#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dvh s ASP 2 N 0.00 6.65 0.20 0.00 1.11 -1.26 -4.79 116.67 118.58 1dvh s ASP 2 Ca 0.00 -1.92 -0.17 0.00 0.18 0.00 0.00 52.55 50.64 1dvh s ASP 2 Cb 0.00 -2.54 0.17 0.00 1.07 0.00 0.00 42.92 41.63 1dvh s ASP 2 CO 0.00 -1.30 1.61 1.23 1.18 0.00 0.00 175.17 177.89 1dvh h GLY 3 N 12.18 0.18 1.01 0.21 0.00 -1.90 0.16 103.07 114.90 1dvh h GLY 3 Ca 0.27 0.30 0.14 0.00 0.00 0.00 0.00 47.33 48.04 1dvh h GLY 3 CO 1.38 -0.23 0.36 0.00 0.00 0.00 0.00 176.54 178.06 1dvh h ALA 4 N 1.31 2.40 0.17 3.60 0.00 -1.89 0.51 119.26 125.36 1dvh h ALA 4 Ca 0.26 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.89 1dvh h ALA 4 Cb 0.50 0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.34 1dvh h ALA 4 CO -0.63 -0.61 -1.24 0.00 0.00 0.00 0.00 179.25 176.77 1dvh h ALA 5 N 1.72 -0.01 -0.63 0.00 0.00 -1.15 -3.30 119.26 115.88 1dvh h ALA 5 Ca 0.23 -0.89 -0.03 0.00 0.00 0.00 0.00 54.91 54.22 1dvh h ALA 5 Cb 0.95 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1dvh h ALA 5 CO -0.00 0.64 0.27 -0.07 0.00 0.00 0.00 179.25 180.09 1dvh h LEU 6 N -0.18 0.83 0.00 0.00 3.38 -0.05 -2.51 115.31 116.79 1dvh h LEU 6 Ca -0.24 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1dvh h LEU 6 Cb 1.85 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.39 1dvh h LEU 6 CO 0.16 0.73 0.00 0.00 0.09 0.00 0.00 178.44 179.42 1dvh n TYR 7 N -4.33 0.00 -0.21 1.13 9.36 0.06 -4.01 117.16 119.17 1dvh n TYR 7 Ca 0.06 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.42 1dvh n TYR 7 Cb 0.15 -0.48 0.46 0.00 -0.63 0.00 0.00 39.34 38.85 1dvh n TYR 7 CO 0.00 0.00 0.00 0.87 0.22 0.00 0.00 176.86 177.95 1dvh h LYS 8 N 0.00 0.49 0.00 2.98 1.79 -1.53 0.11 116.57 120.41 1dvh h LYS 8 Ca 0.00 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1dvh h LYS 8 Cb 0.34 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 1dvh h LYS 8 CO 0.00 0.32 0.00 -1.13 -1.08 0.00 0.00 179.45 177.56 1dvh n SER 9 N -4.51 0.00 0.00 0.86 3.41 -1.26 -3.05 113.62 109.07 1dvh n SER 9 Ca 0.16 -1.44 0.00 0.00 -0.26 0.00 0.00 58.87 57.33 1dvh n SER 9 Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 1dvh n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dvh h ILE 11 N 0.00 0.31 -0.95 0.00 1.08 -1.31 0.14 117.51 116.78 1dvh h ILE 11 Ca 0.00 -0.04 0.10 0.00 -0.39 0.00 0.00 64.86 64.53 1dvh h ILE 11 Cb 0.91 0.19 -0.07 0.00 -3.07 0.00 0.00 36.82 34.78 1dvh h ILE 11 CO 0.00 0.02 0.61 1.23 -0.69 0.00 0.00 178.15 179.32 1dvh h GLY 12 N 0.11 1.43 0.13 5.37 0.00 -1.83 0.44 103.07 108.73 1dvh h GLY 12 Ca 0.69 -0.40 -0.36 0.00 0.00 0.00 0.00 47.33 47.26 1dvh h GLY 12 CO -0.17 0.21 -2.02 0.00 0.00 0.00 0.00 176.54 174.56 1dvh h HIS 14 N -0.60 0.00 0.00 0.00 -0.00 -1.22 -3.31 115.15 110.01 1dvh h HIS 14 Ca -0.51 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.86 1dvh h HIS 14 Cb 1.65 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 29.06 1dvh h HIS 14 CO 0.03 0.27 0.00 0.41 -0.00 0.00 0.00 177.93 178.63 1dvh n GLY 15 N 0.86 -0.20 0.30 2.45 0.00 0.16 -0.58 105.19 108.17 1dvh n GLY 15 Ca 0.02 -1.64 0.11 0.00 0.00 0.00 0.00 46.02 44.50 1dvh n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dvh h ALA 16 N 0.00 1.22 -0.58 4.61 0.00 -1.97 0.58 119.26 123.12 1dvh h ALA 16 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1dvh h ALA 16 Cb 0.00 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1dvh h ALA 16 CO 0.00 -0.38 0.00 -0.40 0.00 0.00 0.00 179.25 178.47 1dvh n ASP 17 N -5.14 5.74 -1.38 0.00 5.75 -1.26 -4.95 116.55 115.30 1dvh n ASP 17 Ca 0.19 -2.93 -0.10 0.00 -0.01 0.00 0.00 54.79 51.94 1dvh n ASP 17 Cb 0.60 -0.69 -0.04 0.00 -1.03 0.00 0.00 41.12 39.96 1dvh n ASP 17 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1dvh n GLY 18 N 0.62 0.85 0.01 6.12 0.00 0.20 -4.50 105.19 108.49 1dvh n GLY 18 Ca 0.28 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.41 1dvh n GLY 18 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1dvh n SER 19 N -0.27 0.72 -4.71 1.61 7.64 -0.88 -0.84 113.62 116.89 1dvh n SER 19 Ca -0.10 -0.55 -0.42 0.00 1.01 0.00 0.00 58.87 58.81 1dvh n SER 19 Cb 0.35 0.73 -0.03 0.00 -1.01 0.00 0.00 64.21 64.25 1dvh n SER 19 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1dvh s LYS 20 N -3.06 4.50 -1.02 1.43 1.02 0.25 -4.76 119.74 118.11 1dvh s LYS 20 Ca 0.08 1.55 -0.23 0.00 0.02 0.00 0.00 55.97 57.38 1dvh s LYS 20 Cb 0.16 -3.43 -0.04 0.00 -0.52 0.00 0.00 37.83 34.01 1dvh s LYS 20 CO 0.80 -0.15 1.86 0.00 -0.92 0.00 0.00 175.35 176.94 1dvh s ALA 21 N 1.11 1.96 -0.28 5.17 0.00 -1.26 -4.43 121.76 124.04 1dvh s ALA 21 Ca 0.54 -1.88 -0.25 0.00 0.00 0.00 0.00 51.96 50.38 1dvh s ALA 21 Cb -0.24 -4.59 -0.11 0.00 0.00 0.00 0.00 23.12 18.18 1dvh s ALA 21 CO 0.28 -4.65 1.08 0.00 0.00 0.00 0.00 175.76 172.47 1dvh n ALA 22 N 12.98 -0.18 0.00 0.00 0.00 -1.25 -3.37 120.51 128.70 1dvh n ALA 22 Ca 0.41 0.16 0.00 0.00 0.00 0.00 0.00 53.44 54.01 1dvh n ALA 22 Cb 0.47 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.80 1dvh n ALA 22 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1dvh n MET 23 N 3.49 0.00 -0.26 0.00 1.56 -1.26 -0.62 117.12 120.03 1dvh n MET 23 Ca 0.26 0.00 0.18 0.00 -0.27 0.00 0.00 57.70 57.87 1dvh n MET 23 Cb -0.03 0.00 0.48 0.00 2.15 0.00 0.00 33.22 35.82 1dvh n MET 23 CO 0.00 0.00 0.00 0.78 -0.73 0.00 0.00 175.97 176.02 1dvh h GLY 24 N 0.00 1.02 0.00 -5.12 0.00 -1.91 -3.44 103.07 93.61 1dvh h GLY 24 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1dvh h GLY 24 CO 0.00 -0.01 0.00 1.44 0.00 0.00 0.00 176.54 177.97 1dvh n SER 25 N -4.55 0.00 -4.75 0.19 7.64 0.21 -5.13 113.62 107.23 1dvh n SER 25 Ca 0.20 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.72 1dvh n SER 25 Cb 0.67 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.91 1dvh n SER 25 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dvh s ALA 26 N 0.00 2.55 -0.03 -0.43 0.00 -0.54 -4.80 121.76 118.50 1dvh s ALA 26 Ca 0.00 1.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.71 1dvh s ALA 26 Cb 0.00 -3.47 -0.06 0.00 0.00 0.00 0.00 23.12 19.59 1dvh s ALA 26 CO 0.00 -1.21 1.66 0.15 0.00 0.00 0.00 175.76 176.36 1dvh s LYS 27 N -3.30 4.18 -0.27 0.00 3.01 -1.26 -4.21 119.74 117.89 1dvh s LYS 27 Ca 0.78 2.22 -0.24 0.00 -1.01 0.00 0.00 55.97 57.72 1dvh s LYS 27 Cb -0.32 -3.94 -0.10 0.00 -1.01 0.00 0.00 37.83 32.46 1dvh s LYS 27 CO 0.34 -0.83 1.06 -2.30 0.51 0.00 0.00 175.35 174.13 1dvh n PRO 28 N 6.94 0.00 0.28 -1.68 -0.02 -1.26 -4.78 135.00 134.48 1dvh n PRO 28 Ca 0.17 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.78 1dvh n PRO 28 Cb 0.42 -0.80 0.83 0.00 -0.02 0.00 0.00 33.50 33.93 1dvh n PRO 28 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1dvh h VAL 29 N 3.42 0.64 -0.56 -1.45 2.07 -1.64 -3.40 116.25 115.33 1dvh h VAL 29 Ca -0.11 -0.10 -0.31 0.00 0.82 0.00 0.00 66.70 67.00 1dvh h VAL 29 Cb 0.75 1.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.54 1dvh h VAL 29 CO 0.57 0.02 1.26 1.17 0.02 0.00 0.00 177.57 180.61 1dvh n LYS 30 N -3.96 0.46 -0.12 1.57 3.00 -0.02 -0.28 118.16 118.81 1dvh n LYS 30 Ca -0.03 -0.26 0.00 0.00 -0.00 0.00 0.00 58.31 58.02 1dvh n LYS 30 Cb 0.11 -2.62 0.00 0.00 0.00 0.00 0.00 35.03 32.52 1dvh n LYS 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1dvh n GLY 31 N 6.24 0.93 3.75 3.14 0.00 -1.26 -4.99 105.19 113.01 1dvh n GLY 31 Ca 0.52 -0.04 -0.35 0.00 0.00 0.00 0.00 46.02 46.15 1dvh n GLY 31 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dvh s GLN 32 N -0.67 2.77 0.16 1.61 -0.21 0.62 -4.93 119.66 119.00 1dvh s GLN 32 Ca 0.00 1.74 -0.31 0.00 0.02 0.00 0.00 55.36 56.81 1dvh s GLN 32 Cb 0.00 -1.91 -0.08 0.00 1.00 0.00 0.00 33.01 32.01 1dvh s GLN 32 CO 0.00 -1.34 1.33 0.20 -2.12 0.00 0.00 175.29 173.36 1dvh s GLY 33 N -1.85 2.28 0.23 3.09 0.00 -1.26 -4.23 107.32 105.57 1dvh s GLY 33 Ca 0.75 1.09 -0.09 0.00 0.00 0.00 0.00 44.72 46.47 1dvh s GLY 33 CO 0.37 2.17 1.65 0.00 0.00 0.00 0.00 173.10 177.29 1dvh h ALA 34 N 6.00 0.69 -0.77 3.20 0.00 -1.91 0.27 119.26 126.75 1dvh h ALA 34 Ca -0.44 0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.69 1dvh h ALA 34 Cb 1.21 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 19.32 1dvh h ALA 34 CO 0.81 -0.40 0.51 1.49 0.00 0.00 0.00 179.25 181.66 1dvh h GLU 35 N 0.12 1.01 0.78 0.00 4.57 -1.92 0.14 114.58 119.29 1dvh h GLU 35 Ca 0.36 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.44 1dvh h GLU 35 Cb 0.60 -0.23 0.01 0.00 -0.16 0.00 0.00 28.75 28.97 1dvh h GLU 35 CO -0.58 0.67 -0.38 1.49 -1.18 0.00 0.00 179.01 179.04 1dvh h GLU 36 N 1.04 -1.01 -0.79 1.92 4.81 -1.15 -0.89 114.58 118.52 1dvh h GLU 36 Ca 0.28 0.07 0.19 0.00 -0.13 0.00 0.00 59.36 59.77 1dvh h GLU 36 Cb -0.12 0.23 -0.13 0.00 0.63 0.00 0.00 28.75 29.36 1dvh h GLU 36 CO -0.06 -0.67 0.11 -0.07 -0.73 0.00 0.00 179.01 177.59 1dvh h LEU 37 N -1.06 -0.16 0.37 1.64 3.38 -0.43 0.15 115.31 119.20 1dvh h LEU 37 Ca -0.11 0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1dvh h LEU 37 Cb 0.80 0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1dvh h LEU 37 CO 0.18 -0.14 -0.18 0.22 0.09 0.00 0.00 178.44 178.61 1dvh h TYR 38 N 0.17 -0.46 -0.88 1.13 3.20 -0.61 0.95 116.97 120.48 1dvh h TYR 38 Ca 0.45 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.37 1dvh h TYR 38 Cb 0.83 0.15 -0.06 0.00 1.54 0.00 0.00 36.73 39.20 1dvh h TYR 38 CO -0.34 -0.17 0.55 0.87 -1.64 0.00 0.00 178.16 177.44 1dvh h LYS 39 N -0.71 1.00 0.04 1.82 1.57 -0.39 0.22 116.57 120.11 1dvh h LYS 39 Ca -0.05 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1dvh h LYS 39 Cb 0.50 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1dvh h LYS 39 CO 0.08 0.66 -0.02 0.87 -0.57 0.00 0.00 179.45 180.48 1dvh h LYS 40 N 1.03 -0.05 -0.64 3.15 1.79 -0.65 -0.62 116.57 120.59 1dvh h LYS 40 Ca 0.37 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.81 1dvh h LYS 40 Cb 0.12 0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.76 1dvh h LYS 40 CO -0.16 0.08 0.25 0.52 -1.08 0.00 0.00 179.45 179.06 1dvh h MET 41 N -0.16 0.93 -0.77 3.15 2.86 -0.26 -0.22 114.93 120.47 1dvh h MET 41 Ca -0.01 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.47 1dvh h MET 41 Cb 0.15 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.61 1dvh h MET 41 CO 0.01 0.77 0.45 -0.22 1.06 0.00 0.00 176.91 178.98 1dvh h LYS 42 N 0.92 1.06 -0.11 1.72 1.63 -0.20 0.57 116.57 122.15 1dvh h LYS 42 Ca 0.22 -0.11 0.03 0.00 -0.85 0.00 0.00 60.65 59.94 1dvh h LYS 42 Cb 0.19 -0.22 -0.04 0.00 -0.60 0.00 0.00 32.23 31.56 1dvh h LYS 42 CO -0.02 0.76 -0.11 0.78 -3.45 0.00 0.00 179.45 177.41 1dvh h GLY 43 N 1.06 -0.03 1.88 5.01 0.00 -0.09 0.71 103.07 111.62 1dvh h GLY 43 Ca 0.28 0.13 -0.09 0.00 0.00 0.00 0.00 47.33 47.65 1dvh h GLY 43 CO -0.05 -0.12 -0.38 -0.97 0.00 0.00 0.00 176.54 175.02 1dvh h TYR 44 N -0.14 0.15 0.45 5.60 0.05 -0.58 0.13 116.97 122.65 1dvh h TYR 44 Ca 0.08 -0.04 -0.02 0.00 0.05 0.00 0.00 58.73 58.80 1dvh h TYR 44 Cb 0.25 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.96 1dvh h TYR 44 CO -0.23 0.50 -0.22 0.00 -1.05 0.00 0.00 178.16 177.17 1dvh h ALA 45 N 1.50 -0.61 0.00 3.88 0.00 0.70 -3.42 119.26 121.31 1dvh h ALA 45 Ca 0.01 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 1dvh h ALA 45 Cb 0.73 0.24 -0.31 0.00 0.00 0.00 0.00 17.79 18.45 1dvh h ALA 45 CO 0.05 -0.57 -0.83 -0.25 0.00 0.00 0.00 179.25 177.66 1dvh n ASP 46 N -5.18 0.47 -0.28 0.00 8.00 0.19 -4.73 116.55 115.02 1dvh n ASP 46 Ca -0.08 -1.99 0.04 0.00 0.71 0.00 0.00 54.79 53.47 1dvh n ASP 46 Cb 0.24 -0.15 0.05 0.00 -0.02 0.00 0.00 41.12 41.25 1dvh n ASP 46 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dvh n GLY 47 N 0.36 2.11 4.22 0.44 0.00 0.35 -4.94 105.19 107.73 1dvh n GLY 47 Ca -0.03 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 1dvh n GLY 47 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1dvh n SER 48 N -0.58 -1.56 -4.72 1.61 2.88 -0.49 -4.85 113.62 105.91 1dvh n SER 48 Ca 0.06 -1.12 -0.41 0.00 -1.33 0.00 0.00 58.87 56.07 1dvh n SER 48 Cb 0.65 -1.43 -0.04 0.00 -0.75 0.00 0.00 64.21 62.64 1dvh n SER 48 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1dvh s TYR 49 N -3.04 3.74 -5.00 0.66 5.04 -0.83 -4.96 117.35 112.96 1dvh s TYR 49 Ca 0.73 1.75 0.00 0.00 -2.44 0.00 0.00 57.07 57.11 1dvh s TYR 49 Cb -0.42 -3.09 0.00 0.00 0.35 0.00 0.00 41.96 38.80 1dvh s TYR 49 CO 0.92 0.10 0.00 0.41 -1.34 0.00 0.00 175.55 175.64 1dvh n GLY 50 N 2.54 -0.83 3.57 8.97 0.00 -1.26 -4.39 105.19 113.79 1dvh n GLY 50 Ca 0.04 -1.48 -0.06 0.00 0.00 0.00 0.00 46.02 44.52 1dvh n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dvh n GLY 51 N -0.33 0.85 0.32 -0.02 0.00 -1.26 -4.99 105.19 99.76 1dvh n GLY 51 Ca 0.00 -1.19 0.01 0.00 0.00 0.00 0.00 46.02 44.84 1dvh n GLY 51 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1dvh h GLU 52 N 0.00 -0.02 -0.94 1.61 9.09 -2.00 0.22 114.58 122.54 1dvh h GLU 52 Ca -0.29 0.00 0.11 0.00 0.05 0.00 0.00 59.36 59.24 1dvh h GLU 52 Cb 1.14 0.01 -0.07 0.00 -1.65 0.00 0.00 28.75 28.18 1dvh h GLU 52 CO 0.37 -0.01 0.60 0.00 0.05 0.00 0.00 179.01 180.02 1dvh h ARG 53 N -0.02 0.87 -0.00 1.06 3.08 -2.01 -1.11 114.38 116.25 1dvh h ARG 53 Ca 0.37 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.37 1dvh h ARG 53 Cb 0.60 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1dvh h ARG 53 CO -0.84 0.57 -0.14 1.63 -1.07 0.00 0.00 179.97 180.12 1dvh n LYS 54 N -4.57 0.74 0.01 0.04 4.01 0.71 -4.15 118.16 114.95 1dvh n LYS 54 Ca 0.17 -0.30 -0.10 0.00 -0.51 0.00 0.00 58.31 57.57 1dvh n LYS 54 Cb 0.36 -1.49 -0.04 0.00 -0.51 0.00 0.00 35.03 33.35 1dvh n LYS 54 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1dvh h ALA 55 N 3.64 -0.04 -0.14 7.82 0.00 -0.37 0.10 119.26 130.27 1dvh h ALA 55 Ca 0.00 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1dvh h ALA 55 Cb 0.39 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1dvh h ALA 55 CO 0.00 -0.57 -0.02 0.52 0.00 0.00 0.00 179.25 179.18 1dvh h MET 56 N -0.14 0.02 -0.28 0.00 2.86 -1.75 -2.47 114.93 113.17 1dvh h MET 56 Ca 0.07 -0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.78 1dvh h MET 56 Cb 0.25 -0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.83 1dvh h MET 56 CO -0.18 0.01 -0.27 0.52 1.06 0.00 0.00 176.91 178.05 1dvh h MET 57 N 0.02 -0.26 -0.09 1.72 2.07 -1.63 0.22 114.93 116.98 1dvh h MET 57 Ca 0.07 0.02 0.04 0.00 -2.07 0.00 0.00 59.70 57.76 1dvh h MET 57 Cb 0.09 0.06 -0.06 0.00 -1.87 0.00 0.00 31.60 29.82 1dvh h MET 57 CO -0.13 -0.17 -0.31 1.15 1.07 0.00 0.00 176.91 178.51 1dvh h THR 58 N -0.27 0.30 -0.81 2.22 2.02 -0.56 0.71 112.91 116.53 1dvh h THR 58 Ca 0.14 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.38 1dvh h THR 58 Cb 0.49 0.30 -0.05 0.00 -1.74 0.00 0.00 68.15 67.16 1dvh h THR 58 CO -0.43 0.00 0.53 -1.13 0.37 0.00 0.00 175.52 174.86 1dvh h ASN 59 N -0.41 0.81 0.33 4.18 -0.00 -0.95 -0.65 115.58 118.89 1dvh h ASN 59 Ca 0.08 -0.00 -0.02 0.00 -0.00 0.00 0.00 56.30 56.37 1dvh h ASN 59 Cb 0.54 -0.18 0.00 0.00 -0.00 0.00 0.00 38.32 38.69 1dvh h ASN 59 CO -0.32 0.54 -0.16 0.00 -0.00 0.00 0.00 177.43 177.49 1dvh h ALA 60 N 1.55 -0.44 0.00 1.57 0.00 0.11 -3.28 119.26 118.76 1dvh h ALA 60 Ca 0.34 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1dvh h ALA 60 Cb 0.15 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1dvh h ALA 60 CO -0.11 -0.65 -0.34 -0.39 0.00 0.00 0.00 179.25 177.77 1dvh h VAL 61 N -0.65 0.52 -1.01 0.00 -1.51 -0.71 -3.32 116.25 109.56 1dvh h VAL 61 Ca -0.05 -1.74 0.27 0.00 -1.23 0.00 0.00 66.70 63.96 1dvh h VAL 61 Cb 0.46 2.24 -0.06 0.00 -2.13 0.00 0.00 31.29 31.80 1dvh h VAL 61 CO 0.07 0.30 0.69 0.50 -1.23 0.00 0.00 177.57 177.90 1dvh h LYS 62 N 0.00 0.20 0.00 5.19 1.63 -1.18 0.70 116.57 123.11 1dvh h LYS 62 Ca -0.01 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1dvh h LYS 62 Cb 1.24 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.82 1dvh h LYS 62 CO 0.04 0.13 0.00 0.36 -3.45 0.00 0.00 179.45 176.53 1dvh n LYS 63 N -4.41 0.18 -2.65 1.90 2.85 -1.25 -4.81 118.16 109.96 1dvh n LYS 63 Ca 0.23 0.07 -0.23 0.00 -1.05 0.00 0.00 58.31 57.32 1dvh n LYS 63 Cb 0.95 -1.50 0.11 0.00 -0.65 0.00 0.00 35.03 33.94 1dvh n LYS 63 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1dvh s TYR 64 N -2.79 1.40 0.17 5.58 1.51 0.24 -5.13 117.35 118.32 1dvh s TYR 64 Ca 0.18 -0.38 0.07 0.00 -1.01 0.00 0.00 57.07 55.93 1dvh s TYR 64 Cb 0.16 -2.90 -0.04 0.00 -0.11 0.00 0.00 41.96 39.07 1dvh s TYR 64 CO 0.41 -1.72 -0.15 -1.12 -1.11 0.00 0.00 175.55 171.86 1dvh s SER 65 N -4.76 2.42 0.26 2.29 0.01 -1.26 -4.99 113.70 107.67 1dvh s SER 65 Ca 0.67 -0.92 -0.10 0.00 1.31 0.00 0.00 55.95 56.91 1dvh s SER 65 Cb -0.05 -0.12 0.40 0.00 0.21 0.00 0.00 66.02 66.47 1dvh s SER 65 CO 0.44 -0.13 1.52 -0.67 0.41 0.00 0.00 173.24 174.81 1dvh n ASP 66 N 0.08 -0.41 -0.25 2.44 2.03 -1.26 -0.08 116.55 119.10 1dvh n ASP 66 Ca -0.12 1.68 -0.06 0.00 0.52 0.00 0.00 54.79 56.82 1dvh n ASP 66 Cb 0.58 -0.48 0.09 0.00 -0.72 0.00 0.00 41.12 40.59 1dvh n ASP 66 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1dvh h GLU 67 N 0.00 1.11 -0.29 -0.67 4.22 -1.98 0.66 114.58 117.64 1dvh h GLU 67 Ca 0.44 -0.23 -0.06 0.00 0.08 0.00 0.00 59.36 59.60 1dvh h GLU 67 Cb 0.68 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1dvh h GLU 67 CO -1.00 0.94 -0.05 0.93 -2.18 0.00 0.00 179.01 177.66 1dvh h GLU 68 N 1.07 0.54 -0.47 1.92 5.08 -0.90 0.08 114.58 121.91 1dvh h GLU 68 Ca 0.24 -0.20 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1dvh h GLU 68 Cb 0.28 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 1dvh h GLU 68 CO -0.01 0.72 0.22 -0.07 -1.00 0.00 0.00 179.01 178.88 1dvh h LEU 69 N 0.31 0.31 -0.06 1.33 3.38 -0.46 0.24 115.31 120.36 1dvh h LEU 69 Ca 0.08 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1dvh h LEU 69 Cb 0.51 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1dvh h LEU 69 CO 0.02 0.22 0.03 0.50 0.09 0.00 0.00 178.44 179.31 1dvh h LYS 70 N 0.45 0.06 -0.47 1.13 3.64 -0.71 -0.59 116.57 120.08 1dvh h LYS 70 Ca 0.20 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.61 1dvh h LYS 70 Cb 0.13 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 1dvh h LYS 70 CO -0.15 0.04 0.27 0.00 -2.27 0.00 0.00 179.45 177.33 1dvh h ALA 71 N 1.03 0.59 0.50 5.00 0.00 -0.45 0.49 119.26 126.42 1dvh h ALA 71 Ca 0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1dvh h ALA 71 Cb 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1dvh h ALA 71 CO -0.02 -0.05 -0.51 -0.07 0.00 0.00 0.00 179.25 178.60 1dvh h LEU 72 N 0.53 -1.40 -0.51 0.00 3.38 -0.28 -0.13 115.31 116.90 1dvh h LEU 72 Ca 0.19 0.11 0.06 0.00 0.09 0.00 0.00 57.88 58.33 1dvh h LEU 72 Cb 0.04 0.46 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 1dvh h LEU 72 CO -0.10 -0.67 0.22 0.00 0.09 0.00 0.00 178.44 177.98 1dvh h ALA 73 N -0.86 0.64 -0.56 1.53 0.00 -0.77 0.35 119.26 119.59 1dvh h ALA 73 Ca -0.06 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.00 1dvh h ALA 73 Cb 0.88 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.58 1dvh h ALA 73 CO -0.07 -0.16 0.12 -0.44 0.00 0.00 0.00 179.25 178.70 1dvh h ASP 74 N 0.43 0.00 0.35 0.00 3.32 -0.66 0.21 116.42 120.06 1dvh h ASP 74 Ca 0.24 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.37 1dvh h ASP 74 Cb 0.21 0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1dvh h ASP 74 CO -0.21 0.02 -0.17 0.22 -1.72 0.00 0.00 179.24 177.38 1dvh h TYR 75 N 0.25 -0.43 -1.31 4.55 3.20 0.43 -3.25 116.97 120.41 1dvh h TYR 75 Ca 0.29 -0.01 0.38 0.00 3.14 0.00 0.00 58.73 62.53 1dvh h TYR 75 Cb 0.42 0.14 -0.07 0.00 1.54 0.00 0.00 36.73 38.76 1dvh h TYR 75 CO -0.24 -0.27 0.92 0.52 -1.64 0.00 0.00 178.16 177.44 1dvh h MET 76 N -0.61 0.08 -0.41 1.82 2.86 -0.17 0.26 114.93 118.77 1dvh h MET 76 Ca -0.05 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1dvh h MET 76 Cb 0.36 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 1dvh h MET 76 CO 0.08 0.06 0.08 1.03 1.06 0.00 0.00 176.91 179.21 1dvh h SER 77 N 0.09 0.57 0.04 1.22 0.87 -0.62 -2.98 113.55 112.74 1dvh h SER 77 Ca 0.67 -0.09 -0.12 0.00 -1.23 0.00 0.00 61.79 61.02 1dvh h SER 77 Cb 2.42 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 64.23 1dvh h SER 77 CO -0.12 0.59 -0.59 0.11 -0.53 0.00 0.00 176.83 176.29 1dvh h LYS 78 N 0.60 0.08 0.00 2.24 1.79 -0.70 -3.35 116.57 117.23 1dvh h LYS 78 Ca 0.14 -0.13 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1dvh h LYS 78 Cb 0.27 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1dvh h LYS 78 CO 0.00 1.06 0.00 -0.11 -1.08 0.00 0.00 179.45 179.32