==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 12-JUL-12 4G2G . COMPND 2 MOLECULE: CYTOCHROME P450 121; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR S.A.HUDSON . 394 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16922.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 268 68.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 7.6 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 18 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 148 37.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 1 2 0 2 1 2 2 0 0 1 0 0 0 0 1 2 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 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 PARALLEL BRIDGES PER LADDER . 3 3 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 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 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 A 0 0 159 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 141.6 13.4 -9.7 13.6 2 4 A T - 0 0 141 3,-0.0 3,-0.1 1,-0.0 2,-0.1 -0.909 360.0-110.2-124.5 158.5 11.1 -6.7 13.6 3 5 A V - 0 0 105 -2,-0.3 3,-0.1 1,-0.1 2,-0.0 -0.359 52.5 -76.8 -78.8 163.0 8.7 -5.2 11.1 4 6 A L - 0 0 47 1,-0.1 -1,-0.1 -2,-0.1 29,-0.1 -0.403 68.5 -84.1 -55.4 137.2 9.5 -1.8 9.4 5 7 A L - 0 0 60 26,-0.3 28,-2.4 1,-0.1 2,-0.3 -0.220 51.6-135.9 -50.7 128.6 8.6 1.0 11.9 6 8 A E B -a 33 0A 109 26,-0.2 28,-0.2 -3,-0.1 -1,-0.1 -0.715 16.9-110.8 -97.4 140.4 4.9 1.9 11.7 7 9 A V S S+ 0 0 19 26,-2.2 28,-0.3 -2,-0.3 2,-0.1 -0.968 86.1 43.1-114.2 142.1 3.2 5.3 11.7 8 10 A P - 0 0 58 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.367 65.3-159.9 -94.2 157.9 1.5 6.9 13.4 9 11 A F - 0 0 64 1,-0.2 2,-0.3 -2,-0.1 -3,-0.1 0.881 69.4 -11.1 -65.5 -43.1 3.4 6.4 16.7 10 12 A S - 0 0 38 269,-0.2 -1,-0.2 2,-0.1 370,-0.0 -0.944 44.8-141.4-161.0 142.9 0.6 7.3 19.1 11 13 A A + 0 0 31 -2,-0.3 2,-0.2 -3,-0.1 375,-0.2 0.495 68.0 117.6 -81.2 -5.2 -2.9 8.9 19.0 12 14 A R - 0 0 71 1,-0.1 3,-0.2 366,-0.1 -2,-0.1 -0.468 42.7-173.3 -68.6 127.1 -2.2 10.8 22.3 13 15 A G S S+ 0 0 5 -2,-0.2 263,-0.5 1,-0.2 -1,-0.1 0.306 74.8 68.1-104.2 9.3 -2.3 14.6 21.7 14 16 A D S S+ 0 0 40 1,-0.2 2,-0.3 261,-0.1 -1,-0.2 0.407 105.6 31.0-101.7 -10.1 -1.1 15.6 25.2 15 17 A R - 0 0 85 -3,-0.2 -1,-0.2 261,-0.1 -3,-0.0 -0.985 69.5-132.4-147.7 148.6 2.5 14.3 24.9 16 18 A I - 0 0 42 -2,-0.3 -3,-0.1 -3,-0.1 260,-0.0 -0.816 37.8-113.2 -92.9 133.1 5.1 13.8 22.1 17 19 A P >> - 0 0 33 0, 0.0 3,-1.6 0, 0.0 4,-0.6 -0.303 15.9-125.8 -63.5 146.8 6.7 10.3 22.2 18 20 A D H 3> S+ 0 0 146 1,-0.3 4,-1.5 2,-0.2 3,-0.5 0.845 106.4 76.0 -61.4 -26.0 10.5 10.3 23.1 19 21 A A H 3> S+ 0 0 46 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.766 83.8 62.3 -54.0 -33.9 10.8 8.4 19.8 20 22 A V H <> S+ 0 0 4 -3,-1.6 4,-3.0 2,-0.2 -1,-0.2 0.962 103.9 45.9 -57.6 -49.7 10.4 11.6 17.8 21 23 A A H X S+ 0 0 48 -4,-0.6 4,-2.7 -3,-0.5 5,-0.2 0.909 113.6 51.0 -65.1 -38.6 13.6 13.3 19.2 22 24 A E H X S+ 0 0 75 -4,-1.5 4,-2.6 1,-0.2 5,-0.4 0.893 111.6 46.9 -64.2 -41.7 15.5 10.0 18.7 23 25 A L H X S+ 0 0 16 -4,-2.4 4,-3.4 -5,-0.2 -1,-0.2 0.931 112.9 49.1 -62.0 -46.8 14.3 9.8 15.1 24 26 A R H < S+ 0 0 20 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.919 115.6 42.9 -65.4 -42.7 15.1 13.5 14.4 25 27 A T H < S+ 0 0 117 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.927 127.9 28.3 -66.7 -45.1 18.7 13.2 15.9 26 28 A R H < S+ 0 0 99 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.876 139.3 5.9 -90.8 -33.4 19.5 9.8 14.3 27 29 A E < + 0 0 88 -4,-3.4 -1,-0.2 -5,-0.4 -2,-0.2 -0.574 56.5 178.3-154.5 72.9 17.5 9.7 11.1 28 30 A P S S+ 0 0 38 0, 0.0 16,-2.7 0, 0.0 17,-0.6 0.622 85.1 38.7 -69.4 -9.9 15.6 12.9 10.2 29 31 A I E S+ B 0 43A 9 14,-0.2 2,-0.3 -6,-0.1 14,-0.2 -0.945 83.7 153.3-131.0 122.4 14.5 11.2 7.1 30 32 A R E - B 0 42A 52 12,-2.5 12,-3.5 -2,-0.4 2,-0.1 -0.992 44.1 -99.6-154.5 156.0 13.6 7.6 7.3 31 33 A K E + B 0 41A 45 -2,-0.3 2,-0.3 10,-0.2 -26,-0.3 -0.415 44.3 164.7 -78.8 137.9 11.5 4.8 5.8 32 34 A V E - B 0 40A 0 8,-3.1 8,-2.5 -2,-0.1 2,-0.4 -0.917 33.5-116.3-139.7 174.5 8.3 3.8 7.6 33 35 A R E -aB 6 39A 75 -28,-2.4 -26,-2.2 -2,-0.3 6,-0.2 -0.951 25.3-145.7-117.6 133.5 5.1 1.9 6.9 34 36 A T > - 0 0 5 4,-3.4 3,-2.7 -2,-0.4 38,-0.1 -0.444 34.6 -95.3 -94.9 169.5 1.7 3.5 6.8 35 37 A I T 3 S+ 0 0 39 36,-0.4 135,-0.1 -28,-0.3 37,-0.1 0.676 124.1 59.1 -58.8 -20.2 -1.7 2.0 7.9 36 38 A T T 3 S- 0 0 50 35,-0.5 -1,-0.3 34,-0.4 3,-0.1 0.479 120.3-107.4 -83.9 -2.2 -2.3 1.0 4.3 37 39 A G S < S+ 0 0 38 -3,-2.7 -2,-0.1 1,-0.3 2,-0.1 0.292 77.6 133.3 87.9 -10.2 0.8 -1.2 4.2 38 40 A A - 0 0 18 32,-0.5 -4,-3.4 -5,-0.1 -1,-0.3 -0.383 55.4-123.9 -64.2 148.8 2.7 1.3 1.9 39 41 A E E +B 33 0A 89 -6,-0.2 263,-0.4 -2,-0.1 2,-0.3 -0.677 35.8 171.8 -87.0 150.6 6.2 2.5 2.6 40 42 A A E -B 32 0A 1 -8,-2.5 -8,-3.1 -2,-0.3 2,-0.7 -0.978 36.6-107.5-152.5 160.8 7.0 6.2 3.0 41 43 A W E -Bc 31 303A 41 261,-2.6 263,-3.6 -2,-0.3 2,-0.6 -0.849 29.3-152.4 -92.7 117.8 9.8 8.6 4.1 42 44 A L E -Bc 30 304A 4 -12,-3.5 -12,-2.5 -2,-0.7 2,-0.5 -0.817 8.0-159.9 -91.4 121.3 9.0 10.1 7.4 43 45 A V E +Bc 29 305A 0 261,-2.8 263,-2.6 -2,-0.6 -14,-0.2 -0.924 19.1 166.3-107.7 118.2 10.7 13.6 7.6 44 46 A S + 0 0 0 -16,-2.7 2,-0.3 -2,-0.5 -20,-0.1 0.376 41.2 87.2-122.4 2.0 11.2 14.8 11.2 45 47 A S S > S- 0 0 13 -17,-0.6 4,-3.3 1,-0.1 265,-0.3 -0.797 74.1-124.6-103.4 152.8 13.6 17.8 11.3 46 48 A Y H > S+ 0 0 25 263,-0.4 4,-2.6 -2,-0.3 5,-0.2 0.923 111.2 49.1 -51.3 -48.0 12.8 21.5 10.9 47 49 A A H > S+ 0 0 63 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.922 116.1 39.7 -67.3 -43.7 15.3 21.8 8.0 48 50 A L H > S+ 0 0 20 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.888 113.7 54.5 -76.4 -33.0 14.1 18.8 6.0 49 51 A C H X S+ 0 0 0 -4,-3.3 4,-2.7 1,-0.2 -2,-0.2 0.944 111.5 44.9 -63.0 -45.7 10.4 19.4 6.7 50 52 A T H X S+ 0 0 16 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.901 110.4 55.2 -61.9 -42.4 10.8 23.0 5.3 51 53 A Q H < S+ 0 0 65 -4,-2.0 4,-0.4 -5,-0.2 -1,-0.2 0.932 111.8 43.6 -58.1 -45.0 12.8 21.7 2.3 52 54 A V H >< S+ 0 0 0 -4,-2.5 3,-1.2 1,-0.2 6,-0.3 0.938 113.7 48.8 -69.2 -47.0 10.0 19.2 1.4 53 55 A L H 3< S+ 0 0 6 -4,-2.7 287,-0.6 1,-0.2 288,-0.3 0.818 112.2 50.5 -65.3 -25.0 7.1 21.7 1.9 54 56 A E T 3< S+ 0 0 109 -4,-2.1 2,-0.7 -5,-0.2 -1,-0.2 0.497 94.8 78.7 -88.2 -1.5 8.9 24.4 -0.2 55 57 A D X - 0 0 30 -3,-1.2 3,-2.2 -4,-0.4 -1,-0.1 -0.913 63.2-163.3-115.2 105.1 9.6 22.1 -3.2 56 58 A R T 3 S+ 0 0 161 -2,-0.7 -1,-0.1 1,-0.3 4,-0.1 0.628 82.7 80.6 -65.4 -17.3 6.5 21.7 -5.3 57 59 A R T 3 S+ 0 0 118 1,-0.1 230,-2.0 2,-0.1 2,-1.0 0.684 80.4 72.8 -61.1 -22.0 8.0 18.7 -7.0 58 60 A F E < S-D 286 0A 4 -3,-2.2 2,-0.4 -6,-0.3 228,-0.2 -0.874 93.5-155.1 -86.8 99.9 6.8 17.0 -3.8 59 61 A S E -D 285 0A 18 226,-2.4 226,-2.7 -2,-1.0 4,-0.4 -0.626 34.3-168.4 -93.2 130.2 3.2 17.2 -4.9 60 62 A M S > S+ 0 0 53 -2,-0.4 3,-1.2 224,-0.2 4,-0.3 0.926 95.5 53.2 -69.1 -49.9 0.1 17.3 -2.8 61 63 A K G > S+ 0 0 62 1,-0.2 3,-1.7 2,-0.2 21,-0.1 0.871 101.2 58.5 -55.0 -42.9 -2.1 16.7 -5.9 62 64 A E G > S+ 0 0 81 1,-0.3 3,-1.9 223,-0.2 -1,-0.2 0.703 85.4 79.4 -67.9 -17.4 -0.2 13.6 -7.1 63 65 A T G < S+ 0 0 14 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.745 89.0 57.0 -52.6 -29.0 -0.9 11.8 -3.8 64 66 A A G < S+ 0 0 17 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.397 79.6 124.5 -85.2 -3.0 -4.4 11.1 -5.3 65 67 A A S X S- 0 0 35 -3,-1.9 3,-1.7 1,-0.1 2,-0.2 -0.348 73.5-102.8 -60.7 140.8 -2.9 9.3 -8.3 66 68 A A T 3 S+ 0 0 108 1,-0.2 -1,-0.1 -2,-0.0 -2,-0.1 -0.452 106.2 17.3 -65.3 128.6 -4.3 5.7 -8.9 67 69 A G T 3 S+ 0 0 89 1,-0.3 -1,-0.2 -2,-0.2 -2,-0.1 0.451 91.2 137.3 93.2 -3.1 -1.7 3.1 -7.7 68 70 A A < - 0 0 16 -3,-1.7 -1,-0.3 -5,-0.1 2,-0.2 -0.415 68.6 -95.4 -70.0 148.0 0.4 5.6 -5.6 69 71 A P - 0 0 40 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.567 52.8-147.6 -60.9 134.4 1.7 4.5 -2.2 70 72 A R - 0 0 56 -2,-0.2 -32,-0.5 1,-0.1 -34,-0.4 -0.893 30.5-158.8-115.3 134.9 -1.0 5.9 0.2 71 73 A L S S- 0 0 14 -2,-0.4 -35,-0.5 1,-0.3 -36,-0.4 0.920 86.2 -29.0 -63.3 -46.0 -0.9 7.2 3.8 72 74 A N S S- 0 0 18 -37,-0.1 -1,-0.3 -38,-0.1 2,-0.3 -0.895 83.8 -66.5-159.3 179.8 -4.6 6.4 4.0 73 75 A A - 0 0 9 96,-3.0 96,-0.3 -2,-0.3 98,-0.1 -0.557 51.9-103.8 -82.1 141.9 -7.7 6.2 1.8 74 76 A L - 0 0 53 -2,-0.3 99,-0.4 1,-0.2 -1,-0.1 -0.396 27.4-174.1 -55.0 133.2 -9.3 9.1 0.1 75 77 A T S S+ 0 0 25 97,-0.1 -1,-0.2 2,-0.1 105,-0.1 0.336 74.2 49.9-106.9 -0.3 -12.5 10.3 1.9 76 78 A V S S- 0 0 40 1,-0.0 5,-0.1 104,-0.0 101,-0.1 -0.860 105.8 -78.0-125.4 164.3 -13.1 12.8 -1.0 77 79 A P >> - 0 0 32 0, 0.0 3,-1.4 0, 0.0 4,-0.6 -0.369 50.8-111.8 -58.6 147.5 -13.2 12.5 -4.8 78 80 A P G >4 S+ 0 0 68 0, 0.0 3,-1.3 0, 0.0 4,-0.5 0.849 116.7 57.2 -53.6 -37.6 -9.6 12.4 -6.2 79 81 A E G >4 S+ 0 0 111 1,-0.3 3,-1.1 2,-0.2 7,-0.2 0.807 94.6 65.9 -65.9 -25.7 -9.9 15.9 -7.8 80 82 A V G X4 S+ 0 0 10 -3,-1.4 3,-1.4 1,-0.3 -1,-0.3 0.710 85.9 71.3 -69.6 -20.9 -10.9 17.5 -4.4 81 83 A V G << S+ 0 0 27 -3,-1.3 3,-0.3 -4,-0.6 -1,-0.3 0.865 97.6 50.3 -59.0 -37.4 -7.3 16.7 -3.2 82 84 A N G <> S+ 0 0 38 -3,-1.1 4,-2.6 -4,-0.5 -1,-0.3 -0.103 78.8 137.6 -82.7 32.6 -6.2 19.5 -5.6 83 85 A N H <> + 0 0 22 -3,-1.4 4,-2.7 1,-0.2 -1,-0.2 0.911 69.3 42.1 -55.3 -53.7 -8.9 21.7 -4.0 84 86 A M H > S+ 0 0 39 -3,-0.3 4,-3.2 1,-0.2 -1,-0.2 0.914 113.2 54.0 -61.5 -43.5 -6.8 25.0 -3.7 85 87 A G H > S+ 0 0 20 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.899 110.8 47.5 -51.3 -45.7 -5.4 24.4 -7.2 86 88 A N H X S+ 0 0 45 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.908 111.0 50.6 -63.2 -43.7 -9.0 24.1 -8.5 87 89 A I H <>S+ 0 0 0 -4,-2.7 5,-2.4 -5,-0.2 6,-0.5 0.960 112.4 46.7 -57.9 -49.7 -10.0 27.2 -6.6 88 90 A A H ><5S+ 0 0 41 -4,-3.2 3,-2.0 1,-0.3 -2,-0.2 0.937 110.8 51.6 -62.4 -43.9 -7.1 29.2 -8.1 89 91 A D H 3<5S+ 0 0 130 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.848 106.4 54.9 -64.0 -29.5 -7.7 28.0 -11.6 90 92 A A T 3<5S- 0 0 21 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.579 115.9-117.7 -75.4 -5.2 -11.3 29.1 -11.3 91 93 A G T < 5S+ 0 0 43 -3,-2.0 4,-0.2 -4,-0.4 -3,-0.2 0.734 84.5 117.2 72.9 25.9 -10.1 32.6 -10.4 92 94 A L >< + 0 0 0 -5,-2.4 4,-2.4 -6,-0.2 5,-0.3 0.446 37.1 97.8-104.5 -6.8 -11.8 32.2 -6.9 93 95 A R H > S+ 0 0 96 -6,-0.5 4,-2.7 2,-0.2 5,-0.2 0.927 86.2 42.0 -47.8 -60.0 -8.6 32.5 -4.7 94 96 A K H > S+ 0 0 80 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.934 115.4 52.4 -61.7 -40.9 -8.8 36.2 -3.7 95 97 A A H > S+ 0 0 20 -4,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.893 112.2 43.6 -63.0 -39.0 -12.6 35.9 -3.2 96 98 A V H X S+ 0 0 2 -4,-2.4 4,-1.1 2,-0.2 -1,-0.2 0.937 114.6 49.4 -73.5 -42.4 -12.4 32.9 -0.9 97 99 A M H >< S+ 0 0 54 -4,-2.7 3,-0.7 -5,-0.3 4,-0.3 0.915 110.5 50.9 -62.1 -40.8 -9.5 34.3 1.1 98 100 A K H >< S+ 0 0 95 -4,-2.9 3,-0.7 -5,-0.2 -1,-0.2 0.827 107.7 53.8 -66.5 -31.2 -11.4 37.7 1.5 99 101 A A H 3< S+ 0 0 25 -4,-1.4 101,-0.2 1,-0.2 -1,-0.2 0.695 107.5 50.9 -80.7 -18.1 -14.5 35.9 2.8 100 102 A I T << S+ 0 0 11 -4,-1.1 -1,-0.2 -3,-0.7 248,-0.2 0.294 75.0 121.7-107.9 15.4 -12.6 34.0 5.5 101 103 A T X - 0 0 61 -3,-0.7 3,-1.2 -4,-0.3 244,-0.0 -0.477 64.1-134.0 -67.8 142.3 -10.7 36.8 7.3 102 104 A P T 3 S+ 0 0 9 0, 0.0 6,-0.5 0, 0.0 -1,-0.1 0.663 99.2 78.3 -67.7 -9.9 -11.5 37.2 11.1 103 105 A K T 3 + 0 0 111 4,-0.1 3,-0.1 5,-0.1 -2,-0.0 0.369 59.8 126.6 -84.6 5.3 -11.7 40.9 10.3 104 106 A A S X> S- 0 0 44 -3,-1.2 3,-1.5 1,-0.1 4,-0.6 -0.346 80.7 -78.5 -53.0 143.9 -15.2 40.8 8.7 105 107 A P T 34 S- 0 0 134 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.255 112.2 -6.5 -39.7 123.6 -17.6 43.5 10.4 106 108 A G T 3> S+ 0 0 55 -3,-0.1 4,-2.6 1,-0.1 5,-0.1 0.348 97.7 117.2 69.1 -4.4 -18.8 42.1 13.7 107 109 A L H <> S+ 0 0 8 -3,-1.5 4,-2.4 2,-0.2 5,-0.2 0.969 77.6 46.4 -58.1 -53.9 -17.3 38.6 13.2 108 110 A E H X S+ 0 0 41 -4,-0.6 4,-2.7 -6,-0.5 -1,-0.2 0.884 113.0 51.3 -57.3 -36.7 -14.9 38.9 16.3 109 111 A Q H > S+ 0 0 91 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.896 107.8 52.3 -68.3 -41.9 -17.9 40.2 18.4 110 112 A F H X S+ 0 0 49 -4,-2.6 4,-3.0 2,-0.2 -2,-0.2 0.930 109.8 49.2 -55.2 -46.5 -19.9 37.3 17.3 111 113 A L H X S+ 0 0 1 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.933 112.7 46.8 -60.5 -50.0 -17.1 34.9 18.4 112 114 A R H X S+ 0 0 69 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.915 113.9 47.2 -56.2 -49.1 -16.8 36.6 21.8 113 115 A D H X S+ 0 0 85 -4,-2.8 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