#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c1u n PHE 1 N 0.00 0.00 -1.64 -1.42 -1.74 0.03 -4.97 117.46 107.72 1c1u n PHE 1 Ca 0.00 0.00 -0.56 0.00 -0.56 0.00 0.00 57.45 56.33 1c1u n PHE 1 Cb 0.00 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 40.93 1c1u n PHE 1 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1c1u n GLY 1 N 4.04 0.49 2.51 4.97 0.00 -1.26 0.24 105.19 116.18 1c1u n GLY 1 Ca 0.00 0.82 -0.17 0.00 0.00 0.00 0.00 46.02 46.66 1c1u n GLY 1 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1c1u n SER 1 N 3.53 -5.12 0.00 1.61 7.64 -1.26 -4.65 113.62 115.37 1c1u n SER 1 Ca 0.23 0.43 0.00 0.00 1.01 0.00 0.00 58.87 60.54 1c1u n SER 1 Cb 0.13 -4.15 0.00 0.00 -1.01 0.00 0.00 64.21 59.18 1c1u n SER 1 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c1u n GLY 1 N -0.80 0.91 1.86 0.23 0.00 0.14 -4.71 105.19 102.81 1c1u n GLY 1 Ca -0.17 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1c1u n GLY 1 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1c1u n GLU 1 N 0.00 0.00 0.00 1.61 0.00 -1.26 0.20 120.64 121.18 1c1u n GLU 1 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1c1u n GLU 1 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 31.44 31.37 1c1u n GLU 1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1c1u n ALA 1 N -2.67 0.00 -0.46 4.31 0.00 -1.26 -4.86 120.51 115.57 1c1u n ALA 1 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 1c1u n ALA 1 Cb 0.06 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.67 1c1u n ALA 1 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1c1u n ASP 1 N 0.00 2.98 -4.64 0.00 2.03 -1.26 -5.03 116.55 110.63 1c1u n ASP 1 Ca 0.00 -2.39 -0.33 0.00 0.52 0.00 0.00 54.79 52.59 1c1u n ASP 1 Cb 0.00 -0.30 0.13 0.00 -0.72 0.00 0.00 41.12 40.23 1c1u n ASP 1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1c1u n GLY 2 N 0.69 0.70 3.27 0.00 0.00 -1.26 -4.93 105.19 103.66 1c1u n GLY 2 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 1c1u n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1c1u s LEU 3 N 0.00 5.16 -0.01 0.99 1.43 -1.20 -5.02 118.68 120.04 1c1u s LEU 3 Ca 0.00 -1.50 -0.30 0.00 -1.03 0.00 0.00 54.13 51.30 1c1u s LEU 3 Cb 0.00 -1.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.18 1c1u s LEU 3 CO 0.00 -0.54 1.35 -0.13 0.23 0.00 0.00 176.35 177.26 1c1u s ARG 4 N 1.43 4.30 0.30 1.70 0.52 -1.26 -4.75 118.95 121.19 1c1u s ARG 4 Ca 0.03 1.90 -0.02 0.00 -0.52 0.00 0.00 55.73 57.12 1c1u s ARG 4 Cb -0.23 -3.55 0.64 0.00 0.52 0.00 0.00 34.95 32.33 1c1u s ARG 4 CO 0.02 -0.53 1.57 -1.35 0.02 0.00 0.00 175.30 175.03 1c1u h PRO 5 N 7.67 0.01 -0.01 3.54 0.11 -1.97 -1.22 132.00 140.14 1c1u h PRO 5 Ca -0.37 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1c1u h PRO 5 Cb 1.18 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1c1u h PRO 5 CO 0.89 0.01 -0.07 1.28 -0.21 0.00 0.00 178.00 179.90 1c1u n LEU 6 N -5.53 1.07 0.00 2.35 4.77 -1.26 -4.11 117.00 114.29 1c1u n LEU 6 Ca 0.20 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 1c1u n LEU 6 Cb 0.66 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 1c1u n LEU 6 CO -0.08 0.18 0.00 0.49 -1.33 0.00 0.00 177.39 176.66 1c1u n PHE 7 N -0.30 0.00 -0.11 -1.77 3.72 -0.52 -4.69 117.46 113.79 1c1u n PHE 7 Ca 0.18 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.52 1c1u n PHE 7 Cb 0.31 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.86 1c1u n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1c1u h GLU 8 N 0.00 -0.08 -0.01 -1.08 3.07 -1.59 0.23 114.58 115.12 1c1u h GLU 8 Ca 0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1c1u h GLU 8 Cb 0.00 0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 27.93 1c1u h GLU 8 CO 0.00 -0.05 0.10 0.87 -1.40 0.00 0.00 179.01 178.52 1c1u h LYS 9 N -0.08 0.00 -0.09 2.33 1.79 -1.61 -0.70 116.57 118.20 1c1u h LYS 9 Ca 0.19 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.66 1c1u h LYS 9 Cb 0.38 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 1c1u h LYS 9 CO -0.45 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 179.55 1c1u n LYS 10 N -3.11 2.89 -3.40 3.15 5.02 -0.06 -4.97 118.16 117.68 1c1u n LYS 10 Ca -0.02 -1.63 -0.24 0.00 -2.02 0.00 0.00 58.31 54.40 1c1u n LYS 10 Cb 0.17 -1.07 0.06 0.00 -0.02 0.00 0.00 35.03 34.17 1c1u n LYS 10 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1c1u n SER 11 N -0.22 -6.28 -4.65 4.39 2.88 0.54 -4.99 113.62 105.29 1c1u n SER 11 Ca 0.03 -0.45 -0.31 0.00 -1.33 0.00 0.00 58.87 56.81 1c1u n SER 11 Cb 0.29 -4.99 -0.09 0.00 -0.75 0.00 0.00 64.21 58.68 1c1u n SER 11 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1c1u s LEU 12 N -7.09 3.33 0.24 2.46 1.43 0.39 -4.97 118.68 114.46 1c1u s LEU 12 Ca 0.49 -0.19 0.08 0.00 -1.03 0.00 0.00 54.13 53.48 1c1u s LEU 12 Cb -0.22 -2.02 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 1c1u s LEU 12 CO 0.60 0.21 0.11 -1.61 0.23 0.00 0.00 176.35 175.90 1c1u s GLU 13 N -2.00 2.68 0.37 1.70 2.02 -1.26 -3.81 118.70 118.40 1c1u s GLU 13 Ca 0.22 -1.14 0.05 0.00 0.02 0.00 0.00 54.97 54.12 1c1u s GLU 13 Cb -0.11 -2.43 -0.01 0.00 0.10 0.00 0.00 34.13 31.67 1c1u s GLU 13 CO 0.14 0.41 0.53 0.16 0.02 0.00 0.00 175.26 176.52 1c1u s ASP 14 N -3.60 5.93 0.62 -0.19 1.47 -1.26 -5.00 116.67 114.63 1c1u s ASP 14 Ca 0.32 -0.04 0.38 0.00 1.18 0.00 0.00 52.55 54.39 1c1u s ASP 14 Cb -0.08 -1.33 2.06 0.00 -0.34 0.00 0.00 42.92 43.23 1c1u s ASP 14 CO 0.23 -0.51 2.27 0.07 0.68 0.00 0.00 175.17 177.90 1c1u h LYS 14 N 0.74 0.00 -0.04 2.11 2.10 -2.06 -3.23 116.57 116.19 1c1u h LYS 14 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 1c1u h LYS 14 Cb 1.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1c1u h LYS 14 CO 0.54 0.02 0.00 0.25 -2.00 0.00 0.00 179.45 178.26 1c1u n THR 14 N -3.34 0.78 0.25 0.07 -2.24 -1.26 -4.65 114.28 103.88 1c1u n THR 14 Ca -0.02 -0.89 0.10 0.00 -2.27 0.00 0.00 64.05 60.97 1c1u n THR 14 Cb 0.12 0.62 0.63 0.00 -2.10 0.00 0.00 70.33 69.60 1c1u n THR 14 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1c1u h GLU 14 N 0.30 0.00 -0.67 -0.78 4.11 -1.97 -2.33 114.58 113.24 1c1u h GLU 14 Ca 0.00 0.00 0.10 0.00 0.07 0.00 0.00 59.36 59.53 1c1u h GLU 14 Cb 0.43 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.61 1c1u h GLU 14 CO 0.00 0.16 0.30 -0.09 0.07 0.00 0.00 179.01 179.45 1c1u h ARG 14 N 0.00 0.49 0.00 1.06 2.43 -1.82 -2.39 114.38 114.14 1c1u h ARG 14 Ca -0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1c1u h ARG 14 Cb 0.39 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1c1u h ARG 14 CO 0.02 0.32 0.00 -1.91 -1.51 0.00 0.00 179.97 176.90 1c1u n GLU 14 N -4.93 0.00 0.00 0.20 2.13 -0.88 -0.05 120.64 117.11 1c1u n GLU 14 Ca 0.10 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.92 1c1u n GLU 14 Cb 0.29 -0.88 0.00 0.00 0.27 0.00 0.00 31.44 31.12 1c1u n GLU 14 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1c1u n LEU 14 N 0.04 0.00 0.24 4.31 7.99 -0.90 -2.56 117.00 126.11 1c1u n LEU 14 Ca 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 56.01 56.12 1c1u n LEU 14 Cb 0.00 0.00 0.50 0.00 -0.11 0.00 0.00 43.42 43.81 1c1u n LEU 14 CO 0.00 0.00 0.85 -0.33 -1.51 0.00 0.00 177.39 176.40 1c1u h GLU 14 N 0.00 0.00 -0.01 3.23 5.08 -0.72 -1.17 114.58 121.00 1c1u h GLU 14 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1c1u h GLU 14 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1c1u h GLU 14 CO 0.00 0.16 -0.13 -1.13 -1.00 0.00 0.00 179.01 176.90 1c1u n SER 14 N -3.30 0.66 -3.75 1.42 3.41 -1.06 -2.22 113.62 108.79 1c1u n SER 14 Ca 0.00 -0.73 -0.42 0.00 -0.26 0.00 0.00 58.87 57.47 1c1u n SER 14 Cb 0.40 -0.02 0.01 0.00 -0.26 0.00 0.00 64.21 64.35 1c1u n SER 14 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1c1u n TYR 14 N -0.80 2.58 -2.97 7.33 4.01 -1.03 -4.67 117.16 121.61 1c1u n TYR 14 Ca 0.14 -2.61 -0.20 0.00 -0.16 0.00 0.00 57.90 55.08 1c1u n TYR 14 Cb 0.29 -1.34 -0.04 0.00 -0.31 0.00 0.00 39.34 37.95 1c1u n TYR 14 CO 0.00 0.00 0.00 0.44 -0.46 0.00 0.00 176.86 176.84 1c1u n ILE 14 N 0.80 0.00 -0.27 -0.72 -5.35 -1.24 -4.05 119.36 108.53 1c1u n ILE 14 Ca 0.42 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.90 1c1u n ILE 14 Cb 0.29 -0.23 0.00 0.00 -1.74 0.00 0.00 39.64 37.96 1c1u n ILE 14 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1c1u n ASP 14 N -1.15 -2.79 -4.99 7.28 -0.08 -0.94 -5.07 116.55 108.82 1c1u n ASP 14 Ca 0.06 0.20 -0.19 0.00 -1.51 0.00 0.00 54.79 53.34 1c1u n ASP 14 Cb 0.29 0.09 0.00 0.00 2.34 0.00 0.00 41.12 43.84 1c1u n ASP 14 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 1c1u s GLY 14 N -1.54 1.66 0.00 0.27 0.00 -0.47 -4.93 107.32 102.31 1c1u s GLY 14 Ca 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 44.72 43.31 1c1u s GLY 14 CO 0.00 -1.28 0.00 -0.96 0.00 0.00 0.00 173.10 170.86