==== 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 DE NOVO PROTEIN 27-MAR-03 1OVV . COMPND 2 MOLECULE: FOUR-HELIX BUNDLE MODEL DI-CO(II)-DF1-L13A (FORM . SOURCE 2 SYNTHETIC: YES; . AUTHOR L.DI COSTANZO,S.GEREMIA . 288 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16273.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 270 93.8 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 . 0 0.0 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 . 0 0.0 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 . 5 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 228 79.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 2 5 1 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 D > 0 0 109 0, 0.0 4,-3.5 0, 0.0 6,-0.2 0.000 360.0 360.0 360.0 -56.3 -10.8 -1.6 -27.2 2 2 A Y H > + 0 0 86 2,-0.2 4,-2.0 1,-0.2 5,-0.3 0.956 360.0 48.8 -57.1 -38.4 -11.3 2.1 -27.6 3 3 A L H >> S+ 0 0 16 1,-0.3 4,-2.0 2,-0.2 3,-0.5 0.981 110.5 50.5 -66.4 -43.2 -13.1 1.6 -24.3 4 4 A R H 3> S+ 0 0 106 1,-0.2 4,-0.8 2,-0.2 -1,-0.3 0.895 107.4 53.2 -58.2 -34.4 -10.2 -0.3 -23.1 5 5 A E H 3X S+ 0 0 85 -4,-3.5 4,-2.2 1,-0.3 3,-0.3 0.845 108.5 47.8 -77.4 -26.0 -7.8 2.4 -24.2 6 6 A L H X>S+ 0 0 6 -4,-2.5 4,-2.5 1,-0.3 3,-0.7 0.906 109.5 50.3 -68.1 -38.6 2.2 15.1 -8.8 21 21 A L H 3X5S+ 0 0 52 -4,-2.4 4,-2.4 1,-0.3 -1,-0.3 0.943 105.9 59.8 -53.0 -43.2 -0.1 15.2 -5.8 22 22 A E H 3<5S+ 0 0 157 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.828 115.3 31.5 -62.6 -24.7 2.6 13.5 -4.0 23 23 A Y H <<5S+ 0 0 157 -4,-1.2 -1,-0.2 -3,-0.7 -2,-0.2 0.694 132.3 24.1-110.7 -20.3 5.0 16.4 -4.7 24 24 A V H <5S- 0 0 30 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.464 77.2-152.3-126.0 -5.7 2.9 19.5 -4.8 25 25 A K << + 0 0 135 -4,-2.4 -4,-0.1 -5,-0.5 3,-0.1 0.784 25.5 171.2 45.8 34.0 -0.2 18.7 -2.7 26 26 A L >> - 0 0 57 -6,-0.2 4,-1.6 1,-0.2 3,-1.4 -0.693 35.2-139.2 -76.3 114.6 -2.5 21.0 -4.5 27 27 A P H >> S+ 0 0 107 0, 0.0 4,-1.3 0, 0.0 3,-1.2 0.890 99.9 63.5 -31.6 -52.3 -5.9 20.2 -3.3 28 28 A V H 3> S+ 0 0 40 1,-0.3 4,-2.0 2,-0.2 5,-0.3 0.847 95.3 52.1 -55.2 -39.6 -7.0 20.6 -6.9 29 29 A L H <> S+ 0 0 2 -3,-1.4 4,-3.0 1,-0.2 -1,-0.3 0.920 106.1 63.6 -58.1 -29.6 -5.1 17.8 -8.3 30 30 A A H X S+ 0 0 0 -4,-2.0 3,-1.3 1,-0.3 4,-1.1 0.974 106.0 58.9 -68.4 -45.9 -9.4 15.7 -10.5 33 33 A L H >X S+ 0 0 17 -4,-3.0 3,-1.2 1,-0.3 4,-0.9 0.872 104.2 50.2 -40.7 -45.4 -7.7 12.6 -9.3 34 34 A E H 3X S+ 0 0 105 -4,-1.4 4,-1.3 1,-0.3 -1,-0.3 0.810 104.8 57.4 -76.9 -23.1 -11.0 11.5 -7.8 35 35 A D H > 0 0 139 0, 0.0 4,-3.0 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 -56.9 7.1 20.1 -16.1 51 2 B Y H 3> + 0 0 67 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.891 360.0 61.0 -41.9 -35.9 4.8 17.5 -14.6 52 3 B L H 3> S+ 0 0 15 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.963 105.3 43.9 -60.7 -49.0 2.1 20.3 -15.1 53 4 B R H <> S+ 0 0 79 -3,-0.5 4,-3.1 1,-0.2 -1,-0.2 0.916 112.0 54.9 -58.9 -42.4 2.7 20.3 -18.9 54 5 B E H X S+ 0 0 107 -4,-3.0 4,-2.9 2,-0.2 -1,-0.2 0.940 108.5 46.6 -55.4 -44.1 2.7 16.6 -18.8 55 6 B L H X S+ 0 0 1 -4,-2.9 4,-2.5 -5,-0.3 5,-0.3 0.984 110.8 53.8 -68.2 -46.4 -0.6 16.6 -17.1 56 7 B L H X S+ 0 0 1 -4,-3.1 4,-2.2 1,-0.2 -1,-0.3 0.875 109.3 48.5 -40.4 -51.7 -1.8 19.1 -19.6 57 8 B K H X S+ 0 0 23 -4,-3.1 4,-3.5 1,-0.2 5,-0.3 0.962 107.7 54.5 -64.8 -47.3 -0.8 16.9 -22.4 58 9 B L H X S+ 0 0 8 -4,-2.9 4,-3.6 1,-0.2 -2,-0.2 0.925 111.3 43.7 -46.2 -49.7 -2.5 13.9 -20.9 59 10 B E H X S+ 0 0 3 -4,-2.5 4,-5.4 2,-0.3 5,-0.2 0.885 112.5 51.0 -77.1 -32.0 -5.8 15.6 -20.6 60 11 B L H X S+ 0 0 13 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.926 112.3 48.6 -62.4 -43.3 -5.5 17.1 -24.1 61 12 B Q H X S+ 0 0 88 -4,-3.5 4,-1.9 -5,-0.2 -2,-0.3 0.985 117.5 44.8 -53.6 -52.2 -4.7 13.5 -25.3 62 13 B A H X S+ 0 0 7 -4,-3.6 4,-2.5 -5,-0.3 5,-0.4 0.963 108.2 51.2 -65.4 -57.8 -7.7 12.5 -23.3 63 14 B I H X S+ 0 0 5 -4,-5.4 4,-1.5 1,-0.2 -1,-0.3 0.883 110.1 54.9 -49.8 -37.9 -10.1 15.1 -24.3 64 15 B K H X S+ 0 0 64 -4,-2.3 4,-1.6 -5,-0.2 -1,-0.2 0.946 111.8 38.8 -59.2 -54.6 -9.2 14.2 -27.9 65 16 B Q H X S+ 0 0 76 -4,-1.9 4,-3.2 -3,-0.2 5,-0.3 0.865 110.5 59.8 -64.1 -37.2 -9.9 10.4 -27.7 66 17 B Y H X S+ 0 0 1 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.894 106.2 50.4 -59.4 -35.1 -13.0 10.8 -25.5 67 18 B R H X S+ 0 0 114 -4,-1.5 4,-1.9 -5,-0.4 -1,-0.2 0.948 111.1 45.0 -65.8 -48.7 -14.4 12.9 -28.3 68 19 B E H X S+ 0 0 89 -4,-1.6 4,-2.7 1,-0.2 5,-0.2 0.936 116.0 48.3 -62.9 -41.8 -13.7 10.4 -31.0 69 20 B A H X S+ 0 0 7 -4,-3.2 4,-1.8 1,-0.3 -1,-0.2 0.931 110.3 50.2 -63.2 -39.3 -15.0 7.7 -28.8 70 21 B L H < S+ 0 0 31 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.833 113.0 52.3 -71.0 -21.5 -18.1 9.8 -28.1 71 22 B E H < S+ 0 0 137 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.890 105.7 48.2 -74.1 -47.6 -18.2 10.1 -31.8 72 23 B Y H < S+ 0 0 189 -4,-2.7 2,-0.3 1,-0.3 -2,-0.2 0.861 130.9 12.1 -72.3 -29.0 -18.1 6.5 -32.8 73 24 B V S < S- 0 0 37 -4,-1.8 2,-1.5 -5,-0.2 -1,-0.3 -0.970 78.0-132.6-150.7 123.0 -20.8 5.5 -30.3 74 25 B K + 0 0 152 -2,-0.3 -4,-0.1 -3,-0.2 -3,-0.1 -0.267 39.9 158.9 -87.1 56.7 -23.0 8.0 -28.5 75 26 B L >> - 0 0 55 -2,-1.5 3,-2.2 -6,-0.2 4,-0.8 -0.649 39.0-142.4 -87.2 115.2 -22.9 6.9 -24.9 76 27 B P H 3> S+ 0 0 104 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.741 95.9 70.4 -52.2 -27.0 -23.7 9.7 -22.6 77 28 B V H 3> S+ 0 0 34 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.972 95.6 52.6 -54.7 -48.1 -21.2 8.4 -20.1 78 29 B L H <> S+ 0 0 0 -3,-2.2 4,-2.2 1,-0.3 -1,-0.2 0.882 110.9 45.0 -60.4 -34.8 -18.4 9.5 -22.4 79 30 B A H X S+ 0 0 32 -4,-0.8 4,-2.2 2,-0.3 -1,-0.3 0.923 107.6 58.9 -76.4 -33.2 -19.6 13.0 -22.8 80 31 B K H X S+ 0 0 73 -4,-2.9 4,-1.1 1,-0.3 -1,-0.2 0.893 108.6 47.5 -57.1 -36.3 -20.2 13.1 -19.1 81 32 B I H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.2 5,-0.3 0.847 103.2 60.6 -74.2 -31.7 -16.5 12.4 -19.0 82 33 B L H X S+ 0 0 22 -4,-2.2 4,-3.7 1,-0.2 5,-0.2 0.980 101.9 52.7 -57.2 -45.1 -15.6 15.1 -21.5 83 34 B E H X S+ 0 0 123 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.883 110.0 49.8 -61.4 -35.5 -17.1 17.7 -19.2 84 35 B D H >X S+ 0 0 14 -4,-1.1 4,-2.5 2,-0.2 3,-1.0 0.973 111.4 45.3 -59.8 -58.3 -14.9 16.4 -16.4 85 36 B E H 3X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.3 5,-0.2 0.905 109.2 60.4 -59.3 -33.5 -11.7 16.4 -18.4 86 37 B E H 3X S+ 0 0 51 -4,-3.7 4,-1.4 -5,-0.3 -1,-0.3 0.867 105.5 46.2 -56.7 -35.1 -12.9 19.8 -19.5 87 38 B K H < S+ 0 0 73 -4,-1.6 3,-2.1 1,-0.3 -1,-0.2 0.963 109.1 49.4 -64.3 -47.6 -5.0 28.0 -13.8 95 46 B I H 3< S+ 0 0 49 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.901 111.5 51.0 -58.6 -32.3 -2.2 26.2 -12.0 96 47 B L T 3< 0 0 14 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.3 0.555 360.0 360.0 -82.7 -3.2 -0.3 27.0 -15.1 97 48 B G < 0 0 51 -3,-2.1 -3,-0.2 -4,-0.3 -2,-0.1 0.808 360.0 360.0 71.8 360.0 -1.4 30.5 -14.6 98 !* 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 99 1 C D > 0 0 134 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -30.6 -16.1 22.4 -44.8 100 2 C Y H > + 0 0 72 2,-0.2 4,-1.0 1,-0.2 5,-0.1 0.759 360.0 55.2 -66.8 -24.9 -13.7 25.2 -45.4 101 3 C L H >> S+ 0 0 13 1,-0.2 4,-3.6 2,-0.2 3,-1.3 0.957 105.3 51.6 -72.1 -49.0 -15.6 25.5 -48.7 102 4 C R H 3> S+ 0 0 164 1,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.894 106.7 52.9 -47.7 -43.7 -18.6 25.8 -46.6 103 5 C E H 3X S+ 0 0 90 -4,-1.9 4,-1.2 2,-0.2 -1,-0.3 0.768 111.5 46.4 -65.2 -26.3 -16.9 28.6 -44.7 104 6 C L H S+ 0 0 2 -3,-1.3 4,-2.8 -4,-1.0 5,-0.5 0.919 106.8 55.0 -83.5 -52.7 -16.2 30.4 -47.9 105 7 C L H X5S+ 0 0 31 -4,-3.6 4,-1.6 1,-0.3 -2,-0.2 0.877 108.2 55.7 -39.5 -38.1 -19.6 29.9 -49.1 106 8 C K H X5S+ 0 0 155 -4,-1.6 4,-1.9 -5,-0.4 -2,-0.3 0.930 109.7 41.4 -68.1 -40.7 -20.2 31.6 -45.8 107 9 C L H X5S+ 0 0 33 -4,-1.2 4,-2.5 -3,-0.4 5,-0.3 0.973 109.1 54.0 -75.7 -51.7 -18.1 34.6 -46.5 108 10 C E H X5S+ 0 0 2 -4,-2.8 4,-2.7 1,-0.3 5,-0.3 0.963 111.7 54.2 -42.3 -47.2 -19.1 35.2 -50.0 109 11 C L H XX S+ 0 0 74 -4,-1.2 3,-1.2 -5,-0.3 4,-0.8 0.973 111.7 45.8 -59.0 -59.1 -26.9 47.1 -48.4 118 20 C A H >X S+ 0 0 10 -4,-3.7 4,-2.2 1,-0.3 3,-1.9 0.941 111.3 54.4 -46.7 -54.3 -24.4 49.6 -49.8 119 21 C L H 3< S+ 0 0 33 -4,-3.9 -1,-0.3 1,-0.3 -2,-0.2 0.704 97.9 62.1 -57.1 -26.7 -26.2 49.5 -53.1 120 22 C E H << S+ 0 0 147 -3,-1.2 -1,-0.3 -4,-1.1 -2,-0.2 0.740 112.4 37.2 -76.8 -20.2 -29.5 50.4 -51.7 121 23 C Y H << S+ 0 0 201 -3,-1.9 2,-0.4 -4,-0.8 -2,-0.2 0.847 127.8 17.9 -96.7 -48.5 -28.2 53.7 -50.4 122 24 C V < - 0 0 36 -4,-2.2 2,-1.0 2,-0.1 -1,-0.3 -0.974 69.4-133.3-131.3 149.5 -25.9 54.8 -53.2 123 25 C K + 0 0 167 -2,-0.4 3,-0.1 -3,-0.1 -4,-0.1 -0.851 38.0 155.3-105.8 98.3 -25.6 53.6 -56.7 124 26 C L >> - 0 0 57 -2,-1.0 4,-1.0 1,-0.1 3,-0.9 -0.969 33.3-150.6-118.7 114.9 -22.0 53.0 -57.6 125 27 C P H >> S+ 0 0 107 0, 0.0 4,-2.9 0, 0.0 3,-1.0 0.893 95.5 62.5 -51.4 -45.2 -21.7 50.5 -60.4 126 28 C V H 3> S+ 0 0 44 1,-0.3 4,-2.2 2,-0.2 5,-0.3 0.943 102.3 55.9 -51.7 -40.4 -18.4 49.2 -59.2 127 29 C L H <> S+ 0 0 1 -3,-0.9 4,-2.1 1,-0.2 -1,-0.3 0.885 109.4 42.1 -54.3 -44.9 -20.4 48.2 -56.2 128 30 C A H X S+ 0 0 2 -4,-2.2 4,-2.2 2,-0.3 3,-0.9 0.955 111.1 56.1 -49.3 -54.5 -18.6 43.1 -57.3 131 33 C L H >X S+ 0 0 20 -4,-2.1 4,-1.7 1,-0.3 3,-1.3 0.938 108.8 50.9 -46.1 -42.9 -21.9 42.2 -55.9 132 34 C E H 3X S+ 0 0 107 -4,-4.0 4,-1.1 1,-0.3 -1,-0.3 0.784 104.1 53.6 -72.9 -29.8 -22.2 40.5 -59.1 133 35 C D H X S+ 0 0 0 -4,-3.4 4,-2.3 1,-0.3 3,-0.8 0.956 112.3 47.1 -59.5 -47.9 -19.0 27.4 -54.4 142 44 C E H 3< S+ 0 0 105 -4,-3.2 -1,-0.3 1,-0.2 4,-0.3 0.874 101.8 63.9 -59.1 -37.9 -22.2 25.4 -54.5 143 45 C T H 3< S+ 0 0 109 -4,-2.4 -1,-0.2 3,-0.2 -2,-0.2 0.889 108.8 44.2 -57.2 -33.7 -21.2 23.5 -57.6 144 46 C I H << S+ 0 0 58 -4,-1.6 -2,-0.2 -3,-0.8 -1,-0.2 0.967 107.0 52.0 -76.0 -56.5 -18.4 22.1 -55.6 145 47 C L < 0 0 72 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.557 360.0 360.0 -57.3 2.8 -20.3 21.3 -52.5 146 48 C G 0 0 92 -5,-0.3 -3,-0.2 -4,-0.3 -2,-0.1 0.778 360.0 360.0 77.4 360.0 -22.3 19.7 -55.3 147 !* 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 0.0 148 1 D D > 0 0 129 0, 0.0 4,-1.3 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -6.5 -16.9 53.5 -43.6 149 2 D Y H > + 0 0 98 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.763 360.0 47.4 -84.9 -26.7 -18.8 50.9 -45.6 150 3 D L H > S+ 0 0 20 2,-0.2 4,-3.6 3,-0.2 -1,-0.2 0.780 112.5 52.3 -81.3 -26.0 -16.3 50.4 -48.4 151 4 D R H > S+ 0 0 138 2,-0.2 4,-2.6 3,-0.2 -2,-0.2 0.870 109.7 50.2 -73.7 -30.8 -13.7 50.1 -45.5 152 5 D E H X S+ 0 0 80 -4,-1.3 4,-2.9 2,-0.2 -2,-0.2 0.992 115.9 39.2 -61.8 -60.1 -16.1 47.5 -44.1 153 6 D L H X S+ 0 0 1 -4,-2.6 4,-3.4 1,-0.3 5,-0.4 0.894 109.7 64.0 -60.2 -40.5 -16.2 45.7 -47.4 154 7 D L H X S+ 0 0 20 -4,-3.6 4,-2.6 1,-0.2 -1,-0.3 0.972 108.1 38.2 -40.7 -61.1 -12.7 46.5 -47.7 155 8 D K H X S+ 0 0 75 -4,-2.6 4,-2.9 1,-0.3 -2,-0.2 0.906 112.0 59.4 -68.6 -36.0 -12.0 44.3 -44.6 156 9 D L H X S+ 0 0 22 -4,-2.9 4,-1.9 1,-0.2 -1,-0.3 0.925 109.8 42.7 -51.4 -49.0 -14.6 41.8 -45.7 157 10 D E H X S+ 0 0 4 -4,-3.4 4,-1.9 -3,-0.3 -1,-0.2 0.893 110.3 56.4 -67.1 -41.5 -12.6 41.3 -48.9 158 11 D L H < S+ 0 0 71 -4,-2.6 4,-0.4 -5,-0.4 -2,-0.2 0.893 108.8 48.6 -59.0 -36.4 -9.3 41.2 -47.1 159 12 D Q H >< S+ 0 0 45 -4,-2.9 3,-1.7 1,-0.2 4,-0.3 0.969 111.8 44.8 -71.6 -49.3 -10.5 38.4 -44.9 160 13 D A H >X S+ 0 0 6 -4,-1.9 4,-2.8 1,-0.3 3,-1.3 0.797 102.8 65.3 -59.8 -32.0 -11.9 36.1 -47.6 161 14 D I H 3X S+ 0 0 15 -4,-1.9 4,-0.9 1,-0.3 -1,-0.3 0.746 102.9 50.2 -70.7 -12.8 -8.9 36.6 -49.7 162 15 D K H <4 S+ 0 0 66 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.494 111.9 44.9-100.8 -1.1 -7.0 34.8 -46.9 163 16 D Q H <> S+ 0 0 26 -3,-1.3 4,-2.8 -4,-0.3 5,-0.2 0.762 112.1 51.1-100.6 -40.5 -9.4 31.9 -46.7 164 17 D Y H X S+ 0 0 1 -4,-2.8 4,-3.6 1,-0.3 5,-0.2 0.950 107.4 54.8 -59.8 -46.0 -9.6 31.4 -50.4 165 18 D R H X S+ 0 0 115 -4,-0.9 4,-1.5 -5,-0.4 -1,-0.3 0.875 108.1 50.7 -54.9 -35.3 -5.9 31.4 -50.4 166 19 D E H > S+ 0 0 44 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.924 110.4 46.2 -68.5 -46.1 -6.2 28.6 -47.8 167 20 D A H >X S+ 0 0 1 -4,-2.8 4,-1.8 1,-0.2 3,-0.6 0.925 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