0 120 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.627 132.3 26.8 -70.7 -17.2 57.1 84.0 28.0 70 70 A T S S+ 0 0 101 1,-0.1 2,-0.5 -4,-0.0 -1,-0.2 0.662 112.7 70.5-113.6 -32.9 60.4 85.7 27.7 71 71 A H + 0 0 118 2,-0.0 -3,-1.9 -5,-0.0 -4,-0.8 -0.821 53.2 139.4 -99.0 126.5 60.7 87.5 31.1 72 72 A N E +C 66 0A 52 -2,-0.5 2,-0.3 -6,-0.2 -6,-0.2 -0.978 17.0 176.9-157.8 150.3 61.2 85.7 34.4 73 73 A H E -C 65 0A 59 -8,-2.1 -8,-2.8 -2,-0.3 2,-0.4 -0.975 21.1-123.1-153.6 164.0 63.3 86.3 37.6 74 74 A S E -C 64 0A 9 -2,-0.3 32,-1.3 -10,-0.2 31,-0.4 -0.896 14.1-169.6-118.3 144.6 63.9 84.8 41.0 75 75 A V E -Cd 63 106A 0 -12,-2.2 -12,-2.8 -2,-0.4 2,-0.4 -1.000 7.6-160.8-130.7 128.4 63.6 86.3 44.5 76 76 A L E -Cd 62 107A 0 30,-2.2 32,-3.5 -2,-0.4 2,-0.5 -0.946 4.5-159.4-113.2 129.6 64.9 84.6 47.7 77 77 A F E +Cd 61 108A 0 -16,-2.3 -16,-1.9 -2,-0.4 2,-0.3 -0.938 31.6 153.9-102.4 127.0 63.8 85.4 51.2 78 78 A N E - d 0 109A 0 30,-2.0 32,-1.5 -2,-0.5 33,-0.3 -0.983 49.2 -67.7-152.2 158.7 66.3 84.3 53.7 79 79 A R - 0 0 42 -21,-0.5 15,-0.7 -20,-0.5 3,-0.1 -0.249 54.0-118.9 -52.3 132.7 67.6 85.1 57.2 80 80 A V - 0 0 62 14,-0.2 2,-0.4 1,-0.1 14,-0.1 -0.238 35.1 -91.7 -70.4 152.8 69.4 88.4 57.4 81 81 A R + 0 0 133 12,-0.1 2,-0.4 4,-0.0 -1,-0.1 -0.606 51.6 178.8 -67.9 123.4 73.0 88.5 58.5 82 82 A D > - 0 0 58 -2,-0.4 4,-1.7 1,-0.1 5,-0.2 -0.965 23.1-153.5-134.5 117.4 73.0 89.0 62.3 83 83 A L H > S+ 0 0 129 -2,-0.4 4,-1.9 1,-0.2 5,-0.1 0.877 94.1 41.0 -60.4 -44.1 76.2 89.1 64.3 84 84 A T H > S+ 0 0 98 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.841 115.2 50.8 -76.2 -29.2 74.9 87.8 67.7 85 85 A A H > S+ 0 0 18 2,-0.2 4,-2.5 1,-0.2 5,-0.4 0.787 114.1 46.5 -74.9 -28.5 72.7 85.1 66.2 86 86 A E H X S+ 0 0 19 -4,-1.7 4,-1.2 3,-0.2 -2,-0.2 0.858 106.7 55.0 -82.0 -37.0 75.7 83.9 64.2 87 87 A I H < S+ 0 0 134 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.1 0.905 120.9 34.8 -61.1 -36.5 78.2 84.0 67.0 88 88 A W H < S+ 0 0 199 -4,-1.4 -2,-0.2 -5,-0.1 -3,-0.2 0.956 135.3 14.8 -82.8 -53.5 75.8 81.7 68.9 89 89 A F H < S- 0 0 180 -4,-2.5 -3,-0.2 1,-0.3 2,-0.2 0.626 110.0 -84.2-106.4 -11.8 74.2 79.5 66.2 90 90 A G < - 0 0 36 -4,-1.2 -1,-0.3 -5,-0.4 -2,-0.1 -0.561 54.9 -45.5 128.9 163.7 76.3 79.7 63.0 91 91 A R - 0 0 220 -2,-0.2 2,-0.4 -4,-0.1 3,-0.1 -0.250 44.7-152.1 -68.5 149.3 76.9 81.7 59.9 92 92 A R - 0 0 45 1,-0.1 -6,-0.0 -35,-0.0 -1,-0.0 -0.958 17.1-135.6-121.3 141.8 74.0 82.9 57.7 93 93 A L > - 0 0 33 -2,-0.4 4,-0.6 1,-0.1 -1,-0.1 0.955 43.1-172.1 -61.9 -46.2 74.2 83.5 54.0 94 94 A G H > - 0 0 1 -15,-0.7 4,-0.6 1,-0.1 -14,-0.2 -0.146 37.2 -71.6 77.5 178.5 72.3 86.8 54.3 95 95 A Q H 4 S+ 0 0 35 2,-0.2 -1,-0.1 1,-0.1 -19,-0.1 0.834 119.1 58.6 -81.7 -37.9 71.0 88.9 51.4 96 96 A D H 4 S+ 0 0 162 1,-0.2 4,-0.4 2,-0.1 -1,-0.1 0.912 114.8 35.0 -60.7 -46.6 74.2 90.5 49.9 97 97 A A H X S+ 0 0 47 -4,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.635 98.2 84.0 -85.7 -14.6 75.9 87.2 49.0 98 98 A A H X>S+ 0 0 0 -4,-0.6 4,-3.0 1,-0.2 5,-0.7 0.897 83.6 55.1 -56.5 -50.0 72.8 85.2 48.1 99 99 A P H >>S+ 0 0 38 0, 0.0 4,-1.7 0, 0.0 5,-0.8 0.922 117.1 34.7 -52.0 -51.3 72.3 86.3 44.5 100 100 A E H 45S+ 0 0 136 -4,-0.4 -2,-0.2 3,-0.2 -3,-0.1 0.940 120.2 50.5 -69.6 -46.1 75.8 85.3 43.4 101 101 A K H <5S+ 0 0 128 -4,-2.3 -3,-0.2 1,-0.2 -1,-0.2 0.886 126.3 21.8 -59.7 -49.7 76.0 82.3 45.7 102 102 A L H <5S- 0 0 12 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.718 105.5-116.1 -93.2 -26.9 72.7 80.6 44.8 103 103 A G T << + 0 0 12 -4,-1.7 2,-0.3 -5,-0.7 -3,-0.2 0.810 65.0 140.4 93.1 33.1 72.2 82.2 41.4 104 104 A V < - 0 0 6 -5,-0.8 -1,-0.3 -6,-0.5 -29,-0.1 -0.726 55.7-129.6-104.9 158.8 69.1 84.1 42.2 105 105 A D S S+ 0 0 102 -31,-0.4 2,-0.3 -2,-0.3 -30,-0.2 0.846 85.1 9.0 -77.1 -34.3 68.3 87.6 40.9 106 106 A R E -d 75 0A 106 -32,-1.3 -30,-2.2 -7,-0.1 2,-0.4 -0.973 57.8-156.1-145.1 157.4 67.4 89.2 44.3 107 107 A A E -d 76 0A 17 -2,-0.3 2,-0.3 -32,-0.2 -30,-0.2 -0.995 12.6-175.8-139.8 127.3 67.4 88.3 48.0 108 108 A L E -d 77 0A 34 -32,-3.5 -30,-2.0 -2,-0.4 2,-0.2 -0.891 36.7 -93.6-120.9 154.7 65.2 89.8 50.6 109 109 A A E > -d 78 0A 17 -2,-0.3 3,-2.1 -32,-0.2 -30,-0.2 -0.454 26.0-134.0 -68.5 134.6 65.1 89.3 54.4 110 110 A F G > S+ 0 0 31 -32,-1.5 3,-1.9 1,-0.3 4,-0.3 0.816 104.6 69.6 -56.8 -31.1 62.7 86.6 55.6 111 111 A S G 3 S+ 0 0 81 1,-0.3 -1,-0.3 -33,-0.3 3,-0.3 0.747 98.9 49.7 -59.7 -22.6 61.6 89.1 58.2 112 112 A E G X> S+ 0 0 88 -3,-2.1 4,-1.5 1,-0.2 3,-1.3 0.389 76.6 110.3 -98.4 6.7 60.0 91.2 55.4 113 113 A I H <> S+ 0 0 5 -3,-1.9 4,-2.9 1,-0.3 5,-0.3 0.842 77.5 48.7 -52.2 -40.4 58.1 88.3 53.7 114 114 A N H 34 S+ 0 0 64 -4,-0.3 4,-0.4 -3,-0.3 -1,-0.3 0.761 113.3 47.8 -74.2 -21.1 54.6 89.5 54.7 115 115 A Q H <4 S+ 0 0 90 -3,-1.3 -1,-0.2 -4,-0.1 -2,-0.2 0.680 124.1 31.0 -89.3 -17.8 55.4 93.0 53.5 116 116 A Q H X S+ 0 0 55 -4,-1.5 4,-1.6 -3,-0.3 -2,-0.2 0.761 102.4 69.4-109.8 -36.5 56.8 91.9 50.2 117 117 A L H >X S+ 0 0 6 -4,-2.9 4,-1.6 -5,-0.3 3,-0.8 0.931 99.5 49.5 -54.2 -53.3 55.1 88.7 49.1 118 118 A Y H 3> S+ 0 0 62 -4,-0.4 4,-1.0 -5,-0.3 -1,-0.2 0.862 109.1 55.0 -55.9 -34.5 51.7 90.2 48.4 119 119 A Q H 34 S+ 0 0 99 1,-0.2 -1,-0.3 2,-0.2 -2,-0.2 0.861 107.9 49.3 -67.2 -32.7 53.5 92.8 46.3 120 120 A L H << S+ 0 0 28 -4,-1.6 -1,-0.2 -3,-0.8 -2,-0.2 0.778 114.8 43.6 -75.9 -27.6 55.1 90.1 44.3 121 121 A L H >< S+ 0 0 0 -4,-1.6 3,-1.8 -3,-0.1 -1,-0.2 0.488 84.5 123.2 -93.2 -9.7 51.8 88.2 43.7 122 122 A N T 3< S+ 0 0 60 -4,-1.0 36,-0.2 1,-0.3 3,-0.1 -0.359 85.0 0.3 -57.8 124.1 49.9 91.4 42.9 123 123 A G T 3 S+ 0 0 42 34,-2.4 -1,-0.3 1,-0.2 2,-0.2 0.515 96.5 131.7 77.8 0.7 48.3 91.2 39.4 124 124 A L < - 0 0 23 -3,-1.8 -1,-0.2 33,-0.4 -101,-0.2 -0.504 51.5-145.6 -80.5 159.9 49.6 87.7 38.6 125 125 A D S S+ 0 0 103 -103,-2.9 36,-1.4 1,-0.2 35,-0.4 0.747 77.2 30.7 -96.0 -30.8 47.1 85.2 37.3 126 126 A V E -be 23 161A 1 -104,-1.4 -102,-1.5 33,-0.1 2,-0.4 -0.979 55.1-165.9-134.5 143.3 48.5 82.0 38.9 127 127 A V E -be 24 162A 1 34,-2.2 36,-2.5 -2,-0.4 2,-0.6 -0.996 14.6-150.2-125.7 125.1 50.3 81.1 42.0 128 128 A Y E +be 25 163A 19 -104,-3.2 -102,-2.7 -2,-0.4 2,-0.3 -0.932 31.9 157.6 -96.5 122.2 52.0 77.7 42.3 129 129 A H E -b 26 0A 4 34,-1.7 2,-1.5 -2,-0.6 -102,-0.1 -0.991 46.7-130.0-149.4 135.7 52.0 76.6 45.9 130 130 A A > - 0 0 5 -104,-0.5 3,-1.2 -2,-0.3 4,-0.4 -0.690 39.0-155.7 -86.0 82.3 52.3 73.2 47.5 131 131 A Q T 3 + 0 0 97 -2,-1.5 4,-0.1 1,-0.2 -2,-0.0 -0.352 68.9 19.9 -64.4 138.8 49.3 73.7 49.9 132 132 A G T 3 S+ 0 0 58 2,-0.3 -1,-0.2 -2,-0.1 3,-0.2 0.482 91.0 106.5 83.2 4.3 49.2 71.7 53.1 133 133 A E S < S+ 0 0 80 -3,-1.2 2,-0.4 1,-0.3 -2,-0.1 0.937 92.1 7.8 -77.7 -52.1 53.0 70.9 53.1 134 134 A Y > - 0 0 48 -4,-0.4 4,-2.2 1,-0.1 3,-0.4 -0.998 64.1-143.5-135.2 130.8 53.9 73.2 56.0 135 135 A A H > S+ 0 0 80 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.865 103.1 53.1 -60.5 -38.8 51.4 75.2 58.1 136 136 A Y H > S+ 0 0 61 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.830 108.1 51.1 -67.6 -32.0 53.7 78.2 58.3 137 137 A A H > S+ 0 0 3 -3,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.924 109.9 49.8 -69.4 -45.6 54.0 78.3 54.6 138 138 A D H X S+ 0 0 27 -4,-2.2 4,-3.1 2,-0.2 5,-0.3 0.898 108.5 52.6 -60.6 -40.5 50.2 78.2 54.2 139 139 A V H X S+ 0 0 93 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.934 111.6 46.6 -61.6 -44.9 49.7 81.0 56.8 140 140 A I H < S+ 0 0 15 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.926 116.2 44.1 -61.7 -47.7 52.2 83.2 54.8 141 141 A V H < S+ 0 0 0 -4,-2.6 -2,-0.2 2,-0.2 5,-0.2 0.922 112.1 51.5 -66.3 -44.7 50.5 82.4 51.4 142 142 A N H < 0 0 72 -4,-3.1 4,-1.8 1,-0.2 -1,-0.2 0.866 360.0 360.0 -62.2 -32.9 47.0 82.8 52.7 143 143 A S < 0 0 51 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.2 0.855 360.0 360.0 -73.6 360.0 47.9 86.2 54.1 144 ! 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 0.0 145 145 A L > 0 0 8 0, 0.0 4,-3.0 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 -44.5 46.4 86.6 49.0 146 146 A E H > + 0 0 72 -4,-1.8 4,-1.8 2,-0.2 -3,-0.2 0.830 360.0 52.9 -66.8 -33.2 43.9 87.9 51.6 147 147 A K H 4 S+ 0 0 85 -4,-1.7 4,-0.4 2,-0.2 -1,-0.2 0.883 112.9 43.5 -66.3 -42.5 45.7 91.3 51.4 148 148 A L H >4 S+ 0 0 1 -5,-0.2 3,-1.2 2,-0.2 -2,-0.2 0.947 111.8 52.9 -67.8 -49.1 45.4 91.3 47.6 149 149 A R H 3< S+ 0 0 139 -4,-3.0 3,-0.4 1,-0.3 -2,-0.2 0.869 118.1 36.7 -53.4 -43.3 41.7 90.1 47.7 150 150 A K T 3< S+ 0 0 151 -4,-1.8 3,-0.4 1,-0.2 -1,-0.3 0.394 101.8 79.3 -92.0 0.2 40.7 92.9 50.0 151 151 A G X > + 0 0 4 -3,-1.2 5,-2.2 -4,-0.4 3,-1.3 0.028 46.3 120.0-101.4 31.6 43.0 95.5 48.6 152 152 A S G > 5S+ 0 0 82 -3,-0.4 3,-1.8 1,-0.3 -1,-0.2 0.824 73.5 60.3 -62.0 -32.5 41.1 96.7 45.5 153 153 A R G 3 5S+ 0 0 215 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.711 106.6 47.7 -66.1 -21.7 40.9 100.3 46.8 154 154 A Q G < 5S- 0 0 129 -3,-1.3 -1,-0.3 -6,-0.1 -2,-0.2 0.236 125.4-110.1 -97.9 6.8 44.7 100.2 46.7 155 155 A N T < 5 + 0 0 143 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.822 69.9 145.8 67.0 35.8 44.5 98.7 43.2 156 156 A L < - 0 0 32 -5,-2.2 2,-0.4 -8,-0.2 -1,-0.2 -0.788 27.6-169.5-103.5 144.8 45.7 95.3 44.2 157 157 A T - 0 0 82 -2,-0.3 -34,-2.4 -7,-0.1 -33,-0.4 -0.997 13.0-138.3-136.1 140.9 44.4 92.0 42.7 158 158 A A - 0 0 25 -2,-0.4 2,-0.2 -10,-0.2 -36,-0.1 -0.689 28.8-105.1 -98.1 146.8 45.0 88.5 43.7 159 159 A P - 0 0 8 0, 0.0 -34,-0.2 0, 0.0 -33,-0.1 -0.556 26.2-153.9 -66.1 132.9 45.7 85.6 41.4 160 160 A A S S+ 0 0 105 -35,-0.4 2,-0.4 -2,-0.2 -34,-0.1 0.572 72.3 69.0 -87.1 -7.1 42.5 83.6 41.1 161 161 A T E -e 126 0A 66 -36,-1.4 -34,-2.2 2,-0.0 2,-0.5 -0.935 57.0-173.7-117.6 132.1 44.3 80.3 40.3 162 162 A M E -e 127 0A 63 -2,-0.4 2,-0.5 -36,-0.2 -34,-0.2 -0.992 8.7-168.1-122.8 127.3 46.5 78.2 42.6 163 163 A I E -e 128 0A 56 -36,-2.5 -34,-1.7 -2,-0.5 2,-0.6 -0.952 23.3-126.5-122.6 132.1 48.3 75.3 41.2 164 164 A D - 0 0 67 -2,-0.5 4,-0.4 -36,-0.2 -34,-0.2 -0.667 18.7-164.3 -72.1 116.3 50.1 72.6 43.1 165 165 A W > + 0 0 13 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.591 69.4 87.0 -80.1 -9.8 53.6 72.4 41.7 166 166 A R H > S+ 0 0 51 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.891 80.5 56.0 -59.9 -46.6 54.4 69.0 43.2 167 167 A P H > S+ 0 0 88 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.926 116.2 39.2 -55.4 -39.1 53.0 66.8 40.5 168 168 A V H > S+ 0 0 53 -4,-0.4 4,-1.7 -3,-0.2 -2,-0.2 0.913 118.4 46.4 -74.3 -43.8 55.3 68.6 38.0 169 169 A V H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -3,-0.2 0.895 112.8 50.7 -66.5 -37.9 58.3 68.9 40.3 170 170 A H H X S+ 0 0 35 -4,-3.3 4,-1.3 2,-0.2 -1,-0.2 0.799 107.6 52.1 -72.2 -27.9 58.0 65.3 41.4 171 171 A E H X S+ 0 0 70 -4,-1.1 4,-0.5 -5,-0.3 -1,-0.2 0.838 110.6 50.1 -74.0 -33.2 57.9 64.1 37.8 172 172 A M H >< S+ 0 0 32 -4,-1.7 3,-1.6 1,-0.2 -2,-0.2 0.971 110.5 49.0 -65.1 -50.3 61.1 66.1 37.3 173 173 A R H 3< S+ 0 0 3 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.756 99.8 67.9 -59.2 -28.4 62.6 64.4 40.3 174 174 A L H 3< S+ 0 0 0 -4,-1.3 2,-0.6 1,-0.2 205,-0.4 0.728 96.1 59.7 -65.2 -25.4 61.6 61.0 39.0 175 175 A F S << S- 0 0 56 -3,-1.6 203,-0.2 -4,-0.5 2,-0.2 -0.921 83.0-146.8-112.9 108.6 64.1 61.4 36.1 176 176 A K - 0 0 15 201,-2.9 -3,-0.1 -2,-0.6 -2,-0.1 -0.466 6.5-132.7 -78.8 141.2 67.7 61.8 37.2 177 177 A S > - 0 0 28 -2,-0.2 4,-2.3 1,-0.1 3,-0.3 -0.436 35.6-102.2 -81.7 160.7 70.3 63.8 35.4 178 178 A P H > S+ 0 0 95 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.877 125.2 53.5 -52.3 -37.4 73.7 62.2 34.8 179 179 A E H > S+ 0 0 87 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.892 107.7 49.0 -64.8 -40.7 75.0 64.3 37.7 180 180 A E H > S+ 0 0 4 -3,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.870 109.3 52.7 -66.8 -38.2 72.3 63.0 40.1 181 181 A I H X S+ 0 0 24 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.853 107.3 52.4 -67.7 -30.6 73.0 59.5 39.0 182 182 A A H X S+ 0 0 24 -4,-1.6 4,-1.9 -5,-0.2 -1,-0.2 0.882 110.3 48.1 -69.8 -39.8 76.7 60.0 39.8 183 183 A V H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.947 113.7 46.4 -65.2 -47.0 75.8 61.3 43.3 184 184 A L H X S+ 0 0 2 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.814 109.0 56.4 -63.6 -31.9 73.4 58.3 43.8 185 185 A R H X S+ 0 0 94 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.900 108.8 46.0 -67.8 -40.2 76.2 56.0 42.6 186 186 A R H X S+ 0 0 64 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.884 112.4 51.5 -69.1 -37.0 78.5 57.4 45.2 187 187 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 76,-0.4 0.888 109.7 49.1 -66.6 -39.5 75.8 57.0 47.9 188 188 A G H X S+ 0 0 0 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.870 113.1 47.7 -67.1 -35.2 75.2 53.4 46.8 189 189 A E H X S+ 0 0 88 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.879 111.6 49.1 -72.0 -42.1 79.0 52.7 47.1 190 190 A I H X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.936 113.3 47.8 -63.1 -44.1 79.3 54.4 50.5 191 191 A T H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.836 109.1 53.8 -66.9 -34.0 76.3 52.4 51.8 192 192 A A H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.895 106.6 51.5 -68.3 -39.7 77.8 49.1 50.3 193 193 A M H X S+ 0 0 56 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.874 108.7 52.2 -64.9 -35.9 81.1 49.7 52.2 194 194 A A H X S+ 0 0 0 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.920 110.5 47.3 -64.9 -44.1 79.1 50.2 55.4 195 195 A H H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.813 111.5 50.3 -67.0 -33.1 77.3 46.9 54.9 196 196 A T H X S+ 0 0 31 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.931 110.7 50.3 -68.7 -46.3 80.5 45.1 54.1 197 197 A R H X S+ 0 0 40 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.908 108.9 51.7 -58.4 -44.6 82.0 46.6 57.3 198 198 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 3,-0.5 0.900 109.4 49.7 -60.0 -43.8 79.0 45.4 59.3 199 199 A M H < S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.874 112.9 47.7 -62.7 -37.7 79.4 41.8 58.0 200 200 A E H < S+ 0 0 75 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.624 116.0 43.3 -78.0 -18.2 83.0 41.8 58.8 201 201 A K H < S+ 0 0 92 -4,-1.2 -2,-0.2 -3,-0.5 -1,-0.2 0.740 85.2 111.4 -97.4 -29.7 82.5 43.2 62.4 202 202 A C < + 0 0 0 -4,-2.3 236,-0.0 -5,-0.2 -4,-0.0 -0.184 37.4 163.8 -54.5 128.0 79.5 41.1 63.4 203 203 A R > - 0 0 63 76,-0.0 3,-2.0 77,-0.0 48,-0.2 -0.991 47.0 -91.2-144.6 141.7 80.2 38.5 66.1 204 204 A P T 3 S+ 0 0 44 0, 0.0 48,-0.2 0, 0.0 3,-0.1 -0.217 112.9 32.7 -53.1 138.2 77.8 36.6 68.4 205 205 A G T 3 S+ 0 0 33 46,-3.6 47,-0.1 1,-0.4 2,-0.1 0.216 87.4 117.5 100.6 -21.1 77.2 38.6 71.6 206 206 A M < - 0 0 45 -3,-2.0 45,-3.9 45,-0.2 -1,-0.4 -0.415 69.9-109.0 -74.2 158.9 77.5 42.0 70.1 207 207 A F B >> -G 250 0C 68 43,-0.3 3,-2.0 1,-0.1 4,-0.8 -0.656 19.8-117.9 -90.7 150.4 74.4 44.2 70.3 208 208 A E H >> S+ 0 0 0 41,-2.5 3,-1.3 1,-0.3 4,-1.2 0.924 115.0 58.5 -51.1 -43.4 72.3 45.0 67.3 209 209 A Y H 3> S+ 0 0 108 38,-1.6 4,-1.8 1,-0.3 -1,-0.3 0.631 92.3 70.1 -64.1 -14.7 73.1 48.8 67.8 210 210 A H H <> S+ 0 0 77 -3,-2.0 4,-1.9 2,-0.2 -1,-0.3 0.874 98.7 47.4 -68.6 -38.2 76.8 48.0 67.5 211 211 A L H <>S+ 0 0 1 -4,-2.4 5,-2.1 1,-0.2 3,-0.9 0.966 112.1 49.3 -57.6 -53.1 78.8 56.7 56.3 220 220 A N H ><5S+ 0 0 80 -4,-1.9 3,-2.4 1,-0.2 -2,-0.2 0.892 102.0 58.4 -54.7 -48.6 80.5 59.6 58.2 221 221 A R H 3<5S+ 0 0 151 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.795 106.3 50.6 -60.0 -22.2 84.0 59.0 57.1 222 222 A H T <<5S- 0 0 34 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.304 127.6 -95.6 -96.1 8.5 83.0 59.3 53.4 223 223 A G T < 5S+ 0 0 56 -3,-2.4 2,-0.7 1,-0.2 43,-0.3 0.647 91.1 119.1 90.7 10.3 81.2 62.6 54.0 224 224 A A < - 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