==== 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 12-JAN-10 3LD3 . COMPND 2 MOLECULE: INORGANIC PYROPHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ANAPLASMA PHAGOCYTOPHILUM; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIONS DISEASE (S . 342 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15767.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 231 67.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 85 24.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 32 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 56 16.4 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 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 1 1 2 4 2 3 0 0 0 1 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 0 0 0 1 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 5 A D 0 0 196 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -42.6 61.7 50.5 46.1 2 6 A I - 0 0 93 2,-0.0 3,-0.2 3,-0.0 11,-0.0 0.929 360.0-170.0 -67.0 -43.8 60.6 47.6 43.8 3 7 A G - 0 0 17 1,-0.2 54,-0.1 2,-0.1 10,-0.1 -0.006 38.5 -75.2 76.6 172.6 63.2 48.9 41.4 4 8 A S S S- 0 0 17 1,-0.2 9,-1.7 53,-0.2 -1,-0.2 0.585 88.6 -78.5 -84.5 -10.5 63.7 47.8 37.7 5 9 A G > - 0 0 20 7,-0.3 3,-1.6 -3,-0.2 -1,-0.2 0.014 26.8-110.1 119.6 136.7 65.4 44.5 38.7 6 10 A S T 3 S+ 0 0 121 1,-0.3 -1,-0.1 -3,-0.1 6,-0.1 0.795 121.2 44.4 -64.0 -27.8 68.8 43.5 40.0 7 11 A N T >> S+ 0 0 100 4,-0.2 4,-1.4 2,-0.1 3,-1.2 0.117 96.6 177.3-103.7 21.8 69.5 41.7 36.7 8 12 A A T <4 + 0 0 28 -3,-1.6 4,-0.1 1,-0.3 -3,-0.1 -0.362 57.1 21.9 -65.2 144.5 68.1 44.6 34.4 9 13 A P T 34 S+ 0 0 30 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 -0.981 125.1 51.6 -91.1 2.9 68.0 44.8 31.5 10 14 A E T <4 S+ 0 0 109 -3,-1.2 2,-0.3 1,-0.3 -2,-0.2 0.878 131.2 10.9 -66.7 -40.7 68.3 41.0 31.0 11 15 A E S < S- 0 0 46 -4,-1.4 2,-0.3 74,-0.2 -1,-0.3 -0.991 82.4-176.6-133.7 139.9 65.4 40.5 33.4 12 16 A V E -A 84 0A 0 72,-2.7 72,-3.1 -2,-0.3 2,-0.4 -0.921 26.8-112.2-136.3 156.6 63.2 43.3 34.7 13 17 A N E -A 83 0A 33 -9,-1.7 2,-0.4 -2,-0.3 70,-0.2 -0.736 28.5-167.4 -87.0 137.9 60.4 43.9 37.1 14 18 A V E -A 82 0A 0 68,-2.3 68,-2.5 -2,-0.4 2,-0.6 -0.996 14.0-149.0-127.6 126.2 57.0 44.9 35.7 15 19 A V E -AB 81 54A 10 39,-2.6 39,-1.9 -2,-0.4 2,-0.2 -0.864 28.8-131.0 -89.6 116.9 54.1 46.3 37.8 16 20 A I E + B 0 53A 0 64,-2.7 63,-3.3 -2,-0.6 37,-0.3 -0.520 34.7 168.6 -75.6 131.6 51.0 45.1 36.0 17 21 A E E S+ 0 0 14 35,-3.2 2,-0.4 1,-0.3 10,-0.4 0.668 70.8 30.0-106.2 -37.3 48.3 47.7 35.4 18 22 A V E S- B 0 52A 2 34,-2.4 34,-3.0 8,-0.1 -1,-0.3 -0.995 78.7-130.4-131.0 130.2 46.0 45.8 33.0 19 23 A S > - 0 0 19 -2,-0.4 3,-1.3 32,-0.2 29,-0.2 -0.464 33.4 -96.7 -76.7 146.4 45.4 42.1 32.9 20 24 A Q T 3 S+ 0 0 10 1,-0.2 31,-0.1 -2,-0.2 -1,-0.1 -0.251 105.5 7.0 -55.5 137.1 45.7 40.1 29.7 21 25 A D T 3 S+ 0 0 62 27,-1.8 -1,-0.2 1,-0.2 2,-0.1 0.750 98.4 143.8 64.6 25.6 42.3 39.4 28.0 22 26 A S < - 0 0 37 -3,-1.3 -1,-0.2 26,-0.3 26,-0.1 -0.363 61.0 -83.5 -90.9 170.4 40.4 41.7 30.4 23 27 A H - 0 0 115 1,-0.1 2,-2.7 -2,-0.1 -1,-0.2 -0.422 62.6 -90.6 -63.0 154.8 37.5 44.0 29.9 24 28 A P S S+ 0 0 16 0, 0.0 18,-2.5 0, 0.0 2,-0.7 -0.196 77.1 138.2 -77.8 53.8 38.8 47.3 28.6 25 29 A V E -H 41 0B 25 -2,-2.7 2,-1.1 16,-0.2 16,-0.2 -0.883 42.1-152.9 -93.5 114.7 39.3 49.0 32.0 26 30 A K E -H 40 0B 12 14,-2.8 13,-2.5 -2,-0.7 14,-1.2 -0.734 15.6-172.7 -96.3 97.1 42.6 50.9 31.7 27 31 A Y E -H 38 0B 77 -2,-1.1 2,-0.3 -10,-0.4 11,-0.2 -0.539 3.1-173.4 -81.9 156.1 44.1 51.2 35.1 28 32 A E E -H 37 0B 57 9,-2.3 9,-2.7 -2,-0.2 2,-0.2 -0.965 21.2-124.0-148.4 136.8 47.2 53.3 35.9 29 33 A F E -H 36 0B 60 -2,-0.3 2,-0.5 7,-0.2 7,-0.2 -0.550 19.5-136.0 -78.0 143.8 49.3 53.7 39.0 30 34 A D > - 0 0 55 5,-2.4 4,-1.6 -2,-0.2 5,-0.1 -0.863 3.0-153.9 -96.3 128.6 49.9 57.1 40.4 31 35 A E T 4 S+ 0 0 106 -2,-0.5 -1,-0.1 2,-0.2 -2,-0.0 0.866 93.3 52.5 -68.3 -39.5 53.5 57.8 41.5 32 36 A K T 4 S+ 0 0 95 1,-0.1 -1,-0.1 -3,-0.1 -3,-0.0 0.995 126.7 17.3 -59.0 -73.9 52.4 60.4 44.1 33 37 A N T 4 S- 0 0 91 2,-0.1 -2,-0.2 1,-0.1 -1,-0.1 0.872 90.2-131.4 -70.5 -36.8 49.8 58.3 46.0 34 38 A G < + 0 0 52 -4,-1.6 2,-0.2 1,-0.3 -3,-0.1 0.484 62.4 139.8 88.1 6.0 50.8 54.7 44.9 35 39 A A - 0 0 41 -5,-0.1 -5,-2.4 -6,-0.0 2,-0.5 -0.543 57.3-123.5 -82.8 149.0 47.1 54.2 44.2 36 40 A L E -H 29 0B 65 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.838 35.1-168.8 -88.8 125.4 45.7 52.4 41.2 37 41 A W E -H 28 0B 145 -9,-2.7 -9,-2.3 -2,-0.5 2,-0.9 -0.844 29.3-118.6-113.3 151.3 43.3 54.7 39.2 38 42 A V E -H 27 0B 70 -2,-0.3 -11,-0.2 -11,-0.2 3,-0.1 -0.816 29.4-177.5 -80.0 112.1 40.9 54.0 36.5 39 43 A D E - 0 0 75 -13,-2.5 2,-0.3 -2,-0.9 -1,-0.2 0.951 61.0 -44.8 -73.2 -51.4 42.4 56.2 33.7 40 44 A R E -H 26 0B 34 -14,-1.2 -14,-2.8 -3,-0.2 2,-0.5 -0.981 46.1-106.3-163.2 167.5 39.6 55.4 31.3 41 45 A F E -H 25 0B 145 -2,-0.3 -16,-0.2 -16,-0.2 -3,-0.0 -0.916 53.3-108.6 -93.5 132.1 37.4 52.7 29.9 42 46 A L - 0 0 10 -18,-2.5 97,-0.1 -2,-0.5 4,-0.1 -0.420 20.7-148.5 -62.2 134.5 38.6 52.2 26.3 43 47 A P S S+ 0 0 40 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.791 78.6 74.4 -77.5 -18.7 36.0 53.7 23.9 44 48 A T S S- 0 0 0 94,-0.5 2,-1.9 1,-0.1 258,-0.1 -0.497 94.8-113.1 -89.4 154.1 36.8 51.0 21.3 45 49 A A S S+ 0 0 0 257,-0.4 174,-1.8 -2,-0.2 2,-0.3 -0.510 78.7 117.8 -87.6 62.0 35.8 47.4 21.7 46 50 A M B -I 218 0C 0 -2,-1.9 2,-0.3 172,-0.2 172,-0.3 -0.837 47.8-155.5-124.1 164.7 39.4 46.2 22.1 47 51 A Y - 0 0 30 170,-1.9 -24,-0.1 -2,-0.3 -27,-0.1 -0.986 34.7 -92.9-141.3 150.7 41.3 44.5 24.9 48 52 A Y - 0 0 2 -2,-0.3 -27,-1.8 -29,-0.2 -26,-0.3 -0.473 31.1-150.1 -63.6 123.8 45.0 44.4 25.9 49 53 A P S S+ 0 0 6 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.564 78.7 21.6 -78.6 -7.2 46.5 41.3 24.1 50 54 A C S S- 0 0 0 21,-0.1 21,-0.2 -31,-0.1 -29,-0.1 -0.907 104.0 -77.4-138.4 167.3 49.1 40.8 26.9 51 55 A N E - C 0 70A 0 19,-2.0 19,-3.1 -2,-0.3 2,-0.4 -0.432 56.0-149.9 -58.4 143.8 49.3 41.8 30.5 52 56 A Y E +BC 18 69A 4 -34,-3.0 -35,-3.2 17,-0.2 -34,-2.4 -0.988 33.9 111.3-130.8 131.8 50.3 45.5 30.5 53 57 A G E -BC 16 68A 0 15,-2.4 15,-2.9 -2,-0.4 2,-0.3 -0.827 47.4 -85.1-166.0-154.7 52.4 47.5 32.9 54 58 A F E -BC 15 67A 35 -39,-1.9 -39,-2.6 13,-0.3 13,-0.2 -0.936 24.6-114.6-137.4 154.8 55.6 49.4 33.6 55 59 A I > - 0 0 0 11,-2.2 3,-0.6 -2,-0.3 11,-0.4 -0.799 41.0-126.1 -86.9 116.8 59.1 49.0 34.8 56 60 A P T 3 S+ 0 0 14 0, 0.0 -43,-0.1 0, 0.0 3,-0.1 -0.296 87.4 22.7 -58.9 147.7 59.6 50.9 38.0 57 61 A N T 3 S+ 0 0 104 1,-0.2 2,-0.3 -54,-0.1 -53,-0.2 0.879 95.1 121.1 65.8 39.3 62.4 53.4 38.3 58 62 A T < - 0 0 6 -3,-0.6 2,-0.4 111,-0.1 -1,-0.2 -0.966 47.0-159.4-129.3 148.1 62.7 54.0 34.5 59 63 A I - 0 0 73 106,-1.9 109,-0.2 -2,-0.3 5,-0.1 -0.908 17.8-165.7-127.3 104.4 62.4 57.2 32.4 60 64 A A > - 0 0 24 4,-3.3 3,-2.4 -2,-0.4 39,-0.0 -0.158 43.5 -82.7 -77.6 177.7 61.6 56.5 28.8 61 65 A G T 3 S+ 0 0 80 1,-0.3 38,-0.1 2,-0.1 37,-0.1 0.785 129.5 52.9 -54.7 -33.2 61.9 59.0 25.9 62 66 A D T 3 S- 0 0 30 36,-0.4 -1,-0.3 2,-0.2 37,-0.1 0.320 120.3-105.1 -88.6 7.6 58.5 60.4 26.6 63 67 A G S < S+ 0 0 48 -3,-2.4 -2,-0.1 1,-0.3 3,-0.1 0.210 89.9 100.8 92.2 -14.0 59.3 61.1 30.4 64 68 A D S S- 0 0 74 1,-0.2 -4,-3.3 -5,-0.1 -1,-0.3 -0.554 84.1 -84.3 -95.0 164.8 57.2 58.1 31.7 65 69 A P - 0 0 46 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.245 60.2 -82.7 -62.2 158.1 58.4 54.7 32.8 66 70 A V - 0 0 3 -11,-0.4 -11,-2.2 96,-0.1 2,-0.4 -0.475 44.9-135.7 -66.0 129.2 59.0 52.1 30.1 67 71 A D E -Cd 54 101A 16 33,-0.5 35,-2.3 -13,-0.2 2,-0.4 -0.732 22.0-165.7 -88.8 138.4 55.7 50.3 29.2 68 72 A V E -Cd 53 102A 0 -15,-2.9 -15,-2.4 -2,-0.4 2,-0.6 -0.992 19.8-150.6-131.8 133.6 55.8 46.5 28.8 69 73 A L E -Cd 52 103A 0 33,-3.3 35,-3.0 -2,-0.4 2,-0.7 -0.875 21.1-160.8 -92.5 117.5 53.5 44.0 27.3 70 74 A V E -Cd 51 104A 0 -19,-3.1 -19,-2.0 -2,-0.6 2,-0.4 -0.886 3.2-154.3-108.3 106.3 53.9 40.7 29.3 71 75 A L + 0 0 23 33,-2.6 2,-0.3 -2,-0.7 -21,-0.1 -0.661 28.3 160.2 -75.3 131.2 52.7 37.6 27.5 72 76 A A - 0 0 12 -2,-0.4 4,-0.0 33,-0.1 39,-0.0 -0.948 53.0-110.2-147.4 168.6 51.8 34.9 29.9 73 77 A R S S+ 0 0 127 -2,-0.3 -1,-0.0 1,-0.1 -2,-0.0 0.768 103.7 18.6 -73.7 -25.5 49.7 31.7 30.1 74 78 A F S S- 0 0 137 -3,-0.0 -54,-0.1 0, 0.0 -1,-0.1 -0.939 95.3 -86.6-139.0 159.8 47.1 33.3 32.4 75 79 A P - 0 0 73 0, 0.0 2,-0.4 0, 0.0 -56,-0.1 -0.396 35.0-143.1 -65.9 147.1 46.2 36.9 33.4 76 80 A V - 0 0 30 -58,-0.1 -56,-0.1 -2,-0.1 3,-0.1 -0.939 25.0-112.3-111.7 134.6 48.1 38.6 36.1 77 81 A M > - 0 0 131 -2,-0.4 3,-2.0 1,-0.1 -61,-0.3 -0.256 36.1 -94.7 -70.2 148.1 46.1 40.9 38.4 78 82 A P T 3 S+ 0 0 35 0, 0.0 -61,-0.2 0, 0.0 -1,-0.1 -0.336 111.5 30.1 -60.4 140.0 46.7 44.6 38.4 79 83 A G T 3 S+ 0 0 36 -63,-3.3 2,-0.2 1,-0.4 -62,-0.1 0.145 91.0 119.0 94.2 -16.8 49.1 45.7 41.1 80 84 A A < - 0 0 33 -3,-2.0 -64,-2.7 -64,-0.1 2,-0.4 -0.514 57.8-135.6 -76.6 152.4 51.1 42.4 41.0 81 85 A V E -A 15 0A 67 -66,-0.2 2,-0.4 -2,-0.2 -66,-0.2 -0.882 21.3-172.4-109.5 136.7 54.8 42.5 40.1 82 86 A I E -A 14 0A 18 -68,-2.5 -68,-2.3 -2,-0.4 2,-0.5 -0.995 22.8-130.3-135.7 140.7 56.3 40.0 37.7 83 87 A C E +A 13 0A 18 -2,-0.4 24,-2.6 -70,-0.2 2,-0.3 -0.770 39.9 176.0 -87.6 122.7 59.9 39.3 36.7 84 88 A V E -AE 12 106A 0 -72,-3.1 -72,-2.7 -2,-0.5 -14,-0.0 -0.862 32.7-131.3-134.2 160.3 60.2 39.2 32.9 85 89 A R E - E 0 105A 36 20,-3.0 20,-2.0 -2,-0.3 -74,-0.2 -0.970 30.2-127.3-111.4 118.0 62.7 38.8 30.1 86 90 A P E + E 0 104A 6 0, 0.0 18,-0.3 0, 0.0 73,-0.1 -0.445 29.1 174.5 -62.9 136.9 62.4 41.4 27.2 87 91 A V E - 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0 0 24 -3,-2.4 3,-1.6 1,-0.1 -1,-0.1 -0.889 62.9-173.7-108.6 95.3 42.5 39.1 7.2 315 147 B K T 3 S+ 0 0 106 -2,-0.8 -1,-0.1 1,-0.3 -3,-0.1 0.621 80.4 68.5 -71.3 -12.0 43.5 40.5 3.8 316 148 B D T 3 S+ 0 0 128 -5,-0.1 2,-0.3 -3,-0.1 -1,-0.3 0.177 103.3 55.0 -83.5 12.0 41.0 38.2 2.2 317 149 B K < - 0 0 46 -3,-1.6 2,-0.3 -6,-0.2 -51,-0.0 -0.922 61.4-179.0-136.6 163.7 38.3 40.3 3.8 318 150 B F - 0 0 125 -2,-0.3 -51,-0.5 2,-0.0 2,-0.4 -0.968 10.7-155.6-155.7 154.3 37.3 43.9 3.9 319 151 B V E -O 266 0D 13 -2,-0.3 2,-0.6 -11,-0.3 -53,-0.2 -0.985 4.7-171.9-136.5 126.5 34.7 46.0 5.5 320 152 B S E -O 265 0D 64 -55,-3.4 -55,-2.7 -2,-0.4 2,-0.4 -0.953 20.3-152.8-113.7 107.4 33.4 49.3 4.3 321 153 B V E -O 264 0D 37 -2,-0.6 -57,-0.3 -57,-0.2 -2,-0.0 -0.672 15.4-177.6 -88.5 130.7 31.1 50.7 7.1 322 154 B G E - 0 0 43 -59,-2.9 2,-0.2 -2,-0.4 -1,-0.1 0.179 33.9 -50.9 -98.2-139.5 28.3 53.1 6.1 323 155 B C E - 0 0 95 1,-0.1 -60,-2.0 -61,-0.1 2,-0.3 -0.589 46.1-105.6-104.5 161.0 25.7 54.9 8.1 324 156 B W E -O 262 0D 37 -62,-0.2 2,-0.3 -2,-0.2 -62,-0.2 -0.608 32.0-163.1 -76.7 141.2 23.1 54.1 10.8 325 157 B Q E -O 261 0D 83 -64,-2.4 -64,-2.0 -2,-0.3 -33,-0.2 -0.911 24.3 -97.2-120.9 162.0 19.5 54.0 9.7 326 158 B D E > -O 260 0D 76 -2,-0.3 4,-2.4 -66,-0.2 -66,-0.2 0.095 34.7 -94.3 -79.4 177.3 16.5 54.1 12.1 327 159 B A H > S+ 0 0 6 -68,-0.5 4,-2.7 1,-0.2 -67,-0.2 0.882 123.3 54.9 -58.3 -41.8 14.2 51.6 13.7 328 160 B A H > S+ 0 0 64 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.919 109.5 48.1 -60.6 -39.5 11.6 51.9 10.8 329 161 B S H > S+ 0 0 31 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.929 110.6 50.6 -65.6 -46.7 14.4 51.1 8.3 330 162 B A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.915 109.8 50.9 -56.9 -45.0 15.6 48.1 10.2 331 163 B K H X S+ 0 0 35 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.882 108.5 51.3 -63.0 -37.5 12.1 46.8 10.5 332 164 B E H X S+ 0 0 96 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.904 108.1 52.0 -65.3 -41.3 11.5 47.2 6.7 333 165 B L H X S+ 0 0 45 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.938 112.6 46.3 -57.4 -45.2 14.8 45.3 6.0 334 166 B I H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.927 108.4 55.1 -65.4 -46.3 13.5 42.5 8.3 335 167 B R H X S+ 0 0 91 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.935 110.8 45.9 -50.6 -52.1 10.0 42.5 6.7 336 168 B S H X S+ 0 0 64 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.859 110.7 52.8 -58.9 -42.5 11.7 41.9 3.2 337 169 B A H X S+ 0 0 3 -4,-2.0 -106,-1.7 2,-0.2 4,-1.3 0.845 109.8 48.3 -65.9 -35.5 13.9 39.2 4.5 338 170 B I H X S+ 0 0 40 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.924 112.0 49.1 -68.1 -45.8 11.0 37.3 6.0 339 171 B I H >X S+ 0 0 116 -4,-2.4 4,-1.9 1,-0.2 3,-0.7 0.947 109.8 52.7 -56.0 -48.2 9.0 37.7 2.7 340 172 B A H 3< S+ 0 0 41 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.806 107.9 50.7 -58.3 -34.3 12.1 36.4 0.9 341 173 B A H 3< S+ 0 0 37 -4,-1.3 -1,-0.3 -112,-0.2 -2,-0.2 0.750 108.4 53.1 -76.9 -24.9 12.3 33.3 3.2 342 174 B K H << 0 0 88 -4,-1.4 -2,-0.2 -3,-0.7 -1,-0.2 0.874 360.0 360.0 -74.9 -38.5 8.6 32.6 2.6 343 175 B K < 0 0 122 -4,-1.9 -4,-0.0 -5,-0.1 0, 0.0 -0.455 360.0 360.0 -68.6 360.0 8.9 32.6 -1.3