==== 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 08-FEB-97 1MJZ . COMPND 2 MOLECULE: INORGANIC PYROPHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR V.OGANESYAN,E.H.HARUTYUNYAN,S.M.AVAEVA,R.HUBER . 175 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9101.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 62.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 25.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 14 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 17.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 2 1 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 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 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 99 0, 0.0 3,-1.3 0, 0.0 36,-0.1 0.000 360.0 360.0 360.0 162.3 57.1 92.1 10.2 2 2 A L G > + 0 0 36 35,-0.3 3,-1.0 1,-0.2 35,-0.1 0.663 360.0 71.1 -56.1 -22.7 56.7 89.1 12.6 3 3 A L G 3 S+ 0 0 50 1,-0.2 -1,-0.2 33,-0.1 34,-0.1 0.760 93.9 53.6 -70.9 -19.2 55.3 87.3 9.5 4 4 A N G < S+ 0 0 115 -3,-1.3 -1,-0.2 2,-0.0 -2,-0.1 0.080 77.1 124.1-100.1 16.5 58.8 87.2 7.9 5 5 A V < - 0 0 23 -3,-1.0 13,-0.1 1,-0.1 11,-0.0 -0.729 64.7-119.0 -75.6 125.1 60.6 85.6 10.8 6 6 A P - 0 0 64 0, 0.0 53,-0.5 0, 0.0 10,-0.2 0.009 15.2-119.8 -47.9 158.3 62.3 82.4 9.8 7 7 A A S S- 0 0 5 1,-0.4 9,-2.6 51,-0.1 2,-0.3 0.878 81.8 -46.4 -75.5 -34.5 61.3 79.1 11.5 8 8 A G - 0 0 15 7,-0.4 -1,-0.4 1,-0.1 3,-0.3 -0.896 47.9-106.5 178.2 167.8 64.9 78.7 12.8 9 9 A K S S+ 0 0 125 -2,-0.3 6,-0.2 1,-0.2 2,-0.1 0.809 114.8 10.4 -72.0 -41.6 68.5 78.9 11.7 10 10 A D B >> S-A 14 0A 88 4,-1.7 4,-1.4 -3,-0.1 3,-1.1 -0.639 100.2-119.7-146.0 73.4 68.9 75.1 11.6 11 11 A L T 34 S+ 0 0 48 1,-0.3 -3,-0.1 -3,-0.3 4,-0.1 -0.387 81.3 11.6 -61.8 145.9 65.6 73.2 12.1 12 12 A P T 34 S+ 0 0 23 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 -0.969 134.1 36.0 -92.6 10.8 64.6 71.3 14.0 13 13 A E T <4 S+ 0 0 76 -3,-1.1 2,-0.4 1,-0.2 -2,-0.2 0.620 119.5 45.3 -93.7 -14.1 67.3 71.7 16.6 14 14 A D B < S+A 10 0A 17 -4,-1.4 -4,-1.7 74,-0.1 2,-0.3 -0.938 79.4 154.2-134.8 100.0 67.9 75.5 16.2 15 15 A I E -B 87 0B 0 72,-2.2 72,-2.9 -2,-0.4 2,-0.4 -0.840 40.0-125.7-129.6 163.1 64.5 77.4 16.0 16 16 A Y E -B 86 0B 51 -9,-2.6 2,-0.5 -2,-0.3 43,-0.3 -0.929 19.5-159.3-107.4 130.0 62.9 80.8 16.6 17 17 A V E -B 85 0B 0 68,-2.7 68,-2.7 -2,-0.4 2,-0.7 -0.976 11.8-142.3-109.6 125.4 59.8 81.1 18.9 18 18 A V E -BC 84 57B 0 39,-3.6 39,-1.4 -2,-0.5 2,-0.3 -0.798 24.6-131.5 -80.8 116.2 57.7 84.2 18.5 19 19 A I E + C 0 56B 0 64,-3.2 63,-3.2 -2,-0.7 37,-0.3 -0.556 37.1 163.0 -76.1 128.6 56.5 85.2 22.0 20 20 A E E + 0 0 15 35,-3.0 36,-0.2 -2,-0.3 -1,-0.2 0.691 69.1 25.1-104.6 -38.3 52.8 85.9 22.4 21 21 A I E S- C 0 55B 1 34,-2.1 34,-2.9 59,-0.1 -1,-0.3 -0.998 76.9-133.6-139.6 122.8 52.3 85.7 26.3 22 22 A P > - 0 0 21 0, 0.0 3,-1.0 0, 0.0 29,-0.3 -0.448 34.5 -91.8 -68.2 147.5 55.0 86.3 28.9 23 23 A A T 3 S+ 0 0 11 1,-0.2 31,-0.1 50,-0.2 30,-0.0 -0.356 109.3 10.8 -51.1 146.0 55.6 84.0 31.8 24 24 A N T 3 S+ 0 0 98 27,-2.3 -1,-0.2 1,-0.2 2,-0.2 0.783 93.7 146.8 56.3 25.6 53.6 85.1 34.9 25 25 A A < - 0 0 30 -3,-1.0 26,-0.4 1,-0.2 -1,-0.2 -0.597 59.8 -82.3 -82.4 156.8 51.5 87.7 33.1 26 26 A D - 0 0 127 -2,-0.2 2,-2.2 1,-0.1 -1,-0.2 -0.250 62.0 -89.9 -43.0 152.9 47.9 88.7 33.9 27 27 A P S S+ 0 0 47 0, 0.0 18,-1.5 0, 0.0 2,-0.5 -0.226 80.6 130.7 -80.8 57.1 45.5 86.2 32.3 28 28 A I E -I 44 0C 36 -2,-2.2 2,-0.7 16,-0.2 16,-0.2 -0.958 48.0-146.9-104.3 122.6 45.0 87.8 28.8 29 29 A K E -I 43 0C 49 14,-2.3 13,-3.0 -2,-0.5 14,-1.5 -0.851 20.2-173.2 -92.5 114.1 45.5 85.4 25.9 30 30 A Y E -I 41 0C 60 -2,-0.7 2,-0.3 11,-0.2 11,-0.2 -0.796 7.2-168.4-107.5 160.5 47.0 87.1 22.9 31 31 A E E -I 40 0C 76 9,-1.8 9,-2.6 -2,-0.3 2,-0.5 -0.983 27.2-118.5-146.5 130.1 47.6 85.7 19.5 32 32 A I E -I 39 0C 4 -2,-0.3 2,-0.3 7,-0.2 7,-0.2 -0.700 34.4-127.8 -69.3 128.7 49.5 87.1 16.5 33 33 A D > - 0 0 37 5,-2.8 4,-1.4 -2,-0.5 5,-0.1 -0.690 8.6-147.2 -74.6 134.9 47.1 87.6 13.7 34 34 A K T 4 S+ 0 0 94 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.841 94.2 54.3 -85.3 -27.2 48.4 86.0 10.6 35 35 A E T 4 S+ 0 0 177 1,-0.1 -1,-0.2 3,-0.1 -32,-0.1 0.987 127.4 11.7 -60.6 -63.0 46.8 88.6 8.3 36 36 A S T 4 S- 0 0 68 2,-0.1 -2,-0.2 -35,-0.0 -33,-0.1 0.662 89.7-127.8 -92.2 -16.9 48.2 91.9 9.9 37 37 A G < + 0 0 11 -4,-1.4 -35,-0.3 1,-0.3 2,-0.2 0.675 64.0 137.7 65.1 16.4 50.9 90.5 12.1 38 38 A A - 0 0 46 -6,-0.1 -5,-2.8 -5,-0.1 2,-0.7 -0.607 63.4-106.0 -92.4 159.8 49.4 92.5 15.0 39 39 A L E -I 32 0C 73 -7,-0.2 2,-0.4 -2,-0.2 -7,-0.2 -0.755 42.9-167.5 -76.4 110.7 49.0 91.3 18.5 40 40 A F E -I 31 0C 103 -9,-2.6 -9,-1.8 -2,-0.7 2,-0.5 -0.862 25.0-117.6-102.8 139.1 45.2 90.6 19.1 41 41 A V E +I 30 0C 72 -2,-0.4 -11,-0.2 -11,-0.2 3,-0.1 -0.545 29.3 179.3 -71.0 123.1 43.3 90.0 22.3 42 42 A D E - 0 0 70 -13,-3.0 2,-0.3 -2,-0.5 -12,-0.2 0.808 59.8 -39.2 -93.1 -41.8 41.9 86.5 22.0 43 43 A R E -I 29 0C 91 -14,-1.5 -14,-2.3 2,-0.0 2,-0.9 -0.954 43.7-110.3-173.0 166.3 40.2 86.5 25.4 44 44 A F E -I 28 0C 143 -2,-0.3 -16,-0.2 -16,-0.2 -3,-0.0 -0.892 46.4-132.3 -99.5 100.7 40.3 87.4 29.0 45 45 A M - 0 0 23 -18,-1.5 97,-0.1 -2,-0.9 4,-0.1 -0.170 6.1-145.8 -51.8 141.0 40.6 84.0 30.7 46 46 A S + 0 0 77 95,-0.2 2,-0.1 2,-0.1 -1,-0.1 0.735 70.0 86.7 -89.0 -26.9 38.2 83.5 33.6 47 47 A T S S- 0 0 19 94,-0.6 2,-1.7 1,-0.1 94,-0.1 -0.422 83.5-119.8 -73.3 153.6 40.4 81.4 35.9 48 48 A A S S+ 0 0 110 -2,-0.1 2,-0.3 -22,-0.0 -1,-0.1 -0.512 74.7 120.2 -88.5 71.7 42.9 82.9 38.4 49 49 A M - 0 0 43 -2,-1.7 2,-0.3 92,-0.1 -4,-0.1 -0.939 48.7-152.6-137.4 149.5 45.8 81.2 36.6 50 50 A F - 0 0 106 -2,-0.3 -24,-0.1 -23,-0.1 -27,-0.1 -0.942 34.7 -96.8-125.6 156.1 49.0 82.5 34.9 51 51 A Y - 0 0 6 -26,-0.4 -27,-2.3 -2,-0.3 -26,-0.2 -0.483 30.9-147.2 -69.8 131.6 51.1 81.0 32.1 52 52 A P S S+ 0 0 14 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.655 78.6 15.4 -79.9 -15.0 53.9 79.2 33.9 53 53 A C S S- 0 0 3 -31,-0.1 -29,-0.1 21,-0.1 2,-0.1 -0.874 102.8 -73.2-139.6 165.9 56.4 79.9 31.1 54 54 A N E - D 0 73B 0 19,-1.3 19,-2.6 -2,-0.3 2,-0.4 -0.296 51.3-148.8 -56.9 146.7 56.5 82.3 28.0 55 55 A Y E +CD 21 72B 8 -34,-2.9 -35,-3.0 17,-0.2 -34,-2.1 -0.923 34.6 117.5-134.0 119.4 54.1 81.1 25.3 56 56 A G E -CD 19 71B 0 15,-2.2 15,-2.5 -2,-0.4 2,-0.3 -0.881 43.7-102.4-159.5-143.7 54.4 81.5 21.6 57 57 A Y E -CD 18 70B 4 -39,-1.4 -39,-3.6 13,-0.3 2,-0.6 -0.921 22.8-111.9-154.4 158.0 54.8 79.8 18.2 58 58 A I - 0 0 0 11,-1.8 3,-0.4 -2,-0.3 11,-0.3 -0.927 40.1-124.4 -95.5 128.2 57.2 78.9 15.5 59 59 A N S S+ 0 0 4 -2,-0.6 -43,-0.1 -53,-0.5 3,-0.1 -0.275 87.6 26.7 -81.2 153.6 56.6 80.8 12.3 60 60 A H S S+ 0 0 96 1,-0.3 2,-0.3 -57,-0.1 112,-0.2 0.906 96.2 112.0 72.4 38.2 56.1 78.9 9.0 61 61 A T - 0 0 5 -3,-0.4 2,-0.4 111,-0.1 -1,-0.3 -0.990 48.9-160.6-142.2 148.5 54.7 75.8 10.6 62 62 A L - 0 0 47 106,-1.4 109,-0.2 -2,-0.3 2,-0.1 -0.956 10.7-155.2-138.1 114.6 51.3 74.2 10.6 63 63 A S B >> -J 67 0D 6 4,-3.8 3,-2.4 -2,-0.4 4,-0.5 -0.479 40.9 -92.3 -90.3 164.1 50.4 71.7 13.2 64 64 A L T 34 S+ 0 0 109 1,-0.3 38,-0.1 2,-0.1 -1,-0.1 0.755 122.8 62.2 -38.3 -38.5 47.7 69.1 12.7 65 65 A D T 34 S- 0 0 44 36,-0.2 -1,-0.3 2,-0.2 37,-0.0 0.197 123.2 -95.2 -85.5 13.7 45.0 71.5 14.1 66 66 A G T <4 S+ 0 0 57 -3,-2.4 -2,-0.1 1,-0.3 -1,-0.1 0.691 93.0 72.5 92.9 20.2 45.4 74.1 11.5 67 67 A D B < S-J 63 0D 68 -4,-0.5 -4,-3.8 3,-0.0 -1,-0.3 -0.959 86.2 -60.5-161.6 175.6 47.9 76.6 13.1 68 68 A P - 0 0 18 0, 0.0 2,-0.2 0, 0.0 -6,-0.2 -0.165 61.2 -90.7 -69.1 153.4 51.5 77.0 14.0 69 69 A V - 0 0 2 -11,-0.3 -11,-1.8 96,-0.1 2,-0.3 -0.409 45.0-135.5 -55.4 112.9 53.3 74.7 16.5 70 70 A D E -D 57 0B 16 33,-0.4 35,-2.0 -13,-0.2 2,-0.4 -0.658 23.2-166.4 -62.2 139.5 52.9 76.3 20.0 71 71 A V E -De 56 105B 0 -15,-2.5 -15,-2.2 -2,-0.3 2,-0.4 -0.997 18.3-148.2-138.6 137.7 55.9 76.4 22.3 72 72 A L E -De 55 106B 0 33,-2.5 35,-2.3 -2,-0.4 -17,-0.2 -0.884 18.0-169.6-107.2 134.2 56.6 77.1 26.0 73 73 A V E -D 54 0B 0 -19,-2.6 -19,-1.3 -2,-0.4 2,-0.2 -0.939 9.6-152.5-133.2 100.9 59.9 78.7 26.7 74 74 A P + 0 0 15 0, 0.0 -21,-0.1 0, 0.0 3,-0.0 -0.626 24.3 172.0 -75.6 144.4 61.2 79.0 30.3 75 75 A T - 0 0 28 -2,-0.2 4,-0.0 33,-0.1 -2,-0.0 -0.945 47.0-114.0-152.3 154.9 63.5 82.0 30.8 76 76 A P S S+ 0 0 69 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.886 106.8 23.5 -66.6 -32.0 65.1 83.6 33.9 77 77 A Y S S- 0 0 179 -3,-0.0 -54,-0.1 0, 0.0 0, 0.0 -0.982 98.0 -94.6-131.1 144.1 62.9 86.8 33.2 78 78 A P - 0 0 73 0, 0.0 2,-0.2 0, 0.0 -54,-0.0 -0.128 42.6-129.9 -57.8 144.0 59.6 87.2 31.4 79 79 A L - 0 0 48 -58,-0.1 3,-0.1 1,-0.1 6,-0.0 -0.565 19.5 -99.1 -96.0 167.0 59.8 88.2 27.7 80 80 A Q > - 0 0 149 -2,-0.2 3,-2.4 1,-0.1 -61,-0.2 -0.630 41.0-105.5 -82.7 130.5 58.0 90.9 25.7 81 81 A P T 3 S+ 0 0 41 0, 0.0 -61,-0.2 0, 0.0 3,-0.1 -0.288 110.0 26.2 -46.0 124.0 55.0 90.0 23.6 82 82 A G T 3 S+ 0 0 28 -63,-3.2 2,-0.2 1,-0.3 -62,-0.1 0.471 91.9 128.2 92.2 1.9 56.2 90.1 20.0 83 83 A S < - 0 0 35 -3,-2.4 -64,-3.2 -64,-0.2 2,-0.5 -0.622 53.7-134.2 -89.2 154.2 59.8 89.3 20.8 84 84 A V E -B 18 0B 61 -2,-0.2 2,-0.4 -66,-0.2 -66,-0.2 -0.883 19.3-166.1-107.7 124.0 61.6 86.5 19.0 85 85 A I E -B 17 0B 9 -68,-2.7 -68,-2.7 -2,-0.5 2,-0.5 -0.928 19.4-131.8-114.3 135.8 63.8 84.0 21.0 86 86 A R E +B 16 0B 37 -2,-0.4 24,-2.1 -70,-0.2 2,-0.3 -0.787 43.3 170.0 -75.3 122.0 66.3 81.6 19.7 87 87 A C E -BF 15 109B 0 -72,-2.9 -72,-2.2 -2,-0.5 -14,-0.0 -0.899 36.9-133.6-137.0 167.7 65.6 78.2 21.3 88 88 A R E - F 0 108B 35 20,-3.0 20,-2.1 -2,-0.3 -74,-0.1 -0.949 31.6-124.9-117.7 121.5 66.4 74.5 21.4 89 89 A P E + F 0 107B 2 0, 0.0 18,-0.3 0, 0.0 73,-0.1 -0.240 34.6 165.9 -63.4 140.2 63.4 72.0 21.6 90 90 A V E - 0 0 0 16,-2.9 33,-0.4 1,-0.4 68,-0.4 0.550 55.6 -12.9-139.3 -6.4 63.6 69.6 24.5 91 91 A G E - F 0 106B 0 15,-1.5 15,-2.1 67,-0.2 -1,-0.4 -0.979 50.5-129.9 172.8 170.8 60.2 68.0 24.9 92 92 A V E -GF 156 105B 0 64,-1.8 64,-2.7 -2,-0.3 2,-0.5 -0.992 7.2-148.1-150.4 146.7 56.5 67.9 24.1 93 93 A L E -GF 155 104B 0 11,-1.8 11,-2.1 -2,-0.3 2,-0.3 -0.987 23.0-145.3-121.1 115.8 53.3 67.7 26.1 94 94 A K E +G 154 0B 44 60,-3.5 59,-2.7 -2,-0.5 60,-1.5 -0.615 28.6 157.1 -89.4 138.4 50.6 65.9 24.3 95 95 A M E -G 152 0B 3 -2,-0.3 7,-2.7 57,-0.3 2,-0.5 -0.992 32.3-139.8-151.4 156.5 46.9 66.9 24.7 96 96 A T E +GH 151 101B 28 55,-3.1 55,-3.5 -2,-0.3 5,-0.2 -0.937 23.4 165.8-111.5 127.7 43.5 66.8 23.1 97 97 A N E > - H 0 100B 16 3,-1.7 3,-1.1 -2,-0.5 53,-0.2 -0.230 64.4 -67.3-107.1-148.3 41.0 69.7 23.2 98 98 A E T 3 S+ 0 0 146 51,-0.4 52,-0.1 1,-0.2 3,-0.1 0.172 134.6 54.7 -95.5 25.4 37.8 70.1 21.1 99 99 A A T 3 S- 0 0 69 1,-0.4 -1,-0.2 3,-0.0 2,-0.1 0.115 112.2-116.3-123.7 14.2 40.0 70.4 18.0 100 100 A G E < S+H 97 0B 24 -3,-1.1 -3,-1.7 2,-0.1 -1,-0.4 -0.450 74.8 17.4 86.1-162.6 41.9 67.2 18.4 101 101 A E E +H 96 0B 127 -5,-0.2 -36,-0.2 -2,-0.1 -5,-0.2 -0.221 58.5 168.4 -40.0 122.0 45.7 66.7 19.0 102 102 A D - 0 0 18 -7,-2.7 -1,-0.1 -38,-0.1 -6,-0.1 -0.459 13.4-169.5-147.5 69.7 47.4 69.9 20.2 103 103 A A - 0 0 10 -9,-0.1 2,-0.5 1,-0.1 -33,-0.4 -0.071 10.3-149.4 -42.5 143.5 50.9 69.3 21.4 104 104 A K E - F 0 93B 4 -11,-2.1 -11,-1.8 -35,-0.1 -33,-0.2 -0.941 12.5-149.3-123.7 118.4 52.9 71.9 23.2 105 105 A L E -eF 71 92B 0 -35,-2.0 -33,-2.5 -2,-0.5 2,-0.4 -0.391 2.6-145.0 -67.9 155.6 56.6 71.8 22.8 106 106 A V E +eF 72 91B 0 -15,-2.1 -16,-2.9 -35,-0.2 -15,-1.5 -0.980 23.4 174.0-117.2 136.1 58.9 72.9 25.4 107 107 A A E - F 0 89B 0 -35,-2.3 3,-0.1 -2,-0.4 -90,-0.0 -0.988 18.3-143.3-135.9 143.7 62.1 74.6 24.2 108 108 A V E - F 0 88B 0 -20,-2.1 -20,-3.0 -2,-0.3 -33,-0.1 -0.677 38.5 -81.5-107.5 157.0 64.9 76.3 26.2 109 109 A P E - F 0 87B 7 0, 0.0 -22,-0.3 0, 0.0 8,-0.2 -0.346 56.3-105.6 -56.6 139.0 66.9 79.4 25.3 110 110 A H >> - 0 0 31 -24,-2.1 3,-2.0 -95,-0.1 4,-1.0 -0.219 28.3-106.5 -67.6 155.5 69.7 78.5 23.0 111 111 A S T 34 S+ 0 0 51 1,-0.3 -1,-0.1 2,-0.2 3,-0.1 0.768 116.3 63.1 -63.4 -26.7 73.3 78.4 24.3 112 112 A K T 34 S+ 0 0 165 1,-0.2 -1,-0.3 3,-0.1 3,-0.1 0.781 107.1 43.3 -70.9 -21.7 74.2 81.6 22.6 113 113 A L T <4 S- 0 0 100 -3,-2.0 2,-0.3 1,-0.4 -1,-0.2 0.652 134.3 -13.3 -83.2 -22.9 71.6 83.6 24.6 114 114 A S < - 0 0 35 -4,-1.0 -1,-0.4 -3,-0.1 3,-0.3 -0.902 42.5-141.3-175.8 145.2 72.6 81.9 27.8 115 115 A K S > S+ 0 0 176 -2,-0.3 3,-1.2 1,-0.2 4,-0.4 0.552 84.1 90.9 -92.8 -8.9 74.5 79.0 29.3 116 116 A E T 3 S+ 0 0 103 1,-0.3 -1,-0.2 2,-0.1 3,-0.1 0.592 88.9 40.8 -66.7 -27.6 71.8 78.3 32.0 117 117 A Y T > S+ 0 0 22 -3,-0.3 3,-3.0 -8,-0.2 -1,-0.3 0.484 83.7 104.4-101.6 -5.3 69.7 75.8 30.1 118 118 A D T < S+ 0 0 50 -3,-1.2 -2,-0.1 1,-0.3 -1,-0.1 0.852 74.3 59.4 -50.0 -34.5 72.7 73.9 28.6 119 119 A H T 3 S+ 0 0 138 -4,-0.4 2,-0.9 -3,-0.1 -1,-0.3 0.590 87.6 88.4 -68.1 -9.0 72.2 71.0 31.0 120 120 A I < + 0 0 9 -3,-3.0 -12,-0.1 1,-0.2 3,-0.1 -0.803 39.3 145.0 -99.8 103.5 68.7 70.4 29.7 121 121 A K + 0 0 112 -2,-0.9 2,-0.3 1,-0.3 -1,-0.2 0.691 65.7 13.6-105.3 -21.9 68.8 68.1 26.7 122 122 A D S > S- 0 0 49 35,-0.1 3,-2.3 36,-0.1 4,-0.3 -0.912 86.1 -87.4-156.1 170.9 65.6 66.1 27.1 123 123 A V G > S+ 0 0 19 -33,-0.4 3,-1.0 1,-0.3 8,-0.1 0.688 118.0 60.8 -59.7 -34.6 62.3 66.0 28.9 124 124 A N G 3 S+ 0 0 108 1,-0.2 -1,-0.3 4,-0.0 4,-0.1 0.651 97.5 61.4 -65.7 -25.5 63.7 64.2 32.0 125 125 A D G < S+ 0 0 60 -3,-2.3 -1,-0.2 -35,-0.2 -2,-0.2 0.515 81.3 97.0 -80.0 -10.6 66.1 67.0 32.7 126 126 A L S < S- 0 0 6 -3,-1.0 5,-0.1 -4,-0.3 -5,-0.0 -0.695 93.8 -93.0 -73.4 137.8 63.3 69.6 33.2 127 127 A P > - 0 0 73 0, 0.0 4,-1.9 0, 0.0 5,-0.2 -0.119 28.8-130.9 -42.5 134.0 62.5 70.1 36.9 128 128 A E H > S+ 0 0 153 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.896 107.0 55.5 -50.4 -49.2 59.6 67.9 38.0 129 129 A L H > S+ 0 0 123 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.908 107.0 50.0 -59.0 -44.4 57.8 70.8 39.6 130 130 A L H > S+ 0 0 31 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.901 112.2 46.4 -61.6 -48.8 57.9 72.8 36.3 131 131 A K H X S+ 0 0 40 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.887 115.1 47.7 -59.3 -41.2 56.5 69.8 34.2 132 132 A A H X S+ 0 0 49 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.931 112.1 49.4 -68.8 -41.2 53.8 69.2 36.9 133 133 A Q H X S+ 0 0 87 -4,-2.8 4,-1.9 -5,-0.3 -1,-0.2 0.900 111.6 48.5 -60.2 -43.3 52.9 72.9 37.0 134 134 A I H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.964 112.5 47.7 -63.8 -53.0 52.6 73.2 33.2 135 135 A A H X S+ 0 0 13 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.940 112.1 49.8 -56.1 -46.0 50.4 70.1 32.9 136 136 A H H X S+ 0 0 98 -4,-2.6 4,-1.0 -5,-0.2 -1,-0.2 0.885 109.3 54.1 -59.7 -40.5 48.2 71.3 35.8 137 137 A F H >X S+ 0 0 10 -4,-1.9 4,-2.1 -5,-0.2 3,-1.1 0.969 112.0 40.7 -59.8 -52.9 48.0 74.7 34.0 138 138 A F H 3< S+ 0 0 0 -4,-2.7 4,-0.4 1,-0.3 -2,-0.2 0.896 112.2 59.4 -70.9 -30.5 46.7 73.3 30.6 139 139 A E H 3< S+ 0 0 77 -4,-2.8 -1,-0.3 -5,-0.3 11,-0.2 0.753 123.2 16.4 -53.7 -33.2 44.5 70.9 32.5 140 140 A H H X< S+ 0 0 62 -3,-1.1 3,-2.2 -4,-1.0 -2,-0.2 0.599 92.0 93.6-127.6 -9.3 42.6 73.6 34.3 141 141 A Y T 3< S+ 0 0 13 -4,-2.1 -94,-0.6 1,-0.3 3,-0.3 0.775 97.8 42.2 -72.8 -26.2 43.0 77.1 32.7 142 142 A K T > S+ 0 0 14 -4,-0.4 3,-2.8 -5,-0.2 -1,-0.3 0.266 77.5 115.3 -93.6 10.3 39.8 76.5 30.6 143 143 A D T < S+ 0 0 100 -3,-2.2 -1,-0.2 1,-0.3 -2,-0.1 0.641 83.3 42.1 -53.9 -28.6 37.7 75.0 33.4 144 144 A L T 3 S+ 0 0 118 -3,-0.3 2,-0.9 -4,-0.2 -1,-0.3 0.136 87.5 108.1-106.2 11.4 35.3 77.9 33.3 145 145 A E X - 0 0 25 -3,-2.8 3,-1.9 1,-0.2 -3,-0.1 -0.844 59.7-154.1 -92.7 102.0 35.2 78.2 29.5 146 146 A K T 3 S+ 0 0 216 -2,-0.9 -1,-0.2 1,-0.3 2,-0.1 0.882 87.8 37.1 -44.0 -65.1 31.8 76.9 28.5 147 147 A G T 3 S+ 0 0 53 2,-0.0 2,-0.3 -49,-0.0 -1,-0.3 0.306 109.8 76.1 -74.6 15.1 32.5 75.7 24.9 148 148 A K < + 0 0 92 -3,-1.9 2,-0.3 -6,-0.2 -3,-0.1 -0.882 44.3 163.9-138.2 156.0 36.0 74.3 25.6 149 149 A W - 0 0 115 -2,-0.3 -51,-0.4 2,-0.0 2,-0.3 -0.959 14.7-156.1-171.3 152.8 37.7 71.4 27.3 150 150 A V - 0 0 26 -2,-0.3 2,-0.4 -11,-0.2 -53,-0.3 -0.999 4.1-160.4-147.0 131.4 41.3 69.8 27.3 151 151 A K E -G 96 0B 139 -55,-3.5 -55,-3.1 -2,-0.3 2,-0.6 -0.981 14.4-144.9-127.4 134.0 42.8 66.4 28.0 152 152 A V E +G 95 0B 36 -2,-0.4 -57,-0.3 -57,-0.2 3,-0.1 -0.744 17.1 178.8 -98.8 108.7 46.5 66.0 28.9 153 153 A E E - 0 0 120 -59,-2.7 2,-0.3 -2,-0.6 -58,-0.2 0.862 45.7-109.4 -90.4 -37.4 48.0 62.8 27.5 154 154 A G E -G 94 0B 19 -60,-1.5 -60,-3.5 2,-0.0 -1,-0.3 -0.894 37.1 -38.2 143.4-165.8 51.5 63.3 28.8 155 155 A W E -G 93 0B 73 -2,-0.3 2,-0.3 -62,-0.2 -62,-0.2 -0.623 40.5-177.4-100.7 143.5 55.2 64.0 28.2 156 156 A E E -G 92 0B 87 -64,-2.7 -64,-1.8 -2,-0.2 -33,-0.1 -0.877 27.9 -94.3-133.8 174.1 57.4 62.9 25.3 157 157 A N > - 0 0 59 -2,-0.3 4,-2.4 -66,-0.2 -66,-0.2 -0.077 36.3 -95.9 -86.9 176.8 61.1 63.3 24.5 158 158 A A H > S+ 0 0 11 -68,-0.4 4,-3.8 1,-0.2 -67,-0.2 0.890 122.4 55.9 -61.3 -38.1 63.1 65.8 22.4 159 159 A E H > S+ 0 0 148 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.919 108.3 47.9 -65.6 -39.5 63.1 63.4 19.4 160 160 A A H > S+ 0 0 21 2,-0.2 4,-2.0 1,-0.2 3,-0.5 0.949 113.1 50.3 -64.3 -39.7 59.3 63.4 19.5 161 161 A A H X S+ 0 0 0 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.954 111.4 47.2 -57.2 -57.7 59.4 67.2 19.8 162 162 A K H X S+ 0 0 61 -4,-3.8 4,-2.1 2,-0.2 -1,-0.2 0.699 107.6 55.3 -54.4 -31.2 61.8 67.6 16.8 163 163 A A H X S+ 0 0 61 -4,-1.3 4,-3.6 -3,-0.5 5,-0.2 0.872 106.4 52.3 -80.5 -40.1 59.7 65.2 14.5 164 164 A E H X S+ 0 0 39 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.841 108.3 50.8 -53.2 -36.7 56.7 67.4 15.1 165 165 A I H X S+ 0 0 0 -4,-1.4 4,-3.4 2,-0.2 -2,-0.2 0.970 114.1 43.8 -68.2 -54.9 58.7 70.5 14.1 166 166 A V H X S+ 0 0 68 -4,-2.1 4,-2.9 2,-0.2 5,-0.3 0.960 115.8 47.5 -54.4 -48.8 59.8 68.8 10.9 167 167 A A H X S+ 0 0 44 -4,-3.6 4,-2.4 1,-0.2 -1,-0.2 0.925 116.6 43.9 -65.2 -38.4 56.4 67.4 10.1 168 168 A S H X S+ 0 0 2 -4,-2.3 -106,-1.4 -5,-0.2 4,-1.2 0.893 112.5 52.1 -72.8 -34.1 54.7 70.8 10.8 169 169 A F H X S+ 0 0 40 -4,-3.4 4,-1.5 -108,-0.2 3,-0.4 0.945 111.7 46.5 -65.9 -45.3 57.4 72.6 8.8 170 170 A E H X S+ 0 0 105 -4,-2.9 4,-0.5 1,-0.2 3,-0.4 0.955 110.2 53.6 -58.1 -45.9 56.9 70.3 5.7 171 171 A R H X S+ 0 0 51 -4,-2.4 4,-1.4 -5,-0.3 3,-0.4 0.775 105.5 53.2 -63.4 -26.0 53.1 70.6 5.9 172 172 A A H < S+ 0 0 29 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.873 101.4 61.9 -75.1 -36.6 53.3 74.4 5.9 173 173 A K H < S+ 0 0 149 -4,-1.5 -2,-0.2 -3,-0.4 -1,-0.2 0.490 120.0 21.0 -74.1 1.5 55.4 74.2 2.7 174 174 A N H < 0 0 130 -4,-0.5 -2,-0.2 -3,-0.4 -3,-0.1 0.615 360.0 360.0-115.8 -60.5 52.6 72.5 0.7 175 175 A K < 0 0 202 -4,-1.4 -1,-0.1 -5,-0.2 0, 0.0 -0.153 360.0 360.0 -52.3 360.0 49.1 73.1 2.3