==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-OCT-06 2J7F . COMPND 2 MOLECULE: BETA-GLUCOSIDASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR T.M.GLOSTER,D.ZECHEL,A.VASELLA,G.J.DAVIES . 871 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32563.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 662 76.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 106 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.9 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 . 65 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 275 31.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 25 2.9 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 8 0 2 2 0 5 1 1 2 0 3 0 4 0 0 2 0 0 0 1 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 4 6 4 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 2 0 4 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 . 2 2 0 0 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 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 3 A V 0 0 148 0, 0.0 2,-0.8 0, 0.0 436,-0.2 0.000 360.0 360.0 360.0 136.9 47.6 49.4 48.2 2 4 A K E -A 436 0A 82 434,-1.7 434,-2.3 0, 0.0 2,-0.3 -0.866 360.0-175.6-103.3 96.9 47.0 45.7 49.0 3 5 A K E -A 435 0A 129 -2,-0.8 432,-0.2 432,-0.2 431,-0.1 -0.731 14.0-137.9 -96.8 143.3 50.3 44.0 48.3 4 6 A F - 0 0 11 430,-2.9 3,-0.1 -2,-0.3 4,-0.1 -0.461 35.0 -77.1 -93.2 165.6 50.8 40.2 48.5 5 7 A P > - 0 0 55 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 -0.210 59.9 -87.0 -56.0 155.0 53.7 38.2 50.0 6 8 A E T 3 S+ 0 0 195 1,-0.2 428,-0.0 0, 0.0 0, 0.0 -0.446 115.9 17.9 -60.6 132.8 57.0 37.9 48.0 7 9 A G T 3 S+ 0 0 60 1,-0.2 -1,-0.2 -2,-0.2 2,-0.1 0.652 83.9 162.7 74.6 18.0 56.8 34.9 45.6 8 10 A F < - 0 0 7 -3,-1.4 2,-0.8 1,-0.1 -1,-0.2 -0.460 41.7-117.5 -63.7 136.7 53.0 34.6 45.8 9 11 A L E -b 386 0B 32 376,-2.5 378,-2.7 -2,-0.1 2,-0.6 -0.737 26.8-169.5 -90.3 106.5 51.6 32.5 42.9 10 12 A W E +b 387 0B 0 -2,-0.8 63,-1.7 376,-0.2 62,-1.4 -0.836 27.4 161.3 -87.8 121.6 49.4 34.4 40.5 11 13 A G E -bc 388 73B 0 376,-2.7 378,-2.4 -2,-0.6 2,-0.3 -0.864 38.2-137.1-135.2 170.3 47.8 31.8 38.1 12 14 A V E -bc 389 74B 0 61,-1.7 63,-2.8 -2,-0.3 2,-0.4 -0.911 24.4-146.1-122.4 159.2 45.1 30.9 35.6 13 15 A A E +bc 390 75B 0 376,-2.2 379,-1.0 -2,-0.3 378,-0.6 -0.969 21.4 161.5-132.9 136.7 43.3 27.5 35.5 14 16 A T - 0 0 1 61,-2.5 2,-0.3 -2,-0.4 381,-0.0 -0.767 24.8-135.4-132.2-179.0 41.8 25.3 32.8 15 17 A A > - 0 0 0 -2,-0.2 4,-1.2 61,-0.2 3,-0.4 -0.976 23.6-118.4-140.9 148.5 40.7 21.6 32.5 16 18 A S H >> S+ 0 0 1 -2,-0.3 4,-2.4 1,-0.2 3,-0.6 0.872 109.5 42.8 -55.0 -51.5 41.4 19.1 29.7 17 19 A Y H 34 S+ 0 0 12 102,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.775 111.3 58.2 -70.5 -24.6 37.8 18.3 28.5 18 20 A Q H 34 S+ 0 0 0 -3,-0.4 378,-2.6 1,-0.1 -1,-0.2 0.784 124.2 12.8 -75.9 -28.6 36.8 21.9 28.7 19 21 A I H << S+ 0 0 3 -4,-1.2 36,-2.3 -3,-0.6 34,-0.6 0.691 109.7 71.4-119.7 -30.7 39.4 23.4 26.4 20 22 A E < - 0 0 7 -4,-2.4 36,-2.2 -5,-0.3 37,-0.3 0.893 59.6-174.9 -67.5 -46.7 41.2 20.7 24.3 21 23 A G + 0 0 3 -5,-0.3 30,-0.3 -4,-0.3 29,-0.2 -0.268 55.3 85.6 64.5-171.6 38.8 19.3 21.8 22 24 A S > + 0 0 35 28,-2.6 3,-1.2 1,-0.1 6,-0.1 0.905 51.7 173.0 47.9 53.0 40.0 16.3 19.7 23 25 A P T 3 S+ 0 0 22 0, 0.0 -1,-0.1 0, 0.0 27,-0.1 0.718 76.9 37.6 -66.4 -16.7 39.0 13.8 22.4 24 26 A L T > S+ 0 0 89 26,-0.1 3,-0.7 3,-0.1 -2,-0.1 0.309 87.7 125.1-117.1 7.4 39.8 10.8 20.1 25 27 A A G X S+ 0 0 29 -3,-1.2 3,-1.6 1,-0.2 -4,-0.0 -0.325 74.2 8.4 -64.4 147.3 43.0 12.2 18.4 26 28 A D G 3 S- 0 0 78 1,-0.3 -1,-0.2 68,-0.0 69,-0.2 0.795 133.8 -51.4 50.9 42.2 46.2 10.2 18.6 27 29 A G G < S+ 0 0 44 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.1 0.519 85.6 160.5 82.6 4.9 44.8 7.0 20.1 28 30 A A < - 0 0 12 -3,-1.6 54,-0.3 -6,-0.1 -1,-0.2 -0.308 37.3-126.8 -55.0 137.3 43.0 8.5 23.1 29 31 A G - 0 0 16 52,-2.5 57,-0.1 1,-0.1 -1,-0.1 -0.485 34.7 -92.3 -75.7 158.6 40.3 6.3 24.7 30 32 A M - 0 0 77 -2,-0.1 94,-2.4 55,-0.1 95,-0.5 -0.401 40.3-147.6 -62.8 150.6 36.8 7.8 25.1 31 33 A S B > -K 123 0C 6 92,-0.3 4,-1.8 93,-0.2 3,-0.3 -0.723 27.3-106.3-110.5 169.4 36.1 9.4 28.4 32 34 A I H > S+ 0 0 4 90,-2.3 4,-2.1 -2,-0.3 5,-0.2 0.715 120.6 57.9 -66.5 -24.7 32.7 9.6 30.3 33 35 A W H > S+ 0 0 3 89,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.799 104.8 52.0 -75.3 -28.5 32.3 13.2 29.3 34 36 A H H > S+ 0 0 23 -3,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.966 115.8 38.8 -63.5 -54.2 32.5 12.2 25.7 35 37 A T H < S+ 0 0 35 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.1 0.877 118.7 49.5 -67.4 -37.5 29.8 9.5 26.0 36 38 A F H >< S+ 0 0 9 -4,-2.1 3,-1.1 1,-0.2 6,-0.3 0.915 112.7 44.8 -66.7 -47.9 27.7 11.7 28.4 37 39 A S H 3< S+ 0 0 5 -4,-2.0 6,-0.2 1,-0.2 -1,-0.2 0.761 110.3 56.4 -72.8 -21.3 27.8 14.8 26.2 38 40 A H T 3< S+ 0 0 85 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.460 88.8 91.7 -86.4 1.7 27.1 12.7 23.1 39 41 A T S X S- 0 0 69 -3,-1.1 3,-1.4 -4,-0.1 4,-0.4 -0.846 89.1-114.4 -93.5 122.4 23.9 11.4 24.9 40 42 A P T 3 S+ 0 0 126 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.321 95.3 24.0 -61.1 137.5 20.9 13.7 23.9 41 43 A G T 3 S+ 0 0 82 2,-0.3 -4,-0.1 -4,-0.1 3,-0.1 0.171 97.4 92.3 101.5 -14.1 19.4 15.7 26.7 42 44 A N S < S+ 0 0 51 -3,-1.4 2,-0.4 -6,-0.3 -5,-0.1 0.778 84.7 38.5 -86.5 -32.9 22.5 15.8 29.0 43 45 A V S > S- 0 0 10 -4,-0.4 3,-2.0 -6,-0.2 -2,-0.3 -0.974 93.8 -94.3-127.0 139.0 24.2 19.1 27.9 44 46 A K G > S- 0 0 34 355,-2.3 3,-1.9 -2,-0.4 358,-0.2 -0.192 106.0 -2.0 -51.8 131.0 22.7 22.4 26.9 45 47 A N G 3 S- 0 0 113 1,-0.3 -1,-0.3 356,-0.1 3,-0.1 0.608 120.0 -75.6 61.5 19.1 22.1 22.8 23.1 46 48 A G G < S+ 0 0 56 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.698 83.3 169.2 66.5 19.5 23.6 19.4 22.4 47 49 A D < + 0 0 36 -3,-1.9 2,-0.3 -4,-0.1 -1,-0.2 -0.290 8.0 177.6 -64.3 144.2 27.1 20.9 23.0 48 50 A T - 0 0 23 -3,-0.1 4,-0.5 -10,-0.1 3,-0.4 -0.867 42.1-109.2-135.9 177.5 30.1 18.6 23.4 49 51 A G S S+ 0 0 1 -2,-0.3 -28,-0.3 -16,-0.2 -15,-0.1 0.103 79.7 113.7 -92.8 21.6 33.8 18.8 23.9 50 52 A D S S- 0 0 61 -29,-0.2 -28,-2.6 -28,-0.1 -1,-0.2 0.893 100.3 -0.1 -60.7 -41.5 34.6 17.6 20.4 51 53 A V S > S+ 0 0 86 -3,-0.4 3,-2.6 -30,-0.3 5,-0.3 0.763 84.2 152.4-113.0 -49.4 36.1 21.0 19.4 52 54 A A T 3 S- 0 0 4 -4,-0.5 -33,-0.2 1,-0.3 -32,-0.1 -0.243 84.8 -21.7 51.4-130.8 35.9 23.2 22.5 53 55 A C T 3 S- 0 0 0 -34,-0.6 -1,-0.3 -35,-0.2 -33,-0.1 0.298 82.8-125.2 -82.4 5.5 38.8 25.8 22.4 54 56 A D X> + 0 0 22 -3,-2.6 4,-2.3 1,-0.1 3,-1.6 0.814 59.0 151.7 46.0 35.0 40.8 23.6 20.0 55 57 A H H 3> + 0 0 3 -36,-2.3 4,-1.3 1,-0.3 -35,-0.2 0.731 58.4 76.2 -65.5 -18.2 43.6 23.9 22.6 56 58 A Y H 34 S+ 0 0 16 -36,-2.2 -1,-0.3 -37,-0.3 -35,-0.1 0.827 114.4 19.6 -63.5 -30.8 44.7 20.5 21.5 57 59 A N H <4 S+ 0 0 105 -3,-1.6 3,-0.3 -37,-0.3 -2,-0.2 0.632 128.8 51.6-102.9 -25.9 46.2 22.3 18.4 58 60 A R H X + 0 0 80 -4,-2.3 4,-2.0 -38,-0.2 5,-0.2 0.280 69.6 116.4 -98.9 10.4 46.3 25.8 19.8 59 61 A W H X S+ 0 0 39 -4,-1.3 4,-2.2 1,-0.2 5,-0.2 0.818 74.7 52.0 -48.4 -43.2 48.2 25.1 23.0 60 62 A K H > S+ 0 0 119 -3,-0.3 4,-3.2 2,-0.2 5,-0.2 0.957 108.7 49.9 -64.4 -50.4 51.3 27.2 22.1 61 63 A E H > S+ 0 0 74 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.910 112.3 48.7 -48.0 -51.0 49.2 30.3 21.3 62 64 A D H X S+ 0 0 0 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.849 112.5 47.1 -61.6 -41.3 47.4 30.0 24.7 63 65 A I H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 3,-0.3 0.945 109.1 53.7 -65.4 -49.2 50.7 29.6 26.6 64 66 A E H X S+ 0 0 76 -4,-3.2 4,-3.0 1,-0.2 -2,-0.2 0.871 107.8 53.2 -50.1 -36.9 52.2 32.6 24.7 65 67 A I H X S+ 0 0 25 -4,-1.9 4,-1.5 -5,-0.2 -1,-0.2 0.889 108.6 48.2 -65.0 -42.0 49.0 34.4 26.0 66 68 A I H <>S+ 0 0 0 -4,-1.6 5,-1.5 -3,-0.3 4,-0.4 0.953 115.2 45.2 -60.0 -54.1 49.8 33.3 29.6 67 69 A E H ><5S+ 0 0 83 -4,-2.8 3,-2.5 1,-0.2 -2,-0.2 0.946 110.6 52.9 -51.3 -57.2 53.4 34.5 29.2 68 70 A K H 3<5S+ 0 0 185 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.809 108.5 51.7 -54.7 -30.3 52.4 37.8 27.5 69 71 A L T 3<5S- 0 0 7 -4,-1.5 -1,-0.3 -3,-0.2 363,-0.2 0.562 110.1-125.4 -82.5 -8.6 50.1 38.5 30.5 70 72 A G T < 5 + 0 0 41 -3,-2.5 -3,-0.2 -4,-0.4 2,-0.1 0.593 51.4 161.6 72.7 11.2 52.9 37.8 33.0 71 73 A V < - 0 0 3 -5,-1.5 -1,-0.2 1,-0.1 -60,-0.2 -0.439 28.2-155.5 -64.7 134.7 50.8 35.2 34.8 72 74 A K + 0 0 86 -62,-1.4 40,-3.0 -2,-0.1 2,-0.4 0.623 65.3 39.7 -96.8 -17.9 53.2 33.1 36.8 73 75 A A E -cd 11 112B 0 -63,-1.7 -61,-1.7 38,-0.2 2,-0.5 -0.992 57.8-159.3-137.6 142.8 51.4 29.7 37.3 74 76 A Y E -cd 12 113B 0 38,-2.4 40,-2.8 -2,-0.4 2,-0.6 -0.973 4.5-162.2-126.0 117.5 49.2 27.6 35.0 75 77 A R E +cd 13 114B 0 -63,-2.8 -61,-2.5 -2,-0.5 2,-0.3 -0.881 26.5 154.7 -96.3 118.6 46.8 25.0 36.4 76 78 A F E - d 0 115B 5 38,-1.8 40,-2.7 -2,-0.6 2,-0.3 -0.911 31.9-128.5-138.5 161.2 45.8 22.5 33.8 77 79 A S E - d 0 116B 1 -2,-0.3 2,-0.4 38,-0.2 40,-0.2 -0.837 13.0-128.9-115.1 155.4 44.6 18.9 33.9 78 80 A I - 0 0 0 38,-1.8 2,-0.9 -2,-0.3 41,-0.4 -0.850 22.5-124.2 -99.8 134.7 45.6 15.8 32.2 79 81 A S >> - 0 0 10 -2,-0.4 3,-1.6 1,-0.2 4,-1.2 -0.744 16.4-152.6 -78.9 106.2 43.1 13.6 30.3 80 82 A W H >> S+ 0 0 0 -2,-0.9 4,-3.0 1,-0.3 3,-0.6 0.863 93.0 53.5 -46.7 -50.7 43.4 10.1 31.8 81 83 A P H 34 S+ 0 0 1 0, 0.0 -52,-2.5 0, 0.0 -1,-0.3 0.655 101.7 59.0 -67.0 -14.4 42.2 8.4 28.6 82 84 A R H <4 S+ 0 0 6 -3,-1.6 13,-0.5 -54,-0.3 14,-0.2 0.839 115.5 37.4 -69.6 -33.7 44.9 10.2 26.4 83 85 A I H << S+ 0 0 0 -4,-1.2 9,-2.9 -3,-0.6 13,-0.2 0.922 136.6 16.1 -85.7 -50.2 47.5 8.6 28.7 84 86 A L S >< S- 0 0 0 -4,-3.0 3,-2.3 7,-0.2 -1,-0.3 -0.885 70.3-164.9-128.4 94.0 45.9 5.2 29.3 85 87 A P T 3 S+ 0 0 5 0, 0.0 40,-0.4 0, 0.0 -1,-0.1 0.805 92.6 37.7 -52.2 -37.3 43.2 4.6 26.6 86 88 A E T 3 S- 0 0 102 4,-0.3 2,-1.0 2,-0.3 5,-0.1 0.208 115.8-113.3 -94.6 11.2 41.6 1.7 28.5 87 89 A G S < S+ 0 0 0 -3,-2.3 2,-0.3 -7,-0.2 57,-0.1 -0.202 94.4 38.2 87.4 -47.3 42.3 3.3 31.9 88 90 A T S S+ 0 0 33 -2,-1.0 2,-0.7 55,-0.1 -2,-0.3 -0.875 107.0 18.6-124.9 165.8 44.8 0.7 33.0 89 91 A G S S+ 0 0 49 -2,-0.3 -2,-0.0 -4,-0.1 0, 0.0 -0.679 96.9 64.0 85.9-111.3 47.5 -1.2 31.2 90 92 A R - 0 0 132 -2,-0.7 2,-0.5 1,-0.1 -4,-0.3 -0.137 64.7-150.0 -61.4 136.1 48.6 0.3 27.9 91 93 A V - 0 0 59 -7,-0.2 2,-0.8 -6,-0.1 -7,-0.2 -0.917 9.2-140.4-105.9 130.8 50.3 3.7 27.9 92 94 A N >> - 0 0 18 -9,-2.9 4,-1.6 -2,-0.5 3,-0.8 -0.813 6.3-160.6 -95.4 105.7 49.8 6.0 24.8 93 95 A Q H 3> S+ 0 0 106 -2,-0.8 4,-2.8 1,-0.2 -1,-0.2 0.845 89.7 59.3 -55.9 -36.1 53.1 7.8 24.0 94 96 A K H 3> S+ 0 0 115 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.830 103.8 51.1 -63.8 -33.5 51.3 10.5 21.9 95 97 A G H <> S+ 0 0 1 -3,-0.8 4,-1.5 -13,-0.5 -1,-0.2 0.910 112.3 46.0 -65.7 -45.8 49.2 11.5 25.0 96 98 A L H X S+ 0 0 1 -4,-1.6 4,-2.8 -14,-0.2 -2,-0.2 0.890 109.8 55.4 -59.7 -44.6 52.4 11.9 27.0 97 99 A D H X S+ 0 0 60 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.923 103.2 56.3 -53.4 -49.8 53.9 13.8 24.1 98 100 A F H X S+ 0 0 0 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.915 114.5 36.3 -48.8 -54.1 51.0 16.3 24.2 99 101 A Y H X S+ 0 0 0 -4,-1.5 4,-3.2 2,-0.2 -1,-0.2 0.842 111.2 61.6 -74.0 -34.2 51.5 17.2 27.9 100 102 A N H X S+ 0 0 27 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.921 105.7 47.3 -52.5 -47.2 55.3 17.0 27.6 101 103 A R H X S+ 0 0 109 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.911 113.7 47.7 -62.6 -42.8 55.3 19.8 25.0 102 104 A I H X S+ 0 0 2 -4,-1.5 4,-2.3 -5,-0.2 -2,-0.2 0.955 114.0 47.3 -58.9 -50.7 53.0 21.9 27.2 103 105 A I H X S+ 0 0 0 -4,-3.2 4,-2.1 1,-0.2 -2,-0.2 0.906 113.4 45.9 -57.9 -49.3 55.1 21.3 30.3 104 106 A D H X S+ 0 0 61 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.860 111.5 52.7 -65.9 -38.1 58.5 22.1 28.7 105 107 A T H X S+ 0 0 18 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.939 109.1 49.1 -62.2 -49.9 57.1 25.2 27.0 106 108 A L H <>S+ 0 0 0 -4,-2.3 5,-3.0 2,-0.2 -2,-0.2 0.914 112.2 48.7 -53.3 -48.3 55.8 26.5 30.4 107 109 A L H ><5S+ 0 0 67 -4,-2.1 3,-1.5 3,-0.2 -2,-0.2 0.912 109.3 52.3 -62.8 -43.6 59.2 25.8 32.0 108 110 A E H 3<5S+ 0 0 157 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.881 112.9 45.2 -53.5 -43.6 61.0 27.6 29.1 109 111 A K T 3<5S- 0 0 53 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.191 118.4-113.2 -89.0 12.9 58.8 30.7 29.6 110 112 A G T < 5 + 0 0 58 -3,-1.5 2,-0.4 1,-0.2 -3,-0.2 0.731 67.7 143.4 60.3 25.3 59.2 30.5 33.4 111 113 A I < - 0 0 4 -5,-3.0 -38,-0.2 -6,-0.2 -1,-0.2 -0.837 49.4-129.2 -92.9 131.6 55.5 29.6 34.2 112 114 A T E -d 73 0B 49 -40,-3.0 -38,-2.4 -2,-0.4 2,-0.4 -0.717 21.6-136.2 -82.2 119.5 55.0 27.2 37.1 113 115 A P E -d 74 0B 3 0, 0.0 45,-0.6 0, 0.0 2,-0.5 -0.628 16.7-169.9 -81.3 132.0 52.8 24.2 36.2 114 116 A F E -de 75 158B 1 -40,-2.8 -38,-1.8 -2,-0.4 2,-0.6 -0.958 16.3-156.9-112.9 110.0 50.1 22.9 38.6 115 117 A V E -de 76 159B 0 43,-2.2 45,-3.0 -2,-0.5 2,-0.7 -0.770 10.5-156.5 -99.3 119.0 48.8 19.6 37.3 116 118 A T E -de 77 160B 0 -40,-2.7 -38,-1.8 -2,-0.6 3,-0.2 -0.835 6.2-161.6 -85.5 114.2 45.4 18.3 38.2 117 119 A I E S+ 0 0 0 43,-3.5 2,-0.5 -2,-0.7 -37,-0.2 0.922 78.4 27.2 -64.5 -43.0 45.6 14.5 37.7 118 120 A Y E + e 0 162B 3 43,-1.5 45,-2.2 42,-0.4 -1,-0.3 -0.948 54.8 160.9-128.8 108.9 41.8 14.1 37.6 119 121 A H S S- 0 0 2 -2,-0.5 -102,-0.3 -41,-0.4 -42,-0.1 -0.400 75.0 -76.6-124.8 55.6 39.4 16.7 36.4 120 122 A W S S+ 0 0 14 1,-0.1 2,-1.5 43,-0.1 -88,-0.1 0.118 97.5 114.4 90.6 -15.2 36.3 14.6 35.7 121 123 A D + 0 0 2 -43,-0.2 -41,-0.3 -89,-0.1 -1,-0.1 -0.447 45.2 179.3 -89.0 64.4 37.2 12.9 32.3 122 124 A L - 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0 0 18 54,-1.6 4,-2.2 -2,-0.6 3,-0.7 0.908 60.2-170.1 52.1 64.5 -12.6 39.9 27.5 603 167 B P H 3> S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 5,-0.3 0.800 84.5 64.1 -55.2 -23.8 -16.3 40.5 28.2 604 168 B W H 3>>S+ 0 0 21 2,-0.2 4,-3.1 1,-0.2 5,-0.6 0.928 106.3 41.8 -64.4 -45.6 -15.2 43.7 30.2 605 169 B V H <>>S+ 0 0 13 -3,-0.7 5,-1.8 3,-0.2 4,-1.2 0.969 112.5 54.5 -63.6 -53.8 -13.8 45.3 27.0 606 170 B V H <5S+ 0 0 9 -4,-2.2 4,-0.2 -5,-0.3 -2,-0.2 0.887 121.2 30.6 -44.7 -51.1 -16.8 44.1 24.9 607 171 B A H X5S+ 0 0 0 -4,-2.3 4,-1.9 3,-0.2 5,-0.3 0.960 130.6 31.1 -75.0 -61.0 -19.2 45.8 27.3 608 172 B I H X>S+ 0 0 0 -4,-3.1 5,-2.5 -5,-0.3 4,-1.8 0.944 126.9 36.9 -74.9 -48.9 -17.3 48.8 28.7 609 173 B V H < S- 0 0 28 -7,-1.8 3,-2.3 4,-0.2 4,-0.3 -0.819 104.7 -42.5-117.6 158.9 -14.8 49.8 20.2 617 181 B A T 3 S+ 0 0 7 1,-0.4 -6,-0.1 -2,-0.3 -146,-0.1 -0.336 123.2 34.3 -54.0 142.3 -17.7 48.5 18.1 618 182 B P T 3 S- 0 0 35 0, 0.0 -1,-0.4 0, 0.0 -7,-0.1 -0.979 93.3-142.6 -83.4 7.8 -20.6 49.1 18.4 619 183 B G < + 0 0 34 -3,-2.3 2,-0.2 -9,-0.7 -8,-0.2 0.758 43.5 146.6 87.5 29.3 -19.4 52.6 19.4 620 184 B M - 0 0 59 -10,-2.0 -6,-0.8 -4,-0.3 2,-0.3 -0.539 38.2-159.4-100.6 157.7 -21.9 53.5 22.1 621 185 B R + 0 0 194 -2,-0.2 2,-0.3 -8,-0.2 -9,-0.3 -0.739 45.0 122.2-137.6 86.7 -21.7 55.5 25.4 622 186 B D > - 0 0 69 -11,-2.9 4,-2.5 -2,-0.3 5,-0.1 -0.928 44.5-157.5-149.5 118.7 -24.5 54.5 27.6 623 187 B I H > S+ 0 0 38 -2,-0.3 4,-1.8 1,-0.2 5,-0.2 0.831 94.9 52.6 -76.5 -27.3 -23.7 53.1 31.1 624 188 B Y H > S+ 0 0 104 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.947 111.8 46.3 -70.5 -45.9 -27.1 51.4 31.4 625 189 B V H > S+ 0 0 29 1,-0.2 4,-2.4 2,-0.2 3,-0.3 0.940 109.5 55.9 -56.7 -47.8 -26.6 49.6 28.1 626 190 B A H X S+ 0 0 0 -4,-2.5 4,-1.9 -15,-0.4 -1,-0.2 0.879 108.8 45.3 -56.9 -42.7 -23.0 48.7 29.1 627 191 B F H X S+ 0 0 1 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.767 110.2 53.5 -75.3 -25.7 -24.0 46.9 32.3 628 192 B R H X S+ 0 0 81 -4,-1.5 4,-2.8 -3,-0.3 -2,-0.2 0.878 107.9 51.9 -71.8 -35.0 -26.8 45.1 30.6 629 193 B A H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.904 107.5 53.1 -62.4 -43.4 -24.1 43.9 28.1 630 194 B V H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.935 113.8 42.6 -52.3 -49.8 -22.0 42.7 31.1 631 195 B H H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.897 114.6 47.8 -67.7 -47.3 -25.0 40.7 32.4 632 196 B N H X S+ 0 0 4 -4,-2.8 4,-2.6 -62,-0.3 -1,-0.2 0.800 107.1 58.8 -66.1 -30.8 -26.0 39.3 29.0 633 197 B L H X S+ 0 0 0 -4,-2.4 4,-2.9 -5,-0.2 -2,-0.2 0.966 108.7 45.2 -58.2 -50.9 -22.3 38.3 28.2 634 198 B L H X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.893 113.4 48.6 -60.9 -45.8 -22.4 36.2 31.4 635 199 B R H X S+ 0 0 37 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.872 112.9 48.7 -61.5 -40.2 -25.8 34.7 30.5 636 200 B A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.955 110.8 50.8 -64.4 -52.4 -24.6 33.9 26.9 637 201 B H H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.924 110.7 48.6 -41.6 -57.7 -21.4 32.3 28.2 638 202 B A H X S+ 0 0 4 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.873 110.4 50.5 -58.5 -42.3 -23.4 30.1 30.6 639 203 B R H X S+ 0 0 85 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.881 110.1 51.5 -64.6 -38.3 -25.8 29.0 27.9 640 204 B A H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.893 110.1 47.9 -63.9 -42.2 -22.8 28.2 25.7 641 205 B V H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.924 110.6 52.2 -63.5 -45.4 -21.2 26.0 28.4 642 206 B K H X S+ 0 0 104 -4,-2.5 4,-0.7 1,-0.2 -2,-0.2 0.872 111.7 46.2 -58.3 -40.7 -24.5 24.3 29.0 643 207 B V H >< S+ 0 0 6 -4,-1.9 3,-0.6 1,-0.2 4,-0.4 0.863 106.8 60.9 -67.5 -36.3 -24.7 23.5 25.3 644 208 B F H >X S+ 0 0 1 -4,-2.0 4,-2.3 1,-0.2 3,-1.4 0.893 99.5 53.4 -59.7 -40.7 -21.1 22.4 25.3 645 209 B R H 3< S+ 0 0 92 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.762 109.2 50.7 -68.8 -24.8 -21.8 19.6 27.9 646 210 B E T << S+ 0 0 120 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.487 123.0 27.3 -81.5 -9.0 -24.6 18.3 25.5 647 211 B T T <4 S+ 0 0 41 -3,-1.4 2,-0.5 -4,-0.4 -2,-0.2 0.566 107.9 57.9-139.1 -18.6 -22.3 18.2 22.4 648 212 B V >< - 0 0 14 -4,-2.3 3,-0.5 -5,-0.1 2,-0.3 -0.963 58.9-159.8-130.9 119.2 -18.6 17.7 23.1 649 213 B K T 3 S+ 0 0 46 -2,-0.5 3,-0.1 1,-0.2 -3,-0.0 -0.671 78.7 7.8 -93.3 149.2 -17.2 14.8 25.0 650 214 B D T 3 S+ 0 0 148 -2,-0.3 2,-0.2 1,-0.2 -1,-0.2 0.721 101.6 131.4 48.5 28.5 -13.7 14.9 26.5 651 215 B G < - 0 0 13 -3,-0.5 2,-0.4 -7,-0.1 -55,-0.2 -0.650 49.6-140.2-101.0 161.4 -13.6 18.6 25.7 652 216 B K E -t 596 0G 34 -57,-3.9 -55,-2.8 -2,-0.2 2,-0.4 -0.977 13.9-167.3-121.1 139.8 -12.7 21.6 27.9 653 217 B I E +t 597 0G 0 -2,-0.4 68,-3.0 -57,-0.2 69,-0.8 -0.992 16.8 149.8-130.2 135.6 -14.4 25.0 28.0 654 218 B G E -t 598 0G 0 -57,-2.2 -55,-2.2 -2,-0.4 2,-0.3 -0.578 32.0-123.5-139.3-158.7 -13.4 28.3 29.6 655 219 B I E - 0 0 0 67,-0.5 69,-2.8 -57,-0.3 2,-0.4 -0.955 20.3-128.0-162.0 146.2 -13.6 32.1 29.3 656 220 B V E -tu 601 724G 0 -56,-2.5 -54,-1.6 -2,-0.3 2,-0.4 -0.881 18.2-168.0-117.3 135.2 -10.9 34.8 29.0 657 221 B F E - u 0 725G 2 67,-2.0 69,-3.2 -2,-0.4 2,-0.2 -0.944 20.5-129.3-123.4 137.5 -10.5 38.0 31.0 658 222 B N E - 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