#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kni n LYS 3 N 0.00 2.19 0.00 0.00 4.01 -1.26 -5.13 118.16 117.97 3kni n LYS 3 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 3kni n LYS 3 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 3kni n LYS 3 CO 0.00 0.00 0.00 1.58 -1.11 0.00 0.00 177.40 177.87 3kni n HIS 4 N 0.00 0.00 -1.53 2.13 -0.00 -1.26 -4.72 115.22 109.85 3kni n HIS 4 Ca 0.00 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 57.89 3kni n HIS 4 Cb 0.00 0.00 0.12 0.00 -0.12 0.00 0.00 29.99 29.99 3kni n HIS 4 CO 0.00 0.00 0.00 -2.14 0.46 0.00 0.00 176.34 174.66 3kni s PRO 5 N -0.15 1.41 -0.14 1.57 0.02 -1.26 -5.05 135.00 131.40 3kni s PRO 5 Ca 0.00 0.41 -0.30 0.00 0.02 0.00 0.00 61.00 61.12 3kni s PRO 5 Cb 0.00 -1.86 0.12 0.00 0.02 0.00 0.00 34.50 32.78 3kni s PRO 5 CO 0.00 -2.04 0.94 0.08 -0.33 0.00 0.00 177.00 175.65 3kni s VAL 6 N -3.23 0.00 0.34 3.83 1.01 -1.26 -5.04 120.40 116.05 3kni s VAL 6 Ca 0.63 0.00 -0.28 0.00 0.00 0.00 0.00 61.98 62.33 3kni s VAL 6 Cb -0.15 -1.00 -0.10 0.00 0.00 0.00 0.00 36.38 35.13 3kni s VAL 6 CO 0.54 0.00 1.32 -2.16 0.00 0.00 0.00 175.10 174.80 3kni s PRO 7 N -1.14 4.30 -0.08 2.72 0.04 -1.26 -4.92 135.00 134.66 3kni s PRO 7 Ca -0.03 2.23 -0.21 0.00 0.04 0.00 0.00 61.00 63.03 3kni s PRO 7 Cb -0.00 -3.03 -0.29 0.00 0.04 0.00 0.00 34.50 31.22 3kni s PRO 7 CO 0.03 -0.24 0.75 -0.22 0.04 0.00 0.00 177.00 177.36 3kni h LYS 8 N 3.28 0.22 -5.07 4.56 1.63 -2.04 -3.47 116.57 115.69 3kni h LYS 8 Ca -0.49 -0.38 -0.47 0.00 -0.85 0.00 0.00 60.65 58.45 3kni h LYS 8 Cb 1.23 0.14 -0.30 0.00 -0.60 0.00 0.00 32.23 32.70 3kni h LYS 8 CO 0.65 1.18 -0.81 0.15 -3.45 0.00 0.00 179.45 177.18 3kni s LYS 9 N -2.40 1.15 0.16 1.90 -0.14 -1.26 -5.11 119.74 114.04 3kni s LYS 9 Ca -0.17 -0.45 -0.34 0.00 -1.36 0.00 0.00 55.97 53.65 3kni s LYS 9 Cb 0.01 -1.08 -0.14 0.00 -1.68 0.00 0.00 37.83 34.94 3kni s LYS 9 CO 0.78 0.24 1.46 1.17 -0.76 0.00 0.00 175.35 178.24 3kni n LYS 10 N 2.94 1.86 -2.09 1.68 4.81 -1.26 -4.84 118.16 121.25 3kni n LYS 10 Ca -0.16 0.67 -0.42 0.00 -0.87 0.00 0.00 58.31 57.53 3kni n LYS 10 Cb 0.55 -2.37 -0.03 0.00 0.02 0.00 0.00 35.03 33.20 3kni n LYS 10 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 3kni s THR 11 N 0.54 3.72 1.02 3.15 2.01 -1.26 -4.96 115.64 119.86 3kni s THR 11 Ca 0.77 0.87 -0.17 0.00 0.31 0.00 0.00 61.69 63.48 3kni s THR 11 Cb -0.74 -3.57 0.01 0.00 0.01 0.00 0.00 72.50 68.21 3kni s THR 11 CO 0.43 -0.08 -0.10 -1.54 -0.69 0.00 0.00 174.62 172.64 3kni n SER 12 N 7.05 -2.85 -0.05 3.53 3.41 -1.26 -4.67 113.62 118.78 3kni n SER 12 Ca 0.17 0.12 -0.14 0.00 -0.26 0.00 0.00 58.87 58.76 3kni n SER 12 Cb 0.43 -0.99 -0.07 0.00 -0.26 0.00 0.00 64.21 63.32 3kni n SER 12 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3kni h LYS 13 N -1.59 0.48 -0.03 4.33 1.57 -1.99 -1.46 116.57 117.87 3kni h LYS 13 Ca -0.46 -0.32 0.02 0.00 -1.87 0.00 0.00 60.65 58.02 3kni h LYS 13 Cb 1.32 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.65 3kni h LYS 13 CO 0.33 0.93 -0.09 0.00 -0.57 0.00 0.00 179.45 180.04 3kni h ALA 14 N 0.55 -0.08 -0.80 3.86 0.00 -1.99 -0.08 119.26 120.71 3kni h ALA 14 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3kni h ALA 14 Cb 0.92 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 3kni h ALA 14 CO 0.07 -0.58 0.50 -0.09 0.00 0.00 0.00 179.25 179.16 3kni h ARG 15 N -0.15 1.07 0.21 0.00 2.43 -1.90 -2.84 114.38 113.21 3kni h ARG 15 Ca 0.05 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 3kni h ARG 15 Cb 0.21 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 3kni h ARG 15 CO -0.12 0.74 -0.10 0.07 -1.51 0.00 0.00 179.97 179.05 3kni h ARG 16 N 1.10 -0.27 0.00 0.20 0.11 -0.76 -3.24 114.38 111.52 3kni h ARG 16 Ca 0.29 0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.39 3kni h ARG 16 Cb -0.08 0.06 0.00 0.00 1.11 0.00 0.00 29.97 31.06 3kni h ARG 16 CO -0.06 -0.18 0.54 -0.44 0.10 0.00 0.00 179.97 179.93 3kni h ASP 17 N -0.35 0.00 0.13 0.08 3.32 -0.99 0.39 116.42 118.99 3kni h ASP 17 Ca -0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3kni h ASP 17 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3kni h ASP 17 CO 0.05 0.00 -0.44 0.00 -1.72 0.00 0.00 179.24 177.12 3kni n ALA 18 N -1.68 3.49 0.86 3.45 0.00 -1.08 -2.89 120.51 122.67 3kni n ALA 18 Ca -0.01 -0.52 0.13 0.00 0.00 0.00 0.00 53.44 53.04 3kni n ALA 18 Cb 0.57 -0.96 0.54 0.00 0.00 0.00 0.00 19.45 19.60 3kni n ALA 18 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3kni n ARG 19 N -0.55 0.03 -0.16 0.00 0.63 0.14 -2.07 116.66 114.68 3kni n ARG 19 Ca 0.10 0.08 0.12 0.00 -0.92 0.00 0.00 57.85 57.22 3kni n ARG 19 Cb 0.39 -1.54 0.19 0.00 0.45 0.00 0.00 32.46 31.95 3kni n ARG 19 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3kni n ARG 20 N -1.60 2.44 0.00 -0.14 1.74 -1.14 -4.36 116.66 113.59 3kni n ARG 20 Ca 0.06 -2.21 0.02 0.00 -0.77 0.00 0.00 57.85 54.95 3kni n ARG 20 Cb 0.32 -1.49 0.11 0.00 -1.02 0.00 0.00 32.46 30.38 3kni n ARG 20 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3kni n SER 21 N 1.43 0.00 -0.44 0.55 3.41 -0.88 -1.90 113.62 115.80 3kni n SER 21 Ca 0.18 0.36 0.07 0.00 -0.26 0.00 0.00 58.87 59.23 3kni n SER 21 Cb 0.59 -0.40 0.17 0.00 -0.26 0.00 0.00 64.21 64.32 3kni n SER 21 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3kni n HIS 22 N -1.40 0.00 0.03 7.33 8.25 -1.26 -4.69 115.22 123.48 3kni n HIS 22 Ca 0.02 -1.23 0.11 0.00 -0.26 0.00 0.00 57.72 56.36 3kni n HIS 22 Cb 0.05 -0.20 -0.13 0.00 1.12 0.00 0.00 29.99 30.83 3kni n HIS 22 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3kni n HIS 23 N -1.14 0.25 -1.62 4.41 -0.00 -0.80 -4.98 115.22 111.34 3kni n HIS 23 Ca 0.17 0.07 -0.61 0.00 -0.00 0.00 0.00 57.72 57.35 3kni n HIS 23 Cb 0.69 -0.61 -0.08 0.00 -0.00 0.00 0.00 29.99 29.99 3kni n HIS 23 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3kni n ALA 24 N -2.23 -2.21 -1.63 -1.41 0.00 -1.26 -4.90 120.51 106.87 3kni n ALA 24 Ca -0.03 0.53 -0.33 0.00 0.00 0.00 0.00 53.44 53.61 3kni n ALA 24 Cb 0.56 -1.90 0.02 0.00 0.00 0.00 0.00 19.45 18.14 3kni n ALA 24 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3kni s LEU 25 N 1.48 3.51 -0.34 0.00 1.43 -1.26 -5.02 118.68 118.48 3kni s LEU 25 Ca 0.96 1.94 -0.10 0.00 -1.03 0.00 0.00 54.13 55.90 3kni s LEU 25 Cb -1.30 -4.55 0.01 0.00 0.03 0.00 0.00 46.19 40.38 3kni s LEU 25 CO 0.66 -1.32 0.18 0.42 0.23 0.00 0.00 176.35 176.52 3kni s THR 26 N -2.29 4.64 -0.11 5.49 -4.23 -1.26 -5.05 115.64 112.83 3kni s THR 26 Ca 0.66 -0.60 -0.41 0.00 -1.18 0.00 0.00 61.69 60.16 3kni s THR 26 Cb -0.19 -3.46 -0.19 0.00 1.34 0.00 0.00 72.50 69.99 3kni s THR 26 CO 0.36 -0.07 1.25 -0.81 -0.54 0.00 0.00 174.62 174.81 3kni n PRO 27 N 5.00 0.19 -1.30 3.99 -0.04 -1.26 -4.83 135.00 136.76 3kni n PRO 27 Ca -0.13 0.07 -0.39 0.00 -0.04 0.00 0.00 63.50 63.01 3kni n PRO 27 Cb 0.48 -1.60 0.02 0.00 -0.04 0.00 0.00 33.50 32.36 3kni n PRO 27 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3kni n PRO 28 N 2.35 0.12 -3.49 0.54 -0.04 -1.26 -4.90 135.00 128.32 3kni n PRO 28 Ca 0.22 0.05 -0.42 0.00 -0.04 0.00 0.00 63.50 63.31 3kni n PRO 28 Cb 0.07 -1.17 -0.09 0.00 -0.04 0.00 0.00 33.50 32.26 3kni n PRO 28 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 3kni s THR 29 N -1.93 4.79 0.29 0.52 -1.32 -1.26 -5.07 115.64 111.65 3kni s THR 29 Ca 0.60 -1.16 0.09 0.00 -1.21 0.00 0.00 61.69 60.01 3kni s THR 29 Cb -0.48 -3.87 -0.04 0.00 -1.51 0.00 0.00 72.50 66.60 3kni s THR 29 CO 0.63 -0.51 0.01 -0.76 -2.21 0.00 0.00 174.62 171.78 3kni s LEU 30 N 1.55 3.16 0.21 9.08 1.43 -1.26 -4.03 118.68 128.82 3kni s LEU 30 Ca 0.03 -0.71 -0.02 0.00 -1.03 0.00 0.00 54.13 52.40 3kni s LEU 30 Cb -0.23 -1.66 -0.04 0.00 0.03 0.00 0.00 46.19 44.29 3kni s LEU 30 CO 0.05 -0.07 0.18 0.68 0.23 0.00 0.00 176.35 177.42 3kni s VAL 31 N -2.37 0.00 0.00 -1.59 -7.23 0.31 -4.84 120.40 104.69 3kni s VAL 31 Ca 0.33 -1.93 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 3kni s VAL 31 Cb -0.05 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.42 3kni s VAL 31 CO 0.20 0.00 0.00 -2.65 -0.31 0.00 0.00 175.10 172.34 3kni n PRO 32 N -0.30 0.00 0.00 4.82 -0.02 -1.26 0.34 135.00 138.58 3kni n PRO 32 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 3kni n PRO 32 Cb 0.65 -0.10 0.00 0.00 -0.02 0.00 0.00 33.50 34.03 3kni n PRO 32 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kni n PRO 34 N 0.00 0.00 0.00 0.00 -0.02 -1.26 0.02 135.00 133.74 3kni n PRO 34 Ca 0.00 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 3kni n PRO 34 Cb 0.00 -0.32 0.00 0.00 -0.02 0.00 0.00 33.50 33.16 3kni n PRO 34 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3kni n GLU 35 N -0.89 0.00 -3.64 -0.52 -0.58 -1.26 -4.52 120.64 109.23 3kni n GLU 35 Ca 0.00 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.70 3kni n GLU 35 Cb 0.00 -0.92 -0.05 0.00 -0.57 0.00 0.00 31.44 29.90 3kni n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3kni h LYS 37 N 2.60 0.16 -3.77 0.00 2.10 -1.79 -3.37 116.57 112.50 3kni h LYS 37 Ca -0.17 -0.02 -0.45 0.00 -2.00 0.00 0.00 60.65 58.01 3kni h LYS 37 Cb 1.19 -0.03 0.06 0.00 -0.90 0.00 0.00 32.23 32.54 3kni h LYS 37 CO 0.21 0.22 -0.21 0.00 -2.00 0.00 0.00 179.45 177.67 3kni n ALA 38 N -2.19 -2.28 -2.01 0.07 0.00 -1.26 -4.66 120.51 108.18 3kni n ALA 38 Ca -0.05 0.31 -0.34 0.00 0.00 0.00 0.00 53.44 53.35 3kni n ALA 38 Cb 0.09 -1.04 -0.06 0.00 0.00 0.00 0.00 19.45 18.43 3kni n ALA 38 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3kni s MET 39 N -0.42 4.21 -0.06 0.00 -1.94 -1.24 -4.18 119.30 115.67 3kni s MET 39 Ca 0.46 0.92 -0.30 0.00 -1.71 0.00 0.00 55.69 55.05 3kni s MET 39 Cb -0.65 -2.57 0.08 0.00 2.01 0.00 0.00 34.83 33.69 3kni s MET 39 CO 0.35 0.21 0.74 -1.59 -0.01 0.00 0.00 175.02 174.73 3kni s LYS 40 N -2.57 0.98 0.34 2.03 0.00 0.15 -4.91 119.74 115.75 3kni s LYS 40 Ca 0.52 0.18 -0.27 0.00 0.00 0.00 0.00 55.97 56.39 3kni s LYS 40 Cb -0.13 0.46 -0.12 0.00 0.00 0.00 0.00 37.83 38.03 3kni s LYS 40 CO 0.19 -0.32 1.19 -0.35 0.00 0.00 0.00 175.35 176.06 3kni n PRO 41 N 0.76 1.85 -0.87 1.78 -0.04 -1.26 0.11 135.00 137.34 3kni n PRO 41 Ca -0.17 0.65 -0.29 0.00 -0.04 0.00 0.00 63.50 63.65 3kni n PRO 41 Cb 0.58 -2.19 0.19 0.00 -0.04 0.00 0.00 33.50 32.04 3kni n PRO 41 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3kni s PRO 42 N -1.84 0.27 -0.43 0.54 0.04 -1.26 -3.12 135.00 129.21 3kni s PRO 42 Ca 0.57 0.91 0.00 0.00 0.04 0.00 0.00 61.00 62.52 3kni s PRO 42 Cb -0.60 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.26 3kni s PRO 42 CO 0.61 -2.94 0.00 0.72 0.04 0.00 0.00 177.00 175.43 3kni n HIS 43 N -4.38 -0.04 -1.20 0.56 8.25 -1.26 -4.90 115.22 112.25 3kni n HIS 43 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 3kni n HIS 43 Cb 0.55 -2.04 0.00 0.00 1.12 0.00 0.00 29.99 29.62 3kni n HIS 43 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3kni n THR 44 N -1.76 0.00 -3.88 1.59 -2.24 -1.18 -5.10 114.28 101.71 3kni n THR 44 Ca -0.04 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.46 3kni n THR 44 Cb 0.45 -0.01 -0.16 0.00 -2.10 0.00 0.00 70.33 68.50 3kni n THR 44 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3kni s VAL 45 N 2.80 1.11 -0.38 2.28 1.01 -1.26 -4.98 120.40 120.97 3kni s VAL 45 Ca 0.00 -0.68 -0.33 0.00 0.00 0.00 0.00 61.98 60.98 3kni s VAL 45 Cb 0.00 -1.31 -0.10 0.00 0.00 0.00 0.00 36.38 34.96 3kni s VAL 45 CO 0.00 0.09 2.25 0.00 0.00 0.00 0.00 175.10 177.44 3kni n PRO 47 N 8.40 0.00 0.00 0.00 -0.04 -1.26 -0.99 135.00 141.12 3kni n PRO 47 Ca 0.40 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 3kni n PRO 47 Cb 0.29 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.68 3kni n PRO 47 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3kni n GLU 48 N 0.72 0.00 0.19 0.54 4.71 -1.26 -4.92 120.64 120.61 3kni n GLU 48 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 57.16 57.29 3kni n GLU 48 Cb 0.00 0.00 0.66 0.00 -1.01 0.00 0.00 31.44 31.09 3kni n GLU 48 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3kni n GLY 50 N -0.75 -1.64 0.00 0.00 0.00 -0.16 -4.77 105.19 97.88 3kni n GLY 50 Ca -0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.26 3kni n GLY 50 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kni n TYR 51 N -3.42 -0.31 -4.39 1.61 4.01 -1.26 -4.70 117.16 108.70 3kni n TYR 51 Ca -0.02 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.49 3kni n TYR 51 Cb 0.62 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.57 3kni n TYR 51 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 3kni s TYR 52 N 0.00 2.48 -1.17 -0.72 -0.85 -1.26 -4.55 117.35 111.27 3kni s TYR 52 Ca 0.00 -0.28 -0.05 0.00 -0.52 0.00 0.00 57.07 56.22 3kni s TYR 52 Cb 0.00 -1.09 0.05 0.00 0.38 0.00 0.00 41.96 41.29 3kni s TYR 52 CO 0.00 0.66 0.12 0.00 -1.52 0.00 0.00 175.55 174.81 3kni n ALA 53 N -0.67 -1.49 -2.41 9.51 0.00 -1.26 -4.84 120.51 119.35 3kni n ALA 53 Ca -0.06 -0.26 -0.16 0.00 0.00 0.00 0.00 53.44 52.96 3kni n ALA 53 Cb 0.59 -0.90 -0.08 0.00 0.00 0.00 0.00 19.45 19.07 3kni n ALA 53 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3kni s GLY 54 N -3.62 1.90 -1.11 0.00 0.00 -1.26 -5.10 107.32 98.13 3kni s GLY 54 Ca 0.16 -1.84 -0.04 0.00 0.00 0.00 0.00 44.72 43.00 3kni s GLY 54 CO 0.72 -1.34 1.68 -2.13 0.00 0.00 0.00 173.10 172.03 3kni n ARG 55 N -0.52 4.61 -0.05 2.90 3.00 -1.26 -4.81 116.66 120.53 3kni n ARG 55 Ca 0.05 -4.38 -0.04 0.00 -0.00 0.00 0.00 57.85 53.48 3kni n ARG 55 Cb 0.63 -2.56 0.04 0.00 0.00 0.00 0.00 32.46 30.56 3kni n ARG 55 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 3kni n LYS 56 N 1.36 -2.18 0.00 -0.14 0.00 -1.26 -4.94 118.16 111.00 3kni n LYS 56 Ca 0.35 -0.20 0.00 0.00 -0.00 0.00 0.00 58.31 58.46 3kni n LYS 56 Cb 0.31 -0.25 0.00 0.00 -0.00 0.00 0.00 35.03 35.10 3kni n LYS 56 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 3kni n VAL 57 N -3.27 0.00 -4.27 0.58 0.24 -1.26 -4.98 118.33 105.38 3kni n VAL 57 Ca 0.02 0.22 -0.17 0.00 -2.04 0.00 0.00 64.34 62.37 3kni n VAL 57 Cb 0.08 -0.78 -0.14 0.00 -1.47 0.00 0.00 33.84 31.53 3kni n VAL 57 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3kni s LEU 58 N 0.00 2.06 0.00 1.34 1.43 -1.26 -5.17 118.68 117.08 3kni s LEU 58 Ca 0.00 -0.23 0.02 0.00 -1.03 0.00 0.00 54.13 52.90 3kni s LEU 58 Cb 0.00 -0.38 -0.01 0.00 0.03 0.00 0.00 46.19 45.83 3kni s LEU 58 CO 0.00 0.05 0.09 -0.62 0.23 0.00 0.00 176.35 176.10 3kni n GLU 59 N 2.60 0.51 0.00 1.70 -0.58 -1.26 -5.09 120.64 118.51 3kni n GLU 59 Ca -0.15 -1.47 0.00 0.00 -0.42 0.00 0.00 57.16 55.12 3kni n GLU 59 Cb 0.57 0.98 0.00 0.00 -0.57 0.00 0.00 31.44 32.42 3kni n GLU 59 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93