==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 13-MAY-93 1DYE . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR X.ZHANG,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8581.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.8 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 7.4 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 . 13 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 52.5 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 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 80 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 137.0 43.7 -1.8 8.9 2 2 A N > - 0 0 67 95,-0.0 4,-2.3 1,-0.0 5,-0.2 -0.862 360.0 -87.3-140.4 175.5 40.6 -0.9 10.9 3 3 A I H > S+ 0 0 22 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.839 123.9 52.0 -56.4 -40.4 38.5 2.3 11.3 4 4 A F H > S+ 0 0 79 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.925 111.5 44.5 -61.6 -50.9 40.7 3.7 14.1 5 5 A E H > S+ 0 0 93 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.881 113.6 52.8 -63.7 -38.8 43.9 3.3 12.1 6 6 A M H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.918 112.6 41.9 -62.7 -51.1 42.2 4.8 9.1 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.4 0.865 109.1 59.2 -66.9 -34.9 40.8 7.9 10.8 8 8 A R H X S+ 0 0 107 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.860 107.6 47.9 -63.7 -27.4 44.1 8.4 12.7 9 9 A I H < S+ 0 0 87 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.863 115.9 43.5 -78.3 -37.3 45.8 8.6 9.3 10 10 A D H < S+ 0 0 20 -4,-1.7 -2,-0.2 1,-0.1 -1,-0.2 0.784 124.6 30.3 -79.5 -29.4 43.3 11.1 8.0 11 11 A E H < S- 0 0 42 -4,-2.5 19,-0.3 -5,-0.1 -3,-0.2 0.720 91.7-148.9-102.5 -30.9 42.9 13.4 11.0 12 12 A G < - 0 0 22 -4,-1.4 2,-0.4 -5,-0.4 -1,-0.1 -0.229 23.1 -87.9 83.7-176.9 46.3 13.3 12.6 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.998 43.0 171.8-133.0 127.9 46.9 13.6 16.4 14 14 A R E -A 28 0A 135 14,-1.1 14,-2.2 -2,-0.4 4,-0.1 -0.990 21.3-163.2-141.9 129.2 47.4 17.0 18.1 15 15 A L E S+ 0 0 67 -2,-0.4 43,-2.5 12,-0.2 2,-0.3 0.344 75.0 61.1 -91.5 3.2 47.6 17.6 21.9 16 16 A K E S-C 57 0B 93 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.967 99.5 -87.1-132.6 145.3 47.0 21.3 21.7 17 17 A I E + 0 0 18 39,-1.7 2,-0.3 -2,-0.3 10,-0.2 -0.239 58.4 166.6 -51.0 134.2 44.0 23.3 20.4 18 18 A Y E -A 26 0A 28 8,-2.5 8,-2.9 -4,-0.1 2,-0.4 -0.836 36.4-101.6-140.7 175.1 44.5 23.9 16.7 19 19 A K E -A 25 0A 127 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.883 31.8-136.4-107.0 136.6 42.4 25.0 13.8 20 20 A D > - 0 0 49 4,-3.0 3,-1.5 -2,-0.4 -1,-0.1 -0.030 40.0 -84.2 -76.2-174.3 41.0 22.6 11.3 21 21 A T T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.758 133.2 48.8 -64.4 -26.8 40.9 23.0 7.5 22 22 A E T 3 S- 0 0 79 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.398 124.3-104.6 -90.7 -3.2 37.7 25.0 7.8 23 23 A G S < S+ 0 0 36 -3,-1.5 2,-0.3 1,-0.3 -2,-0.1 0.525 72.8 143.1 90.4 10.2 39.3 27.2 10.5 24 24 A Y - 0 0 79 1,-0.1 -4,-3.0 -5,-0.1 -1,-0.3 -0.614 59.6-100.9 -90.5 149.2 37.4 25.6 13.5 25 25 A Y E +AB 19 34A 32 9,-0.8 8,-2.7 11,-0.3 9,-1.1 -0.460 55.1 163.0 -63.6 124.7 38.8 25.0 16.8 26 26 A T E -AB 18 32A 2 -8,-2.9 -8,-2.5 6,-0.2 2,-0.3 -0.866 18.7-169.8-140.1 167.1 39.8 21.3 17.2 27 27 A I E > - B 0 31A 0 4,-1.2 4,-1.8 -2,-0.3 -12,-0.2 -0.975 52.1 -2.3-155.7 161.0 41.9 19.1 19.4 28 28 A G E 4 S-A 14 0A 0 -14,-2.2 -14,-1.1 -2,-0.3 2,-0.8 -0.334 122.1 -3.3 63.2-126.3 43.2 15.4 19.5 29 29 A I T 4 S- 0 0 4 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.647 127.2 -53.1-103.8 73.8 42.1 13.2 16.6 30 30 A G T 4 S+ 0 0 16 -2,-0.8 2,-1.1 -19,-0.3 -2,-0.2 0.734 84.1 160.1 68.6 23.3 39.7 15.4 14.6 31 31 A H E < -B 27 0A 34 -4,-1.8 -4,-1.2 1,-0.0 -1,-0.2 -0.660 33.2-143.5 -84.0 101.2 37.6 16.3 17.7 32 32 A L E -B 26 0A 70 -2,-1.1 -6,-0.2 -6,-0.2 3,-0.1 -0.321 19.4-177.4 -60.4 127.8 35.7 19.5 16.7 33 33 A L E - 0 0 14 -8,-2.7 2,-0.3 1,-0.4 -7,-0.2 0.920 57.9 -24.7 -93.5 -53.2 35.3 21.8 19.7 34 34 A T E -B 25 0A 29 -9,-1.1 -9,-0.8 2,-0.1 -1,-0.4 -0.977 35.9-138.8-159.1 151.4 33.3 24.8 18.5 35 35 A K S S+ 0 0 141 -2,-0.3 -1,-0.0 -11,-0.2 7,-0.0 0.474 75.1 112.4 -91.3 -4.6 32.5 26.6 15.3 36 36 A S S S- 0 0 37 1,-0.1 -11,-0.3 2,-0.1 -2,-0.1 -0.423 73.4-132.0 -71.9 140.8 32.9 29.8 17.3 37 37 A P S S+ 0 0 123 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.522 75.7 106.8 -68.3 -6.1 35.7 32.2 16.6 38 38 A S > - 0 0 49 1,-0.2 4,-1.6 2,-0.1 3,-0.4 -0.701 55.6-162.0 -91.8 119.8 36.5 32.4 20.2 39 39 A L H > S+ 0 0 67 -2,-0.7 4,-1.6 1,-0.3 -1,-0.2 0.704 100.5 51.9 -61.1 -22.1 39.5 30.7 21.6 40 40 A N H > S+ 0 0 120 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.821 102.4 55.2 -84.4 -33.9 37.9 31.1 24.9 41 41 A A H > S+ 0 0 32 -3,-0.4 4,-1.3 1,-0.2 -2,-0.2 0.811 113.1 47.2 -65.2 -26.2 34.7 29.5 23.7 42 42 A A H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.816 107.6 51.8 -81.2 -40.1 37.0 26.6 22.7 43 43 A K H X S+ 0 0 52 -4,-1.6 4,-1.6 2,-0.2 11,-0.3 0.859 111.2 50.9 -67.8 -27.8 38.9 26.4 26.0 44 44 A S H X S+ 0 0 72 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.938 109.8 47.1 -69.6 -53.0 35.6 26.2 27.7 45 45 A E H X S+ 0 0 67 -4,-1.3 4,-3.0 1,-0.2 -2,-0.2 0.919 110.5 55.3 -56.7 -45.6 34.2 23.4 25.6 46 46 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 5,-0.3 0.897 107.9 45.7 -56.5 -45.0 37.4 21.6 26.0 47 47 A D H X>S+ 0 0 35 -4,-1.6 4,-2.5 2,-0.2 5,-0.9 0.875 112.8 52.2 -68.4 -34.2 37.3 21.6 29.8 48 48 A K H <5S+ 0 0 148 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.927 111.5 46.8 -64.6 -44.3 33.7 20.6 29.6 49 49 A A H <5S+ 0 0 46 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.837 121.7 35.2 -65.8 -35.9 34.6 17.6 27.3 50 50 A I H <5S- 0 0 37 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.769 99.2-127.8 -91.4 -33.4 37.5 16.5 29.5 51 51 A G T <5S+ 0 0 67 -4,-2.5 2,-0.3 1,-0.4 -3,-0.2 0.823 77.9 75.5 86.3 29.4 36.2 17.2 32.9 52 52 A R S - 0 0 12 -2,-0.9 3,-0.7 -11,-0.3 -1,-0.2 0.786 33.4-145.9 -95.6 -36.7 43.1 21.8 30.5 55 55 A N T 3 S- 0 0 111 1,-0.2 -2,-0.1 -12,-0.2 -12,-0.1 0.936 75.6 -52.1 62.4 49.7 44.1 25.2 29.4 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.7 1,-0.1 2,-0.4 0.479 119.4 99.5 70.2 5.4 44.0 24.1 25.7 57 57 A V B < +C 16 0B 65 -3,-0.7 2,-0.3 -41,-0.2 -41,-0.2 -0.966 45.2 178.9-128.7 138.6 46.3 21.1 26.3 58 58 A I - 0 0 4 -43,-2.5 2,-0.1 -2,-0.4 -30,-0.1 -0.906 26.3-111.6-132.7 162.2 45.5 17.4 26.7 59 59 A T > - 0 0 67 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.411 33.7-109.0 -86.1 163.5 47.2 14.1 27.1 60 60 A K H > S+ 0 0 104 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.862 120.3 53.3 -59.7 -41.7 47.4 11.2 24.5 61 61 A D H > S+ 0 0 119 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.876 108.3 49.7 -60.8 -43.7 45.1 9.1 26.6 62 62 A E H > S+ 0 0 36 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.878 109.7 51.7 -65.1 -38.4 42.5 11.9 26.8 63 63 A A H X S+ 0 0 1 -4,-2.1 4,-1.8 1,-0.2 -34,-0.4 0.842 111.0 47.6 -65.5 -36.3 42.8 12.4 23.0 64 64 A E H X S+ 0 0 77 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.812 107.0 56.6 -76.2 -29.7 42.1 8.6 22.6 65 65 A K H X S+ 0 0 136 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.945 109.5 45.8 -65.8 -44.7 39.2 8.7 24.9 66 66 A L H X S+ 0 0 4 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.914 110.9 53.4 -61.0 -43.7 37.6 11.4 22.8 67 67 A F H X S+ 0 0 14 -4,-1.8 4,-2.2 1,-0.2 5,-0.3 0.957 106.8 51.9 -57.3 -50.4 38.4 9.4 19.6 68 68 A N H X S+ 0 0 92 -4,-2.6 4,-2.1 1,-0.2 5,-0.2 0.937 111.4 47.4 -53.3 -46.1 36.7 6.3 21.1 69 69 A Q H X S+ 0 0 93 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.888 111.9 49.8 -62.2 -41.3 33.5 8.3 21.9 70 70 A D H X S+ 0 0 37 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.820 110.1 47.5 -70.1 -34.7 33.4 10.0 18.5 71 71 A V H X S+ 0 0 6 -4,-2.2 4,-3.3 2,-0.2 5,-0.2 0.937 114.5 48.3 -70.5 -45.6 33.7 6.8 16.5 72 72 A D H X S+ 0 0 84 -4,-2.1 4,-2.9 -5,-0.3 5,-0.3 0.935 113.0 47.9 -56.6 -48.1 31.1 5.1 18.6 73 73 A A H X S+ 0 0 42 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.899 111.2 51.8 -60.5 -42.4 28.8 8.2 18.2 74 74 A A H X S+ 0 0 9 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.965 111.7 46.1 -59.1 -53.7 29.5 8.1 14.5 75 75 A V H X S+ 0 0 34 -4,-3.3 4,-2.1 1,-0.2 -2,-0.2 0.947 114.6 45.8 -54.6 -52.4 28.5 4.4 14.2 76 76 A R H X S+ 0 0 112 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.902 109.5 56.9 -61.1 -37.3 25.3 4.8 16.4 77 77 A G H >X S+ 0 0 2 -4,-2.5 3,-0.5 -5,-0.3 4,-0.5 0.941 107.5 46.4 -59.2 -47.6 24.3 7.8 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-0.8 1,-0.2 7,-0.4 0.897 112.4 52.0 -59.1 -40.3 24.5 5.9 11.1 79 79 A L H 3< S+ 0 0 70 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.724 111.8 45.9 -71.2 -20.9 22.5 3.1 12.7 80 80 A R H << S+ 0 0 170 -4,-1.4 2,-0.5 -3,-0.5 -1,-0.2 0.373 93.4 95.2 -96.1 -9.8 19.8 5.5 13.9 81 81 A N > S+ 0 0 0 -7,-0.2 4,-2.4 2,-0.1 3,-0.6 0.882 101.5 68.4 -85.8 -43.7 22.1 6.0 6.3 85 85 A K H 3X S+ 0 0 80 -4,-2.6 4,-2.8 -7,-0.4 5,-0.2 0.873 98.5 50.4 -46.0 -49.8 21.2 2.7 7.9 86 86 A P H 3> S+ 0 0 51 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.885 111.6 50.1 -61.1 -35.6 20.1 0.9 4.8 87 87 A V H <> S+ 0 0 3 -3,-0.6 4,-0.7 -4,-0.4 3,-0.4 0.959 111.0 46.7 -66.0 -51.7 23.2 1.9 3.0 88 88 A Y H >< S+ 0 0 35 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.926 110.8 54.0 -53.7 -48.3 25.5 0.7 5.8 89 89 A D H 3< S+ 0 0 80 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.797 106.4 53.0 -59.3 -33.3 23.5 -2.6 6.0 90 90 A S H 3< S+ 0 0 34 -4,-1.4 -1,-0.3 -3,-0.4 2,-0.2 0.606 97.1 91.1 -78.3 -13.5 24.0 -3.2 2.3 91 91 A L S << S- 0 0 6 -3,-1.6 31,-0.0 -4,-0.7 30,-0.0 -0.610 72.6-118.9 -95.0 158.1 27.8 -2.7 2.4 92 92 A D > - 0 0 55 -2,-0.2 4,-1.6 1,-0.1 -1,-0.1 -0.029 44.9 -93.3 -72.1 174.5 30.8 -5.0 2.9 93 93 A A H > S+ 0 0 77 2,-0.2 4,-0.8 1,-0.2 -1,-0.1 0.822 121.0 46.4 -66.4 -33.0 33.2 -4.5 5.9 94 94 A V H >> S+ 0 0 27 62,-0.2 4,-1.2 2,-0.2 3,-0.7 0.953 113.4 47.2 -72.2 -52.9 35.8 -2.2 4.1 95 95 A R H 3> S+ 0 0 23 1,-0.3 4,-1.5 2,-0.2 -2,-0.2 0.807 104.3 62.6 -59.2 -32.7 33.2 0.1 2.5 96 96 A R H 3X S+ 0 0 79 -4,-1.6 4,-2.3 1,-0.2 -1,-0.3 0.888 100.9 53.3 -60.8 -37.8 31.4 0.4 5.8 97 97 A C H S+ 0 0 50 1,-0.2 4,-2.4 2,-0.2 -1,-0.1 0.839 127.2 54.2 -57.6 -43.1 25.2 12.6 9.7 109 109 A T H > S+ 0 0 122 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.916 107.6 50.8 -64.2 -40.7 23.2 15.4 8.3 110 110 A G H >< S+ 0 0 32 -4,-0.7 3,-0.9 2,-0.2 -2,-0.2 0.947 113.9 41.2 -61.6 -52.7 25.9 16.2 5.7 111 111 A V H >< S+ 0 0 1 -4,-2.0 3,-2.9 1,-0.3 -1,-0.2 0.899 107.1 62.0 -63.1 -42.3 26.4 12.7 4.4 112 112 A A H 3< S+ 0 0 10 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.751 95.8 64.9 -56.8 -21.2 22.7 12.0 4.4 113 113 A G T << S+ 0 0 54 -3,-0.9 2,-1.5 -4,-0.8 -1,-0.3 0.557 75.9 86.9 -76.4 -11.0 22.6 14.9 1.9 114 114 A F <> + 0 0 40 -3,-2.9 4,-2.6 1,-0.2 5,-0.3 -0.307 56.0 159.9 -85.8 53.3 24.6 12.9 -0.7 115 115 A T H > + 0 0 83 -2,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.841 66.4 43.4 -41.6 -56.1 21.3 11.4 -2.0 116 116 A N H > S+ 0 0 91 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.918 115.1 46.8 -63.0 -47.7 22.5 10.3 -5.4 117 117 A S H > S+ 0 0 2 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.898 111.1 53.9 -61.1 -43.3 25.8 8.8 -4.3 118 118 A L H X S+ 0 0 15 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.922 108.7 49.7 -58.6 -42.3 24.1 7.0 -1.4 119 119 A R H X S+ 0 0 122 -4,-2.0 4,-1.7 -5,-0.3 -1,-0.2 0.900 111.0 48.8 -63.8 -40.4 21.6 5.5 -4.0 120 120 A M H <>S+ 0 0 25 -4,-2.1 5,-2.5 2,-0.2 -1,-0.2 0.785 109.8 51.4 -70.0 -31.6 24.5 4.4 -6.2 121 121 A L H ><5S+ 0 0 2 -4,-1.8 3,-1.7 3,-0.2 -2,-0.2 0.900 107.9 52.1 -71.5 -42.3 26.4 2.8 -3.4 122 122 A Q H 3<5S+ 0 0 90 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.914 109.5 50.1 -60.4 -35.9 23.4 0.9 -2.4 123 123 A Q T 3<5S- 0 0 84 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.469 112.8-122.0 -79.6 -3.6 23.1 -0.4 -5.9 124 124 A K T < 5 + 0 0 103 -3,-1.7 2,-1.2 1,-0.2 -3,-0.2 0.789 62.0 146.8 65.2 32.2 26.7 -1.4 -5.9 125 125 A R >< + 0 0 111 -5,-2.5 4,-2.3 1,-0.2 5,-0.2 -0.737 21.2 175.3 -97.7 76.8 27.6 0.8 -8.9 126 126 A W H > S+ 0 0 50 -2,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.883 70.8 44.9 -52.3 -54.7 31.1 1.5 -7.6 127 127 A D H > S+ 0 0 113 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.911 114.3 49.3 -61.3 -44.9 32.5 3.5 -10.4 128 128 A E H > S+ 0 0 110 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.916 111.2 48.7 -66.0 -38.3 29.4 5.6 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 -9,-0.2 -1,-0.2 0.877 108.9 53.9 -66.7 -37.8 29.3 6.4 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.907 109.4 48.9 -63.1 -39.2 33.0 7.4 -7.1 131 131 A S H < S+ 0 0 79 -4,-2.1 4,-0.4 1,-0.2 3,-0.3 0.919 113.6 45.1 -66.8 -42.6 32.4 9.8 -9.9 132 132 A N H >< S+ 0 0 45 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.848 106.2 58.6 -70.7 -37.5 29.4 11.4 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.4 6,-0.3 1,-0.2 -1,-0.2 0.863 99.6 61.7 -60.1 -30.3 31.1 11.7 -4.8 134 134 A A T 3< S+ 0 0 27 -4,-1.1 2,-1.6 -3,-0.3 -1,-0.2 0.671 84.8 78.8 -69.9 -19.5 33.8 13.8 -6.5 135 135 A K S < S+ 0 0 161 -3,-1.2 2,-0.3 -4,-0.4 -1,-0.2 -0.579 80.6 96.3 -89.9 69.0 31.4 16.5 -7.5 136 136 A S S > S- 0 0 19 -2,-1.6 4,-1.8 1,-0.1 3,-0.2 -0.996 84.2-116.5-155.0 157.3 31.2 18.1 -4.2 137 137 A R H > S+ 0 0 147 -2,-0.3 4,-3.2 1,-0.2 5,-0.3 0.925 113.6 63.1 -57.7 -45.3 32.6 20.8 -2.1 138 138 A W H > S+ 0 0 18 1,-0.3 4,-2.1 2,-0.2 8,-0.2 0.868 105.9 43.1 -43.7 -52.7 34.1 18.1 0.2 139 139 A Y H 4 S+ 0 0 57 -6,-0.3 -1,-0.3 -3,-0.2 -2,-0.2 0.837 114.5 50.6 -68.2 -38.6 36.3 16.8 -2.5 140 140 A N H < S+ 0 0 109 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.849 114.5 43.8 -69.9 -33.2 37.3 20.3 -3.7 141 141 A Q H < S+ 0 0 105 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.886 131.2 18.3 -79.6 -39.9 38.2 21.4 -0.2 142 142 A T S X S+ 0 0 21 -4,-2.1 4,-2.5 -5,-0.3 -1,-0.2 -0.530 72.9 165.3-132.5 66.9 40.2 18.3 1.0 143 143 A P H > S+ 0 0 49 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.753 70.2 51.4 -55.2 -39.5 41.0 16.4 -2.2 144 144 A N H > S+ 0 0 114 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.921 115.6 41.1 -69.0 -45.4 43.7 14.0 -0.9 145 145 A R H > S+ 0 0 20 2,-0.2 4,-2.3 -3,-0.2 5,-0.3 0.925 115.5 51.0 -65.5 -48.2 41.6 12.7 2.0 146 146 A A H X S+ 0 0 0 -4,-2.5 4,-3.2 1,-0.2 5,-0.3 0.940 109.1 51.8 -54.1 -47.6 38.4 12.6 -0.3 147 147 A K H X S+ 0 0 91 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.868 108.1 52.0 -56.8 -39.9 40.3 10.6 -2.9 148 148 A R H X S+ 0 0 69 -4,-1.4 4,-1.7 2,-0.2 12,-0.2 0.963 114.1 41.6 -60.3 -51.5 41.4 8.1 -0.3 149 149 A V H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.921 114.5 51.9 -61.9 -46.9 37.8 7.5 0.9 150 150 A I H X S+ 0 0 13 -4,-3.2 4,-2.4 -5,-0.3 -1,-0.2 0.901 107.6 51.9 -57.3 -43.6 36.5 7.5 -2.6 151 151 A T H X S+ 0 0 35 -4,-2.2 4,-2.5 -5,-0.3 5,-0.4 0.874 106.0 55.3 -62.2 -36.6 39.1 4.9 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.887 109.7 45.6 -62.4 -40.6 38.0 2.8 -0.7 153 153 A F H < S+ 0 0 0 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.886 114.4 49.5 -67.8 -41.5 34.3 2.9 -2.0 154 154 A R H < S+ 0 0 105 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.939 125.1 23.4 -64.2 -48.3 35.4 2.2 -5.5 155 155 A T H < S- 0 0 43 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.698 84.7-135.8 -95.1 -31.9 37.6 -0.8 -4.8 156 156 A G S < S+ 0 0 17 -4,-2.2 2,-0.2 -5,-0.4 -62,-0.2 0.606 73.2 98.5 81.3 7.4 36.6 -2.4 -1.5 157 157 A T S S- 0 0 50 -6,-0.3 3,-0.3 -5,-0.1 -1,-0.3 -0.723 81.9-116.9-121.6 173.2 40.2 -2.7 -0.4 158 158 A W S >> S+ 0 0 48 -2,-0.2 3,-2.1 1,-0.2 4,-0.6 0.158 71.3 123.9 -95.8 19.2 42.5 -0.6 1.8 159 159 A D G >4 + 0 0 85 1,-0.3 3,-1.9 2,-0.2 -1,-0.2 0.862 65.6 58.7 -44.4 -50.6 44.9 0.1 -1.0 160 160 A A G 34 S+ 0 0 38 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.622 109.5 46.6 -56.6 -19.3 44.7 3.9 -0.6 161 161 A Y G <4 0 0 19 -3,-2.1 -1,-0.3 -13,-0.1 -2,-0.2 0.372 360.0 360.0-107.0 -2.8 45.9 3.6 3.0 162 162 A K << 0 0 168 -3,-1.9 -2,-0.1 -4,-0.6 -3,-0.1 0.637 360.0 360.0-117.6 360.0 48.8 1.3 2.5