==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-DEC-06 2O9T . COMPND 2 MOLECULE: BETA-GLUCOSIDASE B; . SOURCE 2 ORGANISM_SCIENTIFIC: PAENIBACILLUS POLYMYXA; . AUTHOR P.ISORNA,J.POLAINA,J.SANZ-APARICIO . 445 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17208.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 335 75.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 40 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 139 31.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 3.6 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 2 3 1 0 0 2 0 1 0 1 2 0 2 1 0 0 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 3 4 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 PARALLEL BRIDGES PER LADDER . 3 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 2 0 0 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 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 N 0 0 180 0, 0.0 2,-0.3 0, 0.0 444,-0.0 0.000 360.0 360.0 360.0 42.9 78.2 37.6 11.2 2 5 A T - 0 0 98 2,-0.0 2,-0.6 442,-0.0 442,-0.0 -0.793 360.0-148.5-105.2 148.7 79.8 39.3 14.2 3 6 A F + 0 0 37 442,-3.6 442,-1.5 -2,-0.3 2,-0.5 -0.872 20.0 174.5-121.9 99.5 77.9 40.4 17.3 4 7 A I B -A 444 0A 109 -2,-0.6 440,-0.2 440,-0.3 439,-0.1 -0.903 16.4-150.3-107.1 127.5 79.2 43.5 19.0 5 8 A F - 0 0 4 438,-1.8 379,-0.0 -2,-0.5 -2,-0.0 -0.581 36.0 -71.6 -95.1 157.5 77.4 45.0 22.0 6 9 A P - 0 0 51 0, 0.0 -1,-0.2 0, 0.0 3,-0.2 0.169 40.4-118.2 -38.8 161.4 77.2 48.7 23.0 7 10 A A S S+ 0 0 98 1,-0.2 -2,-0.1 -3,-0.1 436,-0.0 0.844 116.3 46.5 -74.8 -34.4 80.3 50.2 24.6 8 11 A T S S+ 0 0 118 2,-0.1 -1,-0.2 387,-0.0 386,-0.0 0.507 81.8 134.2 -86.0 -5.2 78.4 50.9 27.8 9 12 A F - 0 0 14 -3,-0.2 2,-0.7 1,-0.1 386,-0.2 -0.101 57.4-124.5 -47.1 139.2 76.9 47.3 27.9 10 13 A M E -b 395 0B 15 384,-2.0 386,-3.8 63,-0.0 2,-0.6 -0.825 25.8-170.7 -96.4 114.7 77.1 45.8 31.4 11 14 A W E +b 396 0B 17 -2,-0.7 62,-0.8 384,-0.2 63,-0.8 -0.903 24.9 140.2-104.4 121.6 78.9 42.4 31.5 12 15 A G E -bc 397 74B 0 384,-2.6 386,-2.2 -2,-0.6 2,-0.3 -0.827 42.3-122.5-148.1-173.3 78.7 40.6 34.8 13 16 A T E -bc 398 75B 0 61,-1.3 63,-2.9 384,-0.3 2,-0.3 -0.969 23.7-152.3-136.8 151.4 78.3 37.5 36.8 14 17 A S E +bc 399 76B 0 384,-1.7 386,-1.6 -2,-0.3 387,-0.7 -0.944 15.7 167.1-133.8 148.9 75.8 36.6 39.5 15 18 A T - 0 0 3 61,-2.1 2,-0.3 -2,-0.3 389,-0.0 -0.716 25.7-124.2-137.9-171.1 75.5 34.4 42.6 16 19 A S > - 0 0 0 -2,-0.2 4,-1.3 61,-0.1 5,-0.4 -0.986 18.6-126.4-142.2 145.4 73.2 33.8 45.6 17 20 A S H > S+ 0 0 1 -2,-0.3 4,-2.0 1,-0.2 5,-0.4 0.928 107.7 38.7 -63.1 -48.9 74.0 33.9 49.4 18 21 A Y H 4 S+ 0 0 9 101,-0.3 4,-0.4 1,-0.2 -1,-0.2 0.905 113.5 57.3 -69.9 -38.4 72.6 30.5 50.4 19 22 A Q H 4 S+ 0 0 0 1,-0.1 386,-1.7 2,-0.1 35,-0.3 0.731 124.9 14.1 -64.4 -26.1 73.7 28.8 47.2 20 23 A I H < S+ 0 0 2 -4,-1.3 36,-2.5 -3,-0.3 34,-0.3 0.705 107.9 72.3-123.4 -25.2 77.4 29.6 47.6 21 24 A E < + 0 0 7 -4,-2.0 36,-2.3 -5,-0.4 37,-0.3 0.905 57.5 179.4 -63.5 -49.0 78.4 30.9 51.1 22 25 A G + 0 0 4 -4,-0.4 -1,-0.2 -5,-0.4 4,-0.1 -0.549 43.7 109.6 75.3-147.6 78.2 27.8 53.3 23 26 A G > + 0 0 4 -2,-0.2 3,-1.4 1,-0.1 6,-0.2 0.874 41.9 168.1 41.6 47.0 79.2 28.7 56.9 24 27 A T T 3 S+ 0 0 12 1,-0.3 -1,-0.1 26,-0.1 27,-0.1 0.812 75.0 30.5 -57.1 -39.5 75.5 28.2 57.8 25 28 A D T 3 S+ 0 0 131 3,-0.0 2,-0.3 6,-0.0 -1,-0.3 -0.116 104.2 102.5-114.7 33.1 76.1 28.2 61.6 26 29 A E S X S+ 0 0 78 -3,-1.4 3,-1.7 1,-0.2 -4,-0.0 -0.846 74.5 16.6-118.4 153.2 79.1 30.6 61.5 27 30 A G T 3 S- 0 0 15 -2,-0.3 -1,-0.2 1,-0.3 68,-0.1 0.699 130.1 -59.7 63.1 20.6 79.5 34.2 62.4 28 31 A G T 3 S+ 0 0 38 1,-0.3 -1,-0.3 -3,-0.2 64,-0.1 0.425 90.2 153.3 90.2 -1.7 76.2 34.3 64.2 29 32 A R < - 0 0 15 -3,-1.7 -1,-0.3 -6,-0.2 54,-0.2 -0.351 29.2-154.4 -62.5 138.8 74.1 33.3 61.3 30 33 A T - 0 0 42 52,-1.2 -4,-0.1 1,-0.1 57,-0.1 -0.707 35.9 -70.1-108.6 166.0 70.9 31.5 62.4 31 34 A P - 0 0 75 0, 0.0 93,-2.8 0, 0.0 94,-0.4 -0.240 44.5-148.9 -59.6 140.5 69.0 29.0 60.2 32 35 A S B >> -J 123 0C 0 91,-0.3 4,-1.2 92,-0.1 3,-0.8 -0.557 35.5 -96.9 -99.9 170.3 67.1 30.2 57.1 33 36 A I H 3> S+ 0 0 4 89,-2.5 4,-2.8 1,-0.2 5,-0.1 0.808 125.4 56.1 -58.3 -29.2 63.9 28.6 55.8 34 37 A W H 3> S+ 0 0 2 2,-0.2 4,-2.8 88,-0.2 -1,-0.2 0.823 98.1 59.8 -73.3 -29.1 66.0 26.6 53.3 35 38 A D H <4 S+ 0 0 17 -3,-0.8 4,-0.3 2,-0.2 -1,-0.2 0.873 115.2 37.1 -63.8 -34.7 68.1 25.1 56.1 36 39 A T H >< S+ 0 0 59 -4,-1.2 3,-1.1 2,-0.2 4,-0.3 0.903 115.5 53.1 -80.7 -47.1 64.9 23.7 57.5 37 40 A F H >< S+ 0 0 1 -4,-2.8 3,-2.0 1,-0.3 6,-0.2 0.897 101.1 59.3 -56.1 -47.7 63.3 22.9 54.1 38 41 A a T 3< S+ 0 0 5 -4,-2.8 6,-0.3 1,-0.3 -1,-0.3 0.712 98.7 60.8 -59.3 -20.4 66.3 20.9 52.9 39 42 A Q T < S+ 0 0 148 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.542 79.5 100.2 -83.5 -9.5 65.9 18.4 55.8 40 43 A I S X S- 0 0 72 -3,-2.0 3,-2.0 -4,-0.3 4,-0.5 -0.717 87.5-108.6 -81.5 116.4 62.3 17.4 54.8 41 44 A P T 3 S+ 0 0 128 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.149 98.6 10.9 -46.6 123.9 62.5 14.0 52.9 42 45 A G T 3 S+ 0 0 81 2,-0.4 3,-0.1 -4,-0.1 -4,-0.1 0.118 98.0 100.1 93.7 -22.3 61.9 14.4 49.2 43 46 A K S < S+ 0 0 52 -3,-2.0 2,-0.4 -6,-0.2 -5,-0.1 0.844 87.6 33.4 -67.8 -33.0 62.1 18.2 49.0 44 47 A V S > S- 0 0 5 -4,-0.5 3,-2.7 -6,-0.3 -2,-0.4 -0.988 94.4-102.8-129.5 132.8 65.6 18.2 47.7 45 48 A I G > S+ 0 0 79 363,-2.8 3,-2.1 -2,-0.4 366,-0.3 -0.146 106.8 0.9 -49.0 136.8 67.4 15.7 45.4 46 49 A G G 3 S- 0 0 71 1,-0.3 -1,-0.3 364,-0.1 3,-0.1 0.519 117.3 -84.4 59.8 5.1 69.7 13.5 47.4 47 50 A G G < S+ 0 0 46 -3,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.679 76.6 173.1 72.8 13.9 68.7 15.3 50.6 48 51 A D < - 0 0 46 -3,-2.1 2,-0.3 360,-0.1 -1,-0.2 -0.264 11.8-169.0 -62.2 145.7 71.3 18.0 49.8 49 52 A a - 0 0 33 2,-0.2 4,-0.3 -3,-0.1 -14,-0.1 -0.870 36.8-106.4-130.6 160.1 71.5 21.1 52.0 50 53 A G S S+ 0 0 1 -2,-0.3 -28,-0.3 -16,-0.1 2,-0.2 0.266 70.1 136.3 -73.8 13.1 73.3 24.4 51.7 51 54 A D S S- 0 0 98 1,-0.2 2,-2.9 -29,-0.1 -2,-0.2 -0.477 87.7 -21.0 -63.6 125.1 75.7 23.4 54.4 52 55 A V S > S+ 0 0 68 -2,-0.2 3,-3.3 2,-0.1 4,-0.2 -0.255 86.2 167.5 68.4 -54.8 79.2 24.4 53.2 53 56 A A T 3 S- 0 0 3 -2,-2.9 -33,-0.2 -4,-0.3 -32,-0.1 -0.217 77.5 -17.1 46.7-122.6 78.1 24.6 49.6 54 57 A C T 3 S- 0 0 0 -34,-0.3 -1,-0.3 -35,-0.3 -33,-0.1 0.426 86.1-129.7 -89.0 -0.3 81.1 26.4 47.8 55 58 A D X> + 0 0 29 -3,-3.3 3,-2.1 1,-0.1 4,-2.0 0.789 52.4 155.9 55.7 31.7 82.4 27.6 51.1 56 59 A H H 3> + 0 0 3 -36,-2.5 4,-1.4 1,-0.3 -35,-0.2 0.721 60.8 76.3 -57.5 -23.4 82.5 31.2 49.6 57 60 A F H 34 S+ 0 0 35 -36,-2.3 -1,-0.3 -37,-0.3 -35,-0.1 0.837 111.6 24.9 -58.8 -31.2 82.2 32.4 53.1 58 61 A H H <4 S+ 0 0 90 -3,-2.1 3,-0.3 -37,-0.3 -2,-0.2 0.728 127.0 47.7-102.5 -31.1 85.9 31.5 53.4 59 62 A H H X S+ 0 0 35 -4,-2.0 4,-2.0 1,-0.2 3,-0.3 0.271 73.5 114.2 -96.1 12.5 86.9 31.7 49.8 60 63 A F H X S+ 0 0 35 -4,-1.4 4,-2.8 1,-0.2 5,-0.2 0.843 75.7 50.5 -54.2 -41.0 85.4 35.1 48.9 61 64 A K H > S+ 0 0 105 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.913 112.6 46.6 -65.9 -40.2 88.7 36.9 48.3 62 65 A E H > S+ 0 0 113 -3,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.826 114.2 49.6 -70.6 -28.3 89.9 34.1 45.9 63 66 A D H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.974 109.2 48.2 -72.6 -53.8 86.6 34.2 44.2 64 67 A V H X S+ 0 0 2 -4,-2.8 4,-1.8 1,-0.3 -2,-0.2 0.836 114.8 47.7 -54.2 -35.8 86.4 37.9 43.6 65 68 A Q H X S+ 0 0 99 -4,-1.7 4,-3.1 -5,-0.2 -1,-0.3 0.889 107.2 55.9 -71.5 -39.6 89.9 37.8 42.3 66 69 A L H X S+ 0 0 23 -4,-1.6 4,-1.5 1,-0.2 -2,-0.2 0.873 106.2 52.8 -59.0 -35.0 88.9 34.9 40.1 67 70 A M H <>S+ 0 0 1 -4,-2.2 5,-1.8 2,-0.2 -1,-0.2 0.942 110.0 46.2 -64.4 -49.8 86.2 37.2 38.7 68 71 A K H ><5S+ 0 0 117 -4,-1.8 3,-3.7 1,-0.2 -2,-0.2 0.970 109.3 53.5 -56.9 -56.7 88.8 39.9 37.9 69 72 A Q H 3<5S+ 0 0 146 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.843 107.7 54.4 -46.8 -35.0 91.1 37.4 36.3 70 73 A L T 3<5S- 0 0 6 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.413 121.1-110.5 -82.8 2.1 88.1 36.4 34.2 71 74 A G T < 5 + 0 0 32 -3,-3.7 2,-0.5 1,-0.2 -3,-0.2 0.775 62.0 153.7 76.9 30.4 87.6 40.0 33.1 72 75 A F < - 0 0 4 -5,-1.8 -1,-0.2 1,-0.1 -60,-0.1 -0.783 25.5-179.0 -97.1 128.7 84.4 40.8 34.9 73 76 A L S S+ 0 0 91 -62,-0.8 39,-3.3 -2,-0.5 2,-0.4 0.567 70.5 49.4 -99.4 -9.3 83.6 44.3 35.8 74 77 A H E -cd 12 112B 18 -63,-0.8 -61,-1.3 37,-0.2 2,-0.4 -0.985 56.8-176.1-133.1 142.6 80.3 43.6 37.5 75 78 A Y E -cd 13 113B 1 37,-1.6 39,-1.7 -2,-0.4 2,-0.5 -0.936 8.0-161.9-141.2 113.2 79.3 41.1 40.2 76 79 A R E +cd 14 114B 0 -63,-2.9 -61,-2.1 -2,-0.4 2,-0.3 -0.846 23.0 159.4 -97.7 128.1 75.7 40.7 41.5 77 80 A F E - d 0 115B 4 37,-2.4 39,-2.9 -2,-0.5 2,-0.3 -0.903 29.7-127.2-139.0 165.1 75.4 38.9 44.9 78 81 A S E - d 0 116B 1 -2,-0.3 2,-0.4 37,-0.2 39,-0.2 -0.801 17.4-122.9-116.2 160.0 72.8 38.7 47.6 79 82 A V - 0 0 0 37,-2.1 2,-1.1 -2,-0.3 40,-0.4 -0.849 24.0-123.8-102.0 135.6 72.9 39.3 51.3 80 83 A A >> - 0 0 0 -2,-0.4 3,-2.5 1,-0.2 4,-0.9 -0.691 15.5-157.8 -82.5 103.7 71.9 36.5 53.7 81 84 A W H >> S+ 0 0 0 -2,-1.1 4,-2.7 1,-0.3 3,-1.2 0.871 91.5 62.0 -43.7 -46.3 69.2 38.0 55.8 82 85 A P H 34 S+ 0 0 0 0, 0.0 -52,-1.2 0, 0.0 -1,-0.3 0.693 100.3 54.2 -57.4 -21.9 69.9 35.3 58.5 83 86 A R H <4 S+ 0 0 2 -3,-2.5 12,-0.5 -54,-0.2 13,-0.3 0.723 116.8 36.4 -82.9 -26.4 73.5 36.7 58.8 84 87 A I H << S+ 0 0 0 -3,-1.2 8,-3.0 -4,-0.9 12,-0.1 0.909 129.3 26.8 -92.2 -53.3 72.2 40.2 59.5 85 88 A M < + 0 0 2 -4,-2.7 -1,-0.2 6,-0.2 -2,-0.1 -0.634 66.1 164.6-110.9 70.4 69.0 39.7 61.6 86 89 A P S S+ 0 0 17 0, 0.0 2,-0.3 0, 0.0 39,-0.2 0.653 72.5 5.4 -60.1 -16.3 69.7 36.3 63.3 87 90 A A S > S- 0 0 42 -3,-0.1 3,-0.6 -57,-0.1 4,-0.4 -0.972 110.6 -47.1-159.6 168.6 66.9 37.1 65.7 88 91 A A T 3 S- 0 0 63 -2,-0.3 52,-0.0 1,-0.2 -3,-0.0 -0.194 115.9 -28.2 -47.8 104.7 64.1 39.6 66.4 89 92 A G T 3 S+ 0 0 55 -2,-0.2 -1,-0.2 -4,-0.1 -4,-0.1 0.955 97.6 120.9 48.6 80.1 65.8 43.0 66.1 90 93 A I < - 0 0 70 -3,-0.6 -5,-0.1 -6,-0.1 -2,-0.1 0.581 55.2-142.9-136.5 -32.4 69.4 42.4 67.0 91 94 A I - 0 0 85 -4,-0.4 2,-1.0 1,-0.2 -6,-0.2 0.981 13.9-134.8 60.0 86.9 71.7 43.4 64.1 92 95 A N >> - 0 0 30 -8,-3.0 4,-1.9 1,-0.2 3,-0.6 -0.599 15.4-166.3 -74.6 102.0 74.6 40.9 64.0 93 96 A E H 3> S+ 0 0 88 -2,-1.0 4,-2.5 1,-0.2 -1,-0.2 0.809 86.7 60.5 -57.8 -32.7 77.7 43.1 63.5 94 97 A E H 3> S+ 0 0 119 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.885 104.3 48.1 -63.8 -39.8 79.6 39.9 62.5 95 98 A G H <> S+ 0 0 2 -3,-0.6 4,-1.3 -12,-0.5 3,-0.3 0.934 111.6 50.0 -66.2 -44.9 77.3 39.3 59.6 96 99 A L H X S+ 0 0 5 -4,-1.9 4,-2.1 -13,-0.3 -2,-0.2 0.895 106.0 56.0 -60.4 -41.7 77.6 42.8 58.4 97 100 A L H X S+ 0 0 53 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.855 100.7 60.3 -60.4 -34.6 81.4 42.8 58.6 98 101 A F H X S+ 0 0 13 -4,-1.3 4,-2.1 -3,-0.3 -1,-0.2 0.947 109.0 40.8 -58.5 -50.4 81.5 39.8 56.3 99 102 A Y H X S+ 0 0 1 -4,-1.3 4,-2.8 2,-0.2 -1,-0.2 0.869 111.6 57.8 -67.6 -33.8 79.8 41.7 53.5 100 103 A E H X S+ 0 0 42 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.940 109.6 44.4 -60.2 -46.8 81.8 44.8 54.2 101 104 A H H X S+ 0 0 88 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.880 110.2 55.0 -65.1 -39.0 85.0 42.7 53.7 102 105 A L H X S+ 0 0 2 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.934 110.3 46.8 -58.6 -43.6 83.5 41.2 50.6 103 106 A L H X S+ 0 0 1 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.807 106.2 57.9 -66.9 -32.7 82.9 44.7 49.3 104 107 A D H X S+ 0 0 58 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.889 109.7 45.7 -65.0 -36.2 86.5 45.7 50.2 105 108 A E H X S+ 0 0 32 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.915 111.9 50.5 -72.0 -43.7 87.6 42.9 48.0 106 109 A I H <>S+ 0 0 1 -4,-2.2 5,-2.7 1,-0.2 4,-0.5 0.930 112.9 45.1 -59.9 -49.6 85.3 43.9 45.1 107 110 A E H ><5S+ 0 0 91 -4,-2.7 3,-0.6 1,-0.2 -1,-0.2 0.850 111.0 56.3 -65.9 -30.4 86.3 47.5 45.2 108 111 A L H 3<5S+ 0 0 123 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.826 107.0 47.2 -69.9 -33.2 90.0 46.4 45.4 109 112 A A T 3<5S- 0 0 15 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.476 119.7-110.6 -86.7 -2.0 89.7 44.3 42.2 110 113 A G T < 5 + 0 0 43 -3,-0.6 2,-0.3 -4,-0.5 -3,-0.2 0.878 67.0 147.4 77.1 37.3 88.0 47.2 40.5 111 114 A L < - 0 0 12 -5,-2.7 -1,-0.2 -6,-0.1 -37,-0.2 -0.772 46.3-132.1-108.3 156.4 84.6 45.6 40.2 112 115 A I E -d 74 0B 48 -39,-3.3 -37,-1.6 -2,-0.3 2,-0.1 -0.920 30.1-149.9-107.0 112.2 81.2 47.2 40.2 113 116 A P E -d 75 0B 3 0, 0.0 45,-0.9 0, 0.0 44,-0.4 -0.376 16.2-160.6 -85.6 160.3 78.7 45.4 42.6 114 117 A M E -de 76 158B 2 -39,-1.7 -37,-2.4 43,-0.1 2,-0.5 -0.975 16.7-150.9-137.2 116.7 75.0 44.9 42.7 115 118 A L E -de 77 159B 0 43,-2.0 45,-2.9 -2,-0.4 2,-0.6 -0.833 2.5-154.8 -97.1 124.4 73.6 43.9 46.0 116 119 A T E -de 78 160B 0 -39,-2.9 -37,-2.1 -2,-0.5 45,-0.2 -0.895 1.8-159.7-100.3 118.5 70.4 41.8 46.0 117 120 A L E S+ 0 0 1 43,-2.7 2,-0.5 -2,-0.6 -36,-0.2 0.936 74.6 27.0 -66.7 -49.9 68.5 42.3 49.2 118 121 A Y E + e 0 162B 2 43,-2.2 45,-2.0 42,-0.2 -1,-0.2 -0.923 51.4 163.5-125.5 118.1 66.4 39.1 49.2 119 122 A H S S- 0 0 2 -2,-0.5 -101,-0.3 -40,-0.4 -1,-0.1 -0.318 72.0 -82.2-123.8 50.9 67.3 35.9 47.5 120 123 A W S S+ 0 0 13 43,-0.1 2,-1.6 1,-0.1 -87,-0.1 0.209 95.5 118.2 76.4 -10.1 64.9 33.4 49.2 121 124 A D + 0 0 0 -42,-0.2 -40,-0.1 -88,-0.1 -1,-0.1 -0.372 42.2 178.5 -87.7 62.6 66.8 32.8 52.4 122 125 A L - 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