==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-APR-02 1LJG . COMPND 2 MOLECULE: LYSOZYME C; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR N.T.SARASWATHI,R.SANKARANARAYANAN,M.VIJAYAN . 258 2 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12790.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 17 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 20.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 24.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 2 0 0 0 4 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 . 4 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 85 0, 0.0 39,-2.9 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 143.6 0.0 45.0 15.9 2 2 A V B -A 39 0A 100 37,-0.2 37,-0.2 38,-0.1 2,-0.1 -0.924 360.0-145.4-111.6 109.9 1.8 45.7 19.2 3 3 A F - 0 0 14 35,-2.3 2,-0.2 -2,-0.6 3,-0.0 -0.390 10.4-125.5 -73.9 147.5 -0.7 45.9 22.1 4 4 A G > - 0 0 36 -2,-0.1 4,-2.0 1,-0.1 5,-0.2 -0.499 36.0-106.7 -80.1 163.9 -0.3 48.3 25.0 5 5 A R H > S+ 0 0 71 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.955 117.7 35.0 -60.1 -55.2 -0.4 46.4 28.4 6 6 A a H > S+ 0 0 34 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.852 112.4 62.4 -68.8 -33.7 -3.9 47.5 29.5 7 7 A E H > S+ 0 0 91 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.922 109.4 41.0 -56.6 -44.2 -5.2 47.5 26.0 8 8 A L H X S+ 0 0 0 -4,-2.0 4,-3.3 2,-0.2 5,-0.3 0.924 110.9 56.4 -69.7 -44.8 -4.4 43.7 25.8 9 9 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.929 110.1 46.9 -51.5 -47.1 -5.7 43.1 29.3 10 10 A A H X S+ 0 0 29 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.927 112.0 49.6 -61.0 -47.3 -9.0 44.7 28.2 11 11 A A H X S+ 0 0 9 -4,-2.0 4,-1.2 -5,-0.2 -2,-0.2 0.895 113.1 46.6 -60.3 -42.2 -9.1 42.6 25.0 12 12 A M H <>S+ 0 0 1 -4,-3.3 5,-2.0 2,-0.2 6,-0.3 0.903 111.1 50.8 -68.2 -41.5 -8.4 39.4 26.9 13 13 A K H ><5S+ 0 0 86 -4,-2.6 3,-1.6 -5,-0.3 -2,-0.2 0.899 107.8 54.8 -62.2 -38.9 -11.0 40.1 29.5 14 14 A R H 3<5S+ 0 0 177 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.807 106.8 51.1 -63.7 -31.1 -13.5 40.8 26.7 15 15 A H T 3<5S- 0 0 49 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.217 122.6-104.7 -93.5 15.5 -12.8 37.4 25.3 16 16 A G T < 5S+ 0 0 37 -3,-1.6 -3,-0.2 -5,-0.1 -2,-0.1 0.743 79.9 128.2 73.5 28.9 -13.3 35.6 28.6 17 17 A L > < + 0 0 0 -5,-2.0 3,-2.0 2,-0.1 2,-0.5 0.692 36.0 109.1 -88.0 -19.6 -9.8 34.8 29.8 18 18 A D T 3 S- 0 0 66 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.445 104.4 -11.6 -64.5 111.1 -10.0 36.3 33.3 19 19 A N T > S+ 0 0 97 4,-1.9 3,-2.6 -2,-0.5 -1,-0.3 0.569 90.3 165.1 75.4 11.3 -10.1 33.4 35.7 20 20 A Y B X S-B 23 0B 77 -3,-2.0 3,-1.7 3,-0.7 -1,-0.3 -0.444 78.3 -4.6 -61.9 124.3 -10.6 31.0 32.8 21 21 A R T 3 S- 0 0 156 1,-0.3 -1,-0.3 -2,-0.2 3,-0.1 0.771 136.6 -57.8 60.0 25.1 -9.9 27.5 34.3 22 22 A G T < S+ 0 0 68 -3,-2.6 2,-0.7 1,-0.2 -1,-0.3 0.538 105.3 130.6 84.9 7.6 -8.9 29.3 37.5 23 23 A Y B < -B 20 0B 48 -3,-1.7 -4,-1.9 -6,-0.1 -3,-0.7 -0.844 53.4-133.8-102.3 109.5 -6.2 31.5 35.8 24 24 A S >> - 0 0 37 -2,-0.7 3,-1.4 -5,-0.3 4,-1.0 -0.097 25.7-106.6 -54.5 154.4 -6.4 35.2 36.7 25 25 A L H 3> S+ 0 0 6 1,-0.3 4,-2.3 2,-0.2 3,-0.4 0.847 118.1 64.7 -51.5 -39.9 -6.1 37.8 33.9 26 26 A G H 3> S+ 0 0 4 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.853 96.4 57.5 -55.4 -35.4 -2.7 38.7 35.2 27 27 A N H <> S+ 0 0 21 -3,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.916 109.1 43.6 -61.6 -44.4 -1.5 35.2 34.3 28 28 A W H X S+ 0 0 0 -4,-1.0 4,-2.5 -3,-0.4 -2,-0.2 0.881 113.7 49.6 -70.1 -40.3 -2.5 35.6 30.6 29 29 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.908 112.6 49.2 -64.4 -41.0 -1.1 39.2 30.3 30 30 A b H X S+ 0 0 0 -4,-2.4 4,-1.9 -5,-0.3 -2,-0.2 0.892 110.5 49.9 -65.8 -39.4 2.1 38.0 31.8 31 31 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 5,-0.3 0.934 111.2 48.7 -65.2 -44.8 2.3 35.0 29.4 32 32 A A H X>S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 6,-1.3 0.884 108.8 54.9 -62.1 -39.0 1.7 37.2 26.4 33 33 A K H X5S+ 0 0 55 -4,-2.1 4,-1.5 4,-0.2 -1,-0.2 0.939 117.1 33.5 -61.1 -48.7 4.4 39.7 27.5 34 34 A F H <5S+ 0 0 48 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.680 118.3 52.2 -85.1 -17.8 7.1 37.0 27.8 35 35 A E H <5S- 0 0 29 -4,-2.1 -3,-0.2 20,-0.2 -2,-0.2 0.897 139.9 -9.8 -82.2 -42.3 6.0 34.8 24.9 36 36 A S H ><5S- 0 0 11 -4,-2.2 3,-1.6 19,-0.4 -3,-0.2 0.317 84.7-115.4-140.6 9.3 5.7 37.6 22.3 37 37 A N T 3< - 0 0 40 4,-3.5 3,-1.5 -2,-0.3 -1,-0.0 -0.702 20.6-119.5-102.9 157.2 11.7 25.6 16.5 47 47 A T T 3 S+ 0 0 159 -2,-0.3 -1,-0.1 1,-0.3 4,-0.1 0.570 109.1 66.0 -71.4 -8.6 14.5 23.1 15.8 48 48 A D T 3 S- 0 0 77 2,-0.2 -1,-0.3 21,-0.0 3,-0.1 0.390 123.3 -98.6 -93.2 3.2 12.0 20.3 15.3 49 49 A G S < S+ 0 0 17 -3,-1.5 2,-0.2 1,-0.4 -2,-0.1 0.445 90.3 114.3 95.4 0.4 10.6 22.0 12.2 50 50 A S - 0 0 0 19,-0.1 -4,-3.5 10,-0.0 -1,-0.4 -0.579 51.3-148.2 -99.3 166.4 7.6 23.6 13.9 51 51 A T E -C 45 0C 4 -6,-0.3 9,-2.3 -2,-0.2 2,-0.4 -0.980 9.6-132.6-136.2 145.9 7.0 27.3 14.5 52 52 A D E -CD 44 59C 27 -8,-3.1 -8,-1.7 -2,-0.3 2,-0.4 -0.859 29.4-155.9 -98.7 134.4 5.3 29.2 17.3 53 53 A Y E > -CD 43 58C 18 5,-2.6 5,-2.6 -2,-0.4 3,-0.4 -0.908 31.3 -18.8-121.5 142.0 2.8 31.9 16.2 54 54 A G T > 5S- 0 0 0 -12,-1.8 3,-2.2 -2,-0.4 30,-0.2 0.000 97.8 -30.9 75.4-174.4 1.2 35.1 17.5 55 55 A I T 3 5S+ 0 0 4 28,-0.4 -19,-0.4 1,-0.3 -17,-0.3 0.734 142.3 35.4 -53.1 -28.2 0.7 36.9 20.8 56 56 A L T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.213 106.0-125.5-113.3 13.4 0.5 33.5 22.6 57 57 A Q T < 5 - 0 0 19 -3,-2.2 2,-0.4 1,-0.2 -3,-0.2 0.895 32.0-165.2 43.1 61.5 3.1 31.7 20.5 58 58 A I E < -D 53 0C 1 -5,-2.6 -5,-2.6 -6,-0.1 2,-0.2 -0.621 18.8-119.3 -80.0 131.3 0.9 28.7 19.5 59 59 A N E >>> -D 52 0C 25 -2,-0.4 4,-1.9 -7,-0.2 3,-0.7 -0.500 8.3-147.6 -77.2 134.4 2.9 25.8 18.1 60 60 A S T 345S+ 0 0 0 -9,-2.3 6,-0.2 -2,-0.2 13,-0.1 0.657 86.5 76.9 -74.4 -17.3 2.3 24.5 14.6 61 61 A R T 345S+ 0 0 42 11,-0.2 12,-2.0 -10,-0.2 -1,-0.2 0.826 120.8 0.3 -65.8 -26.6 3.1 20.8 15.3 62 62 A W T <45S+ 0 0 135 -3,-0.7 13,-2.1 10,-0.2 -2,-0.2 0.644 130.7 45.5-132.2 -26.2 -0.3 20.3 17.0 63 63 A W T <5S+ 0 0 21 -4,-1.9 13,-1.3 11,-0.2 15,-0.4 0.768 108.9 17.3-100.7 -27.8 -2.5 23.4 17.0 64 64 A c S S- 0 0 10 -9,-0.1 3,-1.4 -19,-0.0 -2,-0.1 -0.953 73.0-121.2-120.9 113.5 5.3 20.9 9.9 70 70 A P T 3 S- 0 0 84 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.144 91.1 -3.5 -50.7 138.9 5.9 17.1 9.7 71 71 A G T 3 S+ 0 0 81 1,-0.2 2,-0.2 -9,-0.0 -10,-0.0 0.821 94.4 171.2 43.2 38.7 3.1 15.0 11.2 72 72 A S < - 0 0 39 -3,-1.4 2,-0.3 2,-0.0 -10,-0.2 -0.513 22.4-152.3 -80.0 146.7 1.4 18.2 12.2 73 73 A R - 0 0 156 -12,-2.0 -9,-0.2 -2,-0.2 3,-0.1 -0.781 7.3-148.0-111.6 158.7 -2.1 18.0 13.6 74 74 A N > + 0 0 56 -2,-0.3 3,-1.7 1,-0.1 -11,-0.2 -0.522 31.8 158.3-127.8 64.2 -4.6 20.9 13.3 75 75 A L T 3 S+ 0 0 53 -13,-2.1 -12,-0.2 1,-0.3 -11,-0.1 0.710 76.2 51.3 -60.7 -24.5 -6.6 20.5 16.5 76 76 A d T 3 S- 0 0 24 -13,-1.3 -1,-0.3 -14,-0.2 -12,-0.1 0.482 104.5-132.6 -93.1 -1.5 -7.7 24.2 16.4 77 77 A N < + 0 0 134 -3,-1.7 -13,-0.1 1,-0.2 -2,-0.1 0.887 65.0 107.7 55.3 47.6 -8.8 23.8 12.8 78 78 A I S S- 0 0 42 -15,-0.4 -13,-2.3 16,-0.0 2,-0.2 -0.996 73.8-103.5-152.1 154.2 -7.1 27.0 11.6 79 79 A P B > -e 65 0D 66 0, 0.0 3,-1.8 0, 0.0 4,-0.4 -0.574 33.8-125.2 -76.1 143.5 -4.2 28.2 9.5 80 80 A c G > S+ 0 0 1 -15,-1.8 3,-1.7 1,-0.3 4,-0.2 0.778 108.7 69.3 -58.1 -27.8 -1.3 29.4 11.6 81 81 A S G > S+ 0 0 81 -16,-0.4 3,-1.7 1,-0.3 -1,-0.3 0.795 87.6 64.8 -62.1 -27.4 -1.5 32.7 9.7 82 82 A A G X S+ 0 0 29 -3,-1.8 3,-0.8 1,-0.3 -1,-0.3 0.715 94.4 61.5 -67.5 -18.7 -4.8 33.4 11.4 83 83 A L G < S+ 0 0 2 -3,-1.7 -28,-0.4 -4,-0.4 -1,-0.3 0.487 94.1 63.2 -85.2 -3.3 -2.8 33.5 14.6 84 84 A L G < S+ 0 0 39 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.2 0.120 80.5 117.2-105.8 18.6 -0.8 36.5 13.3 85 85 A S S < S- 0 0 45 -3,-0.8 6,-0.1 2,-0.3 -3,-0.0 -0.377 75.4-121.3 -84.9 164.7 -3.8 38.9 13.0 86 86 A S S S+ 0 0 71 -2,-0.1 2,-0.6 2,-0.0 -1,-0.1 0.653 101.7 76.6 -76.5 -16.0 -4.4 42.1 14.9 87 87 A D S S- 0 0 92 1,-0.1 3,-0.5 -47,-0.1 4,-0.3 -0.874 70.3-161.3 -96.3 120.2 -7.6 40.5 16.2 88 88 A I > + 0 0 7 -2,-0.6 4,-2.9 1,-0.2 5,-0.2 0.452 63.1 105.0 -82.8 0.0 -6.7 38.0 18.9 89 89 A T H > S+ 0 0 47 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.892 80.8 47.8 -45.0 -52.4 -10.0 36.1 18.7 90 90 A A H > S+ 0 0 27 -3,-0.5 4,-2.0 -8,-0.3 -1,-0.2 0.926 113.6 46.5 -57.5 -49.1 -8.4 33.2 16.9 91 91 A S H > S+ 0 0 2 -4,-0.3 4,-2.6 -9,-0.3 -1,-0.2 0.879 112.4 51.0 -63.4 -38.1 -5.4 32.9 19.4 92 92 A V H X S+ 0 0 1 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.951 110.5 46.8 -66.0 -48.6 -7.7 33.2 22.4 93 93 A N H X S+ 0 0 91 -4,-2.6 4,-0.8 -5,-0.2 -1,-0.2 0.869 116.3 45.2 -61.4 -36.5 -10.1 30.4 21.3 94 94 A d H >X S+ 0 0 5 -4,-2.0 4,-1.9 -5,-0.2 3,-0.8 0.912 110.8 54.3 -71.8 -42.4 -7.2 28.2 20.4 95 95 A A H 3X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.3 5,-0.3 0.888 101.4 59.3 -57.7 -40.8 -5.5 29.1 23.7 96 96 A K H 3< S+ 0 0 45 -4,-2.5 4,-0.3 1,-0.2 -1,-0.3 0.816 107.5 46.4 -59.5 -31.0 -8.7 28.1 25.6 97 97 A K H << S+ 0 0 84 -3,-0.8 3,-0.4 -4,-0.8 -1,-0.2 0.860 111.6 51.6 -78.9 -35.8 -8.3 24.6 24.1 98 98 A I H >< S+ 0 0 9 -4,-1.9 3,-2.3 1,-0.2 5,-0.4 0.943 105.8 51.8 -66.2 -48.5 -4.6 24.4 25.0 99 99 A V T 3< S+ 0 0 1 -4,-2.8 5,-0.4 1,-0.3 3,-0.2 0.644 110.5 52.2 -64.5 -12.4 -4.9 25.4 28.7 100 100 A S T 3 S+ 0 0 43 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.2 0.296 82.6 96.6-103.2 7.0 -7.5 22.6 28.9 101 101 A D S < S- 0 0 89 -3,-2.3 -1,-0.2 3,-0.2 -2,-0.1 0.179 109.4 -84.3 -86.0 17.5 -5.2 20.0 27.4 102 102 A G S S+ 0 0 65 -3,-0.2 -2,-0.1 -4,-0.0 -3,-0.1 0.502 116.2 70.0 99.2 4.4 -4.0 18.5 30.7 103 103 A N S > S- 0 0 99 -5,-0.4 3,-1.8 1,-0.3 4,-0.1 0.272 80.0-143.7-134.9 8.6 -1.1 20.8 31.7 104 104 A G G > S- 0 0 16 -5,-0.4 3,-1.1 1,-0.3 -1,-0.3 -0.255 72.3 -26.4 58.1-148.6 -2.8 24.1 32.6 105 105 A M G > S+ 0 0 0 1,-0.3 3,-2.0 2,-0.1 7,-0.3 0.476 117.2 96.1 -77.6 2.2 -0.8 27.1 31.6 106 106 A N G < + 0 0 68 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.668 64.5 80.3 -64.1 -13.7 2.4 25.0 31.8 107 107 A A G < S+ 0 0 52 -3,-1.1 2,-0.8 1,-0.1 -1,-0.3 0.774 82.9 69.6 -63.2 -26.2 1.9 24.6 28.1 108 108 A W S <> S- 0 0 8 -3,-2.0 4,-2.1 1,-0.2 5,-0.1 -0.853 70.8-163.8 -97.3 112.5 3.5 28.0 27.7 109 109 A V H > S+ 0 0 88 -2,-0.8 4,-2.8 1,-0.2 5,-0.2 0.852 88.6 52.6 -65.3 -36.3 7.2 27.8 28.6 110 110 A A H > S+ 0 0 13 2,-0.2 4,-2.7 1,-0.2 5,-0.4 0.871 109.0 51.5 -67.3 -36.0 7.7 31.5 29.0 111 111 A W H >>S+ 0 0 10 2,-0.2 4,-2.6 3,-0.2 5,-2.6 0.943 111.9 46.6 -64.0 -46.6 4.7 31.6 31.4 112 112 A R H <5S+ 0 0 80 -4,-2.1 -2,-0.2 -7,-0.3 -1,-0.2 0.937 118.7 40.7 -60.5 -48.9 6.2 28.8 33.4 113 113 A N H <5S+ 0 0 71 -4,-2.8 -2,-0.2 1,-0.1 -1,-0.2 0.816 132.6 19.1 -71.5 -34.4 9.7 30.4 33.5 114 114 A R H <5S+ 0 0 162 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.571 131.9 29.7-115.3 -11.3 8.7 34.0 34.1 115 115 A b T ><5S+ 0 0 0 -4,-2.6 3,-2.4 -5,-0.4 -3,-0.2 0.787 81.6 103.5-115.7 -46.0 5.1 34.1 35.5 116 116 A K T 3 + 0 0 69 1,-0.2 3,-1.5 -2,-0.1 4,-0.2 -0.607 51.7 171.9 -85.1 78.8 2.7 38.3 41.8 120 120 A V G > + 0 0 17 -2,-1.8 3,-1.3 1,-0.3 4,-0.2 0.601 61.7 82.2 -67.4 -9.9 0.9 38.3 38.4 121 121 A Q G > S+ 0 0 148 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.802 77.5 71.1 -64.8 -27.3 -1.6 40.9 39.7 122 122 A A G X S+ 0 0 25 -3,-1.5 3,-1.4 1,-0.3 -1,-0.3 0.771 84.1 68.8 -60.5 -25.8 1.0 43.5 38.9 123 123 A W G < S+ 0 0 55 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.634 99.4 49.2 -70.6 -10.9 0.5 43.0 35.2 124 124 A I G X S+ 0 0 36 -3,-1.8 3,-1.9 -4,-0.2 -1,-0.3 0.343 80.9 133.2-107.6 4.0 -3.0 44.5 35.5 125 125 A R T < S+ 0 0 163 -3,-1.4 3,-0.1 1,-0.3 -119,-0.1 -0.245 74.1 13.4 -59.1 140.0 -1.9 47.6 37.4 126 126 A G T 3 S+ 0 0 68 1,-0.2 2,-0.4 -120,-0.0 -1,-0.3 0.366 94.8 133.0 76.9 -6.1 -3.3 50.9 36.1 127 127 A a < - 0 0 22 -3,-1.9 2,-1.3 1,-0.1 -1,-0.2 -0.648 51.6-148.5 -83.0 128.4 -5.9 49.0 34.0 128 128 A R 0 0 231 -2,-0.4 -1,-0.1 -3,-0.1 -3,-0.0 -0.748 360.0 360.0 -94.4 88.5 -9.5 50.2 34.1 129 129 A L 0 0 99 -2,-1.3 -119,-0.1 -5,-0.1 -123,-0.0 -0.476 360.0 360.0 -97.9 360.0 -11.1 46.9 33.6 130 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 131 1 B K 0 0 94 0, 0.0 39,-2.6 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 142.0 18.2 42.6 44.1 132 2 B V B -F 169 0E 103 37,-0.2 37,-0.2 38,-0.1 2,-0.2 -0.932 360.0-145.0-107.1 117.9 19.7 43.4 47.5 133 3 B F - 0 0 15 35,-2.6 2,-0.2 -2,-0.6 3,-0.0 -0.489 8.9-125.2 -83.9 150.8 17.0 44.5 50.0 134 4 B G > - 0 0 37 -2,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.622 34.6-110.7 -85.0 154.1 17.3 47.0 52.8 135 5 B R H > S+ 0 0 82 -2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.931 115.8 35.9 -51.9 -57.2 16.4 45.5 56.2 136 6 B e H > S+ 0 0 40 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.800 112.8 60.4 -70.3 -28.3 13.2 47.4 56.7 137 7 B E H > S+ 0 0 87 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.906 108.8 43.7 -64.2 -40.9 12.3 47.3 53.0 138 8 B L H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.896 112.0 53.3 -69.8 -42.8 12.3 43.5 53.3 139 9 B A H X S+ 0 0 0 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.919 109.6 48.2 -58.5 -45.1 10.4 43.5 56.5 140 10 B A H X S+ 0 0 22 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.890 113.0 48.4 -63.1 -40.6 7.7 45.7 54.9 141 11 B A H X S+ 0 0 7 -4,-1.8 4,-1.1 1,-0.2 -2,-0.2 0.895 111.5 49.1 -66.5 -42.0 7.5 43.4 51.9 142 12 B M H <>S+ 0 0 1 -4,-2.9 5,-2.2 1,-0.2 6,-0.3 0.843 109.2 52.9 -67.9 -32.8 7.3 40.3 54.1 143 13 B K H ><5S+ 0 0 91 -4,-2.1 3,-1.7 1,-0.2 -1,-0.2 0.896 104.7 55.3 -68.7 -38.9 4.5 41.8 56.2 144 14 B R H 3<5S+ 0 0 186 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.788 106.1 52.7 -63.8 -27.2 2.5 42.6 53.1 145 15 B H T 3<5S- 0 0 48 -4,-1.1 -1,-0.3 -5,-0.1 -2,-0.2 0.166 120.7-108.3 -94.7 17.8 2.7 38.9 52.2 146 16 B G T < 5S+ 0 0 41 -3,-1.7 -3,-0.2 1,-0.1 -2,-0.1 0.791 77.6 131.0 64.0 35.5 1.4 37.8 55.6 147 17 B L > < + 0 0 0 -5,-2.2 3,-2.1 2,-0.1 2,-0.4 0.728 35.0 108.7 -89.8 -20.9 4.6 36.4 57.1 148 18 B D T 3 S- 0 0 65 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.405 103.1 -10.7 -63.1 112.3 4.3 38.3 60.4 149 19 B N T > S+ 0 0 98 4,-2.1 3,-2.3 -2,-0.4 -1,-0.3 0.578 88.3 164.2 73.9 12.4 3.4 35.7 63.1 150 20 B Y 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2,-0.2 1,-0.3 -2,-0.1 0.425 92.0 111.1 89.7 -1.5 23.3 17.5 43.7 180 50 B S - 0 0 1 19,-0.1 -4,-4.2 9,-0.0 -1,-0.3 -0.625 48.9-157.9-102.6 163.3 20.9 20.0 45.2 181 51 B T E -H 175 0G 2 -6,-0.3 9,-1.7 -2,-0.2 2,-0.4 -0.996 15.1-127.8-142.6 146.0 21.2 23.8 45.4 182 52 B D E -HI 174 189G 27 -8,-2.6 -8,-1.8 -2,-0.3 2,-0.4 -0.789 29.0-155.7 -94.0 135.1 19.6 26.5 47.6 183 53 B Y E > -HI 173 188G 22 5,-2.4 5,-2.0 -2,-0.4 3,-0.4 -0.905 33.0 -19.5-121.0 141.6 18.0 29.4 45.9 184 54 B G T > 5S- 0 0 0 -12,-2.0 3,-2.0 -2,-0.4 -13,-0.2 -0.006 98.1 -28.7 76.0-173.1 17.1 33.0 46.7 185 55 B I T 3 5S+ 0 0 2 28,-0.5 -19,-0.3 1,-0.3 -17,-0.3 0.741 141.1 36.2 -55.0 -28.1 16.7 35.2 49.7 186 56 B L T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.2 0.240 104.0-127.7-111.9 11.7 15.6 32.3 51.9 187 57 B Q T < 5 - 0 0 23 -3,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.883 33.7-169.2 42.4 58.3 17.9 29.7 50.3 188 58 B I E < -I 183 0G 3 -5,-2.0 -5,-2.4 -6,-0.1 2,-0.3 -0.615 18.9-120.3 -80.5 132.1 15.2 27.1 49.6 189 59 B N E >> -I 182 0G 32 -2,-0.3 4,-1.9 -7,-0.2 3,-0.9 -0.535 5.3-144.3 -82.4 137.6 16.5 23.7 48.5 190 60 B S T 34 S+ 0 0 2 -9,-1.7 13,-0.2 -2,-0.3 6,-0.2 0.553 87.4 80.0 -73.4 -11.1 15.8 22.0 45.2 191 61 B R T 34 S- 0 0 86 1,-0.1 12,-0.8 11,-0.1 -1,-0.2 0.858 119.3 -0.1 -66.9 -29.7 15.7 18.5 46.6 192 62 B W T <4 S+ 0 0 99 -3,-0.9 13,-3.0 10,-0.1 -2,-0.2 0.700 129.8 46.4-127.1 -33.0 12.1 19.0 47.8 193 63 B W S < S+ 0 0 26 -4,-1.9 13,-1.5 11,-0.3 15,-0.3 0.721 106.2 18.8 -96.6 -23.2 10.7 22.5 47.2 194 64 B g - 0 0 1 -5,-0.4 2,-0.6 9,-0.3 9,-0.1 -0.967 67.8-115.0-145.6 162.5 11.3 23.6 43.6 195 65 B N B +j 209 0H 58 13,-2.4 15,-1.9 -2,-0.3 16,-0.4 -0.879 33.4 159.4-105.2 120.1 12.2 22.1 40.2 196 66 B D - 0 0 36 -2,-0.6 -1,-0.1 13,-0.2 -6,-0.0 0.090 55.9-121.0-118.6 16.5 15.5 23.0 38.6 197 67 B G S S+ 0 0 67 1,-0.1 -2,-0.1 2,-0.1 5,-0.0 0.558 99.7 68.5 55.6 13.2 15.4 20.0 36.3 198 68 B R + 0 0 151 2,-0.1 -1,-0.1 -8,-0.1 -3,-0.0 0.308 68.7 104.1-140.5 8.0 18.7 18.7 37.6 199 69 B T S S- 0 0 8 -9,-0.1 3,-0.3 1,-0.1 -19,-0.1 -0.845 71.6-111.0-103.3 130.1 18.0 17.6 41.2 200 70 B P S S+ 0 0 69 0, 0.0 3,-0.4 0, 0.0 -2,-0.1 -0.054 100.7 23.9 -50.4 148.4 17.7 13.9 42.3 201 71 B G S S- 0 0 46 1,-0.2 2,-0.9 -9,-0.0 -2,-0.0 0.895 95.5-135.2 57.2 40.7 14.3 12.6 43.4 202 72 B S + 0 0 101 -3,-0.3 2,-0.3 2,-0.1 -1,-0.2 0.079 41.9 162.9 -28.6 69.7 12.8 15.5 41.4 203 73 B R - 0 0 144 -2,-0.9 -9,-0.3 -12,-0.8 3,-0.1 -0.769 21.3-176.1 -99.4 147.6 10.2 16.7 44.0 204 74 B N > + 0 0 47 -2,-0.3 3,-1.8 -11,-0.2 -11,-0.3 -0.549 11.6 166.0-141.3 67.4 8.6 20.1 43.6 205 75 B L T 3 S+ 0 0 67 -13,-3.0 -12,-0.2 1,-0.3 -11,-0.1 0.730 80.2 50.2 -59.5 -25.2 6.4 20.6 46.7 206 76 B h T 3 S- 0 0 17 -13,-1.5 -1,-0.3 2,-0.2 -12,-0.1 0.488 105.3-131.5 -92.0 -2.4 6.1 24.3 46.1 207 77 B N < + 0 0 96 -3,-1.8 -13,-0.1 1,-0.2 -2,-0.1 0.925 66.4 108.2 53.0 54.3 5.1 23.7 42.5 208 78 B I S S- 0 0 11 -15,-0.3 -13,-2.4 -91,-0.0 2,-0.2 -0.992 75.1-102.9-154.4 154.0 7.5 26.2 41.0 209 79 B P B > -j 195 0H 4 0, 0.0 3,-1.7 0, 0.0 4,-0.4 -0.572 35.9-122.6 -76.4 145.1 10.7 26.3 39.0 210 80 B g G > S+ 0 0 1 -15,-1.9 3,-1.7 1,-0.3 4,-0.2 0.790 108.8 71.2 -59.9 -24.5 13.6 27.2 41.3 211 81 B S G > S+ 0 0 61 -16,-0.4 3,-1.7 1,-0.3 -1,-0.3 0.802 85.8 66.2 -61.9 -27.1 14.4 30.2 39.0 212 82 B A G X S+ 0 0 9 -3,-1.7 3,-0.8 1,-0.3 9,-0.3 0.734 92.9 61.1 -66.2 -20.8 11.2 31.8 40.4 213 83 B L G < S+ 0 0 1 -3,-1.7 -28,-0.5 -4,-0.4 -1,-0.3 0.504 96.3 61.3 -83.0 -4.6 13.0 32.0 43.8 214 84 B L G < S+ 0 0 35 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.2 0.426 81.9 115.0 -99.4 -1.9 15.7 34.2 42.3 215 85 B S S < S- 0 0 41 -3,-0.8 6,-0.1 2,-0.2 -3,-0.0 -0.212 74.7-126.7 -70.2 158.2 13.3 37.0 41.3 216 86 B S S S+ 0 0 76 2,-0.0 2,-0.7 -45,-0.0 -1,-0.1 0.656 100.0 80.4 -75.2 -17.1 13.3 40.5 42.8 217 87 B D S S- 0 0 43 1,-0.1 3,-0.5 -5,-0.1 4,-0.3 -0.837 72.2-160.6 -90.7 115.4 9.6 39.8 43.5 218 88 B I > + 0 0 6 -2,-0.7 4,-2.8 1,-0.2 5,-0.2 0.360 61.1 105.4 -82.8 8.2 9.6 37.7 46.7 219 89 B T H > S+ 0 0 11 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.912 81.4 45.2 -53.9 -49.5 6.2 36.2 46.3 220 90 B A H > S+ 0 0 4 -3,-0.5 4,-2.3 -8,-0.3 5,-0.2 0.917 114.5 49.0 -61.7 -44.6 7.3 32.7 45.3 221 91 B S H > S+ 0 0 6 -9,-0.3 4,-2.4 -4,-0.3 -1,-0.2 0.905 114.4 45.6 -61.9 -43.0 9.9 32.6 48.1 222 92 B V H X S+ 0 0 2 -4,-2.8 4,-1.6 2,-0.2 -2,-0.2 0.925 113.3 48.0 -68.1 -45.5 7.4 33.7 50.7 223 93 B N H X S+ 0 0 75 -4,-2.9 4,-0.9 -5,-0.2 -2,-0.2 0.893 115.2 46.1 -64.0 -36.8 4.6 31.4 49.5 224 94 B h H >X S+ 0 0 2 -4,-2.3 4,-2.2 -5,-0.2 3,-0.9 0.921 107.6 56.0 -71.0 -43.0 7.1 28.5 49.5 225 95 B A H 3X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.3 -1,-0.2 0.831 101.2 60.3 -58.2 -31.7 8.5 29.3 52.9 226 96 B K H 3< S+ 0 0 46 -4,-1.6 4,-0.4 1,-0.2 -1,-0.3 0.866 107.0 44.8 -64.8 -34.7 5.0 29.1 54.2 227 97 B K H << S+ 0 0 103 -4,-0.9 3,-0.5 -3,-0.9 4,-0.2 0.904 113.6 51.0 -74.9 -39.8 4.8 25.5 53.2 228 98 B I H >< S+ 0 0 9 -4,-2.2 3,-2.2 1,-0.2 5,-0.4 0.948 107.6 49.6 -61.6 -52.7 8.3 24.7 54.5 229 99 B V T 3< S+ 0 0 3 -4,-2.7 5,-0.4 1,-0.3 3,-0.3 0.636 110.7 53.3 -64.4 -12.9 7.8 26.2 58.0 230 100 B S T 3 S+ 0 0 41 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.2 0.433 84.0 92.7 -98.1 -2.4 4.5 24.1 58.2 231 101 B D S < S- 0 0 109 -3,-2.2 -1,-0.2 -4,-0.2 -2,-0.1 0.389 109.9 -88.8 -75.6 2.0 6.4 20.9 57.3 232 102 B G S S+ 0 0 72 -3,-0.3 -3,-0.1 -4,-0.1 -2,-0.1 0.385 113.9 71.4 111.3 -5.9 7.0 19.9 60.9 233 103 B N S > S- 0 0 94 -5,-0.4 3,-1.9 1,-0.3 4,-0.2 0.226 80.0-147.8-125.7 12.4 10.4 21.5 61.9 234 104 B G G > - 0 0 14 -5,-0.4 3,-0.9 1,-0.3 -1,-0.3 -0.221 68.2 -26.1 54.9-142.0 9.3 25.1 62.1 235 105 B M G > S+ 0 0 0 1,-0.2 3,-1.9 2,-0.1 -1,-0.3 0.412 117.6 93.4 -84.0 3.1 12.0 27.5 61.2 236 106 B N G < + 0 0 37 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.596 67.0 80.4 -69.5 -7.1 14.7 25.0 62.2 237 107 B A G < S+ 0 0 49 -3,-0.9 2,-0.7 -4,-0.2 -1,-0.3 0.667 81.5 73.0 -71.7 -15.7 14.5 24.1 58.5 238 108 B W <> - 0 0 7 -3,-1.9 4,-1.9 1,-0.2 3,-0.4 -0.888 69.9-163.1-104.5 107.0 16.8 27.1 57.9 239 109 B V H > S+ 0 0 73 -2,-0.7 4,-2.0 1,-0.2 5,-0.2 0.882 89.7 52.5 -54.4 -46.4 20.3 26.4 59.1 240 110 B A H > S+ 0 0 15 1,-0.2 4,-2.3 2,-0.2 5,-0.4 0.846 108.0 52.8 -61.2 -34.9 21.4 30.0 59.3 241 111 B W H >>S+ 0 0 14 -3,-0.4 5,-2.9 2,-0.2 4,-2.1 0.917 108.8 49.4 -66.6 -43.3 18.3 30.8 61.4 242 112 B R H <5S+ 0 0 98 -4,-1.9 -2,-0.2 -7,-0.2 -1,-0.2 0.855 118.2 40.1 -63.0 -37.3 19.2 28.0 63.9 243 113 B N H <5S+ 0 0 117 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.766 132.5 17.6 -84.8 -28.4 22.8 29.3 64.1 244 114 B R H <5S+ 0 0 158 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.603 130.4 31.2-121.1 -16.7 22.3 33.0 64.2 245 115 B f T ><5S+ 0 0 0 -4,-2.1 3,-2.1 -5,-0.4 -3,-0.2 0.787 84.9 96.5-112.6 -44.5 18.7 33.8 65.1 246 116 B K T 3 + 0 0 111 -2,-0.2 3,-1.8 1,-0.2 4,-0.1 -0.689 44.0 179.6 -88.2 87.1 15.8 38.9 70.4 250 120 B V G > + 0 0 14 -2,-1.6 3,-2.3 1,-0.3 4,-0.2 0.664 68.0 80.7 -63.6 -17.9 14.8 38.8 66.8 251 121 B Q G > S+ 0 0 110 1,-0.3 3,-1.9 2,-0.2 -1,-0.3 0.774 77.0 75.7 -60.2 -22.7 12.6 41.9 67.2 252 122 B A G X S+ 0 0 32 -3,-1.8 3,-1.1 1,-0.3 -1,-0.3 0.781 82.8 67.0 -59.2 -25.8 15.9 43.8 66.9 253 123 B W G < S+ 0 0 56 -3,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.652 103.9 41.2 -73.0 -14.4 15.7 43.1 63.2 254 124 B I G X> S+ 0 0 33 -3,-1.9 3,-2.0 -4,-0.2 4,-0.7 0.233 84.8 135.4-113.1 13.0 12.7 45.3 62.7 255 125 B R T <4 S+ 0 0 176 -3,-1.1 -119,-0.1 1,-0.3 -3,-0.1 -0.396 75.6 13.2 -62.0 130.4 14.0 48.0 65.0 256 126 B G T 34 S+ 0 0 66 -2,-0.1 -1,-0.3 -120,-0.0 -4,-0.0 0.342 102.2 97.7 85.2 -7.7 13.6 51.4 63.5 257 127 B e T <4 - 0 0 18 -3,-2.0 -2,-0.2 -122,-0.0 -1,-0.0 0.841 58.1-172.5 -80.1 -34.7 11.2 50.1 60.8 258 128 B R < 0 0 238 -4,-0.7 -3,-0.1 1,-0.1 -122,-0.0 0.899 360.0 360.0 37.5 65.1 8.1 51.1 62.8 259 129 B L 0 0 118 -5,-0.2 -1,-0.1 -120,-0.0 -123,-0.0 0.893 360.0 360.0 -81.0 360.0 5.8 49.3 60.3