==== 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 04-MAR-96 1IPW . COMPND 2 MOLECULE: SOLUBLE INORGANIC PYROPHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.A.KANKARE,A.GOLDMAN . 341 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15552.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 223 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 88 25.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 28 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 16.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 3 0 1 5 3 1 0 1 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 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 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 0 104 0, 0.0 3,-1.3 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 169.9 -1.6 3.5 7.4 2 2 A L G > + 0 0 33 35,-0.4 3,-1.3 1,-0.3 35,-0.1 0.751 360.0 70.6 -67.9 -22.9 -1.2 6.6 9.5 3 3 A L G 3 S+ 0 0 45 1,-0.3 -1,-0.3 33,-0.2 57,-0.1 0.757 96.0 52.2 -66.6 -20.9 0.3 8.2 6.4 4 4 A N G < S+ 0 0 124 -3,-1.3 -1,-0.3 33,-0.1 -2,-0.2 0.387 78.1 118.4 -96.8 1.0 -3.2 8.2 4.9 5 5 A V < - 0 0 23 -3,-1.3 2,-0.1 -4,-0.1 13,-0.1 -0.487 65.3-123.3 -69.9 133.1 -5.0 9.9 7.7 6 6 A P - 0 0 64 0, 0.0 53,-0.4 0, 0.0 10,-0.2 -0.367 18.0-111.9 -72.8 164.5 -6.6 13.2 6.5 7 7 A A S S- 0 0 5 1,-0.2 9,-2.0 51,-0.1 2,-0.3 0.780 81.6 -53.6 -66.0 -32.7 -5.8 16.5 8.1 8 8 A G - 0 0 16 7,-0.3 7,-0.3 1,-0.1 3,-0.3 -0.944 47.5 -93.2 171.3 174.6 -9.3 16.8 9.5 9 9 A K S S+ 0 0 122 5,-0.4 2,-0.3 -2,-0.3 6,-0.2 0.893 116.5 4.3 -76.9 -41.0 -13.0 16.6 8.6 10 10 A D B >> S-A 14 0A 103 4,-2.3 4,-3.4 -3,-0.1 3,-0.7 -0.720 97.0-108.3-150.0 92.1 -13.2 20.4 8.2 11 11 A L T 34 S+ 0 0 44 1,-0.3 -3,-0.1 -3,-0.3 4,-0.1 -0.365 89.7 0.6 -64.0 138.5 -10.0 22.5 8.4 12 12 A P T 34 S+ 0 0 22 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 -0.956 134.4 46.6-100.6 7.2 -9.2 24.3 10.7 13 13 A E T <4 S+ 0 0 92 -3,-0.7 2,-0.5 1,-0.2 -2,-0.2 0.887 118.2 34.0 -74.0 -44.7 -12.2 23.8 12.8 14 14 A D B < S+A 10 0A 16 -4,-3.4 -4,-2.3 74,-0.1 -5,-0.4 -0.940 79.0 160.4-122.3 105.3 -12.4 20.0 12.7 15 15 A I E -B 87 0B 0 72,-2.5 72,-2.5 -2,-0.5 2,-0.4 -0.755 35.0-130.4-124.1 167.1 -9.1 18.2 12.6 16 16 A Y E -B 86 0B 43 -9,-2.0 43,-0.5 70,-0.2 2,-0.5 -0.972 19.2-156.6-117.0 135.2 -7.6 14.8 13.3 17 17 A V E -BC 85 58B 0 68,-2.8 68,-2.7 -2,-0.4 2,-0.7 -0.949 9.9-142.9-115.6 124.1 -4.5 14.6 15.4 18 18 A V E -BC 84 57B 0 39,-3.1 39,-1.9 -2,-0.5 2,-0.3 -0.820 24.9-137.9 -85.7 113.5 -2.2 11.5 15.0 19 19 A I E + C 0 56B 0 64,-3.2 63,-3.5 -2,-0.7 37,-0.3 -0.591 34.7 163.7 -78.1 132.5 -0.9 10.8 18.6 20 20 A E E S+ 0 0 18 35,-3.1 36,-0.2 -2,-0.3 10,-0.2 0.654 70.2 36.2-114.4 -35.6 2.7 9.9 19.0 21 21 A I E S- C 0 55B 3 34,-2.7 34,-3.3 8,-0.1 -1,-0.3 -0.977 76.9-138.8-127.5 121.4 3.2 10.4 22.8 22 22 A P > - 0 0 18 0, 0.0 3,-0.5 0, 0.0 29,-0.3 -0.316 32.1 -96.9 -71.3 160.8 0.5 9.6 25.3 23 23 A A T 3 S+ 0 0 13 1,-0.2 31,-0.1 29,-0.1 30,-0.1 -0.426 102.4 8.5 -73.2 152.1 -0.2 11.9 28.3 24 24 A N T 3 S+ 0 0 66 27,-2.2 -1,-0.2 1,-0.1 2,-0.2 0.860 97.2 139.6 44.3 58.8 1.5 11.0 31.6 25 25 A A < - 0 0 35 -3,-0.5 -1,-0.1 26,-0.2 26,-0.1 -0.604 60.9 -69.2-122.2 179.6 3.8 8.3 30.2 26 26 A D - 0 0 95 -2,-0.2 2,-3.0 1,-0.1 -1,-0.1 -0.466 64.3 -95.4 -63.4 148.2 7.3 7.0 30.6 27 27 A P S S+ 0 0 29 0, 0.0 18,-1.6 0, 0.0 2,-0.5 -0.252 78.6 131.7 -68.9 62.8 9.8 9.4 29.1 28 28 A I E -H 44 0C 38 -2,-3.0 2,-0.8 16,-0.2 16,-0.2 -0.969 47.4-148.7-115.3 124.8 10.1 7.8 25.7 29 29 A K E -H 43 0C 24 14,-3.3 13,-3.3 -2,-0.5 14,-1.7 -0.874 21.5-176.4 -97.2 107.3 9.8 10.2 22.8 30 30 A Y E -H 41 0C 62 -2,-0.8 2,-0.3 11,-0.3 11,-0.2 -0.656 5.6-172.7 -97.2 164.5 8.3 8.4 19.8 31 31 A E E -H 40 0C 61 9,-2.5 9,-3.3 -2,-0.2 2,-0.6 -0.970 29.6-114.1-156.9 139.1 7.7 9.8 16.4 32 32 A I E -H 39 0C 0 -2,-0.3 2,-0.4 7,-0.2 7,-0.3 -0.688 35.4-123.9 -76.9 115.2 5.9 8.4 13.4 33 33 A D > - 0 0 39 5,-3.5 4,-3.5 -2,-0.6 5,-0.4 -0.486 15.7-145.0 -62.0 117.0 8.5 7.8 10.7 34 34 A K T 4 S+ 0 0 69 -2,-0.4 -1,-0.2 1,-0.2 -2,-0.0 0.716 93.7 50.4 -57.8 -23.5 7.2 9.8 7.8 35 35 A E T 4 S+ 0 0 165 3,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.896 127.5 19.1 -83.7 -41.5 8.4 7.3 5.1 36 36 A S T 4 S- 0 0 62 -3,-0.2 -2,-0.2 2,-0.2 -33,-0.2 0.701 91.4-131.6-100.3 -28.0 7.0 4.1 6.6 37 37 A G < + 0 0 10 -4,-3.5 -35,-0.4 1,-0.3 2,-0.2 0.593 62.6 137.3 82.6 9.6 4.3 5.5 8.9 38 38 A A - 0 0 45 -5,-0.4 -5,-3.5 -37,-0.1 2,-0.7 -0.571 64.5-103.8 -88.6 155.7 5.7 3.3 11.6 39 39 A L E -H 32 0C 68 -7,-0.3 2,-0.3 -2,-0.2 -7,-0.2 -0.703 43.0-171.2 -81.7 113.2 6.3 4.4 15.2 40 40 A F E -H 31 0C 96 -9,-3.3 -9,-2.5 -2,-0.7 2,-0.6 -0.784 28.2-117.0-103.9 151.0 10.0 5.0 15.7 41 41 A V E -H 30 0C 73 -2,-0.3 -11,-0.3 -11,-0.2 3,-0.1 -0.782 29.0-175.2 -85.0 117.6 11.7 5.7 19.0 42 42 A D E - 0 0 66 -13,-3.3 2,-0.3 -2,-0.6 -12,-0.2 0.904 59.5 -42.5 -80.7 -46.6 13.1 9.2 18.7 43 43 A R E -H 29 0C 61 -14,-1.7 -14,-3.3 2,-0.0 2,-0.7 -0.958 48.2-104.6-175.5 159.8 14.9 9.3 22.0 44 44 A F E -H 28 0C 148 -2,-0.3 -16,-0.2 -16,-0.2 -3,-0.0 -0.889 49.8-120.5 -94.8 111.5 14.7 8.4 25.7 45 45 A M - 0 0 10 -18,-1.6 95,-0.1 -2,-0.7 94,-0.0 -0.260 15.0-149.5 -54.1 138.5 14.1 11.8 27.4 46 46 A S S S+ 0 0 16 93,-0.3 2,-0.2 2,-0.1 -1,-0.1 0.593 72.2 74.2 -88.3 -16.3 16.9 12.6 29.9 47 47 A T S S- 0 0 0 92,-0.4 2,-1.4 2,-0.1 257,-0.1 -0.568 89.8-113.7 -94.0 161.7 14.8 14.7 32.4 48 48 A A S S+ 0 0 0 256,-0.3 173,-1.9 -2,-0.2 2,-0.3 -0.507 78.9 115.5 -93.4 64.6 12.3 13.2 34.8 49 49 A M B -I 220 0D 0 -2,-1.4 2,-0.3 171,-0.2 171,-0.3 -0.873 47.8-157.5-131.0 161.7 9.4 14.8 33.0 50 50 A F - 0 0 16 169,-1.9 -24,-0.1 -2,-0.3 -27,-0.1 -0.994 34.8 -94.6-142.6 146.4 6.4 13.6 31.1 51 51 A Y - 0 0 4 -2,-0.3 -27,-2.2 -29,-0.3 -26,-0.2 -0.382 28.1-147.8 -60.1 128.0 4.1 15.2 28.5 52 52 A P S S+ 0 0 23 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.658 81.7 27.2 -73.9 -10.8 1.2 16.7 30.4 53 53 A C S S- 0 0 0 -31,-0.1 2,-0.1 21,-0.1 -29,-0.1 -0.924 101.1 -82.5-141.3 166.3 -1.0 16.0 27.3 54 54 A N E - D 0 73B 0 19,-1.5 19,-2.9 -2,-0.3 2,-0.4 -0.490 51.5-150.4 -70.7 141.5 -1.1 13.5 24.5 55 55 A Y E +CD 21 72B 10 -34,-3.3 -35,-3.1 17,-0.2 -34,-2.7 -0.947 35.6 110.2-123.1 136.1 1.2 14.8 21.8 56 56 A G E -CD 19 71B 0 15,-2.7 15,-2.2 -2,-0.4 2,-0.3 -0.791 46.3 -96.3-168.4-149.0 1.1 14.4 18.1 57 57 A Y E -CD 18 70B 6 -39,-1.9 -39,-3.1 13,-0.3 2,-0.5 -0.911 23.9-105.2-149.7 171.1 0.5 16.2 14.8 58 58 A I E -C 17 0B 0 11,-1.5 3,-0.5 -2,-0.3 11,-0.4 -0.885 44.1-128.5 -98.9 127.0 -1.9 17.0 12.0 59 59 A N S S+ 0 0 11 -2,-0.5 -43,-0.1 -43,-0.5 3,-0.1 -0.385 86.6 30.4 -74.0 161.9 -1.2 14.9 9.0 60 60 A H S S+ 0 0 87 1,-0.3 2,-0.3 -57,-0.1 109,-0.2 0.879 95.0 114.7 60.2 35.7 -0.7 16.6 5.6 61 61 A T - 0 0 9 -3,-0.5 2,-0.4 108,-0.1 -1,-0.3 -0.971 45.6-166.5-132.5 151.1 0.6 19.8 7.1 62 62 A L - 0 0 66 103,-2.1 106,-0.1 -2,-0.3 5,-0.1 -0.944 7.4-171.0-140.2 110.5 4.1 21.3 6.8 63 63 A S - 0 0 8 4,-4.0 3,-0.3 -2,-0.4 6,-0.1 -0.117 41.4 -93.7 -86.4-162.7 5.2 24.0 9.1 64 64 A L S S+ 0 0 119 1,-0.2 36,-0.1 2,-0.1 -1,-0.0 0.821 121.5 61.3 -83.6 -35.3 8.4 26.1 8.7 65 65 A D S S- 0 0 72 2,-0.2 -1,-0.2 34,-0.1 35,-0.0 0.365 123.3-106.9 -72.5 -6.9 10.5 24.0 10.9 66 66 A G S S+ 0 0 39 1,-0.3 -2,-0.1 -3,-0.3 -1,-0.1 0.001 84.6 89.0 108.4 -24.1 9.8 21.4 8.5 67 67 A D S S- 0 0 82 1,-0.2 -4,-4.0 -5,-0.1 -1,-0.3 -0.467 81.3 -77.7 -96.2-170.3 7.4 19.1 10.1 68 68 A P - 0 0 15 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 -0.123 64.8 -75.5 -80.9 167.6 3.7 18.9 10.4 69 69 A V - 0 0 2 -11,-0.4 -11,-1.5 93,-0.1 2,-0.4 -0.467 52.2-137.4 -63.4 118.5 1.8 21.1 12.8 70 70 A D E -De 57 102B 19 31,-0.5 33,-2.3 -2,-0.4 2,-0.3 -0.756 23.2-168.5 -92.5 134.0 2.5 19.6 16.4 71 71 A V E -De 56 103B 0 -15,-2.2 -15,-2.7 -2,-0.4 2,-0.4 -0.902 19.5-152.0-123.1 140.6 -0.6 19.4 18.8 72 72 A L E -De 55 104B 0 31,-2.0 33,-2.6 -2,-0.3 -17,-0.2 -0.895 18.6-168.9-106.2 135.1 -1.1 18.7 22.4 73 73 A V E -D 54 0B 0 -19,-2.9 -19,-1.5 -2,-0.4 33,-0.2 -0.911 11.3-148.2-134.2 107.9 -4.5 17.2 23.2 74 74 A P + 0 0 18 0, 0.0 -21,-0.1 0, 0.0 3,-0.1 -0.490 25.6 172.7 -72.5 140.8 -5.8 16.8 26.8 75 75 A T - 0 0 24 -2,-0.2 4,-0.0 1,-0.1 -2,-0.0 -0.955 46.1-114.3-142.4 161.2 -8.0 13.8 27.3 76 76 A P S S+ 0 0 61 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.926 105.4 25.1 -64.4 -38.4 -9.6 12.2 30.3 77 77 A Y S S- 0 0 182 -3,-0.1 -54,-0.1 1,-0.0 0, 0.0 -0.920 97.7 -92.7-126.7 148.2 -7.4 9.1 29.8 78 78 A P - 0 0 78 0, 0.0 2,-0.2 0, 0.0 -54,-0.1 -0.253 45.1-132.4 -57.2 143.2 -4.0 8.7 28.1 79 79 A L - 0 0 43 -58,-0.1 3,-0.0 1,-0.1 -56,-0.0 -0.607 20.9 -97.4 -98.5 163.7 -4.3 7.7 24.4 80 80 A Q > - 0 0 144 -2,-0.2 3,-1.9 1,-0.1 -61,-0.2 -0.577 42.0-107.6 -80.0 135.5 -2.5 5.0 22.6 81 81 A P T 3 S+ 0 0 35 0, 0.0 -61,-0.2 0, 0.0 3,-0.1 -0.386 109.2 26.6 -59.9 141.9 0.6 6.0 20.6 82 82 A G T 3 S+ 0 0 23 -63,-3.5 2,-0.2 1,-0.3 -62,-0.1 0.541 95.0 127.7 82.3 4.0 -0.3 5.9 16.9 83 83 A S < - 0 0 34 -3,-1.9 -64,-3.2 -64,-0.3 2,-0.5 -0.572 54.0-133.6 -92.2 159.8 -4.0 6.5 17.6 84 84 A V E -B 18 0B 59 -66,-0.2 2,-0.4 -2,-0.2 -66,-0.2 -0.963 18.9-167.9-117.2 129.8 -5.9 9.3 15.9 85 85 A I E -B 17 0B 14 -68,-2.7 -68,-2.8 -2,-0.5 2,-0.6 -0.948 19.3-130.9-122.4 138.6 -8.2 11.7 17.7 86 86 A R E +B 16 0B 40 -2,-0.4 22,-3.4 -70,-0.2 2,-0.2 -0.751 43.1 156.8 -83.9 121.9 -10.8 14.2 16.3 87 87 A C E -BF 15 107B 0 -72,-2.5 -72,-2.5 -2,-0.6 -14,-0.0 -0.806 40.3-130.2-139.7 173.8 -10.3 17.7 17.9 88 88 A R E - F 0 106B 30 18,-2.0 18,-2.0 -2,-0.2 -74,-0.1 -0.994 35.6-116.2-129.8 127.9 -11.0 21.4 17.5 89 89 A P E + F 0 105B 5 0, 0.0 16,-0.3 0, 0.0 70,-0.1 -0.378 35.1 169.0 -62.8 142.7 -8.0 23.8 18.0 90 90 A V E - 0 0 0 14,-3.0 31,-0.9 1,-0.4 65,-0.5 0.437 56.2 -14.7-136.7 -2.5 -8.2 26.3 20.8 91 91 A G E - F 0 104B 0 13,-1.0 13,-2.3 63,-0.2 -1,-0.4 -0.982 50.8-126.9 176.9 174.1 -4.9 28.0 21.3 92 92 A V E -GF 153 103B 3 61,-1.7 61,-1.5 -2,-0.3 2,-0.7 -0.977 9.3-145.2-149.4 130.3 -1.1 28.0 20.5 93 93 A L E -GF 152 102B 0 9,-2.8 9,-2.3 -2,-0.3 2,-0.4 -0.880 24.3-156.9 -93.1 115.3 1.9 28.1 22.7 94 94 A K E +GF 151 101B 42 57,-3.6 56,-2.6 -2,-0.7 57,-2.0 -0.812 23.4 156.0 -96.0 136.3 4.6 30.1 20.8 95 95 A M E -GF 149 100B 1 5,-3.0 5,-3.6 -2,-0.4 2,-0.4 -0.943 34.8-124.5-151.0 172.8 8.2 29.6 21.7 96 96 A T E G 148 0B 43 52,-2.2 52,-1.4 -2,-0.3 -2,-0.0 -0.984 360.0 360.0-128.5 131.5 11.7 29.9 20.4 97 97 A D 0 0 81 -2,-0.4 50,-0.2 50,-0.2 -2,-0.0 -0.762 360.0 360.0-122.2 360.0 14.3 27.2 20.3 98 ! 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 99 101 A E 0 0 129 0, 0.0 2,-0.3 0, 0.0 -3,-0.3 0.000 360.0 360.0 360.0 147.3 10.7 29.8 16.7 100 102 A D E - F 0 95B 26 -5,-3.6 -5,-3.0 -36,-0.1 2,-0.4 -0.973 360.0-152.6-145.1 152.5 8.2 26.9 17.2 101 103 A A E - F 0 94B 15 -2,-0.3 -31,-0.5 -7,-0.2 2,-0.5 -0.999 3.5-166.2-133.4 132.8 4.5 26.8 17.8 102 104 A K E -eF 70 93B 5 -9,-2.3 -9,-2.8 -2,-0.4 -31,-0.2 -0.980 16.0-147.3-117.4 117.4 2.6 24.0 19.6 103 105 A L E -eF 71 92B 0 -33,-2.3 -31,-2.0 -2,-0.5 2,-0.5 -0.411 3.5-141.4 -82.8 163.5 -1.2 24.1 19.2 104 106 A V E +eF 72 91B 0 -13,-2.3 -14,-3.0 -33,-0.2 -13,-1.0 -0.997 24.0 176.9-122.8 122.5 -3.6 22.9 21.9 105 107 A A E - F 0 89B 0 -33,-2.6 3,-0.0 -2,-0.5 -18,-0.0 -0.954 14.0-151.5-125.8 146.7 -6.6 21.0 20.6 106 108 A V E - F 0 88B 0 -18,-2.0 -18,-2.0 -2,-0.4 -31,-0.1 -0.845 38.7 -76.9-117.0 153.7 -9.3 19.5 22.7 107 109 A P E - F 0 87B 4 0, 0.0 -20,-0.3 0, 0.0 8,-0.1 -0.145 53.2-104.7 -48.1 139.3 -11.5 16.4 21.9 108 110 A H >> - 0 0 38 -22,-3.4 3,-2.3 -93,-0.1 4,-1.5 -0.365 31.1-111.3 -64.3 147.4 -14.3 17.0 19.4 109 111 A S T 34 S+ 0 0 30 1,-0.3 -1,-0.1 2,-0.2 7,-0.1 0.723 116.2 62.3 -53.3 -27.7 -17.8 17.2 20.9 110 112 A K T 34 S+ 0 0 165 1,-0.2 -1,-0.3 3,-0.1 3,-0.1 0.792 106.9 43.0 -72.6 -26.2 -18.7 13.9 19.3 111 113 A L T <4 S- 0 0 94 -3,-2.3 2,-0.3 1,-0.4 -2,-0.2 0.781 134.8 -10.3 -86.9 -29.8 -16.0 12.1 21.2 112 114 A S < - 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0 0 22 -4,-1.4 -1,-0.4 1,-0.1 3,-0.3 -0.919 45.9-151.3-166.3 143.3 20.4 -7.3 45.2 286 115 B K S > S+ 0 0 126 -2,-0.3 3,-2.5 1,-0.2 4,-0.3 0.669 78.9 94.7 -91.6 -16.7 24.0 -7.6 43.9 287 116 B E T 3 S+ 0 0 122 1,-0.3 3,-0.2 2,-0.1 -1,-0.2 0.667 88.3 43.8 -49.2 -22.0 23.4 -5.1 41.0 288 117 B Y T > S+ 0 0 28 -3,-0.3 3,-2.6 -8,-0.2 -1,-0.3 0.385 75.8 107.7-110.3 6.7 24.8 -2.2 43.1 289 118 B D T < S+ 0 0 46 -3,-2.5 -1,-0.1 1,-0.3 -2,-0.1 0.794 78.9 55.9 -53.8 -31.6 27.8 -3.8 44.7 290 119 B H T 3 S+ 0 0 126 -4,-0.3 2,-0.9 -3,-0.2 -1,-0.3 0.368 86.2 88.3 -82.2 0.0 30.1 -1.7 42.5 291 120 B I < + 0 0 9 -3,-2.6 -12,-0.1 1,-0.2 -1,-0.1 -0.846 42.3 146.2-103.1 94.8 28.5 1.6 43.6 292 121 B K + 0 0 128 -2,-0.9 2,-0.3 1,-0.2 -1,-0.2 0.692 63.2 17.8-100.4 -21.8 30.6 2.5 46.7 293 122 B D S >> S- 0 0 35 -3,-0.2 3,-3.1 35,-0.1 4,-0.5 -0.961 85.2 -91.8-149.3 164.5 30.6 6.2 46.4 294 123 B V G >4 S+ 0 0 6 -33,-1.5 3,-0.9 -2,-0.3 -32,-0.1 0.777 120.8 59.9 -45.3 -32.5 28.8 9.3 44.8 295 124 B N G 34 S+ 0 0 127 1,-0.2 -1,-0.3 -34,-0.1 4,-0.1 0.666 97.0 59.5 -72.7 -20.2 31.3 9.1 41.9 296 125 B D G <4 S+ 0 0 73 -3,-3.1 -1,-0.2 -35,-0.2 -2,-0.2 0.544 81.6 102.0 -84.6 -12.1 30.2 5.6 41.0 297 126 B L S << S- 0 0 5 -3,-0.9 5,-0.0 -4,-0.5 -5,-0.0 -0.502 92.5 -93.8 -71.5 141.2 26.6 6.7 40.4 298 127 B P > - 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0 0 133 -2,-0.4 -51,-1.0 -3,-0.1 2,-0.4 -0.998 19.7-157.8-151.1 149.3 13.0 27.8 45.2 321 150 B V E -P 268 0F 20 -11,-0.3 2,-0.5 -2,-0.3 -53,-0.2 -0.993 3.7-172.1-130.0 138.5 15.8 25.3 45.1 322 151 B K E -P 267 0F 115 -55,-2.7 -55,-2.6 -2,-0.4 2,-0.3 -0.971 19.4-146.0-130.5 103.3 19.5 25.9 44.4 323 152 B V E -P 266 0F 34 -2,-0.5 -57,-0.3 -57,-0.2 3,-0.1 -0.618 15.8-175.2 -70.9 133.0 21.4 22.6 44.2 324 153 B E E - 0 0 95 -59,-3.1 2,-0.3 1,-0.3 -58,-0.2 0.769 44.0 -75.4-104.6 -27.2 24.9 23.2 45.5 325 154 B G E -P 265 0F 27 -60,-1.7 -60,-3.4 2,-0.0 -1,-0.3 -0.907 42.1 -77.9 155.1 176.4 26.7 20.0 44.9 326 155 B W E -P 264 0F 59 -2,-0.3 2,-0.3 -62,-0.2 -62,-0.2 -0.640 32.0-163.3-104.3 162.3 27.3 16.3 45.8 327 156 B E E -P 263 0F 81 -64,-1.4 -64,-1.6 -2,-0.2 -33,-0.1 -0.963 23.3 -96.8-142.5 158.9 29.3 14.9 48.6 328 157 B N > - 0 0 70 -2,-0.3 4,-2.2 -66,-0.2 -66,-0.2 0.102 38.4 -91.1 -73.2-178.6 30.8 11.5 49.3 329 158 B A H > S+ 0 0 4 -68,-0.4 4,-3.3 1,-0.2 5,-0.2 0.913 124.0 55.3 -56.1 -45.9 29.8 8.4 51.3 330 159 B E H > S+ 0 0 117 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.890 107.6 47.0 -57.8 -44.2 31.7 9.7 54.3 331 160 B A H > S+ 0 0 27 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.909 113.7 50.4 -64.7 -38.3 29.8 13.0 54.3 332 161 B A H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.940 110.7 47.2 -63.3 -50.7 26.5 10.9 53.9 333 162 B K H X S+ 0 0 25 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.891 108.9 56.6 -60.8 -35.2 27.4 8.6 56.8 334 163 B A H X S+ 0 0 56 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.893 105.0 51.3 -62.3 -43.4 28.3 11.7 58.8 335 164 B E H X S+ 0 0 56 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.925 110.2 50.2 -60.0 -42.6 24.8 13.1 58.2 336 165 B I H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.895 113.1 43.2 -63.3 -49.2 23.2 9.8 59.4 337 166 B V H X S+ 0 0 60 -4,-2.3 4,-3.0 2,-0.2 5,-0.4 0.977 114.2 50.2 -65.0 -50.1 25.1 9.5 62.6 338 167 B A H X S+ 0 0 40 -4,-2.4 4,-3.4 1,-0.2 -2,-0.2 0.918 115.8 43.2 -52.4 -48.3 24.7 13.2 63.5 339 168 B S H X S+ 0 0 0 -4,-2.5 -106,-1.6 -5,-0.2 4,-1.4 0.765 113.3 50.7 -69.8 -31.4 20.9 13.0 62.9 340 169 B F H >X S+ 0 0 55 -4,-1.8 4,-1.0 -3,-0.3 3,-0.7 0.980 116.0 41.2 -69.8 -54.1 20.5 9.7 64.7 341 170 B E H >< S+ 0 0 103 -4,-3.0 3,-1.4 1,-0.3 -2,-0.2 0.940 114.2 54.6 -57.3 -44.1 22.4 11.0 67.7 342 171 B R H 3< S+ 0 0 90 -4,-3.4 -1,-0.3 -5,-0.4 -2,-0.2 0.818 105.0 53.1 -61.1 -30.4 20.5 14.2 67.3 343 172 B A H << 0 0 43 -4,-1.4 -1,-0.3 -3,-0.7 -2,-0.2 0.687 360.0 360.0 -79.8 -15.8 17.2 12.3 67.4 344 173 B K << 0 0 176 -3,-1.4 -1,-0.2 -4,-1.0 -2,-0.2 0.596 360.0 360.0 -66.7 360.0 18.1 10.6 70.7