==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 24-APR-06 2GRN . COMPND 2 MOLECULE: UBIQUITIN-CONJUGATING ENZYME E2 I; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.A.YUNUS,C.D.LIMA . 314 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16272.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 210 66.9 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 . 25 8.0 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 0.6 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 . 17 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 38.2 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+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 1 1 1 0 2 1 1 1 2 1 0 1 0 0 1 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 . 2 0 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 M 0 0 224 0, 0.0 3,-0.2 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 57.2 12.0 8.2 29.9 2 2 A S > + 0 0 26 1,-0.1 4,-2.9 2,-0.1 5,-0.2 0.070 360.0 121.8-112.2 22.4 8.5 6.7 29.4 3 3 A G H > S+ 0 0 44 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.791 74.3 50.5 -56.9 -32.9 7.3 7.2 32.9 4 4 A I H > S+ 0 0 136 -3,-0.2 4,-2.0 62,-0.2 -1,-0.2 0.930 112.0 46.8 -73.1 -43.5 4.4 9.3 31.9 5 5 A A H > S+ 0 0 0 61,-0.5 4,-3.0 1,-0.2 5,-0.2 0.941 112.4 50.9 -61.7 -45.8 3.3 6.7 29.3 6 6 A L H X S+ 0 0 65 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.863 107.2 53.3 -60.6 -37.4 3.7 3.9 31.8 7 7 A S H X S+ 0 0 83 -4,-1.7 4,-1.4 -5,-0.2 -1,-0.2 0.944 113.5 43.0 -62.9 -47.0 1.6 5.8 34.5 8 8 A R H X S+ 0 0 55 -4,-2.0 4,-2.4 1,-0.2 3,-0.3 0.943 113.2 51.3 -63.9 -49.1 -1.3 6.2 32.0 9 9 A L H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.824 104.4 57.1 -60.7 -33.1 -1.0 2.6 30.6 10 10 A A H X S+ 0 0 33 -4,-2.0 4,-1.8 -5,-0.2 -1,-0.2 0.909 111.5 43.8 -64.0 -39.6 -1.1 1.1 34.2 11 11 A Q H X S+ 0 0 116 -4,-1.4 4,-2.5 -3,-0.3 -2,-0.2 0.867 109.2 55.5 -73.0 -35.9 -4.4 2.9 34.6 12 12 A E H X S+ 0 0 14 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.916 108.6 50.8 -61.5 -39.9 -5.7 1.9 31.2 13 13 A R H X S+ 0 0 60 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.919 110.3 46.5 -63.8 -45.9 -5.1 -1.7 32.2 14 14 A K H X S+ 0 0 123 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.915 113.8 50.0 -63.8 -40.2 -6.9 -1.5 35.5 15 15 A A H X S+ 0 0 58 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.930 112.3 46.6 -62.3 -47.8 -9.8 0.3 33.8 16 16 A W H < S+ 0 0 17 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.922 112.3 49.4 -61.8 -45.6 -10.0 -2.4 31.1 17 17 A R H < S+ 0 0 163 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.831 109.9 53.5 -63.4 -31.8 -9.8 -5.2 33.5 18 18 A K H < S- 0 0 185 -4,-1.8 2,-0.3 1,-0.3 -1,-0.2 0.893 130.9 -8.1 -70.5 -39.7 -12.6 -3.6 35.6 19 19 A D S < S+ 0 0 115 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.1 -0.875 70.3 147.2-164.5 127.3 -14.9 -3.4 32.6 20 20 A H - 0 0 72 -2,-0.3 3,-0.1 -3,-0.2 2,-0.0 -0.975 52.3 -75.0-153.3 161.3 -14.7 -4.0 28.8 21 21 A P > - 0 0 28 0, 0.0 3,-1.5 0, 0.0 -2,-0.0 -0.339 57.9-100.2 -63.0 139.3 -16.9 -5.1 25.9 22 22 A F T 3 S+ 0 0 208 1,-0.2 3,-0.1 -2,-0.0 0, 0.0 -0.272 105.4 23.9 -60.0 141.7 -17.6 -8.9 25.8 23 23 A G T 3 S+ 0 0 31 1,-0.3 -1,-0.2 -3,-0.1 2,-0.2 0.124 97.1 114.6 90.6 -21.7 -15.5 -10.9 23.4 24 24 A F < - 0 0 11 -3,-1.5 2,-0.4 21,-0.1 -1,-0.3 -0.546 46.8-162.8 -85.5 150.0 -12.7 -8.3 23.3 25 25 A V E +A 44 0A 65 19,-2.1 19,-2.1 -2,-0.2 2,-0.2 -0.991 16.8 163.9-132.9 138.2 -9.2 -9.0 24.6 26 26 A A E +A 43 0A 3 -2,-0.4 17,-0.2 17,-0.2 -2,-0.0 -0.764 14.6 156.6-155.8 103.0 -6.5 -6.4 25.5 27 27 A V E -A 42 0A 70 15,-2.2 15,-3.0 -2,-0.2 -2,-0.0 -0.996 41.0-114.7-137.5 135.0 -3.5 -7.6 27.6 28 28 A P E -A 41 0A 14 0, 0.0 13,-0.3 0, 0.0 10,-0.2 -0.328 36.0-119.5 -62.5 143.8 0.1 -6.3 28.0 29 29 A T E -A 37 0A 19 11,-3.3 8,-3.5 8,-0.9 2,-0.3 -0.258 28.7-110.3 -76.8 173.5 2.8 -8.6 26.8 30 30 A K E -A 36 0A 145 6,-0.2 6,-0.2 8,-0.1 5,-0.1 -0.812 18.9-130.3-108.1 147.6 5.5 -9.9 29.1 31 31 A N > - 0 0 55 4,-3.7 3,-2.2 -2,-0.3 6,-0.1 -0.470 37.4 -99.8 -85.5 166.2 9.2 -9.0 29.2 32 32 A P T 3 S+ 0 0 143 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.847 124.1 57.8 -55.7 -33.9 11.7 -11.8 29.2 33 33 A D T 3 S- 0 0 119 1,-0.1 3,-0.1 2,-0.1 -3,-0.0 0.432 122.2-106.1 -78.5 2.6 12.1 -11.4 33.0 34 34 A G S < S+ 0 0 50 -3,-2.2 -1,-0.1 1,-0.3 3,-0.1 0.208 79.4 128.4 95.0 -16.8 8.4 -12.0 33.5 35 35 A T - 0 0 70 1,-0.1 -4,-3.7 -5,-0.1 -1,-0.3 -0.304 67.8 -93.3 -71.6 158.7 7.5 -8.4 34.2 36 36 A M E -A 30 0A 68 -6,-0.2 2,-0.8 -3,-0.1 -6,-0.2 -0.484 25.4-148.0 -75.0 139.0 4.7 -6.7 32.3 37 37 A N E > -A 29 0A 39 -8,-3.5 3,-1.4 3,-0.2 -8,-0.9 -0.859 15.4-178.2-108.2 93.7 5.5 -4.7 29.2 38 38 A L E 3 S+ 0 0 20 -2,-0.8 -1,-0.1 1,-0.2 3,-0.1 0.592 75.9 66.2 -68.8 -9.8 2.8 -2.0 29.2 39 39 A M E 3 S+ 0 0 27 1,-0.2 25,-2.6 24,-0.1 2,-0.4 0.532 101.0 49.5 -88.7 -7.2 4.2 -0.6 25.9 40 40 A N E < S- B 0 63A 35 -3,-1.4 -11,-3.3 23,-0.2 2,-0.4 -0.937 70.5-176.9-137.4 109.3 3.2 -3.7 23.8 41 41 A W E -AB 28 62A 0 21,-2.8 21,-2.6 -2,-0.4 2,-0.6 -0.873 19.9-145.2-112.7 142.0 -0.3 -5.1 24.1 42 42 A E E +AB 27 61A 98 -15,-3.0 -15,-2.2 -2,-0.4 2,-0.2 -0.915 31.7 175.3-103.7 119.4 -1.8 -8.2 22.4 43 43 A C E -AB 26 60A 4 17,-3.2 17,-2.3 -2,-0.6 2,-0.3 -0.740 20.9-157.0-121.5 168.3 -5.5 -7.6 21.6 44 44 A A E -AB 25 59A 6 -19,-2.1 -19,-2.1 15,-0.3 15,-0.2 -0.978 5.0-158.0-148.8 132.9 -8.3 -9.4 19.9 45 45 A I E - B 0 58A 0 13,-2.5 13,-3.0 -2,-0.3 2,-0.3 -0.962 14.3-139.0-117.2 123.9 -11.4 -8.0 18.3 46 46 A P E - B 0 57A 25 0, 0.0 11,-0.2 0, 0.0 8,-0.1 -0.588 28.8-106.1 -81.6 140.3 -14.6 -10.1 17.7 47 47 A G - 0 0 12 9,-2.8 8,-0.4 6,-0.4 2,-0.3 -0.343 42.8-102.3 -61.7 145.9 -16.5 -9.7 14.5 48 48 A K > - 0 0 80 69,-0.3 3,-1.6 6,-0.1 6,-0.4 -0.565 38.2-111.9 -75.9 127.9 -19.8 -7.7 14.9 49 49 A K T 3 S+ 0 0 175 -2,-0.3 -1,-0.1 1,-0.2 4,-0.0 -0.272 102.3 32.6 -58.4 140.2 -22.8 -10.0 15.0 50 50 A G T 3 S+ 0 0 72 1,-0.4 -1,-0.2 -3,-0.0 -2,-0.1 0.348 104.6 93.2 93.5 -6.3 -25.1 -9.5 12.0 51 51 A T S X S- 0 0 19 -3,-1.6 3,-2.1 1,-0.0 -1,-0.4 -0.750 92.0-106.1-115.4 163.9 -22.2 -8.8 9.7 52 52 A P T 3 S+ 0 0 34 0, 0.0 100,-0.3 0, 0.0 -3,-0.1 0.540 118.5 65.3 -66.5 -3.9 -20.0 -11.0 7.5 53 53 A W T > S+ 0 0 1 -5,-0.3 3,-1.6 99,-0.1 -6,-0.4 0.520 76.0 124.1 -93.2 -7.4 -17.3 -10.6 10.1 54 54 A E T < + 0 0 96 -3,-2.1 -6,-0.1 -6,-0.4 3,-0.1 -0.177 67.7 25.5 -55.6 141.9 -19.4 -12.5 12.7 55 55 A G T 3 S+ 0 0 49 -8,-0.4 2,-0.3 1,-0.3 -1,-0.2 0.288 97.4 111.4 88.1 -11.5 -17.8 -15.5 14.3 56 56 A G < - 0 0 3 -3,-1.6 -9,-2.8 100,-0.2 2,-0.5 -0.709 53.5-154.5 -99.7 150.3 -14.2 -14.3 13.7 57 57 A L E -B 46 0A 33 98,-2.6 2,-0.7 -2,-0.3 -33,-0.0 -0.965 14.9-159.8-122.3 109.1 -11.7 -13.2 16.3 58 58 A F E -B 45 0A 2 -13,-3.0 -13,-2.5 -2,-0.5 2,-0.2 -0.816 5.6-150.5 -99.8 112.0 -9.2 -10.9 14.8 59 59 A K E +B 44 0A 138 -2,-0.7 19,-2.4 -15,-0.2 2,-0.3 -0.512 21.1 167.8 -82.0 143.1 -5.9 -10.5 16.7 60 60 A L E -BC 43 77A 3 -17,-2.3 -17,-3.2 17,-0.3 2,-0.4 -0.983 28.3-127.5-150.3 157.6 -3.8 -7.3 16.6 61 61 A R E -BC 42 76A 50 15,-2.9 15,-2.6 -2,-0.3 2,-0.5 -0.884 14.0-153.8-110.1 139.5 -0.9 -5.8 18.5 62 62 A M E -BC 41 75A 0 -21,-2.6 -21,-2.8 -2,-0.4 2,-0.5 -0.964 11.4-167.9-114.9 119.1 -1.0 -2.3 20.0 63 63 A L E -BC 40 74A 59 11,-2.8 11,-2.8 -2,-0.5 2,-0.4 -0.925 3.6-158.5-111.4 127.8 2.4 -0.5 20.3 64 64 A F - 0 0 13 -25,-2.6 2,-0.2 -2,-0.5 -2,-0.0 -0.832 11.7-136.1-105.2 141.3 2.8 2.6 22.4 65 65 A K > - 0 0 113 -2,-0.4 3,-2.0 7,-0.2 6,-0.1 -0.511 29.5-105.0 -90.0 162.2 5.6 5.1 21.9 66 66 A D T 3 S+ 0 0 106 1,-0.3 -61,-0.5 -2,-0.2 -62,-0.2 0.721 119.7 56.9 -59.1 -22.4 7.6 6.7 24.8 67 67 A D T > S+ 0 0 69 -63,-0.1 3,-2.6 -62,-0.1 4,-0.4 0.296 88.6 167.5 -94.7 10.9 5.7 10.0 24.2 68 68 A Y T < + 0 0 4 -3,-2.0 -60,-0.1 1,-0.3 -59,-0.1 -0.392 56.9 30.5 -62.0 143.6 2.3 8.4 24.7 69 69 A P T 3 S+ 0 0 22 0, 0.0 -1,-0.3 0, 0.0 38,-0.1 -0.879 113.7 64.4 -89.6 23.2 -0.4 9.8 25.1 70 70 A S S < S+ 0 0 74 -3,-2.6 -2,-0.2 34,-0.1 33,-0.0 0.866 113.5 39.7 -69.0 -32.7 0.9 12.8 23.0 71 71 A S S S- 0 0 0 -4,-0.4 -6,-0.1 -6,-0.1 27,-0.1 -0.810 93.7-113.0-113.7 153.7 1.0 10.3 20.2 72 72 A P - 0 0 19 0, 0.0 -7,-0.2 0, 0.0 2,-0.1 -0.383 36.5-102.0 -80.8 162.2 -1.5 7.5 19.3 73 73 A P - 0 0 4 0, 0.0 2,-0.6 0, 0.0 -9,-0.2 -0.493 32.5-118.7 -80.5 157.8 -0.6 3.8 19.6 74 74 A K E -C 63 0A 106 -11,-2.8 -11,-2.8 -2,-0.1 2,-0.5 -0.885 28.3-158.6 -99.8 125.2 0.2 1.9 16.4 75 75 A C E +C 62 0A 2 -2,-0.6 17,-2.6 17,-0.4 2,-0.4 -0.909 12.2 179.2-109.5 124.5 -2.2 -0.9 15.8 76 76 A K E -CD 61 91A 66 -15,-2.6 -15,-2.9 -2,-0.5 15,-0.3 -0.977 24.8-132.7-130.4 124.0 -1.3 -3.9 13.6 77 77 A F E -C 60 0A 2 13,-2.8 -17,-0.3 -2,-0.4 -33,-0.0 -0.506 28.8-126.5 -69.6 136.9 -3.4 -6.9 12.7 78 78 A E S S+ 0 0 84 -19,-2.4 -19,-0.2 -2,-0.2 12,-0.1 -0.935 99.7 21.9-132.6 109.2 -1.5 -10.1 13.1 79 79 A P S S- 0 0 70 0, 0.0 -1,-0.2 0, 0.0 10,-0.1 0.579 114.2-102.5 -77.0 174.8 -1.7 -11.6 10.6 80 80 A P - 0 0 64 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.281 40.5-134.2 -59.9 145.5 -2.6 -8.8 8.2 81 81 A L - 0 0 8 6,-0.3 2,-0.9 9,-0.1 5,-0.1 -0.753 13.7-113.1-108.4 153.1 -6.3 -8.7 7.2 82 82 A F + 0 0 30 -2,-0.3 5,-0.1 65,-0.1 69,-0.1 -0.735 69.1 122.8 -79.2 107.2 -8.1 -8.4 3.9 83 83 A H > - 0 0 0 -2,-0.9 3,-1.7 3,-0.3 50,-0.2 -0.900 68.7-120.4-167.5 139.5 -9.7 -4.9 4.4 84 84 A P T 3 S+ 0 0 0 0, 0.0 45,-3.6 0, 0.0 46,-1.2 0.778 113.1 44.1 -55.8 -30.1 -9.6 -1.6 2.4 85 85 A N T 3 S+ 0 0 3 43,-0.3 8,-2.0 44,-0.2 2,-0.5 0.172 94.4 90.6-104.6 18.4 -8.2 0.3 5.4 86 86 A V B < S-E 92 0B 1 -3,-1.7 -3,-0.3 6,-0.2 6,-0.2 -0.967 73.4-131.3-117.2 121.2 -5.6 -2.2 6.6 87 87 A Y > - 0 0 23 4,-2.9 3,-1.7 -2,-0.5 -6,-0.3 -0.199 27.9-108.5 -62.9 159.5 -2.1 -1.9 5.1 88 88 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 42,-0.1 0.782 123.5 59.9 -61.5 -23.5 -0.4 -5.1 3.7 89 89 A S T 3 S- 0 0 49 2,-0.1 3,-0.1 -10,-0.1 -2,-0.0 0.655 123.4-108.1 -76.0 -19.2 1.8 -4.8 6.8 90 90 A G < + 0 0 0 -3,-1.7 -13,-2.8 1,-0.3 2,-0.1 0.187 69.5 145.9 110.1 -14.4 -1.3 -5.1 9.0 91 91 A T B -D 76 0A 11 -15,-0.3 -4,-2.9 -5,-0.1 2,-0.4 -0.362 40.9-140.8 -61.3 128.0 -1.3 -1.5 10.2 92 92 A V B -E 86 0B 7 -17,-2.6 2,-0.5 -6,-0.2 -17,-0.4 -0.747 8.4-142.3 -94.3 139.3 -4.9 -0.3 10.6 93 93 A C + 0 0 17 -8,-2.0 2,-0.3 -2,-0.4 3,-0.1 -0.866 31.2 151.0-105.8 131.0 -5.9 3.3 9.6 94 94 A L > - 0 0 29 -2,-0.5 3,-1.8 1,-0.1 8,-0.1 -0.977 48.9-124.7-155.7 141.3 -8.3 5.4 11.6 95 95 A S G > S+ 0 0 55 -2,-0.3 3,-1.8 1,-0.3 7,-1.8 0.908 113.5 55.0 -55.0 -44.1 -8.7 9.1 12.1 96 96 A I G 3 S+ 0 0 42 1,-0.3 8,-0.3 6,-0.2 -1,-0.3 0.587 103.3 59.1 -67.6 -7.0 -8.5 8.7 15.9 97 97 A L G < S+ 0 0 18 -3,-1.8 2,-0.5 6,-0.1 -1,-0.3 0.192 89.2 86.6-104.8 15.2 -5.2 6.9 15.4 98 98 A E X > - 0 0 53 -3,-1.8 3,-2.1 1,-0.1 5,-2.0 -0.964 65.7-150.6-122.6 120.0 -3.5 9.8 13.6 99 99 A E T 3 5S+ 0 0 110 -2,-0.5 -1,-0.1 1,-0.3 -4,-0.0 0.852 101.4 45.1 -52.6 -42.1 -1.8 12.6 15.6 100 100 A D T 3 5S+ 0 0 136 2,-0.1 -1,-0.3 0, 0.0 -5,-0.0 0.336 121.7 41.4 -87.5 9.5 -2.5 15.2 13.0 101 101 A K T < 5S- 0 0 102 -3,-2.1 -5,-0.1 -6,-0.2 -2,-0.1 0.372 127.2 -31.0-116.8-109.9 -6.1 14.1 12.7 102 102 A D T 5S+ 0 0 93 -7,-1.8 -6,-0.2 -8,-0.1 2,-0.2 0.326 87.3 124.7-103.2 6.7 -8.5 13.0 15.5 103 103 A W < + 0 0 16 -5,-2.0 -6,-0.1 -8,-0.5 -7,-0.1 -0.498 34.0 179.3 -69.8 136.6 -6.1 11.5 18.0 104 104 A R > - 0 0 161 -8,-0.3 3,-2.5 -2,-0.2 -34,-0.1 -0.997 39.1-118.0-138.1 133.7 -6.4 13.2 21.4 105 105 A P T 3 S+ 0 0 68 0, 0.0 -34,-0.1 0, 0.0 -35,-0.1 0.724 112.6 57.8 -39.5 -32.6 -4.4 12.2 24.5 106 106 A A T 3 S+ 0 0 70 2,-0.0 -3,-0.0 -3,-0.0 0, 0.0 0.721 73.5 118.4 -77.1 -25.0 -7.6 11.2 26.3 107 107 A I < - 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0 0 25 -3,-1.5 3,-1.6 -4,-0.2 -1,-0.2 -0.321 34.1 -52.5 100.1 177.6 22.1 6.0 -28.3 179 451 B P T 3 S+ 0 0 134 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.651 134.5 53.6 -67.8 -15.2 20.1 3.5 -30.4 180 452 B K T >> S+ 0 0 150 -3,-0.3 4,-2.0 1,-0.2 3,-0.6 0.191 71.9 119.6-102.8 14.8 20.6 0.8 -27.7 181 453 B S H <> + 0 0 9 -3,-1.6 4,-2.2 1,-0.2 5,-0.2 0.826 68.8 57.9 -49.1 -39.5 19.2 3.1 -24.9 182 454 B S H 3> S+ 0 0 27 -3,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.931 108.9 44.1 -60.3 -46.0 16.4 0.7 -24.2 183 455 B V H <> S+ 0 0 88 -3,-0.6 4,-2.7 1,-0.2 -1,-0.2 0.890 112.2 53.4 -66.4 -38.9 18.8 -2.2 -23.4 184 456 B L H X S+ 0 0 53 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.879 105.6 53.2 -64.2 -40.4 21.1 0.0 -21.3 185 457 B I H < S+ 0 0 0 -4,-2.2 4,-0.2 -5,-0.2 -1,-0.2 0.945 115.6 39.3 -59.9 -50.2 18.3 1.3 -19.1 186 458 B A H >< S+ 0 0 8 -4,-1.6 3,-1.1 1,-0.2 5,-0.2 0.889 114.9 53.7 -68.0 -40.3 17.2 -2.2 -18.2 187 459 B Q H 3< S+ 0 0 110 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.880 111.5 45.0 -62.0 -39.9 20.8 -3.5 -18.0 188 460 B Q T 3< S+ 0 0 115 -4,-2.4 2,-0.4 -5,-0.2 -1,-0.2 0.350 96.9 90.0 -88.7 5.9 21.8 -0.8 -15.5 189 461 B T S < S- 0 0 12 -3,-1.1 2,-1.6 -4,-0.2 8,-0.1 -0.877 78.5-127.7-106.7 134.4 18.7 -1.1 -13.3 190 462 B D > - 0 0 71 -2,-0.4 3,-1.6 1,-0.2 6,-0.2 -0.616 28.8-177.8 -79.0 90.5 18.6 -3.5 -10.3 191 463 B T T 3 S+ 0 0 21 -2,-1.6 -1,-0.2 1,-0.3 41,-0.1 0.429 70.4 76.6 -71.9 2.2 15.4 -5.3 -11.3 192 464 B S T 3 S+ 0 0 91 1,-0.1 -1,-0.3 43,-0.1 -2,-0.1 0.554 87.9 67.7 -87.3 -8.5 15.5 -7.4 -8.1 193 465 B D X> - 0 0 58 -3,-1.6 4,-1.6 1,-0.1 3,-0.5 -0.937 68.3-160.1-116.9 110.0 14.3 -4.4 -6.2 194 466 B P H 3> S+ 0 0 26 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.851 92.8 56.4 -53.6 -40.3 10.7 -3.2 -6.9 195 467 B E H 3> S+ 0 0 64 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.875 107.4 48.1 -62.9 -38.2 11.4 0.3 -5.5 196 468 B K H <> S+ 0 0 112 -3,-0.5 4,-2.2 -6,-0.2 -1,-0.2 0.810 110.6 51.6 -73.4 -28.2 14.3 0.8 -7.9 197 469 B V H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.903 109.4 49.6 -73.8 -39.8 12.2 -0.4 -10.8 198 470 B V H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.926 111.7 50.2 -61.5 -44.2 9.4 2.0 -9.9 199 471 B S H X S+ 0 0 54 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.934 113.1 44.0 -60.3 -48.1 12.0 4.8 -9.7 200 472 B A H X S+ 0 0 2 -4,-2.2 4,-2.5 1,-0.2 5,-0.3 0.906 112.0 54.0 -65.5 -40.4 13.5 4.0 -13.1 201 473 B F H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.921 112.5 43.3 -60.1 -43.7 10.1 3.6 -14.6 202 474 B L H X S+ 0 0 11 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.877 112.7 51.1 -71.4 -38.0 9.0 7.1 -13.4 203 475 B K H < S+ 0 0 71 -4,-2.4 4,-0.4 -5,-0.2 -2,-0.2 0.950 114.8 43.3 -64.4 -47.4 12.3 8.8 -14.4 204 476 B V H >< S+ 0 0 2 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.943 114.9 48.5 -63.5 -48.0 12.1 7.4 -17.9 205 477 B S H >< S+ 0 0 0 -4,-2.3 3,-1.8 -5,-0.3 -1,-0.2 0.766 96.8 74.1 -65.4 -22.1 8.4 8.1 -18.3 206 478 B S T 3< S+ 0 0 66 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.677 94.7 51.4 -65.7 -16.4 8.9 11.7 -17.0 207 479 B V T < S+ 0 0 4 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.327 78.5 136.7-102.9 9.0 10.5 12.7 -20.3 208 480 B F < + 0 0 4 -3,-1.8 2,-0.3 -4,-0.1 57,-0.1 -0.298 27.1 176.6 -57.4 133.5 7.7 11.4 -22.4 209 481 B K - 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0 0 42 -3,-1.3 3,-1.3 -4,-0.3 -4,-0.0 -0.736 69.9-148.5 -82.6 119.6 11.7 -12.7 -13.1 233 505 B S T 3 S+ 0 0 135 -2,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.659 99.1 51.9 -62.1 -13.7 9.7 -15.4 -11.3 234 506 B S T 3 S+ 0 0 99 2,-0.1 2,-0.3 -3,-0.0 -1,-0.3 0.619 82.1 107.6 -96.3 -17.7 10.9 -13.9 -8.1 235 507 B F < - 0 0 17 -3,-1.3 2,-1.2 -6,-0.3 3,-0.1 -0.460 68.7-136.1 -66.3 124.8 9.9 -10.3 -8.9 236 508 B N > - 0 0 81 -2,-0.3 4,-1.5 1,-0.2 3,-0.3 -0.711 21.3-175.6 -86.6 98.5 6.8 -9.3 -6.8 237 509 B S H > S+ 0 0 27 -2,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.751 79.4 59.9 -64.3 -28.1 4.6 -7.5 -9.3 238 510 B N H > S+ 0 0 95 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.895 104.7 47.6 -69.1 -41.0 2.1 -6.6 -6.7 239 511 B T H > S+ 0 0 49 -3,-0.3 4,-3.1 2,-0.2 5,-0.3 0.875 109.9 54.7 -67.7 -35.8 4.6 -4.6 -4.7 240 512 B F H X S+ 0 0 1 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.951 110.8 44.8 -60.3 -48.8 5.7 -2.9 -7.9 241 513 B L H X S+ 0 0 4 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.937 114.5 48.7 -61.4 -47.7 2.1 -1.8 -8.6 242 514 B T H X S+ 0 0 38 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.944 114.6 44.2 -59.4 -48.6 1.6 -0.7 -5.0 243 515 B R H X S+ 0 0 44 -4,-3.1 4,-2.9 2,-0.2 -1,-0.2 0.838 111.1 55.4 -66.6 -30.7 4.8 1.3 -4.9 244 516 B L H X S+ 0 0 1 -4,-2.3 4,-1.8 -5,-0.3 -1,-0.2 0.955 110.1 45.3 -64.0 -49.9 4.1 2.8 -8.3 245 517 B L H <>S+ 0 0 0 -4,-2.6 5,-2.7 2,-0.2 6,-1.1 0.877 112.9 52.1 -60.8 -38.8 0.7 4.0 -7.1 246 518 B V H ><5S+ 0 0 3 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.961 111.4 45.0 -62.3 -52.4 2.3 5.4 -3.9 247 519 B H H 3<5S+ 0 0 33 -4,-2.9 13,-1.4 1,-0.3 -1,-0.2 0.757 109.9 55.7 -65.4 -23.2 5.0 7.3 -5.9 248 520 B M T 3<5S- 0 0 3 -4,-1.8 -1,-0.3 11,-0.2 -2,-0.2 0.524 115.2-118.4 -85.6 -3.4 2.3 8.6 -8.3 249 521 B G T < 5S+ 0 0 31 -3,-1.6 -3,-0.2 -4,-0.4 48,-0.2 0.683 85.9 111.8 76.5 20.8 0.4 10.0 -5.2 250 522 B L S + 0 0 2 -2,-0.5 4,-2.7 34,-0.3 5,-0.3 0.462 60.1 97.5 -94.7 -2.0 1.6 12.4 -14.2 264 536 B Y H > S+ 0 0 66 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.944 88.3 40.1 -50.2 -59.4 1.4 13.0 -17.9 265 537 B G H > S+ 0 0 3 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.929 115.1 50.8 -58.5 -50.7 4.5 10.9 -18.8 266 538 B P H > S+ 0 0 1 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.889 112.0 48.6 -56.3 -40.3 3.8 8.0 -16.3 267 539 B L H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.903 113.0 46.2 -68.7 -40.3 0.2 7.7 -17.6 268 540 B M H X S+ 0 0 21 -4,-2.2 4,-1.6 -5,-0.3 -1,-0.2 0.873 112.4 51.1 -69.4 -36.4 1.3 7.6 -21.2 269 541 B A H X S+ 0 0 1 -4,-2.8 4,-2.8 -5,-0.2 -2,-0.2 0.921 111.1 48.2 -65.2 -42.9 4.0 5.1 -20.4 270 542 B L H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.893 104.2 60.5 -63.7 -39.5 1.5 2.9 -18.6 271 543 B N H < S+ 0 0 28 -4,-2.1 4,-0.3 1,-0.2 -1,-0.2 0.922 112.0 39.8 -52.8 -45.0 -0.9 3.2 -21.6 272 544 B H H >< S+ 0 0 27 -4,-1.6 3,-1.5 1,-0.2 4,-0.3 0.942 113.0 54.7 -69.1 -50.7 1.8 1.6 -23.7 273 545 B M H >< S+ 0 0 3 -4,-2.8 3,-2.1 1,-0.3 6,-0.3 0.883 100.2 58.4 -52.1 -47.6 2.9 -1.0 -21.1 274 546 B V T 3< S+ 0 0 9 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.636 100.6 58.7 -63.1 -12.3 -0.6 -2.5 -20.5 275 547 B Q T < S+ 0 0 108 -3,-1.5 -1,-0.3 -4,-0.3 2,-0.2 0.457 89.4 97.3 -94.4 -1.9 -0.8 -3.4 -24.2 276 548 B Q S X S- 0 0 55 -3,-2.1 3,-1.1 -4,-0.3 -3,-0.0 -0.551 78.5-125.0 -91.3 154.7 2.3 -5.6 -24.1 277 549 B D T 3 S+ 0 0 166 1,-0.2 -1,-0.1 -2,-0.2 -4,-0.0 0.813 107.8 60.3 -64.1 -33.3 2.6 -9.3 -23.7 278 550 B Y T 3 S+ 0 0 30 2,-0.1 -1,-0.2 -5,-0.1 -4,-0.1 0.659 80.9 106.3 -71.2 -14.9 4.9 -9.1 -20.7 279 551 B F S < S- 0 0 9 -3,-1.1 2,-0.8 -6,-0.3 5,-0.1 -0.526 76.2-125.0 -73.3 122.7 2.3 -7.2 -18.7 280 552 B P > - 0 0 38 0, 0.0 3,-2.5 0, 0.0 4,-0.4 -0.521 15.8-153.5 -67.8 105.3 0.6 -9.2 -15.9 281 553 B K G > S+ 0 0 152 -2,-0.8 3,-1.3 1,-0.3 -2,-0.0 0.738 88.4 72.1 -53.2 -25.6 -3.1 -8.9 -16.7 282 554 B A G 3 S+ 0 0 81 1,-0.3 4,-0.5 2,-0.2 -1,-0.3 0.707 92.0 58.4 -64.5 -19.7 -4.0 -9.4 -13.0 283 555 B L G <> S+ 0 0 4 -3,-2.5 4,-2.4 1,-0.2 -1,-0.3 0.686 85.5 81.8 -82.3 -18.8 -2.6 -5.9 -12.3 284 556 B A H <> S+ 0 0 8 -3,-1.3 4,-2.9 -4,-0.4 5,-0.2 0.901 89.1 49.2 -53.9 -49.2 -5.1 -4.3 -14.8 285 557 B P H > S+ 0 0 47 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.882 112.3 48.9 -60.1 -38.9 -8.0 -4.2 -12.3 286 558 B L H > S+ 0 0 16 -4,-0.5 4,-1.7 2,-0.2 -2,-0.2 0.916 112.8 46.8 -67.1 -44.3 -5.9 -2.6 -9.6 287 559 B L H X S+ 0 0 2 -4,-2.4 4,-1.5 1,-0.2 5,-0.2 0.934 112.1 51.3 -63.1 -44.7 -4.5 -0.0 -12.0 288 560 B L H X S+ 0 0 38 -4,-2.9 4,-1.9 -5,-0.2 3,-0.3 0.912 106.5 55.0 -59.0 -43.6 -8.0 0.7 -13.3 289 561 B A H X S+ 0 0 5 -4,-2.3 4,-0.8 1,-0.2 -1,-0.2 0.883 113.7 39.7 -58.6 -41.4 -9.3 1.2 -9.7 290 562 B F H < S+ 0 0 2 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.631 112.8 53.0 -87.9 -12.8 -6.7 3.8 -8.8 291 563 B V H < S+ 0 0 0 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.767 113.5 44.5 -88.7 -27.5 -6.7 5.7 -12.1 292 564 B T H < S+ 0 0 62 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.1 0.718 92.2 102.1 -85.7 -21.8 -10.5 6.1 -12.0 293 565 B K S < S- 0 0 29 -4,-0.8 5,-0.1 -5,-0.2 -167,-0.0 -0.416 90.1 -95.2 -65.3 131.7 -10.4 7.1 -8.3 294 566 B P + 0 0 100 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.167 60.0 151.7 -49.5 133.4 -10.8 10.9 -7.8 295 567 B N >> - 0 0 42 -4,-0.1 4,-2.0 -3,-0.1 3,-0.8 -0.850 47.6-134.0-168.8 130.7 -7.4 12.7 -7.5 296 568 B S H 3> S+ 0 0 95 -2,-0.3 4,-1.2 1,-0.3 -1,-0.1 0.843 106.4 56.5 -55.1 -39.9 -6.3 16.2 -8.3 297 569 B A H 34 S+ 0 0 30 1,-0.2 -34,-0.3 2,-0.2 -1,-0.3 0.814 110.0 45.4 -64.6 -31.3 -3.1 15.0 -10.0 298 570 B L H X4 S+ 0 0 0 -3,-0.8 3,-1.5 1,-0.2 7,-0.3 0.849 106.0 59.1 -80.4 -36.3 -5.1 12.9 -12.4 299 571 B E H >< S+ 0 0 100 -4,-2.0 3,-0.8 1,-0.3 -2,-0.2 0.783 100.8 56.7 -63.2 -27.6 -7.7 15.6 -13.2 300 572 B S T 3< S+ 0 0 95 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.557 108.2 48.4 -80.9 -8.2 -4.9 17.9 -14.5 301 573 B C T <> + 0 0 12 -3,-1.5 4,-2.7 1,-0.1 -1,-0.3 -0.322 70.0 150.4-124.7 47.2 -3.9 15.2 -17.0 302 574 B S H <> + 0 0 56 -3,-0.8 4,-2.9 1,-0.2 5,-0.2 0.851 69.1 49.7 -47.4 -48.7 -7.4 14.5 -18.4 303 575 B F H > S+ 0 0 148 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.955 114.7 42.0 -60.6 -53.2 -6.2 13.4 -21.8 304 576 B A H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.891 116.5 51.6 -60.5 -39.9 -3.6 11.0 -20.7 305 577 B R H X S+ 0 0 29 -4,-2.7 4,-2.3 -7,-0.3 -2,-0.2 0.923 109.2 46.8 -64.1 -48.9 -5.9 9.7 -18.0 306 578 B H H X S+ 0 0 112 -4,-2.9 4,-2.7 -5,-0.2 -1,-0.2 0.891 112.6 52.2 -61.1 -39.9 -8.9 9.0 -20.3 307 579 B S H X S+ 0 0 30 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.912 109.6 47.5 -61.8 -46.6 -6.6 7.3 -22.8 308 580 B L H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.908 113.4 48.6 -63.2 -43.6 -5.1 5.0 -20.2 309 581 B L H X S+ 0 0 14 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.934 109.0 51.9 -64.0 -46.1 -8.6 4.1 -18.9 310 582 B Q H X S+ 0 0 123 -4,-2.7 4,-0.6 1,-0.2 -1,-0.2 0.890 112.5 47.9 -57.5 -37.3 -9.9 3.4 -22.4 311 583 B T H >X S+ 0 0 16 -4,-1.9 3,-1.2 1,-0.2 4,-0.5 0.905 107.1 54.7 -69.4 -42.5 -6.9 1.1 -22.9 312 584 B L H >< S+ 0 0 7 -4,-2.6 3,-1.1 1,-0.3 -1,-0.2 0.841 98.8 63.4 -61.0 -32.1 -7.5 -0.7 -19.6 313 585 B Y H 3< S+ 0 0 137 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.806 103.7 49.7 -62.3 -27.2 -11.1 -1.4 -20.7 314 586 B K H << 0 0 166 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.537 360.0 360.0 -90.0 -7.3 -9.6 -3.5 -23.5 315 587 B V << 0 0 76 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.1 0.934 360.0 360.0 -59.1 360.0 -7.2 -5.6 -21.4