==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 31-MAR-06 2CJF . COMPND 2 MOLECULE: 3-DEHYDROQUINATE DEHYDRATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR; . AUTHOR R.J.PAYNE,A.RIBOLDI-TUNNICLIFFE,A.D.ABELL,A.J.LAPTHORN, . 1788 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 56380.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1324 74.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 246 13.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 1.3 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 . 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 . 2 0.1 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 . 93 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 304 17.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 556 31.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 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 11 0 0 2 7 3 0 0 1 16 19 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 12 18 18 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 6 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 6 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 2 A R 0 0 172 0, 0.0 2,-0.1 0, 0.0 70,-0.1 0.000 360.0 360.0 360.0 123.4 154.3 95.5 20.5 2 3 A S > - 0 0 44 1,-0.1 4,-0.8 46,-0.0 3,-0.3 -0.400 360.0 -97.6 -92.7 171.7 151.9 95.1 17.6 3 4 A L T 4 S+ 0 0 15 1,-0.2 46,-0.3 2,-0.2 5,-0.1 0.660 117.4 62.2 -63.1 -18.1 150.4 97.8 15.2 4 5 A A T 4 S+ 0 0 89 1,-0.2 -1,-0.2 44,-0.1 145,-0.0 0.962 114.4 27.0 -74.8 -50.5 147.2 97.9 17.3 5 6 A N T 4 S+ 0 0 100 -3,-0.3 -2,-0.2 1,-0.1 -1,-0.2 0.325 124.6 38.7 -95.6 1.0 148.7 99.1 20.6 6 7 A A S < S- 0 0 5 -4,-0.8 43,-0.3 43,-0.0 66,-0.1 -0.967 70.4-123.6-158.6 136.8 151.7 101.0 19.3 7 8 A P - 0 0 34 0, 0.0 66,-1.4 0, 0.0 67,-0.4 -0.446 31.6-114.3 -73.7 148.4 152.9 103.3 16.5 8 9 A I E -a 50 0A 0 41,-2.1 43,-2.6 64,-0.2 2,-0.5 -0.686 31.4-128.5 -72.2 134.3 155.9 102.5 14.3 9 10 A M E -ab 51 75A 0 65,-2.4 67,-2.4 -2,-0.3 2,-0.5 -0.814 19.2-161.4 -90.5 128.6 158.7 105.0 14.9 10 11 A I E -ab 52 76A 0 41,-2.0 43,-3.2 -2,-0.5 2,-0.4 -0.965 10.3-163.3-111.4 117.0 159.9 106.6 11.7 11 12 A L E -ab 53 77A 0 65,-2.6 67,-2.5 -2,-0.5 2,-0.5 -0.837 4.0-164.6-111.8 128.8 163.4 108.1 12.2 12 13 A N E -ab 54 78A 0 41,-0.6 43,-3.7 -2,-0.4 3,-0.1 -0.974 8.8-148.3-125.5 126.1 164.9 110.6 9.8 13 14 A G > - 0 0 0 65,-3.1 3,-1.2 -2,-0.5 4,-0.2 0.140 42.6 -36.1 -85.3-166.5 168.5 111.6 9.8 14 15 A P T 3 S+ 0 0 0 0, 0.0 67,-0.4 0, 0.0 -1,-0.2 -0.046 116.7 6.3 -59.2 151.1 170.4 114.8 8.9 15 16 A N T > S+ 0 0 17 1,-0.1 3,-2.0 -3,-0.1 41,-0.1 0.146 88.4 113.0 71.0 -16.7 169.4 117.2 6.1 16 17 A L G X + 0 0 18 -3,-1.2 3,-1.7 1,-0.3 16,-0.2 0.682 58.2 80.2 -72.6 -7.8 166.1 115.5 5.3 17 18 A N G 3 S+ 0 0 63 1,-0.3 -1,-0.3 -4,-0.2 15,-0.2 0.687 93.9 52.4 -60.1 -11.5 164.2 118.5 6.6 18 19 A L G X> S+ 0 0 16 -3,-2.0 3,-1.4 13,-0.1 4,-0.6 0.266 73.8 133.8-118.9 1.2 165.0 119.9 3.3 19 20 A L T <4 S+ 0 0 13 -3,-1.7 13,-0.6 1,-0.2 10,-0.1 -0.336 72.0 32.3 -53.1 136.2 163.7 117.2 1.1 20 21 A G T 34 S+ 0 0 19 8,-0.5 -1,-0.2 2,-0.4 11,-0.1 -0.347 100.5 85.3 100.3 -46.6 161.7 118.8 -1.7 21 22 A Q T <4 S+ 0 0 116 -3,-1.4 2,-0.3 1,-0.1 -2,-0.2 0.855 97.0 6.1 -60.3 -42.1 163.9 121.9 -1.8 22 23 A R S < S+ 0 0 67 -4,-0.6 -2,-0.4 1,-0.1 5,-0.2 -0.948 107.0 23.8-144.4 166.7 166.6 120.5 -4.1 23 24 A Q >> + 0 0 33 -2,-0.3 4,-2.6 1,-0.1 3,-2.4 0.807 50.4 166.4 60.7 42.3 167.9 117.8 -6.4 24 25 A P T 34 S+ 0 0 72 0, 0.0 4,-0.3 0, 0.0 5,-0.2 0.687 74.1 66.1 -64.1 -17.8 164.6 116.1 -7.4 25 26 A E T 34 S+ 0 0 148 3,-0.1 -2,-0.1 1,-0.1 4,-0.0 0.775 118.8 26.4 -68.1 -20.8 166.3 114.2 -10.2 26 27 A I T <4 S+ 0 0 62 -3,-2.4 82,-0.2 2,-0.1 -1,-0.1 0.760 141.7 15.5-106.7 -36.2 168.1 112.5 -7.2 27 28 A Y S < S- 0 0 57 -4,-2.6 3,-0.1 -5,-0.2 107,-0.1 0.485 104.0-113.4-124.1 -12.0 165.7 112.7 -4.2 28 29 A G - 0 0 25 -5,-0.5 -8,-0.5 -4,-0.3 -3,-0.1 -0.006 24.3 -84.5 94.8 164.1 162.3 113.6 -5.7 29 30 A S S S+ 0 0 91 -5,-0.2 -1,-0.1 -10,-0.1 2,-0.1 0.605 90.7 98.2 -84.4 -13.1 159.8 116.5 -5.6 30 31 A D - 0 0 66 -3,-0.1 2,-0.1 -6,-0.1 -9,-0.1 -0.393 64.7-132.3 -82.7 154.2 158.0 115.6 -2.3 31 32 A T > - 0 0 56 -11,-0.1 4,-2.3 -2,-0.1 -11,-0.2 -0.361 28.1-103.1 -95.3 177.1 158.8 117.1 1.1 32 33 A L H > S+ 0 0 18 -13,-0.6 4,-3.9 2,-0.2 5,-0.3 0.922 125.5 53.6 -70.2 -39.7 159.2 115.5 4.5 33 34 A A H > S+ 0 0 63 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.899 109.4 50.4 -55.4 -39.5 155.7 116.6 5.5 34 35 A D H > S+ 0 0 71 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.910 112.1 45.5 -61.7 -47.3 154.7 114.8 2.3 35 36 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.945 111.4 51.7 -60.8 -53.3 156.7 111.7 3.3 36 37 A E H X S+ 0 0 82 -4,-3.9 4,-2.3 1,-0.2 3,-0.4 0.948 106.8 56.3 -47.4 -45.9 155.2 111.8 6.8 37 38 A A H X S+ 0 0 56 -4,-2.3 4,-2.1 1,-0.3 -2,-0.2 0.907 107.3 47.4 -57.6 -49.0 151.8 112.0 5.1 38 39 A L H X S+ 0 0 58 -4,-2.0 4,-2.5 2,-0.2 -1,-0.3 0.843 109.4 53.6 -51.9 -40.4 152.5 108.7 3.2 39 40 A C H X S+ 0 0 0 -4,-2.2 4,-3.1 -3,-0.4 5,-0.2 0.958 108.2 48.2 -69.9 -48.5 153.7 107.0 6.3 40 41 A V H X S+ 0 0 78 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.911 114.7 49.2 -47.4 -48.5 150.4 107.9 8.2 41 42 A K H X S+ 0 0 160 -4,-2.1 4,-1.7 -5,-0.3 -2,-0.2 0.837 111.9 45.7 -65.4 -39.7 148.5 106.6 5.2 42 43 A A H X S+ 0 0 8 -4,-2.5 4,-1.0 2,-0.2 -2,-0.2 0.891 115.4 45.9 -74.9 -40.5 150.4 103.4 4.9 43 44 A A H ><>S+ 0 0 0 -4,-3.1 5,-3.1 -5,-0.2 3,-1.4 0.963 109.0 56.3 -63.4 -48.1 150.2 102.6 8.6 44 45 A A H ><5S+ 0 0 60 -4,-2.9 3,-2.4 1,-0.3 -2,-0.2 0.907 102.0 58.8 -42.6 -51.6 146.5 103.6 8.7 45 46 A A H 3<5S+ 0 0 75 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.780 108.4 42.6 -57.1 -30.8 146.0 101.0 6.0 46 47 A H T <<5S- 0 0 91 -3,-1.4 -1,-0.3 -4,-1.0 -2,-0.2 0.212 124.2-100.0-105.0 26.9 147.3 98.2 8.2 47 48 A G T < 5S+ 0 0 58 -3,-2.4 -3,-0.2 1,-0.2 2,-0.2 0.725 88.5 115.8 69.8 23.5 145.4 99.4 11.2 48 49 A G < - 0 0 5 -5,-3.1 2,-0.3 -6,-0.2 -1,-0.2 -0.635 54.0-141.8-117.0 169.0 148.6 101.1 12.6 49 50 A T - 0 0 86 -46,-0.3 -41,-2.1 -43,-0.3 2,-0.3 -0.896 14.8-141.3-123.4 163.9 149.8 104.6 13.4 50 51 A V E -a 8 0A 22 -2,-0.3 2,-0.5 -43,-0.3 -41,-0.2 -0.895 7.1-149.0-124.4 156.8 153.3 106.1 13.0 51 52 A D E -a 9 0A 41 -43,-2.6 -41,-2.0 -2,-0.3 2,-0.4 -0.918 28.4-160.0-125.3 96.4 155.4 108.5 15.1 52 53 A F E +a 10 0A 25 -2,-0.5 2,-0.3 -43,-0.2 -41,-0.2 -0.689 16.4 168.3 -98.7 123.7 157.4 110.4 12.5 53 54 A R E -a 11 0A 47 -43,-3.2 -41,-0.6 -2,-0.4 2,-0.3 -0.939 19.4-163.6-132.1 150.0 160.6 112.3 13.5 54 55 A Q E +a 12 0A 48 -2,-0.3 2,-0.3 -43,-0.2 -41,-0.2 -0.990 14.6 173.1-127.0 133.1 163.6 114.0 11.8 55 56 A S - 0 0 3 -43,-3.7 -39,-0.2 -2,-0.3 -2,-0.0 -0.998 30.1-163.1-134.6 145.8 166.9 114.9 13.5 56 57 A N S S+ 0 0 8 -2,-0.3 2,-0.5 -42,-0.2 156,-0.2 0.431 76.3 89.7 -90.2 -6.5 170.3 116.3 12.3 57 58 A H > - 0 0 41 1,-0.1 4,-1.9 152,-0.1 3,-0.4 -0.865 65.9-153.6-103.4 123.6 171.8 115.2 15.6 58 59 A E H > S+ 0 0 13 -2,-0.5 4,-2.2 1,-0.2 -1,-0.1 0.875 94.7 47.2 -59.7 -50.7 173.3 111.7 16.0 59 60 A G H > S+ 0 0 2 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.717 109.6 57.5 -68.5 -16.4 172.8 111.2 19.8 60 61 A E H > S+ 0 0 64 -3,-0.4 4,-2.5 2,-0.2 3,-0.3 0.977 106.3 46.2 -74.3 -62.7 169.2 112.5 19.4 61 62 A L H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.869 112.3 52.6 -36.4 -53.3 168.4 109.8 17.0 62 63 A V H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.892 107.8 51.6 -54.1 -44.4 170.1 107.4 19.4 63 64 A D H X S+ 0 0 62 -4,-1.6 4,-1.6 -3,-0.3 -2,-0.2 0.951 110.4 48.8 -57.5 -42.9 167.9 108.8 22.2 64 65 A W H X S+ 0 0 46 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.710 107.7 53.5 -76.1 -24.9 164.7 108.1 19.9 65 66 A I H X S+ 0 0 0 -4,-1.8 4,-3.1 2,-0.2 -1,-0.2 0.902 107.7 50.2 -69.3 -47.0 165.8 104.6 19.1 66 67 A H H < S+ 0 0 15 -4,-1.9 4,-0.4 1,-0.2 -2,-0.2 0.890 114.7 46.7 -58.3 -34.2 166.1 103.8 22.9 67 68 A E H >X S+ 0 0 63 -4,-1.6 3,-1.1 2,-0.2 4,-0.6 0.891 110.7 48.5 -71.5 -45.2 162.6 105.3 23.2 68 69 A A H >X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 3,-0.8 0.837 99.5 74.0 -60.7 -32.5 161.2 103.4 20.3 69 70 A R H 3< S+ 0 0 48 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.800 112.9 19.5 -48.4 -33.2 162.9 100.5 22.0 70 71 A L H <4 S+ 0 0 99 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.2 0.412 130.2 41.1-120.9 5.9 160.1 100.4 24.7 71 72 A N H << S+ 0 0 80 -3,-0.8 2,-0.3 -4,-0.6 -3,-0.2 0.345 100.7 62.6-143.6 -6.9 157.2 102.3 23.2 72 73 A H < - 0 0 10 -4,-1.6 -64,-0.2 -66,-0.1 3,-0.1 -0.851 65.6-131.9-130.0 167.6 156.8 101.3 19.6 73 74 A C S S- 0 0 1 -66,-1.4 2,-0.3 -2,-0.3 -65,-0.2 0.425 84.3 -22.7 -95.6 -5.6 156.1 98.2 17.4 74 75 A G - 0 0 0 -67,-0.4 -65,-2.4 25,-0.2 2,-0.4 -0.947 61.1-114.8 173.9 171.0 159.0 98.7 14.9 75 76 A I E -bc 9 101A 0 25,-2.9 27,-2.8 -2,-0.3 2,-0.4 -1.000 13.1-170.6-133.5 137.2 161.3 101.2 13.4 76 77 A V E -bc 10 102A 0 -67,-2.4 -65,-2.6 -2,-0.4 2,-0.4 -0.995 22.8-172.4-114.9 129.3 161.7 102.5 9.9 77 78 A I E -bc 11 103A 0 25,-2.6 27,-3.3 -2,-0.4 -65,-0.2 -0.980 33.9-177.1-132.3 138.2 164.8 104.7 9.4 78 79 A N E +b 12 0A 7 -67,-2.5 -65,-3.1 -2,-0.4 3,-0.1 -0.939 16.4 174.9-116.5 94.4 166.5 106.9 6.8 79 80 A P > - 0 0 0 0, 0.0 3,-2.0 0, 0.0 4,-0.1 0.560 19.0-172.6 -80.7 -3.7 169.6 107.7 8.8 80 81 A A G > + 0 0 21 24,-0.4 3,-2.4 1,-0.3 4,-0.3 -0.244 68.2 4.4 46.4-124.7 170.7 109.4 5.6 81 82 A A G > S+ 0 0 2 -67,-0.4 3,-1.9 1,-0.3 4,-0.4 0.832 126.9 64.5 -66.1 -28.6 174.3 110.5 6.1 82 83 A Y G X> S+ 0 0 1 -3,-2.0 4,-2.1 1,-0.3 3,-0.6 0.638 82.9 78.0 -74.4 -5.7 174.7 108.8 9.4 83 84 A S G <4 S+ 0 0 0 -3,-2.4 37,-2.6 1,-0.2 38,-0.4 0.787 101.8 40.6 -60.7 -26.8 174.1 105.4 7.7 84 85 A H G <4 S+ 0 0 20 -3,-1.9 -1,-0.2 -4,-0.3 -2,-0.2 0.572 127.6 26.9-103.5 -1.6 177.7 105.7 6.6 85 86 A T T <4 S+ 0 0 20 -3,-0.6 2,-1.1 -4,-0.4 3,-0.2 0.498 94.2 94.5-134.2 -25.2 179.4 107.1 9.7 86 87 A S X + 0 0 0 -4,-2.1 4,-1.2 1,-0.2 -1,-0.1 -0.696 22.5 157.8 -96.2 97.2 177.3 106.0 12.7 87 88 A V H > S+ 0 0 0 -2,-1.1 4,-2.7 294,-0.2 -1,-0.2 0.718 81.1 65.4 -70.9 -24.3 178.3 102.8 14.5 88 89 A A H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.842 101.0 45.8 -71.9 -32.2 176.4 104.4 17.5 89 90 A I H > S+ 0 0 0 2,-0.2 4,-3.2 -7,-0.2 5,-0.2 0.900 112.0 52.3 -73.8 -45.7 173.0 104.2 15.7 90 91 A L H X S+ 0 0 4 -4,-1.2 4,-2.7 2,-0.2 -2,-0.2 0.971 113.4 44.1 -48.3 -49.9 173.9 100.6 14.6 91 92 A D H X S+ 0 0 20 -4,-2.7 4,-1.3 1,-0.2 3,-0.2 0.962 111.0 53.9 -69.9 -43.6 174.6 99.8 18.3 92 93 A A H >X S+ 0 0 0 -4,-2.9 3,-0.7 1,-0.2 4,-0.6 0.915 111.0 47.3 -45.7 -50.8 171.5 101.7 19.4 93 94 A L H >< S+ 0 0 0 -4,-3.2 3,-0.6 1,-0.3 -1,-0.2 0.788 103.7 61.0 -68.7 -30.0 169.6 99.5 17.0 94 95 A N H 3< S+ 0 0 30 -4,-2.7 -1,-0.3 -3,-0.2 -2,-0.2 0.816 95.2 62.3 -59.5 -31.0 171.3 96.4 18.3 95 96 A T H << S+ 0 0 17 -4,-1.3 2,-2.2 -3,-0.7 -1,-0.2 0.784 83.9 85.5 -68.6 -21.5 169.9 97.0 21.8 96 97 A C X< - 0 0 2 -3,-0.6 3,-0.8 -4,-0.6 2,-0.2 -0.480 67.2-172.8 -81.0 72.3 166.4 96.6 20.3 97 98 A D T 3 S+ 0 0 95 -2,-2.2 -2,-0.1 1,-0.2 -3,-0.0 -0.515 71.2 7.9 -63.2 132.4 166.1 92.8 20.5 98 99 A G T 3 S+ 0 0 83 1,-0.2 -1,-0.2 -2,-0.2 -2,-0.1 0.210 95.0 126.5 86.2 -15.6 162.9 91.5 18.8 99 100 A L < - 0 0 19 -3,-0.8 2,-0.4 -6,-0.1 -1,-0.2 -0.622 64.0-122.3 -80.6 126.0 162.0 94.9 17.3 100 101 A P - 0 0 15 0, 0.0 -25,-2.9 0, 0.0 2,-0.5 -0.587 32.0-167.7 -73.0 125.2 161.4 94.9 13.5 101 102 A V E -c 75 0A 0 -2,-0.4 25,-2.3 23,-0.2 26,-1.4 -0.943 11.2-178.8-120.1 116.8 163.8 97.4 11.8 102 103 A V E -cd 76 127A 0 -27,-2.8 -25,-2.6 -2,-0.5 2,-0.3 -0.951 10.9-157.6-115.8 130.8 163.6 98.5 8.3 103 104 A E E -cd 77 128A 0 24,-2.3 26,-2.4 -2,-0.5 2,-0.4 -0.765 12.0-168.9-102.8 143.5 166.1 101.0 6.9 104 105 A V E - d 0 129A 0 -27,-3.3 2,-0.4 -2,-0.3 -24,-0.4 -0.994 15.0-176.5-138.4 136.5 165.2 103.1 3.8 105 106 A H E - d 0 130A 6 24,-2.0 26,-0.9 -2,-0.4 27,-0.6 -0.989 17.3-152.2-127.2 136.0 167.1 105.3 1.5 106 107 A I S S+ 0 0 10 -2,-0.4 27,-1.4 24,-0.2 2,-0.1 0.862 81.8 59.2 -68.0 -46.3 165.3 107.2 -1.2 107 108 A S S S- 0 0 14 24,-0.1 2,-1.5 25,-0.1 24,-1.1 -0.471 97.8-108.9 -78.5 151.6 168.4 107.3 -3.6 108 109 A N > - 0 0 10 23,-0.3 3,-2.3 22,-0.2 4,-0.2 -0.678 36.3-168.7 -84.0 97.5 169.9 104.1 -4.8 109 110 A I G > S+ 0 0 7 -2,-1.5 3,-2.1 1,-0.3 -1,-0.2 0.770 78.6 69.1 -60.9 -27.2 173.1 104.5 -2.8 110 111 A H G 3 S+ 0 0 30 1,-0.3 -1,-0.3 -3,-0.1 7,-0.1 0.479 101.1 50.7 -70.8 -3.3 174.9 101.7 -4.6 111 112 A Q G < S+ 0 0 96 -3,-2.3 -1,-0.3 5,-0.1 -2,-0.2 0.249 103.1 78.4-103.5 -2.3 174.9 104.0 -7.6 112 113 A R S < S- 0 0 45 -3,-2.1 5,-0.1 1,-0.3 -3,-0.1 -0.022 99.2 -39.3 -99.1-158.0 176.4 106.9 -5.7 113 114 A E > - 0 0 69 1,-0.1 3,-1.3 3,-0.1 -1,-0.3 -0.333 66.0-111.1 -55.6 151.3 179.8 108.0 -4.4 114 115 A P G > S+ 0 0 107 0, 0.0 3,-0.7 0, 0.0 4,-0.2 0.678 117.6 61.1 -65.6 -17.8 181.7 104.9 -3.2 115 116 A F G > S+ 0 0 40 1,-0.2 3,-0.8 2,-0.1 -2,-0.1 0.739 98.0 61.5 -75.6 -18.7 181.5 106.0 0.5 116 117 A R G < S+ 0 0 7 -3,-1.3 -1,-0.2 1,-0.2 -5,-0.1 0.571 84.2 80.6 -78.3 -8.1 177.7 105.9 0.1 117 118 A H G < S+ 0 0 71 -3,-0.7 2,-0.4 -4,-0.2 -1,-0.2 0.723 84.0 63.0 -76.4 -13.0 177.9 102.2 -0.7 118 119 A H < - 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0 0 7 -4,-1.9 -64,-0.2 -5,-0.2 3,-0.1 -0.744 64.0-133.1-123.3 161.4 214.3 60.2 3.5 1723 2274 L C S S- 0 0 4 -66,-1.8 2,-0.3 -2,-0.2 -65,-0.2 0.495 83.1 -29.0 -90.6 -6.5 212.2 59.5 0.3 1724 2275 L G - 0 0 0 -67,-0.5 -65,-2.3 25,-0.1 2,-0.4 -0.955 61.5-110.0 172.8 177.1 209.6 62.3 0.8 1725 2276 L I E -hi16591751D 0 25,-2.4 27,-2.2 -2,-0.3 2,-0.6 -0.999 10.9-169.3-140.4 136.8 207.8 64.5 3.4 1726 2277 L V E -hi16601752D 0 -67,-2.3 -65,-1.6 -2,-0.4 2,-0.4 -0.980 25.4-176.7-121.4 111.0 204.4 64.8 4.6 1727 2278 L I E -hi16611753D 1 25,-2.5 27,-2.9 -2,-0.6 -65,-0.2 -0.918 29.7-173.4-115.9 134.5 204.1 67.9 6.7 1728 2279 L N E -h 1662 0D 8 -67,-2.2 -65,-3.3 -2,-0.4 -62,-0.1 -0.916 13.5-178.7-106.4 97.7 201.3 69.4 8.7 1729 2280 L P > - 0 0 1 0, 0.0 3,-1.6 0, 0.0 -67,-0.1 0.588 14.5-172.0 -71.9 -11.2 203.0 72.7 9.6 1730 2281 L A G > S+ 0 0 19 24,-0.4 3,-2.3 1,-0.3 4,-0.4 -0.268 71.6 2.7 55.0-135.5 199.9 73.8 11.7 1731 2282 L A G > S+ 0 0 0 -67,-0.4 3,-1.6 1,-0.3 4,-0.3 0.786 129.5 65.0 -46.8 -37.5 200.3 77.5 12.8 1732 2283 L Y G <> S+ 0 0 0 -3,-1.6 4,-2.5 1,-0.3 3,-0.4 0.628 82.3 76.0 -63.0 -19.5 203.7 77.7 10.9 1733 2284 L S G <4 S+ 0 0 0 -3,-2.3 37,-2.8 1,-0.2 38,-0.7 0.905 105.2 35.5 -50.7 -41.2 202.0 77.2 7.6 1734 2285 L H T <4 S+ 0 0 23 -3,-1.6 -1,-0.2 -4,-0.4 -2,-0.2 0.480 129.9 29.7 -97.9 -14.4 200.8 80.8 7.8 1735 2286 L T T 4 S+ 0 0 19 -3,-0.4 2,-0.9 -4,-0.3 -2,-0.2 0.651 93.2 88.0-116.9 -32.6 203.7 82.4 9.5 1736 2287 L S X + 0 0 0 -4,-2.5 4,-1.5 1,-0.2 -1,-0.1 -0.640 28.1 167.2-102.9 99.5 206.9 80.7 8.6 1737 2288 L V H > S+ 0 0 0 -2,-0.9 4,-2.1 -156,-0.2 -1,-0.2 0.688 81.9 63.8 -67.9 -14.8 209.0 81.6 5.6 1738 2289 L A H > S+ 0 0 1 2,-0.2 4,-4.0 1,-0.2 5,-0.2 0.978 99.9 47.9 -81.8 -50.8 211.9 79.5 6.9 1739 2290 L I H > S+ 0 0 0 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.925 112.6 52.0 -50.5 -53.7 210.1 76.2 6.8 1740 2291 L L H X S+ 0 0 2 -4,-1.5 4,-1.3 2,-0.2 -1,-0.3 0.955 112.8 43.6 -40.0 -55.0 209.2 77.1 3.3 1741 2292 L D H >X S+ 0 0 19 -4,-2.1 4,-0.8 1,-0.2 3,-0.6 0.914 111.9 55.5 -67.7 -39.5 212.9 77.9 2.5 1742 2293 L A H >X S+ 0 0 0 -4,-4.0 3,-0.8 1,-0.3 4,-0.5 0.898 109.6 45.3 -51.3 -48.7 213.8 74.7 4.3 1743 2294 L L H 3< S+ 0 0 0 -4,-2.8 3,-0.4 1,-0.3 -1,-0.3 0.705 103.9 61.7 -74.6 -18.0 211.6 72.7 2.1 1744 2295 L N H << S+ 0 0 40 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.673 95.7 64.8 -83.9 -16.7 212.8 74.5 -1.1 1745 2296 L T H << S+ 0 0 13 -3,-0.8 2,-1.6 -4,-0.8 -1,-0.2 0.783 80.3 83.8 -77.2 -24.7 216.2 73.1 -0.3 1746 2297 L C S >< S- 0 0 1 -4,-0.5 3,-1.7 -3,-0.4 2,-0.2 -0.539 79.8-153.5 -69.4 78.6 214.9 69.5 -0.8 1747 2298 L D T 3 - 0 0 92 -2,-1.6 -2,-0.1 1,-0.3 -3,-0.1 -0.332 69.4 -8.5 -73.3 126.2 215.3 69.4 -4.6 1748 2299 L G T 3 S+ 0 0 82 1,-0.3 -1,-0.3 -2,-0.2 -2,-0.0 0.816 98.0 138.5 61.1 28.9 213.1 67.1 -6.5 1749 2300 L L < - 0 0 21 -3,-1.7 2,-0.3 -6,-0.2 -1,-0.3 -0.906 60.0-114.8 -98.5 133.9 211.9 65.6 -3.1 1750 2301 L P - 0 0 14 0, 0.0 -25,-2.4 0, 0.0 2,-0.4 -0.535 36.9-175.6 -69.1 127.9 208.2 64.9 -3.0 1751 2302 L V E -i 1725 0D 0 -2,-0.3 25,-1.5 -27,-0.2 26,-1.2 -0.989 8.6-173.5-126.7 135.3 206.5 67.2 -0.4 1752 2303 L V E -ij17261777D 3 -27,-2.2 -25,-2.5 -2,-0.4 2,-0.4 -1.000 14.2-147.5-129.3 126.7 202.8 67.0 0.5 1753 2304 L E E -ij17271778D 0 24,-3.8 26,-1.9 -2,-0.4 2,-0.4 -0.831 15.4-161.0 -97.7 139.4 201.3 69.5 2.8 1754 2305 L V E + j 01779D 0 -27,-2.9 2,-0.4 -2,-0.4 -24,-0.4 -0.975 16.0 176.8-131.1 118.9 198.5 68.4 5.2 1755 2306 L H E - j 01780D 5 24,-3.3 26,-1.0 -2,-0.4 27,-0.8 -0.978 15.4-159.3-114.8 132.0 195.8 70.3 7.1 1756 2307 L I S S+ 0 0 8 -2,-0.4 27,-1.4 24,-0.2 2,-0.2 0.878 80.6 52.2 -73.8 -42.8 193.2 68.4 9.1 1757 2308 L S S S- 0 0 13 25,-0.1 2,-1.2 24,-0.1 24,-1.0 -0.516 101.2-104.3 -85.4 164.1 190.7 71.3 9.2 1758 2309 L N > - 0 0 12 22,-0.2 3,-1.9 23,-0.2 4,-0.1 -0.770 35.9-167.6 -89.6 101.7 189.6 73.0 6.0 1759 2310 L I G > S+ 0 0 7 -2,-1.2 3,-1.5 1,-0.3 -1,-0.2 0.754 78.4 71.8 -63.3 -22.8 191.7 76.2 6.5 1760 2311 L H G 3 S+ 0 0 28 1,-0.3 -1,-0.3 -1038,-0.1 7,-0.1 0.583 99.9 47.6 -74.2 1.2 189.8 77.9 3.6 1761 2312 L Q G < S+ 0 0 90 -3,-1.9 -1,-0.3 5,-0.1 -2,-0.2 0.295 103.0 74.0-121.0 4.0 186.8 78.1 5.9 1762 2313 L R S < S- 0 0 40 -3,-1.5 5,-0.1 1,-0.3 -3,-0.0 -0.318 99.3 -29.6-100.8-173.7 188.4 79.5 9.0 1763 2314 L E > - 0 0 72 1,-0.1 3,-1.4 -2,-0.1 -1,-0.3 -0.051 64.1-115.1 -20.5 124.9 189.9 82.8 10.1 1764 2315 L P G > S+ 0 0 96 0, 0.0 3,-0.8 0, 0.0 4,-0.3 0.713 116.8 63.2 -50.9 -21.7 191.2 84.8 7.1 1765 2316 L F G > S+ 0 0 35 1,-0.2 3,-0.8 2,-0.1 -2,-0.1 0.891 98.0 55.6 -71.2 -30.1 194.7 84.5 8.6 1766 2317 L R G < S+ 0 0 14 -3,-1.4 -1,-0.2 1,-0.2 -5,-0.1 0.455 87.5 81.5 -81.3 6.5 194.5 80.7 8.2 1767 2318 L H G < S+ 0 0 60 -3,-0.8 2,-0.4 -4,-0.3 -1,-0.2 0.849 83.1 65.2 -75.5 -32.9 193.7 80.9 4.5 1768 2319 L H < - 0 0 126 -3,-0.8 2,-0.4 -4,-0.3 3,-0.1 -0.801 56.7-178.5-103.5 129.5 197.4 81.4 3.4 1769 2320 L S - 0 0 9 -2,-0.4 -35,-0.2 1,-0.1 4,-0.2 -1.000 18.8-161.9-121.8 125.8 200.2 78.9 3.7 1770 2321 L Y S >> S+ 0 0 59 -37,-2.8 3,-2.1 -2,-0.4 4,-0.6 0.855 93.8 65.3 -66.4 -38.4 203.7 79.6 2.7 1771 2322 L V H >> S+ 0 0 0 -38,-0.7 4,-2.9 1,-0.3 3,-1.3 0.833 90.7 65.8 -63.2 -27.1 204.3 75.8 2.7 1772 2323 L S H 34 S+ 0 0 4 1,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.669 87.3 68.4 -64.0 -21.2 201.8 75.6 -0.2 1773 2324 L Q H <4 S+ 0 0 70 -3,-2.1 -1,-0.3 -4,-0.2 -2,-0.2 0.787 119.1 19.5 -64.9 -29.3 204.2 77.6 -2.4 1774 2325 L R H << S+ 0 0 27 -3,-1.3 -2,-0.2 -4,-0.6 -23,-0.2 0.751 94.4 101.5-105.4 -37.5 206.6 74.6 -2.3 1775 2326 L A < - 0 0 0 -4,-2.9 -23,-0.2 1,-0.2 3,-0.1 -0.265 70.0-136.2 -60.2 140.0 204.7 71.5 -1.3 1776 2327 L D S S+ 0 0 68 -25,-1.5 2,-0.3 1,-0.2 -24,-0.2 0.882 86.9 8.6 -62.2 -28.7 204.0 69.5 -4.5 1777 2328 L G E - j 01752D 1 -26,-1.2 -24,-3.8 -1045,-0.1 2,-0.4 -0.967 65.7-152.2-153.7 156.9 200.5 69.0 -3.1 1778 2329 L V E -Fj 7301753D 7 -1048,-3.1 -1048,-2.9 -2,-0.3 2,-0.4 -0.974 6.4-166.3-139.2 144.0 198.3 70.2 -0.4 1779 2330 L V E +Fj 7291754D 0 -26,-1.9 -24,-3.3 -2,-0.4 2,-0.4 -0.996 12.5 175.4-138.5 123.3 195.5 68.4 1.2 1780 2331 L A E +Fj 7281755D 2 -1052,-3.9 -1052,-3.7 -2,-0.4 -22,-0.2 -0.984 55.2 14.2-135.5 144.1 193.0 70.1 3.5 1781 2332 L G S S+ 0 0 12 -26,-1.0 -23,-0.2 -24,-1.0 -25,-0.2 0.591 81.5 113.4 78.6 16.4 189.8 69.2 5.3 1782 2333 L C S > S- 0 0 0 -27,-0.8 3,-0.5 1,-0.4 4,-0.2 0.281 71.5-136.6-102.9 17.0 190.2 65.5 5.0 1783 2334 L G T > - 0 0 16 -27,-1.4 3,-1.1 1,-0.2 -1,-0.4 -0.322 64.4 -29.8 71.7-153.1 190.7 65.0 8.7 1784 2335 L V T >> S+ 0 0 25 1,-0.2 3,-1.8 2,-0.2 4,-0.9 0.820 132.1 75.0 -67.2 -30.5 193.4 62.5 9.7 1785 2336 L Q H <> S+ 0 0 36 -3,-0.5 4,-2.7 1,-0.3 -1,-0.2 0.758 79.1 75.5 -48.4 -30.9 192.8 60.7 6.5 1786 2337 L G H <> S+ 0 0 0 -3,-1.1 4,-1.3 -4,-0.2 -1,-0.3 0.841 93.1 52.1 -47.4 -41.7 194.7 63.6 4.8 1787 2338 L Y H <> S+ 0 0 0 -3,-1.8 4,-3.5 -4,-0.2 -1,-0.2 0.904 106.2 52.2 -60.3 -51.6 198.0 62.2 6.1 1788 2339 L V H X S+ 0 0 19 -4,-0.9 4,-2.5 2,-0.2 5,-0.2 0.935 110.1 48.1 -53.6 -48.2 197.2 58.9 4.7 1789 2340 L F H X S+ 0 0 0 -4,-2.7 4,-1.4 2,-0.2 -1,-0.2 0.867 109.8 55.3 -56.9 -31.7 196.6 60.6 1.3 1790 2341 L G H X S+ 0 0 0 -4,-1.3 4,-1.7 -5,-0.2 3,-0.4 0.977 108.5 45.4 -67.9 -53.8 199.9 62.3 2.0 1791 2342 L V H X S+ 0 0 0 -4,-3.5 4,-2.6 1,-0.2 5,-0.2 0.921 111.4 53.4 -46.5 -52.6 201.7 59.0 2.4 1792 2343 L E H X S+ 0 0 30 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.826 106.9 52.9 -56.3 -33.1 199.9 57.6 -0.8 1793 2344 L R H X S+ 0 0 45 -4,-1.4 4,-0.7 -3,-0.4 -1,-0.2 0.927 109.9 46.5 -73.7 -44.6 201.1 60.6 -2.8 1794 2345 L I H >X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 3,-0.6 0.891 110.7 52.2 -58.4 -51.4 204.8 60.1 -1.8 1795 2346 L A H >< S+ 0 0 12 -4,-2.6 3,-0.6 2,-0.2 4,-0.4 0.944 109.7 50.5 -44.8 -52.7 204.6 56.3 -2.5 1796 2347 L A H 3< S+ 0 0 48 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.748 121.9 34.6 -59.7 -19.2 203.2 57.3 -6.0 1797 2348 L L H << S+ 0 0 87 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.438 113.5 52.6-123.9 -7.8 206.1 59.6 -6.3 1798 2349 L A << 0 0 13 -4,-2.0 -145,-0.5 -3,-0.6 -2,-0.2 0.160 360.0 360.0-104.0 9.0 209.0 57.9 -4.6 1799 2350 L G 0 0 87 -4,-0.4 -1,-0.2 -5,-0.2 -147,-0.0 -0.948 360.0 360.0 171.1 360.0 208.2 54.9 -6.7