==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (O-GLYCOSYL) 05-FEB-88 1L10 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR S.DAO-PIN,K.WILSON,T.ALBER,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8701.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 73.2 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 . 8 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 53.0 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 1 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 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 92 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 151.1 36.9 -23.4 9.0 2 2 A N > - 0 0 71 95,-0.0 4,-2.6 1,-0.0 3,-0.4 -0.863 360.0 -85.8-144.1 169.9 34.7 -21.0 10.9 3 3 A I H > S+ 0 0 21 -2,-0.3 4,-2.6 1,-0.2 5,-0.3 0.839 124.4 51.0 -50.9 -43.2 34.4 -17.2 11.4 4 4 A F H > S+ 0 0 73 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.917 112.3 44.3 -64.1 -44.5 37.0 -17.1 14.1 5 5 A E H > S+ 0 0 88 -3,-0.4 4,-1.5 2,-0.2 -2,-0.2 0.872 114.0 52.1 -68.5 -37.4 39.6 -19.0 12.2 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 3,-0.2 0.936 113.2 42.4 -61.8 -54.8 38.9 -17.0 9.1 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-0.4 0.837 108.7 58.2 -66.0 -31.2 39.2 -13.7 10.8 8 8 A R H X S+ 0 0 92 -4,-1.8 4,-1.7 -5,-0.3 -1,-0.2 0.893 106.6 49.3 -69.3 -26.9 42.3 -14.7 12.7 9 9 A I H < S+ 0 0 56 -4,-1.5 -2,-0.2 -3,-0.2 -1,-0.2 0.949 115.7 44.4 -69.4 -45.4 44.0 -15.4 9.4 10 10 A D H < S+ 0 0 20 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.800 125.1 29.0 -71.6 -33.6 43.0 -12.0 8.0 11 11 A E H < S- 0 0 36 -4,-2.2 19,-0.3 -5,-0.1 -1,-0.2 0.726 90.9-153.9-100.1 -34.2 43.8 -9.9 11.1 12 12 A G < - 0 0 19 -4,-1.7 2,-0.4 -5,-0.4 -1,-0.1 -0.212 24.8 -83.6 82.0-175.1 46.7 -11.8 12.8 13 13 A L + 0 0 43 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.982 43.5 170.1-135.7 123.8 47.5 -11.6 16.5 14 14 A R E -A 28 0A 123 14,-1.2 14,-2.6 -2,-0.4 4,-0.1 -0.995 18.9-165.9-137.2 125.3 49.7 -8.9 18.1 15 15 A L E S+ 0 0 66 -2,-0.4 43,-2.5 12,-0.2 2,-0.3 0.433 73.5 68.1 -93.8 -2.4 50.0 -8.5 21.8 16 16 A K E S-C 57 0B 120 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.872 99.6 -91.4-116.2 144.8 51.5 -5.0 21.6 17 17 A I E + 0 0 22 39,-1.5 2,-0.3 -2,-0.3 10,-0.2 -0.360 58.4 170.8 -55.8 137.7 49.7 -1.8 20.5 18 18 A Y E -A 26 0A 34 8,-3.0 8,-3.4 -4,-0.1 2,-0.4 -0.867 32.1 -97.5-140.9 169.5 50.3 -1.5 16.8 19 19 A K E -A 25 0A 130 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.864 34.4-119.4 -98.7 136.0 49.1 0.6 13.8 20 20 A D > - 0 0 53 4,-3.0 3,-2.1 -2,-0.4 -1,-0.1 -0.007 35.7-101.6 -35.4 164.3 46.4 -0.4 11.2 21 21 A T T 3 S+ 0 0 109 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.800 134.2 55.7 -61.9 -26.8 47.0 -0.7 7.6 22 22 A E T 3 S- 0 0 83 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.435 126.7-103.6 -83.6 -1.5 45.3 2.6 8.1 23 23 A G S < S+ 0 0 37 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.487 77.0 139.2 83.2 7.9 47.8 4.0 10.5 24 24 A Y - 0 0 71 1,-0.1 -4,-3.0 -5,-0.1 -1,-0.3 -0.683 60.3-105.7 -96.2 148.9 45.4 3.4 13.4 25 25 A Y E +AB 19 34A 34 9,-0.5 8,-3.0 11,-0.4 9,-1.3 -0.385 52.6 157.1 -62.7 123.4 46.2 2.2 16.8 26 26 A T E -AB 18 32A 4 -8,-3.4 -8,-3.0 -2,-0.3 2,-0.3 -0.875 20.1-169.8-139.8 164.3 45.1 -1.5 17.3 27 27 A I E > + B 0 31A 0 4,-1.7 4,-2.0 -2,-0.3 -12,-0.2 -0.976 53.2 7.9-149.2 164.9 45.9 -4.4 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.6 -14,-1.2 -2,-0.3 2,-0.9 -0.405 122.9 -8.6 76.0-134.3 45.0 -8.2 19.5 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.701 127.6 -52.1-104.4 72.2 43.1 -9.6 16.6 30 30 A G T 4 S+ 0 0 15 -2,-0.9 2,-1.0 -19,-0.3 -2,-0.2 0.789 83.7 160.4 66.8 31.3 42.2 -6.4 14.7 31 31 A H E < -B 27 0A 33 -4,-2.0 -4,-1.7 32,-0.0 -1,-0.2 -0.735 32.8-144.3 -86.4 101.6 40.7 -4.6 17.7 32 32 A L E -B 26 0A 71 -2,-1.0 -6,-0.3 -6,-0.2 3,-0.1 -0.411 18.7-177.0 -62.4 125.8 40.8 -0.9 16.8 33 33 A L E - 0 0 14 -8,-3.0 2,-0.3 1,-0.3 -7,-0.2 0.892 59.4 -19.6 -92.3 -49.0 41.5 1.2 19.9 34 34 A T E -B 25 0A 27 -9,-1.3 -9,-0.5 2,-0.1 -1,-0.3 -0.997 37.5-141.3-153.5 155.1 41.3 4.8 18.6 35 35 A K S S+ 0 0 141 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.498 75.4 107.0 -93.2 -6.7 41.5 6.8 15.4 36 36 A S S S- 0 0 36 2,-0.1 -11,-0.4 1,-0.1 6,-0.1 -0.420 76.1-125.0 -68.7 150.0 43.5 9.5 17.2 37 37 A P S S+ 0 0 116 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.635 76.3 98.8 -78.9 -13.0 47.1 10.1 16.8 38 38 A S > - 0 0 54 1,-0.2 4,-2.0 2,-0.0 3,-0.1 -0.674 57.2-156.2 -88.3 130.1 48.2 9.8 20.4 39 39 A L H > S+ 0 0 71 -2,-0.6 4,-2.2 1,-0.3 -1,-0.2 0.735 101.6 60.7 -59.0 -26.9 49.7 6.6 21.7 40 40 A N H > S+ 0 0 120 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.955 100.7 48.0 -74.3 -42.1 48.5 8.0 24.9 41 41 A A H > S+ 0 0 32 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.892 113.4 52.1 -56.9 -37.0 44.8 8.1 23.8 42 42 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.896 106.9 50.7 -66.4 -45.0 45.3 4.5 22.6 43 43 A K H X S+ 0 0 46 -4,-2.2 4,-2.2 2,-0.2 11,-0.3 0.848 110.0 51.1 -61.7 -32.7 46.8 3.4 25.9 44 44 A S H X S+ 0 0 73 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.896 109.8 48.1 -72.7 -42.8 43.9 4.9 27.8 45 45 A E H X S+ 0 0 65 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.930 110.5 53.9 -63.5 -45.4 41.3 3.2 25.6 46 46 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 5,-0.3 0.947 109.0 45.7 -54.9 -53.6 43.2 -0.1 26.0 47 47 A D H X>S+ 0 0 36 -4,-2.2 4,-1.8 1,-0.2 5,-0.9 0.856 113.0 51.7 -60.5 -35.5 43.1 0.0 29.7 48 48 A K H <5S+ 0 0 142 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.926 110.9 48.8 -64.7 -40.8 39.5 1.0 29.6 49 49 A A H <5S+ 0 0 47 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.815 120.8 33.6 -69.6 -32.3 38.8 -2.0 27.3 50 50 A I H <5S- 0 0 40 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.651 100.2-126.0 -98.8 -25.3 40.6 -4.5 29.5 51 51 A G T <5S+ 0 0 68 -4,-1.8 2,-0.3 -5,-0.3 -3,-0.2 0.808 77.6 75.3 80.3 29.6 39.9 -3.1 33.0 52 52 A R S - 0 0 3 -2,-0.9 3,-1.9 -11,-0.3 -1,-0.2 0.648 31.7-146.1 -98.7 -20.9 48.2 -2.6 30.6 55 55 A N T 3 S- 0 0 122 1,-0.3 3,-0.1 -12,-0.1 -2,-0.1 0.863 76.3 -53.5 56.8 39.7 50.9 -0.3 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.5 1,-0.2 2,-0.4 0.536 119.7 99.2 75.7 8.4 50.3 -1.1 26.0 57 57 A V B < +C 16 0B 63 -3,-1.9 2,-0.2 -41,-0.2 -41,-0.2 -0.978 45.1 179.5-135.7 137.4 50.5 -4.8 26.3 58 58 A I - 0 0 5 -43,-2.5 2,-0.2 -2,-0.4 -30,-0.1 -0.776 25.7-112.8-126.2 165.6 47.9 -7.6 26.7 59 59 A T > - 0 0 65 -2,-0.2 4,-2.3 1,-0.1 5,-0.1 -0.516 33.4-107.2 -88.5 170.0 47.9 -11.4 27.1 60 60 A K H > S+ 0 0 106 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.890 121.3 56.0 -62.2 -45.6 46.6 -14.0 24.5 61 61 A D H > S+ 0 0 111 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.873 107.1 46.0 -47.7 -55.0 43.7 -14.5 26.8 62 62 A E H > S+ 0 0 34 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.864 110.4 56.7 -62.2 -37.7 42.7 -10.9 26.8 63 63 A A H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 -34,-0.4 0.904 108.1 45.4 -61.7 -45.9 43.2 -10.8 23.0 64 64 A E H X S+ 0 0 80 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.767 109.0 56.8 -68.2 -30.7 40.7 -13.6 22.5 65 65 A K H X S+ 0 0 121 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.943 108.2 45.6 -63.9 -46.2 38.2 -12.0 24.9 66 66 A L H X S+ 0 0 2 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.877 112.5 54.5 -59.8 -38.2 38.2 -8.8 22.9 67 67 A F H X S+ 0 0 12 -4,-1.6 4,-2.7 2,-0.2 5,-0.3 0.959 105.6 50.2 -64.4 -47.2 37.9 -11.0 19.8 68 68 A N H X S+ 0 0 92 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.943 113.1 47.5 -53.4 -48.5 34.8 -12.8 21.1 69 69 A Q H X S+ 0 0 100 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.880 111.8 50.2 -59.3 -43.9 33.2 -9.5 21.9 70 70 A D H X S+ 0 0 37 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.895 111.8 45.9 -65.4 -43.3 34.0 -8.0 18.5 71 71 A V H X S+ 0 0 6 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.934 113.4 50.1 -63.8 -48.9 32.6 -11.0 16.5 72 72 A D H X S+ 0 0 80 -4,-2.6 4,-2.3 -5,-0.3 5,-0.3 0.962 112.0 48.7 -51.5 -46.0 29.4 -11.0 18.7 73 73 A A H X S+ 0 0 44 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.852 108.9 53.1 -64.8 -40.4 29.0 -7.3 18.1 74 74 A A H X S+ 0 0 9 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.948 111.2 45.2 -60.8 -52.9 29.5 -7.6 14.3 75 75 A V H X S+ 0 0 33 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.928 115.2 47.5 -56.2 -46.9 26.8 -10.3 14.0 76 76 A R H X S+ 0 0 132 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.876 109.7 54.9 -68.4 -30.9 24.3 -8.3 16.2 77 77 A G H X S+ 0 0 2 -4,-2.2 4,-0.7 -5,-0.3 -1,-0.2 0.921 108.0 46.8 -68.2 -44.3 25.1 -5.3 14.3 78 78 A I H >< S+ 0 0 0 -4,-1.9 3,-0.9 1,-0.2 7,-0.5 0.938 111.4 52.8 -54.7 -47.0 24.2 -7.1 11.0 79 79 A L H 3< S+ 0 0 69 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.732 111.9 45.3 -65.7 -24.9 21.0 -8.4 12.6 80 80 A R H 3< S+ 0 0 181 -4,-1.5 2,-0.5 -3,-0.2 -1,-0.3 0.464 92.5 97.4 -94.5 -16.3 19.9 -4.9 13.7 81 81 A N S+ 0 0 140 2,-0.1 4,-0.5 3,-0.1 -1,-0.2 0.808 120.3 41.3 -84.0 -34.3 20.0 -3.0 5.1 84 84 A L H > S+ 0 0 0 -6,-0.2 4,-2.5 -7,-0.2 3,-0.3 0.863 101.0 66.6 -85.5 -40.7 22.2 -5.9 6.3 85 85 A K H X S+ 0 0 78 -4,-2.9 4,-3.0 -7,-0.5 5,-0.2 0.870 99.0 50.3 -51.2 -48.7 19.8 -8.2 7.9 86 86 A P H > S+ 0 0 52 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.882 112.4 47.3 -63.9 -37.9 17.9 -9.2 4.7 87 87 A V H >X S+ 0 0 3 -4,-0.5 4,-1.1 -3,-0.3 3,-0.6 0.964 113.0 49.1 -65.5 -48.3 21.1 -10.0 2.8 88 88 A Y H >< S+ 0 0 34 -4,-2.5 3,-1.2 1,-0.3 -3,-0.2 0.954 110.4 50.4 -54.2 -51.2 22.4 -12.1 5.8 89 89 A D H 3< S+ 0 0 77 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.788 109.0 52.9 -59.3 -28.9 19.2 -14.0 6.1 90 90 A S H << S+ 0 0 34 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.648 96.7 88.6 -81.8 -20.0 19.3 -14.8 2.4 91 91 A L S << S- 0 0 6 -3,-1.2 31,-0.0 -4,-1.1 2,-0.0 -0.488 75.2-117.9 -83.1 155.5 22.8 -16.2 2.4 92 92 A D > - 0 0 56 -2,-0.2 4,-2.4 1,-0.1 5,-0.1 -0.214 43.2 -92.0 -74.7 173.0 24.2 -19.7 3.1 93 93 A A H > S+ 0 0 75 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.834 122.5 46.4 -62.7 -41.0 26.5 -20.4 6.0 94 94 A V H >> S+ 0 0 26 62,-0.2 4,-1.2 2,-0.2 3,-0.6 0.953 113.9 46.7 -68.2 -50.6 29.8 -19.9 4.2 95 95 A R H 3> S+ 0 0 25 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.883 104.1 63.7 -61.9 -32.5 28.8 -16.6 2.5 96 96 A R H 3X S+ 0 0 77 -4,-2.4 4,-2.5 1,-0.2 -1,-0.3 0.931 99.8 53.4 -54.2 -42.9 27.4 -15.4 5.8 97 97 A C H S+ 0 0 52 1,-0.3 4,-2.8 2,-0.2 5,-0.1 0.809 128.8 53.8 -50.4 -47.4 28.1 -1.8 9.6 109 109 A T H > S+ 0 0 117 2,-0.2 4,-1.0 1,-0.2 -1,-0.3 0.955 106.6 47.2 -61.8 -52.6 28.0 1.6 8.1 110 110 A G H >< S+ 0 0 33 -4,-0.7 3,-0.7 1,-0.2 -2,-0.2 0.915 116.1 44.9 -59.0 -45.8 30.7 1.1 5.6 111 111 A V H >< S+ 0 0 0 -4,-2.2 3,-2.6 1,-0.2 -1,-0.2 0.912 104.5 61.0 -69.1 -37.7 29.3 -2.1 4.4 112 112 A A H 3< S+ 0 0 17 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.739 95.6 66.2 -64.8 -14.7 25.8 -0.9 4.2 113 113 A G T << S+ 0 0 54 -4,-1.0 2,-1.4 -3,-0.7 -1,-0.3 0.570 75.1 86.5 -78.3 -9.9 27.1 1.6 1.7 114 114 A F <> + 0 0 41 -3,-2.6 4,-2.1 1,-0.2 3,-0.3 -0.245 56.9 158.5 -85.1 55.1 27.9 -1.1 -0.8 115 115 A T H > + 0 0 86 -2,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.831 64.5 46.2 -40.1 -58.4 24.3 -0.9 -2.0 116 116 A N H > S+ 0 0 86 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.873 114.3 46.4 -64.8 -42.9 24.7 -2.4 -5.5 117 117 A S H > S+ 0 0 1 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.809 109.7 55.5 -64.4 -38.5 26.8 -5.4 -4.4 118 118 A L H X S+ 0 0 14 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.902 107.8 49.8 -58.8 -47.5 24.4 -6.1 -1.5 119 119 A R H X S+ 0 0 112 -4,-1.7 4,-2.0 -5,-0.2 -2,-0.2 0.939 111.3 48.2 -55.0 -53.6 21.5 -6.2 -4.1 120 120 A M H <>S+ 0 0 26 -4,-2.1 5,-2.4 1,-0.2 4,-0.4 0.844 109.7 51.8 -60.6 -40.0 23.5 -8.6 -6.3 121 121 A L H ><5S+ 0 0 2 -4,-2.0 3,-1.8 2,-0.2 -1,-0.2 0.934 108.6 51.8 -64.7 -42.2 24.3 -10.9 -3.3 122 122 A Q H 3<5S+ 0 0 91 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.882 109.5 50.0 -59.9 -35.3 20.7 -11.0 -2.4 123 123 A Q T 3<5S- 0 0 100 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.482 112.7-122.0 -75.6 -7.2 19.9 -12.0 -5.9 124 124 A K T < 5 + 0 0 100 -3,-1.8 2,-1.2 -4,-0.4 -3,-0.2 0.794 62.1 146.1 62.9 34.2 22.6 -14.8 -5.8 125 125 A R >< + 0 0 127 -5,-2.4 4,-2.6 1,-0.2 5,-0.2 -0.691 20.7 173.3 -97.2 73.6 24.4 -13.3 -8.8 126 126 A W H > + 0 0 49 -2,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.893 69.4 45.2 -54.6 -48.2 27.8 -14.4 -7.4 127 127 A D H > S+ 0 0 110 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.920 113.8 49.3 -68.2 -40.0 30.0 -13.4 -10.3 128 128 A E H > S+ 0 0 99 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.884 111.0 49.6 -63.8 -45.3 28.4 -10.0 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.855 107.4 53.9 -61.8 -39.5 28.7 -9.2 -7.2 130 130 A A H X S+ 0 0 10 -4,-1.8 4,-1.0 -5,-0.2 -1,-0.2 0.873 109.5 49.3 -61.1 -42.8 32.4 -10.2 -7.1 131 131 A V H < S+ 0 0 93 -4,-1.8 3,-0.5 -5,-0.2 4,-0.4 0.957 114.0 45.7 -60.4 -47.5 33.1 -7.9 -10.0 132 132 A N H >< S+ 0 0 46 -4,-2.3 3,-1.0 1,-0.2 -2,-0.2 0.848 107.7 55.6 -61.8 -44.0 31.2 -5.0 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.6 6,-0.3 1,-0.2 -1,-0.2 0.807 101.0 61.5 -57.2 -37.3 32.8 -5.5 -4.8 134 134 A A T 3< S+ 0 0 26 -4,-1.0 2,-1.6 -3,-0.5 -1,-0.2 0.646 84.7 78.1 -68.4 -19.2 36.3 -5.1 -6.4 135 135 A K S < S+ 0 0 148 -3,-1.0 2,-0.3 -4,-0.4 -1,-0.2 -0.579 81.2 98.2 -87.5 66.0 35.6 -1.6 -7.6 136 136 A S S > S- 0 0 19 -2,-1.6 4,-2.1 1,-0.1 3,-0.2 -0.982 84.7-116.3-151.4 155.2 36.2 -0.1 -4.2 137 137 A R H > S+ 0 0 137 -2,-0.3 4,-3.1 1,-0.2 5,-0.3 0.926 116.0 63.9 -55.0 -44.6 38.7 1.7 -2.1 138 138 A W H > S+ 0 0 14 1,-0.2 4,-1.9 2,-0.2 8,-0.2 0.855 106.1 41.6 -43.2 -51.0 38.6 -1.5 0.2 139 139 A Y H 4 S+ 0 0 62 -6,-0.3 -1,-0.2 -3,-0.2 -2,-0.2 0.897 115.7 48.7 -72.5 -43.5 39.9 -3.7 -2.7 140 140 A N H < S+ 0 0 111 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.836 116.2 43.2 -63.7 -35.5 42.5 -1.2 -3.8 141 141 A Q H < S+ 0 0 98 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.790 132.1 18.6 -81.4 -34.6 43.9 -0.7 -0.2 142 142 A T S X S+ 0 0 23 -4,-1.9 4,-2.6 -5,-0.3 5,-0.2 -0.506 73.2 163.2-140.0 69.3 43.9 -4.3 1.0 143 143 A P H > + 0 0 52 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.787 69.1 51.8 -58.3 -43.9 43.8 -6.4 -2.2 144 144 A N H > S+ 0 0 110 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.936 116.5 39.7 -65.9 -46.4 44.9 -9.8 -0.8 145 145 A R H > S+ 0 0 23 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.908 115.4 51.9 -62.3 -47.8 42.4 -9.9 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.921 109.2 52.5 -58.8 -39.3 39.6 -8.4 -0.2 147 147 A K H X S+ 0 0 83 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.861 106.7 50.9 -68.8 -28.1 40.3 -11.0 -2.8 148 148 A R H X S+ 0 0 49 -4,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.909 114.2 44.7 -69.4 -44.1 40.0 -13.8 -0.3 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.952 113.0 50.9 -66.6 -42.5 36.6 -12.5 0.9 150 150 A I H X S+ 0 0 10 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.888 108.8 50.6 -63.0 -43.7 35.4 -11.9 -2.6 151 151 A T H X S+ 0 0 35 -4,-2.0 4,-2.7 -5,-0.2 5,-0.4 0.839 107.4 55.4 -60.7 -37.9 36.3 -15.5 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.924 110.4 43.9 -62.2 -42.6 34.4 -16.7 -0.6 153 153 A F H < S+ 0 0 2 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.859 115.8 50.5 -67.9 -39.6 31.3 -14.8 -1.8 154 154 A R H < S+ 0 0 88 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.921 124.5 23.2 -59.1 -51.5 31.9 -16.0 -5.4 155 155 A T H < S- 0 0 50 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.705 82.4-138.9 -96.0 -32.9 32.3 -19.7 -4.6 156 156 A G S < S+ 0 0 14 -4,-2.3 2,-0.2 -5,-0.4 -62,-0.2 0.645 72.9 97.1 78.5 11.4 30.6 -20.4 -1.3 157 157 A I S S- 0 0 77 -6,-0.3 3,-0.4 -5,-0.1 -1,-0.3 -0.809 79.9-116.8-128.8 171.1 33.5 -22.7 -0.3 158 158 A W S > S+ 0 0 38 -2,-0.2 3,-1.3 1,-0.2 4,-0.3 0.142 72.3 115.7 -99.1 18.3 36.6 -22.1 1.9 159 159 A D T >> + 0 0 84 1,-0.2 3,-1.1 2,-0.2 4,-0.8 0.745 67.1 65.5 -57.8 -33.6 39.4 -22.7 -0.6 160 160 A A H 3> S+ 0 0 15 -3,-0.4 4,-0.6 1,-0.3 -1,-0.2 0.746 108.8 42.2 -59.2 -25.5 40.7 -19.0 -0.4 161 161 A Y H <4 S+ 0 0 3 -3,-1.3 -1,-0.3 2,-0.2 -2,-0.2 0.365 98.4 75.7-101.5 -4.5 41.6 -19.8 3.1 162 162 A K H <4 S+ 0 0 128 -3,-1.1 -2,-0.2 -4,-0.3 -1,-0.1 0.687 94.3 51.5 -73.9 -39.4 43.1 -23.3 2.5 163 163 A N H < 0 0 129 -4,-0.8 -2,-0.2 1,-0.2 -1,-0.1 0.986 360.0 360.0 -58.5 -57.7 46.1 -22.0 1.1 164 164 A L < 0 0 111 -4,-0.6 -1,-0.2 0, 0.0 -2,-0.1 0.140 360.0 360.0 -63.3 360.0 46.5 -19.7 4.1