==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SERINE PROTEASE 22-MAY-98 1BFU . COMPND 2 MOLECULE: SUBTILISIN CARLSBERG; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS LICHENIFORMIS; . AUTHOR J.L.SCHMITKE,L.J.STERN,A.M.KLIBANOV . 274 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10006.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 194 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 13.9 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 . 24 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 23.4 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 2 1 0 1 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 . 2 0 2 1 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 A A 0 0 121 0, 0.0 78,-0.7 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 140.8 14.6 3.2 28.8 2 2 A Q B -a 79 0A 47 76,-0.2 78,-0.2 74,-0.1 2,-0.2 -0.899 360.0-148.0-105.2 122.0 15.3 5.0 25.5 3 3 A T - 0 0 71 76,-3.5 78,-0.2 -2,-0.6 75,-0.1 -0.561 2.9-146.6 -85.8 148.2 14.9 3.1 22.3 4 4 A V - 0 0 71 -2,-0.2 76,-0.1 76,-0.2 78,-0.1 -0.908 17.4-133.7-119.5 103.1 17.1 3.9 19.2 5 5 A P > - 0 0 14 0, 0.0 3,-1.4 0, 0.0 199,-0.1 -0.213 20.7-119.9 -53.0 140.6 15.3 3.4 15.9 6 6 A Y T 3> S+ 0 0 61 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.776 107.0 76.9 -53.6 -24.8 17.4 1.4 13.3 7 7 A G H 3> S+ 0 0 1 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.882 90.0 50.1 -55.0 -44.8 17.1 4.6 11.2 8 8 A I H <4>S+ 0 0 7 -3,-1.4 5,-2.1 1,-0.2 6,-0.8 0.922 114.0 41.2 -67.4 -44.3 19.7 6.6 13.1 9 9 A P H >45S+ 0 0 50 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 0.917 110.7 60.6 -69.4 -35.2 22.5 4.0 13.1 10 10 A L H 3<5S+ 0 0 38 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.1 0.828 109.9 39.3 -57.5 -36.5 21.8 3.1 9.5 11 11 A I T 3<5S- 0 0 0 -4,-1.4 258,-2.4 -5,-0.2 259,-0.6 0.425 115.6-116.3 -94.6 2.2 22.4 6.6 8.2 12 12 A K T X>5S+ 0 0 65 -3,-1.3 4,-1.2 -4,-0.4 3,-0.6 0.717 72.0 138.4 71.2 24.7 25.4 6.9 10.7 13 13 A A H 3>< + 0 0 0 -5,-2.1 4,-2.2 -6,-0.2 5,-0.2 0.793 65.7 64.1 -68.9 -26.9 23.7 9.8 12.6 14 14 A D H 3> S+ 0 0 64 -6,-0.8 4,-1.7 1,-0.2 -1,-0.2 0.802 99.0 52.8 -66.3 -30.5 24.9 8.1 15.8 15 15 A K H <> S+ 0 0 87 -3,-0.6 4,-0.8 2,-0.2 -1,-0.2 0.907 110.2 46.2 -72.5 -42.8 28.6 8.7 14.8 16 16 A V H >X>S+ 0 0 0 -4,-1.2 5,-1.6 1,-0.2 3,-0.6 0.903 112.6 50.2 -66.8 -41.4 28.1 12.4 14.2 17 17 A Q H ><5S+ 0 0 18 -4,-2.2 3,-2.0 1,-0.3 -1,-0.2 0.903 103.5 59.2 -62.2 -43.2 26.2 12.9 17.4 18 18 A A H 3<5S+ 0 0 87 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.789 99.6 59.4 -55.7 -28.3 28.9 11.0 19.3 19 19 A Q H <<5S- 0 0 79 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.720 127.5-103.0 -73.1 -22.5 31.2 13.8 18.0 20 20 A G T <<5S+ 0 0 53 -3,-2.0 2,-0.7 -4,-0.5 -3,-0.2 0.432 82.9 125.9 113.4 2.9 28.9 16.3 19.8 21 21 A F < + 0 0 57 -5,-1.6 -1,-0.3 1,-0.1 -2,-0.2 -0.844 15.2 151.2 -99.9 113.2 26.9 17.6 16.8 22 22 A K S S- 0 0 51 -2,-0.7 64,-2.0 213,-0.1 65,-0.3 0.231 71.3 -90.5-124.3 12.0 23.2 17.3 17.4 23 23 A G > + 0 0 0 209,-0.3 3,-1.9 1,-0.2 65,-0.3 0.616 61.9 175.1 89.1 12.7 21.8 20.2 15.3 24 24 A A T 3 + 0 0 46 1,-0.3 -1,-0.2 63,-0.1 63,-0.2 -0.182 67.3 13.8 -52.9 142.3 21.9 22.8 18.1 25 25 A N T 3 S+ 0 0 151 61,-0.6 2,-0.4 1,-0.2 -1,-0.3 0.406 96.3 125.4 71.1 -2.8 20.9 26.3 17.1 26 26 A V < - 0 0 9 -3,-1.9 62,-3.3 60,-0.2 2,-0.8 -0.752 55.6-140.6 -90.9 133.9 19.4 25.0 13.8 27 27 A K E -b 88 0B 79 -2,-0.4 92,-2.9 90,-0.2 93,-1.9 -0.834 22.9-179.1-100.0 106.4 15.8 25.9 13.0 28 28 A V E -bc 89 120B 0 60,-2.1 62,-2.1 -2,-0.8 2,-0.5 -0.879 10.0-159.3-107.9 135.5 13.8 23.1 11.4 29 29 A A E -bc 90 121B 0 91,-2.6 93,-3.1 -2,-0.4 2,-0.7 -0.959 4.9-153.9-117.4 127.9 10.2 23.4 10.4 30 30 A V E -bc 91 122B 2 60,-2.7 62,-2.0 -2,-0.5 2,-1.2 -0.884 5.7-158.0-102.2 108.6 8.0 20.4 9.9 31 31 A L E +b 92 0B 0 91,-2.8 93,-0.4 -2,-0.7 62,-0.2 -0.733 51.5 100.6 -88.6 94.7 5.2 21.3 7.5 32 32 A D E S-b 93 0B 0 -2,-1.2 62,-2.4 60,-1.0 63,-1.7 -0.458 88.7 -48.2-144.7-146.4 2.6 18.6 8.4 33 33 A T S S- 0 0 1 1,-0.4 27,-0.5 60,-0.2 28,-0.2 0.194 93.2 -97.3 -88.0 12.8 -0.6 17.8 10.3 34 34 A G - 0 0 2 58,-0.2 -1,-0.4 -4,-0.2 2,-0.4 -0.489 40.4 -87.2 101.8-173.6 0.8 19.6 13.3 35 35 A I - 0 0 1 21,-1.3 2,-2.1 23,-0.3 3,-0.1 -1.000 19.4-124.4-143.7 140.3 2.6 18.3 16.4 36 36 A Q > - 0 0 19 -2,-0.4 3,-2.7 22,-0.2 22,-0.2 -0.576 34.2-175.6 -82.2 77.1 1.4 17.0 19.8 37 37 A A T 3 S+ 0 0 33 -2,-2.1 7,-0.3 20,-0.7 -1,-0.2 0.623 73.9 66.9 -50.1 -21.6 3.6 19.6 21.6 38 38 A S T 3 S+ 0 0 94 19,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.487 71.6 123.2 -81.9 -1.3 2.7 18.1 25.0 39 39 A H X - 0 0 3 -3,-2.7 3,-2.0 1,-0.1 168,-0.0 -0.443 64.3-138.2 -62.6 124.5 4.6 14.9 24.1 40 40 A P T 3 S+ 0 0 75 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.595 101.2 52.6 -61.1 -13.0 7.3 14.3 26.8 41 41 A D T 3 S+ 0 0 0 32,-0.0 33,-2.3 35,-0.0 2,-0.3 0.193 102.6 69.1-109.6 16.9 9.8 13.3 24.1 42 42 A L < - 0 0 10 -3,-2.0 2,-0.5 31,-0.2 31,-0.1 -0.987 56.6-160.8-136.8 145.6 9.4 16.4 22.0 43 43 A N - 0 0 100 -2,-0.3 46,-0.8 29,-0.3 2,-0.5 -0.862 11.2-173.1-128.6 95.9 10.3 20.1 22.4 44 44 A V E -d 89 0B 24 -2,-0.5 46,-0.2 -7,-0.3 3,-0.1 -0.791 6.3-172.7 -89.8 123.9 8.4 22.4 20.0 45 45 A V E - 0 0 80 44,-2.9 2,-0.3 -2,-0.5 45,-0.2 0.766 60.3 -49.8 -86.8 -28.8 9.6 26.0 20.2 46 46 A G E +d 90 0B 11 43,-1.3 45,-2.6 10,-0.1 2,-0.3 -0.963 56.6 163.1-179.7-166.7 6.9 27.5 18.0 47 47 A G E -d 91 0B 20 -2,-0.3 2,-0.3 43,-0.3 45,-0.2 -0.966 26.7-111.3 157.3-170.0 5.0 27.3 14.8 48 48 A A E -d 92 0B 17 43,-1.5 45,-1.7 -2,-0.3 2,-0.5 -0.985 14.3-136.1-155.9 151.8 1.9 28.5 12.9 49 49 A S E +d 93 0B 37 -2,-0.3 45,-0.2 43,-0.2 7,-0.1 -0.963 17.5 175.8-118.9 128.2 -1.3 27.0 11.6 50 50 A F + 0 0 75 43,-2.7 2,-0.5 -2,-0.5 44,-0.1 -0.052 59.5 96.8-114.6 27.5 -2.9 27.7 8.2 51 51 A V S > S- 0 0 25 3,-0.5 3,-1.6 42,-0.1 44,-0.1 -0.985 83.0-110.5-120.6 122.4 -5.7 25.2 8.7 52 52 A A T 3 S+ 0 0 100 -2,-0.5 -2,-0.1 1,-0.2 3,-0.1 -0.189 94.6 5.5 -54.8 134.8 -9.0 26.6 9.9 53 53 A G T 3 S+ 0 0 90 1,-0.1 2,-0.5 -4,-0.1 -1,-0.2 0.328 107.2 99.8 76.8 -8.4 -10.1 25.6 13.4 54 54 A E < - 0 0 42 -3,-1.6 -3,-0.5 39,-0.1 -1,-0.1 -0.950 62.6-142.2-120.2 123.2 -6.8 23.8 14.3 55 55 A A > - 0 0 52 -2,-0.5 3,-1.0 1,-0.1 -5,-0.1 -0.376 26.8-116.8 -72.1 155.9 -3.9 25.3 16.4 56 57 A Y T 3 S+ 0 0 73 1,-0.2 -21,-1.3 -22,-0.1 -8,-0.1 0.791 106.9 63.1 -65.5 -28.7 -0.4 24.4 15.3 57 58 A N T 3 S+ 0 0 64 -23,-0.2 -20,-0.7 -21,-0.1 2,-0.4 0.097 89.7 74.6 -88.6 22.6 0.4 22.6 18.6 58 59 A T < - 0 0 69 -3,-1.0 2,-0.5 -22,-0.2 -23,-0.3 -0.983 59.6-158.4-131.4 143.6 -2.2 19.8 18.3 59 60 A D + 0 0 14 -2,-0.4 -25,-0.1 -25,-0.2 -23,-0.1 -0.944 15.2 172.3-124.9 107.4 -2.0 16.7 16.1 60 61 A G S S+ 0 0 53 -2,-0.5 -1,-0.1 -27,-0.5 -26,-0.1 0.182 82.1 43.2 -95.9 15.2 -5.3 15.1 15.4 61 62 A N S S- 0 0 58 -28,-0.2 -1,-0.1 37,-0.1 -27,-0.1 0.689 89.8-135.2-122.3 -52.8 -3.8 12.8 12.9 62 63 A G S > S+ 0 0 0 -29,-0.1 4,-2.0 -28,-0.1 5,-0.2 -0.158 79.8 97.5 118.1 -36.8 -0.5 11.4 14.1 63 64 A H H > S+ 0 0 44 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.886 85.0 46.7 -49.7 -50.8 1.5 11.9 10.9 64 65 A G H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.908 111.2 50.0 -62.0 -45.8 3.1 15.2 12.0 65 66 A T H > S+ 0 0 0 1,-0.2 4,-1.4 2,-0.2 142,-0.3 0.828 112.9 48.2 -62.2 -35.7 4.1 14.0 15.5 66 67 A H H X S+ 0 0 0 -4,-2.0 4,-1.4 2,-0.2 141,-0.3 0.898 112.8 46.3 -72.8 -44.0 5.7 10.9 14.0 67 68 A V H X S+ 0 0 0 -4,-2.2 4,-1.0 -5,-0.2 -2,-0.2 0.894 112.6 51.6 -65.5 -39.9 7.7 12.8 11.3 68 69 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 3,-0.3 0.859 105.7 56.1 -64.7 -36.4 8.7 15.4 14.0 69 70 A G H X S+ 0 0 1 -4,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.870 101.1 56.5 -64.7 -37.6 10.0 12.6 16.2 70 71 A T H < S+ 0 0 11 -4,-1.4 13,-2.2 1,-0.2 -1,-0.2 0.819 113.5 41.6 -64.4 -30.2 12.3 11.3 13.5 71 72 A V H < S+ 0 0 0 -4,-1.0 13,-2.7 -3,-0.3 -2,-0.2 0.892 137.1 0.8 -85.5 -41.8 13.9 14.6 13.3 72 73 A A H < + 0 0 4 -4,-2.6 -29,-0.3 10,-0.2 -2,-0.2 0.134 63.9 159.5-143.1 31.6 14.2 15.6 16.9 73 74 A A < - 0 0 0 -4,-2.3 9,-2.5 -31,-0.1 -31,-0.2 -0.374 59.0 -98.4 -54.6 127.0 12.9 13.2 19.5 74 75 A L - 0 0 50 -33,-2.3 2,-1.2 7,-0.2 4,-0.2 -0.019 25.6-121.2 -48.9 150.1 14.7 14.4 22.7 75 76 A D + 0 0 80 10,-0.3 -1,-0.1 6,-0.1 2,-0.1 -0.667 69.8 111.0 -96.9 78.2 17.9 12.6 23.7 76 77 A N S S- 0 0 57 -2,-1.2 -74,-0.1 2,-0.4 -35,-0.0 -0.259 83.7 -70.1-124.0-147.6 16.9 11.5 27.2 77 78 A T S S+ 0 0 119 -2,-0.1 2,-0.3 -76,-0.1 -2,-0.1 -0.156 103.9 54.0-106.5 38.2 16.0 8.2 29.1 78 79 A T S S+ 0 0 61 2,-0.2 -2,-0.4 -4,-0.2 -76,-0.2 -0.991 92.7 0.5-165.6 156.6 12.7 7.5 27.4 79 80 A G B S-a 2 0A 9 -78,-0.7 -76,-3.5 -2,-0.3 2,-0.2 -0.397 95.8 -39.5 67.4-134.7 11.0 7.0 24.1 80 81 A V - 0 0 1 -78,-0.2 2,-0.4 -2,-0.1 -4,-0.4 -0.477 52.1-113.1-118.4-171.0 13.1 7.3 21.0 81 82 A L - 0 0 14 -2,-0.2 -7,-0.2 -78,-0.2 -73,-0.2 -0.993 22.3-138.5-135.0 129.9 15.9 9.4 19.6 82 83 A G - 0 0 0 -9,-2.5 -11,-0.2 -2,-0.4 -10,-0.2 -0.328 24.7-114.7 -81.7 165.4 15.8 11.9 16.8 83 84 A V S S+ 0 0 0 -13,-2.2 -11,-0.2 1,-0.3 -12,-0.2 0.816 116.8 19.2 -66.3 -32.1 18.4 12.4 14.1 84 85 A A S > S+ 0 0 0 -13,-2.7 3,-1.8 -14,-0.1 -1,-0.3 -0.589 74.1 174.9-139.8 71.9 19.1 15.9 15.4 85 86 A P T 3 S+ 0 0 9 0, 0.0 -10,-0.3 0, 0.0 -62,-0.1 0.546 77.2 54.8 -57.3 -12.7 17.7 15.9 19.0 86 87 A S T 3 S+ 0 0 60 -64,-2.0 -61,-0.6 -12,-0.1 -60,-0.2 0.174 80.6 124.9-109.0 16.0 19.0 19.5 19.7 87 88 A V S < S- 0 0 12 -3,-1.8 2,-0.9 -65,-0.3 -60,-0.2 -0.357 71.4-110.6 -73.2 153.0 17.2 21.1 16.8 88 89 A S E -b 27 0B 31 -62,-3.3 -60,-2.1 -65,-0.3 2,-0.5 -0.811 41.2-144.0 -86.6 109.2 14.9 24.1 17.3 89 90 A L E -bd 28 44B 1 -2,-0.9 -44,-2.9 -46,-0.8 -43,-1.3 -0.672 21.1-177.8 -87.8 121.7 11.5 22.5 16.4 90 91 A Y E -bd 29 46B 37 -62,-2.1 -60,-2.7 -2,-0.5 2,-0.7 -0.958 14.6-151.2-119.0 128.2 8.8 24.4 14.6 91 92 A A E -bd 30 47B 0 -45,-2.6 -43,-1.5 -2,-0.5 2,-0.7 -0.868 13.2-177.7-100.9 111.0 5.4 23.0 13.9 92 93 A V E -bd 31 48B 0 -62,-2.0 -60,-1.0 -2,-0.7 2,-0.7 -0.866 16.5-150.6-110.8 97.4 3.8 24.5 10.8 93 94 A K E +bd 32 49B 0 -45,-1.7 -43,-2.7 -2,-0.7 -60,-0.2 -0.560 37.3 147.9 -73.1 111.5 0.3 23.0 10.3 94 95 A V + 0 0 1 -62,-2.4 2,-0.3 -2,-0.7 8,-0.2 0.333 60.7 60.3-121.8 -0.3 -0.6 22.9 6.6 95 96 A L S S- 0 0 13 -63,-1.7 6,-0.2 6,-0.1 -44,-0.1 -0.965 75.4-131.9-130.7 145.8 -2.7 19.7 6.7 96 97 A N > - 0 0 51 4,-3.1 3,-1.9 -2,-0.3 -2,-0.1 -0.112 45.6 -76.5 -85.2-172.8 -5.9 19.0 8.7 97 98 A S T 3 S+ 0 0 52 1,-0.3 -64,-0.1 2,-0.1 -1,-0.1 0.705 130.2 57.1 -57.2 -24.8 -6.9 16.0 10.8 98 99 A S T 3 S- 0 0 101 2,-0.2 -1,-0.3 -37,-0.0 3,-0.1 0.129 118.3-108.7 -95.5 18.1 -7.5 13.9 7.6 99 100 A G S < S+ 0 0 36 -3,-1.9 2,-0.3 1,-0.2 -2,-0.1 0.685 81.4 118.3 64.9 19.1 -4.0 14.5 6.3 100 101 A S + 0 0 69 25,-0.0 -4,-3.1 -67,-0.0 2,-0.3 -0.865 33.7 169.4-119.2 154.7 -5.1 16.8 3.5 101 102 A G - 0 0 31 -2,-0.3 2,-0.2 -6,-0.2 -6,-0.1 -0.983 29.8-109.0-155.6 160.0 -4.4 20.5 2.8 102 103 A S > - 0 0 67 -2,-0.3 4,-2.1 -8,-0.2 5,-0.2 -0.586 30.2-114.4 -93.5 158.4 -4.8 23.1 0.1 103 104 A Y H > S+ 0 0 103 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.900 117.9 52.0 -52.8 -45.5 -2.2 24.6 -2.1 104 105 A S H > S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.887 107.6 50.9 -61.1 -42.3 -2.7 28.0 -0.5 105 106 A G H > S+ 0 0 6 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.870 114.9 43.6 -64.8 -35.2 -2.3 26.6 3.0 106 107 A I H X S+ 0 0 11 -4,-2.1 4,-2.6 2,-0.2 3,-0.5 0.942 111.2 52.4 -74.4 -48.3 0.9 24.9 2.0 107 108 A V H X S+ 0 0 18 -4,-3.3 4,-2.7 1,-0.3 -2,-0.2 0.905 109.1 52.2 -53.7 -41.8 2.3 27.8 0.1 108 109 A S H X S+ 0 0 44 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.3 0.846 109.2 50.0 -63.2 -34.7 1.6 29.9 3.2 109 110 A G H X S+ 0 0 0 -4,-1.1 4,-2.4 -3,-0.5 -2,-0.2 0.926 110.8 47.6 -69.3 -45.4 3.5 27.4 5.3 110 111 A I H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.940 115.1 47.4 -58.8 -48.6 6.5 27.5 3.0 111 112 A E H X S+ 0 0 114 -4,-2.7 4,-2.4 -5,-0.2 -2,-0.2 0.894 109.5 52.2 -61.1 -44.7 6.4 31.3 3.0 112 113 A W H X S+ 0 0 54 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.944 110.5 48.5 -58.7 -48.1 6.1 31.5 6.7 113 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