==== 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 26-JUN-00 1GAY . COMPND 2 MOLECULE: MUTANT 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) . 6821.0 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 . 9 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 18.5 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 . 4 3.1 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 80 0, 0.0 39,-2.7 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 136.5 1.4 20.8 20.5 2 2 A G B -A 39 0A 60 37,-0.2 37,-0.2 38,-0.1 2,-0.1 -0.948 360.0-145.0-110.8 113.9 4.1 20.4 17.9 3 3 A F - 0 0 14 35,-2.8 2,-0.3 -2,-0.6 3,-0.0 -0.404 9.2-126.4 -76.5 152.4 7.0 22.9 18.2 4 4 A E > - 0 0 144 -2,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.704 34.2-106.8 -94.0 150.0 8.9 24.5 15.3 5 5 A R H > S+ 0 0 95 -2,-0.3 4,-2.1 1,-0.2 3,-0.1 0.918 113.4 31.4 -43.0 -69.6 12.7 24.1 15.6 6 6 A a H > S+ 0 0 24 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.845 114.4 61.3 -65.9 -33.6 13.9 27.6 16.5 7 7 A E H > S+ 0 0 68 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.938 110.3 42.7 -53.7 -50.0 10.7 28.4 18.4 8 8 A L H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.902 107.9 59.5 -63.3 -42.9 11.6 25.5 20.7 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.925 111.5 40.7 -55.3 -43.9 15.3 26.4 20.9 10 10 A R H X S+ 0 0 105 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.852 110.9 57.6 -73.5 -32.8 14.4 29.8 22.3 11 11 A T H X S+ 0 0 19 -4,-1.9 4,-0.9 -5,-0.2 -2,-0.2 0.932 110.6 44.2 -61.5 -42.8 11.7 28.2 24.6 12 12 A L H <>S+ 0 0 0 -4,-3.1 5,-2.2 2,-0.2 6,-0.3 0.880 111.6 51.5 -69.7 -41.7 14.4 26.0 26.1 13 13 A K H ><5S+ 0 0 87 -4,-1.9 3,-1.9 -5,-0.3 5,-0.2 0.930 107.8 53.5 -63.0 -40.7 16.9 28.9 26.4 14 14 A R H 3<5S+ 0 0 178 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.768 106.7 54.3 -64.3 -24.2 14.3 31.0 28.2 15 15 A L T 3<5S- 0 0 58 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.2 0.316 123.2-103.8 -93.5 11.1 13.8 28.1 30.6 16 16 A G T < 5S+ 0 0 41 -3,-1.9 -3,-0.2 -4,-0.1 -2,-0.1 0.716 81.6 127.2 77.4 25.9 17.6 27.9 31.5 17 17 A M > < + 0 0 0 -5,-2.2 3,-1.8 2,-0.1 2,-0.9 0.708 34.3 108.9 -85.7 -21.5 18.6 24.8 29.5 18 18 A D T 3 S- 0 0 73 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.409 105.9 -13.7 -61.5 97.8 21.5 26.4 27.6 19 19 A G T > S+ 0 0 36 4,-2.2 3,-2.4 -2,-0.9 -1,-0.3 0.531 87.5 168.1 85.6 7.9 24.5 24.6 29.3 20 20 A Y B X S-B 23 0B 46 -3,-1.8 3,-2.0 3,-0.6 -1,-0.3 -0.381 79.1 -9.9 -58.8 121.7 22.5 23.3 32.1 21 21 A R T 3 S- 0 0 156 1,-0.3 -1,-0.3 -2,-0.1 85,-0.2 0.839 134.5 -54.4 53.2 37.7 24.9 20.7 33.8 22 22 A G T < S+ 0 0 76 -3,-2.4 2,-0.7 1,-0.2 -1,-0.3 0.504 105.5 132.8 78.4 5.8 27.3 21.1 30.8 23 23 A I B < -B 20 0B 9 -3,-2.0 -4,-2.2 -6,-0.1 -3,-0.6 -0.801 49.7-139.6 -98.0 112.6 24.6 20.3 28.2 24 24 A S > - 0 0 45 -2,-0.7 4,-1.4 -5,-0.2 3,-0.5 -0.219 22.7-113.3 -62.8 159.1 24.5 22.7 25.2 25 25 A L H > S+ 0 0 7 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.854 117.0 61.7 -61.5 -37.7 21.2 23.8 23.8 26 26 A A H > S+ 0 0 11 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.872 102.4 51.1 -57.3 -39.7 22.0 21.8 20.6 27 27 A N H > S+ 0 0 31 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.869 109.3 49.3 -68.1 -36.2 22.1 18.6 22.6 28 28 A W H X S+ 0 0 0 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.859 111.8 49.4 -70.1 -36.8 18.7 19.3 24.2 29 29 A M H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.920 109.9 50.5 -66.4 -45.2 17.3 20.0 20.8 30 30 A b H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.917 111.8 49.0 -59.7 -42.1 18.8 16.8 19.4 31 31 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.949 112.0 46.8 -62.9 -49.7 17.2 14.9 22.3 32 32 A A H X>S+ 0 0 1 -4,-2.4 4,-2.1 1,-0.2 6,-1.5 0.855 111.6 52.8 -62.0 -37.3 13.8 16.4 21.8 33 33 A K H X5S+ 0 0 90 -4,-2.5 4,-1.1 4,-0.2 -1,-0.2 0.955 114.6 39.6 -62.4 -51.9 13.9 15.8 18.1 34 34 A W H <5S+ 0 0 107 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.751 118.3 48.2 -74.0 -21.0 14.7 12.1 18.4 35 35 A E H <5S- 0 0 45 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.913 138.9 -10.9 -84.9 -45.0 12.4 11.4 21.3 36 36 A S H <5S- 0 0 19 -4,-2.1 3,-0.4 20,-0.4 -3,-0.2 0.389 84.1-111.5-137.6 -3.0 9.1 13.1 20.2 37 37 A G S < -A 2 0A 57 -3,-0.4 3,-0.7 -7,-0.3 -37,-0.2 -0.889 41.1-162.0-107.9 124.9 5.7 17.0 20.2 40 40 A T T 3 S+ 0 0 2 -39,-2.7 16,-0.2 -2,-0.5 -1,-0.1 0.675 88.7 52.9 -75.4 -22.1 4.4 17.6 23.7 41 41 A R T 3 S+ 0 0 181 -40,-0.3 -1,-0.2 14,-0.2 44,-0.1 0.354 77.1 127.0 -95.8 1.0 1.6 14.9 23.5 42 42 A A < + 0 0 18 -3,-0.7 13,-2.0 12,-0.1 2,-0.3 -0.345 32.8 173.8 -60.9 135.2 3.8 12.0 22.4 43 43 A T E -C 54 0C 82 11,-0.2 2,-0.3 15,-0.1 11,-0.2 -0.976 15.8-164.2-142.0 156.2 3.5 8.9 24.6 44 44 A N E -C 53 0C 71 9,-1.7 9,-2.5 -2,-0.3 2,-0.4 -0.947 11.4-145.5-146.6 123.1 4.9 5.4 24.3 45 45 A Y E -C 52 0C 126 -2,-0.3 2,-0.8 7,-0.2 7,-0.2 -0.739 2.4-157.4 -92.9 128.9 3.8 2.3 26.2 46 46 A N E >> -C 51 0C 49 5,-3.0 5,-1.0 -2,-0.4 4,-0.8 -0.892 7.6-170.2-103.6 94.4 6.4 -0.3 27.2 47 47 A A T 45S+ 0 0 71 -2,-0.8 -1,-0.2 1,-0.2 3,-0.2 0.806 77.8 63.1 -57.3 -31.0 4.3 -3.4 27.6 48 48 A G T 45S+ 0 0 80 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.949 118.9 19.1 -62.3 -56.8 7.2 -5.3 29.1 49 49 A D T 45S- 0 0 62 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.232 102.9-122.5-100.7 14.7 7.8 -3.3 32.3 50 50 A R T <5 + 0 0 153 -4,-0.8 2,-0.2 1,-0.2 -3,-0.2 0.747 68.4 130.2 51.9 32.7 4.3 -1.7 32.2 51 51 A S E < -C 46 0C 1 -5,-1.0 -5,-3.0 19,-0.1 2,-0.4 -0.650 46.3-142.8-109.6 167.6 5.8 1.9 32.1 52 52 A T E -C 45 0C 9 -7,-0.2 9,-2.5 -2,-0.2 2,-0.5 -0.986 7.3-138.6-135.7 137.9 5.0 4.8 29.7 53 53 A D E -CD 44 60C 29 -9,-2.5 -9,-1.7 -2,-0.4 2,-0.4 -0.861 29.7-155.6 -94.2 133.5 7.3 7.5 28.2 54 54 A Y E > -CD 43 59C 20 5,-2.2 5,-2.2 -2,-0.5 3,-0.4 -0.927 29.1 -28.0-123.6 139.0 5.7 10.9 28.3 55 55 A G T > 5S- 0 0 0 -13,-2.0 3,-1.3 -2,-0.4 -14,-0.2 -0.062 98.1 -23.0 72.9-164.8 6.0 14.2 26.4 56 56 A I T 3 5S+ 0 0 2 28,-0.3 -20,-0.4 1,-0.3 -18,-0.3 0.792 141.7 34.3 -58.3 -31.3 8.6 16.1 24.4 57 57 A F T 3 5S- 0 0 2 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.382 105.2-127.1-105.9 1.9 11.5 14.4 26.2 58 58 A Q T < 5 - 0 0 17 -3,-1.3 2,-0.4 1,-0.2 -3,-0.2 0.926 35.2-167.6 49.5 56.4 9.7 11.0 26.5 59 59 A I E < -D 54 0C 3 -5,-2.2 -5,-2.2 -6,-0.1 2,-0.3 -0.608 17.1-118.8 -80.4 129.4 10.3 10.8 30.3 60 60 A N E >> -D 53 0C 24 -2,-0.4 4,-2.4 -7,-0.2 3,-1.0 -0.522 5.6-145.4 -79.6 131.9 9.6 7.4 31.8 61 61 A S T 34 S+ 0 0 0 -9,-2.5 6,-0.2 -2,-0.3 13,-0.1 0.640 89.9 73.5 -64.1 -21.9 7.0 6.7 34.5 62 62 A R T 34 S+ 0 0 49 11,-0.2 12,-2.7 -10,-0.1 -1,-0.2 0.887 121.2 4.7 -64.0 -33.3 9.0 4.0 36.3 63 63 A Y T <4 S+ 0 0 128 -3,-1.0 13,-2.6 10,-0.2 -2,-0.2 0.728 132.1 40.0-122.1 -28.4 11.4 6.5 37.8 64 64 A W S < S+ 0 0 33 -4,-2.4 13,-2.0 11,-0.3 15,-0.3 0.787 107.5 18.0-103.7 -33.0 10.4 10.1 37.0 65 65 A c - 0 0 0 -5,-0.5 2,-0.6 9,-0.3 15,-0.2 -0.934 68.9-113.3-138.9 163.0 6.7 10.8 37.2 66 66 A N B +e 80 0D 79 13,-2.5 15,-2.1 -2,-0.3 16,-0.4 -0.877 36.9 155.2-105.1 123.0 3.6 9.3 38.7 67 67 A D - 0 0 34 -2,-0.6 -1,-0.1 -6,-0.2 13,-0.1 0.263 51.6-129.0-119.4 5.1 0.8 7.9 36.6 68 68 A G S S+ 0 0 64 -7,-0.1 -2,-0.1 1,-0.1 12,-0.0 0.355 92.7 77.0 64.2 -4.0 -0.4 5.5 39.3 69 69 A K + 0 0 138 2,-0.1 -1,-0.1 -19,-0.0 -3,-0.0 0.267 62.8 98.7-119.0 8.0 -0.4 2.4 36.9 70 70 A T S > S- 0 0 13 -9,-0.1 3,-1.7 -18,-0.0 -2,-0.1 -0.893 79.8-118.7-100.0 114.2 3.3 1.6 36.8 71 71 A P T 3 S- 0 0 69 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.279 87.9 -8.7 -55.0 122.7 4.1 -1.3 39.2 72 72 A G T 3 S+ 0 0 81 1,-0.2 -10,-0.0 -2,-0.1 2,-0.0 0.673 96.2 158.1 62.3 22.4 6.6 -0.4 41.9 73 73 A A < - 0 0 31 -3,-1.7 2,-0.2 1,-0.1 -10,-0.2 -0.250 29.7-147.9 -76.9 160.9 7.4 3.0 40.3 74 74 A V - 0 0 90 -12,-2.7 -9,-0.3 -13,-0.1 2,-0.2 -0.708 9.8-136.8-118.9 174.8 8.9 6.0 42.0 75 75 A N > + 0 0 44 -2,-0.2 3,-1.2 -11,-0.1 -11,-0.3 -0.604 28.6 164.9-137.0 72.3 8.4 9.8 41.2 76 76 A A T 3 S+ 0 0 20 -13,-2.6 -12,-0.2 1,-0.3 -11,-0.1 0.711 81.8 49.5 -65.6 -21.2 11.8 11.5 41.3 77 77 A d T 3 S- 0 0 19 -13,-2.0 -1,-0.3 2,-0.2 -12,-0.1 0.562 103.0-136.2 -91.1 -8.7 10.5 14.6 39.5 78 78 A H < + 0 0 153 -3,-1.2 2,-0.3 -14,-0.2 -13,-0.1 0.934 62.5 119.6 50.6 54.6 7.6 14.7 42.0 79 79 A L S S- 0 0 39 -15,-0.3 -13,-2.5 16,-0.0 -1,-0.2 -0.981 71.5-110.5-143.1 150.2 5.1 15.4 39.2 80 80 A S B > -e 66 0D 70 -2,-0.3 3,-1.6 -15,-0.2 4,-0.4 -0.564 36.0-120.6 -74.5 145.2 2.0 13.6 37.8 81 81 A c G > S+ 0 0 1 -15,-2.1 3,-1.6 1,-0.3 -14,-0.1 0.760 111.1 74.3 -62.1 -21.9 3.0 12.4 34.4 82 82 A S G > S+ 0 0 82 -16,-0.4 3,-2.1 1,-0.3 -1,-0.3 0.841 84.8 64.6 -56.8 -35.2 0.1 14.5 33.1 83 83 A A G X S+ 0 0 17 -3,-1.6 3,-0.7 1,-0.3 9,-0.3 0.764 95.2 60.2 -60.7 -22.5 2.3 17.5 33.8 84 84 A L G < S+ 0 0 4 -3,-1.6 -28,-0.3 -4,-0.4 -1,-0.3 0.323 98.5 57.6 -88.6 7.7 4.6 16.1 31.0 85 85 A L G < S+ 0 0 56 -3,-2.1 -1,-0.2 -30,-0.1 -2,-0.2 0.244 79.4 115.8-119.6 10.1 1.8 16.4 28.4 86 86 A Q S < S- 0 0 78 -3,-0.7 6,-0.1 2,-0.2 -3,-0.0 -0.390 70.9-126.1 -78.9 159.6 1.1 20.1 28.6 87 87 A D S S+ 0 0 91 -2,-0.1 2,-0.6 -46,-0.0 -1,-0.1 0.837 101.2 71.3 -70.4 -37.6 1.6 22.6 25.8 88 88 A N S S- 0 0 104 1,-0.1 3,-0.4 -48,-0.0 4,-0.3 -0.767 73.9-161.5 -81.9 119.6 3.7 24.7 28.2 89 89 A I > + 0 0 6 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.304 58.3 107.6 -90.9 13.6 6.9 22.7 28.7 90 90 A A H > S+ 0 0 34 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.936 84.4 44.5 -54.1 -52.1 8.1 24.4 31.9 91 91 A D H > S+ 0 0 62 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.900 112.1 52.5 -61.7 -40.0 7.3 21.3 34.0 92 92 A A H > S+ 0 0 7 -9,-0.3 4,-2.3 -4,-0.3 -1,-0.2 0.891 110.3 49.2 -62.5 -39.3 8.8 18.9 31.4 93 93 A V H X S+ 0 0 2 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.912 107.2 54.0 -67.7 -41.7 12.0 21.0 31.5 94 94 A A H X S+ 0 0 53 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.916 113.1 44.6 -57.9 -41.9 12.2 21.0 35.3 95 95 A d H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.875 108.9 54.1 -70.8 -40.0 12.0 17.2 35.2 96 96 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.853 109.0 51.5 -63.7 -31.3 14.5 16.8 32.3 97 97 A K H X S+ 0 0 40 -4,-2.1 4,-0.7 2,-0.2 -2,-0.2 0.920 107.8 51.5 -70.1 -40.3 16.9 18.9 34.6 98 98 A R H >< S+ 0 0 68 -4,-1.8 3,-0.8 1,-0.2 4,-0.3 0.912 108.9 51.8 -61.6 -41.0 16.1 16.4 37.4 99 99 A V H >< S+ 0 0 2 -4,-2.5 3,-2.0 1,-0.2 6,-0.4 0.940 108.3 49.4 -61.5 -49.9 17.0 13.5 35.1 100 100 A V H 3< S+ 0 0 6 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.566 97.7 69.3 -71.0 -5.1 20.4 14.9 34.1 101 101 A R T << S+ 0 0 108 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.609 87.1 90.2 -83.7 -10.1 21.2 15.6 37.7 102 102 A D S X S- 0 0 67 -3,-2.0 3,-1.4 -4,-0.3 6,-0.1 -0.301 103.6 -83.5 -79.5 168.3 21.5 11.8 38.0 103 103 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.633 123.6 47.4 -43.9 -31.4 24.7 9.8 37.4 104 104 A Q T > S- 0 0 105 -5,-0.3 3,-1.4 1,-0.2 -4,-0.1 0.689 82.2-167.5 -90.3 -20.5 24.4 9.5 33.6 105 105 A G G X S- 0 0 17 -3,-1.4 3,-2.0 -6,-0.4 -1,-0.2 -0.452 72.9 -7.3 68.4-139.4 23.6 13.1 32.7 106 106 A I G > S+ 0 0 15 1,-0.3 3,-1.3 -85,-0.2 -1,-0.3 0.773 127.8 73.3 -61.8 -24.9 22.5 13.6 29.1 107 107 A R G < + 0 0 111 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.576 67.9 94.0 -66.1 -9.4 23.3 9.9 28.5 108 108 A A G < S+ 0 0 31 -3,-2.0 2,-0.6 -6,-0.1 -1,-0.3 0.869 77.1 67.0 -51.7 -37.2 20.2 8.9 30.6 109 109 A W S X> S- 0 0 19 -3,-1.3 4,-1.4 -4,-0.2 3,-0.8 -0.772 73.1-153.2 -90.8 121.1 18.3 8.7 27.2 110 110 A V H 3> S+ 0 0 80 -2,-0.6 4,-2.2 1,-0.3 5,-0.2 0.882 95.0 61.6 -59.4 -37.1 19.4 5.9 24.9 111 111 A A H 3> S+ 0 0 18 1,-0.2 4,-3.1 2,-0.2 5,-0.4 0.860 100.1 54.2 -58.2 -38.1 18.2 7.9 21.9 112 112 A W H <>>S+ 0 0 16 -3,-0.8 5,-2.6 1,-0.2 4,-2.5 0.948 108.2 49.1 -61.7 -46.1 20.7 10.6 22.7 113 113 A R H <5S+ 0 0 94 -4,-1.4 -2,-0.2 3,-0.2 -1,-0.2 0.885 117.6 42.4 -59.2 -38.4 23.5 8.0 22.7 114 114 A N H <5S+ 0 0 87 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.913 131.0 18.2 -73.9 -48.2 22.2 6.7 19.3 115 115 A R H <5S+ 0 0 115 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.456 134.3 26.8-107.8 -4.7 21.5 9.9 17.4 116 116 A b T ><5S+ 0 0 2 -4,-2.5 3,-1.6 -5,-0.4 -3,-0.2 0.678 87.1 96.0-127.7 -39.6 23.3 12.7 19.2 117 117 A Q T 3 + 0 0 19 -2,-0.8 3,-1.7 1,-0.1 4,-0.3 0.371 43.8 106.3-105.2 6.5 24.4 18.7 16.5 122 122 A R G >> + 0 0 160 1,-0.3 3,-1.6 2,-0.2 4,-0.7 0.800 66.2 72.9 -52.6 -36.8 25.0 22.3 15.4 123 123 A Q G 34 S+ 0 0 123 1,-0.3 3,-0.5 -3,-0.2 -1,-0.3 0.776 86.4 64.3 -51.0 -33.1 22.1 22.1 12.8 124 124 A Y G <4 S+ 0 0 16 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.738 111.9 31.1 -68.9 -25.0 19.5 22.2 15.6 125 125 A V T X4 S+ 0 0 29 -3,-1.6 3,-1.8 -4,-0.3 5,-0.4 0.358 84.4 132.3-114.6 4.8 20.3 25.7 16.8 126 126 A Q T 3< S- 0 0 103 -4,-0.7 -120,-0.1 -3,-0.5 -3,-0.0 -0.404 84.5 -3.6 -64.9 119.8 21.5 27.3 13.5 127 127 A G T 3 S+ 0 0 81 -2,-0.3 -1,-0.3 3,-0.1 -121,-0.1 0.606 97.0 116.8 76.8 13.2 19.8 30.6 13.0 128 128 A a S < S- 0 0 1 -3,-1.8 -2,-0.1 2,-0.1 -118,-0.1 0.498 80.7-121.0 -89.4 -6.1 17.6 30.4 16.1 129 129 A G 0 0 75 -4,-0.3 -3,-0.1 1,-0.2 -4,-0.0 0.773 360.0 360.0 72.1 28.3 19.3 33.5 17.8 130 130 A V 0 0 61 -5,-0.4 -1,-0.2 -117,-0.0 -3,-0.1 -0.646 360.0 360.0-108.1 360.0 20.3 31.5 20.8