==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-APR-99 1CKG . COMPND 2 MOLECULE: PROTEIN (LYSOZYME); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.TAKANO,Y.YAMAGATA,J.FUNAHASHI,K.YUTANI . 260 2 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12815.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 176 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 2 0.8 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 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 20.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 24.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 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 2 0 0 0 4 1 1 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 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 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 69 0, 0.0 39,-2.7 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 139.7 11.6 38.3 19.0 2 2 A V B -A 39 0A 100 37,-0.2 37,-0.2 38,-0.1 36,-0.1 -0.951 360.0-149.3-107.2 104.9 13.4 35.1 19.6 3 3 A F - 0 0 10 35,-1.8 2,-0.4 -2,-0.7 3,-0.1 -0.373 18.0-116.1 -67.5 153.6 10.7 32.5 20.5 4 4 A E >> - 0 0 90 1,-0.1 4,-2.1 -2,-0.1 3,-0.6 -0.773 35.9-105.8 -89.1 146.1 11.8 29.7 22.8 5 5 A R H >> S+ 0 0 81 -2,-0.4 4,-2.1 1,-0.3 3,-0.6 0.879 117.5 39.4 -36.5 -65.9 11.6 26.3 21.0 6 6 A a H 3> S+ 0 0 9 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.807 112.2 58.2 -61.2 -29.5 8.5 25.0 22.7 7 7 A E H <> S+ 0 0 67 -3,-0.6 4,-1.3 2,-0.2 -1,-0.2 0.862 108.7 44.7 -68.5 -38.0 6.7 28.4 22.6 8 8 A L H S+ 0 0 0 -4,-3.0 5,-2.7 1,-0.2 6,-0.3 0.830 114.2 51.6 -62.0 -31.7 2.5 27.4 15.0 13 13 A K H ><5S+ 0 0 79 -4,-1.4 3,-1.5 -5,-0.3 -1,-0.2 0.914 110.0 48.2 -68.3 -44.0 0.2 24.5 16.1 14 14 A R H 3<5S+ 0 0 180 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.807 106.6 58.0 -64.5 -31.2 -2.4 26.9 17.3 15 15 A L T 3<5S- 0 0 54 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.293 122.2-106.8 -85.4 10.7 -2.1 28.7 14.0 16 16 A G T < 5S+ 0 0 40 -3,-1.5 -3,-0.2 -5,-0.1 -2,-0.1 0.668 78.4 131.9 75.3 23.7 -3.0 25.6 12.1 17 17 A M > < + 0 0 0 -5,-2.7 3,-2.0 -6,-0.1 2,-0.5 0.744 36.2 100.1 -77.8 -28.5 0.5 24.7 10.8 18 18 A D T 3 S- 0 0 80 -6,-0.3 6,-0.2 1,-0.3 3,-0.1 -0.491 103.5 -0.2 -67.3 115.2 0.7 21.0 11.7 19 19 A G T > S+ 0 0 46 4,-2.7 3,-1.6 -2,-0.5 2,-0.5 0.622 88.2 160.7 82.9 14.7 -0.1 19.0 8.6 20 20 A Y B X S-B 23 0B 35 -3,-2.0 3,-1.9 3,-1.0 -1,-0.3 -0.590 81.2 -12.9 -72.7 117.6 -0.7 22.0 6.5 21 21 A R T 3 S- 0 0 163 -2,-0.5 -1,-0.3 1,-0.3 3,-0.1 0.786 132.8 -56.2 60.9 26.3 -0.3 20.9 2.9 22 22 A G T < S+ 0 0 72 -3,-1.6 2,-0.5 1,-0.3 -1,-0.3 0.530 106.2 134.8 82.8 8.1 1.1 17.7 4.3 23 23 A I B < -B 20 0B 14 -3,-1.9 -4,-2.7 -6,-0.1 -3,-1.0 -0.785 49.3-135.3 -93.7 124.5 3.9 19.5 6.2 24 24 A S >> - 0 0 42 -2,-0.5 4,-1.7 -6,-0.2 3,-0.9 -0.375 18.9-117.0 -78.1 159.9 4.4 18.5 9.8 25 25 A L H 3> S+ 0 0 6 1,-0.3 4,-2.1 2,-0.2 5,-0.1 0.816 116.1 59.3 -61.9 -32.4 4.9 20.9 12.7 26 26 A A H 3> S+ 0 0 12 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.756 105.0 48.6 -69.7 -25.9 8.4 19.4 13.2 27 27 A N H <> S+ 0 0 31 -3,-0.9 4,-2.2 2,-0.2 -2,-0.2 0.867 108.7 51.6 -80.9 -37.6 9.4 20.4 9.6 28 28 A W H X S+ 0 0 0 -4,-1.7 4,-2.8 1,-0.2 -2,-0.2 0.936 112.9 47.7 -61.0 -43.5 8.0 24.0 10.0 29 29 A M H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.801 109.1 51.8 -66.6 -37.3 10.1 24.2 13.1 30 30 A b H X S+ 0 0 0 -4,-1.1 4,-1.6 2,-0.2 -1,-0.2 0.870 111.1 49.2 -68.3 -36.8 13.2 22.8 11.4 31 31 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 5,-0.3 0.955 111.8 47.6 -64.8 -54.1 12.7 25.4 8.7 32 32 A A H X>S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 6,-1.3 0.902 110.0 53.5 -53.8 -43.9 12.4 28.3 11.3 33 33 A K H <5S+ 0 0 100 -4,-2.3 4,-0.4 4,-0.2 -1,-0.2 0.877 116.8 36.3 -61.8 -38.6 15.5 27.1 13.2 34 34 A W H <5S+ 0 0 110 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.691 118.6 49.4 -88.7 -23.4 17.7 27.1 10.1 35 35 A E H <5S- 0 0 43 -4,-2.2 -2,-0.2 21,-0.2 -3,-0.2 0.906 138.8 -11.4 -80.6 -44.2 16.2 30.2 8.4 36 36 A S T ><5S- 0 0 19 -4,-2.4 3,-0.8 20,-0.3 -3,-0.2 0.477 82.1-110.3-137.8 -7.9 16.3 32.5 11.4 37 37 A G T 3 > -C 51 0C 46 5,-3.5 5,-1.1 -2,-0.5 4,-1.0 -0.866 8.7-175.7-109.6 95.8 20.4 39.1 -1.8 47 47 A A T 45S+ 0 0 38 -2,-0.8 -1,-0.2 1,-0.2 5,-0.0 0.768 74.0 68.2 -61.4 -29.7 22.8 41.4 -3.8 48 48 A G T 45S+ 0 0 72 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.909 122.6 11.5 -59.6 -45.6 22.2 39.5 -7.1 49 49 A D T 45S- 0 0 48 -3,-0.5 -1,-0.2 2,-0.1 -2,-0.2 0.264 103.0-115.0-117.9 11.1 18.6 40.6 -7.4 50 50 A R T <5 + 0 0 118 -4,-1.0 2,-0.2 1,-0.2 -3,-0.2 0.697 68.5 137.8 64.9 22.7 18.4 43.3 -4.7 51 51 A S E < -C 46 0C 0 -5,-1.1 -5,-3.5 19,-0.1 2,-0.4 -0.570 41.2-147.3 -97.6 164.4 15.9 41.4 -2.6 52 52 A V E -C 45 0C 1 -7,-0.2 9,-2.3 -2,-0.2 2,-0.5 -0.970 10.1-134.8-131.1 143.0 15.8 40.9 1.2 53 53 A D E -CD 44 60C 24 -9,-2.6 -9,-1.1 -2,-0.4 2,-0.4 -0.885 27.5-156.6-100.4 128.8 14.6 38.0 3.2 54 54 A Y E > -CD 43 59C 8 5,-2.8 5,-2.4 -2,-0.5 3,-0.3 -0.884 31.2 -21.8-115.8 141.0 12.4 38.8 6.2 55 55 A G T > 5S- 0 0 1 -13,-2.0 3,-1.2 -2,-0.4 -16,-0.1 -0.120 95.6 -30.0 77.5-169.3 11.4 37.2 9.4 56 56 A I T 3 5S+ 0 0 1 28,-0.3 -20,-0.3 1,-0.3 -18,-0.3 0.854 140.9 34.8 -57.3 -39.8 11.2 33.8 11.1 57 57 A F T 3 5S- 0 0 1 -3,-0.3 -1,-0.3 27,-0.1 -2,-0.2 0.287 107.9-124.7 -98.6 5.3 10.6 32.0 7.8 58 58 A Q T < 5 - 0 0 17 -3,-1.2 2,-0.4 1,-0.2 -3,-0.2 0.930 33.8-166.2 47.5 61.7 12.8 34.4 5.7 59 59 A I E < -D 54 0C 3 -5,-2.4 -5,-2.8 25,-0.1 2,-0.3 -0.632 17.5-120.8 -81.1 129.7 10.2 35.4 3.2 60 60 A N E >>> -D 53 0C 19 -2,-0.4 4,-2.2 -7,-0.2 5,-1.0 -0.581 3.9-144.0 -79.1 134.8 11.6 37.1 0.1 61 61 A S T 345S+ 0 0 0 -9,-2.3 6,-0.3 -2,-0.3 9,-0.2 0.572 93.9 69.5 -67.4 -16.3 10.6 40.7 -1.0 62 62 A R T 345S+ 0 0 73 11,-0.2 12,-2.2 -10,-0.2 -1,-0.2 0.847 120.8 4.5 -74.4 -33.5 10.9 39.8 -4.7 63 63 A Y T <45S+ 0 0 106 -3,-0.8 13,-1.7 10,-0.2 -2,-0.2 0.679 134.1 34.7-123.7 -27.5 7.9 37.4 -4.8 64 64 A W T <5S+ 0 0 31 -4,-2.2 13,-2.0 11,-0.2 14,-0.4 0.867 110.7 23.3-103.9 -46.0 6.1 37.4 -1.5 65 65 A c < - 0 0 0 -5,-1.0 2,-0.5 12,-0.1 -1,-0.2 -0.882 68.8-120.2-125.0 159.6 6.0 40.7 0.3 66 66 A N B +e 80 0D 65 13,-2.2 15,-2.0 -2,-0.3 16,-0.4 -0.862 33.0 161.2-100.2 120.9 6.4 44.4 -0.7 67 67 A D - 0 0 16 -2,-0.5 -1,-0.1 -6,-0.3 13,-0.1 0.273 51.8-126.6-114.9 7.4 9.3 46.4 0.7 68 68 A G S S+ 0 0 63 -7,-0.2 -2,-0.1 2,-0.1 135,-0.0 0.424 95.4 76.5 63.5 1.9 9.0 49.0 -2.0 69 69 A K + 0 0 30 134,-0.1 -1,-0.1 2,-0.1 -3,-0.0 0.227 67.0 94.3-125.6 14.5 12.7 48.6 -2.9 70 70 A T S > S- 0 0 9 -9,-0.2 3,-1.5 -18,-0.0 -2,-0.1 -0.928 70.9-128.8-114.4 117.9 12.9 45.3 -4.8 71 71 A P T 3 S+ 0 0 76 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.210 92.4 16.6 -59.4 150.8 12.8 45.4 -8.6 72 72 A G T 3 S+ 0 0 65 1,-0.2 -10,-0.0 -9,-0.0 0, 0.0 0.570 91.1 176.3 62.1 10.7 10.3 43.1 -10.3 73 73 A A < - 0 0 44 -3,-1.5 2,-0.3 2,-0.0 -10,-0.2 -0.153 16.5-168.4 -54.2 126.1 8.6 42.8 -6.9 74 74 A V - 0 0 79 -12,-2.2 3,-0.2 -9,-0.2 -9,-0.0 -0.814 11.6-153.1-107.8 154.2 5.4 40.7 -6.8 75 75 A N > + 0 0 43 -2,-0.3 3,-1.4 1,-0.1 -11,-0.2 -0.394 32.5 154.3-128.0 57.0 3.3 40.9 -3.6 76 76 A A T 3 S+ 0 0 24 -13,-1.7 -12,-0.2 1,-0.3 -1,-0.1 0.802 79.2 49.1 -53.9 -32.8 1.6 37.5 -3.7 77 77 A d T 3 S- 0 0 22 -13,-2.0 -1,-0.3 -14,-0.2 -12,-0.1 0.685 102.4-141.1 -81.3 -15.3 1.2 37.6 0.1 78 78 A H < + 0 0 156 -3,-1.4 2,-0.3 -14,-0.4 -13,-0.1 0.965 60.3 108.5 53.5 56.3 -0.2 41.2 -0.3 79 79 A L S S- 0 0 22 -15,-0.3 -13,-2.2 16,-0.0 -1,-0.2 -0.985 74.8-101.3-155.2 151.2 1.5 42.5 2.8 80 80 A S B > -e 66 0D 65 -2,-0.3 3,-0.8 -15,-0.2 4,-0.2 -0.537 31.4-126.6 -71.1 148.1 4.4 44.9 3.6 81 81 A c G > S+ 0 0 1 -15,-2.0 3,-1.7 1,-0.2 -14,-0.1 0.774 107.4 68.6 -66.9 -25.5 7.6 43.0 4.5 82 82 A S G > S+ 0 0 72 -16,-0.4 3,-2.1 1,-0.3 -1,-0.2 0.835 88.1 65.6 -62.1 -32.8 7.8 45.0 7.7 83 83 A A G X S+ 0 0 24 -3,-0.8 3,-0.6 1,-0.3 -1,-0.3 0.682 95.6 58.6 -62.0 -18.6 4.8 43.1 8.9 84 84 A L G < S+ 0 0 5 -3,-1.7 -28,-0.3 -4,-0.2 -1,-0.3 0.229 95.8 63.1 -94.7 8.6 7.0 40.0 8.9 85 85 A L G < S+ 0 0 40 -3,-2.1 -1,-0.2 -30,-0.1 2,-0.2 0.174 83.4 107.9-114.4 15.1 9.4 41.6 11.3 86 86 A Q S < S- 0 0 107 -3,-0.6 6,-0.1 2,-0.3 -3,-0.0 -0.520 77.5-121.8 -93.4 158.0 6.9 41.8 14.1 87 87 A D S S+ 0 0 75 -2,-0.2 2,-0.7 2,-0.1 -1,-0.1 0.798 100.9 75.5 -66.8 -33.4 6.6 39.7 17.4 88 88 A N - 0 0 113 1,-0.1 3,-0.3 -5,-0.1 -2,-0.3 -0.797 67.4-170.3 -82.3 116.1 3.2 38.6 16.3 89 89 A I > + 0 0 6 -2,-0.7 4,-2.8 1,-0.2 5,-0.2 0.247 53.8 108.0 -93.0 9.7 3.8 36.0 13.6 90 90 A A H > S+ 0 0 41 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.947 84.0 45.2 -53.2 -51.3 0.1 35.6 12.4 91 91 A D H > S+ 0 0 82 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.866 112.2 51.9 -59.3 -42.3 0.9 37.5 9.2 92 92 A A H > S+ 0 0 4 -9,-0.3 4,-2.9 -4,-0.2 -1,-0.2 0.911 109.7 49.2 -62.6 -43.7 4.1 35.5 8.6 93 93 A V H X S+ 0 0 5 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.937 110.2 50.8 -61.9 -43.5 2.3 32.2 9.1 94 94 A A H < S+ 0 0 54 -4,-2.4 4,-0.5 -5,-0.2 -1,-0.2 0.855 114.0 45.2 -62.8 -34.1 -0.4 33.3 6.6 95 95 A d H >X S+ 0 0 2 -4,-1.8 4,-2.4 2,-0.2 3,-0.6 0.880 110.7 52.4 -77.3 -35.8 2.3 34.2 4.1 96 96 A A H 3X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.3 -2,-0.2 0.886 106.6 54.9 -65.1 -37.6 4.2 31.0 4.7 97 97 A K H 3< S+ 0 0 48 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.695 108.8 48.8 -65.6 -25.0 1.0 29.1 4.0 98 98 A R H X> S+ 0 0 74 -3,-0.6 3,-2.0 -4,-0.5 4,-0.5 0.899 105.8 56.6 -79.7 -45.4 0.8 30.9 0.7 99 99 A V H >< S+ 0 0 3 -4,-2.4 3,-1.9 1,-0.3 6,-0.4 0.920 105.7 49.8 -50.9 -52.8 4.4 30.1 -0.2 100 100 A V T 3< S+ 0 0 6 -4,-1.9 -1,-0.3 1,-0.3 6,-0.2 0.377 96.3 71.7 -72.5 3.1 3.9 26.3 0.1 101 101 A R T <4 S+ 0 0 125 -3,-2.0 -1,-0.3 4,-0.1 -2,-0.2 0.633 79.0 95.6 -87.8 -19.1 0.8 26.5 -2.1 102 102 A D S X< S- 0 0 59 -3,-1.9 3,-1.8 -4,-0.5 6,-0.1 -0.374 99.3-102.5 -67.1 152.1 3.1 27.2 -5.1 103 103 A P T 3 S+ 0 0 140 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.286 121.8 60.7 -61.8 12.9 4.0 24.0 -7.1 104 104 A Q T > S- 0 0 94 -5,-0.3 3,-0.9 1,-0.1 -4,-0.1 0.645 86.0-174.1-107.4 -31.3 7.4 24.1 -5.3 105 105 A G G X - 0 0 18 -3,-1.8 3,-1.6 -6,-0.4 -4,-0.1 -0.310 59.9 -22.6 70.8-152.7 6.0 23.7 -1.8 106 106 A I G > S+ 0 0 15 1,-0.3 3,-1.7 -6,-0.2 -1,-0.2 0.676 125.9 78.4 -68.0 -13.1 8.2 23.9 1.3 107 107 A R G < + 0 0 120 -3,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.467 68.8 89.2 -71.9 -2.7 11.2 23.0 -0.9 108 108 A A G < S+ 0 0 41 -3,-1.6 2,-0.6 -6,-0.1 -1,-0.3 0.821 76.7 72.4 -61.5 -32.5 11.0 26.6 -1.9 109 109 A W S <> S- 0 0 19 -3,-1.7 4,-1.3 1,-0.2 3,-0.2 -0.798 73.4-158.7 -90.2 122.1 13.3 27.1 1.0 110 110 A V H > S+ 0 0 77 -2,-0.6 4,-2.1 1,-0.2 5,-0.2 0.902 89.4 56.3 -64.4 -47.3 16.8 25.9 0.1 111 111 A A H > S+ 0 0 26 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.770 102.6 57.6 -59.6 -26.9 18.0 25.5 3.7 112 112 A W H >>S+ 0 0 24 2,-0.2 4,-3.1 -6,-0.2 5,-2.1 0.968 106.6 48.0 -67.4 -48.4 15.0 23.2 4.4 113 113 A R H <5S+ 0 0 84 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.892 118.2 42.2 -56.8 -40.9 16.2 20.9 1.6 114 114 A N H <5S+ 0 0 98 -4,-2.1 -1,-0.2 1,-0.1 -2,-0.2 0.738 129.3 22.3 -80.2 -26.1 19.7 21.0 3.0 115 115 A R H <5S+ 0 0 129 -4,-2.2 -3,-0.2 -3,-0.2 -2,-0.2 0.620 131.7 24.9-118.3 -16.8 19.0 20.6 6.7 116 116 A b T ><5S+ 0 0 1 -4,-3.1 3,-2.1 -5,-0.3 -3,-0.2 0.741 84.0 104.4-118.5 -40.2 15.6 19.1 7.2 117 117 A Q T 3 + 0 0 18 -2,-0.6 3,-0.8 1,-0.1 4,-0.3 0.185 42.6 106.3-122.8 20.1 13.3 16.4 12.9 122 122 A R G > + 0 0 150 1,-0.2 3,-1.3 2,-0.2 4,-0.5 0.756 67.6 70.2 -70.6 -26.7 11.6 15.1 16.1 123 123 A Q G > S+ 0 0 115 1,-0.3 3,-0.5 2,-0.2 -1,-0.2 0.790 87.9 66.5 -60.0 -31.0 14.0 17.2 18.3 124 124 A Y G < S+ 0 0 16 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.713 115.4 25.5 -65.3 -21.5 12.3 20.4 17.1 125 125 A V G X S+ 0 0 27 -3,-1.3 3,-1.0 -4,-0.3 5,-0.4 0.269 84.4 139.9-127.6 8.7 9.1 19.4 18.9 126 126 A Q T < S- 0 0 112 -3,-0.5 -120,-0.1 -4,-0.5 -3,-0.1 -0.395 80.1 -8.2 -63.5 117.4 10.3 17.1 21.7 127 127 A G T 3 S+ 0 0 73 -2,-0.3 -1,-0.2 3,-0.1 -121,-0.1 0.904 92.8 118.6 65.5 49.3 8.4 17.7 24.9 128 128 A a S < S- 0 0 5 -3,-1.0 -2,-0.1 2,-0.2 -1,-0.1 0.365 81.8-113.2-118.9 -5.1 6.4 20.8 24.0 129 129 A G 0 0 81 1,-0.3 -3,-0.1 -4,-0.2 -4,-0.0 0.864 360.0 360.0 73.6 37.5 2.9 19.3 24.4 130 130 A V 0 0 66 -5,-0.4 -1,-0.3 -117,-0.0 -2,-0.2 -0.844 360.0 360.0-125.4 360.0 2.0 19.5 20.7 131 !* 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 0.0 132 1 B K 0 0 82 0, 0.0 39,-2.7 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 129.5 39.1 62.9 7.1 133 2 B V B -F 170 0E 97 37,-0.2 37,-0.2 38,-0.1 2,-0.1 -0.941 360.0-148.6-101.6 111.6 41.0 62.0 4.0 134 3 B F - 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0 0 35 -3,-1.5 2,-0.4 1,-0.1 -1,-0.2 -0.088 21.5-166.1 -52.1 135.0 15.3 50.7 5.5 205 74 B V - 0 0 13 -12,-1.5 2,-0.7 -9,-0.2 3,-0.2 -0.970 9.8-153.6-119.7 128.8 16.8 47.6 7.1 206 75 B N > + 0 0 53 -2,-0.4 3,-1.7 1,-0.2 -11,-0.2 -0.574 24.6 166.5-113.3 70.9 19.7 48.7 9.3 207 76 B A T 3 S+ 0 0 15 -13,-2.7 -12,-0.2 -2,-0.7 -1,-0.2 0.680 75.8 50.8 -56.6 -26.2 21.7 45.5 9.3 208 77 B h T 3 S- 0 0 22 -13,-2.4 -1,-0.3 -14,-0.2 -12,-0.1 0.570 106.7-126.7 -92.0 -5.7 24.8 47.2 10.8 209 78 B H < + 0 0 162 -3,-1.7 2,-0.3 -14,-0.3 -2,-0.1 0.997 69.6 97.7 58.1 63.1 22.8 48.7 13.7 210 79 B L S S- 0 0 27 -15,-0.2 -13,-2.3 -4,-0.1 -1,-0.2 -0.930 76.4 -98.2-173.5 153.1 23.8 52.3 13.2 211 80 B S B > -j 197 0H 57 -2,-0.3 3,-1.4 -15,-0.2 4,-0.4 -0.519 36.8-122.3 -72.1 145.5 23.0 55.7 11.7 212 81 B g G > S+ 0 0 0 -15,-3.2 3,-1.5 1,-0.3 -14,-0.2 0.815 109.5 70.0 -61.7 -24.4 24.6 56.3 8.3 213 82 B S G > S+ 0 0 60 -16,-0.4 3,-1.7 1,-0.3 -1,-0.3 0.772 86.9 63.2 -62.6 -31.2 26.2 59.4 9.9 214 83 B A G X S+ 0 0 25 -3,-1.4 3,-0.7 1,-0.3 -1,-0.3 0.743 96.0 61.4 -67.7 -18.5 28.4 57.3 12.1 215 84 B L G < S+ 0 0 6 -3,-1.5 -28,-0.3 -4,-0.4 -1,-0.3 0.329 97.2 58.6 -89.7 8.3 30.0 56.1 8.8 216 85 B L G < S+ 0 0 31 -3,-1.7 -1,-0.2 -30,-0.1 -2,-0.2 0.385 84.0 110.3-115.3 3.9 31.1 59.7 8.0 217 86 B Q S < S- 0 0 95 -3,-0.7 6,-0.1 -4,-0.2 -3,-0.0 -0.217 78.0-116.4 -78.9 165.4 33.2 60.2 11.1 218 87 B D S S+ 0 0 90 1,-0.1 2,-0.7 2,-0.1 -1,-0.1 0.760 101.9 73.7 -71.3 -28.8 37.0 60.5 11.4 219 88 B N - 0 0 108 1,-0.1 3,-0.4 -5,-0.1 4,-0.2 -0.829 68.7-164.6 -88.3 113.9 37.2 57.3 13.5 220 89 B I > + 0 0 5 -2,-0.7 4,-2.6 1,-0.2 5,-0.2 0.247 55.7 110.3 -87.8 19.8 36.5 54.4 11.2 221 90 B A H > S+ 0 0 37 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.940 83.6 39.6 -60.2 -50.9 35.8 51.8 13.8 222 91 B D H > S+ 0 0 77 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.761 113.7 54.8 -68.7 -29.6 32.1 51.5 13.0 223 92 B A H > S+ 0 0 7 -4,-0.2 4,-2.2 -9,-0.2 -1,-0.2 0.893 110.7 47.6 -68.2 -39.4 32.7 51.7 9.3 224 93 B V H X S+ 0 0 3 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.933 111.1 49.4 -65.8 -48.4 35.2 48.8 9.7 225 94 B A H X S+ 0 0 52 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.930 113.6 46.8 -58.0 -45.9 32.7 46.8 11.8 226 95 B h H X S+ 0 0 3 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.872 110.6 52.1 -65.2 -37.9 30.0 47.4 9.2 227 96 B A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.915 106.4 53.9 -65.5 -41.2 32.3 46.5 6.3 228 97 B K H < S+ 0 0 47 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.900 108.3 51.0 -58.4 -40.8 33.2 43.2 8.1 229 98 B R H >< S+ 0 0 49 -4,-1.8 3,-2.2 1,-0.2 4,-0.4 0.959 106.6 53.3 -62.2 -50.7 29.5 42.4 8.2 230 99 B V H >< S+ 0 0 8 -4,-2.2 3,-1.5 1,-0.3 6,-0.2 0.898 107.7 50.8 -52.4 -45.2 28.9 43.1 4.5 231 100 B V T 3< S+ 0 0 1 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.418 88.2 80.5 -78.8 5.9 31.7 40.7 3.5 232 101 B R T < S+ 0 0 139 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.683 76.4 95.5 -80.7 -14.3 30.2 37.9 5.6 233 102 B D S X S- 0 0 28 -3,-1.5 3,-1.4 -4,-0.4 6,-0.1 -0.284 97.0 -99.7 -69.0 158.5 27.9 37.5 2.7 234 103 B P T 3 S+ 0 0 137 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.861 118.6 47.9 -47.4 -52.1 28.9 34.7 0.1 235 104 B Q T > S- 0 0 99 1,-0.2 3,-1.5 2,-0.1 2,-0.1 0.575 90.4-167.2 -72.4 -8.0 30.4 36.9 -2.6 236 105 B G G X - 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