==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-APR-08 2VRJ . COMPND 2 MOLECULE: BETA-GLUCOSIDASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR M.AGUILAR,T.M.GLOSTER,M.I.GARCIA-MORENO,C.ORTIZ MELLET,G.J.D . 881 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32717.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 678 77.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 106 12.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 . 68 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 105 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 286 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.6 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 8 0 2 2 0 4 1 0 2 1 2 2 4 0 0 2 0 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 3 7 4 1 0 0 0 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 . 7 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 1 0 0 0 1 0 0 1 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 0 154 0, 0.0 2,-0.5 0, 0.0 439,-0.2 0.000 360.0 360.0 360.0 143.8 -25.9 24.1 19.9 2 4 A K E -A 439 0A 87 437,-2.3 437,-1.8 2,-0.0 2,-0.4 -0.884 360.0-173.8-125.0 95.8 -22.2 23.7 20.7 3 5 A K E -A 438 0A 77 -2,-0.5 435,-0.2 435,-0.2 434,-0.1 -0.773 12.7-142.1 -96.1 137.3 -20.5 27.1 20.1 4 6 A F - 0 0 8 433,-3.1 3,-0.1 -2,-0.4 374,-0.0 -0.382 36.9 -74.6 -89.9 169.9 -16.7 27.3 20.3 5 7 A P > - 0 0 58 0, 0.0 3,-2.0 0, 0.0 -1,-0.2 -0.258 60.1 -86.6 -61.5 152.2 -14.7 30.3 21.7 6 8 A E T 3 S+ 0 0 104 1,-0.2 431,-0.0 -3,-0.1 -3,-0.0 -0.357 117.3 16.6 -53.7 135.5 -14.4 33.6 19.7 7 9 A G T 3 S+ 0 0 70 1,-0.2 -1,-0.2 -3,-0.1 430,-0.0 0.464 83.4 162.2 74.6 2.2 -11.4 33.3 17.3 8 10 A F < - 0 0 5 -3,-2.0 2,-0.7 1,-0.1 -1,-0.2 -0.295 41.7-121.0 -47.7 133.1 -11.2 29.5 17.6 9 11 A L E -b 389 0B 23 379,-2.7 381,-2.4 63,-0.0 2,-0.6 -0.737 26.9-169.8 -93.8 113.5 -9.1 28.3 14.7 10 12 A W E +b 390 0B 0 -2,-0.7 63,-1.3 379,-0.2 62,-1.3 -0.864 25.6 156.5 -97.9 124.8 -10.8 25.8 12.3 11 13 A G E -bc 391 73B 0 379,-3.0 381,-2.3 -2,-0.6 2,-0.3 -0.761 37.2-133.3-136.1-177.9 -8.4 24.3 9.9 12 14 A V E -bc 392 74B 0 61,-1.2 63,-3.0 379,-0.3 2,-0.3 -0.923 24.4-144.2-130.5 164.0 -7.5 21.5 7.6 13 15 A A E +bc 393 75B 0 379,-2.5 382,-1.1 -2,-0.3 381,-0.7 -0.969 20.7 164.2-136.6 147.9 -4.1 19.7 7.3 14 16 A T - 0 0 1 61,-2.2 2,-0.3 -2,-0.3 384,-0.0 -0.841 24.6-133.2-142.8 176.0 -1.9 18.1 4.6 15 17 A A > - 0 0 0 -2,-0.3 4,-1.2 61,-0.2 3,-0.4 -0.985 23.6-119.9-139.5 143.2 1.8 17.0 4.3 16 18 A S H >> S+ 0 0 1 -2,-0.3 4,-2.6 1,-0.2 3,-0.6 0.865 108.5 43.3 -50.3 -55.2 4.2 17.8 1.4 17 19 A Y H 34 S+ 0 0 11 102,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.793 110.8 58.5 -68.7 -24.1 5.0 14.3 0.2 18 20 A Q H 34 S+ 0 0 1 -3,-0.4 381,-2.4 1,-0.1 -1,-0.2 0.808 124.8 12.1 -76.6 -26.9 1.4 13.2 0.5 19 21 A I H << S+ 0 0 2 -4,-1.2 36,-2.2 -3,-0.6 34,-0.8 0.664 110.1 71.8-120.6 -27.5 -0.0 15.8 -1.9 20 22 A E < - 0 0 6 -4,-2.6 36,-2.4 -5,-0.3 37,-0.4 0.906 59.6-176.0 -69.5 -47.4 2.7 17.6 -3.9 21 23 A G + 0 0 2 -5,-0.3 30,-0.3 -4,-0.3 29,-0.2 -0.238 55.0 86.2 65.7-171.7 4.1 15.2 -6.5 22 24 A S > + 0 0 35 28,-2.7 3,-1.8 1,-0.1 28,-0.1 0.882 53.5 174.4 48.6 48.3 7.0 16.4 -8.6 23 25 A P T 3 S+ 0 0 24 0, 0.0 -1,-0.1 0, 0.0 27,-0.1 0.762 76.5 37.1 -56.9 -29.4 9.5 15.3 -5.8 24 26 A L T > S+ 0 0 86 26,-0.1 3,-0.6 3,-0.1 -2,-0.1 0.272 89.0 127.7-110.1 11.1 12.5 16.2 -8.0 25 27 A A G X S+ 0 0 29 -3,-1.8 3,-1.8 1,-0.2 -4,-0.0 -0.293 70.9 7.5 -66.5 149.6 11.2 19.3 -9.7 26 28 A D G 3 S- 0 0 74 1,-0.3 -1,-0.2 2,-0.0 68,-0.1 0.839 135.0 -47.9 50.9 47.5 13.1 22.6 -9.8 27 29 A G G < S+ 0 0 44 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.479 88.6 158.0 79.9 5.3 16.3 21.4 -8.2 28 30 A A < - 0 0 12 -3,-1.8 54,-0.3 -4,-0.1 -1,-0.2 -0.309 37.5-128.8 -61.4 143.3 14.8 19.5 -5.2 29 31 A G - 0 0 14 52,-2.3 57,-0.1 1,-0.1 -4,-0.1 -0.525 35.0 -90.1 -82.1 160.1 17.0 16.7 -3.7 30 32 A M - 0 0 76 -2,-0.2 94,-2.8 55,-0.1 95,-0.5 -0.385 40.1-145.6 -64.5 147.5 15.5 13.2 -3.2 31 33 A S B > -M 123 0C 7 92,-0.3 4,-1.9 93,-0.1 3,-0.2 -0.688 27.6-107.3-102.0 169.1 13.8 12.5 0.1 32 34 A I H > S+ 0 0 4 90,-2.3 4,-2.2 -2,-0.2 5,-0.2 0.721 121.7 57.9 -67.5 -21.5 13.8 9.2 2.0 33 35 A W H > S+ 0 0 2 89,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.839 103.1 52.6 -77.6 -30.1 10.2 8.8 1.0 34 36 A H H > S+ 0 0 23 -3,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.964 116.6 38.1 -58.1 -53.7 11.2 9.0 -2.7 35 37 A T H < S+ 0 0 32 -4,-1.9 -2,-0.2 2,-0.2 4,-0.2 0.904 117.2 50.6 -69.9 -39.6 13.8 6.3 -2.3 36 38 A F H >< S+ 0 0 11 -4,-2.2 3,-1.2 1,-0.2 6,-0.3 0.939 113.1 45.4 -61.7 -48.4 11.7 4.2 0.1 37 39 A S H 3< S+ 0 0 6 -4,-2.1 -1,-0.2 1,-0.3 6,-0.2 0.761 109.4 56.1 -69.3 -24.5 8.6 4.2 -2.2 38 40 A H T 3< S+ 0 0 83 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.389 88.0 93.2 -88.0 4.6 10.8 3.5 -5.2 39 41 A T S X S- 0 0 71 -3,-1.2 3,-1.6 -4,-0.2 4,-0.3 -0.881 88.6-114.2 -95.2 119.6 12.0 0.3 -3.5 40 42 A P T 3 S+ 0 0 122 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.244 95.9 23.7 -55.9 139.7 9.8 -2.7 -4.5 41 43 A G T 3 S+ 0 0 82 2,-0.3 3,-0.1 -4,-0.1 -4,-0.1 0.242 96.6 93.5 93.9 -13.0 7.8 -4.2 -1.7 42 44 A N S < S+ 0 0 50 -3,-1.6 2,-0.4 -6,-0.3 -5,-0.1 0.755 83.9 39.5 -85.6 -29.1 7.6 -1.1 0.6 43 45 A V S > S- 0 0 10 -4,-0.3 3,-2.2 -6,-0.2 -2,-0.3 -0.990 92.9 -98.7-129.6 133.3 4.3 0.5 -0.6 44 46 A K G > S+ 0 0 42 358,-2.7 3,-1.9 -2,-0.4 361,-0.2 -0.176 106.7 2.0 -44.9 132.5 1.0 -1.2 -1.5 45 47 A N G 3 S- 0 0 131 1,-0.3 -1,-0.3 359,-0.1 358,-0.1 0.613 119.6 -80.2 61.6 14.1 0.6 -1.5 -5.3 46 48 A G G < S+ 0 0 58 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.751 80.2 169.6 65.4 24.9 4.0 0.0 -5.9 47 49 A D < - 0 0 35 -3,-1.9 2,-0.3 -4,-0.1 -1,-0.2 -0.353 9.2-177.9 -69.5 149.2 2.5 3.5 -5.3 48 50 A T - 0 0 25 -10,-0.1 4,-0.5 4,-0.0 3,-0.4 -0.863 40.4-110.9-134.7 173.9 4.8 6.5 -5.0 49 51 A G S S+ 0 0 1 -2,-0.3 -28,-0.3 -16,-0.2 4,-0.1 0.132 79.4 115.6 -91.7 22.3 4.5 10.2 -4.3 50 52 A D S S+ 0 0 60 -29,-0.2 -28,-2.7 -28,-0.1 -1,-0.2 0.882 98.9 0.4 -55.3 -42.4 5.7 11.0 -7.9 51 53 A V S > S+ 0 0 86 -3,-0.4 3,-2.9 -30,-0.3 4,-0.2 0.740 82.8 154.7-114.7 -46.8 2.4 12.6 -8.8 52 54 A A T 3 S- 0 0 3 -4,-0.5 -33,-0.2 1,-0.3 -32,-0.1 -0.260 85.8 -23.8 53.0-128.1 0.1 12.3 -5.7 53 55 A C T 3 S- 0 0 0 -34,-0.8 -1,-0.3 -35,-0.1 -33,-0.1 0.242 83.7-122.6 -91.6 11.3 -2.5 15.2 -6.0 54 56 A D X> + 0 0 21 -3,-2.9 4,-2.1 1,-0.1 3,-1.7 0.824 59.3 153.4 48.0 33.1 -0.2 17.2 -8.2 55 57 A H H 3> + 0 0 3 -36,-2.2 4,-1.2 1,-0.3 -35,-0.2 0.810 59.5 75.0 -61.2 -24.5 -0.5 20.0 -5.6 56 58 A Y H 34 S+ 0 0 16 -36,-2.4 -1,-0.3 -37,-0.3 -35,-0.1 0.850 115.0 21.6 -56.9 -32.9 2.9 21.2 -6.8 57 59 A N H <4 S+ 0 0 104 -3,-1.7 3,-0.3 -37,-0.4 -2,-0.2 0.714 127.6 48.9-100.0 -26.2 1.0 22.5 -9.8 58 60 A R H X S+ 0 0 84 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.182 71.1 115.9-104.6 15.6 -2.6 22.8 -8.5 59 61 A W H X S+ 0 0 37 -4,-1.2 4,-2.2 1,-0.2 5,-0.2 0.823 74.1 53.9 -57.6 -40.1 -1.8 24.7 -5.2 60 62 A K H > S+ 0 0 113 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.961 110.5 46.9 -62.4 -49.2 -3.7 27.8 -6.3 61 63 A E H > S+ 0 0 72 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.941 111.8 51.0 -54.6 -51.9 -6.9 25.7 -7.0 62 64 A D H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.883 110.9 47.1 -56.5 -42.2 -6.5 23.8 -3.7 63 65 A I H X S+ 0 0 0 -4,-2.2 4,-3.2 2,-0.2 -1,-0.2 0.882 107.3 57.2 -67.1 -39.6 -6.2 27.1 -1.6 64 66 A E H X S+ 0 0 69 -4,-2.3 4,-3.3 2,-0.2 -2,-0.2 0.877 105.7 52.8 -59.4 -34.9 -9.2 28.5 -3.5 65 67 A I H X S+ 0 0 22 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.944 108.9 46.7 -60.9 -51.1 -11.1 25.4 -2.2 66 68 A I H X>S+ 0 0 1 -4,-1.9 5,-1.8 2,-0.2 4,-0.5 0.943 116.0 47.1 -52.3 -52.0 -10.0 26.2 1.4 67 69 A E H ><5S+ 0 0 83 -4,-3.2 3,-1.7 1,-0.2 -2,-0.2 0.941 110.9 50.2 -54.7 -53.4 -11.0 29.9 0.8 68 70 A K H 3<5S+ 0 0 189 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.857 110.0 51.2 -59.2 -33.3 -14.4 28.9 -0.7 69 71 A L H 3<5S- 0 0 9 -4,-2.4 -1,-0.3 -5,-0.2 366,-0.2 0.575 109.7-126.1 -79.2 -9.1 -15.1 26.6 2.3 70 72 A G T <<5 + 0 0 40 -3,-1.7 -3,-0.2 -4,-0.5 -2,-0.1 0.683 48.3 166.7 72.8 16.7 -14.3 29.5 4.6 71 73 A V < - 0 0 4 -5,-1.8 -1,-0.2 -6,-0.2 -60,-0.2 -0.441 27.1-150.7 -68.2 138.2 -11.8 27.3 6.4 72 74 A K + 0 0 85 -62,-1.3 40,-3.0 39,-0.1 2,-0.3 0.691 67.3 28.3 -92.6 -20.1 -9.7 29.6 8.7 73 75 A A E -cd 11 112B 0 -63,-1.3 -61,-1.2 38,-0.3 2,-0.5 -0.973 58.7-154.3-141.2 148.1 -6.2 27.9 8.9 74 76 A Y E -cd 12 113B 2 38,-2.5 40,-2.5 -2,-0.3 2,-0.6 -0.980 6.6-159.0-128.7 117.3 -4.2 25.6 6.7 75 77 A R E +cd 13 114B 0 -63,-3.0 -61,-2.2 -2,-0.5 2,-0.3 -0.868 27.6 157.9 -91.7 119.0 -1.7 23.3 8.2 76 78 A F E - d 0 115B 5 38,-2.1 40,-2.8 -2,-0.6 2,-0.3 -0.930 30.7-129.7-137.9 159.7 0.9 22.3 5.6 77 79 A S E - d 0 116B 2 -2,-0.3 2,-0.4 38,-0.2 40,-0.2 -0.792 14.0-128.1-113.2 158.4 4.4 20.9 5.7 78 80 A I - 0 0 0 38,-1.9 2,-0.9 -2,-0.3 41,-0.4 -0.878 20.6-124.1-103.4 133.8 7.5 22.0 3.9 79 81 A S >> - 0 0 9 -2,-0.4 3,-1.4 1,-0.2 4,-1.2 -0.671 17.3-154.8 -74.9 106.5 9.7 19.5 2.0 80 82 A W H >> S+ 0 0 0 -2,-0.9 4,-3.1 1,-0.3 3,-0.9 0.897 91.9 53.4 -48.8 -50.0 13.2 19.9 3.5 81 83 A P H 34 S+ 0 0 1 0, 0.0 -52,-2.3 0, 0.0 -1,-0.3 0.683 101.6 58.8 -72.2 -8.9 15.0 18.7 0.3 82 84 A R H <4 S+ 0 0 7 -3,-1.4 13,-0.4 -54,-0.3 14,-0.2 0.836 115.8 37.0 -73.2 -30.0 13.2 21.2 -1.8 83 85 A I H << S+ 0 0 0 -4,-1.2 9,-3.0 -3,-0.9 13,-0.2 0.922 136.9 16.7 -86.7 -49.0 14.7 23.9 0.4 84 86 A L S >< S- 0 0 0 -4,-3.1 3,-2.2 7,-0.2 -1,-0.3 -0.896 70.2-167.9-128.5 96.2 18.2 22.3 1.0 85 87 A P T 3 S+ 0 0 4 0, 0.0 40,-0.4 0, 0.0 39,-0.1 0.767 91.7 39.8 -63.8 -25.7 18.6 19.6 -1.6 86 88 A E T 3 S- 0 0 100 4,-0.4 2,-0.8 2,-0.3 5,-0.1 0.203 116.5-112.7-100.3 8.0 21.7 18.2 0.2 87 89 A G S < S+ 0 0 0 -3,-2.2 2,-0.3 -7,-0.2 57,-0.1 -0.224 94.2 30.6 92.1 -49.4 20.1 18.7 3.6 88 90 A T S S+ 0 0 44 -2,-0.8 2,-0.7 55,-0.1 -2,-0.3 -0.889 108.1 24.9-132.2 166.4 22.6 21.3 4.7 89 91 A G S S+ 0 0 50 -2,-0.3 -2,-0.0 -4,-0.1 0, 0.0 -0.727 96.3 63.1 87.7-114.6 24.5 24.0 2.9 90 92 A R - 0 0 130 -2,-0.7 2,-0.5 1,-0.1 -4,-0.4 -0.180 65.5-151.0 -57.4 133.2 23.0 25.1 -0.5 91 93 A V - 0 0 58 -7,-0.2 2,-0.8 -6,-0.1 -7,-0.2 -0.920 9.3-139.9-105.3 130.7 19.5 26.7 -0.3 92 94 A N >> - 0 0 18 -9,-3.0 4,-1.9 -2,-0.5 3,-1.0 -0.811 8.5-163.9 -95.2 106.4 17.3 26.3 -3.4 93 95 A Q H 3> S+ 0 0 99 -2,-0.8 4,-3.2 1,-0.3 -1,-0.2 0.831 89.6 58.4 -62.3 -33.5 15.4 29.5 -4.2 94 96 A K H 3> S+ 0 0 117 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.815 105.9 50.7 -65.4 -28.7 12.8 27.7 -6.4 95 97 A G H <> S+ 0 0 2 -3,-1.0 4,-1.4 -13,-0.4 -2,-0.2 0.906 112.7 44.7 -73.0 -44.5 11.9 25.6 -3.4 96 98 A L H X S+ 0 0 1 -4,-1.9 4,-2.8 -14,-0.2 -2,-0.2 0.910 110.3 56.7 -62.7 -40.6 11.5 28.7 -1.2 97 99 A D H X S+ 0 0 60 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.889 102.4 55.6 -56.7 -46.3 9.6 30.3 -4.1 98 100 A F H X S+ 0 0 0 -4,-1.8 4,-1.3 1,-0.2 -1,-0.2 0.937 115.0 36.7 -54.2 -53.9 7.0 27.4 -4.1 99 101 A Y H X S+ 0 0 1 -4,-1.4 4,-2.8 2,-0.2 5,-0.2 0.835 110.9 61.6 -69.5 -31.5 6.1 27.9 -0.4 100 102 A N H X S+ 0 0 27 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.915 104.5 49.0 -59.5 -42.7 6.4 31.7 -0.6 101 103 A R H X S+ 0 0 105 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.884 112.2 48.6 -64.2 -39.8 3.5 31.8 -3.2 102 104 A I H X S+ 0 0 2 -4,-1.3 4,-2.6 -5,-0.2 -2,-0.2 0.929 113.5 46.1 -64.0 -48.8 1.4 29.5 -1.0 103 105 A I H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.922 114.1 47.2 -60.7 -45.7 2.0 31.6 2.1 104 106 A D H X S+ 0 0 60 -4,-2.7 4,-3.0 -5,-0.2 -1,-0.2 0.912 112.7 50.2 -66.9 -40.2 1.3 34.9 0.3 105 107 A T H X S+ 0 0 17 -4,-2.2 4,-1.4 -5,-0.2 -1,-0.2 0.910 110.4 49.3 -60.2 -48.5 -1.8 33.5 -1.2 106 108 A L H <>S+ 0 0 0 -4,-2.6 5,-2.8 2,-0.2 3,-0.3 0.928 113.7 46.1 -55.3 -50.8 -3.1 32.2 2.1 107 109 A L H ><5S+ 0 0 66 -4,-2.4 3,-2.0 1,-0.2 -2,-0.2 0.931 109.3 54.1 -60.5 -49.0 -2.5 35.6 3.8 108 110 A E H 3<5S+ 0 0 159 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.817 112.6 46.6 -50.0 -31.8 -4.1 37.5 0.8 109 111 A K T 3<5S- 0 0 63 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.222 117.3-111.4-101.2 11.4 -7.2 35.3 1.4 110 112 A G T < 5S+ 0 0 64 -3,-2.0 2,-0.4 1,-0.2 -3,-0.2 0.763 71.0 138.3 63.1 29.7 -7.3 35.7 5.2 111 113 A I < - 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