==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-APR-03 1UBZ . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.MURAKI,K.HARATA . 130 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6699.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 88 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 9 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 19.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 25.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 3.8 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 0 0 1 0 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 K 0 0 64 0, 0.0 39,-2.7 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 142.4 1.8 20.4 21.2 2 2 A V B -A 39 0A 93 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.923 360.0-148.4-112.4 109.7 4.6 20.1 18.7 3 3 A F - 0 0 10 35,-2.6 2,-0.3 -2,-0.7 3,-0.0 -0.403 14.3-125.5 -70.3 150.9 7.4 22.6 19.2 4 4 A E > - 0 0 137 1,-0.1 4,-2.5 -2,-0.1 5,-0.2 -0.663 36.5-104.2 -88.9 155.7 9.2 23.9 16.2 5 5 A R H > S+ 0 0 92 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.926 116.7 36.3 -46.7 -62.9 13.0 23.4 16.7 6 6 A a H > S+ 0 0 23 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.807 113.1 58.9 -67.1 -29.6 14.1 26.9 17.5 7 7 A E H > S+ 0 0 55 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.930 109.8 45.1 -63.2 -42.3 10.9 27.6 19.4 8 8 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.934 109.5 55.9 -66.2 -45.6 11.9 24.7 21.7 9 9 A A H X S+ 0 0 0 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.877 111.2 42.4 -54.9 -46.0 15.5 25.9 22.0 10 10 A R H X S+ 0 0 119 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.884 112.7 54.4 -68.3 -37.3 14.6 29.3 23.3 11 11 A T H X S+ 0 0 38 -4,-1.8 4,-1.4 1,-0.2 -2,-0.2 0.905 111.1 45.5 -63.3 -41.4 11.9 27.8 25.6 12 12 A L H <>S+ 0 0 0 -4,-2.7 5,-2.4 2,-0.2 6,-0.3 0.825 110.3 54.0 -71.9 -33.2 14.5 25.5 27.1 13 13 A K H ><5S+ 0 0 101 -4,-1.5 3,-1.7 -5,-0.3 5,-0.2 0.939 107.8 50.2 -65.1 -46.5 17.0 28.4 27.4 14 14 A R H 3<5S+ 0 0 240 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.814 106.6 57.0 -58.9 -34.8 14.4 30.4 29.3 15 15 A L T 3<5S- 0 0 51 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.197 120.9-106.7 -85.4 17.1 13.9 27.4 31.6 16 16 A G T < 5S+ 0 0 40 -3,-1.7 -3,-0.2 1,-0.1 -2,-0.1 0.720 80.3 129.1 68.4 24.9 17.6 27.3 32.6 17 17 A M > < + 0 0 0 -5,-2.4 3,-1.6 2,-0.1 2,-0.8 0.710 36.3 102.5 -83.3 -21.7 18.5 24.2 30.6 18 18 A D T 3 S- 0 0 69 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.503 106.9 -8.1 -67.9 104.6 21.6 25.6 28.8 19 19 A G T > S+ 0 0 42 4,-2.5 3,-2.0 -2,-0.8 2,-0.4 0.575 86.6 163.3 85.4 9.1 24.5 24.1 30.6 20 20 A Y B X S-B 23 0B 54 -3,-1.6 3,-1.7 3,-0.7 -1,-0.3 -0.488 82.8 -12.5 -65.7 113.9 22.4 22.6 33.4 21 21 A R T 3 S- 0 0 148 -2,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.841 133.0 -54.4 58.1 38.2 24.8 20.1 35.0 22 22 A G T < S+ 0 0 73 -3,-2.0 2,-0.6 1,-0.2 -1,-0.3 0.365 104.8 131.1 82.4 -4.5 27.2 20.5 32.0 23 23 A I B < -B 20 0B 18 -3,-1.7 -4,-2.5 -6,-0.1 -3,-0.7 -0.731 49.6-140.0 -89.2 119.9 24.6 19.7 29.4 24 24 A S > - 0 0 28 -2,-0.6 4,-1.6 -6,-0.2 3,-0.3 -0.334 22.4-113.7 -73.7 158.5 24.4 22.1 26.5 25 25 A L H > S+ 0 0 0 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.888 117.4 58.5 -56.9 -40.3 21.1 23.1 24.9 26 26 A A H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.886 104.3 51.2 -57.2 -42.9 22.1 21.3 21.7 27 27 A N H > S+ 0 0 40 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.888 112.6 45.2 -63.1 -38.3 22.4 18.0 23.7 28 28 A W H X S+ 0 0 0 -4,-1.6 4,-2.9 2,-0.2 -2,-0.2 0.907 113.2 50.8 -71.0 -41.8 18.9 18.6 25.2 29 29 A M H X S+ 0 0 0 -4,-3.2 4,-2.9 2,-0.2 -2,-0.2 0.954 110.2 49.2 -61.7 -46.2 17.4 19.5 21.8 30 30 A b H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.922 112.0 49.6 -57.2 -45.6 18.9 16.4 20.2 31 31 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 5,-0.3 0.940 112.9 45.6 -59.0 -51.1 17.4 14.3 23.1 32 32 A A H X>S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 6,-1.4 0.872 110.0 55.0 -62.3 -41.6 14.0 15.9 22.7 33 33 A K H X5S+ 0 0 78 -4,-2.9 4,-1.2 4,-0.2 -1,-0.2 0.952 115.8 37.1 -58.0 -51.1 14.0 15.5 18.9 34 34 A W H <5S+ 0 0 90 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.747 118.9 46.9 -75.0 -29.3 14.7 11.8 19.0 35 35 A E H <5S- 0 0 37 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.903 138.1 -3.9 -79.2 -45.8 12.6 10.9 22.1 36 36 A S H ><5S- 0 0 16 -4,-2.3 3,-0.7 20,-0.3 -3,-0.2 0.496 83.9-115.4-128.8 -5.5 9.4 12.7 21.1 37 37 A G T 3<> -C 51 0C 82 5,-3.6 4,-1.1 -2,-0.4 5,-0.9 -0.916 8.2-170.1-107.9 99.5 6.4 -0.7 27.7 47 47 A A T 45S+ 0 0 73 -2,-0.8 -1,-0.1 1,-0.2 5,-0.1 0.731 80.6 64.1 -64.3 -22.6 4.1 -3.7 28.0 48 48 A G T 45S+ 0 0 70 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.957 120.4 17.9 -66.2 -51.6 7.0 -5.8 29.4 49 49 A D T 45S- 0 0 46 -3,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.326 102.7-123.6-103.0 7.0 7.5 -3.7 32.6 50 50 A R T <5 + 0 0 152 -4,-1.1 2,-0.2 1,-0.2 -3,-0.2 0.696 68.3 126.9 59.9 23.9 4.1 -2.1 32.5 51 51 A S E < -C 46 0C 2 -5,-0.9 -5,-3.6 19,-0.1 2,-0.4 -0.692 46.9-144.9-107.7 165.7 5.5 1.5 32.6 52 52 A T E -C 45 0C 9 -7,-0.3 9,-2.2 -2,-0.2 2,-0.5 -0.969 8.0-137.6-132.5 140.6 4.9 4.4 30.2 53 53 A D E -CD 44 60C 41 -9,-3.3 -9,-2.1 -2,-0.4 2,-0.4 -0.876 29.9-151.0 -98.2 129.4 7.3 7.2 29.0 54 54 A Y E > -CD 43 59C 25 5,-2.8 5,-2.2 -2,-0.5 3,-0.3 -0.893 29.6 -31.4-114.8 139.6 5.6 10.6 29.0 55 55 A G T > 5S- 0 0 0 -13,-2.2 3,-1.0 -2,-0.4 -14,-0.2 -0.005 98.2 -21.8 69.7-165.5 5.9 13.8 27.1 56 56 A I T 3 5S+ 0 0 0 28,-0.4 -20,-0.3 -16,-0.3 -18,-0.3 0.853 142.1 34.8 -52.7 -37.1 8.5 15.8 25.3 57 57 A F T 3 5S- 0 0 1 -3,-0.3 -1,-0.3 27,-0.2 -2,-0.2 0.468 103.4-130.0-100.8 -0.5 11.4 14.1 27.3 58 58 A Q T < 5 - 0 0 5 -3,-1.0 -3,-0.2 -4,-0.2 2,-0.2 0.935 35.3-169.4 49.9 57.2 9.6 10.7 27.5 59 59 A I E < -D 54 0C 4 -5,-2.2 -5,-2.8 -6,-0.1 2,-0.3 -0.558 20.5-108.9 -83.5 140.9 10.2 10.4 31.2 60 60 A N E >> -D 53 0C 31 -7,-0.2 4,-2.4 -2,-0.2 5,-1.0 -0.547 11.2-154.2 -77.9 126.6 9.4 7.0 33.0 61 61 A S T 45S+ 0 0 0 -9,-2.2 6,-0.3 -2,-0.3 14,-0.3 0.536 93.0 65.3 -73.3 -8.7 6.5 6.4 35.3 62 62 A R T 45S+ 0 0 37 11,-0.2 12,-1.6 -10,-0.2 13,-0.3 0.912 122.9 10.2 -79.7 -41.7 8.4 3.6 37.1 63 63 A Y T 45S+ 0 0 122 -3,-0.4 13,-2.7 10,-0.2 -2,-0.2 0.883 135.2 28.1-103.3 -45.6 11.0 5.9 38.5 64 64 A W T <5S+ 0 0 30 -4,-2.4 13,-2.2 11,-0.3 15,-0.5 0.815 110.3 26.2 -94.9 -43.2 10.0 9.6 38.0 65 65 A c < - 0 0 0 -5,-1.0 2,-0.6 11,-0.1 10,-0.4 -0.892 67.8-122.1-126.1 158.7 6.3 10.4 37.8 66 66 A N B +e 80 0D 72 13,-2.6 15,-1.6 -2,-0.3 16,-0.4 -0.889 32.9 161.1-105.3 119.0 3.1 8.7 39.1 67 67 A D - 0 0 36 -2,-0.6 -1,-0.1 -6,-0.3 13,-0.1 0.253 52.5-124.7-110.3 5.3 0.4 7.6 36.7 68 68 A G S S+ 0 0 64 -7,-0.1 -2,-0.1 2,-0.1 12,-0.0 0.354 95.7 76.2 69.5 -3.2 -1.1 5.3 39.3 69 69 A K + 0 0 107 2,-0.1 -1,-0.1 -19,-0.0 -3,-0.0 0.336 69.2 96.2-119.7 8.0 -0.9 2.2 37.0 70 70 A T > - 0 0 14 -9,-0.2 3,-1.2 -18,-0.0 -2,-0.1 -0.868 67.3-131.7-108.6 121.3 2.8 1.3 37.2 71 71 A P T 3 S+ 0 0 53 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 -0.243 91.0 17.4 -62.2 154.9 4.2 -1.4 39.6 72 72 A G T 3 S+ 0 0 66 1,-0.2 -10,-0.1 2,-0.1 -2,-0.0 0.373 86.0 166.2 63.7 -1.8 7.3 -0.4 41.6 73 73 A A < + 0 0 34 -3,-1.2 -10,-0.2 1,-0.1 -1,-0.2 -0.045 17.8 177.8 -47.1 133.5 6.7 3.3 40.9 74 74 A V - 0 0 102 -12,-1.6 -11,-0.2 -9,-0.1 -1,-0.1 0.522 25.2-144.8-117.2 -13.2 8.7 5.6 43.1 75 75 A N > + 0 0 39 -10,-0.4 3,-1.3 -14,-0.3 -11,-0.3 0.889 26.2 173.9 47.1 58.6 7.7 9.1 41.8 76 76 A A T 3 S+ 0 0 24 -13,-2.7 -12,-0.2 1,-0.3 -11,-0.1 0.642 78.3 50.6 -70.1 -14.0 11.1 10.7 42.3 77 77 A d T 3 S- 0 0 20 -13,-2.2 -1,-0.3 2,-0.2 -12,-0.1 0.515 102.1-135.1 -97.7 -7.9 10.0 13.9 40.6 78 78 A H < + 0 0 158 -3,-1.3 2,-0.3 -14,-0.3 -13,-0.1 0.921 62.3 123.3 52.3 53.5 6.8 14.1 42.8 79 79 A L - 0 0 48 -15,-0.5 -13,-2.6 16,-0.0 2,-0.4 -0.958 68.9-111.1-140.5 156.2 4.7 14.8 39.8 80 80 A S B > -e 66 0D 58 -2,-0.3 3,-1.7 -15,-0.2 4,-0.4 -0.701 28.5-129.7 -85.4 135.5 1.7 13.4 38.1 81 81 A c G > S+ 0 0 1 -15,-1.6 3,-1.0 -2,-0.4 -14,-0.1 0.723 108.1 69.4 -59.8 -18.2 2.7 12.0 34.8 82 82 A S G > S+ 0 0 70 -16,-0.4 3,-2.3 1,-0.3 -1,-0.3 0.868 87.4 65.2 -68.7 -27.7 -0.2 14.0 33.4 83 83 A A G X S+ 0 0 10 -3,-1.7 3,-0.7 1,-0.3 9,-0.4 0.739 95.2 58.8 -63.7 -21.9 1.9 17.1 34.1 84 84 A L G < S+ 0 0 3 -3,-1.0 -28,-0.4 -4,-0.4 -1,-0.3 0.362 98.4 59.5 -90.0 5.1 4.3 15.8 31.5 85 85 A L G < S+ 0 0 38 -3,-2.3 -1,-0.2 -30,-0.1 2,-0.2 0.192 83.6 110.7-115.1 11.9 1.6 15.9 28.8 86 86 A Q S < S- 0 0 94 -3,-0.7 6,-0.1 2,-0.2 -3,-0.0 -0.515 73.9-128.2 -88.4 152.8 1.0 19.6 29.2 87 87 A D S S+ 0 0 82 -2,-0.2 2,-0.7 2,-0.0 -1,-0.1 0.878 97.7 76.4 -66.0 -39.5 1.9 22.3 26.6 88 88 A N - 0 0 107 1,-0.1 3,-0.4 2,-0.0 4,-0.3 -0.667 68.9-167.9 -74.3 116.8 3.7 24.2 29.2 89 89 A I > + 0 0 2 -2,-0.7 4,-2.9 1,-0.2 5,-0.2 0.312 59.1 102.6 -91.8 9.3 7.0 22.3 29.7 90 90 A A H > S+ 0 0 36 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.909 87.1 49.0 -54.1 -43.8 8.3 23.9 32.9 91 91 A D H > S+ 0 0 27 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.960 111.1 46.3 -57.5 -59.3 7.1 20.8 34.7 92 92 A A H > S+ 0 0 4 -9,-0.4 4,-2.6 -4,-0.3 -2,-0.2 0.875 113.5 52.5 -56.5 -37.0 8.7 18.3 32.3 93 93 A V H X S+ 0 0 4 -4,-2.9 4,-1.9 2,-0.2 -2,-0.2 0.923 105.8 51.3 -68.2 -43.2 11.9 20.4 32.5 94 94 A A H X S+ 0 0 62 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.916 114.9 45.2 -61.4 -38.4 12.0 20.4 36.4 95 95 A d H X S+ 0 0 3 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.902 108.6 53.4 -71.7 -42.9 11.7 16.6 36.2 96 96 A A H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.845 109.0 52.9 -60.7 -30.4 14.3 16.1 33.4 97 97 A K H < S+ 0 0 36 -4,-1.9 4,-0.3 2,-0.2 -1,-0.2 0.881 108.6 48.4 -70.5 -37.3 16.7 18.2 35.6 98 98 A R H >< S+ 0 0 65 -4,-1.4 3,-1.7 1,-0.2 -2,-0.2 0.940 109.3 54.0 -64.4 -50.5 15.9 15.8 38.5 99 99 A V H >< S+ 0 0 4 -4,-2.8 3,-1.2 1,-0.3 6,-0.2 0.885 104.0 55.0 -50.6 -46.7 16.6 12.8 36.2 100 100 A V T 3< S+ 0 0 1 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.514 90.4 74.0 -72.5 -2.4 20.0 14.2 35.2 101 101 A R T < S+ 0 0 124 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.264 78.6 101.0 -91.1 12.2 21.2 14.4 38.9 102 102 A E S X S- 0 0 68 -3,-1.2 3,-1.6 1,-0.1 6,-0.1 -0.510 95.5 -96.1 -90.7 162.2 21.5 10.6 38.9 103 103 A P T 3 S+ 0 0 138 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.873 123.9 43.9 -45.2 -45.9 24.9 8.8 38.5 104 104 A Q T > S- 0 0 93 1,-0.2 3,-2.0 2,-0.1 4,-0.1 0.548 87.2-172.0 -81.6 -8.9 24.4 8.3 34.7 105 105 A G G X + 0 0 14 -3,-1.6 3,-1.6 1,-0.3 -1,-0.2 -0.243 69.9 1.4 57.2-131.5 23.1 11.8 33.9 106 106 A I G > S+ 0 0 20 1,-0.3 3,-1.6 -6,-0.2 -1,-0.3 0.592 115.4 82.8 -66.6 -10.9 21.8 12.2 30.4 107 107 A R G < + 0 0 105 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.509 67.8 87.9 -71.4 -5.3 22.6 8.5 29.7 108 108 A A G < S+ 0 0 38 -3,-1.6 2,-0.6 1,-0.2 -1,-0.3 0.635 83.9 59.8 -64.7 -18.2 19.2 7.9 31.3 109 109 A W X> - 0 0 13 -3,-1.6 4,-1.5 1,-0.1 3,-1.3 -0.913 69.9-168.0-112.3 102.7 17.8 8.4 27.8 110 110 A V H 3> S+ 0 0 74 -2,-0.6 4,-3.4 1,-0.3 5,-0.2 0.736 85.1 67.6 -69.9 -12.0 19.2 5.8 25.4 111 111 A A H 3> S+ 0 0 20 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.831 102.3 49.3 -70.9 -24.9 17.9 7.6 22.4 112 112 A W H <>>S+ 0 0 24 -3,-1.3 5,-2.6 -6,-0.2 4,-2.5 0.928 111.8 48.3 -72.0 -44.9 20.5 10.3 23.3 113 113 A R H <5S+ 0 0 81 -4,-1.5 -2,-0.2 3,-0.2 4,-0.2 0.962 119.3 39.2 -56.8 -53.0 23.1 7.6 23.6 114 114 A N H <5S+ 0 0 102 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.865 132.4 20.4 -65.6 -43.5 22.0 6.2 20.2 115 115 A R H <5S+ 0 0 122 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.445 132.5 27.9-110.8 -2.9 21.4 9.4 18.2 116 116 A b T ><5S+ 0 0 1 -4,-2.5 3,-1.1 -5,-0.2 -3,-0.2 0.710 86.4 96.4-126.7 -42.7 23.3 12.1 20.0 117 117 A Q T 3 + 0 0 9 -2,-0.6 3,-2.0 1,-0.1 4,-0.2 0.292 48.5 103.2-109.8 7.7 24.7 18.1 17.8 122 122 A R G >> + 0 0 104 1,-0.3 3,-1.5 2,-0.2 4,-0.6 0.724 67.5 78.1 -63.9 -14.5 25.2 21.8 17.5 123 123 A Q G >4 S+ 0 0 98 1,-0.3 3,-0.5 2,-0.2 -1,-0.3 0.798 82.4 65.5 -61.7 -27.6 23.1 21.5 14.3 124 124 A Y G <4 S+ 0 0 39 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.682 109.0 36.1 -69.6 -21.5 20.0 21.3 16.6 125 125 A V G X4 S+ 0 0 6 -3,-1.5 3,-1.7 -4,-0.2 5,-0.4 0.347 84.0 128.0-112.7 1.5 20.5 24.9 17.8 126 126 A Q T << S+ 0 0 108 -4,-0.6 -120,-0.1 -3,-0.5 -3,-0.0 -0.393 81.2 7.0 -64.9 131.8 21.8 26.5 14.6 127 127 A G T 3 S+ 0 0 82 -2,-0.1 -1,-0.2 1,-0.1 -4,-0.0 0.397 99.0 104.9 79.0 0.3 19.8 29.7 13.7 128 128 A a S < S- 0 0 4 -3,-1.7 -2,-0.1 -123,-0.0 -1,-0.1 0.596 84.0-127.3 -86.7 -12.5 17.8 29.7 16.9 129 129 A G 0 0 75 -4,-0.4 -3,-0.1 1,-0.0 -4,-0.0 0.899 360.0 360.0 67.4 41.8 19.8 32.6 18.4 130 130 A V 0 0 59 -5,-0.4 -105,-0.1 -117,-0.0 -4,-0.1 0.331 360.0 360.0-124.4 360.0 20.6 30.8 21.7