==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 14-MAY-08 3D4J . COMPND 2 MOLECULE: DIPHOSPHOMEVALONATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.E.VOYNOVA,Z.FU,K.BATTAILE,T.J.HERDENDORF,J.-J.P.KIM, . 742 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30414.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 490 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 129 17.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 55 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 216 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.5 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 1 0 3 0 2 0 2 1 3 3 0 1 2 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 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 . 3 4 1 7 3 2 4 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 . 2 0 2 2 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 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 8 A A 0 0 139 0, 0.0 48,-0.3 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 127.3 33.9 -8.7 -10.6 2 9 A A - 0 0 27 46,-0.1 2,-0.4 367,-0.1 46,-0.2 -0.392 360.0-154.3 -76.2 153.5 33.2 -7.6 -7.1 3 10 A V E -A 47 0A 22 44,-2.2 44,-2.3 -2,-0.1 2,-0.4 -0.983 7.6-166.9-129.5 139.9 29.8 -6.2 -6.0 4 11 A T E +A 46 0A 2 -2,-0.4 357,-3.8 357,-0.4 2,-0.3 -0.981 10.0 168.6-137.0 129.4 29.2 -3.9 -3.1 5 12 A C E -AB 45 360A 0 40,-2.2 40,-2.6 -2,-0.4 2,-0.3 -0.792 20.7-140.7-127.0 167.7 25.9 -2.8 -1.3 6 13 A T E -AB 44 359A 8 353,-2.1 353,-2.2 -2,-0.3 38,-0.2 -0.948 15.0-165.0-128.7 150.8 25.0 -1.0 1.9 7 14 A A E -A 43 0A 0 36,-1.6 36,-2.0 -2,-0.3 2,-0.2 -0.965 11.4-130.6-136.5 153.7 22.1 -1.7 4.2 8 15 A P - 0 0 0 0, 0.0 2,-0.2 0, 0.0 34,-0.1 -0.531 13.0-126.6 -99.6 166.7 20.4 0.2 7.0 9 16 A V - 0 0 9 32,-0.2 27,-2.2 -2,-0.2 2,-0.3 -0.594 27.8-153.1 -99.7 168.3 19.4 -0.7 10.6 10 17 A N E -F 35 0B 2 25,-0.2 2,-0.5 94,-0.2 25,-0.2 -0.990 10.1-132.7-145.0 152.9 15.8 -0.2 11.7 11 18 A I E -F 34 0B 8 23,-2.3 23,-2.2 -2,-0.3 2,-0.4 -0.928 21.3-132.3-109.9 123.2 14.0 0.5 14.9 12 19 A A E +F 33 0B 7 -2,-0.5 21,-0.3 21,-0.2 3,-0.2 -0.595 24.0 177.2 -75.8 124.6 10.9 -1.5 15.8 13 20 A V E S+ 0 0 0 19,-2.7 2,-0.6 -2,-0.4 20,-0.2 0.695 86.5 41.6 -95.4 -28.3 8.1 0.6 17.0 14 21 A I E S-F 32 0B 0 18,-2.2 18,-1.1 224,-0.1 -1,-0.3 -0.970 109.4-124.9-116.3 105.9 5.7 -2.4 17.3 15 22 A K - 0 0 4 -2,-0.6 2,-0.6 -3,-0.2 18,-0.1 -0.264 13.1-144.3 -69.4 138.3 8.2 -4.8 18.8 16 23 A Y + 0 0 29 -2,-0.1 2,-0.2 16,-0.0 15,-0.1 -0.850 36.8 151.8 -92.8 118.8 9.1 -8.2 17.6 17 24 A W + 0 0 9 -2,-0.6 -2,-0.0 1,-0.3 2,-0.0 -0.706 43.3 27.5-156.6 100.4 9.7 -10.5 20.6 18 25 A G - 0 0 0 -2,-0.2 10,-2.4 10,-0.0 11,-0.4 0.151 60.3-129.1 119.3 127.2 9.2 -14.2 20.5 19 26 A K E -I 27 0C 8 8,-0.3 3,-0.2 9,-0.1 179,-0.0 -0.755 8.4-165.7-103.6 149.8 9.3 -17.0 17.9 20 27 A R E S+ 0 0 97 6,-4.0 2,-0.3 1,-0.3 -1,-0.1 0.489 93.5 27.2-104.4 -10.6 6.6 -19.6 17.2 21 28 A D E >> -I 26 0C 51 5,-1.3 5,-2.0 1,-0.1 4,-0.9 -0.833 63.0-169.5-154.1 106.8 9.2 -21.6 15.2 22 29 A E T 45S+ 0 0 65 -2,-0.3 -1,-0.1 3,-0.2 173,-0.0 0.692 86.1 57.2 -71.6 -20.8 12.9 -21.3 16.0 23 30 A E T 45S+ 0 0 131 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.964 118.5 24.7 -75.6 -59.1 13.9 -23.2 12.8 24 31 A L T 45S- 0 0 34 2,-0.1 -2,-0.2 50,-0.0 -1,-0.1 0.555 109.9-120.9 -83.9 -8.6 12.3 -21.1 10.1 25 32 A V T <5 + 0 0 1 -4,-0.9 -3,-0.2 1,-0.2 110,-0.1 1.000 47.6 169.9 64.4 71.1 12.4 -18.1 12.4 26 33 A L E < -I 21 0C 1 -5,-2.0 -6,-4.0 107,-0.0 -5,-1.3 -0.969 25.7-132.9-118.4 128.7 8.7 -17.2 12.6 27 34 A P E -I 19 0C 0 0, 0.0 -8,-0.3 0, 0.0 -9,-0.0 -0.390 12.2-131.6 -77.8 151.8 7.4 -14.6 15.1 28 35 A I S S+ 0 0 33 -10,-2.4 2,-0.3 -2,-0.1 -9,-0.1 0.543 95.0 18.4 -78.9 -8.2 4.4 -15.0 17.4 29 36 A N S S- 0 0 1 -11,-0.4 2,-0.1 183,-0.1 -12,-0.1 -0.978 85.9-102.5-155.9 160.6 3.3 -11.6 16.2 30 37 A S - 0 0 20 -2,-0.3 2,-0.3 178,-0.2 120,-0.2 -0.373 34.0-150.6 -81.5 166.9 3.9 -9.1 13.4 31 38 A S E - G 0 149B 0 118,-1.6 118,-3.1 -2,-0.1 2,-0.4 -0.977 8.6-152.8-141.8 152.7 6.1 -6.0 13.8 32 39 A L E +FG 14 148B 1 -18,-1.1 -19,-2.7 -2,-0.3 -18,-2.2 -0.993 23.8 171.9-127.5 132.3 6.4 -2.5 12.4 33 40 A S E -FG 12 147B 0 114,-3.4 114,-2.3 -2,-0.4 2,-0.5 -0.879 30.3-121.2-138.3 169.9 9.7 -0.5 12.2 34 41 A V E -FG 11 146B 0 -23,-2.2 -23,-2.3 -2,-0.3 2,-0.5 -0.944 25.4-132.3-114.9 129.9 11.3 2.6 10.8 35 42 A T E -F 10 0B 0 110,-3.1 320,-2.6 -2,-0.5 110,-0.3 -0.704 23.0-141.0 -82.8 123.2 14.3 2.3 8.5 36 43 A L B -J 354 0D 0 -27,-2.2 2,-0.3 -2,-0.5 318,-0.2 -0.510 30.4 -88.7 -83.8 155.9 17.1 4.7 9.6 37 44 A H >> - 0 0 32 316,-1.8 4,-2.1 -2,-0.2 3,-1.9 -0.469 18.5-145.1 -74.5 125.5 19.2 6.6 7.0 38 45 A Q T 34 S+ 0 0 11 -2,-0.3 -1,-0.1 1,-0.3 -31,-0.1 0.649 95.7 76.8 -59.0 -15.0 22.3 5.0 5.6 39 46 A D T 34 S+ 0 0 117 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.916 113.0 21.8 -60.2 -40.9 23.9 8.5 5.5 40 47 A Q T <4 S+ 0 0 30 -3,-1.9 2,-0.4 1,-0.3 -2,-0.2 0.904 135.1 23.8 -91.0 -53.6 24.3 8.1 9.3 41 48 A L S < S+ 0 0 10 -4,-2.1 2,-0.3 -32,-0.1 -1,-0.3 -0.959 72.1 144.1-123.3 134.5 24.3 4.3 9.9 42 49 A K - 0 0 77 -2,-0.4 54,-1.7 -34,-0.1 2,-0.5 -0.998 39.9-132.9-163.4 160.8 25.1 1.5 7.5 43 50 A T E -AC 7 95A 4 -36,-2.0 -36,-1.6 -2,-0.3 2,-0.4 -0.981 23.8-152.4-117.3 124.7 26.6 -1.9 6.8 44 51 A T E -AC 6 94A 20 50,-3.3 50,-2.6 -2,-0.5 2,-0.4 -0.846 15.9-174.6 -99.0 135.1 28.9 -2.2 3.8 45 52 A T E -AC 5 93A 1 -40,-2.6 -40,-2.2 -2,-0.4 2,-0.4 -0.991 9.2-170.9-137.1 130.7 29.1 -5.6 2.1 46 53 A T E -AC 4 92A 0 46,-2.7 46,-2.4 -2,-0.4 2,-0.3 -0.964 6.1-177.1-121.3 134.7 31.3 -6.9 -0.7 47 54 A A E +AC 3 91A 0 -44,-2.3 -44,-2.2 -2,-0.4 2,-0.3 -0.970 5.2 179.0-132.1 145.7 30.9 -10.2 -2.5 48 55 A V E - C 0 90A 26 42,-2.0 42,-1.8 -2,-0.3 2,-0.4 -0.989 17.0-141.8-141.8 145.1 33.0 -11.9 -5.2 49 56 A I E - C 0 89A 57 -2,-0.3 40,-0.2 -48,-0.3 -2,-0.0 -0.916 33.1 -34.3-126.0 143.0 32.5 -15.3 -6.8 50 57 A S + 0 0 31 38,-2.6 4,-0.1 -2,-0.4 39,-0.0 0.034 35.9 147.0 76.1-163.8 34.4 -18.3 -8.1 51 58 A K S S- 0 0 187 2,-0.1 -1,-0.1 1,-0.1 -2,-0.0 0.590 108.2 -63.6 85.8 27.8 37.6 -19.3 -9.9 52 59 A D S S- 0 0 152 36,-0.1 -1,-0.1 2,-0.0 -3,-0.0 0.992 83.4-149.3 59.5 63.1 37.4 -22.3 -7.8 53 60 A F - 0 0 41 1,-0.2 2,-2.7 2,-0.1 -2,-0.1 -0.015 27.9 -90.4 -58.4 165.1 37.8 -20.1 -4.7 54 61 A T S S- 0 0 72 -4,-0.1 -1,-0.2 1,-0.1 2,-0.1 -0.439 83.5 -79.2 -77.6 63.7 39.4 -21.3 -1.4 55 62 A E S S- 0 0 120 -2,-2.7 2,-0.6 35,-0.0 34,-0.1 -0.295 75.4 -43.1 74.6-156.9 35.9 -22.4 -0.2 56 63 A D + 0 0 31 32,-0.1 2,-0.4 -3,-0.1 11,-0.3 -0.973 67.5 171.5-108.6 121.2 33.1 -20.1 1.2 57 64 A R E -d 90 0A 72 32,-1.3 34,-2.3 -2,-0.6 2,-0.4 -0.998 14.6-165.4-136.4 133.8 34.6 -17.6 3.6 58 65 A I E -d 91 0A 8 7,-0.6 2,-0.4 -2,-0.4 7,-0.2 -0.969 3.2-161.2-122.8 132.8 32.9 -14.6 5.2 59 66 A W E -d 92 0A 22 32,-3.1 34,-2.8 -2,-0.4 2,-0.4 -0.905 4.6-172.4-113.4 139.6 34.6 -11.7 7.0 60 67 A L E > S-dE 93 63A 52 3,-2.0 3,-0.7 -2,-0.4 34,-0.2 -0.956 74.4 -33.2-134.5 113.8 33.0 -9.3 9.4 61 68 A N T 3 S- 0 0 95 32,-2.9 33,-0.1 -2,-0.4 3,-0.1 0.333 125.1 -52.2 61.3 -13.3 34.8 -6.2 10.7 62 69 A G T 3 S+ 0 0 44 1,-0.5 -1,-0.3 31,-0.2 32,-0.0 -0.296 111.2 106.1 147.9 -57.8 37.9 -8.4 10.4 63 70 A R B < -E 60 0A 189 -3,-0.7 -3,-2.0 1,-0.1 2,-1.5 -0.284 69.5-129.2 -55.5 132.6 37.3 -11.7 12.3 64 71 A E - 0 0 94 -5,-0.2 -5,-0.2 -3,-0.1 -1,-0.1 -0.623 29.3-160.2 -89.5 81.6 36.8 -14.5 9.8 65 72 A E - 0 0 80 -2,-1.5 -7,-0.6 -7,-0.2 2,-0.4 0.042 21.9-100.7 -52.0 169.3 33.6 -16.1 11.1 66 73 A D > - 0 0 107 -9,-0.1 3,-1.2 1,-0.1 6,-0.2 -0.814 8.0-141.6-104.4 139.0 32.7 -19.6 10.0 67 74 A V T 3 S+ 0 0 31 -2,-0.4 6,-0.2 -11,-0.3 9,-0.1 0.600 95.4 77.5 -68.7 -11.8 30.2 -20.7 7.3 68 75 A G T 3 + 0 0 36 4,-0.1 -1,-0.2 5,-0.1 5,-0.1 0.799 60.9 117.9 -69.2 -29.7 29.2 -23.6 9.6 69 76 A Q S <> S- 0 0 60 -3,-1.2 4,-2.4 1,-0.2 5,-0.2 -0.121 73.1-130.3 -39.8 122.5 27.1 -21.2 11.8 70 77 A P H > S+ 0 0 102 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.809 104.8 56.4 -50.2 -32.6 23.5 -22.6 11.3 71 78 A R H > S+ 0 0 72 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.964 107.9 43.0 -66.5 -55.5 22.3 -19.1 10.6 72 79 A L H > S+ 0 0 6 1,-0.2 4,-4.0 2,-0.2 5,-0.4 0.923 112.1 57.6 -56.2 -43.8 24.7 -18.4 7.6 73 80 A Q H X S+ 0 0 88 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.950 107.0 46.0 -50.8 -56.6 23.9 -21.9 6.4 74 81 A A H X S+ 0 0 9 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.870 117.2 45.7 -55.6 -39.7 20.2 -21.2 6.2 75 82 A C H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 5,-0.3 0.966 111.3 49.1 -69.2 -53.6 20.9 -17.8 4.5 76 83 A L H X S+ 0 0 11 -4,-4.0 4,-1.5 1,-0.2 -1,-0.2 0.781 112.1 54.2 -56.5 -27.6 23.4 -19.2 2.0 77 84 A R H X S+ 0 0 146 -4,-2.1 4,-3.8 -5,-0.4 5,-0.4 0.981 104.3 49.7 -70.2 -60.3 20.9 -21.9 1.3 78 85 A E H X S+ 0 0 20 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.871 113.7 46.6 -46.8 -47.8 17.9 -19.7 0.5 79 86 A I H < S+ 0 0 2 -4,-2.0 4,-0.3 2,-0.2 -1,-0.2 0.927 118.4 40.9 -62.9 -46.8 19.9 -17.5 -1.9 80 87 A R H >< S+ 0 0 65 -4,-1.5 3,-0.7 -5,-0.3 -2,-0.2 0.824 113.9 52.5 -71.9 -31.8 21.4 -20.6 -3.7 81 88 A C H 3< S+ 0 0 88 -4,-3.8 3,-0.3 1,-0.2 -1,-0.2 0.782 108.8 53.1 -72.4 -25.6 18.1 -22.4 -3.6 82 89 A L T 3< S+ 0 0 48 -4,-1.5 -1,-0.2 -5,-0.4 -2,-0.2 0.494 79.6 95.7 -86.7 -6.0 16.6 -19.3 -5.2 83 90 A A < 0 0 43 -3,-0.7 -1,-0.2 -4,-0.3 -2,-0.1 0.161 360.0 360.0 -72.5 23.7 19.2 -19.4 -8.0 84 91 A R 0 0 227 -3,-0.3 -2,-0.2 -2,-0.0 -1,-0.1 -0.170 360.0 360.0-174.6 360.0 16.7 -21.3 -10.2 85 ! 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 86 107 A S 0 0 123 0, 0.0 3,-0.1 0, 0.0 -37,-0.0 0.000 360.0 360.0 360.0 29.8 29.9 -19.7 -10.6 87 108 A C + 0 0 86 1,-0.2 2,-0.2 0, 0.0 0, 0.0 0.612 360.0 69.0-133.9 -54.1 29.8 -21.8 -7.4 88 109 A K - 0 0 58 -32,-0.0 -38,-2.6 1,-0.0 2,-0.3 -0.504 63.4-156.0 -79.1 145.7 32.2 -20.7 -4.6 89 110 A V E -C 49 0A 6 -40,-0.2 -32,-1.3 -2,-0.2 2,-0.4 -0.910 14.8-168.2-127.8 152.3 31.6 -17.4 -2.7 90 111 A H E -Cd 48 57A 8 -42,-1.8 -42,-2.0 -2,-0.3 2,-0.4 -1.000 11.8-178.9-136.2 132.7 33.6 -14.8 -0.7 91 112 A V E -Cd 47 58A 2 -34,-2.3 -32,-3.1 -2,-0.4 2,-0.4 -0.998 10.0-178.5-138.7 137.7 32.1 -12.0 1.4 92 113 A A E +Cd 46 59A 4 -46,-2.4 -46,-2.7 -2,-0.4 2,-0.3 -0.998 14.2 179.2-134.3 126.7 33.6 -9.2 3.5 93 114 A S E +Cd 45 60A 13 -34,-2.8 -32,-2.9 -2,-0.4 2,-0.3 -0.923 8.6 172.5-131.9 157.1 31.4 -6.8 5.5 94 115 A V E -C 44 0A 53 -50,-2.6 -50,-3.3 -2,-0.3 2,-0.3 -0.955 10.6-157.8-152.9 163.2 31.9 -3.9 7.8 95 116 A N E -C 43 0A 38 -2,-0.3 -52,-0.2 -52,-0.3 -54,-0.0 -0.944 20.9-135.6-144.0 163.9 29.7 -1.3 9.5 96 117 A N S S+ 0 0 77 -54,-1.7 -53,-0.1 -2,-0.3 -1,-0.0 0.144 72.9 99.2-109.0 18.5 30.1 2.2 11.0 97 118 A F S S- 0 0 17 -55,-0.2 -2,-0.1 8,-0.0 -56,-0.0 -0.920 75.2-119.1-109.2 127.1 28.1 1.7 14.1 98 119 A P > - 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0 0 6 -4,-3.1 4,-1.1 -5,-0.2 3,-0.2 -0.770 38.6-178.9 -98.3 107.3 -2.6 -1.3 31.5 573 223 B P H > S+ 0 0 40 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.824 86.4 57.2 -68.5 -29.1 -4.0 -3.9 29.1 574 224 B L H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.860 99.1 59.6 -70.6 -31.7 -1.8 -6.6 30.7 575 225 B L H > S+ 0 0 2 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.917 102.3 52.8 -61.5 -42.2 -3.2 -5.9 34.2 576 226 B R H X S+ 0 0 162 -4,-1.1 4,-2.6 1,-0.2 5,-0.2 0.913 111.5 45.7 -58.9 -44.5 -6.8 -6.8 32.9 577 227 B F H X>S+ 0 0 36 -4,-1.4 4,-2.3 2,-0.2 5,-0.7 0.853 109.8 56.5 -67.4 -34.1 -5.5 -10.1 31.6 578 228 B R H X>S+ 0 0 0 -4,-2.3 5,-2.2 3,-0.2 4,-1.7 0.970 113.3 39.0 -60.9 -51.9 -3.6 -10.6 34.9 579 229 B A H <5S+ 0 0 12 -4,-2.7 -2,-0.2 3,-0.2 -1,-0.2 0.871 119.8 45.0 -67.6 -38.6 -6.8 -10.2 36.9 580 230 B E H <5S+ 0 0 136 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.915 132.4 9.4 -75.8 -42.3 -9.1 -12.1 34.6 581 231 B S H <5S+ 0 0 77 -4,-2.3 4,-0.2 -5,-0.2 -3,-0.2 0.565 127.7 40.9-119.2 -8.4 -7.1 -15.1 33.7 582 232 B V T X S+ 0 0 73 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.945 110.3 39.9 -48.6 -55.9 -7.5 -16.8 40.1 585 235 B A H > S+ 0 0 69 -3,-0.5 4,-2.1 1,-0.2 -2,-0.2 0.862 114.2 54.5 -62.4 -37.0 -5.5 -19.9 39.3 586 236 B R H X S+ 0 0 31 -4,-1.9 4,-2.8 2,-0.2 5,-0.3 0.846 102.4 57.0 -67.2 -33.3 -2.5 -18.6 41.1 587 237 B M H X S+ 0 0 15 -4,-2.7 4,-2.7 -5,-0.2 5,-0.2 0.977 108.3 48.2 -59.3 -51.4 -4.6 -18.1 44.3 588 238 B A H X S+ 0 0 64 -4,-1.7 4,-1.7 1,-0.2 -2,-0.2 0.874 114.9 43.4 -56.7 -43.7 -5.5 -21.8 44.1 589 239 B E H X S+ 0 0 80 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.862 111.6 53.3 -73.0 -34.7 -1.9 -23.0 43.6 590 240 B M H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 3,-0.3 0.944 110.4 48.3 -63.2 -45.1 -0.5 -20.7 46.3 591 241 B A H X S+ 0 0 22 -4,-2.7 4,-2.5 -5,-0.3 -1,-0.2 0.898 111.2 51.4 -59.9 -39.8 -3.0 -22.0 48.7 592 242 B R H X S+ 0 0 56 -4,-1.7 4,-1.9 -5,-0.2 -1,-0.2 0.795 108.3 51.3 -68.5 -29.9 -2.0 -25.5 47.6 593 243 B C H <>S+ 0 0 0 -4,-1.9 5,-2.3 -3,-0.3 -2,-0.2 0.882 112.3 45.4 -73.8 -39.9 1.7 -24.8 48.2 594 244 B I H ><5S+ 0 0 0 -4,-2.2 3,-1.6 3,-0.2 -2,-0.2 0.953 111.8 52.8 -66.8 -49.2 1.1 -23.5 51.7 595 245 B R H 3<5S+ 0 0 143 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.931 118.3 35.5 -50.2 -53.7 -1.2 -26.4 52.5 596 246 B E T 3<5S- 0 0 104 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.261 104.8-126.3 -87.6 11.7 1.5 -29.0 51.4 597 247 B R T < 5 + 0 0 117 -3,-1.6 2,-1.5 1,-0.2 -3,-0.2 0.860 48.7 165.4 43.3 42.0 4.4 -26.9 52.7 598 248 B D >< + 0 0 40 -5,-2.3 4,-2.4 1,-0.2 3,-0.4 -0.664 11.1 179.9 -89.3 84.1 5.9 -27.2 49.2 599 249 B F H > S+ 0 0 8 -2,-1.5 4,-3.4 1,-0.2 5,-0.3 0.931 72.3 52.9 -53.0 -61.1 8.5 -24.5 49.5 600 250 B P H > S+ 0 0 42 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.835 116.1 42.0 -47.6 -36.0 10.2 -24.6 46.0 601 251 B S H > S+ 0 0 37 -3,-0.4 4,-2.2 2,-0.2 5,-0.3 0.877 114.4 51.1 -77.5 -38.9 6.7 -24.3 44.4 602 252 B F H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.875 112.6 48.6 -62.2 -37.2 5.7 -21.6 46.9 603 253 B A H X S+ 0 0 0 -4,-3.4 4,-2.4 -5,-0.2 49,-0.2 0.917 110.8 46.9 -70.9 -47.9 8.9 -19.8 46.1 604 254 B Q H X S+ 0 0 61 -4,-2.0 4,-2.9 -5,-0.3 5,-0.2 0.929 113.7 48.0 -62.0 -46.2 8.7 -19.9 42.3 605 255 B L H X S+ 0 0 7 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.925 110.5 52.6 -60.3 -45.8 5.1 -18.7 42.3 606 256 B T H X S+ 0 0 0 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.2 0.931 113.4 43.9 -56.6 -46.2 5.9 -15.9 44.7 607 257 B M H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.891 112.1 51.8 -66.7 -41.7 8.7 -14.7 42.5 608 258 B K H X S+ 0 0 67 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.899 112.7 46.0 -63.7 -37.5 6.7 -15.1 39.3 609 259 B D H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.849 109.3 52.7 -76.2 -31.4 3.9 -13.0 40.8 610 260 B S H X S+ 0 0 0 -4,-2.0 4,-2.1 42,-0.3 -2,-0.2 0.953 112.8 47.8 -64.2 -44.0 6.2 -10.3 42.2 611 261 B N H X S+ 0 0 1 -4,-2.4 4,-1.3 1,-0.2 -2,-0.2 0.844 110.3 49.6 -64.4 -36.9 7.6 -10.1 38.6 612 262 B Q H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.873 107.7 55.4 -71.6 -35.9 4.2 -9.9 37.0 613 263 B F H X S+ 0 0 5 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.970 111.6 43.0 -58.8 -51.8 3.1 -7.2 39.4 614 264 B H H X S+ 0 0 6 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.755 109.8 59.3 -67.3 -22.5 6.1 -5.1 38.4 615 265 B A H X S+ 0 0 0 -4,-1.3 4,-1.7 2,-0.2 -1,-0.2 0.932 105.2 46.8 -70.7 -46.1 5.5 -6.0 34.7 616 266 B T H < S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.773 108.3 58.2 -67.5 -23.2 2.0 -4.5 34.7 617 267 B C H >< S+ 0 0 1 -4,-1.3 7,-2.4 -5,-0.2 3,-0.9 0.884 108.9 43.8 -69.5 -40.0 3.4 -1.4 36.4 618 268 B L H 3< S+ 0 0 11 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.764 107.2 59.8 -75.3 -24.6 5.8 -1.0 33.5 619 269 B D T 3< S+ 0 0 7 -4,-1.7 -1,-0.2 -378,-0.1 -2,-0.2 0.429 89.3 103.0 -80.8 0.9 2.9 -1.7 31.1 620 270 B T S < S- 0 0 1 -3,-0.9 -52,-0.1 -5,-0.2 -48,-0.1 -0.481 82.1-100.3 -82.6 154.4 1.2 1.4 32.7 621 271 B F S S+ 0 0 39 -54,-0.4 -2,-0.1 -2,-0.1 -3,-0.0 -0.951 117.9 22.1-127.9 114.5 1.2 4.7 30.9 622 272 B P S S- 0 0 68 0, 0.0 -51,-0.1 0, 0.0 2,-0.1 0.629 117.6-114.3 -65.3 164.5 3.2 6.5 31.8 623 273 B P - 0 0 6 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.388 22.8-139.4 -71.6 149.9 5.2 3.6 33.1 624 274 B I - 0 0 16 -7,-2.4 2,-0.5 -10,-0.1 -4,-0.2 -0.909 13.2-160.8-110.4 137.8 5.8 3.1 36.9 625 275 B S + 0 0 18 -2,-0.4 -66,-0.2 1,-0.1 -11,-0.0 -0.955 27.4 150.8-126.9 118.0 9.1 1.9 38.3 626 276 B Y + 0 0 3 -2,-0.5 2,-0.3 31,-0.1 -1,-0.1 0.732 55.0 80.9-110.6 -35.3 9.7 0.4 41.7 627 277 B L - 0 0 14 -13,-0.1 2,-0.2 27,-0.1 32,-0.1 -0.572 60.7-171.1 -77.1 131.9 12.6 -1.9 41.3 628 278 B N > - 0 0 26 -2,-0.3 4,-1.9 30,-0.2 3,-0.2 -0.528 42.8 -81.0-111.9-174.3 16.0 -0.3 41.4 629 279 B A H > S+ 0 0 64 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.846 129.7 49.9 -55.7 -41.4 19.6 -1.5 40.6 630 280 B I H > S+ 0 0 16 -77,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.868 106.1 58.8 -66.6 -35.5 20.0 -3.1 44.1 631 281 B S H > S+ 0 0 0 1,-0.2 4,-2.4 -3,-0.2 -2,-0.2 0.946 107.9 45.3 -57.0 -49.4 16.6 -4.8 43.6 632 282 B W H X S+ 0 0 30 -4,-1.9 4,-2.9 2,-0.2 -1,-0.2 0.857 109.1 54.3 -65.3 -36.0 17.9 -6.5 40.4 633 283 B R H X S+ 0 0 83 -4,-1.8 4,-3.0 2,-0.2 -1,-0.2 0.927 110.2 48.2 -63.8 -42.3 21.2 -7.5 42.0 634 284 B I H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.926 110.9 51.0 -63.0 -43.6 19.3 -9.2 44.8 635 285 B I H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.957 112.8 45.0 -57.6 -50.6 17.0 -10.9 42.2 636 286 B H H X S+ 0 0 50 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.912 110.1 56.3 -59.4 -42.2 20.1 -12.2 40.3 637 287 B L H X S+ 0 0 1 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.903 106.9 49.8 -54.8 -45.6 21.7 -13.2 43.6 638 288 B V H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.917 111.6 45.7 -61.2 -48.6 18.6 -15.4 44.4 639 289 B H H X S+ 0 0 29 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.873 114.5 49.1 -64.7 -36.7 18.5 -17.2 41.1 640 290 B R H X S+ 0 0 98 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.906 110.1 50.8 -68.3 -43.1 22.3 -17.8 41.2 641 291 B F H X S+ 0 0 0 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.942 113.5 45.2 -58.9 -50.6 22.1 -19.1 44.8 642 292 B N H X>S+ 0 0 12 -4,-2.5 5,-1.9 1,-0.2 4,-1.2 0.911 112.0 52.4 -60.8 -43.7 19.3 -21.5 43.8 643 293 B A H <5S+ 0 0 76 -4,-2.4 3,-0.3 1,-0.2 -1,-0.2 0.886 107.3 52.2 -61.7 -39.0 21.2 -22.5 40.6 644 294 B H H <5S+ 0 0 71 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.910 115.0 41.4 -64.1 -40.8 24.3 -23.3 42.7 645 295 B H H <5S- 0 0 61 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.556 106.6-126.5 -83.7 -8.7 22.4 -25.6 45.0 646 296 B G T <5S+ 0 0 67 -4,-1.2 2,-0.3 -3,-0.3 -3,-0.2 0.891 80.0 69.9 64.8 40.6 20.3 -27.1 42.2 647 297 B D S > -Y 545 0J 43 -16,-0.6 3,-1.7 -2,-0.3 4,-0.6 -0.399 41.1-108.3 -76.4 159.0 13.4 -22.1 55.1 666 316 B D H >> S+ 0 0 79 -122,-1.4 3,-1.0 1,-0.3 4,-0.5 0.857 114.0 60.5 -54.1 -41.1 15.1 -21.8 58.5 667 317 B D H 34 S+ 0 0 122 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.557 109.6 41.7 -69.2 -6.4 17.9 -24.1 57.6 668 318 B T H <> S+ 0 0 4 -3,-1.7 4,-2.1 -19,-0.1 -1,-0.2 0.433 86.7 88.8-120.4 2.4 19.1 -21.9 54.8 669 319 B V H S+ 0 0 51 26,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.902 115.9 48.5 -66.2 -40.2 23.9 -19.1 54.4 672 322 B F H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.896 109.2 52.9 -69.5 -36.0 21.7 -16.7 52.5 673 323 B V H X S+ 0 0 0 -4,-3.6 4,-2.5 1,-0.2 -1,-0.2 0.944 109.4 49.7 -61.9 -43.1 22.4 -13.9 55.0 674 324 B A H X S+ 0 0 8 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.825 107.8 54.8 -63.2 -31.0 26.1 -14.5 54.5 675 325 B A H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.912 109.6 45.7 -69.5 -41.1 25.5 -14.3 50.7 676 326 B V H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.912 110.1 54.0 -66.9 -42.3 23.8 -10.9 51.0 677 327 B W H < S+ 0 0 77 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.922 112.1 45.0 -56.8 -45.1 26.5 -9.7 53.3 678 328 B H H < S+ 0 0 64 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.807 115.0 47.4 -69.9 -31.7 29.1 -10.7 50.7 679 329 B G H < S+ 0 0 0 -4,-1.8 34,-1.4 1,-0.3 -2,-0.2 0.841 130.0 20.9 -78.0 -33.0 27.1 -9.2 47.9 680 330 B F S < S- 0 0 0 -4,-3.0 -1,-0.3 32,-0.2 37,-0.2 -0.706 83.4-152.2-135.9 79.9 26.5 -5.9 49.7 681 331 B P - 0 0 41 0, 0.0 34,-1.5 0, 0.0 35,-0.1 -0.398 4.7-148.8 -63.1 120.5 29.1 -5.4 52.5 682 332 B P - 0 0 30 0, 0.0 6,-0.1 0, 0.0 5,-0.1 0.606 28.6-137.9 -60.8 -23.6 27.6 -3.2 55.3 683 333 B G S > S+ 0 0 43 1,-0.1 3,-1.0 3,-0.1 4,-0.4 0.292 81.9 61.8 73.1 152.0 30.8 -1.5 56.5 684 334 B S G > S- 0 0 89 1,-0.3 3,-1.2 2,-0.2 -1,-0.1 0.842 134.9 -70.8 60.4 33.0 31.8 -0.9 60.1 685 335 B N G 3 S- 0 0 142 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.842 78.0 -79.5 50.6 39.4 31.8 -4.7 60.2 686 336 B G G X S+ 0 0 10 -3,-1.0 3,-1.4 1,-0.1 4,-0.4 0.810 70.7 168.1 38.8 50.3 28.0 -4.6 59.9 687 337 B D T < S+ 0 0 135 -3,-1.2 -1,-0.1 -4,-0.4 3,-0.1 0.806 83.6 23.3 -58.7 -32.5 27.5 -3.8 63.6 688 338 B T T 3 S+ 0 0 96 30,-0.1 -1,-0.3 1,-0.1 -2,-0.1 -0.113 94.5 107.3-125.4 34.3 23.9 -2.9 63.0 689 339 B F < + 0 0 2 -3,-1.4 31,-3.5 30,-0.1 2,-0.5 0.810 69.7 57.7 -83.0 -33.9 23.3 -4.9 59.8 690 340 B L E +b 720 0J 51 -4,-0.4 2,-0.3 29,-0.2 31,-0.2 -0.883 65.3 174.8-108.4 124.8 21.2 -7.8 61.2 691 341 B K E +b 721 0J 90 29,-3.5 31,-2.5 -2,-0.5 2,-0.2 -0.778 42.2 14.4-124.3 165.9 17.9 -7.1 63.0 692 342 B G E S+b 722 0J 45 -2,-0.3 31,-0.2 29,-0.2 3,-0.1 -0.501 109.4 33.7 77.4-142.0 15.0 -9.1 64.5 693 343 B L S S- 0 0 46 29,-3.1 29,-0.1 -2,-0.2 2,-0.1 -0.264 95.0-112.3 -50.7 124.5 15.4 -12.9 65.1 694 344 B Q + 0 0 198 -4,-0.0 2,-0.3 2,-0.0 -1,-0.1 -0.361 49.5 160.0 -63.6 137.8 19.1 -13.4 66.0 695 345 B V - 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0 0 68 -3,-0.5 3,-0.1 -4,-0.3 -359,-0.1 -0.145 57.6-145.0 -48.0 127.6 -1.0 2.5 77.0 739 389 B L S S+ 0 0 41 -274,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.633 87.2 31.5 -69.5 -14.3 0.4 5.0 74.6 740 390 B L - 0 0 6 6,-0.2 -1,-0.2 -275,-0.1 -275,-0.1 -0.976 69.0-154.4-148.4 132.0 -1.6 7.7 76.4 741 391 B G S S- 0 0 42 4,-0.6 2,-0.7 -2,-0.3 -1,-0.1 0.429 73.3 -38.8 -76.3-139.3 -2.6 8.2 80.0 742 392 B P S S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 -319,-0.0 -0.037 142.0 26.4 -80.0 38.5 -5.6 10.3 81.0 743 393 B D S S- 0 0 121 -2,-0.7 -3,-0.1 2,-0.1 -318,-0.0 0.202 109.0 -89.2-153.4 -76.3 -4.7 12.8 78.2 744 394 B G S S+ 0 0 9 1,-0.1 -4,-0.1 -5,-0.1 -280,-0.0 0.443 79.8 104.4 151.6 32.8 -2.7 11.7 75.1 745 395 B L 0 0 120 -280,-0.0 -4,-0.6 0, 0.0 -2,-0.1 -0.691 360.0 360.0-124.6 177.2 1.0 12.1 75.8 746 396 B P 0 0 169 0, 0.0 -6,-0.2 0, 0.0 -7,-0.1 -0.354 360.0 360.0 -59.0 360.0 4.0 9.7 76.6