==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 15-APR-03 1P2R . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR B.H.MOOERS,D.DATTA,W.A.BAASE,E.S.ZOLLARS,S.L.MAYO, . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8734.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 70.1 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 . 10 6.1 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 . 10 6.1 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 0 1 2 1 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 1 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 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 74 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 148.0 43.0 -1.6 8.7 2 2 A N > - 0 0 70 95,-0.0 4,-2.6 156,-0.0 5,-0.2 -0.884 360.0 -82.4-159.8 170.8 39.7 -0.7 10.5 3 3 A I H > S+ 0 0 26 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.796 127.5 50.8 -53.1 -37.6 37.6 2.5 11.0 4 4 A F H > S+ 0 0 77 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.964 113.7 42.8 -66.7 -51.2 39.7 3.6 13.9 5 5 A E H > S+ 0 0 96 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.881 115.2 52.1 -61.1 -36.3 43.0 3.2 12.0 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.947 112.7 42.0 -65.6 -52.0 41.4 4.8 9.0 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.853 108.7 59.9 -66.9 -31.5 40.2 7.8 10.7 8 8 A R H X S+ 0 0 104 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.872 108.9 45.4 -62.7 -34.4 43.4 8.1 12.7 9 9 A I H < S+ 0 0 51 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.942 116.1 44.5 -72.0 -45.3 45.2 8.5 9.4 10 10 A D H < S+ 0 0 19 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.769 124.3 33.2 -69.8 -28.7 42.7 11.0 8.0 11 11 A E H < S- 0 0 40 -4,-2.5 19,-0.4 -5,-0.2 -1,-0.2 0.654 92.1-151.6-104.5 -19.2 42.4 13.1 11.1 12 12 A G < - 0 0 23 -4,-1.7 2,-0.4 -5,-0.3 -1,-0.1 -0.197 23.0 -89.2 75.1-174.6 45.9 13.0 12.7 13 13 A L + 0 0 51 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.953 44.4 166.8-143.9 117.5 46.6 13.4 16.4 14 14 A R E -A 28 0A 143 14,-1.6 14,-2.6 -2,-0.4 4,-0.1 -0.999 21.2-161.3-135.4 127.6 47.2 16.7 18.1 15 15 A L E S+ 0 0 66 -2,-0.4 43,-2.7 12,-0.2 2,-0.4 0.485 73.4 62.6 -89.9 -2.7 47.2 17.2 21.8 16 16 A K E S-C 57 0B 96 41,-0.2 41,-0.2 12,-0.1 10,-0.1 -0.935 99.7 -87.9-122.7 148.4 46.7 21.0 21.8 17 17 A I E + 0 0 5 39,-2.2 2,-0.3 -2,-0.4 10,-0.2 -0.205 59.5 159.4 -51.2 135.4 43.8 22.9 20.5 18 18 A Y E -A 26 0A 29 8,-2.5 8,-3.1 -4,-0.1 2,-0.5 -0.878 41.4 -93.8-147.3 177.3 44.3 23.7 16.8 19 19 A K E -A 25 0A 124 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.873 34.6-139.5-105.3 133.8 42.1 24.7 13.8 20 20 A D > - 0 0 43 4,-3.2 3,-1.8 -2,-0.5 -1,-0.1 0.043 43.3 -76.6 -74.5-170.8 40.8 22.1 11.5 21 21 A T T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.675 134.0 49.6 -63.7 -22.5 40.6 22.3 7.7 22 22 A E T 3 S- 0 0 74 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.352 123.7-102.6 -93.9 -0.1 37.5 24.6 8.0 23 23 A G S < S+ 0 0 37 -3,-1.8 2,-0.3 1,-0.3 -2,-0.1 0.595 76.4 139.4 88.2 14.0 39.2 26.8 10.5 24 24 A Y - 0 0 68 1,-0.1 -4,-3.2 -5,-0.0 -1,-0.3 -0.716 60.8-102.5-100.4 142.3 37.3 25.4 13.5 25 25 A Y E +A 19 0A 34 9,-0.5 8,-2.8 11,-0.5 9,-1.3 -0.340 54.5 157.7 -59.2 130.1 38.8 24.7 16.9 26 26 A T E -AB 18 32A 2 -8,-3.1 -8,-2.5 6,-0.3 2,-0.3 -0.909 19.5-167.8-144.9 167.9 39.5 21.0 17.3 27 27 A I E > + B 0 31A 0 4,-1.7 4,-2.3 -2,-0.3 2,-0.2 -0.981 51.6 6.7-155.1 165.1 41.7 18.7 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.6 -14,-1.6 -2,-0.3 2,-0.9 -0.408 122.6 -6.2 69.9-131.3 42.9 15.1 19.5 29 29 A I T 4 S- 0 0 6 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.679 128.2 -52.1-103.3 75.7 41.8 12.9 16.7 30 30 A G T 4 S+ 0 0 12 -2,-0.9 2,-1.1 -19,-0.4 -2,-0.2 0.805 83.3 163.3 65.6 28.8 39.6 15.2 14.8 31 31 A H E < -B 27 0A 29 -4,-2.3 -4,-1.7 -20,-0.1 2,-0.2 -0.685 30.9-144.7 -85.0 102.1 37.4 16.1 17.8 32 32 A L E -B 26 0A 76 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.463 17.7-174.7 -64.1 128.0 35.6 19.2 16.7 33 33 A L - 0 0 12 -8,-2.8 2,-0.3 1,-0.4 -7,-0.2 0.894 56.9 -37.7 -91.4 -47.6 35.1 21.5 19.7 34 34 A T - 0 0 30 -9,-1.3 -9,-0.5 2,-0.1 -1,-0.4 -0.958 35.5-126.6-171.2 158.8 33.0 24.3 18.3 35 35 A K S S+ 0 0 139 -2,-0.3 -1,-0.0 -11,-0.1 7,-0.0 0.406 74.9 119.1 -94.0 -0.5 32.4 26.3 15.2 36 36 A S - 0 0 37 1,-0.1 -11,-0.5 2,-0.1 -2,-0.1 -0.337 66.9-138.8 -67.3 144.6 32.8 29.4 17.3 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.529 76.7 102.7 -80.8 -5.1 35.6 31.9 16.5 38 38 A S > - 0 0 51 1,-0.2 4,-2.3 -13,-0.0 5,-0.2 -0.693 57.3-162.5 -85.7 115.1 36.2 32.2 20.2 39 39 A L H > S+ 0 0 57 -2,-0.7 4,-2.7 1,-0.2 5,-0.2 0.900 94.6 55.3 -59.8 -37.0 39.1 30.3 21.6 40 40 A N H > S+ 0 0 120 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.938 104.9 51.8 -61.3 -42.2 37.7 30.7 25.0 41 41 A A H > S+ 0 0 33 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.932 109.7 50.8 -58.0 -44.8 34.5 29.1 23.9 42 42 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.882 108.3 51.3 -60.3 -42.2 36.6 26.3 22.5 43 43 A K H X S+ 0 0 37 -4,-2.7 4,-2.6 1,-0.2 11,-0.3 0.885 107.9 52.8 -64.5 -37.8 38.4 25.8 25.8 44 44 A S H X S+ 0 0 68 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.929 108.8 48.8 -61.5 -44.6 35.1 25.7 27.6 45 45 A E H X S+ 0 0 67 -4,-2.2 4,-3.1 2,-0.2 -1,-0.2 0.908 110.6 52.5 -60.3 -41.1 33.9 22.9 25.3 46 46 A L H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.946 109.4 48.0 -60.0 -46.5 37.2 21.0 25.9 47 47 A D H X>S+ 0 0 36 -4,-2.6 4,-2.5 1,-0.2 5,-1.2 0.925 113.2 47.3 -61.2 -43.9 36.9 21.2 29.6 48 48 A K H <5S+ 0 0 140 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.904 112.7 50.5 -63.9 -42.8 33.3 20.1 29.5 49 49 A A H <5S+ 0 0 39 -4,-3.1 -2,-0.2 -5,-0.2 -1,-0.2 0.916 119.4 35.0 -62.8 -42.2 34.3 17.3 27.1 50 50 A I H <5S- 0 0 35 -4,-3.0 -2,-0.2 2,-0.2 -1,-0.2 0.710 103.8-124.1 -86.7 -23.9 37.2 16.0 29.2 51 51 A G T <5S+ 0 0 67 -4,-2.5 2,-0.3 -5,-0.3 -3,-0.2 0.759 77.8 78.0 87.4 21.3 35.7 16.7 32.7 52 52 A R S - 0 0 13 -2,-1.1 3,-0.8 -11,-0.3 -1,-0.2 0.681 37.8-141.2 -96.8 -28.2 42.5 21.8 31.0 55 55 A N T 3 S- 0 0 118 1,-0.2 -2,-0.1 -12,-0.1 -11,-0.0 0.976 73.9 -57.7 61.2 47.8 43.7 25.0 29.5 56 56 A G T 3 S+ 0 0 0 -13,-0.1 -39,-2.2 1,-0.1 2,-0.4 0.431 111.8 99.6 60.6 13.1 43.7 23.6 25.9 57 57 A V B < +C 16 0B 76 -3,-0.8 2,-0.3 -41,-0.2 -41,-0.2 -0.995 43.8 178.6-129.6 133.0 46.1 20.6 26.3 58 58 A I - 0 0 4 -43,-2.7 2,-0.1 -2,-0.4 -30,-0.1 -0.850 26.7-108.8-128.1 167.0 45.1 17.0 26.7 59 59 A T > - 0 0 67 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.393 31.8-110.0 -87.9 169.6 46.9 13.6 27.0 60 60 A K H > S+ 0 0 98 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.908 120.8 53.1 -62.1 -41.3 47.0 10.9 24.4 61 61 A D H > S+ 0 0 116 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.927 109.7 48.2 -60.9 -43.8 44.7 8.8 26.6 62 62 A E H > S+ 0 0 41 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.926 109.8 51.9 -62.8 -42.8 42.3 11.6 26.8 63 63 A A H X S+ 0 0 1 -4,-2.7 4,-2.1 1,-0.2 -34,-0.4 0.907 110.1 49.5 -59.0 -45.1 42.4 12.1 23.0 64 64 A E H X S+ 0 0 86 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.841 105.8 57.3 -64.0 -36.9 41.7 8.5 22.4 65 65 A K H X S+ 0 0 141 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.959 109.4 43.5 -62.5 -45.5 38.8 8.5 24.8 66 66 A L H X S+ 0 0 3 -4,-2.3 4,-3.1 1,-0.2 -2,-0.2 0.895 112.9 54.9 -64.6 -33.8 37.0 11.3 22.8 67 67 A F H X S+ 0 0 13 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.940 107.3 47.8 -63.6 -48.4 37.9 9.4 19.6 68 68 A N H X S+ 0 0 91 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.962 114.0 48.5 -55.5 -49.3 36.3 6.3 20.8 69 69 A Q H X S+ 0 0 97 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.906 111.8 49.8 -57.5 -43.1 33.2 8.3 21.8 70 70 A D H X S+ 0 0 34 -4,-3.1 4,-2.0 2,-0.2 -1,-0.2 0.895 110.9 47.0 -65.7 -39.7 33.2 10.1 18.5 71 71 A V H X S+ 0 0 5 -4,-2.8 4,-2.6 2,-0.2 5,-0.3 0.944 113.3 50.2 -66.7 -45.0 33.4 6.9 16.4 72 72 A D H X S+ 0 0 83 -4,-2.7 4,-3.1 -5,-0.3 5,-0.2 0.964 110.5 49.6 -57.1 -48.9 30.7 5.3 18.5 73 73 A A H X S+ 0 0 57 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.875 108.5 53.6 -57.9 -37.6 28.5 8.4 18.0 74 74 A A H X S+ 0 0 8 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.953 110.4 45.4 -64.1 -48.5 29.0 8.3 14.3 75 75 A V H X S+ 0 0 32 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.946 112.6 53.0 -59.5 -44.1 27.9 4.7 14.0 76 76 A R H X S+ 0 0 165 -4,-3.1 4,-0.9 -5,-0.3 -1,-0.2 0.881 107.0 50.9 -61.0 -35.6 25.0 5.5 16.3 77 77 A G H X S+ 0 0 13 -4,-2.2 4,-0.8 -5,-0.2 3,-0.4 0.881 108.6 52.2 -69.5 -38.7 23.9 8.4 14.1 78 78 A V H >< S+ 0 0 0 -4,-2.3 3,-0.6 1,-0.2 7,-0.2 0.926 108.9 49.6 -64.0 -42.8 24.0 6.2 11.0 79 79 A L H 3< S+ 0 0 67 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.705 112.7 47.5 -70.2 -18.3 21.9 3.6 12.6 80 80 A R H 3< S+ 0 0 226 -4,-0.9 2,-0.5 -3,-0.4 -1,-0.2 0.452 92.3 93.2 -97.3 -13.6 19.3 6.1 13.7 81 81 A N S+ 0 0 112 2,-0.1 4,-0.6 3,-0.1 -1,-0.2 0.879 119.9 37.0 -84.9 -39.7 18.4 7.8 5.0 84 84 A L H > S+ 0 0 0 -7,-0.2 4,-2.8 1,-0.2 5,-0.3 0.847 101.0 68.8 -82.3 -37.4 21.6 6.3 6.1 85 85 A K H X S+ 0 0 79 -4,-2.5 4,-3.4 1,-0.2 5,-0.3 0.942 98.5 50.5 -51.9 -49.8 20.7 3.2 7.8 86 86 A P H > S+ 0 0 52 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.915 112.7 46.6 -58.4 -37.8 19.5 1.3 4.8 87 87 A V H X S+ 0 0 1 -4,-0.6 4,-0.8 2,-0.2 3,-0.4 0.977 113.2 49.0 -67.6 -46.9 22.6 2.1 2.9 88 88 A Y H >< S+ 0 0 33 -4,-2.8 3,-1.3 1,-0.3 -1,-0.2 0.918 109.6 51.8 -55.3 -48.8 24.8 1.2 5.7 89 89 A D H 3< S+ 0 0 74 -4,-3.4 -1,-0.3 -5,-0.3 -2,-0.2 0.840 107.0 54.6 -61.9 -29.4 22.9 -2.0 6.2 90 90 A S H 3< S+ 0 0 41 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.635 96.2 89.8 -78.1 -12.8 23.4 -2.8 2.5 91 91 A L S << S- 0 0 6 -3,-1.3 2,-0.1 -4,-0.8 31,-0.0 -0.544 75.4-118.8 -91.4 157.1 27.1 -2.5 2.6 92 92 A D > - 0 0 55 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.269 45.9 -93.7 -74.5 167.9 30.0 -4.8 3.2 93 93 A A H > S+ 0 0 77 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.846 122.1 50.6 -56.9 -39.9 32.3 -4.0 6.2 94 94 A V H > S+ 0 0 27 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.975 113.8 44.5 -65.1 -50.4 35.0 -2.0 4.3 95 95 A R H > S+ 0 0 25 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.869 107.3 58.5 -62.3 -36.1 32.4 0.2 2.7 96 96 A R H X S+ 0 0 78 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.933 104.0 53.2 -58.3 -42.4 30.5 0.7 5.9 97 97 A A H X S+ 0 0 5 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.895 105.0 55.1 -60.7 -40.4 33.7 2.1 7.4 98 98 A A H X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.926 108.7 47.8 -61.9 -36.9 33.9 4.6 4.5 99 99 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.927 110.5 50.9 -69.3 -39.1 30.4 5.8 5.2 100 100 A I H X S+ 0 0 8 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.922 106.6 56.4 -60.6 -44.0 31.2 6.2 8.9 101 101 A N H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.944 106.9 48.3 -51.1 -51.4 34.3 8.1 7.9 102 102 A M H X S+ 0 0 3 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.921 111.1 50.5 -57.3 -44.1 32.1 10.6 6.0 103 103 A V H X S+ 0 0 8 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.898 108.1 52.1 -63.6 -38.9 29.7 11.0 8.9 104 104 A F H < S+ 0 0 33 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.932 116.0 42.5 -61.8 -41.0 32.5 11.6 11.4 105 105 A Q H < S+ 0 0 51 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.929 134.1 13.9 -71.3 -45.7 33.8 14.3 9.1 106 106 A M H X S- 0 0 57 -4,-3.1 4,-0.5 -5,-0.2 -3,-0.2 0.433 103.6-116.2-112.1 -7.8 30.5 16.0 8.1 107 107 A G H X - 0 0 32 -4,-2.6 4,-2.3 -5,-0.3 5,-0.3 0.262 35.1 -73.8 80.8 158.6 27.9 14.8 10.5 108 108 A E H > S+ 0 0 64 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.902 130.3 49.2 -48.2 -55.9 24.7 12.7 10.0 109 109 A T H > S+ 0 0 118 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.895 108.8 51.9 -57.3 -46.4 22.8 15.4 8.5 110 110 A G H >< S+ 0 0 31 -4,-0.5 3,-0.8 1,-0.2 -2,-0.2 0.945 114.8 40.6 -59.3 -51.0 25.5 16.3 6.0 111 111 A V H >< S+ 0 0 0 -4,-2.3 3,-2.4 1,-0.2 -1,-0.2 0.858 105.4 65.4 -66.9 -35.3 26.0 12.8 4.6 112 112 A A H 3< S+ 0 0 6 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.792 95.3 61.9 -59.8 -21.7 22.2 12.2 4.7 113 113 A G T << S+ 0 0 50 -4,-0.9 2,-1.6 -3,-0.8 3,-0.3 0.499 73.8 91.6 -81.4 -6.9 22.0 14.9 2.0 114 114 A F <> + 0 0 42 -3,-2.4 4,-2.9 1,-0.2 5,-0.3 -0.222 54.8 158.3 -82.2 50.7 24.1 13.0 -0.5 115 115 A T H > + 0 0 62 -2,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.813 64.8 42.7 -41.1 -54.6 20.9 11.5 -1.8 116 116 A N H > S+ 0 0 85 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.873 115.5 48.5 -66.4 -41.6 22.0 10.5 -5.3 117 117 A S H > S+ 0 0 0 -3,-0.3 4,-2.9 2,-0.2 -2,-0.2 0.930 109.8 53.8 -63.9 -41.9 25.3 9.1 -4.2 118 118 A L H X S+ 0 0 11 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.901 107.9 50.3 -57.1 -43.9 23.6 7.1 -1.4 119 119 A R H X S+ 0 0 115 -4,-1.8 4,-2.1 -5,-0.3 -1,-0.2 0.937 109.8 49.5 -62.5 -44.3 21.2 5.7 -4.0 120 120 A M H <>S+ 0 0 38 -4,-2.2 5,-2.4 1,-0.2 4,-0.4 0.907 111.0 51.3 -63.2 -39.3 24.1 4.6 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-2.9 3,-1.5 1,-0.2 -1,-0.2 0.924 108.8 48.9 -62.4 -46.1 25.8 3.1 -3.3 122 122 A Q H 3<5S+ 0 0 83 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.857 110.8 52.5 -62.9 -31.0 22.7 1.1 -2.3 123 123 A Q T 3<5S- 0 0 88 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.539 111.5-124.9 -80.0 -5.9 22.4 -0.0 -6.0 124 124 A K T < 5 + 0 0 98 -3,-1.5 2,-1.2 -4,-0.4 -3,-0.2 0.806 59.6 148.8 63.7 34.9 26.1 -1.2 -5.8 125 125 A R >< + 0 0 122 -5,-2.4 4,-2.6 1,-0.2 5,-0.2 -0.682 21.2 176.9 -98.8 74.6 27.0 1.0 -8.8 126 126 A W H > + 0 0 50 -2,-1.2 4,-2.3 1,-0.2 -1,-0.2 0.850 69.9 42.8 -49.6 -55.4 30.5 1.6 -7.6 127 127 A D H > S+ 0 0 109 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.918 116.8 48.1 -64.0 -42.2 32.1 3.6 -10.3 128 128 A E H > S+ 0 0 105 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.892 110.7 50.3 -66.9 -39.8 29.1 5.7 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 -1,-0.2 0.935 109.5 52.7 -61.1 -43.9 28.8 6.4 -7.1 130 130 A A H X S+ 0 0 12 -4,-2.3 4,-1.2 2,-0.2 -2,-0.2 0.892 110.1 47.7 -59.3 -42.9 32.4 7.4 -7.0 131 131 A V H < S+ 0 0 85 -4,-2.1 4,-0.5 1,-0.2 3,-0.3 0.925 114.1 47.2 -64.2 -44.2 32.0 9.8 -9.8 132 132 A N H >< S+ 0 0 39 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.902 105.9 57.2 -66.4 -38.8 29.0 11.3 -8.1 133 133 A L H 3< S+ 0 0 2 -4,-3.1 6,-0.4 1,-0.3 -1,-0.2 0.856 99.3 61.1 -59.2 -35.5 30.6 11.6 -4.8 134 134 A A T 3< S+ 0 0 28 -4,-1.2 2,-1.5 -3,-0.3 -1,-0.3 0.627 83.1 82.8 -68.8 -14.7 33.3 13.7 -6.3 135 135 A K S < S+ 0 0 158 -3,-1.5 2,-0.3 -4,-0.5 -1,-0.2 -0.533 79.1 95.3 -90.5 68.3 30.8 16.4 -7.3 136 136 A S S > S- 0 0 16 -2,-1.5 4,-2.4 1,-0.1 5,-0.2 -0.990 85.2-115.2-155.5 158.0 30.7 18.0 -3.9 137 137 A R H > S+ 0 0 145 -2,-0.3 4,-3.2 1,-0.2 5,-0.3 0.938 116.2 61.7 -58.7 -43.0 32.1 20.8 -1.8 138 138 A W H > S+ 0 0 15 1,-0.2 4,-2.8 2,-0.2 8,-0.2 0.930 106.1 43.4 -47.0 -52.3 33.5 17.9 0.3 139 139 A Y H 4 S+ 0 0 58 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.926 115.2 49.9 -62.9 -44.3 35.7 16.6 -2.5 140 140 A N H < S+ 0 0 106 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.915 115.7 41.0 -64.8 -40.8 36.7 20.1 -3.6 141 141 A Q H < S+ 0 0 107 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.859 131.8 22.1 -77.1 -37.4 37.8 21.2 -0.1 142 142 A T S X S+ 0 0 21 -4,-2.8 4,-2.6 -5,-0.3 5,-0.2 -0.548 73.5 161.5-131.2 73.1 39.5 18.0 1.0 143 143 A P H > S+ 0 0 49 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.842 70.1 47.9 -62.7 -40.3 40.4 16.3 -2.1 144 144 A N H > S+ 0 0 112 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.940 116.4 43.5 -70.7 -40.8 43.1 13.8 -0.9 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.934 115.1 49.4 -65.2 -46.7 41.0 12.6 1.9 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-3.4 1,-0.2 5,-0.3 0.935 107.6 55.5 -58.6 -44.2 37.9 12.4 -0.2 147 147 A K H X S+ 0 0 87 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.2 0.894 106.9 50.9 -55.2 -40.0 39.8 10.5 -2.8 148 148 A R H X S+ 0 0 53 -4,-1.7 4,-1.8 2,-0.2 12,-0.2 0.958 113.2 43.3 -62.6 -48.4 40.7 8.0 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.920 113.7 51.3 -63.8 -43.4 37.2 7.5 1.0 150 150 A I H X S+ 0 0 14 -4,-3.4 4,-3.0 1,-0.2 -1,-0.2 0.892 107.9 52.3 -61.5 -42.9 35.9 7.4 -2.6 151 151 A T H X S+ 0 0 36 -4,-2.6 4,-2.6 -5,-0.3 6,-0.4 0.857 107.1 54.2 -60.7 -35.4 38.4 4.8 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 5,-0.3 0.918 111.5 43.7 -65.7 -41.9 37.3 2.7 -0.6 153 153 A F H < S+ 0 0 1 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.888 114.5 51.4 -70.8 -38.6 33.7 2.9 -1.8 154 154 A R H < S+ 0 0 107 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.913 125.2 21.6 -61.4 -46.2 34.7 2.2 -5.3 155 155 A T H < S- 0 0 38 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.624 85.0-133.4 -98.3 -24.7 36.8 -0.9 -4.6 156 156 A G S < S+ 0 0 17 -4,-2.4 2,-0.3 -5,-0.3 -62,-0.2 0.766 75.3 104.6 70.3 22.2 35.6 -2.3 -1.3 157 157 A T S S- 0 0 43 -6,-0.4 3,-0.3 -5,-0.3 -1,-0.3 -0.842 79.3-123.0-128.7 170.3 39.3 -2.6 -0.3 158 158 A W >> + 0 0 40 -2,-0.3 3,-1.7 1,-0.2 4,-1.0 0.027 69.8 123.4 -98.7 22.2 41.7 -0.6 1.9 159 159 A D T 34 + 0 0 94 1,-0.3 3,-0.5 2,-0.2 -1,-0.2 0.858 68.8 57.3 -56.0 -35.5 44.2 0.1 -1.0 160 160 A A T 34 S+ 0 0 25 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.690 113.4 39.4 -69.5 -17.5 43.9 3.9 -0.5 161 161 A Y T X4 S+ 0 0 2 -3,-1.7 3,-1.5 -13,-0.1 2,-0.4 0.463 87.1 115.9-108.4 -6.8 45.0 3.6 3.1 162 162 A K T 3< S+ 0 0 101 -4,-1.0 -3,-0.0 -3,-0.5 0, 0.0 -0.555 85.1 11.4 -71.9 121.4 47.5 0.9 2.5 163 163 A N T 3 0 0 162 -2,-0.4 -1,-0.3 0, 0.0 -4,-0.0 0.681 360.0 360.0 84.0 28.7 50.9 2.3 3.3 164 164 A L < 0 0 123 -3,-1.5 -2,-0.1 0, 0.0 -3,-0.1 0.766 360.0 360.0-108.5 360.0 49.9 5.5 5.1