==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SERINE PROTEASE 17-SEP-97 1VSB . COMPND 2 MOLECULE: SUBTILISIN CARLSBERG, TYPE VIII; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS LICHENIFORMIS; . AUTHOR V.S.STOLL,B.T.EGER,R.C.HYNES,V.MARTICHONOK,J.B.JONES,E.F.PAI . 274 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9767.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 188 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 5.1 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 . 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 . 22 8.0 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 2 2 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 1 A A 0 0 112 0, 0.0 2,-0.5 0, 0.0 78,-0.3 0.000 360.0 360.0 360.0 -15.4 41.8 10.9 33.2 2 2 A Q - 0 0 43 76,-0.1 2,-0.3 74,-0.1 78,-0.2 -0.852 360.0-145.8 -99.9 125.8 38.7 8.8 34.0 3 3 A T - 0 0 69 76,-3.2 78,-0.3 -2,-0.5 75,-0.1 -0.704 1.4-148.8 -88.0 138.3 35.4 10.7 33.6 4 4 A V - 0 0 74 -2,-0.3 76,-0.1 76,-0.2 78,-0.1 -0.917 21.9-133.8-107.9 104.7 32.5 9.9 36.0 5 5 A P > - 0 0 16 0, 0.0 3,-1.8 0, 0.0 199,-0.1 -0.263 22.0-112.4 -55.6 147.0 29.3 10.3 34.1 6 6 A Y T 3> S+ 0 0 61 1,-0.3 4,-1.4 197,-0.2 198,-0.1 0.736 110.6 68.7 -54.9 -27.3 26.7 12.3 36.1 7 7 A G H 3> S+ 0 0 2 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.766 87.2 65.5 -65.8 -27.1 24.4 9.3 36.4 8 8 A I H <4>S+ 0 0 4 -3,-1.8 5,-2.4 1,-0.2 6,-0.8 0.965 111.7 31.8 -62.2 -57.3 26.7 7.3 38.7 9 9 A P H 45S+ 0 0 56 0, 0.0 3,-0.4 0, 0.0 -1,-0.2 0.764 111.5 66.2 -74.2 -20.4 26.4 9.7 41.6 10 10 A L H <5S+ 0 0 37 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.1 0.869 111.7 34.4 -66.5 -34.1 22.8 10.7 40.8 11 11 A I T <5S- 0 0 0 -4,-1.5 258,-2.9 -3,-0.2 259,-0.5 0.394 116.0-117.4 -97.5 3.2 21.7 7.2 41.6 12 12 A K T >5 + 0 0 61 -3,-0.4 4,-1.1 -4,-0.3 -4,-0.1 0.767 69.1 140.6 64.8 33.6 24.3 6.9 44.4 13 13 A A H > S+ 0 0 63 -6,-0.8 4,-2.4 2,-0.2 -1,-0.2 0.895 99.0 55.4 -64.7 -38.4 29.3 5.7 43.9 15 15 A K H > S+ 0 0 80 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.887 113.8 41.9 -62.8 -37.5 28.2 5.4 47.5 16 16 A V H ><>S+ 0 0 0 -4,-1.1 5,-1.6 2,-0.2 3,-0.7 0.868 110.7 52.8 -78.4 -39.0 27.8 1.7 47.0 17 17 A Q H ><5S+ 0 0 11 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.879 104.1 61.3 -62.1 -36.4 31.0 1.1 45.0 18 18 A A H 3<5S+ 0 0 85 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.772 96.2 58.2 -59.6 -30.3 32.8 3.0 47.9 19 19 A Q T <<5S- 0 0 81 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.427 128.2-100.9 -77.8 -4.6 31.6 0.2 50.3 20 20 A G T < 5S+ 0 0 54 -3,-1.8 2,-0.7 1,-0.2 -3,-0.2 0.583 83.7 128.1 96.5 11.3 33.5 -2.2 48.0 21 21 A F < + 0 0 63 -5,-1.6 -1,-0.2 1,-0.1 -2,-0.2 -0.904 15.6 151.8-106.0 112.0 30.5 -3.6 46.1 22 22 A K - 0 0 53 -2,-0.7 64,-2.3 62,-0.1 65,-0.4 0.199 69.3 -90.2-124.4 14.0 31.1 -3.4 42.3 23 23 A G > + 0 0 0 209,-0.2 3,-2.0 1,-0.2 65,-0.3 0.613 59.5 177.6 88.6 14.4 29.2 -6.3 40.8 24 24 A A T 3 + 0 0 63 1,-0.3 -1,-0.2 63,-0.1 63,-0.2 -0.270 68.3 2.5 -58.6 127.5 31.9 -8.9 40.9 25 25 A N T 3 S+ 0 0 127 61,-0.9 2,-0.4 1,-0.3 -1,-0.3 0.623 95.1 127.7 72.5 12.5 30.8 -12.3 39.7 26 26 A V < - 0 0 8 -3,-2.0 62,-3.2 60,-0.2 2,-0.6 -0.851 56.2-136.5 -95.3 139.0 27.4 -11.1 38.8 27 27 A K E -a 88 0A 48 -2,-0.4 92,-2.6 60,-0.2 93,-1.9 -0.887 23.0-176.5-102.4 117.5 26.5 -12.1 35.2 28 28 A V E -ab 89 120A 0 60,-2.6 62,-2.6 -2,-0.6 2,-0.5 -0.953 11.0-156.5-117.0 124.7 24.8 -9.4 33.1 29 29 A A E -ab 90 121A 0 91,-2.7 93,-2.5 -2,-0.5 2,-0.8 -0.863 3.7-155.8 -99.6 127.4 23.6 -9.9 29.5 30 30 A V E -ab 91 122A 1 60,-3.0 62,-2.5 -2,-0.5 2,-1.3 -0.890 5.6-161.0-101.9 101.7 23.3 -6.9 27.3 31 31 A L E +a 92 0A 0 91,-2.2 93,-0.4 -2,-0.8 62,-0.2 -0.736 51.0 101.9 -83.7 97.1 20.7 -7.8 24.5 32 32 A D E S-a 93 0A 0 60,-1.4 62,-2.6 -2,-1.3 63,-1.7 -0.484 89.7 -47.0-149.1-145.4 21.6 -5.2 22.0 33 33 A T S S- 0 0 0 1,-0.4 27,-0.4 60,-0.2 28,-0.3 0.205 92.4 -95.6 -88.8 17.1 23.4 -4.4 18.8 34 34 A G - 0 0 1 58,-0.3 -1,-0.4 -4,-0.2 2,-0.3 -0.470 42.7 -94.2 95.2-175.9 26.5 -6.3 20.1 35 35 A I - 0 0 1 21,-1.4 2,-2.0 23,-0.4 3,-0.1 -0.996 21.0-118.6-143.4 138.6 29.5 -4.7 21.8 36 36 A Q > - 0 0 18 -2,-0.3 3,-2.3 1,-0.2 22,-0.2 -0.601 35.7-171.1 -75.9 85.4 32.9 -3.5 20.4 37 37 A A T 3 S+ 0 0 31 -2,-2.0 7,-0.4 20,-0.9 -1,-0.2 0.773 75.9 63.9 -53.4 -27.1 34.7 -6.1 22.6 38 38 A S T 3 S+ 0 0 91 19,-0.4 -1,-0.3 -3,-0.1 -2,-0.1 0.518 71.1 123.2 -78.4 -5.7 38.1 -4.6 21.8 39 39 A H X - 0 0 3 -3,-2.3 3,-1.7 1,-0.1 168,-0.0 -0.373 66.9-131.8 -57.8 133.4 37.2 -1.2 23.4 40 40 A P T 3 S+ 0 0 79 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.710 103.7 52.7 -59.3 -26.6 39.9 -0.4 26.1 41 41 A D T 3 S+ 0 0 0 32,-0.1 33,-2.5 35,-0.0 2,-0.4 0.298 102.4 67.2 -96.8 11.5 37.3 0.4 28.7 42 42 A L < - 0 0 9 -3,-1.7 2,-0.5 31,-0.2 31,-0.1 -0.980 54.9-162.8-134.7 142.4 35.2 -2.8 28.4 43 43 A N - 0 0 100 -2,-0.4 46,-0.7 29,-0.3 2,-0.6 -0.932 12.4-167.7-125.8 103.4 35.8 -6.5 29.2 44 44 A V E -c 89 0A 26 -2,-0.5 46,-0.2 -7,-0.4 3,-0.1 -0.847 6.7-170.6 -93.8 119.5 33.3 -8.8 27.5 45 45 A V E - 0 0 74 44,-2.6 2,-0.3 -2,-0.6 45,-0.2 0.723 59.7 -50.1 -81.4 -24.4 33.4 -12.3 28.9 46 46 A G E +c 90 0A 10 43,-1.1 45,-2.6 10,-0.1 2,-0.3 -0.986 56.1 163.1 176.0-170.1 31.2 -13.9 26.2 47 47 A G E -c 91 0A 20 -2,-0.3 2,-0.3 43,-0.3 45,-0.2 -0.972 25.9-113.7 160.2-170.1 28.0 -13.8 24.3 48 48 A A E -c 92 0A 17 43,-1.4 45,-2.4 -2,-0.3 2,-0.5 -0.967 16.5-133.8-154.6 157.8 26.1 -15.0 21.2 49 49 A S E +c 93 0A 37 -2,-0.3 45,-0.2 43,-0.2 7,-0.1 -0.987 18.4 176.1-125.0 127.1 24.7 -13.5 18.1 50 50 A F + 0 0 74 43,-3.2 2,-0.4 -2,-0.5 44,-0.1 0.041 60.2 95.7-112.2 22.4 21.2 -14.2 16.7 51 51 A V S > S- 0 0 28 3,-0.4 3,-1.1 42,-0.2 2,-0.1 -0.952 83.9-109.5-114.5 130.7 21.7 -11.7 13.8 52 52 A A T 3 S+ 0 0 99 -2,-0.4 -2,-0.1 1,-0.2 3,-0.1 -0.347 93.7 5.1 -62.9 131.0 22.8 -13.1 10.5 53 53 A G T 3 S+ 0 0 92 1,-0.1 2,-0.4 -2,-0.1 -1,-0.2 0.275 105.5 96.8 83.6 -10.6 26.3 -12.2 9.3 54 54 A E < - 0 0 44 -3,-1.1 -3,-0.4 39,-0.1 -1,-0.1 -0.944 64.4-136.7-119.5 132.1 27.5 -10.4 12.5 55 55 A A > - 0 0 51 -2,-0.4 3,-0.9 1,-0.1 -5,-0.1 -0.388 26.7-116.5 -75.7 162.0 29.6 -11.8 15.3 56 57 A Y T 3 S+ 0 0 74 1,-0.2 -21,-1.4 -22,-0.1 -8,-0.1 0.786 108.8 61.8 -70.9 -29.8 28.6 -10.9 18.9 57 58 A N T 3 S+ 0 0 68 -23,-0.2 -20,-0.9 -21,-0.1 -19,-0.4 0.088 92.7 74.0 -87.1 21.9 31.8 -9.1 19.7 58 59 A T < - 0 0 67 -3,-0.9 2,-0.4 -22,-0.2 -23,-0.4 -0.943 59.0-164.4-129.5 151.3 31.4 -6.4 17.0 59 60 A D + 0 0 14 -2,-0.3 -25,-0.1 -25,-0.2 -23,-0.1 -0.890 10.6 176.8-140.4 102.2 29.0 -3.5 17.1 60 61 A G S S+ 0 0 62 -27,-0.4 -26,-0.1 -2,-0.4 -1,-0.1 0.425 82.0 45.8 -86.3 0.8 28.4 -1.7 13.8 61 62 A N S S- 0 0 57 -28,-0.3 -1,-0.1 35,-0.0 36,-0.1 0.813 91.0-134.4-107.6 -51.1 25.9 0.6 15.3 62 63 A G S > S+ 0 0 0 -29,-0.1 4,-2.2 -28,-0.1 5,-0.2 -0.121 79.1 99.0 120.1 -34.7 27.3 2.0 18.6 63 64 A H H > S+ 0 0 18 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.877 82.4 47.4 -51.1 -52.2 24.2 1.5 20.7 64 65 A G H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.883 111.5 50.5 -62.0 -41.9 25.2 -1.8 22.3 65 66 A T H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 142,-0.3 0.930 111.1 49.6 -62.1 -44.5 28.7 -0.5 23.2 66 67 A H H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 141,-0.3 0.940 112.8 46.2 -60.9 -47.9 27.2 2.6 24.8 67 68 A V H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 3,-0.4 0.936 112.3 51.5 -60.8 -45.9 24.6 0.6 26.9 68 69 A A H X S+ 0 0 0 -4,-2.7 4,-3.3 1,-0.2 -1,-0.2 0.883 106.3 54.7 -58.9 -41.9 27.4 -1.8 28.0 69 70 A G H X S+ 0 0 0 -4,-2.4 4,-2.1 138,-0.2 -1,-0.2 0.814 103.6 54.0 -62.4 -35.7 29.6 1.0 29.1 70 71 A T H < S+ 0 0 8 -4,-1.5 13,-2.4 -3,-0.4 -1,-0.2 0.881 116.3 40.0 -67.4 -35.6 26.9 2.5 31.4 71 72 A V H < S+ 0 0 0 -4,-1.6 13,-2.9 11,-0.2 -2,-0.2 0.974 138.4 2.2 -75.9 -50.3 26.6 -0.9 33.0 72 73 A A H < + 0 0 4 -4,-3.3 -29,-0.3 10,-0.2 -3,-0.2 0.097 65.5 156.9-134.9 28.2 30.2 -1.9 33.2 73 74 A A < - 0 0 0 -4,-2.1 9,-2.2 -5,-0.1 -31,-0.2 -0.339 58.5 -97.9 -54.2 132.0 32.9 0.5 31.9 74 75 A L - 0 0 50 -33,-2.5 2,-0.9 7,-0.2 4,-0.2 -0.219 26.0-120.8 -56.9 138.1 36.0 -0.6 33.8 75 76 A D S S+ 0 0 82 10,-0.1 2,-0.2 6,-0.1 -1,-0.1 -0.744 70.8 105.4 -83.8 104.6 37.1 1.3 36.9 76 77 A N S S- 0 0 59 -2,-0.9 -74,-0.1 2,-0.3 -35,-0.0 -0.715 85.7 -71.3-152.9-150.9 40.6 2.5 35.9 77 78 A T S S+ 0 0 107 -2,-0.2 2,-0.3 -76,-0.1 -2,-0.1 -0.130 102.4 60.8-114.6 40.5 42.2 5.8 34.8 78 79 A T S S- 0 0 62 -4,-0.2 -2,-0.3 2,-0.2 -76,-0.1 -0.969 92.6 -2.3-155.7 161.4 40.7 6.2 31.4 79 80 A G S S- 0 0 8 -2,-0.3 -76,-3.2 -78,-0.3 2,-0.2 -0.213 98.4 -37.4 61.5-134.4 37.3 6.6 29.7 80 81 A V - 0 0 1 -78,-0.2 2,-0.4 -39,-0.1 -4,-0.3 -0.475 53.7-111.0-115.7-172.4 34.2 6.5 31.9 81 82 A L - 0 0 14 -78,-0.3 -7,-0.2 -2,-0.2 2,-0.1 -0.997 25.5-141.4-128.3 130.0 33.0 4.5 34.9 82 83 A G - 0 0 0 -9,-2.2 -11,-0.2 -2,-0.4 -10,-0.2 -0.415 23.5-115.2 -84.3 166.0 30.3 2.0 34.8 83 84 A V S S+ 0 0 0 -13,-2.4 -11,-0.2 1,-0.3 -12,-0.2 0.891 115.2 19.6 -66.7 -38.3 27.6 1.5 37.5 84 85 A A S > S+ 0 0 0 -13,-2.9 3,-2.0 -14,-0.2 -1,-0.3 -0.610 75.5 178.4-134.6 72.5 28.9 -2.0 38.3 85 86 A P T 3 S+ 0 0 7 0, 0.0 -62,-0.1 0, 0.0 -10,-0.1 0.638 75.7 54.1 -50.6 -26.2 32.6 -2.1 36.9 86 87 A S T 3 S+ 0 0 56 -64,-2.3 -61,-0.9 -12,-0.1 -60,-0.2 0.272 79.8 125.1 -98.2 11.6 33.4 -5.6 38.1 87 88 A V S < S- 0 0 12 -3,-2.0 2,-0.9 -65,-0.4 -60,-0.2 -0.194 70.5-111.3 -70.1 156.1 30.4 -7.4 36.4 88 89 A S E -a 27 0A 24 -62,-3.2 -60,-2.6 -65,-0.3 2,-0.5 -0.879 42.1-148.5 -88.1 109.9 30.8 -10.4 34.1 89 90 A L E -ac 28 44A 1 -2,-0.9 -44,-2.6 -46,-0.7 -43,-1.1 -0.738 17.5-173.9 -90.5 123.8 29.7 -8.8 30.8 90 91 A Y E -ac 29 46A 49 -62,-2.6 -60,-3.0 -2,-0.5 2,-0.6 -0.958 12.9-150.0-118.6 131.3 27.9 -10.8 28.1 91 92 A A E -ac 30 47A 0 -45,-2.6 -43,-1.4 -2,-0.4 2,-0.6 -0.891 12.4-176.0 -99.4 120.6 27.0 -9.4 24.7 92 93 A V E -ac 31 48A 0 -62,-2.5 -60,-1.4 -2,-0.6 2,-0.6 -0.927 16.8-148.6-118.9 100.8 24.0 -10.9 23.1 93 94 A K E +ac 32 49A 0 -45,-2.4 -43,-3.2 -2,-0.6 -60,-0.2 -0.624 41.2 142.1 -73.4 114.3 23.5 -9.5 19.6 94 95 A V + 0 0 2 -62,-2.6 2,-0.4 -2,-0.6 8,-0.3 0.362 57.7 62.9-129.7 -6.5 19.8 -9.4 18.8 95 96 A L S S- 0 0 5 -63,-1.7 6,-0.3 6,-0.1 -1,-0.1 -0.963 79.1-125.4-125.0 140.6 19.6 -6.1 16.9 96 97 A N > - 0 0 49 4,-3.5 3,-2.3 -2,-0.4 -2,-0.1 -0.117 40.0 -86.9 -75.1 179.6 21.3 -5.4 13.6 97 98 A S T 3 S+ 0 0 54 1,-0.3 -34,-0.1 2,-0.1 -1,-0.1 0.641 128.8 60.9 -64.9 -12.8 23.7 -2.5 12.8 98 99 A S T 3 S- 0 0 100 2,-0.2 -1,-0.3 -37,-0.0 3,-0.1 0.296 120.5-109.8 -94.4 7.9 20.6 -0.5 11.9 99 100 A G S < S+ 0 0 21 -3,-2.3 2,-0.3 1,-0.2 -2,-0.1 0.666 82.1 113.8 73.6 24.5 19.3 -0.9 15.5 100 101 A S + 0 0 71 25,-0.1 -4,-3.5 -67,-0.0 2,-0.3 -0.873 36.0 169.9-127.7 150.9 16.5 -3.2 14.5 101 102 A G - 0 0 35 -2,-0.3 2,-0.2 -6,-0.3 -6,-0.1 -0.984 30.0-104.4-154.4 166.4 15.8 -6.9 15.2 102 103 A S > - 0 0 64 -2,-0.3 4,-2.5 -8,-0.3 5,-0.2 -0.563 27.2-119.9 -94.4 159.2 13.1 -9.6 15.0 103 104 A Y H > S+ 0 0 80 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.932 116.7 54.9 -60.2 -42.2 11.0 -11.0 17.7 104 105 A S H > S+ 0 0 84 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.919 109.4 45.6 -56.8 -45.9 12.5 -14.4 16.9 105 106 A G H > S+ 0 0 6 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.885 114.8 48.3 -66.3 -38.2 16.0 -13.1 17.3 106 107 A I H X S+ 0 0 11 -4,-2.5 4,-2.0 2,-0.2 3,-0.3 0.962 109.8 50.7 -67.0 -47.9 15.1 -11.3 20.6 107 108 A V H X S+ 0 0 17 -4,-3.4 4,-2.8 1,-0.3 5,-0.2 0.916 109.0 53.1 -57.2 -42.8 13.3 -14.3 22.1 108 109 A S H X S+ 0 0 44 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.3 0.860 107.3 51.0 -61.7 -39.9 16.4 -16.5 21.3 109 110 A G H X S+ 0 0 0 -4,-1.5 4,-1.9 -3,-0.3 -1,-0.2 0.872 111.0 48.1 -66.3 -35.7 18.7 -14.0 23.1 110 111 A I H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.930 113.7 47.6 -67.8 -45.2 16.4 -14.1 26.2 111 112 A E H X S+ 0 0 110 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.906 110.5 51.1 -62.2 -44.2 16.4 -17.9 26.1 112 113 A W H X S+ 0 0 52 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.904 110.9 50.1 -58.6 -43.6 20.1 -18.1 25.7 113 114 A A H <>S+ 0 0 0 -4,-1.9 5,-2.4 2,-0.2 -2,-0.2 0.892 112.3 45.4 -63.9 -43.2 20.5 -15.7 28.6 114 115 A T H ><5S+ 0 0 20 -4,-2.3 3,-1.6 3,-0.2 -2,-0.2 0.957 114.9 48.3 -65.1 -48.2 18.2 -17.8 30.9 115 116 A T H 3<5S+ 0 0 114 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.816 110.2 51.8 -59.9 -39.2 19.8 -21.1 29.8 116 117 A N T 3<5S- 0 0 82 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.257 117.5-110.0 -86.9 11.8 23.3 -19.7 30.4 117 118 A G T < 5 + 0 0 35 -3,-1.6 -3,-0.2 1,-0.2 -90,-0.2 0.865 49.0 175.2 66.6 42.2 22.6 -18.6 33.9 118 119 A M < - 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