==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-OCT-09 2WUW . COMPND 2 MOLECULE: SUBTILISIN CARLSBERG; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS LICHENIFORMIS; . AUTHOR M.CIANCI,B.TOMASZEWKI,J.R.HELLIWELL,P.J.HALLING . 274 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9996.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 190 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 13.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 4.4 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 . 3 1.1 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 . 1 0.4 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 . 23 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 23.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 3 0 1 0 0 0 2 0 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 2 2 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 PARALLEL BRIDGES PER LADDER . 3 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 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 1 E A 0 0 121 0, 0.0 2,-0.4 0, 0.0 78,-0.4 0.000 360.0 360.0 360.0 162.7 41.7 -10.5 4.9 2 2 E Q - 0 0 44 76,-0.2 2,-0.3 74,-0.2 78,-0.2 -0.743 360.0-146.0 -96.8 128.7 38.3 -8.8 4.3 3 3 E T - 0 0 64 76,-3.6 78,-0.3 -2,-0.4 75,-0.1 -0.721 4.6-145.0 -95.2 148.8 35.1 -10.7 4.5 4 4 E V - 0 0 72 -2,-0.3 78,-0.1 76,-0.2 76,-0.1 -0.938 23.0-133.3-109.2 106.9 32.2 -9.8 2.2 5 5 E P > - 0 0 13 0, 0.0 3,-2.2 0, 0.0 199,-0.1 -0.320 21.9-112.8 -62.4 150.6 29.0 -10.4 4.2 6 6 E Y T 3> S+ 0 0 52 1,-0.3 4,-1.7 197,-0.2 198,-0.1 0.785 111.0 67.1 -58.5 -29.6 26.4 -12.3 2.3 7 7 E G H 3> S+ 0 0 2 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.762 89.0 65.7 -62.1 -26.1 24.1 -9.3 2.1 8 8 E I H <4>S+ 0 0 2 -3,-2.2 5,-2.2 1,-0.2 6,-0.7 0.952 110.1 32.4 -68.0 -53.8 26.4 -7.4 -0.2 9 9 E P H >45S+ 0 0 55 0, 0.0 3,-1.0 0, 0.0 -1,-0.2 0.780 111.4 66.2 -70.8 -25.8 26.2 -9.7 -3.3 10 10 E L H 3<5S+ 0 0 41 -4,-1.7 -2,-0.2 1,-0.3 -3,-0.1 0.877 108.5 37.1 -67.4 -31.9 22.6 -10.6 -2.5 11 11 E I T 3<5S- 0 0 0 -4,-1.5 258,-3.0 -3,-0.2 259,-0.5 0.435 115.5-121.2 -90.7 4.3 21.4 -7.0 -3.2 12 12 E K T <>5 + 0 0 69 -3,-1.0 4,-1.2 256,-0.2 3,-0.4 0.750 68.5 140.6 58.5 32.7 24.0 -7.0 -6.0 13 13 E A H >< + 0 0 0 -5,-2.2 4,-2.3 -6,-0.2 5,-0.2 0.732 66.5 63.7 -68.2 -24.3 25.9 -4.0 -4.5 14 14 E D H > S+ 0 0 56 -6,-0.7 4,-1.4 2,-0.2 -1,-0.2 0.841 97.4 54.7 -72.1 -28.9 29.0 -5.7 -5.5 15 15 E K H > S+ 0 0 95 -3,-0.4 4,-1.2 2,-0.2 -2,-0.2 0.942 109.9 46.7 -67.9 -42.7 28.0 -5.3 -9.2 16 16 E V H <>S+ 0 0 0 -4,-1.2 5,-1.7 1,-0.2 3,-0.4 0.914 110.1 52.2 -64.0 -43.1 27.6 -1.6 -8.7 17 17 E Q H ><5S+ 0 0 16 -4,-2.3 3,-0.5 1,-0.2 -1,-0.2 0.776 104.8 56.4 -63.8 -30.5 30.9 -1.2 -6.9 18 18 E A H 3<5S+ 0 0 89 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.809 99.5 59.2 -70.2 -31.9 32.7 -3.0 -9.7 19 19 E Q T 3<5S- 0 0 83 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.637 127.2-106.3 -64.5 -15.7 31.3 -0.3 -12.1 20 20 E G T < 5S+ 0 0 47 -3,-0.5 2,-0.6 -4,-0.4 -3,-0.2 0.513 81.3 127.1 101.7 3.7 33.2 2.1 -9.9 21 21 E F < + 0 0 68 -5,-1.7 -1,-0.3 1,-0.1 -2,-0.2 -0.865 18.2 155.1-101.0 119.5 30.3 3.6 -8.0 22 22 E K - 0 0 69 -2,-0.6 64,-2.6 62,-0.1 65,-0.4 0.246 67.0 -92.0-130.3 10.4 30.8 3.4 -4.2 23 23 E G > + 0 0 0 209,-0.3 3,-2.3 208,-0.2 65,-0.4 0.494 59.8 178.3 90.2 6.8 28.8 6.2 -2.6 24 24 E A T 3 + 0 0 53 1,-0.3 63,-0.2 63,-0.2 -1,-0.2 -0.119 68.3 0.9 -49.8 122.5 31.7 8.8 -2.7 25 25 E N T 3 S+ 0 0 136 61,-0.9 2,-0.5 1,-0.3 -1,-0.3 0.607 95.8 130.1 68.6 12.3 30.7 12.2 -1.3 26 26 E V < - 0 0 9 -3,-2.3 62,-3.0 60,-0.1 2,-0.6 -0.806 56.2-134.3 -85.2 134.2 27.3 11.0 -0.5 27 27 E K E -a 88 0A 76 -2,-0.5 92,-1.9 60,-0.2 93,-1.9 -0.822 23.8-176.1 -98.4 122.4 26.4 12.0 3.1 28 28 E V E -ab 89 120A 0 60,-3.1 62,-2.9 -2,-0.6 2,-0.5 -0.957 10.6-158.6-120.8 124.0 24.8 9.4 5.2 29 29 E A E -ab 90 121A 0 91,-2.5 93,-2.9 -2,-0.5 2,-0.8 -0.829 5.7-155.4 -96.5 126.9 23.6 10.0 8.7 30 30 E V E -ab 91 122A 1 60,-3.1 62,-2.2 -2,-0.5 2,-1.1 -0.875 5.4-160.1-103.2 107.1 23.1 6.9 11.0 31 31 E L E +ab 92 123A 0 91,-2.4 93,-0.5 -2,-0.8 62,-0.2 -0.756 50.8 94.2 -89.6 96.6 20.6 7.7 13.7 32 32 E D E S-a 93 0A 0 -2,-1.1 62,-2.1 60,-1.0 63,-1.7 -0.505 92.6 -41.8-152.1-148.6 21.4 5.1 16.3 33 33 E T S S- 0 0 1 1,-0.4 27,-0.3 60,-0.2 28,-0.3 0.227 94.0 -94.4 -82.1 14.7 23.3 4.5 19.5 34 34 E G - 0 0 0 58,-0.3 2,-0.4 -4,-0.2 -1,-0.4 -0.513 42.3 -91.0 96.9-177.6 26.4 6.2 18.1 35 35 E I - 0 0 0 21,-1.4 2,-1.8 23,-0.5 3,-0.1 -0.998 22.0-120.2-141.4 139.4 29.4 4.8 16.3 36 36 E Q > - 0 0 13 -2,-0.4 3,-2.3 1,-0.2 22,-0.2 -0.626 35.8-174.0 -76.7 87.8 32.8 3.5 17.5 37 37 E A T 3 S+ 0 0 26 -2,-1.8 7,-0.3 20,-1.0 -1,-0.2 0.783 75.3 60.5 -62.3 -27.6 34.6 6.1 15.4 38 38 E S T 3 S+ 0 0 92 19,-0.4 -1,-0.3 -3,-0.1 -2,-0.1 0.614 73.2 122.1 -76.0 -8.8 38.0 4.7 16.3 39 39 E H X - 0 0 3 -3,-2.3 3,-1.7 1,-0.2 168,-0.0 -0.319 69.0-130.0 -54.0 131.2 37.1 1.2 14.8 40 40 E P T 3 S+ 0 0 77 0, 0.0 -1,-0.2 0, 0.0 38,-0.1 0.740 103.3 53.8 -58.6 -20.1 39.8 0.5 12.1 41 41 E D T 3 S+ 0 0 0 32,-0.1 33,-3.0 35,-0.0 2,-0.4 0.352 101.3 63.9-101.1 9.8 37.1 -0.4 9.5 42 42 E L < - 0 0 8 -3,-1.7 2,-0.5 31,-0.2 31,-0.1 -0.985 57.2-159.0-130.8 143.4 34.9 2.8 9.7 43 43 E N - 0 0 96 -2,-0.4 46,-0.6 29,-0.3 2,-0.6 -0.960 13.0-172.0-117.9 109.4 35.6 6.5 8.9 44 44 E V E -c 89 0A 21 -2,-0.5 46,-0.2 -7,-0.3 3,-0.1 -0.901 5.5-176.7-101.3 120.9 33.2 8.8 10.7 45 45 E V E - 0 0 70 44,-2.2 2,-0.3 -2,-0.6 45,-0.2 0.728 58.3 -29.5 -94.8 -16.2 33.5 12.3 9.5 46 46 E G E +c 90 0A 13 43,-1.0 45,-2.3 10,-0.1 2,-0.3 -0.920 60.0 143.8-170.1-165.3 31.0 14.2 11.8 47 47 E G E -c 91 0A 18 43,-0.3 2,-0.3 -2,-0.3 45,-0.2 -0.887 31.6-113.9 143.3-172.4 27.8 14.0 13.8 48 48 E A E -c 92 0A 16 43,-1.5 45,-2.1 -2,-0.3 2,-0.5 -0.974 15.2-133.3-157.9 154.5 26.0 15.1 16.9 49 49 E S E +c 93 0A 36 -2,-0.3 45,-0.2 43,-0.2 7,-0.1 -0.977 15.9 179.6-122.6 125.3 24.6 13.5 20.1 50 50 E F + 0 0 76 43,-3.5 2,-0.5 -2,-0.5 44,-0.1 0.127 60.1 98.8-103.6 18.6 21.2 14.2 21.5 51 51 E V S > S- 0 0 25 3,-0.4 3,-1.5 42,-0.2 44,-0.1 -0.937 80.7-115.0-112.4 124.9 21.8 11.8 24.3 52 52 E A T 3 S+ 0 0 98 -2,-0.5 -2,-0.1 1,-0.2 3,-0.1 -0.229 93.9 9.6 -56.7 130.1 22.8 13.2 27.7 53 53 E G T 3 S+ 0 0 92 1,-0.1 2,-0.4 0, 0.0 -1,-0.2 0.281 106.1 95.0 92.3 -13.8 26.3 12.2 28.9 54 54 E E < - 0 0 48 -3,-1.5 -3,-0.4 39,-0.1 -1,-0.1 -0.944 65.5-135.9-123.2 130.2 27.6 10.5 25.6 55 55 E A > - 0 0 56 -2,-0.4 3,-0.8 1,-0.1 -7,-0.1 -0.262 27.7-117.8 -74.6 151.7 29.6 12.0 22.8 56 57 E Y T 3 S+ 0 0 76 1,-0.2 -21,-1.4 -7,-0.1 -8,-0.1 0.828 106.8 61.8 -64.6 -29.9 28.4 11.1 19.1 57 58 E N T 3 S+ 0 0 64 -23,-0.2 -20,-1.0 -21,-0.1 -19,-0.4 0.010 94.2 65.4 -97.6 24.9 31.6 9.2 18.2 58 59 E T < - 0 0 70 -3,-0.8 -23,-0.5 -22,-0.2 2,-0.3 -0.933 60.3-162.3-131.1 167.2 31.5 6.5 20.8 59 60 E D + 0 0 11 -2,-0.3 -25,-0.1 -25,-0.2 -23,-0.1 -0.838 12.6 178.6-152.7 97.9 28.9 3.6 21.0 60 61 E G S S+ 0 0 63 -27,-0.3 -1,-0.1 -2,-0.3 -26,-0.1 0.780 84.6 51.0 -78.0 -22.0 28.6 1.7 24.3 61 62 E N S S- 0 0 48 -28,-0.3 -1,-0.1 1,-0.1 36,-0.1 0.952 90.3-139.8 -76.5 -55.4 25.8 -0.5 22.8 62 63 E G S > S+ 0 0 0 -29,-0.1 4,-2.1 -28,-0.1 5,-0.2 -0.017 76.3 101.5 116.7 -29.7 27.2 -1.8 19.5 63 64 E H H > S+ 0 0 35 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.900 82.7 43.7 -58.6 -48.2 24.0 -1.4 17.6 64 65 E G H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.867 112.5 52.5 -70.0 -36.4 25.0 1.9 15.8 65 66 E T H > S+ 0 0 0 2,-0.2 4,-1.4 1,-0.2 142,-0.3 0.879 110.4 48.8 -62.7 -38.4 28.5 0.7 15.0 66 67 E H H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 141,-0.3 0.944 113.1 46.6 -70.6 -45.1 27.0 -2.5 13.4 67 68 E V H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 3,-0.3 0.940 110.4 53.5 -63.0 -43.6 24.5 -0.5 11.3 68 69 E A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.850 106.3 54.0 -57.6 -34.9 27.2 1.9 10.2 69 70 E G H X S+ 0 0 0 -4,-1.4 4,-2.7 138,-0.2 -1,-0.2 0.868 103.8 53.6 -74.9 -30.6 29.4 -0.9 9.0 70 71 E T H < S+ 0 0 6 -4,-1.6 13,-2.7 -3,-0.3 -1,-0.2 0.887 116.4 40.5 -68.7 -39.2 26.6 -2.4 6.8 71 72 E V H < S- 0 0 0 -4,-1.7 13,-2.7 11,-0.2 -2,-0.2 0.957 139.9 -0.5 -67.0 -45.8 26.3 1.1 5.2 72 73 E A H < + 0 0 4 -4,-2.8 -29,-0.3 10,-0.2 -3,-0.2 0.059 64.6 159.2-148.9 17.4 30.0 1.9 5.0 73 74 E A < - 0 0 0 -4,-2.7 9,-2.1 1,-0.1 -31,-0.2 -0.298 58.4 -97.1 -46.1 136.2 32.6 -0.5 6.3 74 75 E L - 0 0 56 -33,-3.0 2,-0.8 7,-0.2 4,-0.2 -0.227 27.2-120.8 -66.5 144.6 35.8 0.6 4.5 75 76 E D S S+ 0 0 88 10,-0.3 2,-0.2 6,-0.1 -1,-0.1 -0.771 70.8 103.3 -87.0 108.8 36.9 -1.3 1.4 76 77 E N S S- 0 0 53 -2,-0.8 -74,-0.2 2,-0.3 -35,-0.0 -0.706 86.0 -70.4-162.6-158.3 40.4 -2.6 2.3 77 78 E T S S+ 0 0 123 -2,-0.2 2,-0.3 -76,-0.1 -2,-0.1 0.022 101.9 62.9-111.3 31.8 42.0 -5.9 3.4 78 79 E T S S- 0 0 59 2,-0.2 -2,-0.3 -4,-0.2 -76,-0.2 -0.954 93.5 -8.6-144.7 160.0 40.5 -6.3 6.8 79 80 E G S S- 0 0 7 -78,-0.4 -76,-3.6 -2,-0.3 2,-0.2 -0.226 98.5 -33.2 66.5-133.3 37.2 -6.7 8.5 80 81 E V - 0 0 1 -78,-0.2 2,-0.4 -76,-0.1 -4,-0.3 -0.478 50.7-121.5-116.2-169.8 34.1 -6.3 6.4 81 82 E L - 0 0 15 -78,-0.3 -7,-0.2 -2,-0.2 -73,-0.1 -0.997 22.8-138.8-141.4 129.7 32.9 -4.3 3.4 82 83 E G - 0 0 0 -9,-2.1 -11,-0.2 -2,-0.4 -10,-0.2 -0.368 25.3-110.6 -87.4 169.0 29.9 -1.9 3.5 83 84 E V S S+ 0 0 0 -13,-2.7 -11,-0.2 1,-0.3 -12,-0.2 0.869 117.5 19.1 -62.7 -36.5 27.3 -1.5 0.7 84 85 E A S > S+ 0 0 0 -13,-2.7 3,-1.7 -14,-0.2 -1,-0.3 -0.721 77.3 175.4-135.6 73.7 28.6 2.0 -0.1 85 86 E P T 3 S+ 0 0 7 0, 0.0 -10,-0.3 0, 0.0 -62,-0.2 0.511 71.3 57.2 -75.3 -1.1 32.0 2.0 1.4 86 87 E S T 3 S+ 0 0 55 -64,-2.6 -61,-0.9 -12,-0.1 -63,-0.2 0.321 79.8 124.2-103.5 3.3 33.1 5.4 0.1 87 88 E V S < S- 0 0 11 -3,-1.7 2,-0.8 -65,-0.4 -60,-0.2 -0.168 70.8-111.5 -59.2 155.0 30.2 7.4 1.8 88 89 E S E -a 27 0A 21 -62,-3.0 -60,-3.1 -65,-0.4 2,-0.5 -0.847 41.4-149.6 -86.3 115.9 30.7 10.3 4.2 89 90 E L E -ac 28 44A 0 -2,-0.8 -44,-2.2 -46,-0.6 -43,-1.0 -0.757 15.8-171.2 -99.9 123.9 29.5 8.7 7.4 90 91 E Y E -ac 29 46A 36 -62,-2.9 -60,-3.1 -2,-0.5 2,-0.7 -0.966 13.2-146.6-116.1 133.8 27.8 10.8 10.2 91 92 E A E -ac 30 47A 0 -45,-2.3 -43,-1.5 -2,-0.4 2,-0.7 -0.870 14.7-176.8-100.1 116.4 26.9 9.5 13.6 92 93 E V E -ac 31 48A 0 -62,-2.2 -60,-1.0 -2,-0.7 2,-0.8 -0.885 15.6-150.8-114.3 99.0 23.8 11.0 15.1 93 94 E K E +ac 32 49A 0 -45,-2.1 -43,-3.5 -2,-0.7 -42,-0.2 -0.568 39.9 142.7 -73.6 107.5 23.3 9.6 18.6 94 95 E V + 0 0 2 -62,-2.1 2,-0.4 -2,-0.8 8,-0.3 0.341 58.4 65.1-121.1 -2.7 19.6 9.5 19.4 95 96 E L S S- 0 0 10 -63,-1.7 6,-0.3 6,-0.1 -44,-0.1 -0.970 76.0-128.2-124.2 144.3 19.5 6.2 21.4 96 97 E N > - 0 0 54 4,-3.6 3,-2.3 -2,-0.4 -2,-0.1 -0.070 40.8 -80.2 -77.8-178.6 21.2 5.5 24.7 97 98 E S T 3 S+ 0 0 56 1,-0.3 -1,-0.1 2,-0.2 -64,-0.1 0.655 129.3 53.9 -49.0 -32.1 23.4 2.6 25.8 98 99 E S T 3 S- 0 0 101 2,-0.2 -1,-0.3 -37,-0.0 3,-0.1 0.243 123.5-104.2 -91.9 8.8 20.5 0.3 26.3 99 100 E G S < S+ 0 0 31 -3,-2.3 2,-0.3 1,-0.2 -2,-0.2 0.724 82.1 119.1 79.2 22.6 19.3 1.0 22.8 100 101 E S + 0 0 70 25,-0.1 -4,-3.6 -67,-0.0 2,-0.3 -0.873 33.4 173.0-124.4 155.0 16.5 3.3 23.7 101 102 E G - 0 0 38 -2,-0.3 2,-0.2 -6,-0.3 -6,-0.1 -0.972 28.1-108.7-149.5 167.3 15.6 7.0 23.0 102 103 E S > - 0 0 69 -8,-0.3 4,-2.1 -2,-0.3 5,-0.1 -0.613 32.6-114.0 -95.2 163.0 12.9 9.7 23.3 103 104 E Y H > S+ 0 0 109 1,-0.2 4,-3.2 -2,-0.2 5,-0.2 0.886 117.2 50.0 -61.0 -41.5 10.8 11.1 20.6 104 105 E S H > S+ 0 0 84 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.876 107.6 52.7 -73.4 -28.8 12.4 14.5 20.9 105 106 E G H > S+ 0 0 7 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.935 114.2 45.1 -62.9 -43.8 15.9 13.1 20.9 106 107 E I H X S+ 0 0 12 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.943 112.0 50.0 -63.6 -51.4 14.9 11.3 17.6 107 108 E V H X S+ 0 0 9 -4,-3.2 4,-2.6 1,-0.2 5,-0.2 0.925 110.1 53.4 -51.5 -51.0 13.2 14.4 16.2 108 109 E S H X S+ 0 0 44 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.857 108.0 48.6 -51.8 -44.7 16.4 16.4 17.1 109 110 E G H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.902 111.3 50.1 -64.1 -41.5 18.6 14.0 15.2 110 111 E I H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.960 113.6 45.2 -63.5 -47.9 16.4 14.1 12.1 111 112 E E H X S+ 0 0 93 -4,-2.6 4,-2.8 1,-0.2 5,-0.3 0.896 110.0 54.5 -61.8 -40.0 16.4 17.9 12.1 112 113 E W H X S+ 0 0 53 -4,-2.4 4,-1.6 -5,-0.2 -1,-0.2 0.902 110.7 47.8 -57.6 -37.0 20.1 18.0 12.7 113 114 E A H <>S+ 0 0 0 -4,-1.8 5,-2.4 2,-0.2 -2,-0.2 0.925 112.0 46.2 -77.9 -42.2 20.5 15.8 9.6 114 115 E T H ><5S+ 0 0 19 -4,-2.5 3,-1.6 1,-0.2 -2,-0.2 0.968 116.1 47.6 -60.8 -46.3 18.1 17.9 7.3 115 116 E T H 3<5S+ 0 0 117 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.814 109.8 52.5 -63.9 -31.9 19.9 21.1 8.5 116 117 E N T 3<5S- 0 0 74 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.239 117.1-110.8 -96.0 17.6 23.3 19.7 8.0 117 118 E G T < 5 + 0 0 43 -3,-1.6 -3,-0.2 1,-0.2 -90,-0.2 0.789 49.0 176.0 64.5 35.8 22.5 18.6 4.4 118 119 E M < - 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