==== 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) 28-JAN-91 1L44 . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR S.DAOPIN,B.W.MATTHEWS . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8649.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 72.0 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 . 10 6.1 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 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 75 0, 0.0 2,-0.2 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 148.3 36.8 -23.5 9.0 2 2 A N > - 0 0 69 95,-0.0 4,-2.3 92,-0.0 5,-0.2 -0.838 360.0 -84.0-141.8 176.0 34.6 -20.9 10.9 3 3 A I H > S+ 0 0 22 -2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.811 123.5 51.7 -52.3 -41.8 34.3 -17.1 11.4 4 4 A F H > S+ 0 0 72 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.927 112.1 43.5 -67.4 -45.2 36.9 -17.1 14.1 5 5 A E H > S+ 0 0 89 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.883 114.0 52.4 -67.3 -36.3 39.6 -18.9 12.2 6 6 A M H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.947 114.1 41.6 -61.5 -50.9 38.8 -16.9 9.1 7 7 A L H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 5,-0.4 0.823 109.5 57.7 -67.0 -33.8 39.2 -13.6 10.9 8 8 A R H X S+ 0 0 108 -4,-2.2 4,-1.3 -5,-0.2 -1,-0.2 0.845 109.1 48.7 -64.4 -31.4 42.3 -14.8 12.8 9 9 A I H < S+ 0 0 53 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.949 115.0 43.0 -71.4 -48.0 43.8 -15.4 9.4 10 10 A D H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.767 125.6 29.2 -67.7 -34.2 42.9 -12.0 8.0 11 11 A E H < S- 0 0 33 -4,-2.1 19,-0.3 -5,-0.2 -1,-0.2 0.691 91.8-149.8-104.8 -25.7 43.7 -9.9 10.9 12 12 A G < - 0 0 18 -4,-1.3 2,-0.4 -5,-0.4 -1,-0.1 -0.186 24.0 -86.6 81.6-177.3 46.5 -11.7 12.7 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.992 42.4 174.1-133.6 128.4 47.2 -11.5 16.5 14 14 A R E -A 28 0A 126 14,-1.3 14,-2.4 -2,-0.4 4,-0.1 -0.998 18.7-166.0-135.4 133.7 49.4 -8.8 18.1 15 15 A L E S+ 0 0 68 -2,-0.4 43,-2.2 12,-0.2 2,-0.3 0.359 74.4 62.9 -99.9 4.0 49.8 -8.4 21.8 16 16 A K E S-C 57 0B 108 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.936 102.0 -88.6-123.4 144.7 51.3 -4.9 21.7 17 17 A I E + 0 0 21 39,-1.2 2,-0.3 -2,-0.3 10,-0.2 -0.248 59.1 174.2 -49.9 140.2 49.5 -1.8 20.4 18 18 A Y E -A 26 0A 28 8,-2.7 8,-3.0 -4,-0.1 2,-0.4 -0.902 32.8-106.8-142.3 168.7 50.2 -1.6 16.8 19 19 A K E -A 25 0A 122 -2,-0.3 6,-0.2 6,-0.2 5,-0.0 -0.861 33.4-137.4-102.8 136.3 49.1 0.5 13.9 20 20 A D > - 0 0 47 4,-3.0 3,-2.1 -2,-0.4 -1,-0.1 -0.098 39.8 -80.9 -79.3-174.6 46.7 -1.0 11.3 21 21 A T T 3 S+ 0 0 111 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.801 135.4 46.1 -59.6 -27.7 46.8 -0.7 7.5 22 22 A E T 3 S- 0 0 81 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.335 124.1-104.0 -91.3 -4.3 45.1 2.8 7.9 23 23 A G S < S+ 0 0 34 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.556 72.7 142.8 89.2 15.2 47.5 3.8 10.7 24 24 A Y - 0 0 76 1,-0.1 -4,-3.0 -5,-0.0 2,-0.4 -0.660 60.4-101.3 -94.9 154.1 45.1 3.4 13.5 25 25 A Y E +AB 19 34A 30 9,-0.8 8,-3.0 11,-0.4 9,-1.3 -0.532 54.2 163.0 -68.1 117.7 46.0 2.1 16.9 26 26 A T E -AB 18 32A 3 -8,-3.0 -8,-2.7 -2,-0.4 2,-0.3 -0.832 17.7-168.7-130.9 160.3 44.9 -1.6 17.2 27 27 A I E > - B 0 31A 0 4,-1.4 4,-1.9 -2,-0.3 -12,-0.2 -0.957 53.4 -4.2-147.9 158.4 45.6 -4.5 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-2.4 -14,-1.3 -2,-0.3 2,-0.9 -0.335 124.7 -3.5 67.3-127.1 45.0 -8.3 19.4 29 29 A I T 4 S- 0 0 5 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.670 127.4 -54.2-102.2 75.5 42.9 -9.6 16.6 30 30 A G T 4 S+ 0 0 16 -2,-0.9 2,-1.1 -19,-0.3 -2,-0.2 0.786 81.8 160.7 66.7 27.1 42.0 -6.4 14.8 31 31 A H E < -B 27 0A 31 -4,-1.9 -4,-1.4 1,-0.0 -1,-0.2 -0.708 33.2-143.4 -82.1 102.8 40.5 -4.7 17.8 32 32 A L E -B 26 0A 67 -2,-1.1 -6,-0.3 -6,-0.2 3,-0.1 -0.431 20.3-178.4 -64.5 128.4 40.5 -1.0 16.8 33 33 A L E - 0 0 14 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.891 58.4 -23.2 -94.7 -45.5 41.3 1.1 19.8 34 34 A T E -B 25 0A 24 -9,-1.3 -9,-0.8 2,-0.1 -1,-0.4 -0.976 34.9-141.2-162.4 150.2 41.1 4.7 18.5 35 35 A K S S+ 0 0 144 -2,-0.3 -1,-0.1 -11,-0.2 7,-0.0 0.485 74.2 112.1 -92.0 -9.6 41.4 6.7 15.3 36 36 A S S S- 0 0 43 1,-0.1 -11,-0.4 2,-0.1 6,-0.1 -0.299 73.2-129.9 -66.7 144.8 43.2 9.3 17.4 37 37 A P S S+ 0 0 119 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.585 77.1 102.0 -71.8 -11.8 46.9 10.0 16.8 38 38 A S > - 0 0 51 1,-0.2 4,-2.7 2,-0.0 3,-0.3 -0.695 56.3-161.4 -88.0 118.6 47.8 9.8 20.3 39 39 A L H > S+ 0 0 66 -2,-0.6 4,-2.4 1,-0.3 -1,-0.2 0.804 101.3 57.2 -60.2 -25.6 49.4 6.6 21.6 40 40 A N H > S+ 0 0 118 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.907 102.2 48.7 -74.5 -39.7 48.3 8.0 24.8 41 41 A A H > S+ 0 0 34 -3,-0.3 4,-1.8 1,-0.2 -2,-0.2 0.917 114.2 51.1 -62.6 -41.3 44.6 8.2 23.8 42 42 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.854 106.8 51.3 -59.1 -46.6 45.2 4.5 22.6 43 43 A K H X S+ 0 0 49 -4,-2.4 4,-1.6 2,-0.2 11,-0.3 0.828 110.1 49.4 -66.1 -28.9 46.7 3.4 25.8 44 44 A S H X S+ 0 0 74 -4,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.865 109.6 50.7 -76.8 -37.3 43.8 4.7 27.8 45 45 A E H X S+ 0 0 65 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.885 109.0 54.1 -65.6 -41.0 41.2 3.2 25.6 46 46 A L H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 5,-0.3 0.923 107.5 47.1 -61.2 -43.7 43.0 -0.1 26.0 47 47 A D H X>S+ 0 0 35 -4,-1.6 4,-2.5 2,-0.2 5,-0.7 0.882 113.2 50.3 -62.9 -36.1 42.9 0.0 29.8 48 48 A K H <5S+ 0 0 148 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.920 110.8 50.1 -64.3 -48.0 39.2 0.9 29.7 49 49 A A H <5S+ 0 0 45 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.865 121.4 32.3 -61.8 -40.2 38.7 -2.0 27.3 50 50 A I H <5S- 0 0 38 -4,-2.3 -2,-0.2 2,-0.3 -1,-0.2 0.711 98.4-127.3 -92.6 -26.4 40.5 -4.5 29.5 51 51 A G T <5S+ 0 0 69 -4,-2.5 2,-0.3 1,-0.3 -3,-0.2 0.702 79.1 77.1 85.1 16.5 39.7 -3.2 33.0 52 52 A R S - 0 0 7 -2,-0.8 3,-1.4 -11,-0.3 -1,-0.2 0.653 32.6-143.5-101.5 -21.5 48.1 -2.7 30.6 55 55 A N T 3 S- 0 0 124 1,-0.3 -2,-0.1 -12,-0.2 -11,-0.1 0.944 75.8 -52.5 57.7 45.8 50.7 -0.3 29.7 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.2 1,-0.1 2,-0.4 0.584 119.9 99.2 68.5 9.3 50.0 -1.1 25.9 57 57 A V B < +C 16 0B 59 -3,-1.4 2,-0.3 -41,-0.2 -41,-0.2 -0.978 44.4 177.3-134.0 145.3 50.3 -4.8 26.4 58 58 A I - 0 0 5 -43,-2.2 2,-0.2 -2,-0.4 -30,-0.1 -0.897 26.9-111.0-137.2 163.9 47.8 -7.7 26.8 59 59 A T > - 0 0 65 -2,-0.3 4,-2.4 1,-0.1 3,-0.4 -0.496 34.5-105.8 -90.9 171.1 47.8 -11.4 27.1 60 60 A K H > S+ 0 0 109 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.867 122.2 55.6 -56.9 -41.5 46.5 -13.9 24.6 61 61 A D H > S+ 0 0 120 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.837 107.1 48.7 -56.2 -45.2 43.5 -14.5 26.8 62 62 A E H > S+ 0 0 37 -3,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.862 110.4 53.1 -62.9 -41.2 42.6 -10.7 26.7 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -34,-0.4 0.873 110.5 46.8 -61.5 -41.9 43.1 -10.8 23.0 64 64 A E H X S+ 0 0 74 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.859 109.6 51.7 -69.7 -40.3 40.7 -13.6 22.7 65 65 A K H X S+ 0 0 137 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.951 111.0 48.5 -62.3 -49.5 38.1 -12.1 24.9 66 66 A L H X S+ 0 0 4 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.913 111.0 51.7 -54.4 -43.1 38.2 -8.9 22.9 67 67 A F H X S+ 0 0 12 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.927 108.1 51.4 -61.4 -44.9 37.8 -11.0 19.7 68 68 A N H X S+ 0 0 89 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.955 111.4 47.4 -57.8 -47.4 34.8 -12.9 21.1 69 69 A Q H X S+ 0 0 95 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.919 111.9 50.4 -60.5 -43.0 33.1 -9.6 22.0 70 70 A D H X S+ 0 0 37 -4,-2.6 4,-1.8 -5,-0.2 -1,-0.2 0.830 109.5 47.6 -64.7 -38.2 33.9 -8.1 18.6 71 71 A V H X S+ 0 0 6 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.929 113.3 51.4 -66.8 -41.3 32.6 -11.0 16.5 72 72 A D H X S+ 0 0 87 -4,-2.3 4,-2.6 -5,-0.3 5,-0.3 0.934 110.4 47.1 -56.9 -50.0 29.4 -11.0 18.7 73 73 A A H X S+ 0 0 44 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.870 110.7 54.1 -62.3 -36.9 28.9 -7.3 18.2 74 74 A A H X S+ 0 0 8 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.963 110.9 44.2 -61.4 -53.5 29.4 -7.8 14.4 75 75 A V H X S+ 0 0 32 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.938 116.3 46.8 -53.5 -52.9 26.8 -10.4 14.2 76 76 A R H X S+ 0 0 109 -4,-2.6 4,-1.9 1,-0.2 5,-0.2 0.913 110.1 54.8 -59.3 -42.7 24.3 -8.4 16.4 77 77 A G H X S+ 0 0 2 -4,-2.5 4,-0.6 -5,-0.3 3,-0.4 0.966 108.6 46.3 -59.9 -46.7 25.0 -5.4 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.5 3,-0.8 1,-0.2 7,-0.4 0.904 111.2 53.0 -58.3 -42.3 24.1 -7.1 11.1 79 79 A L H 3< S+ 0 0 71 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.755 112.4 45.7 -65.8 -24.9 20.9 -8.5 12.6 80 80 A R H 3< S+ 0 0 174 -4,-1.9 2,-0.5 -3,-0.4 -1,-0.3 0.415 92.9 94.7 -94.1 -9.7 19.8 -5.1 13.8 81 81 A N S+ 0 0 0 -6,-0.2 4,-2.7 -7,-0.2 3,-0.4 0.811 101.3 70.0 -86.6 -42.7 22.2 -5.9 6.2 85 85 A K H X S+ 0 0 79 -4,-2.3 4,-3.5 -7,-0.4 5,-0.2 0.901 99.4 48.2 -46.3 -49.3 19.8 -8.2 8.0 86 86 A P H > S+ 0 0 53 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.860 112.3 49.7 -64.6 -34.8 17.9 -9.3 4.8 87 87 A V H > S+ 0 0 2 -3,-0.4 4,-0.8 -4,-0.3 3,-0.3 0.944 112.3 48.1 -65.4 -47.9 21.1 -9.9 3.0 88 88 A Y H >< S+ 0 0 36 -4,-2.7 3,-1.2 1,-0.3 -3,-0.2 0.942 110.4 51.3 -56.9 -49.3 22.4 -12.0 5.8 89 89 A D H 3< S+ 0 0 77 -4,-3.5 -1,-0.3 -5,-0.3 -2,-0.2 0.818 107.0 54.4 -62.1 -27.7 19.2 -13.9 6.0 90 90 A S H 3< S+ 0 0 31 -4,-1.2 -1,-0.3 -3,-0.3 2,-0.2 0.641 95.2 89.8 -81.3 -13.0 19.3 -14.7 2.3 91 91 A L S << S- 0 0 6 -3,-1.2 31,-0.0 -4,-0.8 30,-0.0 -0.568 74.6-117.4 -89.8 159.4 22.7 -16.2 2.4 92 92 A D > - 0 0 53 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.131 45.9 -91.0 -74.9 168.5 24.1 -19.7 2.9 93 93 A A H > S+ 0 0 74 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.862 122.1 45.1 -55.6 -41.6 26.4 -20.4 5.9 94 94 A V H >> S+ 0 0 25 2,-0.2 4,-1.3 62,-0.2 3,-0.7 0.948 112.7 48.4 -70.7 -49.5 29.7 -19.7 4.2 95 95 A R H 3> S+ 0 0 24 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.865 104.1 63.5 -59.5 -32.1 28.7 -16.5 2.5 96 96 A R H 3X S+ 0 0 81 -4,-2.2 4,-2.2 1,-0.2 -1,-0.3 0.929 100.1 53.2 -57.5 -38.2 27.3 -15.4 5.8 97 97 A C H S+ 0 0 53 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.864 127.3 57.5 -51.8 -45.8 28.1 -1.8 9.6 109 109 A T H > S+ 0 0 123 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.941 107.0 46.2 -58.7 -47.6 27.9 1.7 8.2 110 110 A G H < S+ 0 0 31 -4,-0.6 3,-0.4 2,-0.2 -1,-0.2 0.885 113.2 46.4 -66.1 -39.8 30.5 1.1 5.7 111 111 A V H >< S+ 0 0 0 -4,-1.8 3,-2.8 1,-0.2 -1,-0.2 0.921 105.0 63.4 -68.8 -38.1 29.2 -2.2 4.4 112 112 A A H 3< S+ 0 0 14 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.792 94.0 63.4 -55.7 -25.2 25.7 -0.7 4.3 113 113 A G T 3< S+ 0 0 59 -4,-1.0 2,-0.8 -3,-0.4 3,-0.3 0.508 77.5 86.1 -78.5 -2.3 27.1 1.7 1.7 114 114 A F <> + 0 0 38 -3,-2.8 4,-2.2 1,-0.2 3,-0.5 -0.189 57.4 156.7 -89.3 51.1 27.8 -1.1 -0.7 115 115 A T H > + 0 0 69 -2,-0.8 4,-1.9 1,-0.3 -1,-0.2 0.848 65.6 44.1 -40.0 -56.4 24.2 -0.9 -2.0 116 116 A N H > S+ 0 0 95 -3,-0.3 4,-2.1 1,-0.2 -1,-0.3 0.885 113.1 48.1 -63.8 -45.5 24.6 -2.3 -5.3 117 117 A S H > S+ 0 0 0 -3,-0.5 4,-2.3 2,-0.2 -1,-0.2 0.849 109.6 56.0 -61.4 -41.0 26.8 -5.3 -4.3 118 118 A L H X S+ 0 0 13 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.875 107.2 50.1 -59.4 -39.3 24.3 -6.0 -1.5 119 119 A E H X S+ 0 0 106 -4,-1.9 4,-2.1 -5,-0.3 -2,-0.2 0.933 110.5 48.0 -63.5 -49.6 21.5 -6.2 -4.1 120 120 A M H <>S+ 0 0 42 -4,-2.1 5,-2.4 1,-0.2 -2,-0.2 0.911 110.9 52.6 -58.3 -41.5 23.5 -8.6 -6.3 121 121 A L H ><5S+ 0 0 1 -4,-2.3 3,-2.5 1,-0.2 -2,-0.2 0.955 108.5 48.9 -60.7 -49.8 24.2 -10.7 -3.3 122 122 A Q H 3<5S+ 0 0 92 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.855 111.6 51.2 -58.0 -34.5 20.6 -10.9 -2.3 123 123 A Q T 3<5S- 0 0 106 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.473 112.2-123.3 -81.3 1.3 19.8 -11.8 -5.8 124 124 A K T < 5 + 0 0 96 -3,-2.5 2,-1.2 1,-0.2 -3,-0.2 0.788 59.3 148.1 60.4 33.4 22.4 -14.5 -5.8 125 125 A R >< + 0 0 117 -5,-2.4 4,-2.5 1,-0.2 5,-0.2 -0.675 20.1 175.8-100.7 76.0 24.3 -13.1 -8.8 126 126 A W H > + 0 0 49 -2,-1.2 4,-1.5 1,-0.2 -1,-0.2 0.839 69.7 44.9 -49.5 -51.0 27.7 -14.3 -7.6 127 127 A D H > S+ 0 0 108 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.884 114.2 48.5 -65.4 -44.7 29.8 -13.2 -10.4 128 128 A E H > S+ 0 0 96 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.853 110.4 50.8 -68.1 -38.7 28.4 -9.8 -10.8 129 129 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.814 107.6 53.4 -66.0 -34.0 28.6 -9.1 -7.2 130 130 A A H X S+ 0 0 11 -4,-1.5 4,-1.1 2,-0.2 -2,-0.2 0.928 110.8 47.1 -66.0 -44.3 32.4 -10.1 -7.1 131 131 A V H X S+ 0 0 89 -4,-1.9 4,-0.5 1,-0.2 3,-0.5 0.910 114.8 46.8 -61.9 -45.0 33.1 -7.8 -10.0 132 132 A N H >< S+ 0 0 40 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.877 107.3 54.4 -67.8 -40.4 31.2 -4.9 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.3 6,-0.4 1,-0.2 -1,-0.2 0.820 99.1 64.7 -61.8 -30.4 32.7 -5.4 -4.9 134 134 A A H 3< S+ 0 0 28 -4,-1.1 2,-1.5 -3,-0.5 -1,-0.2 0.660 85.9 78.9 -68.8 -16.0 36.3 -5.1 -6.5 135 135 A K S << S+ 0 0 153 -3,-0.9 2,-0.3 -4,-0.5 -1,-0.2 -0.524 78.5 95.3 -93.8 68.7 35.3 -1.5 -7.4 136 136 A S S > S- 0 0 17 -2,-1.5 4,-2.0 1,-0.1 5,-0.1 -0.982 84.4-118.1-152.8 156.0 36.0 -0.0 -4.0 137 137 A R H > S+ 0 0 142 -2,-0.3 4,-3.2 1,-0.2 5,-0.3 0.905 115.7 65.3 -60.6 -40.2 38.6 1.7 -2.1 138 138 A W H > S+ 0 0 16 1,-0.2 4,-2.1 2,-0.2 8,-0.2 0.916 104.4 41.4 -45.1 -56.5 38.4 -1.4 0.1 139 139 A Y H 4 S+ 0 0 57 -6,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.918 115.6 51.5 -62.6 -44.8 39.7 -3.7 -2.7 140 140 A N H < S+ 0 0 107 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.860 115.5 40.1 -62.2 -38.3 42.3 -1.1 -3.7 141 141 A Q H < S+ 0 0 104 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.829 131.8 21.4 -80.6 -39.6 43.7 -0.7 -0.2 142 142 A T S X S+ 0 0 23 -4,-2.1 4,-2.9 -5,-0.3 5,-0.2 -0.513 74.5 162.8-127.7 64.2 43.7 -4.3 1.1 143 143 A P H > + 0 0 48 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.837 69.8 48.2 -55.7 -43.4 43.6 -6.3 -2.2 144 144 A N H > S+ 0 0 112 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.885 117.3 41.2 -67.4 -41.6 44.7 -9.7 -0.9 145 145 A R H > S+ 0 0 21 -3,-0.2 4,-2.4 2,-0.2 5,-0.3 0.924 115.4 50.9 -68.4 -47.6 42.2 -9.8 2.0 146 146 A A H X S+ 0 0 0 -4,-2.9 4,-2.9 -8,-0.2 -2,-0.2 0.945 109.4 52.7 -54.2 -44.3 39.5 -8.2 -0.2 147 147 A K H X S+ 0 0 89 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.881 106.7 52.4 -57.6 -42.2 40.2 -11.0 -2.8 148 148 A R H X S+ 0 0 50 -4,-1.6 4,-1.8 2,-0.2 12,-0.2 0.945 113.8 42.9 -58.9 -48.0 39.8 -13.7 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.919 113.1 51.1 -64.4 -46.9 36.4 -12.3 0.9 150 150 A I H X S+ 0 0 14 -4,-2.9 4,-2.4 -5,-0.3 -1,-0.2 0.924 109.5 50.4 -57.0 -47.1 35.3 -11.8 -2.6 151 151 A T H X S+ 0 0 32 -4,-2.6 4,-2.4 1,-0.2 6,-0.4 0.833 107.7 55.9 -58.2 -38.9 36.2 -15.4 -3.6 152 152 A T H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.903 112.4 40.0 -61.2 -41.5 34.3 -16.5 -0.6 153 153 A F H < S+ 0 0 2 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.868 114.8 53.9 -76.0 -34.7 31.1 -14.8 -1.8 154 154 A R H < S+ 0 0 101 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.935 125.2 20.0 -60.4 -54.1 31.8 -15.8 -5.4 155 155 A T H < S- 0 0 46 -4,-2.4 -2,-0.2 2,-0.2 -3,-0.2 0.593 85.7-133.6 -95.4 -23.9 32.1 -19.5 -4.7 156 156 A G S < S+ 0 0 17 -4,-2.1 2,-0.2 -5,-0.3 -62,-0.2 0.725 74.3 100.7 73.7 16.1 30.4 -20.2 -1.4 157 157 A T S S- 0 0 49 -6,-0.4 3,-0.4 -5,-0.2 -1,-0.3 -0.814 80.7-117.5-127.1 172.6 33.4 -22.3 -0.3 158 158 A W S >> S+ 0 0 28 -2,-0.2 3,-1.5 1,-0.2 4,-0.7 0.075 72.2 120.9 -97.0 20.4 36.5 -21.8 1.9 159 159 A D H >> + 0 0 95 1,-0.2 3,-1.0 2,-0.2 4,-0.7 0.828 65.9 59.0 -53.0 -38.5 38.9 -22.3 -0.9 160 160 A A H 34 S+ 0 0 14 -3,-0.4 -1,-0.2 1,-0.3 4,-0.2 0.743 113.1 41.3 -67.1 -17.4 40.6 -18.8 -0.6 161 161 A Y H <4 S+ 0 0 1 -3,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.447 93.5 83.2-105.3 -5.2 41.5 -19.7 3.0 162 162 A K H << S+ 0 0 134 -3,-1.0 -2,-0.1 -4,-0.7 -3,-0.1 0.813 89.7 52.4 -75.8 -27.9 42.5 -23.3 2.4 163 163 A N < 0 0 128 -4,-0.7 -1,-0.2 1,-0.1 -2,-0.1 0.833 360.0 360.0 -54.0 -49.8 45.9 -22.4 1.4 164 164 A L 0 0 120 -3,-0.2 -2,-0.2 -4,-0.2 -1,-0.1 0.650 360.0 360.0 -82.3 360.0 46.7 -20.2 4.5