==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 09-NOV-09 3KLU . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN YQBN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR A.P.KUZIN,M.SU,J.SEETHARAMAN,D.WANG,Y.FANG,K.CUNNINGHAM,L.- . 119 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8182.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 81 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 10.1 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 . 1 0.8 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 . 1 0.8 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 . 11 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 41 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.7 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 0 0 1 0 1 0 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 1 1 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 1 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 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 8 A K 0 0 183 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 47.2 40.7 -19.8 30.4 2 9 A V - 0 0 143 1,-0.1 2,-0.2 2,-0.0 0, 0.0 0.772 360.0-130.1 20.7 101.2 42.3 -16.5 31.6 3 10 A Y - 0 0 176 1,-0.1 2,-1.0 2,-0.0 -1,-0.1 -0.516 10.7-126.7 -76.3 138.2 40.0 -13.8 30.4 4 11 A D > + 0 0 92 -2,-0.2 3,-0.6 1,-0.1 -1,-0.1 -0.724 30.3 172.9 -91.9 100.1 41.5 -10.8 28.5 5 12 A L G > + 0 0 98 -2,-1.0 3,-1.5 1,-0.2 -1,-0.1 0.410 53.0 97.4 -87.9 1.9 40.3 -7.6 30.2 6 13 A S G > S+ 0 0 59 1,-0.3 3,-1.6 2,-0.2 7,-0.3 0.870 77.6 65.4 -59.1 -30.7 42.5 -5.1 28.3 7 14 A F G < S+ 0 0 109 -3,-0.6 -1,-0.3 1,-0.3 6,-0.1 0.662 97.0 53.0 -65.5 -20.6 39.5 -4.4 26.0 8 15 A F G < S+ 0 0 153 -3,-1.5 -1,-0.3 4,-0.1 -2,-0.2 0.090 94.9 95.2-102.8 23.5 37.4 -2.9 28.7 9 16 A X S <> S- 0 0 99 -3,-1.6 4,-1.4 2,-0.1 -3,-0.0 -0.895 85.6-109.2-120.7 150.9 40.0 -0.4 29.7 10 17 A P T 4 S+ 0 0 123 0, 0.0 2,-3.7 0, 0.0 -1,-0.1 0.756 111.0 71.4 -37.0 -44.5 40.6 3.3 28.8 11 18 A G T 4 S+ 0 0 80 1,-0.1 -2,-0.1 -5,-0.1 3,-0.1 -0.209 124.2 3.7 -72.7 53.9 43.7 2.4 26.7 12 19 A Q T 4 S+ 0 0 97 -2,-3.7 3,-0.1 1,-0.3 -5,-0.1 -0.248 84.0 113.2 172.1 -79.1 41.1 1.0 24.3 13 20 A T S < S- 0 0 58 -4,-1.4 -1,-0.3 -7,-0.3 -5,-0.1 0.037 73.2-113.2 -32.7 112.6 37.4 1.1 24.7 14 21 A I - 0 0 155 1,-0.1 2,-0.2 -3,-0.1 -1,-0.1 -0.150 38.6-124.7 -48.0 138.4 36.2 3.3 21.8 15 22 A D - 0 0 117 1,-0.1 -1,-0.1 -3,-0.1 -2,-0.0 -0.567 27.6 -77.2 -98.4 164.9 34.8 6.5 23.3 16 23 A A - 0 0 40 -2,-0.2 -1,-0.1 25,-0.1 0, 0.0 -0.157 49.5-114.8 -55.2 137.9 31.5 8.2 22.9 17 24 A E - 0 0 67 99,-0.1 23,-0.1 1,-0.0 -2,-0.0 0.880 3.0-136.5 -27.9-127.3 30.7 10.2 19.8 18 25 A E - 0 0 107 21,-0.2 2,-0.5 2,-0.0 22,-0.2 0.193 35.9-164.5 137.1 84.3 30.1 13.9 19.3 19 26 A V E -A 39 0A 47 20,-2.0 20,-3.0 -2,-0.0 2,-0.4 -0.854 11.1-142.7 -98.7 125.0 27.2 13.6 17.0 20 27 A E E +A 38 0A 131 -2,-0.5 18,-0.2 18,-0.2 -2,-0.0 -0.751 23.7 175.6 -89.9 135.2 26.0 16.6 15.0 21 28 A V E -A 37 0A 23 16,-3.3 16,-3.7 -2,-0.4 2,-1.9 -0.982 33.0-133.2-143.8 125.1 22.2 16.9 14.5 22 29 A P + 0 0 89 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.533 31.6 172.2 -79.7 82.8 20.3 19.7 12.8 23 30 A I + 0 0 17 -2,-1.9 2,-0.3 1,-0.2 85,-0.1 0.742 65.9 14.7 -63.6 -26.0 17.6 20.2 15.6 24 31 A S > - 0 0 8 11,-0.2 3,-0.9 -3,-0.1 11,-0.3 -0.977 52.8-148.4-155.0 140.9 16.2 23.3 13.9 25 32 A K T 3 S+ 0 0 187 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.531 92.5 78.5 -83.0 -3.9 16.4 25.1 10.6 26 33 A R T 3 S+ 0 0 114 1,-0.1 2,-0.7 8,-0.1 -1,-0.2 0.546 79.3 78.4 -81.0 -9.4 16.0 28.5 12.4 27 34 A F < + 0 0 40 -3,-0.9 8,-2.8 8,-0.1 2,-0.3 -0.889 62.0 154.2-105.3 112.8 19.6 28.4 13.4 28 35 A V B -C 34 0B 76 -2,-0.7 6,-0.2 6,-0.3 2,-0.1 -0.914 33.4-129.4-133.8 158.1 21.9 29.5 10.5 29 36 A D > - 0 0 66 4,-2.1 3,-2.4 -2,-0.3 6,-0.0 -0.324 50.1 -75.7 -95.0-176.5 25.4 31.0 10.2 30 37 A K T 3 S+ 0 0 180 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.764 131.1 54.2 -50.0 -30.6 26.5 34.0 8.1 31 38 A E T 3 S- 0 0 133 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.179 118.3-107.4 -93.3 16.7 26.3 31.8 4.9 32 39 A G S < S+ 0 0 52 -3,-2.4 2,-0.3 1,-0.2 -2,-0.1 0.505 74.2 136.7 74.2 3.6 22.7 30.7 5.4 33 40 A N - 0 0 93 1,-0.1 -4,-2.1 -4,-0.0 -1,-0.2 -0.629 61.4-101.0 -87.9 144.2 23.6 27.1 6.4 34 41 A V B -C 28 0B 54 -2,-0.3 -6,-0.3 -6,-0.2 -9,-0.1 -0.284 26.5-137.6 -60.7 141.7 22.0 25.3 9.3 35 42 A V - 0 0 33 -8,-2.8 -11,-0.2 -11,-0.3 -12,-0.2 -0.890 24.7-148.2-103.0 101.5 24.0 25.2 12.5 36 43 A P - 0 0 31 0, 0.0 2,-0.2 0, 0.0 -16,-0.0 -0.329 14.5-112.9 -71.2 154.8 23.5 21.6 13.8 37 44 A F E -A 21 0A 5 -16,-3.7 -16,-3.3 37,-0.0 2,-0.6 -0.621 24.7-137.6 -81.8 148.1 23.5 20.8 17.5 38 45 A I E -AB 20 75A 31 37,-2.9 36,-2.1 -2,-0.2 37,-1.5 -0.956 23.2-172.6-111.3 119.4 26.5 18.8 18.8 39 46 A F E +AB 19 73A 0 -20,-3.0 -20,-2.0 -2,-0.6 2,-0.2 -0.739 11.5 175.5-108.5 156.0 25.6 16.0 21.2 40 47 A K - 0 0 66 32,-2.1 77,-0.1 -2,-0.3 -2,-0.0 -0.773 35.3-112.0-163.3 113.0 27.8 13.7 23.2 41 48 A A - 0 0 23 75,-0.4 2,-0.1 -2,-0.2 76,-0.1 -0.017 28.4-138.1 -45.4 143.3 26.6 11.2 25.8 42 49 A I - 0 0 35 1,-0.2 2,-0.1 26,-0.1 -1,-0.1 -0.366 34.6 -79.0 -94.6-175.3 27.4 11.9 29.4 43 50 A T > - 0 0 85 -2,-0.1 4,-1.8 1,-0.1 5,-0.2 -0.408 24.5-123.3 -88.3 163.1 28.5 9.2 31.9 44 51 A T H > S+ 0 0 105 2,-0.2 4,-1.6 1,-0.2 -1,-0.1 0.918 115.1 55.3 -66.9 -41.9 26.4 6.7 33.7 45 52 A D H > S+ 0 0 121 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.919 109.2 48.7 -55.5 -43.9 27.8 8.0 37.0 46 53 A R H > S+ 0 0 52 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.842 105.1 55.0 -68.2 -34.2 26.6 11.4 36.0 47 54 A I H X S+ 0 0 16 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.811 107.5 55.5 -68.1 -27.1 23.1 10.3 35.0 48 55 A D H X S+ 0 0 86 -4,-1.6 4,-2.4 2,-0.2 5,-0.2 0.958 104.7 47.7 -71.3 -50.5 23.0 8.9 38.5 49 56 A E H X S+ 0 0 90 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.855 111.5 54.3 -60.3 -30.5 23.8 12.1 40.3 50 57 A L H X S+ 0 0 0 -4,-1.7 4,-1.0 2,-0.2 -1,-0.2 0.904 107.2 48.8 -69.4 -37.8 21.1 13.7 38.2 51 58 A E H >< S+ 0 0 89 -4,-1.8 3,-1.2 2,-0.2 -2,-0.2 0.967 113.9 45.9 -63.7 -50.4 18.5 11.2 39.1 52 59 A K H >< S+ 0 0 150 -4,-2.4 3,-2.0 1,-0.3 -2,-0.2 0.948 109.6 56.2 -51.1 -54.3 19.3 11.6 42.8 53 60 A E H 3< S+ 0 0 89 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.674 113.1 41.4 -52.3 -24.2 19.3 15.4 42.3 54 61 A N T << S+ 0 0 17 -3,-1.2 6,-3.3 -4,-1.0 2,-0.3 0.026 98.8 89.6-118.8 28.2 15.8 15.2 40.9 55 62 A T B < D 59 0C 43 -3,-2.0 4,-0.3 4,-0.3 -4,-0.0 -0.924 360.0 360.0-124.7 149.7 14.2 12.7 43.3 56 63 A T 0 0 151 2,-3.2 -2,-0.0 -2,-0.3 -3,-0.0 -0.736 360.0 360.0-167.7 360.0 12.4 13.3 46.6 57 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 58 75 A E 0 0 157 0, 0.0 -2,-3.2 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 105.6 9.5 11.0 44.0 59 76 A L B -D 55 0C 43 -4,-0.3 2,-1.5 4,-0.0 -4,-0.3 -0.880 360.0-141.6-109.9 129.7 11.4 11.9 40.8 60 77 A D > + 0 0 80 -6,-3.3 4,-2.6 -2,-0.5 5,-0.1 -0.672 28.2 176.2 -81.9 88.8 10.9 15.0 38.7 61 78 A S H > S+ 0 0 53 -2,-1.5 4,-3.6 2,-0.2 5,-0.4 0.936 73.8 56.4 -61.4 -51.4 11.4 13.2 35.3 62 79 A Q H > S+ 0 0 155 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.914 115.5 38.3 -43.6 -54.3 10.6 16.2 33.2 63 80 A R H > S+ 0 0 74 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.867 114.1 55.8 -66.8 -43.1 13.4 18.1 34.9 64 81 A F H X S+ 0 0 14 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.946 111.4 42.7 -56.5 -52.9 15.7 15.0 35.1 65 82 A Y H X S+ 0 0 102 -4,-3.6 4,-2.5 1,-0.2 -1,-0.2 0.882 112.0 53.9 -65.1 -37.8 15.6 14.4 31.4 66 83 A A H X S+ 0 0 2 -4,-1.8 4,-2.9 -5,-0.4 -1,-0.2 0.932 108.0 49.9 -63.2 -45.4 15.9 18.1 30.6 67 84 A R H X S+ 0 0 45 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.908 109.4 52.6 -61.1 -39.3 19.0 18.3 32.7 68 85 A I H X S+ 0 0 2 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.938 110.5 47.8 -59.7 -46.1 20.4 15.3 30.9 69 86 A A H X S+ 0 0 0 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.917 108.1 54.1 -60.3 -48.0 19.8 16.9 27.5 70 87 A V H >< S+ 0 0 4 -4,-2.9 3,-0.5 1,-0.2 8,-0.3 0.948 115.5 40.0 -52.9 -49.2 21.4 20.2 28.6 71 88 A E H 3< S+ 0 0 44 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.783 111.9 55.0 -75.1 -25.4 24.6 18.3 29.6 72 89 A T H 3< S+ 0 0 0 -4,-2.4 -32,-2.1 -5,-0.2 2,-0.9 0.685 93.4 86.5 -77.9 -15.1 24.5 15.9 26.6 73 90 A T E << +B 39 0A 2 -4,-1.3 -34,-0.3 -3,-0.5 5,-0.2 -0.767 51.3 176.3 -95.8 107.5 24.4 19.0 24.4 74 91 A V E + 0 0 60 -36,-2.1 3,-0.4 -2,-0.9 -35,-0.2 0.834 65.1 54.3 -72.0 -42.5 27.9 20.2 23.6 75 92 A Y E S+B 38 0A 127 -37,-1.5 -37,-2.9 1,-0.4 -1,-0.3 -0.926 114.5 23.0-145.6 117.5 26.9 23.1 21.3 76 93 A P S S- 0 0 24 0, 0.0 2,-0.8 0, 0.0 -1,-0.4 0.492 83.2-165.0 -85.4 145.5 25.0 25.0 22.2 77 94 A T > - 0 0 58 -3,-0.4 3,-2.1 1,-0.1 6,-0.2 -0.846 9.5-153.7 -95.0 116.2 25.6 24.5 25.9 78 95 A F T 3 S+ 0 0 0 -2,-0.8 17,-0.1 1,-0.3 -1,-0.1 0.491 89.2 68.4 -66.7 -3.2 22.7 26.1 27.6 79 96 A K T 3 S+ 0 0 84 -9,-0.2 -1,-0.3 4,-0.1 5,-0.1 0.580 71.6 124.1 -89.4 -12.5 24.8 26.7 30.7 80 97 A A X> - 0 0 33 -3,-2.1 4,-2.4 1,-0.1 3,-0.5 -0.224 66.4-134.1 -53.6 132.5 26.9 29.3 28.9 81 98 A K H 3> S+ 0 0 100 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.872 105.3 59.8 -54.4 -40.6 26.9 32.6 30.6 82 99 A E H 3> S+ 0 0 164 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.897 109.6 41.8 -59.6 -39.5 26.3 34.3 27.3 83 100 A L H <> S+ 0 0 40 -3,-0.5 4,-2.1 -6,-0.2 -1,-0.2 0.866 112.4 53.1 -76.1 -35.3 23.1 32.4 26.9 84 101 A R H <>S+ 0 0 55 -4,-2.4 5,-2.2 2,-0.2 4,-0.3 0.924 114.4 43.9 -64.9 -40.0 22.0 32.8 30.5 85 102 A E H ><5S+ 0 0 113 -4,-2.8 3,-1.8 3,-0.2 -2,-0.2 0.991 114.7 46.8 -63.9 -63.2 22.5 36.6 30.1 86 103 A A H 3<5S+ 0 0 58 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.806 119.0 38.9 -52.4 -40.4 20.9 37.0 26.7 87 104 A Y T 3<5S- 0 0 89 -4,-2.1 -1,-0.3 2,-0.2 -2,-0.2 0.407 108.7-127.0 -93.1 3.1 17.8 35.0 27.5 88 105 A K T < 5 + 0 0 165 -3,-1.8 2,-0.3 -4,-0.3 -3,-0.2 0.913 69.6 101.7 52.8 55.6 17.6 36.4 31.0 89 106 A T < - 0 0 25 -5,-2.2 -2,-0.2 -6,-0.2 -1,-0.1 -0.924 57.0-152.2-162.5 137.5 17.5 33.2 33.1 90 107 A E S S+ 0 0 109 -2,-0.3 -6,-0.1 -3,-0.1 -5,-0.1 0.499 74.3 99.6 -88.6 -3.9 20.0 31.3 35.1 91 108 A D >> - 0 0 45 1,-0.2 4,-2.6 -7,-0.1 3,-0.9 -0.753 61.5-159.0 -88.2 106.5 18.1 28.1 34.6 92 109 A P H 3> S+ 0 0 28 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.783 94.0 55.2 -54.4 -30.6 19.8 26.2 31.7 93 110 A V H 3> S+ 0 0 7 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.847 109.0 46.6 -73.2 -31.9 16.6 24.2 31.1 94 111 A E H <> S+ 0 0 56 -3,-0.9 4,-2.6 2,-0.2 5,-0.3 0.889 107.8 56.8 -75.8 -37.7 14.7 27.5 30.7 95 112 A V H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.956 107.4 50.0 -56.0 -47.0 17.5 28.8 28.4 96 113 A A H X S+ 0 0 0 -4,-2.1 4,-3.3 1,-0.2 -2,-0.2 0.928 109.4 50.0 -58.2 -44.0 16.8 25.7 26.3 97 114 A K H < S+ 0 0 85 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.857 113.0 46.2 -66.2 -33.3 13.0 26.3 26.3 98 115 A R H >< S+ 0 0 104 -4,-2.6 3,-0.5 1,-0.1 -1,-0.2 0.870 116.9 44.2 -76.5 -32.7 13.6 29.9 25.2 99 116 A V H 3< S+ 0 0 12 -4,-2.6 2,-1.6 -5,-0.3 -2,-0.2 0.957 116.5 44.2 -74.5 -50.8 16.1 28.9 22.5 100 117 A L T 3< S+ 0 0 2 -4,-3.3 6,-0.4 -5,-0.2 -1,-0.3 -0.484 77.4 160.0 -89.1 64.6 14.2 25.9 21.1 101 118 A S < + 0 0 78 -2,-1.6 2,-0.6 -3,-0.5 -1,-0.2 0.449 45.4 85.1 -72.4 -0.2 11.0 28.0 21.2 102 119 A V S >> S- 0 0 71 1,-0.2 4,-1.8 -3,-0.1 3,-1.1 -0.927 82.2-132.9-102.7 120.3 9.1 25.9 18.7 103 120 A G H 3> S+ 0 0 58 -2,-0.6 4,-2.3 1,-0.3 3,-0.3 0.849 102.1 50.4 -35.0 -63.2 7.4 23.0 20.5 104 121 A G H 3> S+ 0 0 44 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.839 107.8 54.6 -50.2 -40.3 8.5 20.2 18.2 105 122 A E H <> S+ 0 0 19 -3,-1.1 4,-2.7 1,-0.2 -1,-0.2 0.930 108.8 47.9 -61.9 -47.0 12.1 21.4 18.3 106 123 A Y H X S+ 0 0 30 -4,-1.8 4,-2.2 -6,-0.4 -1,-0.2 0.922 113.6 46.4 -60.4 -43.2 12.2 21.2 22.0 107 124 A A H X S+ 0 0 44 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.909 113.8 49.5 -66.9 -39.2 10.7 17.7 22.1 108 125 A N H X S+ 0 0 96 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.867 108.2 52.8 -67.3 -38.9 13.0 16.5 19.4 109 126 A W H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.947 109.4 49.9 -61.3 -46.7 16.0 17.9 21.2 110 127 A L H X S+ 0 0 29 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.952 112.9 45.4 -56.8 -52.9 15.0 16.0 24.4 111 128 A N H X S+ 0 0 97 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.895 109.4 53.7 -62.9 -40.1 14.5 12.8 22.6 112 129 A K H X S+ 0 0 50 -4,-2.5 4,-3.3 1,-0.2 -1,-0.2 0.934 110.5 49.2 -59.0 -41.7 17.7 13.0 20.6 113 130 A A H X S+ 0 0 0 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.921 110.7 48.4 -60.8 -47.0 19.6 13.5 23.9 114 131 A I H <>S+ 0 0 36 -4,-2.3 5,-1.8 1,-0.2 3,-0.3 0.898 115.2 46.7 -60.7 -39.4 18.0 10.6 25.5 115 132 A E H ><5S+ 0 0 110 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.901 105.1 58.3 -69.6 -44.7 18.8 8.5 22.4 116 133 A I H 3<5S+ 0 0 21 -4,-3.3 -75,-0.4 1,-0.3 -1,-0.2 0.747 101.4 58.2 -57.7 -23.8 22.4 9.8 22.3 117 134 A N T 3<5S- 0 0 20 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.099 122.7-105.9 -94.5 23.7 22.8 8.4 25.9 118 135 A G T < 5S+ 0 0 66 -3,-1.8 2,-0.7 1,-0.2 -3,-0.2 0.533 71.0 146.1 67.5 8.1 21.9 4.9 24.6 119 136 A F < 0 0 97 -5,-1.8 -1,-0.2 1,-0.0 -2,-0.1 -0.676 360.0 360.0 -82.9 117.0 18.4 4.9 26.2 120 137 A D 0 0 212 -2,-0.7 -5,-0.0 -3,-0.1 -1,-0.0 -0.348 360.0 360.0 59.0 360.0 16.0 3.0 24.0