==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN/AGONIST 27-AUG-12 4GRV . COMPND 2 MOLECULE: NEUROTENSIN RECEPTOR TYPE 1, LYSOZYME CHIMERA; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS, ENTEROBACTERIA PHAG . AUTHOR N.NOINAJ,J.F.WHITE,Y.SHIBATA,J.LOVE,B.KLOSS,F.XU,J.GVOZDENOV . 460 4 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21447.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 346 75.2 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 . 16 3.5 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 0.4 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 . 21 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 259 56.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 3.3 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 0 2 1 1 1 0 0 0 1 0 2 0 0 1 1 0 1 0 0 0 0 0 0 1 1 3 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 52 A N 0 0 108 0, 0.0 160,-1.0 0, 0.0 161,-0.5 0.000 360.0 360.0 360.0 -69.2 91.2 -21.1 83.1 2 53 A S + 0 0 14 158,-0.2 2,-1.4 159,-0.1 3,-0.1 -0.556 360.0 169.4-137.2 71.5 91.2 -20.3 79.4 3 54 A D + 0 0 123 1,-0.2 165,-0.0 -2,-0.1 157,-0.0 -0.263 47.5 104.0 -86.6 51.4 88.4 -17.8 78.9 4 55 A L + 0 0 18 -2,-1.4 -1,-0.2 2,-0.1 2,-0.1 -0.172 54.1 132.3-113.0 32.0 89.4 -16.9 75.3 5 56 A D - 0 0 73 -3,-0.1 2,-0.4 2,-0.0 -2,-0.0 -0.470 52.0-136.4 -85.7 157.3 86.5 -19.1 74.0 6 57 A V - 0 0 19 -2,-0.1 2,-0.6 2,-0.1 72,-0.1 -0.958 5.0-150.2-115.5 133.4 84.0 -18.0 71.4 7 58 A N + 0 0 91 -2,-0.4 2,-0.5 2,-0.0 415,-0.0 -0.441 39.1 144.5-103.8 59.0 80.3 -18.8 71.9 8 59 A T - 0 0 10 -2,-0.6 -2,-0.1 1,-0.1 5,-0.1 -0.866 53.6-109.0 -94.8 126.3 79.0 -19.2 68.3 9 60 A D > - 0 0 73 -2,-0.5 4,-1.4 1,-0.1 5,-0.1 0.070 14.1-118.2 -59.7 160.8 76.3 -21.9 68.2 10 61 A I H > S+ 0 0 83 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.810 111.2 59.2 -64.6 -30.1 76.6 -25.3 66.6 11 62 A Y H > S+ 0 0 179 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.882 104.3 46.6 -74.2 -39.6 73.9 -24.5 64.1 12 63 A S H > S+ 0 0 18 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.851 111.9 53.8 -67.3 -34.0 75.5 -21.5 62.6 13 64 A K H X S+ 0 0 21 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.868 108.9 47.9 -67.9 -37.3 78.7 -23.6 62.3 14 65 A V H X S+ 0 0 81 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.915 113.1 49.7 -64.6 -45.4 76.8 -26.3 60.5 15 66 A L H X S+ 0 0 103 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.976 113.6 43.1 -54.5 -62.0 75.3 -23.6 58.2 16 67 A V H X S+ 0 0 12 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.856 112.7 55.3 -54.6 -39.5 78.7 -22.0 57.4 17 68 A T H X S+ 0 0 28 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.966 108.3 47.4 -58.4 -54.9 80.2 -25.4 57.0 18 69 A A H X S+ 0 0 54 -4,-2.8 4,-2.5 1,-0.2 3,-0.3 0.939 112.7 49.1 -47.1 -55.6 77.6 -26.4 54.4 19 70 A I H X S+ 0 0 69 -4,-2.6 4,-2.9 1,-0.3 5,-0.2 0.911 109.9 51.0 -56.6 -46.8 78.1 -23.1 52.6 20 71 A Y H X S+ 0 0 0 -4,-2.8 4,-1.4 1,-0.2 -1,-0.3 0.852 110.4 50.5 -57.5 -38.2 81.9 -23.5 52.5 21 72 A L H X S+ 0 0 87 -4,-2.2 4,-2.5 -3,-0.3 -2,-0.2 0.906 110.5 47.2 -71.4 -40.7 81.5 -27.0 51.1 22 73 A A H X S+ 0 0 52 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.966 112.8 50.0 -61.4 -51.9 79.1 -25.9 48.3 23 74 A L H X S+ 0 0 32 -4,-2.9 4,-2.5 1,-0.2 5,-0.3 0.827 110.4 53.9 -49.5 -36.2 81.5 -23.1 47.5 24 75 A F H X S+ 0 0 59 -4,-1.4 4,-2.5 -5,-0.2 5,-0.4 0.938 108.0 44.7 -71.5 -48.9 84.2 -25.7 47.5 25 76 A V H X S+ 0 0 89 -4,-2.5 4,-2.2 2,-0.2 5,-0.3 0.949 119.3 44.1 -60.6 -45.0 82.7 -28.1 45.0 26 77 A V H X S+ 0 0 75 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.961 117.3 43.2 -64.7 -54.2 81.8 -25.2 42.7 27 78 A G H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.3 5,-0.3 0.939 117.4 44.2 -58.5 -52.5 85.1 -23.4 43.0 28 79 A T H X S+ 0 0 22 -4,-2.5 4,-2.6 -5,-0.3 5,-0.3 0.950 116.5 45.3 -61.2 -52.1 87.4 -26.4 42.7 29 80 A V H X S+ 0 0 97 -4,-2.2 4,-2.9 -5,-0.4 5,-0.2 0.953 117.0 45.6 -56.1 -50.3 85.5 -28.0 39.8 30 81 A G H X S+ 0 0 14 -4,-2.6 4,-2.3 -5,-0.3 -2,-0.2 0.911 115.9 43.2 -62.7 -48.0 85.2 -24.8 37.9 31 82 A N H X S+ 0 0 1 -4,-2.7 4,-2.8 -5,-0.3 5,-0.3 0.962 117.1 46.2 -63.5 -51.0 88.7 -23.6 38.3 32 83 A S H X S+ 0 0 39 -4,-2.6 4,-2.3 -5,-0.3 5,-0.3 0.959 114.0 48.2 -54.6 -54.3 90.2 -27.0 37.6 33 84 A V H X S+ 0 0 86 -4,-2.9 4,-1.2 -5,-0.3 -1,-0.2 0.866 113.3 47.8 -59.7 -39.3 88.0 -27.6 34.6 34 85 A T H X S+ 0 0 21 -4,-2.3 4,-2.4 -5,-0.2 3,-0.5 0.964 111.3 48.8 -66.6 -50.1 88.8 -24.2 33.1 35 86 A L H < S+ 0 0 32 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.813 116.9 42.3 -65.5 -27.5 92.6 -24.4 33.6 36 87 A F H >< S+ 0 0 157 -4,-2.3 3,-0.6 -5,-0.3 -1,-0.3 0.674 110.8 56.7 -88.5 -14.6 92.7 -27.8 32.0 37 88 A T H 3< S+ 0 0 94 -4,-1.2 -2,-0.2 -3,-0.5 -3,-0.2 0.819 110.5 44.5 -81.0 -31.1 90.3 -26.8 29.3 38 89 A L T 3< S+ 0 0 42 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.1 -0.031 85.7 92.8-101.7 30.4 92.6 -24.0 28.3 39 90 A A S < S+ 0 0 73 -3,-0.6 2,-0.3 -5,-0.1 -1,-0.2 -0.287 86.5 61.3-100.5 40.6 95.6 -26.2 28.5 40 91 A R 0 0 77 -3,-0.1 -1,-0.0 0, 0.0 -4,-0.0 -0.892 360.0 360.0-166.2 131.6 94.9 -26.8 24.8 41 92 A K 0 0 159 -2,-0.3 -2,-0.1 -3,-0.0 -3,-0.0 -0.220 360.0 360.0-154.4 360.0 94.8 -24.5 21.7 42 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 43 97 A S 0 0 130 0, 0.0 86,-0.1 0, 0.0 82,-0.0 0.000 360.0 360.0 360.0 143.2 96.1 -14.3 19.6 44 98 A L >> + 0 0 30 80,-0.1 3,-2.2 84,-0.1 4,-0.7 -0.993 360.0 53.5 -97.9 -6.5 95.2 -12.0 21.1 45 99 A Q H 3> S+ 0 0 69 1,-0.3 4,-1.7 2,-0.2 5,-0.1 0.726 96.5 76.9 -54.8 -21.2 92.4 -13.8 23.1 46 100 A S H 3> S+ 0 0 33 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.896 88.3 56.3 -52.0 -43.6 95.3 -16.1 24.0 47 101 A T H <> S+ 0 0 6 -3,-2.2 4,-2.4 1,-0.3 -1,-0.2 0.917 106.3 47.8 -58.4 -46.6 96.5 -13.4 26.5 48 102 A V H X S+ 0 0 9 -4,-0.7 4,-2.4 2,-0.2 -1,-0.3 0.815 109.2 56.7 -64.6 -27.9 93.1 -13.4 28.2 49 103 A H H X S+ 0 0 56 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.956 106.5 47.1 -66.7 -48.5 93.4 -17.1 28.3 50 104 A Y H X S+ 0 0 133 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.896 112.2 51.3 -56.4 -42.9 96.7 -17.0 30.1 51 105 A H H X S+ 0 0 11 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.923 110.7 48.2 -59.2 -45.5 95.2 -14.5 32.5 52 106 A L H X S+ 0 0 19 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.912 109.6 53.2 -59.7 -45.1 92.3 -16.8 33.1 53 107 A G H X S+ 0 0 15 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.936 110.3 46.5 -56.0 -51.0 94.7 -19.7 33.7 54 108 A S H X S+ 0 0 9 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.911 112.5 51.5 -57.3 -45.1 96.6 -17.7 36.3 55 109 A L H X S+ 0 0 4 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.959 110.4 46.4 -56.3 -56.9 93.3 -16.7 37.9 56 110 A A H X S+ 0 0 3 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.861 110.9 53.9 -56.3 -40.2 91.9 -20.2 38.2 57 111 A L H X S+ 0 0 73 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.963 110.5 46.8 -58.4 -51.6 95.2 -21.4 39.6 58 112 A S H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.949 113.5 46.2 -53.4 -57.9 95.1 -18.8 42.3 59 113 A D H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.894 110.8 54.3 -54.9 -44.1 91.5 -19.4 43.3 60 114 A L H X S+ 0 0 21 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.916 109.2 48.0 -55.8 -45.5 92.2 -23.2 43.3 61 115 A L H X>S+ 0 0 56 -4,-2.3 4,-2.6 2,-0.2 5,-0.6 0.848 108.1 54.3 -69.0 -33.6 95.1 -22.7 45.7 62 116 A I H X>S+ 0 0 7 -4,-2.2 4,-1.7 1,-0.2 5,-1.2 0.968 112.3 45.2 -58.1 -51.4 93.0 -20.5 48.0 63 117 A L H <5S+ 0 0 1 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.863 118.0 42.5 -59.7 -40.2 90.4 -23.3 48.2 64 118 A L H <5S+ 0 0 81 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.906 125.9 28.4 -78.1 -42.1 93.0 -26.0 48.7 65 119 A L H X5S+ 0 0 87 -4,-2.6 4,-0.6 -5,-0.2 -3,-0.2 0.936 126.5 34.7 -88.0 -49.0 95.3 -24.3 51.2 66 120 A A H X S+ 0 0 67 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.922 116.9 41.2 -63.4 -49.9 90.5 -26.8 55.3 69 123 A V H X S+ 0 0 28 -4,-0.6 4,-3.1 1,-0.2 5,-0.5 0.932 118.5 45.7 -61.2 -48.5 92.7 -25.5 58.1 70 124 A E H X>S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 5,-1.0 0.882 107.4 59.1 -65.6 -35.2 90.7 -22.3 58.7 71 125 A L H <5S+ 0 0 23 -4,-2.8 5,-0.4 -5,-0.3 4,-0.3 0.870 116.3 35.9 -59.9 -35.2 87.5 -24.3 58.7 72 126 A Y H X>S+ 0 0 104 -4,-1.5 5,-2.7 -3,-0.3 4,-1.1 0.966 130.0 25.9 -80.9 -60.7 88.9 -26.3 61.5 73 127 A N H <5S+ 0 0 0 -4,-3.1 -3,-0.2 3,-0.2 -2,-0.2 0.794 127.2 41.8 -80.2 -28.3 90.9 -23.9 63.7 74 128 A F T <5S+ 0 0 8 -4,-1.9 -3,-0.2 -5,-0.5 -1,-0.2 0.680 129.0 21.3 -97.6 -19.5 89.1 -20.7 62.8 75 129 A I T 4 S- 0 0 93 1,-0.2 4,-0.8 2,-0.1 -1,-0.2 0.285 95.3-122.4-115.7 11.7 99.6 -26.7 63.5 84 138 A G H > - 0 0 32 -3,-0.4 4,-2.3 3,-0.2 -1,-0.2 -0.008 44.6 -58.2 73.3 178.1 102.6 -25.1 65.3 85 139 A D H > S+ 0 0 67 2,-0.2 4,-2.5 1,-0.2 5,-0.4 0.939 136.7 47.9 -63.5 -51.8 104.5 -21.9 64.5 86 140 A A H > S+ 0 0 85 1,-0.2 4,-1.9 2,-0.2 5,-0.3 0.859 110.8 54.8 -57.7 -36.9 105.5 -22.8 60.9 87 141 A G H X S+ 0 0 23 -4,-0.8 4,-2.5 3,-0.2 -1,-0.2 0.949 111.7 44.6 -57.0 -50.0 101.8 -23.8 60.5 88 142 A a H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.972 119.4 36.1 -59.9 -65.2 100.8 -20.4 61.7 89 143 A R H X S+ 0 0 68 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.885 118.8 52.9 -59.4 -41.5 103.1 -18.1 59.8 90 144 A G H X S+ 0 0 22 -4,-1.9 4,-2.6 -5,-0.4 -1,-0.2 0.931 108.6 48.9 -61.0 -49.7 103.0 -20.3 56.7 91 145 A Y H X S+ 0 0 19 -4,-2.5 4,-2.9 -5,-0.3 -2,-0.2 0.962 113.8 45.7 -52.6 -56.5 99.2 -20.3 56.6 92 146 A Y H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.867 111.9 51.2 -62.8 -37.5 99.0 -16.6 56.8 93 147 A F H X S+ 0 0 45 -4,-2.5 4,-2.8 -5,-0.2 -1,-0.2 0.919 112.3 47.1 -60.1 -46.6 101.7 -16.0 54.3 94 148 A L H X S+ 0 0 79 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.942 110.5 52.0 -62.8 -49.6 100.0 -18.3 51.8 95 149 A R H X S+ 0 0 12 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.949 113.9 44.3 -42.9 -59.1 96.6 -16.7 52.4 96 150 A D H X S+ 0 0 4 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.932 112.8 50.3 -56.5 -53.4 98.2 -13.3 51.7 97 151 A A H X S+ 0 0 14 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.938 112.6 45.7 -51.7 -55.9 100.1 -14.4 48.6 98 152 A C H X S+ 0 0 14 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.844 112.3 50.9 -61.6 -36.3 97.2 -16.0 47.0 99 153 A T H X S+ 0 0 8 -4,-2.2 4,-2.4 -5,-0.3 -1,-0.2 0.909 109.5 49.4 -70.7 -40.1 94.8 -13.1 47.7 100 154 A Y H X S+ 0 0 5 -4,-2.6 4,-2.8 -5,-0.2 5,-0.3 0.932 111.9 53.3 -56.8 -44.4 97.3 -10.6 46.2 101 155 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.953 109.3 43.9 -55.8 -56.8 97.4 -12.9 43.3 102 156 A T H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.870 116.7 48.7 -62.0 -35.3 93.7 -13.1 42.6 103 157 A A H X S+ 0 0 2 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.984 113.0 44.1 -65.2 -59.6 93.3 -9.3 43.1 104 158 A L H X S+ 0 0 38 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.846 115.6 51.6 -53.0 -38.0 96.2 -8.3 40.7 105 159 A N H X S+ 0 0 2 -4,-2.4 4,-2.3 -5,-0.3 5,-0.2 0.950 107.6 48.8 -66.9 -50.8 95.0 -10.9 38.2 106 160 A V H X S+ 0 0 3 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.939 115.4 47.4 -53.5 -47.0 91.4 -9.7 38.2 107 161 A A H X S+ 0 0 12 -4,-2.6 4,-2.1 1,-0.2 3,-0.5 0.966 110.4 49.6 -55.8 -56.9 92.8 -6.1 37.7 108 162 A S H X S+ 0 0 14 -4,-2.7 4,-2.5 1,-0.3 -1,-0.2 0.817 110.8 51.5 -56.5 -32.8 95.2 -7.1 34.9 109 163 A L H X S+ 0 0 4 -4,-2.3 4,-2.5 2,-0.2 -1,-0.3 0.858 108.3 50.4 -73.8 -35.1 92.4 -8.9 33.1 110 164 A S H X S+ 0 0 1 -4,-1.9 4,-2.0 -3,-0.5 -2,-0.2 0.822 112.5 49.1 -68.6 -31.1 90.2 -5.8 33.3 111 165 A V H X S+ 0 0 54 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.925 111.4 46.9 -72.3 -49.2 93.1 -3.8 31.9 112 166 A A H X S+ 0 0 14 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.928 115.2 46.6 -58.5 -46.9 93.7 -6.2 29.1 113 167 A R H X S+ 0 0 9 -4,-2.5 4,-2.6 2,-0.2 5,-0.4 0.909 109.8 54.1 -63.5 -42.3 90.0 -6.4 28.2 114 168 A Y H X>S+ 0 0 53 -4,-2.0 4,-2.8 -5,-0.2 5,-0.5 0.950 111.1 46.5 -52.2 -50.9 89.8 -2.6 28.5 115 169 A L H X5S+ 0 0 49 -4,-2.7 4,-2.2 1,-0.2 9,-0.6 0.938 112.5 48.7 -58.3 -50.9 92.6 -2.4 26.0 116 170 A A H <5S+ 0 0 4 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.896 121.1 34.1 -58.3 -44.6 91.2 -4.9 23.5 117 171 A I H <5S+ 0 0 27 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.876 127.0 34.8 -83.0 -37.5 87.7 -3.4 23.5 118 172 A C H <5S+ 0 0 30 -4,-2.8 -3,-0.2 -5,-0.4 -2,-0.2 0.799 131.7 26.0 -93.3 -31.3 88.5 0.3 23.8 119 173 A H S XXS+ 0 0 61 -4,-2.2 4,-1.9 -5,-0.5 5,-1.9 -0.543 73.1 160.5-128.7 67.7 91.7 0.6 21.9 120 174 A P I 4>S+ 0 0 68 0, 0.0 5,-2.2 0, 0.0 6,-0.3 0.956 80.3 22.5 -58.1 -61.8 91.5 -2.3 19.4 121 175 A F I 4>S+ 0 0 140 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-8.4 -5.4 240 1027 A I E > + C 0 244B 0 4,-1.9 4,-2.2 -2,-0.3 -12,-0.2 -0.925 51.8 10.1-144.3 174.7 72.9 -9.9 -4.3 241 1028 A G E 4 S-B 227 0B 0 -14,-1.7 2,-2.4 -2,-0.3 -14,-1.0 -0.105 125.1 -2.3 56.7-152.0 75.0 -10.1 -1.1 242 1029 A I T 4 S- 0 0 4 32,-0.6 -1,-0.2 1,-0.2 -16,-0.2 -0.467 127.6 -61.7 -71.5 76.5 73.6 -8.9 2.2 243 1030 A G T 4 S+ 0 0 11 -2,-2.4 2,-0.9 -19,-0.4 -1,-0.2 0.756 83.9 166.3 47.1 36.2 70.3 -7.8 0.6 244 1031 A H E < -C 240 0B 38 -4,-2.2 -4,-1.9 30,-0.1 2,-0.3 -0.697 25.9-148.7 -83.0 106.1 72.0 -5.2 -1.7 245 1032 A L E +C 239 0B 78 -2,-0.9 2,-0.3 -6,-0.2 -6,-0.2 -0.579 23.7 172.0 -72.0 133.8 69.6 -4.2 -4.4 246 1033 A L - 0 0 12 -8,-2.6 -8,-0.2 -2,-0.3 13,-0.1 -0.991 58.1 -1.8-142.1 148.6 71.2 -3.3 -7.7 247 1034 A T - 0 0 37 -2,-0.3 -9,-0.2 1,-0.1 -1,-0.1 0.865 66.6-170.9 39.5 59.3 69.8 -2.5 -11.1 248 1035 A K + 0 0 33 -11,-0.1 -1,-0.1 -3,-0.1 -9,-0.1 0.659 53.4 100.3 -57.1 -19.3 66.2 -3.1 -10.0 249 1036 A S S S- 0 0 65 -12,-0.1 2,-0.1 1,-0.1 6,-0.1 -0.377 84.1 -67.6 -64.4 143.7 65.0 -2.9 -13.6 250 1037 A P S S+ 0 0 115 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.516 83.1 43.9 -69.0 147.0 64.3 -6.2 -15.4 251 1038 A S S > S- 0 0 54 -2,-0.1 4,-1.2 -3,-0.1 3,-0.5 0.500 70.9-103.3-130.7-144.0 66.0 -8.3 -16.2 252 1039 A L H > S+ 0 0 56 1,-0.2 4,-0.5 2,-0.1 -22,-0.1 0.428 104.4 61.8 -54.8 -2.6 69.0 -10.6 -15.5 253 1040 A N H > S+ 0 0 130 2,-0.2 4,-2.0 3,-0.1 3,-0.5 0.955 102.0 37.9 -93.9 -60.9 71.5 -8.6 -17.6 254 1041 A A H > S+ 0 0 58 -3,-0.5 4,-3.2 1,-0.3 -2,-0.1 0.782 113.8 63.2 -62.2 -25.7 72.0 -5.0 -16.4 255 1042 A A H < S+ 0 0 0 -4,-1.2 -1,-0.3 2,-0.2 -2,-0.2 0.924 106.6 41.6 -57.4 -46.7 71.7 -6.7 -13.0 256 1043 A K H < S+ 0 0 37 -4,-0.5 3,-0.4 -3,-0.5 9,-0.3 0.779 115.3 51.0 -74.6 -28.6 74.9 -8.6 -13.9 257 1044 A S H < S+ 0 0 90 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.925 102.1 58.9 -71.5 -45.5 76.5 -5.5 -15.4 258 1045 A E S < S+ 0 0 41 -4,-3.2 2,-2.0 -5,-0.1 -1,-0.2 0.548 75.3 114.2 -63.7 -5.3 75.7 -3.4 -12.4 259 1046 A L - 0 0 10 -3,-0.4 6,-0.4 -4,-0.2 2,-0.4 -0.479 61.5-163.2 -66.8 82.5 77.8 -5.9 -10.4 260 1047 A D 0 0 113 -2,-2.0 4,-0.0 1,-0.1 -2,-0.0 -0.991 360.0 360.0-135.5 140.0 80.6 -3.5 -9.6 261 1048 A K 0 0 101 -2,-0.4 -1,-0.1 2,-0.1 -2,-0.1 -0.972 360.0 360.0 -91.0 360.0 83.3 -3.7 -8.7 262 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 263 1052 A R 0 0 143 0, 0.0 2,-1.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 142.2 85.6 -7.6 -12.1 264 1053 A N - 0 0 150 1,-0.2 -4,-0.1 2,-0.1 -7,-0.1 -0.716 360.0-171.8 -77.2 96.2 83.3 -9.7 -14.3 265 1054 A T > - 0 0 10 -2,-1.2 3,-1.5 -6,-0.4 -1,-0.2 0.844 12.8-155.1 -57.9 -39.1 81.1 -11.1 -11.5 266 1055 A N T 3 S- 0 0 148 -10,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.791 71.1 -57.9 59.1 29.4 79.3 -13.5 -13.9 267 1056 A G T 3 S+ 0 0 15 -11,-0.2 -37,-2.1 1,-0.2 2,-0.4 0.198 122.7 86.1 93.1 -15.1 76.4 -13.4 -11.4 268 1057 A V B < -D 229 0C 79 -3,-1.5 2,-0.3 -39,-0.2 -39,-0.2 -0.917 52.8-168.3-124.6 144.7 78.4 -14.7 -8.4 269 1058 A I - 0 0 13 -41,-2.0 2,-0.1 -2,-0.4 -41,-0.1 -0.854 22.5-110.8-126.7 165.6 80.5 -13.0 -5.8 270 1059 A T > - 0 0 65 -2,-0.3 4,-1.7 1,-0.1 5,-0.1 -0.380 32.8-108.2 -88.0 171.0 83.0 -14.0 -3.1 271 1060 A K H > S+ 0 0 108 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.937 117.1 49.1 -66.9 -48.8 82.4 -13.8 0.7 272 1061 A D H > S+ 0 0 74 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.758 111.9 52.4 -64.0 -24.4 84.8 -10.9 1.4 273 1062 A E H > S+ 0 0 69 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.840 105.8 51.7 -78.7 -37.5 83.2 -9.0 -1.5 274 1063 A A H X S+ 0 0 0 -4,-1.7 4,-1.5 2,-0.2 -32,-0.6 0.824 114.4 45.9 -66.5 -31.6 79.7 -9.5 -0.2 275 1064 A E H X S+ 0 0 49 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.925 110.6 49.1 -76.7 -48.7 80.9 -8.1 3.1 276 1065 A K H X S+ 0 0 51 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.794 112.9 50.9 -61.4 -28.2 82.8 -5.1 1.7 277 1066 A L H X S+ 0 0 23 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.919 108.0 51.6 -70.4 -46.7 79.7 -4.4 -0.3 278 1067 A F H X S+ 0 0 0 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.824 106.7 54.8 -59.1 -36.7 77.6 -4.6 2.9 279 1068 A N H X S+ 0 0 84 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.906 108.0 48.1 -65.0 -44.1 80.0 -2.1 4.6 280 1069 A Q H X S+ 0 0 118 -4,-1.4 4,-2.7 2,-0.2 -2,-0.2 0.906 111.2 51.3 -60.4 -44.3 79.5 0.4 1.8 281 1070 A D H X S+ 0 0 40 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.913 111.9 45.0 -62.4 -46.3 75.7 0.0 2.0 282 1071 A V H X S+ 0 0 6 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.877 113.7 52.1 -64.6 -37.1 75.6 0.6 5.8 283 1072 A D H X S+ 0 0 92 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.906 108.0 49.5 -65.4 -43.3 78.0 3.5 5.4 284 1073 A A H X S+ 0 0 45 -4,-2.7 4,-1.1 2,-0.2 -1,-0.2 0.719 108.6 56.7 -69.3 -21.6 75.8 5.2 2.7 285 1074 A A H X S+ 0 0 6 -4,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.956 109.5 41.0 -73.0 -56.2 72.8 4.7 5.0 286 1075 A V H X S+ 0 0 32 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.920 115.2 52.7 -56.5 -45.7 74.2 6.6 8.0 287 1076 A R H X S+ 0 0 137 -4,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.834 108.8 50.9 -58.9 -34.2 75.6 9.2 5.5 288 1077 A G H X S+ 0 0 10 -4,-1.1 4,-0.6 2,-0.2 3,-0.4 0.896 110.1 50.2 -67.5 -41.6 72.1 9.4 4.2 289 1078 A I H >< S+ 0 0 0 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.936 111.1 47.2 -58.4 -49.2 70.8 9.9 7.7 290 1079 A L H 3< S+ 0 0 90 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.554 111.6 49.3 -80.4 -7.7 73.3 12.6 8.6 291 1080 A R H 3< S+ 0 0 202 -4,-0.7 2,-0.5 -3,-0.4 -1,-0.3 0.497 94.5 89.5-101.8 -8.2 72.7 14.7 5.4 292 1081 A N S+ 0 0 0 -7,-0.1 4,-1.8 -6,-0.1 -2,-0.2 0.669 102.8 69.5 -89.4 -21.8 66.1 12.2 9.9 296 1085 A K H X S+ 0 0 87 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.963 97.7 44.4 -66.7 -54.8 69.3 13.7 11.5 297 1086 A P H > S+ 0 0 58 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.786 114.6 51.9 -68.3 -21.9 68.0 15.3 14.7 298 1087 A V H > S+ 0 0 4 -4,-0.4 4,-1.5 2,-0.2 -2,-0.2 0.905 110.6 48.1 -71.0 -44.7 65.9 12.2 15.4 299 1088 A Y H < S+ 0 0 30 -4,-1.8 -1,-0.2 1,-0.2 -3,-0.2 0.871 109.4 55.1 -59.6 -39.2 69.0 10.0 14.9 300 1089 A D H < S+ 0 0 49 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.884 108.7 44.9 -65.4 -41.2 70.9 12.3 17.2 301 1090 A S H < S+ 0 0 47 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.768 97.1 91.0 -78.5 -26.6 68.6 12.0 20.2 302 1091 A L S < S- 0 0 9 -4,-1.5 -3,-0.0 -5,-0.1 31,-0.0 0.032 73.1-128.4 -61.7 174.6 68.1 8.3 19.9 303 1092 A D - 0 0 65 0, 0.0 -1,-0.1 0, 0.0 -89,-0.1 0.769 43.4 -78.8 -93.2-100.4 70.4 5.8 21.8 304 1093 A A S > S+ 0 0 5 -91,-0.1 4,-0.8 63,-0.1 -89,-0.2 0.444 120.7 47.8-144.6 -28.0 72.1 2.9 20.0 305 1094 A V H > S+ 0 0 24 2,-0.2 4,-2.7 3,-0.1 3,-0.3 0.924 119.8 36.5 -84.8 -55.1 69.4 0.3 19.6 306 1095 A R H > S+ 0 0 20 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.677 114.1 62.4 -71.2 -14.1 66.7 2.5 18.2 307 1096 A R H > S+ 0 0 54 2,-0.2 4,-1.5 1,-0.1 -1,-0.2 0.865 107.2 41.5 -73.0 -38.9 69.6 4.2 16.5 308 1097 A A H X S+ 0 0 0 -4,-0.8 4,-2.4 -3,-0.3 -2,-0.2 0.901 108.2 62.7 -69.5 -42.5 70.3 0.9 14.7 309 1098 A A H X S+ 0 0 0 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.848 104.6 46.6 -52.1 -41.5 66.5 0.5 14.2 310 1099 A L H X S+ 0 0 1 -4,-1.4 4,-2.7 2,-0.2 3,-0.4 0.978 108.5 53.8 -64.1 -56.7 66.4 3.6 12.0 311 1100 A I H X S+ 0 0 2 -4,-1.5 4,-2.9 1,-0.3 -2,-0.2 0.835 105.1 57.2 -48.5 -38.0 69.5 2.6 10.0 312 1101 A N H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -1,-0.3 0.966 109.4 43.4 -54.6 -54.1 67.7 -0.6 9.3 313 1102 A M H X S+ 0 0 4 -4,-1.6 4,-2.2 -3,-0.4 5,-0.3 0.913 114.7 48.8 -60.9 -45.3 64.8 1.3 7.8 314 1103 A V H X S+ 0 0 5 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.894 111.9 50.9 -61.6 -39.6 67.0 3.7 5.8 315 1104 A F H < S+ 0 0 32 -4,-2.9 -2,-0.2 -5,-0.3 -1,-0.2 0.930 114.0 43.9 -60.5 -45.9 68.9 0.7 4.6 316 1105 A Q H < S+ 0 0 55 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.791 135.2 11.4 -71.4 -28.9 65.7 -1.0 3.5 317 1106 A M H X S- 0 0 56 -4,-2.2 4,-0.9 -5,-0.2 -3,-0.2 0.382 100.2-115.4-136.1 1.8 64.1 2.1 1.9 318 1107 A G H X - 0 0 31 -4,-2.8 4,-1.8 -5,-0.3 3,-0.3 0.163 41.5 -73.2 77.0 161.0 66.6 4.9 1.5 319 1108 A E H > S+ 0 0 20 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.771 128.4 61.1 -61.1 -26.7 66.6 8.4 3.1 320 1109 A T H 4 S+ 0 0 133 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.921 107.8 39.7 -69.2 -47.0 63.7 9.4 0.9 321 1110 A G H >< S+ 0 0 30 -4,-0.9 3,-1.7 -3,-0.3 -2,-0.2 0.925 114.3 52.0 -68.6 -46.2 61.2 6.9 2.0 322 1111 A V H >< S+ 0 0 2 -4,-1.8 3,-1.2 1,-0.3 -1,-0.2 0.797 105.0 55.9 -65.1 -29.4 62.1 7.0 5.7 323 1112 A A T 3< S+ 0 0 26 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.467 92.9 73.8 -80.2 -0.5 61.7 10.8 5.8 324 1113 A G T < S+ 0 0 53 -3,-1.7 2,-0.8 1,-0.2 -1,-0.2 0.460 75.7 80.5 -86.7 -4.0 58.2 10.2 4.4 325 1114 A F <> + 0 0 34 -3,-1.2 4,-2.2 1,-0.2 5,-0.2 -0.462 61.9 163.6 -97.0 60.1 57.2 9.0 7.9 326 1115 A T H > + 0 0 94 -2,-0.8 4,-1.8 1,-0.2 -1,-0.2 0.867 67.3 35.5 -49.4 -60.0 56.8 12.5 9.2 327 1116 A N H > S+ 0 0 95 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.838 113.0 57.9 -71.9 -33.5 54.8 12.1 12.4 328 1117 A S H > S+ 0 0 3 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.923 109.1 47.9 -59.0 -43.8 56.4 8.9 13.4 329 1118 A L H X S+ 0 0 11 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.910 106.9 56.5 -58.4 -45.2 59.7 10.8 13.3 330 1119 A R H < S+ 0 0 156 -4,-1.8 4,-0.5 1,-0.2 -1,-0.2 0.838 113.3 40.6 -59.1 -34.2 58.1 13.6 15.3 331 1120 A M H <>S+ 0 0 51 -4,-1.8 5,-2.8 2,-0.2 3,-0.3 0.857 109.7 56.5 -84.3 -37.9 57.2 11.1 18.1 332 1121 A L H ><5S+ 0 0 7 -4,-2.5 3,-1.1 1,-0.3 -2,-0.2 0.867 107.3 50.9 -59.8 -37.6 60.4 9.1 18.0 333 1122 A N T 3<5S+ 0 0 63 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.787 109.8 51.3 -68.3 -27.4 62.3 12.4 18.6 334 1123 A N T 3 5S- 0 0 68 -4,-0.5 -1,-0.2 -3,-0.3 -2,-0.2 0.244 116.3-114.1 -95.4 11.7 59.9 13.0 21.5 335 1124 A K T < 5 + 0 0 126 -3,-1.1 2,-1.4 1,-0.2 3,-0.3 0.762 66.9 146.7 60.5 27.3 60.5 9.5 23.1 336 1125 A R >< + 0 0 128 -5,-2.8 4,-2.4 1,-0.2 5,-0.3 -0.500 9.9 158.1 -88.1 65.6 56.9 8.5 22.4 337 1126 A W H > + 0 0 46 -2,-1.4 4,-1.4 2,-0.2 -1,-0.2 0.886 69.5 51.2 -56.8 -44.1 58.0 4.9 21.8 338 1127 A D H >> S+ 0 0 107 -3,-0.3 4,-1.2 2,-0.2 3,-0.6 0.988 116.5 34.3 -53.5 -69.9 54.5 3.7 22.5 339 1128 A E H 3> S+ 0 0 46 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.741 115.5 56.6 -68.2 -26.4 52.4 5.9 20.2 340 1129 A A H 3X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.820 102.2 56.4 -74.2 -30.9 55.0 6.1 17.5 341 1130 A A H < S+ 0 0 44 -4,-1.3 3,-1.4 1,-0.2 -2,-0.2 0.958 108.9 46.4 -63.3 -53.2 51.8 5.0 13.9 344 1133 A L H 3< S+ 0 0 3 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.821 106.7 59.8 -58.0 -33.3 54.3 2.9 12.0 345 1134 A A H 3< S+ 0 0 53 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.662 89.0 95.6 -73.8 -15.0 52.0 -0.1 12.2 346 1135 A K S << S- 0 0 127 -3,-1.4 5,-0.1 -4,-0.6 3,-0.1 -0.078 112.3 -57.6 -62.4 173.7 49.4 1.8 10.4 347 1136 A S S S+ 0 0 108 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 -0.470 76.6 155.1 -51.8 121.2 49.0 1.4 6.6 348 1137 A R - 0 0 19 -3,-0.2 -1,-0.2 -2,-0.1 2,-0.1 0.090 53.3-132.4-134.8 -1.0 52.6 2.6 6.4 349 1138 A W S S+ 0 0 88 1,-0.2 3,-0.3 2,-0.1 -2,-0.1 0.227 96.9 91.1 61.1 -17.0 52.6 0.6 3.1 350 1139 A Y + 0 0 13 1,-0.3 3,-0.5 -6,-0.2 -1,-0.2 0.210 60.7 84.8 -93.0 11.7 55.8 -0.8 4.5 351 1140 A N + 0 0 68 1,-0.2 -1,-0.3 -5,-0.1 -2,-0.1 -0.270 58.0 95.8 -95.2 38.0 53.6 -3.5 5.9 352 1141 A Q S S+ 0 0 92 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.511 97.2 34.4 -89.0 -19.1 54.1 -5.1 2.5 353 1142 A T S > S+ 0 0 30 -3,-0.5 4,-1.4 1,-0.1 -1,-0.2 -0.691 80.9 167.9-128.3 78.9 56.8 -6.9 4.5 354 1143 A P H > + 0 0 65 0, 0.0 4,-4.3 0, 0.0 5,-0.3 0.839 68.9 57.7 -65.6 -41.0 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