==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-FEB-12 4DM1 . COMPND 2 MOLECULE: 458AA LONG HYPOTHETICAL ENDO-1,4-BETA-GLUCANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR H.-W.KIM,K.ISHIKAWA . 1131 3 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38621.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 786 69.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 122 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 53 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 86 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 153 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 272 24.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 1.9 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 7 1 0 1 4 0 3 1 0 0 3 7 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 11 2 12 3 0 0 3 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 . 9 0 1 2 0 3 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 3 0 0 0 0 0 2 1 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 34 A Q 0 0 163 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -35.2 26.6 24.1 43.5 2 35 A T - 0 0 30 210,-0.1 3,-0.3 5,-0.1 5,-0.1 -0.857 360.0-155.9-166.7 128.9 23.2 23.3 45.3 3 36 A P S S+ 0 0 82 0, 0.0 155,-0.1 0, 0.0 4,-0.1 0.658 102.1 43.1 -79.0 -9.9 19.5 24.2 45.1 4 37 A T S S- 0 0 40 2,-0.4 3,-0.1 151,-0.1 154,-0.1 0.567 108.8-113.5-103.9 -12.3 18.9 23.4 48.7 5 38 A G S S+ 0 0 21 -3,-0.3 15,-2.8 1,-0.3 16,-0.4 0.266 89.7 100.6 90.3 -8.4 22.0 25.0 50.4 6 39 A I E -A 19 0A 26 13,-0.2 2,-0.4 14,-0.1 -2,-0.4 -0.902 51.9-170.5-112.6 134.7 23.2 21.5 51.3 7 40 A Y E -A 18 0A 27 11,-2.8 11,-2.6 -2,-0.4 2,-0.4 -0.992 9.9-150.2-128.0 129.4 25.9 19.7 49.3 8 41 A Y E +A 17 0A 0 205,-2.2 2,-0.3 -2,-0.4 9,-0.2 -0.786 26.0 160.6-100.3 139.7 26.8 16.1 49.9 9 42 A E E -A 16 0A 18 7,-2.2 7,-3.4 -2,-0.4 2,-0.5 -0.993 37.8-120.0-152.1 151.9 30.3 14.8 49.2 10 43 A V E -A 15 0A 10 247,-2.7 2,-0.5 -2,-0.3 5,-0.2 -0.888 24.9-176.4 -91.8 126.7 32.7 12.0 49.9 11 44 A R E > S-A 14 0A 105 3,-2.6 3,-1.8 -2,-0.5 2,-0.6 -0.985 73.0 -28.2-122.8 123.1 36.0 13.0 51.7 12 45 A G T 3 S- 0 0 34 -2,-0.5 292,-0.2 1,-0.2 -2,-0.1 -0.724 125.6 -43.0 70.1-116.2 38.3 10.1 52.2 13 46 A D T 3 S+ 0 0 19 -2,-0.6 292,-0.4 290,-0.2 2,-0.4 0.054 118.8 99.1-122.6 22.1 35.8 7.3 52.3 14 47 A T E < S-A 11 0A 21 -3,-1.8 -3,-2.6 290,-0.1 2,-0.4 -0.858 71.9-124.0-114.3 137.0 33.3 9.1 54.6 15 48 A I E -AB 10 28A 0 13,-0.5 13,-3.0 -2,-0.4 2,-0.4 -0.708 29.0-164.2 -80.3 133.9 30.1 10.9 53.4 16 49 A Y E -AB 9 27A 30 -7,-3.4 -7,-2.2 -2,-0.4 2,-0.6 -0.922 15.9-147.0-114.6 148.5 29.9 14.6 54.5 17 50 A M E -AB 8 26A 39 9,-2.8 9,-1.6 -2,-0.4 2,-0.5 -0.956 23.2-163.9-112.5 124.5 26.9 16.9 54.6 18 51 A I E -AB 7 25A 15 -11,-2.6 -11,-2.8 -2,-0.6 2,-0.7 -0.912 18.0-150.4-117.1 128.0 28.1 20.5 53.8 19 52 A N E > -A 6 0A 62 5,-3.0 4,-2.1 -2,-0.5 5,-0.3 -0.896 17.1-156.8 -92.3 112.3 26.1 23.6 54.5 20 53 A V T 4 S+ 0 0 58 -15,-2.8 -1,-0.1 -2,-0.7 -14,-0.1 0.813 83.2 49.0 -72.7 -24.9 27.5 25.8 51.7 21 54 A T T 4 S+ 0 0 130 -16,-0.4 -1,-0.2 1,-0.1 -15,-0.1 0.947 120.1 33.6 -72.8 -51.9 26.6 29.2 53.3 22 55 A S T 4 S- 0 0 60 2,-0.1 -2,-0.2 1,-0.1 -1,-0.1 0.731 99.1-131.5 -81.0 -20.3 28.0 28.6 56.7 23 56 A G < + 0 0 48 -4,-2.1 -3,-0.1 1,-0.3 2,-0.1 0.445 54.2 150.6 88.3 -7.9 30.9 26.4 55.5 24 57 A E - 0 0 135 -5,-0.3 -5,-3.0 -6,-0.1 2,-0.4 -0.451 25.3-169.4 -70.6 144.1 30.0 23.8 58.2 25 58 A E E -B 18 0A 84 -7,-0.2 -7,-0.2 -2,-0.1 -9,-0.0 -0.941 7.2-178.6-132.8 139.3 30.7 20.1 57.4 26 59 A T E -B 17 0A 74 -9,-1.6 -9,-2.8 -2,-0.4 2,-0.2 -0.977 26.8-128.0-138.2 132.9 29.6 17.1 59.4 27 60 A P E -B 16 0A 62 0, 0.0 2,-0.4 0, 0.0 -11,-0.3 -0.536 32.0-158.5 -72.8 138.1 30.4 13.5 58.6 28 61 A I E -B 15 0A 12 -13,-3.0 -13,-0.5 -2,-0.2 2,-0.4 -0.926 12.2-153.0-119.1 153.6 27.3 11.4 58.5 29 62 A H - 0 0 75 -2,-0.4 2,-0.7 -15,-0.1 311,-0.2 -0.907 17.0-135.8-116.9 143.3 26.7 7.7 58.8 30 63 A L - 0 0 0 -2,-0.4 311,-2.7 309,-0.1 2,-1.0 -0.894 19.9-178.7-102.9 111.7 23.7 6.1 57.1 31 64 A F E +c 341 0B 35 -2,-0.7 35,-2.2 309,-0.2 36,-1.2 -0.843 36.3 176.2-103.8 95.2 21.9 3.7 59.4 32 65 A G E -cd 342 67B 0 309,-2.2 311,-2.6 -2,-1.0 2,-0.3 -0.578 35.6-164.9-114.1 164.4 19.3 2.7 56.8 33 66 A V E -cd 343 68B 0 34,-1.5 36,-2.3 309,-0.3 2,-0.5 -0.976 24.8-126.1-138.5 148.2 16.4 0.6 55.9 34 67 A N E - d 0 69B 0 309,-2.4 312,-3.3 -2,-0.3 313,-0.6 -0.850 20.2-171.7 -87.1 124.9 14.8 -0.2 52.5 35 68 A W - 0 0 0 34,-1.8 3,-0.3 -2,-0.5 2,-0.2 -0.947 20.1-169.3-117.8 105.2 11.0 0.5 52.5 36 69 A F + 0 0 14 -2,-0.6 10,-2.5 1,-0.2 36,-0.1 -0.506 44.1 93.9 -99.8 162.1 9.9 -0.9 49.2 37 70 A G > + 0 0 0 8,-0.3 3,-1.8 -2,-0.2 7,-1.1 -0.018 64.6 84.5 152.6 -40.5 6.7 -0.7 47.2 38 71 A F T 3 S+ 0 0 1 33,-0.5 35,-1.4 -3,-0.3 38,-0.3 0.637 93.6 54.0 -60.5 -15.8 7.1 2.2 44.8 39 72 A E T 3 S+ 0 0 3 33,-0.3 -1,-0.3 32,-0.1 33,-0.1 0.325 102.0 76.9 -98.2 4.9 8.8 -0.2 42.4 40 73 A T S X S- 0 0 9 -3,-1.8 3,-2.4 31,-0.1 87,-0.2 -0.615 100.0 -93.7-115.0 172.5 5.8 -2.6 42.5 41 74 A P T 3 S+ 0 0 77 0, 0.0 43,-0.1 0, 0.0 86,-0.1 0.775 121.1 68.0 -60.8 -19.0 2.3 -2.9 41.0 42 75 A N T 3 S- 0 0 35 -5,-0.2 42,-2.1 84,-0.1 -4,-0.1 0.795 90.2-151.7 -63.7 -28.3 1.1 -1.2 44.2 43 76 A H < + 0 0 30 -3,-2.4 2,-0.3 -6,-0.6 -5,-0.3 0.829 67.2 73.6 57.0 32.0 2.9 2.0 43.2 44 77 A V S S- 0 0 0 -7,-1.1 -1,-0.1 40,-0.1 -2,-0.1 -0.958 99.0 -80.0-162.8 148.9 3.3 2.9 46.8 45 78 A V > - 0 0 1 -2,-0.3 3,-0.6 -8,-0.2 -8,-0.3 -0.304 60.7-108.6 -48.2 141.0 5.4 1.7 49.7 46 79 A H T 3 S+ 0 0 12 -10,-2.5 -1,-0.1 1,-0.2 -8,-0.1 -0.198 90.3 49.6 -73.2 159.6 3.9 -1.5 51.1 47 80 A G T >> + 0 0 0 38,-0.2 4,-2.2 -10,-0.1 3,-2.1 0.315 64.4 115.1 99.6 -11.7 2.0 -1.8 54.4 48 81 A L T <4 + 0 0 0 -3,-0.6 39,-2.9 1,-0.3 42,-0.2 0.430 68.8 70.0 -75.0 -0.2 -0.4 1.1 54.2 49 82 A W T 34 S+ 0 0 94 37,-0.3 -1,-0.3 41,-0.1 37,-0.1 0.597 116.6 23.3 -79.5 -9.6 -3.2 -1.5 54.2 50 83 A K T <4 S+ 0 0 85 -3,-2.1 2,-0.3 1,-0.2 -2,-0.2 0.605 125.6 39.0-123.8 -24.6 -2.3 -2.1 57.9 51 84 A R S < S- 0 0 32 -4,-2.2 2,-0.3 40,-0.0 36,-0.2 -0.903 76.0-106.9-133.7 156.7 -0.5 1.1 59.0 52 85 A N > - 0 0 31 -2,-0.3 4,-2.1 1,-0.1 39,-0.1 -0.659 32.7-131.2 -73.1 135.2 -0.5 4.8 58.8 53 86 A W H > S+ 0 0 4 -2,-0.3 4,-1.7 1,-0.2 -1,-0.1 0.864 106.0 46.6 -61.3 -38.0 2.4 6.1 56.7 54 87 A E H > S+ 0 0 56 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.911 108.6 54.4 -73.3 -41.5 3.5 8.6 59.2 55 88 A D H > S+ 0 0 84 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.874 106.5 55.3 -55.3 -38.4 3.4 6.2 62.1 56 89 A M H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.944 107.5 46.6 -60.0 -47.8 5.6 3.9 60.0 57 90 A L H X S+ 0 0 0 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.861 111.8 52.0 -65.6 -35.8 8.3 6.6 59.7 58 91 A L H X S+ 0 0 79 -4,-2.3 4,-3.1 2,-0.2 -1,-0.2 0.913 109.7 49.9 -64.5 -39.7 8.0 7.4 63.4 59 92 A Q H X S+ 0 0 36 -4,-2.5 4,-0.9 2,-0.2 -2,-0.2 0.921 109.7 50.3 -64.7 -44.2 8.6 3.7 64.1 60 93 A I H ><>S+ 0 0 0 -4,-2.8 5,-1.5 1,-0.2 3,-1.1 0.964 113.9 45.3 -57.9 -45.6 11.6 3.6 61.8 61 94 A K H ><5S+ 0 0 70 -4,-2.5 3,-2.1 1,-0.2 -2,-0.2 0.911 104.6 62.3 -64.2 -42.8 13.1 6.7 63.6 62 95 A S H 3<5S+ 0 0 93 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.727 100.2 55.2 -54.6 -23.2 12.3 5.2 67.1 63 96 A L T <<5S- 0 0 21 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.383 124.0-101.5 -95.6 5.2 14.6 2.3 66.3 64 97 A G T < 5S+ 0 0 34 -3,-2.1 -3,-0.2 1,-0.3 2,-0.1 0.458 72.7 142.6 91.9 1.8 17.6 4.6 65.5 65 98 A F < + 0 0 0 -5,-1.5 -1,-0.3 1,-0.1 -33,-0.2 -0.474 23.2 177.8 -68.5 144.7 17.5 4.5 61.7 66 99 A N + 0 0 30 -35,-2.2 50,-2.5 1,-0.1 2,-0.3 0.191 60.8 55.5-128.6 16.7 18.4 7.9 60.1 67 100 A A E -de 32 116B 0 -36,-1.2 -34,-1.5 48,-0.3 2,-0.4 -0.999 55.3-165.4-152.6 145.0 18.2 6.8 56.4 68 101 A I E -de 33 117B 2 48,-2.6 50,-2.5 -2,-0.3 2,-0.5 -0.999 12.9-149.0-131.0 129.8 15.7 5.2 54.0 69 102 A R E -de 34 118B 0 -36,-2.3 -34,-1.8 -2,-0.4 50,-0.2 -0.904 18.5-158.8 -94.6 127.1 16.4 3.7 50.6 70 103 A L E - e 0 119B 2 48,-2.8 50,-2.3 -2,-0.5 -34,-0.1 -0.895 1.2-154.3-116.0 98.4 13.3 4.2 48.5 71 104 A P E + e 0 120B 0 0, 0.0 -33,-0.5 0, 0.0 2,-0.3 -0.419 20.8 176.6 -69.1 143.6 13.0 1.8 45.4 72 105 A F E - e 0 121B 0 48,-2.0 50,-1.9 -34,-0.1 51,-1.2 -0.970 20.8-144.4-140.5 160.6 10.9 3.2 42.6 73 106 A a E >> - e 0 123B 0 -35,-1.4 4,-1.0 -2,-0.3 3,-0.6 -0.801 38.0 -99.2-117.9 169.6 9.9 2.2 39.0 74 107 A T G >4 S+ 0 0 15 50,-0.9 3,-1.0 49,-0.7 4,-0.2 0.918 119.3 52.2 -54.0 -43.4 9.4 4.4 36.0 75 108 A E G >4 S+ 0 0 105 49,-0.4 3,-1.9 1,-0.3 -1,-0.2 0.853 100.4 60.7 -65.8 -34.2 5.7 4.5 36.4 76 109 A S G <4 S+ 0 0 0 -3,-0.6 -1,-0.3 -38,-0.3 27,-0.2 0.756 102.0 53.6 -67.7 -21.3 5.6 5.6 40.0 77 110 A V G << S+ 0 0 13 -3,-1.0 -1,-0.3 -4,-1.0 -2,-0.2 0.357 90.6 92.1 -94.1 9.7 7.4 8.7 39.3 78 111 A K S X S- 0 0 57 -3,-1.9 3,-1.4 -4,-0.2 22,-0.4 -0.848 86.3-103.9-101.6 140.1 5.0 9.9 36.5 79 112 A P T 3 S+ 0 0 94 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.216 102.6 28.9 -55.8 149.4 2.1 12.2 37.4 80 113 A G T 3 S+ 0 0 51 1,-0.3 2,-0.4 -4,-0.1 -4,-0.1 0.398 75.8 140.8 78.4 2.5 -1.2 10.4 37.5 81 114 A T < - 0 0 10 -3,-1.4 18,-2.8 -6,-0.2 -1,-0.3 -0.649 46.8-136.0 -80.9 132.0 -0.1 6.9 38.5 82 115 A Q - 0 0 111 -2,-0.4 2,-0.2 16,-0.2 16,-0.1 -0.699 8.6-135.4 -92.9 128.0 -2.6 5.5 40.9 83 116 A P - 0 0 9 0, 0.0 2,-0.4 0, 0.0 -40,-0.2 -0.636 17.3-152.8 -77.6 150.8 -1.4 3.6 44.0 84 117 A I + 0 0 105 -42,-2.1 -40,-0.1 -2,-0.2 0, 0.0 -0.966 65.7 34.9-116.0 136.3 -3.2 0.3 45.0 85 118 A G S S+ 0 0 32 -2,-0.4 2,-0.5 1,-0.3 -37,-0.2 0.873 71.2 142.3 94.9 37.3 -3.5 -1.3 48.5 86 119 A I - 0 0 20 -3,-0.2 2,-1.0 -37,-0.1 -1,-0.3 -0.965 46.6-141.9-106.3 129.6 -4.0 1.7 50.8 87 120 A D >> - 0 0 47 -39,-2.9 4,-1.7 -2,-0.5 3,-0.8 -0.805 17.2-168.4 -83.1 101.0 -6.3 1.7 53.8 88 121 A Y T 34 S+ 0 0 63 -2,-1.0 7,-0.2 1,-0.2 6,-0.2 0.720 82.1 63.2 -67.9 -19.1 -7.7 5.2 53.6 89 122 A S T 34 S+ 0 0 104 1,-0.2 -1,-0.2 2,-0.2 -37,-0.1 0.868 112.6 37.6 -64.7 -36.0 -9.3 5.1 57.0 90 123 A K T <4 S+ 0 0 94 -3,-0.8 -2,-0.2 1,-0.2 -1,-0.2 0.735 129.1 36.4 -84.0 -24.8 -5.7 4.7 58.4 91 124 A N >< + 0 0 0 -4,-1.7 3,-1.9 1,-0.1 4,-0.4 -0.476 66.3 153.8-126.9 59.7 -4.3 7.1 55.8 92 125 A P G > S+ 0 0 75 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.847 72.0 61.1 -64.1 -29.2 -6.9 9.9 55.3 93 126 A D G 3 S+ 0 0 67 1,-0.2 -5,-0.1 -3,-0.1 -2,-0.0 0.536 97.5 60.8 -74.7 -1.0 -4.4 12.5 54.2 94 127 A L G X S+ 0 0 0 -3,-1.9 3,-1.9 -6,-0.2 -1,-0.2 0.525 72.9 119.2 -99.5 -9.0 -3.4 10.3 51.2 95 128 A R T < S+ 0 0 145 -3,-1.4 3,-0.1 -4,-0.4 0, 0.0 -0.376 83.1 13.9 -52.7 130.2 -6.9 10.3 49.6 96 129 A G T 3 S+ 0 0 75 1,-0.3 -1,-0.2 -2,-0.0 2,-0.2 0.267 96.8 123.8 92.3 -12.7 -6.7 11.8 46.1 97 130 A L < - 0 0 34 -3,-1.9 -1,-0.3 4,-0.0 2,-0.1 -0.574 52.0-141.2 -89.4 146.2 -2.9 11.7 45.8 98 131 A D > - 0 0 21 -2,-0.2 4,-1.7 -16,-0.1 3,-0.4 -0.446 38.9 -88.5 -94.4-179.5 -1.2 9.9 43.0 99 132 A S H > S+ 0 0 0 -18,-2.8 4,-2.6 1,-0.3 5,-0.2 0.858 125.4 52.2 -58.9 -38.4 2.1 7.8 43.5 100 133 A L H > S+ 0 0 6 -22,-0.4 4,-2.4 1,-0.2 -1,-0.3 0.870 107.3 50.3 -70.4 -37.2 4.4 10.8 43.0 101 134 A Q H > S+ 0 0 79 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.855 110.1 50.3 -73.3 -31.6 2.7 13.0 45.5 102 135 A I H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 5,-0.2 0.942 108.5 53.5 -69.9 -41.6 2.9 10.2 48.2 103 136 A M H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.927 111.5 46.5 -51.5 -48.3 6.6 9.9 47.4 104 137 A E H X S+ 0 0 37 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.908 110.9 50.1 -60.1 -43.7 7.0 13.6 48.0 105 138 A K H X S+ 0 0 77 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.906 112.3 48.3 -64.5 -39.9 5.0 13.6 51.2 106 139 A I H X S+ 0 0 3 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.922 112.6 47.6 -69.7 -44.4 7.1 10.6 52.6 107 140 A I H X S+ 0 0 0 -4,-2.4 4,-2.7 -5,-0.2 -1,-0.2 0.913 112.5 49.3 -60.7 -41.2 10.4 12.3 51.7 108 141 A K H X S+ 0 0 115 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.949 113.4 46.2 -67.0 -44.6 9.3 15.6 53.3 109 142 A K H X S+ 0 0 52 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.907 111.0 52.4 -61.4 -46.0 8.2 13.9 56.5 110 143 A A H ><>S+ 0 0 0 -4,-2.9 5,-2.8 1,-0.2 3,-0.6 0.932 108.6 51.4 -53.5 -47.4 11.4 11.8 56.6 111 144 A G H ><5S+ 0 0 5 -4,-2.7 3,-1.6 1,-0.2 -1,-0.2 0.873 103.7 57.6 -61.0 -35.6 13.4 15.1 56.3 112 145 A D H 3<5S+ 0 0 91 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.851 108.3 47.3 -61.5 -26.6 11.4 16.6 59.2 113 146 A L T <<5S- 0 0 51 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.283 123.0-107.1 -95.6 7.5 12.7 13.6 61.3 114 147 A G T < 5S+ 0 0 33 -3,-1.6 2,-0.6 1,-0.2 -3,-0.2 0.714 70.2 149.9 74.3 17.4 16.3 14.1 60.1 115 148 A I < - 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