#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dvh n ASP 2 N 0.00 3.83 -0.22 0.00 2.03 -1.26 -4.74 116.55 116.19 1dvh n ASP 2 Ca 0.00 0.99 -0.02 0.00 0.52 0.00 0.00 54.79 56.28 1dvh n ASP 2 Cb 0.00 -1.50 0.09 0.00 -0.72 0.00 0.00 41.12 38.99 1dvh n ASP 2 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1dvh h GLY 3 N 8.44 0.93 1.77 0.27 0.00 -1.89 0.28 103.07 112.87 1dvh h GLY 3 Ca -0.47 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 46.63 1dvh h GLY 3 CO 0.94 0.13 0.00 0.00 0.00 0.00 0.00 176.54 177.61 1dvh n ALA 4 N -2.36 1.52 -0.13 3.60 0.00 -1.26 -0.74 120.51 121.15 1dvh n ALA 4 Ca 0.08 -0.04 -0.25 0.00 0.00 0.00 0.00 53.44 53.23 1dvh n ALA 4 Cb 0.18 -1.15 -0.09 0.00 0.00 0.00 0.00 19.45 18.39 1dvh n ALA 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dvh n ALA 5 N -1.38 1.10 -0.33 0.00 0.00 -0.09 -4.38 120.51 115.43 1dvh n ALA 5 Ca 0.03 -1.00 0.03 0.00 0.00 0.00 0.00 53.44 52.51 1dvh n ALA 5 Cb 0.09 0.07 0.17 0.00 0.00 0.00 0.00 19.45 19.78 1dvh n ALA 5 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1dvh h LEU 6 N -1.00 0.85 -1.10 0.00 3.38 -0.75 -1.34 115.31 115.35 1dvh h LEU 6 Ca -0.54 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1dvh h LEU 6 Cb 1.46 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1dvh h LEU 6 CO -0.33 0.51 0.00 0.22 0.09 0.00 0.00 178.44 178.93 1dvh h TYR 7 N 0.97 0.00 0.00 1.13 3.20 -1.17 -2.81 116.97 118.29 1dvh h TYR 7 Ca 0.42 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.28 1dvh h TYR 7 Cb 0.28 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.55 1dvh h TYR 7 CO -0.03 0.00 -0.03 0.87 -1.64 0.00 0.00 178.16 177.33 1dvh h LYS 8 N 0.00 0.00 0.00 1.82 1.79 -1.44 0.75 116.57 119.49 1dvh h LYS 8 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1dvh h LYS 8 Cb 0.32 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.97 1dvh h LYS 8 CO 0.00 0.03 0.00 0.43 -1.08 0.00 0.00 179.45 178.83 1dvh n SER 9 N -3.80 0.00 -0.04 0.86 7.64 -1.06 -3.12 113.62 114.09 1dvh n SER 9 Ca -0.03 0.05 -0.06 0.00 1.01 0.00 0.00 58.87 59.85 1dvh n SER 9 Cb 0.12 -0.29 -0.05 0.00 -1.01 0.00 0.00 64.21 62.98 1dvh n SER 9 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dvh h ILE 11 N 0.00 0.23 -0.90 0.00 5.03 -1.30 0.98 117.51 121.55 1dvh h ILE 11 Ca -0.22 -0.00 0.18 0.00 -0.12 0.00 0.00 64.86 64.70 1dvh h ILE 11 Cb 1.40 0.22 -0.11 0.00 -3.03 0.00 0.00 36.82 35.30 1dvh h ILE 11 CO -0.02 0.00 0.47 1.23 -0.68 0.00 0.00 178.15 179.16 1dvh h GLY 12 N 0.01 1.54 0.00 5.37 0.00 -1.81 0.37 103.07 108.55 1dvh h GLY 12 Ca 0.74 -0.26 -0.40 0.00 0.00 0.00 0.00 47.33 47.41 1dvh h GLY 12 CO -0.02 -0.12 -2.21 0.00 0.00 0.00 0.00 176.54 174.19 1dvh h HIS 14 N -1.00 0.00 0.00 0.00 -0.00 -1.24 -3.37 115.15 109.54 1dvh h HIS 14 Ca -0.61 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.76 1dvh h HIS 14 Cb 1.53 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.94 1dvh h HIS 14 CO -0.05 0.00 0.00 0.41 -0.00 0.00 0.00 177.93 178.29 1dvh n GLY 15 N -0.31 -1.72 0.19 2.45 0.00 0.13 -0.46 105.19 105.47 1dvh n GLY 15 Ca -0.00 -1.47 -0.04 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 n ALA 16 N -1.04 -0.24 -1.80 4.61 0.00 -1.26 -0.27 120.51 120.51 1dvh n ALA 16 Ca 0.00 0.41 -0.29 0.00 0.00 0.00 0.00 53.44 53.56 1dvh n ALA 16 Cb 0.00 -0.10 0.04 0.00 0.00 0.00 0.00 19.45 19.39 1dvh n ALA 16 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1dvh n ASP 17 N -4.61 6.04 -2.68 0.00 5.75 -1.26 -4.94 116.55 114.85 1dvh n ASP 17 Ca 0.02 -3.77 -0.13 0.00 -0.01 0.00 0.00 54.79 50.90 1dvh n ASP 17 Cb 0.14 -0.61 -0.00 0.00 -1.03 0.00 0.00 41.12 39.61 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 -0.76 -0.50 0.09 6.12 0.00 0.62 -4.33 105.19 106.43 1dvh n GLY 18 Ca 0.51 0.02 -0.11 0.00 0.00 0.00 0.00 46.02 46.45 1dvh n GLY 18 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1dvh h SER 19 N -0.24 0.09 -3.68 1.61 4.64 -1.47 0.11 113.55 114.61 1dvh h SER 19 Ca -0.29 -0.17 -0.51 0.00 -0.47 0.00 0.00 61.79 60.35 1dvh h SER 19 Cb 1.21 -0.03 0.02 0.00 -0.31 0.00 0.00 62.40 63.29 1dvh h SER 19 CO 0.35 1.14 0.51 -0.54 -0.87 0.00 0.00 176.83 177.42 1dvh s LYS 20 N -2.62 4.57 -1.24 4.77 1.02 0.39 -4.79 119.74 121.85 1dvh s LYS 20 Ca -0.06 1.85 -0.19 0.00 0.02 0.00 0.00 55.97 57.59 1dvh s LYS 20 Cb 0.08 -3.21 -0.01 0.00 -0.52 0.00 0.00 37.83 34.18 1dvh s LYS 20 CO 0.82 0.07 1.94 0.00 -0.92 0.00 0.00 175.35 177.26 1dvh n ALA 21 N 1.71 3.68 -0.07 5.17 0.00 -1.26 -4.53 120.51 125.21 1dvh n ALA 21 Ca 0.01 -3.61 0.00 0.00 0.00 0.00 0.00 53.44 49.85 1dvh n ALA 21 Cb 0.45 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.33 1dvh n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dvh n ALA 22 N 8.88 0.00 0.00 0.00 0.00 -1.26 -2.20 120.51 125.93 1dvh n ALA 22 Ca 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1dvh n ALA 22 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 1dvh n ALA 22 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1dvh n MET 23 N 0.25 0.00 -0.29 0.00 2.81 -1.26 -4.23 117.12 114.40 1dvh n MET 23 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1dvh n MET 23 Cb 0.02 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.53 1dvh n MET 23 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1dvh n GLY 24 N 0.00 2.17 3.78 3.03 0.00 -1.26 -4.77 105.19 108.14 1dvh n GLY 24 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1dvh n GLY 24 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1dvh n SER 25 N 1.16 -0.91 -4.74 1.61 7.64 -0.93 -4.74 113.62 112.70 1dvh n SER 25 Ca 0.00 -0.88 -0.42 0.00 1.01 0.00 0.00 58.87 58.58 1dvh n SER 25 Cb 0.47 -3.75 -0.01 0.00 -1.01 0.00 0.00 64.21 59.90 1dvh n SER 25 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dvh n ALA 26 N -4.31 2.21 -1.66 -0.43 0.00 -1.08 -4.80 120.51 110.43 1dvh n ALA 26 Ca -0.30 0.37 -0.42 0.00 0.00 0.00 0.00 53.44 53.08 1dvh n ALA 26 Cb 0.68 -2.41 -0.03 0.00 0.00 0.00 0.00 19.45 17.69 1dvh n ALA 26 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1dvh n LYS 27 N 1.54 2.84 -0.41 0.00 2.85 -1.26 -4.18 118.16 119.54 1dvh n LYS 27 Ca 0.07 1.04 -0.16 0.00 -1.05 0.00 0.00 58.31 58.21 1dvh n LYS 27 Cb 0.37 -2.99 -0.04 0.00 -0.65 0.00 0.00 35.03 31.71 1dvh n LYS 27 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1dvh n PRO 28 N 7.49 0.00 0.23 -1.58 -0.02 -1.26 -4.78 135.00 135.08 1dvh n PRO 28 Ca 0.20 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.75 1dvh n PRO 28 Cb 0.40 -0.45 0.58 0.00 -0.02 0.00 0.00 33.50 34.01 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 2.24 1.05 -0.28 -1.45 2.07 -1.70 -3.38 116.25 114.80 1dvh h VAL 29 Ca -0.02 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1dvh h VAL 29 Cb 0.41 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 1dvh h VAL 29 CO 0.37 0.07 0.12 1.17 0.02 0.00 0.00 177.57 179.31 1dvh n LYS 30 N -4.46 0.46 0.00 1.57 0.00 -0.02 -0.52 118.16 115.18 1dvh n LYS 30 Ca -0.02 -0.93 0.00 0.00 0.00 0.00 0.00 58.31 57.36 1dvh n LYS 30 Cb 0.14 -3.57 0.00 0.00 0.00 0.00 0.00 35.03 31.60 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 6.63 1.12 3.75 3.14 0.00 -1.26 -5.00 105.19 113.57 1dvh n GLY 31 Ca 0.47 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.00 3.21 0.32 1.61 -0.21 0.32 -4.95 119.66 119.95 1dvh s GLN 32 Ca 0.00 2.13 -0.27 0.00 0.02 0.00 0.00 55.36 57.24 1dvh s GLN 32 Cb 0.00 -2.25 -0.09 0.00 1.00 0.00 0.00 33.01 31.67 1dvh s GLN 32 CO 0.00 -1.10 1.00 0.20 -2.12 0.00 0.00 175.29 173.27 1dvh s GLY 33 N -1.07 2.89 0.24 3.09 0.00 -1.26 -4.20 107.32 107.00 1dvh s GLY 33 Ca 0.71 0.66 -0.08 0.00 0.00 0.00 0.00 44.72 46.01 1dvh s GLY 33 CO 0.45 1.15 1.63 0.00 0.00 0.00 0.00 173.10 176.32 1dvh h ALA 34 N 3.27 0.71 -0.60 3.20 0.00 -1.89 0.30 119.26 124.25 1dvh h ALA 34 Ca -0.47 0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.70 1dvh h ALA 34 Cb 1.20 0.46 -0.03 0.00 0.00 0.00 0.00 17.79 19.42 1dvh h ALA 34 CO 0.65 -0.43 0.40 1.49 0.00 0.00 0.00 179.25 181.36 1dvh h GLU 35 N 0.07 0.79 0.70 0.00 4.81 -1.92 0.14 114.58 119.16 1dvh h GLU 35 Ca 0.40 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.55 1dvh h GLU 35 Cb 0.69 -0.18 0.01 0.00 0.63 0.00 0.00 28.75 29.90 1dvh h GLU 35 CO -0.69 0.52 -0.34 1.49 -0.73 0.00 0.00 179.01 179.26 1dvh h GLU 36 N 0.81 -0.91 -0.74 1.92 4.81 -1.00 0.52 114.58 120.00 1dvh h GLU 36 Ca 0.22 0.06 0.16 0.00 -0.13 0.00 0.00 59.36 59.67 1dvh h GLU 36 Cb -0.09 0.21 -0.13 0.00 0.63 0.00 0.00 28.75 29.36 1dvh h GLU 36 CO -0.05 -0.61 -0.05 -0.07 -0.73 0.00 0.00 179.01 177.51 1dvh h LEU 37 N -0.94 -0.44 -0.01 1.64 3.38 -0.46 0.14 115.31 118.61 1dvh h LEU 37 Ca -0.10 0.20 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 1dvh h LEU 37 Cb 0.72 0.37 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 1dvh h LEU 37 CO 0.15 -0.20 -0.01 0.22 0.09 0.00 0.00 178.44 178.70 1dvh h TYR 38 N 0.07 0.03 -0.99 1.13 3.20 -0.65 0.58 116.97 120.33 1dvh h TYR 38 Ca 0.39 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.31 1dvh h TYR 38 Cb 0.66 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.86 1dvh h TYR 38 CO -0.46 0.46 0.64 -0.22 -1.64 0.00 0.00 178.16 176.94 1dvh h LYS 39 N -0.42 1.15 0.12 1.82 3.64 -0.06 0.25 116.57 123.08 1dvh h LYS 39 Ca 0.00 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 1dvh h LYS 39 Cb 0.46 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1dvh h LYS 39 CO 0.00 0.76 -0.06 0.87 -2.27 0.00 0.00 179.45 178.75 1dvh h LYS 40 N 1.19 -0.16 -0.48 1.90 1.79 -0.71 -0.34 116.57 119.76 1dvh h LYS 40 Ca 0.42 0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.86 1dvh h LYS 40 Cb 0.12 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.79 1dvh h LYS 40 CO -0.16 0.18 0.12 0.52 -1.08 0.00 0.00 179.45 179.03 1dvh h MET 41 N -0.53 0.72 -0.29 3.15 2.86 -0.58 0.35 114.93 120.62 1dvh h MET 41 Ca -0.02 -0.13 -0.00 0.00 -2.06 0.00 0.00 59.70 57.49 1dvh h MET 41 Cb 0.42 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 1dvh h MET 41 CO 0.03 0.65 0.17 -0.22 1.06 0.00 0.00 176.91 178.60 1dvh h LYS 42 N 0.70 0.39 -0.12 1.72 1.63 -0.39 0.37 116.57 120.86 1dvh h LYS 42 Ca 0.16 -0.04 0.05 0.00 -0.85 0.00 0.00 60.65 59.97 1dvh h LYS 42 Cb 0.25 -0.08 -0.06 0.00 -0.60 0.00 0.00 32.23 31.74 1dvh h LYS 42 CO -0.00 0.31 -0.26 0.78 -3.45 0.00 0.00 179.45 176.83 1dvh h GLY 43 N 0.36 -0.30 1.01 5.01 0.00 -0.17 -0.37 103.07 108.61 1dvh h GLY 43 Ca 0.10 0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.70 1dvh h GLY 43 CO -0.02 -0.21 0.20 -0.97 0.00 0.00 0.00 176.54 175.54 1dvh h TYR 44 N -0.33 0.99 -0.40 5.60 0.05 -0.64 0.24 116.97 122.48 1dvh h TYR 44 Ca 0.10 -0.10 0.08 0.00 0.05 0.00 0.00 58.73 58.86 1dvh h TYR 44 Cb 0.48 -0.29 -0.08 0.00 1.01 0.00 0.00 36.73 37.86 1dvh h TYR 44 CO -0.35 0.81 -0.11 0.00 -1.05 0.00 0.00 178.16 177.46 1dvh h ALA 45 N 1.07 0.26 -0.19 3.88 0.00 0.29 0.21 119.26 124.77 1dvh h ALA 45 Ca 0.20 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1dvh h ALA 45 Cb 0.28 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1dvh h ALA 45 CO -0.01 -0.46 0.00 -0.25 0.00 0.00 0.00 179.25 178.53 1dvh n ASP 46 N -5.31 1.23 -3.12 0.00 8.00 -0.20 -4.56 116.55 112.58 1dvh n ASP 46 Ca 0.02 -1.85 -0.21 0.00 0.71 0.00 0.00 54.79 53.46 1dvh n ASP 46 Cb 0.22 -0.13 0.01 0.00 -0.02 0.00 0.00 41.12 41.20 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 0.94 -0.50 1.37 0.44 0.00 0.06 -4.87 105.19 102.62 1dvh n GLY 47 Ca 0.11 0.08 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 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 -2.27 3.46 -3.53 1.61 2.88 0.72 -4.99 113.62 111.50 1dvh n SER 48 Ca -0.06 -3.82 -0.09 0.00 -1.33 0.00 0.00 58.87 53.57 1dvh n SER 48 Cb 0.57 -0.48 -0.02 0.00 -0.75 0.00 0.00 64.21 63.53 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 -3.42 -0.38 0.31 0.66 5.04 -1.21 -4.84 117.35 113.50 1dvh s TYR 49 Ca 0.46 0.17 -0.01 0.00 -2.44 0.00 0.00 57.07 55.25 1dvh s TYR 49 Cb 0.40 0.57 0.00 0.00 0.35 0.00 0.00 41.96 43.28 1dvh s TYR 49 CO -0.01 -0.74 0.41 0.41 -1.34 0.00 0.00 175.55 174.28 1dvh n GLY 50 N -0.33 2.32 0.00 8.97 0.00 -1.26 -4.67 105.19 110.21 1dvh n GLY 50 Ca -0.11 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.29 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 -0.51 -0.41 0.33 -0.02 0.00 -1.26 -4.92 105.19 98.40 1dvh n GLY 51 Ca 0.01 -1.07 0.22 0.00 0.00 0.00 0.00 46.02 45.18 1dvh n GLY 51 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1dvh h GLU 52 N 0.00 0.35 -0.74 1.61 4.39 -2.00 -1.35 114.58 116.84 1dvh h GLU 52 Ca 0.00 -0.02 -0.51 0.00 0.34 0.00 0.00 59.36 59.17 1dvh h GLU 52 Cb 0.00 -0.08 -0.43 0.00 -0.10 0.00 0.00 28.75 28.14 1dvh h GLU 52 CO 0.00 0.23 -0.86 0.54 -1.16 0.00 0.00 179.01 177.77 1dvh n ARG 53 N -5.03 3.36 -0.28 2.33 5.12 -1.26 -4.88 116.66 116.02 1dvh n ARG 53 Ca 0.30 -4.10 0.09 0.00 -1.93 0.00 0.00 57.85 52.22 1dvh n ARG 53 Cb 0.92 -2.19 0.25 0.00 -1.16 0.00 0.00 32.46 30.28 1dvh n ARG 53 CO 0.00 0.00 0.00 1.57 -1.93 0.00 0.00 177.63 177.27 1dvh h LYS 54 N 2.25 0.35 0.09 5.56 2.10 -1.60 0.48 116.57 125.80 1dvh h LYS 54 Ca 0.30 -0.02 -0.00 0.00 -2.00 0.00 0.00 60.65 58.93 1dvh h LYS 54 Cb 1.48 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.73 1dvh h LYS 54 CO 0.69 0.23 -0.04 0.00 -2.00 0.00 0.00 179.45 178.32 1dvh h ALA 55 N 1.66 -0.12 -0.70 0.07 0.00 -1.90 0.16 119.26 118.43 1dvh h ALA 55 Ca 0.49 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.34 1dvh h ALA 55 Cb 0.88 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 1dvh h ALA 55 CO -0.51 -0.53 0.46 0.52 0.00 0.00 0.00 179.25 179.19 1dvh h MET 56 N -0.21 0.91 0.75 0.00 2.86 -1.75 0.39 114.93 117.86 1dvh h MET 56 Ca -0.01 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.54 1dvh h MET 56 Cb 0.18 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.63 1dvh h MET 56 CO 0.02 0.60 -0.46 0.52 1.06 0.00 0.00 176.91 178.65 1dvh h MET 57 N 0.93 -1.09 -0.87 1.72 2.07 -0.59 0.17 114.93 117.27 1dvh h MET 57 Ca 0.26 0.07 0.14 0.00 -2.07 0.00 0.00 59.70 58.11 1dvh h MET 57 Cb -0.09 0.25 -0.09 0.00 -1.87 0.00 0.00 31.60 29.80 1dvh h MET 57 CO -0.06 -0.73 0.47 1.15 1.07 0.00 0.00 176.91 178.81 1dvh h THR 58 N -1.13 0.77 -0.80 2.22 2.02 -0.54 0.23 112.91 115.67 1dvh h THR 58 Ca -0.10 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 66.82 1dvh h THR 58 Cb 0.91 0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 67.30 1dvh h THR 58 CO 0.10 0.12 0.41 -1.13 0.37 0.00 0.00 175.52 175.40 1dvh h ASN 59 N 0.68 1.02 0.18 4.18 -0.00 -0.44 0.25 115.58 121.45 1dvh h ASN 59 Ca 0.46 -0.10 -0.20 0.00 -0.00 0.00 0.00 56.30 56.47 1dvh h ASN 59 Cb 0.62 -0.26 -0.00 0.00 -0.00 0.00 0.00 38.32 38.68 1dvh h ASN 59 CO -0.34 0.84 -0.77 0.00 -0.00 0.00 0.00 177.43 177.16 1dvh h ALA 60 N 1.32 0.51 0.00 1.57 0.00 0.14 -3.36 119.26 119.44 1dvh h ALA 60 Ca 0.28 -0.62 -0.16 0.00 0.00 0.00 0.00 54.91 54.42 1dvh h ALA 60 Cb 0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1dvh h ALA 60 CO -0.04 0.75 -0.88 0.28 0.00 0.00 0.00 179.25 179.36 1dvh h VAL 61 N 0.33 1.04 -0.34 0.00 2.07 -0.44 -3.39 116.25 115.51 1dvh h VAL 61 Ca -0.04 -2.11 0.10 0.00 0.82 0.00 0.00 66.70 65.47 1dvh h VAL 61 Cb 1.36 2.29 -0.01 0.00 -1.52 0.00 0.00 31.29 33.41 1dvh h VAL 61 CO 0.14 0.35 0.33 0.50 0.02 0.00 0.00 177.57 178.91 1dvh h LYS 62 N -1.00 0.00 0.00 1.57 3.64 -0.69 0.92 116.57 121.01 1dvh h LYS 62 Ca -0.23 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1dvh h LYS 62 Cb 1.14 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1dvh h LYS 62 CO -0.14 0.00 0.00 1.57 -2.27 0.00 0.00 179.45 178.61 1dvh h LYS 63 N 0.00 0.00 0.00 1.90 2.10 -1.75 -3.44 116.57 115.38 1dvh h LYS 63 Ca 0.16 0.00 -0.40 0.00 -2.00 0.00 0.00 60.65 58.41 1dvh h LYS 63 Cb 0.82 0.00 0.09 0.00 -0.90 0.00 0.00 32.23 32.24 1dvh h LYS 63 CO -0.00 0.00 0.17 0.66 -2.00 0.00 0.00 179.45 178.28 1dvh n TYR 64 N -2.87 -3.25 -4.40 0.07 4.01 0.32 -5.13 117.16 105.90 1dvh n TYR 64 Ca 0.01 -1.41 -0.22 0.00 -0.16 0.00 0.00 57.90 56.12 1dvh n TYR 64 Cb 0.29 -0.70 -0.10 0.00 -0.31 0.00 0.00 39.34 38.51 1dvh n TYR 64 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1dvh s SER 65 N -4.72 3.10 0.28 7.72 0.01 -1.26 -4.99 113.70 113.83 1dvh s SER 65 Ca 0.60 -0.98 -0.02 0.00 1.31 0.00 0.00 55.95 56.85 1dvh s SER 65 Cb -0.03 -0.22 0.61 0.00 0.21 0.00 0.00 66.02 66.59 1dvh s SER 65 CO 0.40 -0.03 1.59 -2.24 0.41 0.00 0.00 173.24 173.38 1dvh h ASP 66 N 2.62 -0.47 -0.10 2.44 2.03 -1.98 0.13 116.42 121.09 1dvh h ASP 66 Ca -0.40 0.25 0.01 0.00 -0.73 0.00 0.00 57.03 56.16 1dvh h ASP 66 Cb 1.23 0.45 -0.01 0.00 -0.83 0.00 0.00 39.33 40.17 1dvh h ASP 66 CO 0.58 -0.29 0.02 -0.08 -1.03 0.00 0.00 179.24 178.44 1dvh h GLU 67 N 0.05 0.06 -0.52 4.15 4.22 -1.98 0.12 114.58 120.66 1dvh h GLU 67 Ca 0.52 -0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.94 1dvh h GLU 67 Cb 0.99 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 1dvh h GLU 67 CO -0.84 0.04 0.27 0.93 -2.18 0.00 0.00 179.01 177.22 1dvh h GLU 68 N 0.06 0.74 -0.64 1.92 5.08 -1.17 0.68 114.58 121.25 1dvh h GLU 68 Ca 0.04 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1dvh h GLU 68 Cb 0.04 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.12 1dvh h GLU 68 CO -0.06 0.60 0.39 -0.07 -1.00 0.00 0.00 179.01 178.87 1dvh h LEU 69 N 0.70 0.76 -0.34 1.33 3.38 -0.50 0.18 115.31 120.82 1dvh h LEU 69 Ca 0.18 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1dvh h LEU 69 Cb 0.09 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1dvh h LEU 69 CO -0.03 0.58 0.13 0.11 0.09 0.00 0.00 178.44 179.32 1dvh h LYS 70 N 0.86 0.52 -0.44 1.13 1.79 -0.44 -0.27 116.57 119.71 1dvh h LYS 70 Ca 0.23 -0.10 -0.01 0.00 -2.18 0.00 0.00 60.65 58.59 1dvh h LYS 70 Cb -0.04 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.51 1dvh h LYS 70 CO -0.04 0.53 0.24 0.00 -1.08 0.00 0.00 179.45 179.09 1dvh h ALA 71 N 0.97 0.57 0.71 3.86 0.00 -0.46 0.72 119.26 125.63 1dvh h ALA 71 Ca 0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1dvh h ALA 71 Cb 0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1dvh h ALA 71 CO -0.01 0.10 -0.48 -0.07 0.00 0.00 0.00 179.25 178.79 1dvh h LEU 72 N 0.58 -1.23 -0.82 0.00 3.38 -0.44 0.00 115.31 116.77 1dvh h LEU 72 Ca 0.16 0.08 0.10 0.00 0.09 0.00 0.00 57.88 58.30 1dvh h LEU 72 Cb 0.06 0.37 -0.07 0.00 0.09 0.00 0.00 40.66 41.10 1dvh h LEU 72 CO -0.02 -0.71 0.47 0.00 0.09 0.00 0.00 178.44 178.26 1dvh h ALA 73 N -1.15 1.18 -0.10 1.53 0.00 -0.92 0.31 119.26 120.11 1dvh h ALA 73 Ca -0.10 0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.89 1dvh h ALA 73 Cb 0.92 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 1dvh h ALA 73 CO 0.07 0.08 -0.18 0.22 0.00 0.00 0.00 179.25 179.44 1dvh h ASP 74 N 0.78 -0.55 0.73 0.00 3.58 -0.58 0.26 116.42 120.64 1dvh h ASP 74 Ca 0.40 0.09 -0.03 0.00 0.42 0.00 0.00 57.03 57.91 1dvh h ASP 74 Cb 0.38 0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.69 1dvh h ASP 74 CO -0.26 -0.23 -0.39 0.22 -2.88 0.00 0.00 179.24 175.70 1dvh h TYR 75 N -0.24 -1.04 -1.07 0.28 3.20 0.56 -2.91 116.97 115.74 1dvh h TYR 75 Ca 0.09 -0.02 0.29 0.00 3.14 0.00 0.00 58.73 62.23 1dvh h TYR 75 Cb 0.37 0.36 -0.08 0.00 1.54 0.00 0.00 36.73 38.91 1dvh h TYR 75 CO -0.27 -0.61 0.71 0.52 -1.64 0.00 0.00 178.16 176.86 1dvh h MET 76 N -1.03 0.27 -0.29 1.82 2.86 -0.27 0.25 114.93 118.54 1dvh h MET 76 Ca -0.10 -0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.59 1dvh h MET 76 Cb 0.81 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.40 1dvh h MET 76 CO 0.13 0.18 0.20 1.03 1.06 0.00 0.00 176.91 179.51 1dvh h SER 77 N 0.28 0.09 -1.01 1.22 0.87 -0.27 0.25 113.55 114.98 1dvh h SER 77 Ca 0.58 0.00 -0.58 0.00 -1.23 0.00 0.00 61.79 60.57 1dvh h SER 77 Cb 1.71 -0.02 -0.41 0.00 -0.44 0.00 0.00 62.40 63.24 1dvh h SER 77 CO -0.22 0.06 -0.60 2.29 -0.53 0.00 0.00 176.83 177.83 1dvh n LYS 78 N -4.47 3.47 0.00 2.24 2.85 0.81 -4.67 118.16 118.38 1dvh n LYS 78 Ca 0.03 -4.17 0.00 0.00 -1.05 0.00 0.00 58.31 53.13 1dvh n LYS 78 Cb 0.29 -2.27 0.00 0.00 -0.65 0.00 0.00 35.03 32.40 1dvh n LYS 78 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24