==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(SERINE PROTEINASE) 10-JUN-92 1SUC . COMPND 2 MOLECULE: SUBTILISIN BPN' CRB-S3; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS AMYLOLIQUEFACIENS; . AUTHOR T.GALLAGHER,P.BRYAN,G.L.GILLILAND . 263 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 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 5.3 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 . 1 0.4 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 . 23 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 25.1 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 1 0 0 0 1 0 2 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 3 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 PARALLEL BRIDGES PER LADDER . 4 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 4 A V 0 0 94 0, 0.0 5,-0.0 0, 0.0 71,-0.0 0.000 360.0 360.0 360.0 -88.4 0.1 58.1 32.2 2 5 A P >> - 0 0 43 0, 0.0 4,-1.2 0, 0.0 3,-1.0 -0.200 360.0-107.7 -66.5 152.7 1.0 55.3 34.6 3 6 A Y H 3> S+ 0 0 151 1,-0.2 4,-2.3 2,-0.2 3,-0.2 0.869 117.4 61.9 -53.3 -39.1 3.8 56.0 37.1 4 7 A G H 3> S+ 0 0 7 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.814 100.2 54.8 -59.3 -26.8 6.3 53.8 35.2 5 8 A V H <4>S+ 0 0 2 -3,-1.0 5,-1.5 2,-0.2 4,-0.3 0.933 111.8 42.5 -71.5 -49.8 6.0 56.1 32.1 6 9 A S H ><5S+ 0 0 61 -4,-1.2 3,-0.8 1,-0.2 -2,-0.2 0.883 109.9 59.3 -60.7 -37.4 7.0 59.2 34.1 7 10 A Q H 3<5S+ 0 0 23 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.865 105.9 46.4 -60.4 -44.0 9.7 57.2 35.9 8 11 A I T 3<5S- 0 0 0 -4,-1.6 250,-2.4 -5,-0.1 251,-0.5 0.439 116.6-117.4 -78.4 -5.9 11.5 56.4 32.6 9 12 A K T X>5 + 0 0 91 -3,-0.8 4,-0.7 -4,-0.3 3,-0.6 0.612 68.4 140.8 75.2 21.1 11.1 60.1 31.6 10 13 A A H >>< + 0 0 0 -5,-1.5 4,-1.7 1,-0.2 3,-0.8 0.839 57.3 67.8 -53.1 -44.5 8.9 59.3 28.5 11 14 A P H 3> S+ 0 0 47 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.860 92.3 61.3 -54.7 -30.5 6.5 62.3 28.9 12 15 A A H <> S+ 0 0 23 -3,-0.6 4,-0.7 1,-0.2 -2,-0.2 0.899 107.2 45.0 -62.9 -39.5 9.3 64.8 28.1 13 16 A L H X<>S+ 0 0 1 -3,-0.8 5,-2.7 -4,-0.7 3,-0.6 0.906 110.4 54.3 -69.3 -41.2 9.6 63.2 24.7 14 17 A H H ><5S+ 0 0 49 -4,-1.7 3,-1.6 1,-0.2 -2,-0.2 0.925 104.3 53.8 -59.4 -42.5 5.9 63.2 24.2 15 18 A S H 3<5S+ 0 0 106 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.713 107.3 53.9 -64.5 -23.0 5.6 66.9 24.9 16 19 A Q T <<5S- 0 0 108 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.506 124.3-103.4 -88.7 -4.2 8.3 67.3 22.1 17 20 A G T < 5S+ 0 0 55 -3,-1.6 2,-0.8 -4,-0.5 -3,-0.2 0.500 81.8 130.2 83.8 15.5 6.2 65.4 19.6 18 21 A Y < + 0 0 74 -5,-2.7 -1,-0.2 1,-0.1 -2,-0.2 -0.830 14.9 143.0-101.2 104.9 8.3 62.2 19.8 19 22 A T S S- 0 0 25 -2,-0.8 56,-2.2 54,-0.1 57,-0.8 0.229 75.1 -89.2-127.8 9.2 5.8 59.4 20.3 20 23 A G > + 0 0 0 201,-0.3 3,-1.4 55,-0.2 57,-0.4 0.659 61.3 176.1 84.8 27.0 7.1 56.5 18.4 21 24 A S T 3 + 0 0 58 1,-0.3 -1,-0.2 55,-0.2 55,-0.2 -0.241 67.3 11.8 -66.2 134.0 5.5 57.3 15.0 22 25 A N T 3 S+ 0 0 150 53,-0.6 2,-0.6 1,-0.2 -1,-0.3 0.623 95.4 127.9 72.2 16.2 6.4 54.9 12.1 23 26 A V < - 0 0 6 -3,-1.4 54,-3.2 52,-0.2 2,-0.6 -0.920 51.3-147.1-103.6 128.6 8.1 52.5 14.5 24 27 A K E -a 77 0A 77 -2,-0.6 84,-2.3 82,-0.2 85,-2.0 -0.747 17.0-173.0-103.0 115.9 6.9 48.9 14.2 25 28 A V E -ab 78 109A 0 52,-3.3 54,-3.0 -2,-0.6 2,-0.6 -0.955 11.6-151.6-115.7 129.3 7.0 47.0 17.5 26 29 A A E -ab 79 110A 0 83,-3.1 85,-2.8 -2,-0.5 2,-1.0 -0.767 2.0-156.0-102.4 119.3 6.3 43.3 17.7 27 30 A V E -ab 80 111A 0 52,-3.7 54,-2.5 -2,-0.6 2,-1.1 -0.829 8.9-162.0 -95.9 103.3 4.7 42.1 21.0 28 31 A I E +ab 81 112A 0 83,-2.4 85,-0.5 -2,-1.0 2,-0.2 -0.728 52.5 93.4 -93.6 93.5 5.8 38.4 21.0 29 32 A D E S-a 82 0A 0 52,-2.8 54,-2.9 -2,-1.1 55,-1.6 -0.686 93.9 -42.2-155.4-156.7 3.3 37.3 23.5 30 33 A S S S- 0 0 1 1,-0.4 28,-0.5 53,-0.2 29,-0.3 0.284 94.6 -92.1 -79.3 14.2 -0.2 35.8 24.1 31 34 A G - 0 0 0 50,-0.4 2,-0.4 -4,-0.2 -1,-0.4 -0.427 42.1 -93.3 96.7-174.4 -1.7 38.0 21.4 32 35 A I - 0 0 0 22,-2.3 2,-1.2 -2,-0.2 48,-0.1 -0.963 23.3-123.1-141.5 133.9 -3.3 41.5 21.7 33 36 A D > - 0 0 17 -2,-0.4 3,-1.0 1,-0.2 23,-0.2 -0.482 27.1-173.6 -74.9 99.6 -6.9 42.2 22.2 34 37 A S T 3 S+ 0 0 55 21,-1.2 7,-0.3 -2,-1.2 -1,-0.2 0.710 76.5 71.3 -70.2 -18.8 -7.3 44.5 19.2 35 38 A S T 3 + 0 0 87 20,-0.4 -1,-0.2 5,-0.1 -2,-0.1 0.582 68.8 112.9 -71.1 -21.1 -10.9 45.3 20.4 36 39 A H X - 0 0 3 -3,-1.0 3,-1.8 1,-0.1 160,-0.0 -0.438 69.3-137.8 -60.4 118.9 -9.6 47.4 23.3 37 40 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.835 101.3 51.9 -50.6 -25.6 -10.6 51.0 22.7 38 41 A D T 3 S+ 0 0 90 2,-0.0 2,-0.4 -3,-0.0 -2,-0.1 0.508 98.5 79.1 -93.5 -6.9 -7.2 52.2 23.9 39 42 A L < - 0 0 12 -3,-1.8 2,-0.6 -6,-0.1 28,-0.1 -0.869 56.3-162.8-111.9 132.0 -5.1 50.0 21.6 40 43 A K - 0 0 187 -2,-0.4 38,-0.7 36,-0.2 2,-0.6 -0.953 13.3-166.0-111.8 112.8 -4.3 50.4 17.9 41 44 A V E -c 78 0A 29 -2,-0.6 38,-0.2 -7,-0.3 36,-0.1 -0.894 8.6-172.3-101.0 128.2 -3.1 47.0 16.5 42 45 A A E - 0 0 59 36,-2.5 2,-0.3 -2,-0.6 37,-0.2 0.841 57.6 -60.0 -88.8 -30.8 -1.4 47.3 13.0 43 46 A G E +c 79 0A 17 35,-1.0 37,-2.5 11,-0.0 2,-0.3 -0.909 57.3 161.2 175.6-158.7 -1.1 43.6 12.2 44 47 A G E -c 80 0A 23 35,-0.3 2,-0.3 -2,-0.3 37,-0.2 -0.964 26.3-114.0 142.4-169.5 0.5 40.5 13.4 45 48 A A E -c 81 0A 18 35,-2.6 37,-2.8 -2,-0.3 2,-0.5 -0.972 14.8-126.4-160.3 148.3 0.4 36.7 13.2 46 49 A S E +c 82 0A 30 6,-0.3 37,-0.2 -2,-0.3 35,-0.1 -0.950 20.2 173.8-105.4 140.3 -0.4 33.6 15.3 47 50 A F + 0 0 50 35,-3.7 36,-0.2 -2,-0.5 5,-0.1 0.200 51.8 106.3-121.7 10.9 2.0 30.7 15.7 48 51 A V B > -J 51 0B 4 3,-0.6 3,-1.2 34,-0.4 36,-0.1 -0.855 65.2-146.6 -95.6 112.9 -0.1 28.9 18.3 49 52 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.856 95.0 39.5 -55.8 -36.2 -1.6 25.9 16.5 50 53 A S T 3 S+ 0 0 108 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.332 114.5 55.1 -96.7 3.2 -4.9 25.8 18.5 51 54 A E B < +J 48 0B 31 -3,-1.2 -3,-0.6 31,-0.1 -1,-0.2 -0.751 60.5 170.3-142.5 85.9 -5.3 29.7 18.7 52 55 A T + 0 0 122 -2,-0.3 -6,-0.3 -3,-0.1 -1,-0.1 0.575 53.7 82.6 -77.5 -15.8 -5.2 31.0 15.1 53 56 A N > - 0 0 68 1,-0.1 3,-1.2 -8,-0.1 -1,-0.1 -0.847 53.8-169.4 -99.0 115.3 -6.3 34.6 15.9 54 57 A P T 3 S+ 0 0 13 0, 0.0 -22,-2.3 0, 0.0 -1,-0.1 0.696 86.0 63.5 -70.7 -18.8 -3.5 36.9 17.1 55 58 A F T 3 S+ 0 0 66 -24,-0.2 -21,-1.2 -22,-0.1 2,-0.6 0.347 85.5 82.3 -92.3 6.2 -6.1 39.5 18.0 56 59 A Q < - 0 0 100 -3,-1.2 2,-0.7 -23,-0.2 -23,-0.1 -0.953 63.9-162.4-114.8 114.6 -7.7 37.4 20.6 57 60 A D + 0 0 11 -2,-0.6 -26,-0.1 -26,-0.1 -24,-0.1 -0.814 16.8 170.0-104.5 101.7 -5.9 37.5 23.9 58 61 A N S S+ 0 0 75 -2,-0.7 -1,-0.1 -28,-0.5 -27,-0.1 0.515 79.0 43.4 -87.1 -11.9 -7.1 34.5 26.0 59 62 A N S S- 0 0 49 -29,-0.3 -1,-0.2 25,-0.1 -28,-0.1 0.869 91.0-136.4 -94.9 -59.4 -4.5 35.0 28.6 60 63 A S S > S+ 0 0 24 -30,-0.1 4,-2.0 -29,-0.1 5,-0.2 -0.174 79.6 98.5 115.2 -26.6 -4.4 38.8 29.3 61 64 A H H > S+ 0 0 21 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.892 80.8 46.0 -56.3 -51.5 -0.5 39.0 29.3 62 65 A G H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.864 111.4 52.1 -69.1 -30.4 0.1 40.2 25.8 63 66 A T H > S+ 0 0 0 2,-0.2 4,-2.5 3,-0.2 133,-0.3 0.926 111.5 47.6 -69.1 -39.7 -2.6 42.9 26.0 64 67 A H H X S+ 0 0 0 -4,-2.0 4,-1.4 2,-0.2 132,-0.3 0.952 113.8 46.7 -67.7 -42.3 -1.0 44.2 29.2 65 68 A V H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 3,-0.5 0.924 113.3 49.9 -62.3 -50.5 2.5 44.1 27.7 66 69 A A H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.912 106.7 54.6 -56.0 -41.8 1.2 45.9 24.5 67 70 A G H X S+ 0 0 7 -4,-2.5 4,-1.9 129,-0.3 -1,-0.2 0.788 106.6 51.1 -67.3 -25.7 -0.6 48.6 26.6 68 71 A T H X S+ 0 0 5 -4,-1.4 4,-2.2 -3,-0.5 -1,-0.2 0.913 109.8 49.2 -75.4 -45.3 2.7 49.4 28.3 69 72 A V H X S+ 0 0 0 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.952 114.5 48.1 -52.1 -48.2 4.5 49.7 24.9 70 73 A A H < S+ 0 0 20 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.814 107.9 52.6 -65.9 -35.7 1.5 52.0 23.9 71 74 A A H < S+ 0 0 33 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.936 117.4 39.2 -69.1 -34.2 1.7 54.1 27.1 72 84 A V H < S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.824 133.3 22.9 -76.8 -54.4 5.5 54.7 26.4 73 85 A A S >< S+ 0 0 1 -4,-2.8 3,-1.2 -5,-0.2 -1,-0.3 -0.794 70.6 178.0-121.8 78.9 5.2 55.1 22.6 74 86 A P T 3 S+ 0 0 70 0, 0.0 -54,-0.1 0, 0.0 -1,-0.1 0.837 80.6 46.9 -54.8 -25.6 1.6 56.1 21.9 75 87 A S T 3 S+ 0 0 55 -56,-2.2 -53,-0.6 2,-0.1 -55,-0.2 0.477 84.6 121.7-100.2 -3.0 2.1 56.5 18.1 76 88 A A < - 0 0 13 -3,-1.2 2,-0.8 -57,-0.8 -52,-0.2 -0.225 69.6-115.7 -64.7 142.0 4.0 53.1 17.6 77 89 A S E -a 24 0A 38 -54,-3.2 -52,-3.3 -57,-0.4 2,-0.5 -0.749 35.3-148.2 -85.1 109.6 2.6 50.5 15.2 78 90 A L E -ac 25 41A 3 -2,-0.8 -36,-2.5 -38,-0.7 -35,-1.0 -0.750 12.0-165.1 -91.5 129.0 1.8 47.6 17.4 79 91 A Y E -ac 26 43A 36 -54,-3.0 -52,-3.7 -2,-0.5 2,-0.9 -0.915 13.2-144.2-118.9 123.8 2.1 44.0 16.1 80 92 A A E -ac 27 44A 0 -37,-2.5 -35,-2.6 -2,-0.5 2,-0.8 -0.800 17.3-177.4 -91.9 107.3 0.5 41.1 17.9 81 93 A V E -ac 28 45A 0 -54,-2.5 -52,-2.8 -2,-0.9 2,-0.9 -0.899 16.2-154.1-110.1 98.6 2.9 38.1 17.5 82 94 A K E +ac 29 46A 2 -37,-2.8 -35,-3.7 -2,-0.8 -34,-0.4 -0.667 41.0 139.3 -85.7 112.4 0.9 35.3 19.2 83 95 A V + 0 0 0 -54,-2.9 2,-0.4 -2,-0.9 12,-0.2 0.428 57.1 69.1-125.7 -16.4 3.3 32.7 20.4 84 96 A L S S- 0 0 11 -55,-1.6 6,-0.2 -3,-0.1 -25,-0.1 -0.947 71.2-140.0-114.2 137.2 1.7 31.9 23.8 85 97 A G > - 0 0 5 4,-2.9 3,-2.4 -2,-0.4 -2,-0.1 -0.086 44.6 -73.7 -83.1-174.2 -1.6 30.2 24.3 86 98 A A T 3 S+ 0 0 44 1,-0.3 -56,-0.1 2,-0.1 -1,-0.0 0.851 131.2 56.3 -51.7 -30.1 -4.4 30.8 26.9 87 99 A D T 3 S- 0 0 131 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.505 114.9-114.1 -83.4 -2.7 -2.2 29.3 29.7 88 100 A G S < S+ 0 0 31 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.521 81.9 115.5 78.0 2.6 0.7 31.8 29.0 89 101 A S + 0 0 64 -59,-0.0 -4,-2.9 0, 0.0 -1,-0.3 -0.675 39.8 177.8 -97.7 155.0 2.9 28.9 27.9 90 102 A G - 0 0 24 -2,-0.3 -6,-0.1 -6,-0.2 2,-0.1 -0.975 30.4-108.7-156.9 148.7 4.3 28.3 24.4 91 103 A Q > - 0 0 124 -2,-0.3 4,-2.0 -8,-0.2 3,-0.4 -0.446 31.9-118.7 -74.0 144.3 6.6 25.9 22.6 92 104 A Y H > S+ 0 0 66 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.928 114.7 57.3 -53.4 -34.3 10.1 27.0 21.6 93 105 A S H > S+ 0 0 67 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.898 105.9 49.4 -63.2 -38.2 9.2 26.4 17.9 94 106 A W H > S+ 0 0 54 -3,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.954 113.0 47.1 -67.5 -43.6 6.2 28.8 18.2 95 107 A I H X S+ 0 0 12 -4,-2.0 4,-2.0 -12,-0.2 -2,-0.2 0.905 114.2 46.1 -61.3 -49.1 8.4 31.5 19.8 96 108 A I H X S+ 0 0 20 -4,-3.0 4,-3.0 2,-0.2 -2,-0.2 0.900 110.3 54.6 -66.9 -43.3 11.2 31.1 17.2 97 109 A N H X S+ 0 0 86 -4,-2.9 4,-2.8 -5,-0.3 -2,-0.2 0.927 107.7 50.8 -52.5 -41.2 8.6 31.1 14.4 98 110 A G H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.909 110.3 47.9 -68.1 -36.2 7.3 34.5 15.9 99 111 A I H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.954 110.5 52.7 -67.6 -50.8 10.9 35.9 15.9 100 112 A E H X S+ 0 0 77 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.956 110.8 47.8 -50.4 -38.1 11.3 34.7 12.3 101 113 A W H X S+ 0 0 43 -4,-2.8 4,-3.0 2,-0.2 -2,-0.2 0.907 107.9 54.5 -66.6 -48.3 8.1 36.5 11.3 102 114 A A H <>S+ 0 0 0 -4,-2.5 5,-2.4 2,-0.2 -1,-0.2 0.894 112.4 43.3 -55.4 -37.0 9.2 39.7 13.1 103 115 A I H ><5S+ 0 0 19 -4,-2.2 3,-1.6 3,-0.2 -2,-0.2 0.957 114.7 50.0 -71.3 -51.7 12.4 39.8 11.1 104 116 A A H 3<5S+ 0 0 72 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.825 111.9 48.9 -56.4 -36.3 10.6 38.9 7.8 105 117 A N T 3<5S- 0 0 70 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.195 115.4-111.8 -96.6 10.6 8.0 41.6 8.4 106 118 A N T < 5 - 0 0 115 -3,-1.6 -82,-0.2 -5,-0.2 -3,-0.2 0.922 45.8-179.0 58.0 47.2 10.5 44.4 9.2 107 119 A M < - 0 0 3 -5,-2.4 -82,-0.2 1,-0.1 -1,-0.2 -0.535 19.1-157.7 -71.3 134.2 9.8 45.0 12.8 108 120 A D S S+ 0 0 59 -84,-2.3 28,-2.7 1,-0.3 2,-0.4 0.782 78.4 24.6 -81.4 -33.1 11.9 47.7 14.4 109 121 A V E -bd 25 136A 0 -85,-2.0 -83,-3.1 26,-0.2 2,-0.5 -0.979 65.4-159.0-138.4 137.3 11.6 46.5 17.9 110 122 A I E -bd 26 137A 0 26,-2.9 28,-3.1 -2,-0.4 2,-0.5 -0.993 7.4-163.7-114.7 135.2 10.9 43.0 19.3 111 123 A N E -bd 27 138A 0 -85,-2.8 -83,-2.4 -2,-0.5 2,-0.5 -0.945 7.6-178.2-121.7 127.4 9.5 42.7 22.8 112 124 A M E +bd 28 139A 0 26,-2.6 28,-2.1 -2,-0.5 2,-1.6 -0.815 7.7 177.8-129.2 87.0 9.7 39.3 24.5 113 125 A S + 0 0 2 -85,-0.5 2,-0.3 -2,-0.5 96,-0.2 -0.339 61.7 89.7 -86.3 57.5 8.1 39.4 28.0 114 126 A L - 0 0 20 -2,-1.6 2,-0.3 26,-0.1 43,-0.3 -0.974 52.6-178.8-150.8 155.1 8.9 35.7 28.1 115 127 A G - 0 0 53 -2,-0.3 26,-0.1 41,-0.1 28,-0.1 -0.963 11.0-159.1-165.3 146.8 11.7 33.5 29.2 116 128 A G B -K 155 0C 11 39,-2.6 39,-3.1 -2,-0.3 -2,-0.0 -0.919 28.6-124.6-124.0 153.3 12.7 29.9 29.5 117 129 A P S S+ 0 0 127 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.782 93.0 51.0 -69.8 -22.0 15.4 28.2 31.7 118 130 A S - 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