==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 01-MAY-06 2GUK . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN PG1857; . SOURCE 2 ORGANISM_SCIENTIFIC: PORPHYROMONAS GINGIVALIS; . AUTHOR Y.KIM,P.QUARTEY,S.MOY,A.JOACHIMIAK,MIDWEST CENTER FOR STRUCT . 223 2 4 0 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12119.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 164 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 12.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 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-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 . 9 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 43.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 3.1 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 4 3 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 4 A Q 0 0 178 0, 0.0 7,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -99.2 15.8 42.6 115.8 2 5 A T + 0 0 128 2,-0.1 2,-0.3 0, 0.0 0, 0.0 0.116 360.0 99.4 -96.4 12.0 15.2 41.5 119.4 3 6 A L S S- 0 0 32 1,-0.1 5,-0.1 2,-0.0 0, 0.0 -0.761 78.3-103.3-107.5 156.6 18.3 39.4 119.1 4 7 A N > - 0 0 65 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.098 38.5-100.7 -70.3 166.0 21.8 40.0 120.3 5 8 A S H > S+ 0 0 86 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.845 121.9 55.0 -59.8 -36.6 24.7 41.1 118.1 6 9 A D H > S+ 0 0 53 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.931 112.3 43.5 -58.2 -48.4 26.2 37.5 117.9 7 10 A L H > S+ 0 0 8 2,-0.2 4,-3.2 1,-0.2 -2,-0.2 0.752 109.5 55.9 -71.5 -27.8 22.8 36.2 116.6 8 11 A R H X S+ 0 0 159 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.905 113.1 42.7 -69.3 -38.4 22.3 39.1 114.2 9 12 A V H X S+ 0 0 74 -4,-2.1 4,-3.1 -5,-0.2 -2,-0.2 0.935 112.3 53.5 -71.5 -46.6 25.6 38.2 112.7 10 13 A F H X S+ 0 0 1 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.946 113.0 43.2 -49.2 -54.2 24.6 34.6 112.8 11 14 A X H X S+ 0 0 15 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.870 111.8 54.9 -60.4 -38.3 21.3 35.4 110.9 12 15 A H H X S+ 0 0 112 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.912 107.9 48.7 -59.2 -45.7 23.3 37.6 108.6 13 16 A H H X S+ 0 0 36 -4,-3.1 4,-2.5 2,-0.2 -1,-0.2 0.787 105.9 57.1 -64.2 -35.7 25.6 34.7 107.8 14 17 A I H X S+ 0 0 0 -4,-1.7 4,-2.3 -5,-0.2 -2,-0.2 0.927 108.2 48.0 -61.3 -45.1 22.6 32.5 107.2 15 18 A Y H X S+ 0 0 98 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.869 110.3 51.8 -59.0 -39.3 21.5 35.1 104.6 16 19 A E H X>S+ 0 0 43 -4,-1.9 5,-2.3 2,-0.2 4,-0.8 0.938 111.7 45.8 -64.1 -48.6 25.0 35.1 103.0 17 20 A F H ><5S+ 0 0 44 -4,-2.5 3,-0.6 1,-0.2 -1,-0.2 0.905 114.6 48.2 -58.9 -44.2 25.0 31.3 102.7 18 21 A E H 3<5S+ 0 0 91 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.802 111.8 49.3 -67.7 -31.4 21.4 31.5 101.3 19 22 A K H 3<5S- 0 0 166 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.547 115.6-121.0 -82.6 -7.7 22.5 34.2 98.9 20 23 A G T <<5 + 0 0 61 -4,-0.8 -3,-0.2 -3,-0.6 -2,-0.1 0.724 69.7 136.5 74.6 24.9 25.5 31.9 97.9 21 24 A V S > -A 58 0A 25 -2,-0.3 3,-1.6 28,-0.2 4,-0.5 -0.392 42.2-116.4 -62.8 147.0 27.3 31.3 123.8 31 34 A N G >4 S+ 0 0 63 26,-2.1 3,-0.7 1,-0.3 -1,-0.1 0.769 113.4 58.6 -61.6 -31.0 26.0 27.9 124.8 32 35 A D G 34 S+ 0 0 151 25,-0.2 4,-0.3 1,-0.2 -1,-0.3 0.626 105.2 54.3 -69.5 -17.7 22.6 29.2 125.8 33 36 A D G <> S+ 0 0 34 -3,-1.6 4,-2.1 1,-0.1 -1,-0.2 0.566 86.9 78.4 -92.9 -12.0 22.2 30.6 122.3 34 37 A I H S+ 0 0 66 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.970 111.5 42.4 -55.2 -45.7 19.4 25.8 120.8 36 39 A Y H > S+ 0 0 77 -4,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.936 114.5 51.1 -58.7 -50.4 18.0 28.8 119.0 37 40 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.904 111.0 47.0 -58.5 -43.0 20.8 28.7 116.4 38 41 A E H X S+ 0 0 37 -4,-3.2 4,-3.4 1,-0.2 5,-0.2 0.885 110.0 54.2 -68.4 -38.4 20.3 25.0 115.6 39 42 A E H X S+ 0 0 91 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.902 108.8 49.0 -58.1 -44.1 16.5 25.5 115.3 40 43 A R H X S+ 0 0 59 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.933 114.5 45.3 -59.8 -46.6 17.1 28.3 112.8 41 44 A L H <>S+ 0 0 0 -4,-2.2 5,-2.5 2,-0.2 4,-0.5 0.919 113.3 48.0 -67.4 -46.9 19.5 26.1 110.8 42 45 A R H ><5S+ 0 0 133 -4,-3.4 3,-1.0 1,-0.2 -1,-0.2 0.900 110.2 54.0 -59.2 -41.4 17.3 23.0 110.9 43 46 A S H 3<5S+ 0 0 87 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.834 112.2 42.7 -61.6 -36.5 14.3 25.1 109.8 44 47 A R T 3<5S- 0 0 97 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.384 113.3-117.5 -93.5 1.0 16.1 26.4 106.8 45 48 A Q T < 5 + 0 0 171 -3,-1.0 -3,-0.2 -4,-0.5 -2,-0.1 0.684 59.7 155.9 75.1 19.9 17.6 22.9 106.0 46 49 A I < - 0 0 7 -5,-2.5 -1,-0.2 -6,-0.2 -2,-0.1 -0.719 41.2-129.3 -89.6 117.6 21.1 24.1 106.5 47 50 A P + 0 0 47 0, 0.0 17,-1.8 0, 0.0 2,-0.3 -0.252 35.0 178.4 -59.0 142.8 23.7 21.4 107.4 48 51 A Y E -B 63 0A 67 15,-0.2 2,-0.4 2,-0.0 15,-0.3 -0.971 27.0-154.3-146.1 165.6 25.9 22.2 110.4 49 52 A F E -B 62 0A 12 13,-2.7 13,-2.8 -2,-0.3 2,-0.4 -0.956 16.7-158.4-142.1 118.0 28.6 20.8 112.7 50 53 A A E +B 61 0A 36 -2,-0.4 11,-0.2 11,-0.2 -2,-0.0 -0.777 17.3 167.1 -97.1 138.7 28.9 22.0 116.3 51 54 A Q E -B 60 0A 21 9,-3.2 9,-3.5 -2,-0.4 -2,-0.0 -0.999 32.0 -97.2-150.5 160.2 32.1 21.8 118.3 52 55 A P - 0 0 103 0, 0.0 7,-0.1 0, 0.0 8,-0.1 0.054 32.7-144.2 -71.0-176.1 33.7 23.0 121.6 53 56 A T > - 0 0 28 5,-0.4 3,-1.3 3,-0.1 5,-0.1 -0.935 28.7-108.6-148.3 149.8 36.1 25.9 122.1 54 57 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.0 0, 0.0 26,-0.0 0.779 114.7 63.8 -51.0 -26.1 39.2 26.9 124.2 55 58 A N T 3 S- 0 0 124 1,-0.1 2,-2.4 3,-0.0 4,-0.1 -0.009 90.0-147.7-106.0 28.5 36.8 29.3 126.0 56 59 A T S < S+ 0 0 126 -3,-1.3 -1,-0.1 1,-0.3 -3,-0.1 -0.160 85.6 58.8 56.3 -56.9 34.4 26.8 127.6 57 60 A E S S+ 0 0 162 -2,-2.4 -26,-2.1 -5,-0.1 2,-0.3 0.256 99.6 77.9 -88.3 14.2 31.0 28.5 127.7 58 61 A R E -A 30 0A 86 -28,-0.2 -5,-0.4 -5,-0.1 2,-0.4 -0.893 62.4-154.4-125.7 154.9 31.2 28.9 123.9 59 62 A T E -A 29 0A 24 -30,-2.8 -30,-2.5 -2,-0.3 2,-0.6 -0.975 15.5-134.0-130.8 134.2 30.5 26.6 120.9 60 63 A N E -AB 28 51A 18 -9,-3.5 -9,-3.2 -2,-0.4 2,-0.6 -0.834 23.3-167.7 -85.5 125.4 31.9 26.8 117.4 61 64 A L E -AB 27 50A 0 -34,-4.0 -34,-2.9 -2,-0.6 2,-0.3 -0.942 2.9-171.5-119.3 104.9 29.0 26.2 115.0 62 65 A F E +AB 26 49A 0 -13,-2.8 -13,-2.7 -2,-0.6 2,-0.3 -0.755 11.9 171.3 -88.5 141.4 30.1 25.6 111.4 63 66 A F E +AB 25 48A 0 -38,-2.3 -38,-3.0 -2,-0.3 2,-0.3 -0.983 19.0 92.3-145.8 158.3 27.3 25.5 108.8 64 67 A G E S-A 24 0A 0 -17,-1.8 -40,-0.2 -2,-0.3 -41,-0.1 -0.979 72.5 -1.1 155.9-162.0 27.2 25.4 105.0 65 68 A a > - 0 0 16 -42,-1.8 4,-1.8 -2,-0.3 3,-0.4 -0.239 64.8-120.3 -56.5 144.6 27.0 22.9 102.1 66 69 A K H > S+ 0 0 136 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.804 110.4 64.6 -53.7 -34.2 26.9 19.3 103.2 67 70 A E H > S+ 0 0 47 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.939 107.4 38.8 -57.5 -50.1 30.1 18.7 101.1 68 71 A b H > S+ 0 0 0 -3,-0.4 4,-3.0 2,-0.2 5,-0.2 0.816 109.4 61.7 -75.6 -30.1 32.2 21.0 103.3 69 72 A X H X S+ 0 0 5 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.919 108.6 44.6 -54.5 -43.4 30.5 19.8 106.5 70 73 A E H X S+ 0 0 107 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.874 112.2 52.2 -72.7 -35.4 31.8 16.4 105.7 71 74 A A H X S+ 0 0 0 -4,-1.7 4,-0.7 2,-0.2 3,-0.2 0.943 111.6 45.3 -62.0 -49.7 35.3 17.8 104.8 72 75 A I H >X>S+ 0 0 0 -4,-3.0 4,-3.2 1,-0.2 5,-0.7 0.847 105.7 58.8 -68.7 -34.8 35.6 19.7 108.2 73 76 A R H 3X5S+ 0 0 120 -4,-1.9 4,-1.1 -5,-0.2 -1,-0.2 0.928 103.7 57.8 -51.4 -40.7 34.4 16.8 110.3 74 77 A L H 3<5S+ 0 0 80 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.721 124.6 13.4 -68.3 -26.6 37.4 15.0 108.7 75 78 A F H <<5S+ 0 0 7 -4,-0.7 -1,-0.2 -3,-0.7 -2,-0.2 0.592 127.5 47.4-129.0 -11.3 40.1 17.4 109.9 76 79 A V H ><5S+ 0 0 0 -4,-3.2 3,-2.6 -5,-0.2 -3,-0.2 0.683 76.3 116.0-100.4 -24.4 38.6 19.7 112.5 77 80 A S T 3< - 0 0 53 -2,-0.4 3,-1.8 1,-0.1 4,-0.1 -0.483 24.6-126.4 -70.3 142.5 41.6 23.4 117.9 81 84 A L G > S+ 0 0 39 1,-0.3 3,-0.7 -2,-0.2 -1,-0.1 0.703 109.9 61.4 -61.2 -18.8 41.5 25.7 114.8 82 85 A N G 3 S+ 0 0 148 1,-0.2 -1,-0.3 7,-0.0 -2,-0.0 0.386 93.3 63.4 -88.1 1.6 45.0 27.0 116.0 83 86 A S G < S+ 0 0 64 -3,-1.8 -1,-0.2 2,-0.0 -2,-0.1 0.304 78.6 118.6-104.8 4.5 46.6 23.5 115.6 84 87 A L < - 0 0 5 -3,-0.7 -8,-0.0 -4,-0.1 -3,-0.0 -0.348 66.8-111.5 -78.4 150.3 46.1 23.2 111.8 85 88 A T > - 0 0 57 1,-0.1 4,-2.9 -2,-0.1 5,-0.2 -0.277 35.7-104.8 -67.4 166.0 48.8 22.9 109.2 86 89 A P H > S+ 0 0 19 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.835 125.6 50.2 -60.7 -31.9 49.3 25.8 106.8 87 90 A E H > S+ 0 0 19 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.944 110.3 48.2 -72.0 -50.3 47.5 23.7 104.1 88 91 A E H > S+ 0 0 18 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.908 110.3 53.9 -52.1 -42.4 44.6 22.9 106.4 89 92 A D H X S+ 0 0 44 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.875 108.0 48.6 -60.2 -41.2 44.5 26.6 107.2 90 93 A F H X S+ 0 0 4 -4,-1.5 4,-3.3 -3,-0.3 -1,-0.2 0.900 110.9 51.3 -63.9 -46.3 44.2 27.6 103.5 91 94 A I H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 5,-0.2 0.957 110.3 47.7 -60.3 -49.8 41.5 25.0 103.0 92 95 A I H X S+ 0 0 15 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.908 114.2 47.1 -57.0 -48.6 39.4 26.4 105.9 93 96 A G H <>S+ 0 0 2 -4,-2.2 5,-2.1 2,-0.2 4,-0.4 0.934 111.7 50.5 -60.0 -46.6 39.9 29.9 104.7 94 97 A A H ><5S+ 0 0 2 -4,-3.3 3,-1.5 1,-0.2 -71,-0.3 0.935 110.0 50.4 -56.7 -46.1 38.9 28.9 101.2 95 98 A X H 3<5S+ 0 0 0 -4,-3.1 -71,-1.2 1,-0.3 -72,-0.6 0.894 105.7 57.0 -60.1 -37.4 35.8 27.2 102.5 96 99 A L T 3<5S- 0 0 11 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.509 123.1-104.0 -72.9 -3.7 34.9 30.3 104.5 97 100 A G T < 5 + 0 0 47 -3,-1.5 -3,-0.2 -4,-0.4 -2,-0.1 0.602 64.4 158.7 95.5 12.3 34.9 32.4 101.2 98 101 A Y < - 0 0 112 -5,-2.1 -1,-0.2 -6,-0.2 5,-0.1 -0.380 54.1 -90.9 -74.1 143.9 38.2 34.2 101.8 99 102 A D > - 0 0 99 1,-0.1 4,-2.3 -2,-0.1 -1,-0.1 -0.287 32.1-138.8 -57.3 131.9 39.9 35.6 98.7 100 103 A I H > S+ 0 0 25 2,-0.2 4,-2.3 1,-0.2 -1,-0.1 0.863 101.7 52.1 -69.0 -34.2 42.3 32.9 97.2 101 104 A c H > S+ 0 0 12 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.886 110.2 50.1 -68.0 -35.9 45.1 35.4 96.5 102 105 A R H > S+ 0 0 111 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.919 109.9 50.7 -62.1 -44.3 44.9 36.6 100.0 103 106 A Q H X S+ 0 0 7 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.878 106.9 54.8 -61.2 -39.4 45.0 32.9 101.2 104 107 A d H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.915 109.1 47.0 -60.4 -46.0 48.1 32.4 99.0 105 108 A E H X S+ 0 0 72 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.927 112.8 48.5 -60.3 -48.5 50.0 35.3 100.7 106 109 A R H X S+ 0 0 113 -4,-2.3 4,-2.4 1,-0.2 5,-0.3 0.940 110.4 52.5 -59.0 -44.2 49.0 34.0 104.2 107 110 A Y H X S+ 0 0 5 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.908 108.1 51.1 -56.8 -43.7 50.1 30.6 103.2 108 111 A C H < S+ 0 0 29 -4,-2.3 -1,-0.2 3,-0.2 -2,-0.2 0.875 108.1 52.3 -62.5 -41.8 53.5 32.0 102.1 109 112 A R H < S+ 0 0 181 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.940 115.6 39.3 -59.7 -52.6 53.9 33.8 105.4 110 113 A R H < 0 0 116 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.899 360.0 360.0 -61.4 -37.0 53.3 30.7 107.5 111 114 A K < 0 0 113 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.832 360.0 360.0-107.3 360.0 55.3 28.6 105.0 112 !* 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 0.0 113 6 B L 0 0 122 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 118.0 50.4 30.0 66.2 114 7 B N > - 0 0 66 1,-0.1 4,-2.2 4,-0.0 5,-0.1 -0.065 360.0 -92.5 -80.4-176.6 49.5 26.4 66.8 115 8 B S H > S+ 0 0 70 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.869 122.9 52.7 -64.5 -46.0 46.4 24.9 68.6 116 9 B D H > S+ 0 0 66 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.899 114.9 44.4 -56.3 -41.6 48.0 24.7 72.1 117 10 B L H > S+ 0 0 8 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.911 106.5 55.7 -74.9 -42.9 48.9 28.4 71.8 118 11 B R H X S+ 0 0 154 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.909 113.4 46.6 -53.9 -39.3 45.5 29.6 70.3 119 12 B V H X S+ 0 0 71 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.806 107.6 54.0 -71.6 -39.1 44.1 28.0 73.5 120 13 B F H X S+ 0 0 1 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.923 105.8 54.4 -55.8 -46.0 46.7 29.6 75.8 121 14 B X H X S+ 0 0 14 -4,-2.6 4,-2.1 1,-0.3 -2,-0.2 0.892 104.1 55.1 -59.8 -41.4 45.8 33.0 74.4 122 15 B H H X S+ 0 0 101 -4,-1.3 4,-1.8 1,-0.2 -1,-0.3 0.883 105.5 52.1 -56.2 -42.7 42.1 32.3 75.3 123 16 B H H X S+ 0 0 44 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.884 105.7 55.2 -61.7 -42.0 43.2 31.6 78.9 124 17 B I H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.944 105.7 51.4 -55.3 -50.0 45.0 35.0 79.0 125 18 B Y H X S+ 0 0 102 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.908 111.4 48.4 -54.0 -43.5 41.8 36.8 78.0 126 19 B E H <>S+ 0 0 70 -4,-1.8 5,-2.2 1,-0.2 4,-0.4 0.883 109.0 51.7 -66.0 -38.8 39.9 35.1 80.8 127 20 B F H ><5S+ 0 0 37 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.897 107.7 53.8 -63.4 -38.3 42.5 35.9 83.4 128 21 B E H 3<5S+ 0 0 99 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.837 106.5 50.5 -65.9 -37.2 42.4 39.6 82.4 129 22 B K T 3<5S- 0 0 174 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.497 119.9-114.4 -80.0 -5.1 38.7 39.8 82.9 130 23 B G T < 5 + 0 0 57 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.766 66.4 145.9 79.5 32.2 39.2 38.2 86.3 131 24 B V S > -C 168 0B 27 -2,-0.3 3,-1.9 28,-0.2 4,-0.7 -0.442 41.0-118.5 -61.5 140.1 55.6 22.3 74.3 141 34 B N G >4 S+ 0 0 56 26,-2.7 3,-1.1 1,-0.3 27,-0.1 0.877 115.6 58.5 -50.5 -39.4 59.0 23.5 75.5 142 35 B D G 34 S+ 0 0 150 25,-0.3 4,-0.3 1,-0.2 -1,-0.3 0.695 104.2 50.3 -64.8 -24.0 59.5 25.2 72.2 143 36 B D G <> S+ 0 0 32 -3,-1.9 4,-2.3 1,-0.1 -1,-0.2 0.502 88.7 85.3 -91.7 -9.2 56.3 27.4 72.7 144 37 B I H S+ 0 0 86 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.933 113.4 43.7 -45.3 -51.3 59.4 31.6 75.2 146 39 B Y H > S+ 0 0 91 -4,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.934 113.2 50.2 -59.7 -49.6 56.5 33.0 73.2 147 40 B A H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.939 112.1 48.3 -55.9 -46.2 53.9 32.2 75.9 148 41 B E H X S+ 0 0 39 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.899 107.5 55.3 -65.0 -38.7 56.0 34.0 78.5 149 42 B E H X S+ 0 0 95 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.926 106.7 50.7 -57.6 -43.4 56.5 37.0 76.2 150 43 B R H X S+ 0 0 50 -4,-2.1 4,-0.7 1,-0.2 -1,-0.2 0.865 111.6 48.3 -62.4 -37.0 52.7 37.4 75.9 151 44 B L H ><>S+ 0 0 0 -4,-1.8 5,-2.8 -5,-0.2 3,-0.6 0.913 110.8 50.4 -68.3 -45.0 52.4 37.2 79.7 152 45 B R H ><5S+ 0 0 124 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.886 102.3 60.1 -61.4 -39.7 55.2 39.8 80.2 153 46 B S H 3<5S+ 0 0 66 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.832 114.5 38.0 -56.3 -28.9 53.6 42.2 77.8 154 47 B R T <<5S- 0 0 82 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.352 111.3-121.0-103.5 0.6 50.6 42.2 80.1 155 48 B Q T < 5 + 0 0 169 -3,-1.5 -3,-0.2 -4,-0.2 -2,-0.1 0.815 55.2 160.0 58.2 35.1 52.6 42.1 83.4 156 49 B I < - 0 0 10 -5,-2.8 -1,-0.2 -6,-0.1 -2,-0.1 -0.788 41.4-122.5 -90.4 120.9 50.9 38.8 84.3 157 50 B P + 0 0 42 0, 0.0 17,-1.8 0, 0.0 2,-0.3 -0.287 39.0 177.8 -57.9 147.4 52.9 36.9 86.9 158 51 B Y E -D 173 0B 58 15,-0.2 2,-0.3 2,-0.0 15,-0.2 -0.982 27.0-160.5-151.1 162.0 54.0 33.4 85.9 159 52 B F E -D 172 0B 24 13,-2.6 13,-3.2 -2,-0.3 2,-0.4 -0.965 15.3-154.4-143.0 119.5 55.9 30.3 87.0 160 53 B A E -D 171 0B 27 -2,-0.3 11,-0.2 11,-0.2 -2,-0.0 -0.813 7.2-170.9 -96.4 139.2 57.1 27.7 84.4 161 54 B Q E -D 170 0B 19 9,-3.0 9,-2.8 -2,-0.4 -2,-0.0 -0.894 15.2-145.4-130.7 97.2 57.6 24.1 85.6 162 55 B P E -D 169 0B 88 0, 0.0 7,-0.2 0, 0.0 26,-0.1 -0.351 18.2-125.9 -59.6 144.1 59.3 21.8 83.0 163 56 B T > - 0 0 47 5,-2.4 3,-2.0 1,-0.2 5,-0.5 -0.888 19.1-138.5 -96.6 113.6 58.1 18.2 83.1 164 57 B P T 3 S+ 0 0 117 0, 0.0 -1,-0.2 0, 0.0 5,-0.0 0.809 93.8 39.3 -39.4 -57.0 61.2 16.0 83.5 165 58 B N T 3 S+ 0 0 164 -3,-0.1 2,-0.2 2,-0.0 -2,-0.0 0.122 114.4 51.4 -94.8 25.2 60.4 13.1 81.1 166 59 B T S < S- 0 0 71 -3,-2.0 -26,-0.0 2,-0.2 -3,-0.0 -0.765 81.7-114.1-136.1-179.6 58.8 15.1 78.2 167 60 B E S S+ 0 0 147 -2,-0.2 -26,-2.7 -5,-0.1 -25,-0.3 -0.286 87.1 102.6-106.4 42.1 59.3 18.1 76.0 168 61 B R E -C 140 0B 75 -5,-0.5 -5,-2.4 -28,-0.3 2,-0.4 -0.930 54.9-157.6-127.0 152.0 56.4 19.8 77.7 169 62 B T E -CD 139 162B 7 -30,-3.2 -30,-2.7 -2,-0.3 2,-0.7 -0.987 17.3-132.6-133.0 134.3 56.2 22.5 80.4 170 63 B N E -CD 138 161B 18 -9,-2.8 -9,-3.0 -2,-0.4 2,-0.7 -0.809 25.3-163.3 -81.2 115.9 53.5 23.4 82.9 171 64 B L E -CD 137 160B 0 -34,-3.8 -34,-2.5 -2,-0.7 2,-0.4 -0.900 4.7-168.6-107.3 108.3 53.1 27.2 82.7 172 65 B F E +CD 136 159B 0 -13,-3.2 -13,-2.6 -2,-0.7 2,-0.3 -0.743 9.8 173.5 -88.9 140.8 51.3 28.6 85.7 173 66 B F E +CD 135 158B 0 -38,-2.3 -38,-3.0 -2,-0.4 2,-0.3 -0.995 21.9 88.7-144.1 154.8 50.1 32.2 85.6 174 67 B G E S-C 134 0B 0 -17,-1.8 -40,-0.2 -2,-0.3 5,-0.1 -0.977 73.5 -1.8 156.0-162.8 48.0 34.3 87.9 175 68 B c > - 0 0 20 -42,-2.2 4,-1.6 -2,-0.3 3,-0.4 -0.175 64.9-120.1 -59.9 147.9 48.2 36.7 90.9 176 69 B K H > S+ 0 0 131 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.857 110.1 60.4 -55.7 -42.0 51.8 37.1 92.3 177 70 B E H > S+ 0 0 65 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.892 107.8 44.3 -56.4 -43.0 50.7 35.8 95.7 178 71 B d H > S+ 0 0 0 -3,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.798 109.1 56.3 -77.3 -25.8 49.7 32.4 94.2 179 72 B X H X S+ 0 0 4 -4,-1.6 4,-1.0 2,-0.2 -2,-0.2 0.925 109.5 46.9 -60.5 -46.1 52.8 32.2 92.1 180 73 B E H X S+ 0 0 89 -4,-2.5 4,-0.7 1,-0.2 -2,-0.2 0.867 114.1 49.7 -64.6 -36.9 54.8 32.6 95.3 181 74 B A H >< S+ 0 0 0 -4,-1.8 3,-1.0 -5,-0.2 4,-0.5 0.933 106.0 51.7 -67.9 -49.5 52.6 29.9 96.9 182 75 B I H >X>S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 3,-0.5 0.737 104.3 60.7 -64.1 -17.5 52.8 27.2 94.2 183 76 B R H 3X5S+ 0 0 111 -4,-1.0 4,-0.6 1,-0.2 -1,-0.2 0.828 96.6 60.4 -75.7 -31.5 56.6 27.5 94.3 184 77 B L H <<5S+ 0 0 83 -3,-1.0 -1,-0.2 -4,-0.7 -2,-0.2 0.594 126.2 10.3 -75.3 -10.8 56.7 26.5 98.0 185 78 B F H <45S+ 0 0 10 -3,-0.5 -2,-0.2 -4,-0.5 -1,-0.2 0.524 126.1 52.0-143.1 -15.9 55.1 23.1 97.3 186 79 B V H ><5S+ 0 0 1 -4,-2.3 3,-2.1 -5,-0.2 -3,-0.2 0.688 76.4 116.7 -93.4 -22.1 54.9 22.4 93.5 187 80 B S T 3< - 0 0 59 -2,-0.3 3,-1.3 1,-0.1 -27,-0.0 -0.671 20.7-135.0 -82.7 141.9 54.8 15.8 90.1 191 84 B L G > S+ 0 0 40 -2,-0.3 3,-0.8 1,-0.3 -1,-0.1 0.736 106.4 58.0 -69.0 -24.6 51.2 17.3 90.2 192 85 B N G 3 S+ 0 0 145 1,-0.2 -1,-0.3 7,-0.0 7,-0.0 0.439 97.6 62.9 -84.8 1.5 49.8 13.7 90.5 193 86 B S G < S+ 0 0 63 -3,-1.3 -1,-0.2 2,-0.0 2,-0.2 0.161 77.2 122.6-105.8 15.0 51.9 13.2 93.7 194 87 B L < - 0 0 4 -3,-0.8 -3,-0.0 1,-0.1 -8,-0.0 -0.504 65.6-113.8 -79.3 145.5 50.1 16.0 95.6 195 88 B T > - 0 0 56 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.283 33.7-103.2 -67.2 163.4 48.3 15.2 98.9 196 89 B P H > S+ 0 0 23 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.862 126.2 51.0 -59.6 -33.2 44.5 15.6 99.0 197 90 B E H > S+ 0 0 25 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.902 109.4 48.2 -64.3 -45.9 45.1 18.9 100.8 198 91 B E H > S+ 0 0 17 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.880 111.5 51.5 -66.1 -36.3 47.5 20.2 98.2 199 92 B D H X S+ 0 0 26 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.893 107.1 52.4 -65.4 -46.4 45.1 19.2 95.5 200 93 B F H X S+ 0 0 3 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.928 111.8 46.4 -49.7 -52.0 42.2 21.1 97.2 201 94 B I H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.892 111.1 51.9 -69.0 -34.9 44.3 24.2 97.4 202 95 B I H X S+ 0 0 11 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.968 112.5 45.8 -59.6 -54.1 45.4 23.8 93.7 203 96 B G H <>S+ 0 0 0 -4,-2.7 5,-2.4 1,-0.2 4,-0.2 0.885 111.5 51.9 -53.5 -43.4 41.8 23.5 92.5 204 97 B A H ><5S+ 0 0 3 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.920 108.9 50.0 -62.7 -41.5 40.8 26.4 94.7 205 98 B X H 3<5S+ 0 0 1 -4,-2.2 -72,-0.7 1,-0.3 -71,-0.5 0.868 106.8 57.2 -63.0 -36.6 43.6 28.6 93.2 206 99 B L T 3<5S- 0 0 13 -4,-1.9 -1,-0.3 -73,-0.2 -2,-0.2 0.419 124.6-104.5 -71.2 -6.1 42.3 27.5 89.7 207 100 B G T < 5 + 0 0 46 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.507 62.9 160.2 94.7 6.8 38.9 28.9 90.5 208 101 B Y < - 0 0 96 -5,-2.4 -1,-0.2 1,-0.1 5,-0.1 -0.226 52.6 -91.6 -66.1 149.9 37.0 25.7 91.2 209 102 B D > - 0 0 104 1,-0.1 4,-1.5 2,-0.0 -1,-0.1 -0.374 33.4-137.0 -59.8 136.4 33.8 25.7 93.2 210 103 B I H > S+ 0 0 27 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.880 102.0 51.1 -71.2 -41.7 34.6 25.2 96.9 211 104 B a H > S+ 0 0 22 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.928 110.3 51.8 -62.4 -43.6 31.8 22.7 97.7 212 105 B R H > S+ 0 0 125 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.894 111.0 47.5 -48.9 -46.8 33.0 20.8 94.6 213 106 B Q H X S+ 0 0 0 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.840 109.1 53.2 -70.2 -36.2 36.5 20.8 96.1 214 107 B b H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.900 109.0 51.7 -63.0 -39.5 35.1 19.8 99.5 215 108 B E H X S+ 0 0 110 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.915 111.4 43.9 -65.4 -43.5 33.5 16.8 97.7 216 109 B R H X S+ 0 0 68 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.770 110.8 56.0 -76.0 -22.7 36.7 15.7 96.0 217 110 B Y H X S+ 0 0 3 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.956 110.5 44.5 -66.3 -50.8 38.7 16.1 99.2 218 111 B C H X S+ 0 0 24 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.866 112.3 53.4 -57.7 -40.2 36.3 13.8 101.0 219 112 B R H X S+ 0 0 148 -4,-2.0 4,-4.2 2,-0.2 5,-0.3 0.915 109.4 47.3 -64.3 -43.0 36.4 11.5 98.0 220 113 B R H X S+ 0 0 90 -4,-2.3 4,-0.6 2,-0.2 -2,-0.2 0.927 115.8 45.6 -60.8 -43.7 40.2 11.4 98.2 221 114 B K H < S+ 0 0 78 -4,-2.7 -2,-0.2 1,-0.1 -1,-0.2 0.830 125.5 32.2 -69.3 -32.3 40.0 10.8 102.0 222 115 B S H < S+ 0 0 83 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.867 108.9 62.1 -89.5 -45.6 37.3 8.1 101.5 223 116 B N H < 0 0 107 -4,-4.2 -3,-0.2 1,-0.3 -2,-0.1 0.607 360.0 360.0 -67.0 -9.4 38.2 6.5 98.1 224 117 B S < 0 0 134 -4,-0.6 -1,-0.3 -5,-0.3 -4,-0.0 -0.790 360.0 360.0-114.2 360.0 41.4 5.5 99.8