==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 08-FEB-08 3C83 . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTERIOPHAGE T4; . AUTHOR B.H.M.MOOERS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8802.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 7 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 52.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 1 1 0 1 2 0 0 1 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 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 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 M 0 0 72 0, 0.0 2,-0.3 0, 0.0 161,-0.0 0.000 360.0 360.0 360.0 147.1 43.5 -2.0 9.0 2 2 A N > - 0 0 68 95,-0.0 4,-2.6 1,-0.0 5,-0.2 -0.893 360.0 -87.4-145.0 172.5 40.5 -0.8 10.9 3 3 A I H > S+ 0 0 21 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.811 123.6 50.6 -53.6 -36.0 38.3 2.3 11.4 4 4 A F H > S+ 0 0 75 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.932 112.7 44.6 -70.3 -43.6 40.5 3.7 14.2 5 5 A E H > S+ 0 0 95 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.864 113.5 53.1 -66.3 -36.7 43.7 3.3 12.2 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.950 114.0 39.2 -65.8 -50.5 42.0 4.7 9.2 7 7 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 5,-0.4 0.800 109.3 61.7 -71.2 -27.7 40.7 7.9 10.9 8 8 A R H X S+ 0 0 109 -4,-2.0 4,-1.8 -5,-0.2 -1,-0.2 0.897 108.2 44.8 -64.5 -35.0 43.9 8.2 12.8 9 9 A I H < S+ 0 0 55 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.933 116.3 45.3 -72.9 -44.9 45.7 8.6 9.5 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.793 125.0 30.3 -69.6 -29.2 43.2 11.0 8.1 11 11 A E H < S- 0 0 46 -4,-2.5 19,-0.3 -5,-0.1 -1,-0.2 0.706 90.0-154.2-103.0 -25.1 42.9 13.2 11.1 12 12 A G < - 0 0 24 -4,-1.8 2,-0.4 -5,-0.4 -1,-0.1 -0.218 25.5 -89.3 74.4-172.0 46.3 13.0 12.8 13 13 A L + 0 0 42 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.976 40.3 174.1-142.5 125.7 46.7 13.6 16.5 14 14 A R E -A 28 0A 139 14,-1.4 14,-2.4 -2,-0.4 4,-0.1 -0.999 18.7-161.2-134.0 127.6 47.3 17.0 18.2 15 15 A L E S+ 0 0 65 -2,-0.4 43,-2.3 12,-0.2 2,-0.3 0.448 76.0 64.3 -87.7 -1.7 47.4 17.4 22.0 16 16 A K E S-C 57 0B 126 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.924 100.6 -88.9-122.0 147.1 46.9 21.2 21.8 17 17 A I E + 0 0 26 39,-1.8 2,-0.3 -2,-0.3 10,-0.2 -0.212 57.6 169.6 -51.0 140.7 43.8 23.1 20.5 18 18 A Y E -A 26 0A 24 8,-2.8 8,-2.8 -4,-0.1 2,-0.5 -0.916 36.7-101.9-147.5 171.5 44.3 23.8 16.8 19 19 A K E -A 25 0A 128 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.865 35.4-140.0-102.0 131.8 42.2 25.0 13.8 20 20 A D > - 0 0 48 4,-2.7 3,-2.2 -2,-0.5 -1,-0.0 -0.109 41.5 -78.6 -77.7-174.8 41.0 22.4 11.4 21 21 A T T 3 S+ 0 0 123 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.721 135.4 48.5 -55.8 -27.1 40.9 22.7 7.6 22 22 A E T 3 S- 0 0 100 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.394 123.5-104.6 -94.1 0.3 37.8 24.9 7.9 23 23 A G S < S+ 0 0 35 -3,-2.2 2,-0.3 1,-0.3 -2,-0.1 0.580 74.2 140.9 87.7 12.3 39.4 27.1 10.6 24 24 A Y - 0 0 62 1,-0.1 -4,-2.7 -5,-0.0 -1,-0.3 -0.700 60.0-101.1 -94.3 144.4 37.4 25.6 13.5 25 25 A Y E +AB 19 34A 35 9,-0.7 8,-3.2 11,-0.4 9,-1.4 -0.367 55.6 156.1 -63.2 126.1 38.8 24.9 16.9 26 26 A T E -AB 18 32A 3 -8,-2.8 -8,-2.8 6,-0.3 2,-0.3 -0.879 19.8-169.1-143.3 168.9 39.6 21.2 17.3 27 27 A I E > + B 0 31A 0 4,-1.5 4,-2.1 -2,-0.3 2,-0.2 -0.978 51.3 7.1-158.8 162.3 41.8 19.0 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.4 -14,-1.4 -2,-0.3 2,-1.0 -0.399 123.2 -4.8 68.4-129.6 43.0 15.4 19.6 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.625 127.0 -55.9-104.8 74.0 42.0 13.2 16.7 30 30 A G T 4 S+ 0 0 15 -2,-1.0 2,-1.0 -19,-0.3 -2,-0.2 0.758 83.7 160.8 65.5 30.6 39.8 15.5 14.8 31 31 A H E < -B 27 0A 32 -4,-2.1 -4,-1.5 1,-0.0 -1,-0.2 -0.716 33.9-140.5 -87.8 106.4 37.5 16.2 17.7 32 32 A L E -B 26 0A 71 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.348 20.7-177.4 -64.1 130.2 35.7 19.4 16.9 33 33 A L E - 0 0 14 -8,-3.2 2,-0.3 1,-0.4 -7,-0.2 0.870 60.2 -26.6 -96.2 -44.9 35.3 21.7 19.9 34 34 A T E -B 25 0A 26 -9,-1.4 -9,-0.7 2,-0.1 -1,-0.4 -0.963 33.9-138.6-167.5 153.9 33.3 24.6 18.4 35 35 A K S S+ 0 0 143 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.534 73.9 113.6 -92.2 -10.1 32.6 26.5 15.3 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.360 72.5-132.7 -66.4 138.8 32.7 29.7 17.3 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.505 77.4 102.4 -70.7 -1.8 35.6 32.1 16.5 38 38 A S > - 0 0 48 1,-0.1 4,-1.8 -13,-0.0 5,-0.1 -0.739 57.7-159.7 -93.6 125.0 36.4 32.4 20.2 39 39 A L H > S+ 0 0 69 -2,-0.5 4,-2.4 1,-0.2 -1,-0.1 0.762 96.1 55.1 -68.2 -27.5 39.3 30.6 21.7 40 40 A N H > S+ 0 0 120 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.883 104.2 52.7 -73.6 -38.1 37.8 30.9 25.1 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.926 112.1 47.6 -59.7 -43.2 34.6 29.4 24.0 42 42 A A H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.912 110.4 50.4 -64.0 -42.8 36.8 26.5 22.7 43 43 A K H X S+ 0 0 55 -4,-2.4 4,-2.0 2,-0.2 11,-0.2 0.889 110.9 50.7 -64.1 -36.3 38.7 26.3 26.0 44 44 A S H X S+ 0 0 71 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.966 110.1 47.8 -66.4 -50.3 35.4 26.2 27.8 45 45 A E H X S+ 0 0 67 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.909 109.8 54.7 -57.3 -41.1 34.1 23.4 25.6 46 46 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 5,-0.3 0.947 108.6 46.2 -57.6 -50.5 37.3 21.4 26.1 47 47 A D H X>S+ 0 0 37 -4,-2.0 4,-2.8 1,-0.2 5,-1.1 0.908 113.2 50.4 -59.0 -42.5 37.1 21.5 29.9 48 48 A K H <5S+ 0 0 144 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.880 111.8 48.0 -64.1 -39.5 33.5 20.5 29.8 49 49 A A H <5S+ 0 0 46 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.880 121.0 35.4 -69.5 -37.8 34.4 17.6 27.4 50 50 A I H <5S- 0 0 35 -4,-2.5 -2,-0.2 2,-0.3 -1,-0.2 0.712 102.3-126.2 -89.0 -27.7 37.3 16.4 29.5 51 51 A G T <5S+ 0 0 70 -4,-2.8 2,-0.3 -5,-0.3 -3,-0.2 0.771 78.1 70.3 85.6 25.4 35.9 17.1 33.0 52 52 A R S - 0 0 11 -2,-0.9 3,-1.1 -11,-0.2 -1,-0.2 0.630 35.2-144.0 -97.4 -24.6 43.0 21.7 30.8 55 55 A N T 3 S- 0 0 123 1,-0.3 -2,-0.1 -12,-0.2 -12,-0.1 0.887 75.2 -46.3 51.5 51.6 43.8 25.1 29.7 56 56 A G T 3 S+ 0 0 6 -13,-0.2 -39,-1.8 1,-0.1 2,-0.4 0.489 121.0 89.5 77.9 5.0 43.9 24.1 26.0 57 57 A V B < -C 16 0B 61 -3,-1.1 2,-0.2 -41,-0.2 -41,-0.2 -0.991 46.2-178.9-139.7 145.1 45.9 20.9 26.3 58 58 A I - 0 0 6 -43,-2.3 2,-0.2 -2,-0.4 -30,-0.1 -0.765 27.4-103.8-129.8 176.2 45.2 17.2 26.9 59 59 A T > - 0 0 62 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.542 33.7-109.9 -97.8 166.4 46.9 13.9 27.3 60 60 A K H > S+ 0 0 120 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.851 121.5 53.5 -63.0 -34.3 47.1 11.2 24.6 61 61 A D H > S+ 0 0 122 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.909 108.6 48.7 -67.3 -40.6 44.8 9.1 26.8 62 62 A E H > S+ 0 0 35 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.919 111.1 50.7 -64.5 -43.1 42.3 11.9 26.9 63 63 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -34,-0.4 0.892 110.8 49.1 -61.2 -41.9 42.5 12.3 23.1 64 64 A E H X S+ 0 0 78 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.820 108.0 53.1 -70.0 -29.4 42.0 8.6 22.6 65 65 A K H X S+ 0 0 137 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.920 109.6 48.8 -70.8 -42.2 39.0 8.6 25.0 66 66 A L H X S+ 0 0 4 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.896 111.6 51.4 -60.6 -40.0 37.4 11.4 22.9 67 67 A F H X S+ 0 0 13 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.908 107.6 50.5 -63.9 -44.5 38.2 9.4 19.8 68 68 A N H X S+ 0 0 89 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.947 113.0 47.8 -60.3 -44.7 36.5 6.3 21.2 69 69 A Q H X S+ 0 0 96 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.909 112.0 49.5 -61.2 -43.3 33.4 8.3 22.0 70 70 A D H X S+ 0 0 35 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.861 110.6 47.5 -66.8 -38.8 33.4 10.0 18.6 71 71 A V H X S+ 0 0 6 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.930 112.5 50.5 -69.8 -41.1 33.6 6.8 16.6 72 72 A D H X S+ 0 0 84 -4,-2.1 4,-2.7 -5,-0.3 5,-0.2 0.914 110.8 49.7 -59.5 -42.6 30.9 5.2 18.7 73 73 A A H X S+ 0 0 43 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.891 108.6 51.4 -63.9 -41.5 28.7 8.2 18.2 74 74 A A H X S+ 0 0 10 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.933 112.8 46.0 -63.9 -44.4 29.2 8.2 14.4 75 75 A V H X S+ 0 0 32 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.962 115.0 45.4 -63.4 -50.4 28.3 4.5 14.1 76 76 A R H X S+ 0 0 103 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.907 111.3 54.6 -61.2 -36.6 25.3 4.8 16.3 77 77 A G H X S+ 0 0 2 -4,-2.7 4,-1.2 -5,-0.2 3,-0.4 0.912 107.5 49.5 -62.1 -43.2 24.3 7.9 14.5 78 78 A I H >< S+ 0 0 0 -4,-2.3 3,-0.6 1,-0.2 7,-0.4 0.923 109.3 53.0 -61.6 -43.0 24.4 6.1 11.2 79 79 A L H 3< S+ 0 0 72 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.749 110.6 46.3 -66.5 -23.7 22.3 3.3 12.6 80 80 A R H 3< S+ 0 0 174 -4,-1.3 2,-0.5 -3,-0.4 -1,-0.3 0.618 92.5 98.4 -91.4 -16.8 19.7 5.7 13.8 81 81 A N > S+ 0 0 0 -6,-0.2 4,-2.6 -7,-0.2 3,-0.6 0.861 100.7 69.1 -87.3 -39.7 22.1 6.1 6.2 85 85 A K H 3X S+ 0 0 93 -4,-3.1 4,-2.8 -7,-0.4 5,-0.2 0.878 98.7 49.4 -47.7 -50.9 21.2 2.8 7.9 86 86 A P H 3> S+ 0 0 50 0, 0.0 4,-1.0 0, 0.0 -1,-0.3 0.844 112.7 48.6 -63.0 -32.1 20.1 1.0 4.8 87 87 A V H X> S+ 0 0 1 -3,-0.6 4,-1.0 -4,-0.4 3,-0.7 0.963 112.0 47.5 -71.2 -49.0 23.3 1.9 3.0 88 88 A Y H >< S+ 0 0 39 -4,-2.6 3,-1.0 1,-0.3 -1,-0.2 0.921 111.0 53.0 -55.7 -45.3 25.5 0.9 5.8 89 89 A A H 3< S+ 0 0 50 -4,-2.8 -1,-0.3 -5,-0.3 -2,-0.2 0.784 107.6 52.0 -63.6 -26.7 23.6 -2.4 6.1 90 90 A S H << S+ 0 0 38 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.648 96.4 89.6 -85.0 -14.2 24.1 -3.1 2.4 91 91 A L S << S- 0 0 4 -4,-1.0 2,-0.1 -3,-1.0 31,-0.0 -0.494 74.0-120.2 -89.1 157.1 27.8 -2.6 2.5 92 92 A D > - 0 0 56 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.278 44.6 -90.0 -79.5 172.9 30.7 -5.0 3.1 93 93 A A H > S+ 0 0 76 2,-0.2 4,-1.2 1,-0.2 -2,-0.1 0.857 121.8 45.2 -54.5 -47.8 33.1 -4.4 6.0 94 94 A V H >> S+ 0 0 26 62,-0.2 4,-1.1 1,-0.2 3,-0.8 0.954 114.4 49.3 -64.8 -48.2 35.7 -2.2 4.4 95 95 A R H 3> S+ 0 0 25 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.831 102.3 61.3 -62.6 -31.1 33.2 -0.1 2.7 96 96 A R H 3X S+ 0 0 80 -4,-2.1 4,-2.2 1,-0.2 -1,-0.3 0.898 101.2 56.3 -62.1 -33.3 31.3 0.4 5.9 97 97 A C H S+ 0 0 57 1,-0.2 4,-2.4 2,-0.2 -1,-0.1 0.840 128.4 56.6 -65.2 -31.1 25.2 12.5 9.6 109 109 A T H > S+ 0 0 120 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.912 108.0 46.0 -65.0 -47.1 23.3 15.4 8.2 110 110 A G H >< S+ 0 0 28 -4,-0.6 3,-0.9 1,-0.2 -2,-0.2 0.923 115.1 45.9 -65.6 -45.0 26.0 16.3 5.6 111 111 A V H >< S+ 0 0 0 -4,-2.0 3,-2.4 1,-0.2 -2,-0.2 0.912 103.4 63.2 -64.8 -41.4 26.4 12.7 4.5 112 112 A A H 3< S+ 0 0 8 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.706 95.1 64.1 -56.1 -20.8 22.7 12.2 4.3 113 113 A G T << S+ 0 0 56 -3,-0.9 2,-0.3 -4,-0.6 -1,-0.3 0.350 75.1 87.1 -86.1 2.3 22.6 14.9 1.6 114 114 A F <> + 0 0 41 -3,-2.4 4,-2.9 1,-0.2 3,-0.2 -0.312 56.6 155.6 -95.1 47.7 24.7 12.8 -0.8 115 115 A T H > + 0 0 79 -2,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.840 65.0 45.2 -42.4 -52.6 21.5 11.3 -2.0 116 116 A N H > S+ 0 0 87 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.911 114.7 47.5 -66.5 -40.7 22.6 10.2 -5.5 117 117 A S H > S+ 0 0 1 -3,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.904 109.9 55.2 -64.8 -39.9 25.9 8.8 -4.3 118 118 A L H X S+ 0 0 13 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.919 107.1 48.5 -60.5 -44.7 24.1 7.0 -1.5 119 119 A R H X S+ 0 0 100 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.871 110.2 53.1 -64.2 -35.5 21.7 5.3 -4.0 120 120 A M H <>S+ 0 0 27 -4,-1.8 5,-2.2 2,-0.2 4,-0.3 0.928 108.6 47.9 -67.5 -42.0 24.6 4.3 -6.1 121 121 A L H ><5S+ 0 0 2 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.931 109.9 53.9 -64.9 -39.2 26.5 2.7 -3.3 122 122 A Q H 3<5S+ 0 0 88 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.908 110.4 46.6 -59.4 -40.3 23.3 0.8 -2.3 123 123 A Q T 3<5S- 0 0 102 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.439 113.8-122.1 -81.1 1.7 23.1 -0.5 -5.9 124 124 A K T < 5 + 0 0 99 -3,-1.8 2,-1.2 -4,-0.3 -3,-0.2 0.808 61.1 148.1 59.4 36.9 26.8 -1.4 -5.8 125 125 A R >< + 0 0 113 -5,-2.2 4,-2.8 1,-0.2 5,-0.2 -0.663 20.2 174.0 -98.4 73.0 27.6 0.7 -8.8 126 126 A W H > + 0 0 51 -2,-1.2 4,-2.3 1,-0.2 -1,-0.2 0.879 68.9 45.6 -51.7 -52.0 31.1 1.5 -7.5 127 127 A D H > S+ 0 0 104 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.904 115.6 47.5 -65.4 -38.4 32.6 3.4 -10.3 128 128 A E H > S+ 0 0 94 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.920 110.8 50.3 -68.6 -41.8 29.6 5.5 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.8 4,-3.3 1,-0.2 5,-0.2 0.908 108.5 54.9 -60.6 -42.2 29.3 6.3 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.3 4,-1.3 -5,-0.2 -1,-0.2 0.896 108.3 46.8 -60.3 -41.3 33.0 7.3 -7.1 131 131 A V H X S+ 0 0 95 -4,-1.8 4,-0.7 1,-0.2 -1,-0.2 0.926 114.4 48.1 -66.7 -43.1 32.5 9.8 -9.9 132 132 A N H >< S+ 0 0 40 -4,-2.2 3,-1.2 1,-0.2 -2,-0.2 0.910 107.1 55.2 -62.3 -44.8 29.4 11.3 -8.2 133 133 A L H 3< S+ 0 0 1 -4,-3.3 6,-0.3 1,-0.3 -1,-0.2 0.845 103.0 57.9 -57.7 -34.4 31.1 11.6 -4.8 134 134 A A H 3< S+ 0 0 26 -4,-1.3 2,-1.9 -5,-0.2 -1,-0.3 0.698 85.0 80.0 -71.7 -19.6 33.9 13.6 -6.4 135 135 A K S << S+ 0 0 170 -3,-1.2 2,-0.3 -4,-0.7 -1,-0.2 -0.522 82.3 99.1 -85.5 67.8 31.5 16.3 -7.7 136 136 A S S > S- 0 0 18 -2,-1.9 4,-2.0 1,-0.1 5,-0.2 -0.995 84.3-118.9-152.9 158.4 31.4 17.9 -4.3 137 137 A R H > S+ 0 0 140 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.901 114.7 62.5 -62.5 -41.1 32.7 20.7 -2.2 138 138 A W H > S+ 0 0 18 1,-0.2 4,-2.3 2,-0.2 8,-0.3 0.910 105.9 44.2 -50.0 -48.7 34.1 18.0 0.1 139 139 A Y H 4 S+ 0 0 59 -6,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.898 115.3 47.7 -66.0 -42.5 36.3 16.7 -2.7 140 140 A N H < S+ 0 0 109 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.835 116.1 43.5 -69.5 -31.6 37.4 20.1 -3.8 141 141 A Q H < S+ 0 0 116 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.856 131.6 18.4 -83.0 -37.3 38.2 21.3 -0.3 142 142 A T S X S+ 0 0 22 -4,-2.3 4,-2.9 -5,-0.3 -1,-0.2 -0.548 73.7 162.8-134.4 70.2 40.1 18.2 1.0 143 143 A P H > + 0 0 47 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.860 69.5 52.8 -58.2 -44.2 41.0 16.3 -2.2 144 144 A N H > S+ 0 0 114 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.945 115.8 39.5 -62.8 -46.1 43.6 14.0 -0.7 145 145 A R H >> S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 3,-0.5 0.966 115.3 52.0 -66.1 -52.1 41.4 12.7 2.0 146 146 A A H 3X S+ 0 0 0 -4,-2.9 4,-2.7 -8,-0.3 5,-0.2 0.908 108.0 53.6 -50.7 -42.8 38.4 12.5 -0.2 147 147 A K H 3X S+ 0 0 95 -4,-3.0 4,-2.2 -5,-0.2 -1,-0.2 0.877 107.4 50.5 -60.9 -37.6 40.4 10.5 -2.8 148 148 A R H > S+ 0 0 38 -2,-0.3 3,-2.6 1,-0.2 4,-0.9 0.282 71.6 118.3 -94.6 9.0 42.6 -0.7 2.0 159 159 A D G >4 + 0 0 103 1,-0.3 3,-0.5 2,-0.2 -1,-0.2 0.775 68.2 60.7 -45.5 -34.1 45.1 0.1 -0.8 160 160 A A G 34 S+ 0 0 24 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.701 112.2 39.6 -69.8 -19.5 44.6 3.8 -0.4 161 161 A Y G X4 S+ 0 0 2 -3,-2.6 3,-1.4 -13,-0.1 2,-0.4 0.431 88.7 111.0-106.7 -6.2 45.8 3.6 3.1 162 162 A K T << S+ 0 0 116 -4,-0.9 -3,-0.0 -3,-0.5 0, 0.0 -0.624 85.0 17.5 -76.6 124.6 48.6 1.0 2.5 163 163 A N T 3 0 0 173 -2,-0.4 -1,-0.2 0, 0.0 -2,-0.1 0.469 360.0 360.0 92.7 9.0 52.0 2.7 2.9 164 164 A L < 0 0 134 -3,-1.4 -2,-0.1 0, 0.0 -3,-0.1 0.840 360.0 360.0 -98.5 360.0 50.8 5.7 4.9