==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-DEC-00 1GFR . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.FUNAHASHI,K.TAKANO,Y.YAMAGATA,K.YUTANI . 130 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7040.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 87 66.9 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 . 8 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.3 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 1 1 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 76 0, 0.0 39,-2.7 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 139.5 1.6 20.5 21.4 2 2 A V B -A 39 0A 98 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.956 360.0-144.1-109.9 105.6 4.2 19.6 18.7 3 3 A F - 0 0 10 35,-2.6 2,-0.3 -2,-0.7 3,-0.0 -0.331 8.5-125.2 -67.7 150.8 7.0 22.2 18.9 4 4 A E > - 0 0 150 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.703 35.9-105.5 -90.0 154.5 8.8 23.5 15.9 5 5 A R H > S+ 0 0 94 -2,-0.3 4,-2.1 1,-0.2 3,-0.1 0.919 113.9 35.5 -45.7 -66.6 12.6 23.1 16.3 6 6 A a H > S+ 0 0 26 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.830 114.1 59.1 -64.1 -30.7 13.8 26.7 16.9 7 7 A E H > S+ 0 0 60 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.923 108.9 44.9 -61.9 -47.2 10.7 27.5 19.0 8 8 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.905 108.7 56.6 -64.9 -41.1 11.6 24.7 21.3 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.938 111.4 42.3 -57.4 -47.2 15.3 25.6 21.5 10 10 A R H X S+ 0 0 107 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.888 113.0 54.3 -66.9 -37.2 14.5 29.2 22.7 11 11 A T H X S+ 0 0 26 -4,-2.0 4,-1.2 -5,-0.2 -2,-0.2 0.924 111.6 44.1 -62.7 -45.2 11.8 27.8 25.1 12 12 A L H <>S+ 0 0 0 -4,-3.0 5,-2.0 2,-0.2 6,-0.3 0.908 112.6 52.4 -67.0 -40.5 14.3 25.4 26.7 13 13 A K H ><5S+ 0 0 89 -4,-2.4 3,-1.7 -5,-0.3 5,-0.3 0.919 107.3 51.5 -61.0 -43.5 16.9 28.1 26.9 14 14 A R H 3<5S+ 0 0 185 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.820 106.2 56.9 -62.6 -29.0 14.5 30.5 28.6 15 15 A L T 3<5S- 0 0 56 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.311 122.9-104.5 -86.9 8.7 13.8 27.7 31.1 16 16 A G T < 5S+ 0 0 41 -3,-1.7 -3,-0.2 -4,-0.1 -2,-0.1 0.679 81.4 127.9 78.4 24.1 17.5 27.4 32.1 17 17 A M > < + 0 0 0 -5,-2.0 3,-2.0 2,-0.1 2,-0.6 0.690 34.7 106.6 -84.6 -20.9 18.4 24.2 30.2 18 18 A D T 3 S- 0 0 78 1,-0.3 6,-0.2 -6,-0.3 3,-0.1 -0.461 105.8 -8.8 -66.7 108.8 21.5 25.5 28.3 19 19 A G T > S+ 0 0 40 4,-2.0 3,-2.1 -2,-0.6 -1,-0.3 0.610 86.5 168.5 80.1 12.5 24.4 23.9 30.1 20 20 A Y B X S-B 23 0B 44 -3,-2.0 3,-2.0 3,-0.8 -1,-0.3 -0.466 81.7 -11.5 -61.9 120.9 22.3 22.6 33.0 21 21 A R T 3 S- 0 0 152 -2,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.887 134.9 -53.9 50.9 41.2 24.7 20.2 34.8 22 22 A G T < S+ 0 0 77 -3,-2.1 2,-0.7 1,-0.2 -1,-0.3 0.500 105.1 133.8 76.8 4.3 27.0 20.6 31.8 23 23 A I B < -B 20 0B 12 -3,-2.0 -4,-2.0 -6,-0.1 -3,-0.8 -0.794 49.3-137.2 -95.0 116.5 24.4 19.6 29.2 24 24 A S >> - 0 0 44 -2,-0.7 4,-1.6 -5,-0.2 3,-0.8 -0.182 20.9-115.0 -64.5 156.4 24.3 21.8 26.1 25 25 A L H 3> S+ 0 0 5 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.875 115.9 61.0 -61.4 -35.4 21.0 22.9 24.6 26 26 A A H 3> S+ 0 0 11 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.838 102.6 51.8 -62.2 -32.8 21.8 20.9 21.4 27 27 A N H <> S+ 0 0 35 -3,-0.8 4,-2.2 2,-0.2 -1,-0.2 0.907 109.9 47.5 -70.0 -42.2 21.9 17.7 23.5 28 28 A W H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.887 112.3 51.3 -65.1 -36.9 18.5 18.4 25.1 29 29 A M H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.916 109.3 49.0 -64.6 -44.7 17.2 19.2 21.6 30 30 A b H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.907 112.5 49.9 -62.2 -40.0 18.5 15.9 20.2 31 31 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.940 112.1 44.6 -64.1 -50.9 16.9 14.1 23.2 32 32 A A H X>S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 6,-1.6 0.861 112.3 56.0 -62.7 -35.3 13.5 15.7 22.7 33 33 A K H X5S+ 0 0 90 -4,-2.3 4,-1.3 4,-0.2 -2,-0.2 0.963 115.3 34.6 -60.9 -53.6 13.8 15.0 19.0 34 34 A W H <5S+ 0 0 113 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.768 118.0 52.2 -76.9 -25.2 14.4 11.3 19.3 35 35 A E H <5S- 0 0 43 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.934 137.8 -13.2 -76.1 -44.4 12.1 10.7 22.3 36 36 A S H <5S- 0 0 22 -4,-2.0 3,-0.2 20,-0.4 -3,-0.2 0.413 84.3-107.1-139.9 -1.6 9.0 12.3 21.0 37 37 A G S < -A 2 0A 41 -7,-0.3 3,-0.8 -37,-0.2 -37,-0.2 -0.883 36.0-168.5-107.3 115.3 5.6 16.3 21.1 40 40 A T T 3 S+ 0 0 2 -39,-2.7 16,-0.2 -2,-0.6 -1,-0.1 0.649 88.4 54.0 -73.3 -20.0 4.4 17.1 24.7 41 41 A R T 3 S+ 0 0 175 -40,-0.3 -1,-0.2 14,-0.2 44,-0.1 0.462 79.9 125.8 -91.3 -8.5 1.4 14.7 24.4 42 42 A A < + 0 0 18 -3,-0.8 13,-2.0 12,-0.1 2,-0.3 -0.222 34.5 177.3 -54.4 138.1 3.4 11.7 23.4 43 43 A T E -C 54 0C 83 11,-0.2 2,-0.4 15,-0.1 11,-0.2 -0.994 13.5-167.6-144.8 143.9 3.0 8.6 25.6 44 44 A N E -C 53 0C 72 9,-1.8 9,-2.8 -2,-0.3 2,-0.3 -0.967 11.8-148.5-137.4 117.3 4.5 5.1 25.4 45 45 A Y E -C 52 0C 131 -2,-0.4 2,-0.7 7,-0.2 7,-0.2 -0.679 7.0-150.1 -84.4 138.2 3.3 2.1 27.4 46 46 A N E >>> -C 51 0C 44 5,-3.1 4,-1.5 -2,-0.3 3,-1.1 -0.848 10.8-173.6-111.5 92.8 5.9 -0.5 28.3 47 47 A A T 345S+ 0 0 76 -2,-0.7 -1,-0.2 1,-0.3 5,-0.0 0.773 77.6 68.9 -57.3 -26.3 4.0 -3.7 28.5 48 48 A G T 345S+ 0 0 84 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.849 120.9 9.0 -64.1 -41.8 7.2 -5.4 29.8 49 49 A D T <45S- 0 0 61 -3,-1.1 -1,-0.2 2,-0.2 -2,-0.2 0.240 100.7-112.8-125.5 12.3 7.2 -3.7 33.2 50 50 A R T <5S+ 0 0 161 -4,-1.5 2,-0.2 1,-0.2 -3,-0.2 0.779 74.4 124.6 63.6 31.3 3.9 -1.9 33.3 51 51 A S E < -C 46 0C 0 -5,-1.0 -5,-3.1 19,-0.1 2,-0.4 -0.714 47.5-143.3-113.5 170.4 5.3 1.6 33.2 52 52 A T E -C 45 0C 9 -2,-0.2 9,-1.9 -7,-0.2 2,-0.5 -0.994 8.6-134.4-139.3 141.0 4.6 4.5 30.8 53 53 A D E -CD 44 60C 26 -9,-2.8 -9,-1.8 -2,-0.4 2,-0.4 -0.831 28.6-152.9 -94.4 130.9 6.8 7.2 29.3 54 54 A Y E > -CD 43 59C 20 5,-2.7 5,-2.0 -2,-0.5 3,-0.4 -0.869 32.6 -31.4-116.6 136.2 5.3 10.7 29.4 55 55 A G T > 5S- 0 0 0 -13,-2.0 3,-1.4 -2,-0.4 -15,-0.2 -0.002 99.0 -22.8 73.7-163.1 5.7 13.8 27.3 56 56 A I T 3 5S+ 0 0 1 28,-0.3 -20,-0.4 1,-0.3 -18,-0.3 0.772 141.0 36.4 -61.5 -29.6 8.4 15.6 25.3 57 57 A F T 3 5S- 0 0 1 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.326 103.6-128.8-103.6 0.9 11.2 13.8 27.1 58 58 A Q T < 5 - 0 0 18 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.913 34.3-168.1 48.4 56.0 9.3 10.5 27.5 59 59 A I E < -D 54 0C 4 -5,-2.0 -5,-2.7 -6,-0.1 2,-0.2 -0.568 18.6-117.0 -78.5 131.6 10.0 10.4 31.3 60 60 A N E >>> -D 53 0C 23 -2,-0.3 4,-2.1 -7,-0.2 3,-0.8 -0.480 6.9-143.8 -78.4 139.3 9.2 7.0 32.8 61 61 A S T 345S+ 0 0 0 -9,-1.9 6,-0.2 1,-0.2 9,-0.1 0.614 89.6 73.5 -73.0 -18.4 6.5 6.4 35.5 62 62 A R T 345S+ 0 0 44 11,-0.2 12,-2.8 1,-0.1 -1,-0.2 0.827 120.8 5.6 -67.2 -28.1 8.4 3.8 37.5 63 63 A Y T <45S+ 0 0 120 -3,-0.8 13,-2.9 10,-0.2 -2,-0.2 0.704 130.1 40.4-126.7 -30.9 10.8 6.4 39.0 64 64 A W T <5S+ 0 0 38 -4,-2.1 13,-2.0 11,-0.3 15,-0.4 0.783 108.0 18.1-102.3 -32.7 9.9 10.0 38.1 65 65 A c S S- 0 0 14 -9,-0.1 3,-1.3 -18,-0.0 -19,-0.1 -0.870 73.9-125.5 -99.3 117.3 2.7 1.6 37.8 71 71 A P T 3 S- 0 0 63 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 -0.302 87.1 -1.7 -58.2 139.0 3.5 -1.3 40.3 72 72 A G T 3 S+ 0 0 82 1,-0.2 2,-0.2 0, 0.0 -10,-0.0 0.744 98.2 154.8 47.8 33.4 6.3 -0.6 42.8 73 73 A A < - 0 0 37 -3,-1.3 2,-0.2 -5,-0.0 -10,-0.2 -0.530 30.9-154.0 -93.4 156.7 6.9 2.9 41.3 74 74 A R - 0 0 208 -12,-2.8 -9,-0.3 -2,-0.2 2,-0.2 -0.701 13.3-137.2-117.7 173.1 8.3 6.0 42.9 75 75 A N > + 0 0 40 -2,-0.2 3,-1.1 -11,-0.1 -11,-0.3 -0.608 29.3 164.4-135.3 70.8 7.8 9.7 42.1 76 76 A A T 3 S+ 0 0 25 -13,-2.9 -12,-0.2 1,-0.3 -11,-0.1 0.754 80.5 48.9 -63.1 -27.3 11.2 11.4 42.3 77 77 A d T 3 S- 0 0 22 -13,-2.0 -1,-0.3 2,-0.2 -12,-0.1 0.578 103.5-135.0 -86.5 -8.6 10.0 14.6 40.5 78 78 A H < + 0 0 154 -3,-1.1 2,-0.3 -14,-0.2 -13,-0.1 0.945 62.2 120.6 51.8 57.5 7.1 14.7 42.8 79 79 A L S S- 0 0 36 -15,-0.4 -13,-2.5 16,-0.0 2,-0.2 -0.969 71.2-107.6-143.7 152.4 4.6 15.4 40.0 80 80 A S B > -e 66 0D 68 -2,-0.3 3,-1.4 -15,-0.2 4,-0.4 -0.609 35.1-121.7 -75.4 145.4 1.5 13.7 38.6 81 81 A c G > S+ 0 0 3 -15,-2.7 3,-1.5 1,-0.3 -1,-0.1 0.792 111.7 73.3 -60.9 -21.7 2.5 12.2 35.2 82 82 A S G > S+ 0 0 80 -16,-0.4 3,-2.3 1,-0.3 -1,-0.3 0.878 84.5 63.8 -58.0 -36.1 -0.3 14.5 33.9 83 83 A A G X S+ 0 0 16 -3,-1.4 3,-0.8 1,-0.3 9,-0.3 0.766 95.3 61.1 -61.3 -22.3 2.0 17.5 34.5 84 84 A L G < S+ 0 0 3 -3,-1.5 -28,-0.3 -4,-0.4 -1,-0.3 0.285 97.0 59.3 -88.1 9.4 4.3 15.9 31.8 85 85 A L G < S+ 0 0 57 -3,-2.3 -1,-0.2 -30,-0.1 -2,-0.2 0.166 79.4 117.0-120.2 14.3 1.6 16.1 29.2 86 86 A Q S < S- 0 0 81 -3,-0.8 6,-0.1 2,-0.2 -3,-0.0 -0.441 70.4-129.4 -82.2 156.0 1.0 19.9 29.3 87 87 A D S S+ 0 0 97 -2,-0.1 2,-0.6 -46,-0.0 -1,-0.1 0.876 100.3 74.0 -68.9 -37.5 1.7 22.3 26.3 88 88 A N S S- 0 0 103 1,-0.1 3,-0.4 -48,-0.0 4,-0.3 -0.694 73.1-162.1 -78.0 118.7 3.7 24.3 28.8 89 89 A I > + 0 0 5 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.278 58.8 106.5 -89.4 12.5 6.9 22.4 29.4 90 90 A A H > S+ 0 0 38 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.919 85.7 43.5 -55.1 -49.2 8.1 24.1 32.6 91 91 A D H > S+ 0 0 57 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.894 113.0 51.0 -64.8 -41.1 7.2 21.0 34.7 92 92 A A H > S+ 0 0 7 -9,-0.3 4,-2.5 -4,-0.3 -1,-0.2 0.901 112.2 48.3 -64.2 -39.2 8.6 18.6 32.3 93 93 A V H X S+ 0 0 3 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.888 108.5 53.1 -66.7 -40.4 11.9 20.6 32.3 94 94 A A H X S+ 0 0 52 -4,-2.3 4,-1.5 -5,-0.2 -2,-0.2 0.910 113.2 45.0 -62.1 -39.0 11.9 20.7 36.1 95 95 A d H X S+ 0 0 1 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.910 109.6 53.2 -72.2 -40.8 11.6 17.0 36.0 96 96 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.882 108.8 51.3 -60.9 -36.8 14.3 16.5 33.3 97 97 A K H X S+ 0 0 42 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.886 108.0 52.4 -66.6 -40.0 16.7 18.6 35.4 98 98 A R H >< S+ 0 0 66 -4,-1.5 3,-1.0 -5,-0.2 4,-0.3 0.907 106.6 53.5 -61.2 -44.1 15.9 16.3 38.4 99 99 A V H >< S+ 0 0 4 -4,-2.3 3,-1.7 1,-0.2 6,-0.3 0.948 108.9 48.4 -56.2 -49.7 16.7 13.2 36.3 100 100 A V H 3< S+ 0 0 5 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.535 92.4 75.3 -73.0 -6.1 20.2 14.6 35.3 101 101 A R T << S+ 0 0 107 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.619 83.9 88.0 -77.4 -11.2 21.0 15.5 38.9 102 102 A D S X S- 0 0 65 -3,-1.7 3,-1.8 -4,-0.3 6,-0.1 -0.470 102.5 -96.5 -80.1 161.0 21.6 11.7 39.3 103 103 A P T 3 S+ 0 0 138 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.823 120.3 57.5 -45.5 -43.3 25.0 10.2 38.5 104 104 A Q T > S- 0 0 100 1,-0.2 3,-1.8 -5,-0.1 -4,-0.1 0.730 81.3-178.0 -62.8 -26.6 24.1 9.2 35.0 105 105 A G G X S- 0 0 15 -3,-1.8 3,-2.1 -6,-0.3 -1,-0.2 -0.322 70.8 -5.9 60.6-141.4 23.2 12.7 33.9 106 106 A I G > S+ 0 0 12 1,-0.3 3,-1.5 -6,-0.1 -1,-0.3 0.715 123.9 79.1 -57.6 -20.2 21.9 12.8 30.3 107 107 A R G < + 0 0 111 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.581 67.0 88.9 -67.7 -7.8 22.8 9.1 30.0 108 108 A A G < S+ 0 0 33 -3,-2.1 2,-0.7 1,-0.1 -1,-0.3 0.846 79.1 68.2 -58.5 -33.2 19.6 8.3 31.9 109 109 A W S X> S- 0 0 19 -3,-1.5 4,-1.4 1,-0.1 3,-0.9 -0.793 70.7-158.3 -92.1 115.5 17.8 8.2 28.5 110 110 A V H 3> S+ 0 0 81 -2,-0.7 4,-2.3 1,-0.3 5,-0.2 0.830 92.4 62.0 -63.4 -27.1 18.9 5.3 26.3 111 111 A A H 3> S+ 0 0 23 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.868 100.4 54.5 -65.8 -33.3 17.8 7.1 23.1 112 112 A W H <>>S+ 0 0 16 -3,-0.9 5,-2.7 -6,-0.2 4,-2.6 0.948 108.6 48.4 -64.3 -47.1 20.3 9.9 23.9 113 113 A R H <5S+ 0 0 101 -4,-1.4 -2,-0.2 3,-0.2 -1,-0.2 0.938 117.2 41.7 -57.5 -46.3 23.1 7.2 24.1 114 114 A N H <5S+ 0 0 90 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.857 131.8 18.9 -70.6 -38.7 22.0 5.7 20.8 115 115 A R H <5S+ 0 0 122 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.470 132.9 26.7-117.1 -2.1 21.2 8.8 18.7 116 116 A b T ><5S+ 0 0 2 -4,-2.6 3,-1.7 -5,-0.3 -3,-0.2 0.662 85.4 100.8-128.1 -42.3 23.0 11.8 20.4 117 117 A Q T 3 + 0 0 16 -2,-1.0 3,-1.6 1,-0.1 4,-0.4 0.279 41.1 106.1-106.4 13.1 24.4 17.7 17.3 122 122 A R G >> + 0 0 156 1,-0.3 3,-1.8 2,-0.2 4,-0.8 0.863 67.8 71.2 -58.2 -37.3 25.0 21.3 16.3 123 123 A Q G 34 S+ 0 0 129 1,-0.3 -1,-0.3 -3,-0.2 3,-0.2 0.713 85.2 67.3 -53.8 -24.5 22.3 21.0 13.6 124 124 A Y G <4 S+ 0 0 23 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.812 112.0 30.0 -70.6 -26.5 19.6 20.9 16.3 125 125 A V T X4 S+ 0 0 25 -3,-1.8 3,-1.7 -4,-0.4 5,-0.5 0.405 85.6 128.7-113.0 2.3 20.2 24.5 17.3 126 126 A Q T 3< S+ 0 0 103 -4,-0.8 -120,-0.1 1,-0.3 -3,-0.0 -0.382 81.8 5.8 -66.4 131.0 21.5 26.1 14.1 127 127 A G T 3 S+ 0 0 82 -2,-0.2 -1,-0.3 3,-0.1 -2,-0.0 0.388 98.5 109.8 81.2 -0.7 19.6 29.3 13.1 128 128 A a S < S- 0 0 1 -3,-1.7 -2,-0.1 2,-0.0 -118,-0.1 0.530 84.0-119.9 -86.5 -5.7 17.6 29.4 16.4 129 129 A G 0 0 74 -4,-0.3 -3,-0.1 1,-0.2 -1,-0.0 0.849 360.0 360.0 72.0 33.6 19.3 32.4 18.0 130 130 A V 0 0 61 -5,-0.5 -1,-0.2 -117,-0.0 -3,-0.1 -0.589 360.0 360.0-120.6 360.0 20.4 30.4 21.1