==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 29-JUN-01 1JI6 . COMPND 2 MOLECULE: PESTICIDIAL CRYSTAL PROTEIN CRY3BB; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS THURINGIENSIS; . AUTHOR V.CODY . 589 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24242.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 415 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 123 20.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 35 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 157 26.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.4 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 5 2 0 0 1 1 0 0 0 0 0 1 0 1 0 1 0 1 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 6 1 4 2 1 0 1 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 1 2 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 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 64 A D > 0 0 143 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 142.6 38.1 26.3 24.6 2 65 A A H > + 0 0 7 2,-0.2 4,-2.9 44,-0.2 3,-0.3 0.971 360.0 43.3 -59.9 -52.1 36.9 23.4 22.4 3 66 A V H > S+ 0 0 9 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.930 113.2 52.7 -59.7 -46.0 36.8 25.5 19.2 4 67 A G H > S+ 0 0 19 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.828 111.6 45.5 -60.4 -33.5 40.1 27.2 20.0 5 68 A T H X S+ 0 0 27 -4,-1.9 4,-2.8 -3,-0.3 5,-0.2 0.961 113.2 50.9 -73.4 -48.6 41.8 23.9 20.5 6 69 A G H X S+ 0 0 1 -4,-2.9 4,-2.7 1,-0.3 5,-0.2 0.918 111.9 46.3 -50.8 -52.0 40.2 22.6 17.3 7 70 A I H X S+ 0 0 7 -4,-3.1 4,-1.1 1,-0.2 -1,-0.3 0.861 113.5 50.4 -60.5 -36.8 41.4 25.6 15.4 8 71 A S H X S+ 0 0 28 -4,-1.5 4,-1.5 -5,-0.3 -1,-0.2 0.870 110.1 48.2 -71.8 -38.5 44.8 25.3 16.9 9 72 A V H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 5,-0.3 0.934 109.4 52.6 -66.1 -47.8 45.2 21.6 16.0 10 73 A V H X S+ 0 0 4 -4,-2.7 4,-1.7 1,-0.3 -1,-0.2 0.783 109.0 51.9 -60.8 -28.0 44.0 22.1 12.4 11 74 A G H X S+ 0 0 13 -4,-1.1 4,-1.1 -5,-0.2 -1,-0.3 0.850 111.6 45.8 -75.6 -36.5 46.7 24.8 12.1 12 75 A Q H X S+ 0 0 48 -4,-1.5 4,-2.1 -3,-0.2 -2,-0.2 0.934 115.0 45.9 -70.8 -46.0 49.4 22.4 13.5 13 76 A I H X S+ 0 0 0 -4,-3.0 4,-3.1 2,-0.2 5,-0.2 0.908 107.0 58.4 -62.5 -44.5 48.4 19.5 11.2 14 77 A L H < S+ 0 0 17 -4,-1.7 4,-0.4 -5,-0.3 -1,-0.2 0.883 112.4 41.9 -53.8 -39.9 48.1 21.8 8.1 15 78 A G H >< S+ 0 0 46 -4,-1.1 3,-0.7 2,-0.2 -1,-0.2 0.879 112.6 51.6 -75.9 -38.3 51.8 22.7 8.6 16 79 A V H >< S+ 0 0 8 -4,-2.1 3,-2.2 1,-0.2 7,-0.3 0.916 104.5 58.2 -65.6 -37.4 52.9 19.2 9.4 17 80 A V T 3< S+ 0 0 1 -4,-3.1 216,-1.7 1,-0.3 5,-0.3 0.720 98.7 60.6 -63.2 -22.0 51.3 17.9 6.3 18 81 A G T < S+ 0 0 13 -3,-0.7 -1,-0.3 -4,-0.4 -2,-0.2 0.401 91.9 84.3 -86.5 2.2 53.5 20.3 4.3 19 82 A V S X> S- 0 0 46 -3,-2.2 3,-1.2 213,-0.1 4,-1.1 -0.869 97.9 -91.6-106.3 139.4 56.5 18.5 5.6 20 83 A P G >4 S+ 0 0 71 0, 0.0 3,-0.7 0, 0.0 5,-0.5 -0.150 112.7 14.6 -50.3 141.1 57.9 15.4 3.9 21 84 A F G >4 S- 0 0 75 209,-0.6 3,-1.7 208,-0.3 205,-0.1 0.762 132.4 -69.7 61.5 31.6 56.4 12.2 5.4 22 85 A A G <4 S- 0 0 4 -3,-1.2 -1,-0.2 -5,-0.3 -5,-0.2 0.926 90.9 -62.2 52.9 45.0 53.8 14.2 7.2 23 86 A G G X< S+ 0 0 3 -4,-1.1 3,-2.3 -3,-0.7 5,-0.4 0.611 92.8 147.5 57.8 17.9 56.5 15.6 9.4 24 87 A A T < S+ 0 0 6 -3,-1.7 -1,-0.1 1,-0.3 -3,-0.1 0.653 70.4 50.3 -57.4 -18.7 57.3 12.1 10.7 25 88 A L T 3 S+ 0 0 97 -5,-0.5 -1,-0.3 3,-0.0 2,-0.1 0.267 101.3 74.0-105.4 12.9 61.0 13.1 11.1 26 89 A T S < S- 0 0 61 -3,-2.3 3,-0.3 -7,-0.0 -10,-0.0 -0.333 93.4 -99.1-109.3-169.4 60.5 16.3 13.0 27 90 A S S >> S+ 0 0 80 1,-0.2 3,-2.0 -2,-0.1 4,-0.7 0.153 76.2 124.3-103.2 22.3 59.5 17.1 16.6 28 91 A F H >> + 0 0 25 -5,-0.4 4,-2.2 1,-0.3 3,-1.0 0.877 61.2 70.4 -45.7 -46.6 55.9 17.8 15.9 29 92 A Y H 3> S+ 0 0 14 -3,-0.3 4,-2.3 1,-0.3 -1,-0.3 0.750 91.3 60.5 -47.9 -28.6 54.7 15.2 18.4 30 93 A Q H <> S+ 0 0 79 -3,-2.0 4,-1.8 2,-0.2 -1,-0.3 0.938 109.8 38.9 -65.7 -48.4 55.9 17.4 21.3 31 94 A S H S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 5,-1.0 0.869 107.2 51.4 -54.0 -39.9 50.8 17.8 19.5 33 96 A L H <5S+ 0 0 9 -4,-2.3 4,-0.4 -5,-0.3 -1,-0.2 0.942 109.5 48.6 -64.1 -47.7 51.1 16.2 23.0 34 97 A N H <5S+ 0 0 122 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.889 119.4 39.9 -60.2 -38.9 50.8 19.6 24.8 35 98 A T H <5S+ 0 0 26 -4,-2.3 -2,-0.2 -5,-0.1 -1,-0.2 0.941 133.8 11.1 -80.2 -49.0 47.8 20.5 22.8 36 99 A I T <5S+ 0 0 0 -4,-2.9 -3,-0.2 -5,-0.2 8,-0.2 0.817 130.5 40.9-102.7 -33.8 45.7 17.3 22.5 37 100 A W S - 0 0 23 0, 0.0 3,-1.5 0, 0.0 -4,-0.1 -0.360 53.4-113.1 -73.0 153.3 48.1 16.7 28.1 39 102 A S T 3 S+ 0 0 95 1,-0.3 37,-0.1 2,-0.1 36,-0.1 0.829 113.4 53.9 -54.5 -41.8 48.2 14.8 31.4 40 103 A D T 3 S- 0 0 89 1,-0.1 -1,-0.3 3,-0.0 -3,-0.0 0.574 96.9-138.6 -72.5 -11.2 45.2 16.5 33.0 41 104 A A <> + 0 0 22 -3,-1.5 4,-1.3 1,-0.1 3,-0.2 0.765 51.3 146.8 57.5 30.8 43.0 15.6 30.0 42 105 A D H > + 0 0 93 1,-0.2 4,-1.6 2,-0.2 3,-0.4 0.954 62.7 61.1 -60.4 -47.7 41.3 19.0 30.1 43 106 A P H > S+ 0 0 17 0, 0.0 4,-1.7 0, 0.0 3,-0.3 0.864 102.4 53.1 -46.7 -44.3 40.9 19.2 26.3 44 107 A W H > S+ 0 0 2 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.922 102.5 53.6 -62.3 -45.7 38.6 16.1 26.3 45 108 A K H X S+ 0 0 99 -4,-1.3 4,-0.8 -3,-0.4 -1,-0.2 0.846 109.6 53.5 -59.6 -29.9 36.2 17.3 28.9 46 109 A A H X S+ 0 0 34 -4,-1.6 4,-1.4 -3,-0.3 -1,-0.3 0.871 111.4 41.7 -70.6 -43.2 35.8 20.3 26.6 47 110 A F H X S+ 0 0 0 -4,-1.7 4,-0.8 -3,-0.2 87,-0.2 0.892 112.8 55.6 -70.8 -38.2 35.0 18.2 23.5 48 111 A M H < S+ 0 0 1 -4,-3.4 4,-0.2 1,-0.2 -2,-0.2 0.701 116.3 37.8 -64.4 -22.8 32.8 16.0 25.7 49 112 A A H X S+ 0 0 38 -4,-0.8 4,-1.7 -5,-0.3 -1,-0.2 0.614 97.7 82.7-102.9 -16.6 30.8 19.1 26.7 50 113 A Q H < S+ 0 0 12 -4,-1.4 4,-0.5 1,-0.2 -2,-0.2 0.866 97.1 35.6 -59.2 -44.1 30.9 21.0 23.4 51 114 A V T >X>S+ 0 0 0 -4,-0.8 4,-2.8 79,-0.4 3,-0.7 0.820 105.3 66.7 -86.3 -26.8 28.0 19.3 21.7 52 115 A E H 3>>S+ 0 0 9 1,-0.3 4,-1.5 -4,-0.2 5,-1.2 0.958 105.4 48.7 -54.2 -44.9 25.8 18.8 24.8 53 116 A V H 3<5S+ 0 0 77 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.707 112.7 48.7 -64.8 -26.7 25.7 22.7 24.7 54 117 A L H <45S+ 0 0 8 -3,-0.7 -2,-0.2 -4,-0.5 -1,-0.2 0.866 124.3 24.9 -86.0 -43.0 24.8 22.7 21.0 55 118 A I H <5S- 0 0 43 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.519 104.0-125.3 -98.7 -3.3 22.0 20.2 20.7 56 119 A D T < - 0 0 107 -2,-0.5 4,-2.4 1,-0.1 5,-0.2 -0.210 25.8-113.9 -55.3 153.3 24.8 9.6 30.2 61 124 A E H > S+ 0 0 167 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.888 112.7 54.3 -54.1 -49.1 27.4 9.3 33.0 62 125 A Y H >> S+ 0 0 147 1,-0.2 4,-2.3 2,-0.2 3,-0.6 0.977 113.1 42.1 -50.5 -60.1 28.3 5.7 32.3 63 126 A A H 3> S+ 0 0 5 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.843 114.9 52.0 -55.8 -40.6 29.1 6.4 28.7 64 127 A K H 3X S+ 0 0 57 -4,-2.4 4,-1.7 1,-0.2 -1,-0.3 0.828 111.5 43.5 -71.5 -33.5 30.9 9.6 29.6 65 128 A S H X S+ 0 0 58 -4,-1.6 4,-1.5 1,-0.2 3,-0.9 0.976 109.5 48.7 -59.2 -61.1 65.2 8.2 21.4 88 151 A W H 3< S+ 0 0 8 -4,-2.2 3,-0.2 1,-0.3 -1,-0.2 0.838 109.9 52.3 -47.9 -45.1 65.1 6.0 18.4 89 152 A K H 3< S+ 0 0 56 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.839 111.7 46.5 -64.4 -34.8 65.4 8.9 16.1 90 153 A K H << S+ 0 0 175 -4,-1.5 -2,-0.2 -3,-0.9 -1,-0.2 0.621 87.9 104.7 -80.2 -20.7 68.4 10.2 18.0 91 154 A T S < S- 0 0 34 -4,-1.5 5,-0.1 -3,-0.2 -4,-0.0 -0.507 75.7-122.3 -69.8 121.2 70.3 6.9 18.1 92 155 A P > - 0 0 68 0, 0.0 3,-1.3 0, 0.0 4,-0.4 -0.336 25.8-116.5 -57.7 148.5 73.2 6.6 15.7 93 156 A L G > S+ 0 0 137 1,-0.3 3,-2.7 2,-0.2 -2,-0.0 0.953 116.4 56.9 -49.4 -56.0 72.6 3.6 13.3 94 157 A S G 3 S+ 0 0 112 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.702 107.7 49.0 -49.0 -25.9 75.7 1.9 14.8 95 158 A L G < S+ 0 0 123 -3,-1.3 2,-0.5 2,-0.1 -1,-0.3 0.414 81.3 112.4-100.1 1.4 74.2 2.2 18.2 96 159 A R < - 0 0 59 -3,-2.7 2,-0.2 -4,-0.4 -3,-0.0 -0.667 50.0-166.5 -78.3 122.6 70.8 0.7 17.4 97 160 A S > - 0 0 42 -2,-0.5 4,-2.2 1,-0.1 5,-0.1 -0.579 36.7-112.6-105.9 168.9 70.2 -2.7 19.1 98 161 A K H > S+ 0 0 156 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.801 120.2 60.7 -66.7 -28.6 67.7 -5.5 18.8 99 162 A R H > S+ 0 0 152 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.942 105.0 46.9 -63.3 -45.8 66.6 -4.5 22.3 100 163 A S H > S+ 0 0 13 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.951 114.6 47.4 -59.6 -52.0 65.7 -1.0 20.9 101 164 A Q H X S+ 0 0 41 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.948 112.4 46.3 -53.0 -61.3 63.9 -2.5 17.9 102 165 A D H X S+ 0 0 87 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.903 117.3 47.2 -49.4 -46.5 61.9 -5.1 19.9 103 166 A R H X S+ 0 0 96 -4,-2.4 4,-1.8 -5,-0.3 5,-0.2 0.968 110.2 47.2 -65.0 -57.1 61.0 -2.3 22.4 104 167 A I H X S+ 0 0 4 -4,-3.1 4,-2.5 1,-0.2 3,-0.4 0.933 114.9 49.4 -53.0 -44.5 60.0 0.5 20.0 105 168 A R H X S+ 0 0 60 -4,-2.5 4,-3.1 -5,-0.3 5,-0.3 0.948 106.3 54.8 -58.5 -51.7 57.8 -2.0 18.1 106 169 A E H X S+ 0 0 131 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.808 111.7 46.1 -49.8 -36.5 56.1 -3.4 21.2 107 170 A L H X S+ 0 0 27 -4,-1.8 4,-2.6 -3,-0.4 -1,-0.2 0.901 111.2 50.8 -75.4 -43.6 55.1 0.2 22.0 108 171 A F H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.966 110.9 47.7 -60.7 -50.8 53.9 1.0 18.6 109 172 A S H X S+ 0 0 46 -4,-3.1 4,-1.4 1,-0.2 -1,-0.2 0.745 112.9 52.0 -61.0 -26.6 51.7 -2.1 18.4 110 173 A Q H X S+ 0 0 98 -4,-0.8 4,-2.7 -5,-0.3 5,-0.3 0.917 112.1 41.5 -75.6 -49.5 50.4 -1.2 21.8 111 174 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 -34,-0.2 5,-0.2 0.985 119.3 46.3 -62.9 -51.9 49.4 2.4 21.1 112 175 A E H X S+ 0 0 3 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.2 0.842 116.2 44.0 -57.6 -45.9 48.0 1.4 17.7 113 176 A S H X S+ 0 0 38 -4,-1.4 4,-2.5 -5,-0.3 -1,-0.2 0.906 112.3 51.1 -68.3 -44.2 46.0 -1.6 19.0 114 177 A H H X S+ 0 0 43 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.941 113.8 46.9 -60.0 -41.8 44.7 0.2 22.0 115 178 A F H >X S+ 0 0 0 -4,-2.9 4,-1.7 -5,-0.3 3,-0.5 0.966 108.9 54.2 -64.3 -45.9 43.6 3.0 19.7 116 179 A R H 3< S+ 0 0 87 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.887 115.2 39.3 -54.5 -45.2 42.0 0.5 17.3 117 180 A N H 3< S+ 0 0 108 -4,-2.5 -1,-0.3 1,-0.2 4,-0.2 0.687 109.4 60.2 -82.5 -18.0 39.9 -1.1 20.0 118 181 A S H X< S+ 0 0 0 -4,-1.8 3,-2.9 -3,-0.5 4,-0.4 0.878 77.9 89.7 -75.8 -38.7 39.0 2.1 21.9 119 182 A M G >< S+ 0 0 10 -4,-1.7 3,-1.8 1,-0.3 -1,-0.2 0.700 78.0 61.9 -30.4 -44.2 37.2 3.9 19.0 120 183 A P G > S+ 0 0 87 0, 0.0 3,-2.5 0, 0.0 -1,-0.3 0.873 89.6 70.4 -59.4 -31.1 33.8 2.4 19.8 121 184 A S G < S+ 0 0 23 -3,-2.9 3,-0.3 1,-0.3 -54,-0.2 0.700 103.3 43.6 -56.3 -19.1 33.8 4.2 23.3 122 185 A F G < S+ 0 0 1 -3,-1.8 13,-0.3 -4,-0.4 -1,-0.3 0.149 111.5 54.3-113.0 20.3 33.4 7.5 21.4 123 186 A A S < S+ 0 0 30 -3,-2.5 -1,-0.2 12,-0.1 -2,-0.2 -0.111 77.8 163.9-142.9 32.9 30.7 6.2 19.1 124 187 A V > - 0 0 33 3,-0.3 3,-1.8 -3,-0.3 7,-0.1 -0.094 49.1 -82.7 -54.2 155.4 28.3 4.8 21.6 125 188 A S T 3 S+ 0 0 99 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 -0.296 114.2 5.1 -63.2 136.1 24.7 4.0 20.6 126 189 A K T 3 S+ 0 0 152 -3,-0.1 -1,-0.3 1,-0.1 4,-0.1 0.688 118.6 82.8 61.4 21.4 22.3 7.1 20.6 127 190 A F <> + 0 0 6 -3,-1.8 4,-1.1 -4,-0.1 -3,-0.3 -0.070 49.8 111.1-148.2 46.5 25.4 9.3 21.4 128 191 A E H > S+ 0 0 40 2,-0.2 4,-0.5 -5,-0.1 7,-0.1 0.912 77.5 45.5 -91.6 -44.5 26.9 9.9 18.1 129 192 A V H >4 S+ 0 0 20 1,-0.2 3,-2.0 2,-0.2 -78,-0.1 0.997 116.9 49.0 -61.2 -33.1 26.3 13.6 17.4 130 193 A L H 34 S+ 0 0 3 1,-0.3 -79,-0.4 2,-0.1 4,-0.2 0.801 111.1 46.3 -81.9 -32.3 27.4 14.3 21.0 131 194 A F H 3X S+ 0 0 0 -4,-1.1 4,-2.3 1,-0.2 -1,-0.3 0.446 84.7 111.9 -82.0 0.2 30.7 12.3 21.0 132 195 A L H S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.898 115.7 52.5 -62.6 -39.3 34.7 16.1 18.2 134 197 A T H > S+ 0 0 0 -4,-0.2 4,-2.1 -87,-0.2 5,-0.2 0.942 112.4 45.6 -58.4 -51.2 36.2 13.5 20.7 135 198 A Y H X S+ 0 0 14 -4,-2.3 4,-3.1 -13,-0.3 5,-0.3 0.950 112.9 49.0 -57.2 -55.2 35.9 10.8 18.0 136 199 A A H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.924 113.2 48.6 -52.9 -47.8 37.4 13.0 15.2 137 200 A Q H X S+ 0 0 0 -4,-2.7 4,-0.7 2,-0.2 -1,-0.2 0.800 114.8 42.7 -62.4 -39.1 40.3 13.9 17.5 138 201 A A H >X S+ 0 0 0 -4,-2.1 4,-2.1 -3,-0.3 3,-0.6 0.908 113.6 53.4 -74.1 -42.9 41.1 10.3 18.6 139 202 A A H 3X S+ 0 0 0 -4,-3.1 4,-2.0 1,-0.3 5,-0.2 0.950 104.8 54.8 -53.6 -52.9 40.6 9.1 15.0 140 203 A N H 3X S+ 0 0 0 -4,-2.8 4,-1.5 -5,-0.3 -1,-0.3 0.799 109.1 48.3 -52.4 -32.1 43.1 11.7 13.8 141 204 A T H X S+ 0 0 0 -4,-1.4 3,-0.9 2,-0.2 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