#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vit n PHE 1 N 0.00 1.60 0.05 1.09 3.72 -1.26 -4.57 117.46 118.09 1vit n PHE 1 Ca 0.00 -1.90 0.05 0.00 -0.05 0.00 0.00 57.45 55.54 1vit n PHE 1 Cb 0.00 -0.54 0.23 0.00 -0.94 0.00 0.00 39.48 38.23 1vit n PHE 1 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1vit n GLY 1 N -1.01 2.09 3.53 1.37 0.00 -1.26 -4.78 105.19 105.14 1vit n GLY 1 Ca 0.38 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1vit n GLY 1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vit s ALA 1 N -1.90 3.03 0.00 4.61 0.00 -1.26 -4.87 121.76 121.36 1vit s ALA 1 Ca 0.31 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 51.02 1vit s ALA 1 Cb 0.22 -3.94 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1vit s ALA 1 CO 0.11 -2.69 0.00 0.41 0.00 0.00 0.00 175.76 173.59 1vit n GLY 1 N 5.19 1.38 2.58 0.00 0.00 -1.26 -5.09 105.19 107.99 1vit n GLY 1 Ca 0.03 -0.78 -0.12 0.00 0.00 0.00 0.00 46.02 45.15 1vit n GLY 1 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vit n GLU 1 N 0.00 2.15 0.00 1.61 -0.58 -1.26 -5.02 120.64 117.53 1vit n GLU 1 Ca 0.00 -3.71 0.00 0.00 -0.42 0.00 0.00 57.16 53.03 1vit n GLU 1 Cb 0.00 -1.71 0.00 0.00 -0.57 0.00 0.00 31.44 29.16 1vit n GLU 1 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1vit n ALA 1 N -0.41 0.00 -3.42 0.62 0.00 -1.26 -4.01 120.51 112.03 1vit n ALA 1 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.37 1vit n ALA 1 Cb 0.81 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.18 1vit n ALA 1 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1vit n ASP 1 N 0.07 2.95 -4.61 0.00 5.75 -1.26 -5.06 116.55 114.38 1vit n ASP 1 Ca 0.00 -3.26 -0.34 0.00 -0.01 0.00 0.00 54.79 51.17 1vit n ASP 1 Cb 0.00 -0.67 -0.11 0.00 -1.03 0.00 0.00 41.12 39.31 1vit n ASP 1 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1vit n GLY 2 N 2.29 1.10 3.21 0.00 0.00 -1.26 -4.97 105.19 105.56 1vit n GLY 2 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1vit n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vit s LEU 3 N 0.00 5.94 0.05 0.99 1.43 -1.26 -4.99 118.68 120.83 1vit s LEU 3 Ca 0.00 -2.60 -0.31 0.00 -1.03 0.00 0.00 54.13 50.19 1vit s LEU 3 Cb 0.00 -2.03 -0.07 0.00 0.03 0.00 0.00 46.19 44.12 1vit s LEU 3 CO 0.00 -0.52 1.43 0.00 0.23 0.00 0.00 176.35 177.49 1vit s ARG 4 N 0.31 4.28 0.18 1.70 3.03 -1.26 -4.65 118.95 122.54 1vit s ARG 4 Ca 0.15 2.05 0.12 0.00 2.03 0.00 0.00 55.73 60.08 1vit s ARG 4 Cb -0.18 -3.48 0.65 0.00 -1.03 0.00 0.00 34.95 30.92 1vit s ARG 4 CO -0.05 -0.55 1.36 -2.30 -1.13 0.00 0.00 175.30 172.63 1vit n PRO 5 N 4.95 0.08 0.00 3.89 -0.02 -1.26 -0.92 135.00 141.72 1vit n PRO 5 Ca 0.13 0.57 0.11 0.00 -2.02 0.00 0.00 63.50 62.29 1vit n PRO 5 Cb 0.43 -1.77 -0.02 0.00 -0.02 0.00 0.00 33.50 32.11 1vit n PRO 5 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1vit n LEU 6 N -1.92 1.88 0.00 2.45 7.99 -1.26 -4.47 117.00 121.67 1vit n LEU 6 Ca -0.01 -0.73 0.00 0.00 -0.01 0.00 0.00 56.01 55.26 1vit n LEU 6 Cb 0.04 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.35 1vit n LEU 6 CO 0.05 0.36 0.00 0.49 -1.51 0.00 0.00 177.39 176.78 1vit n PHE 7 N -0.21 0.00 0.19 -1.77 3.72 -0.37 -4.75 117.46 114.28 1vit n PHE 7 Ca 0.08 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.34 1vit n PHE 7 Cb 0.44 0.20 -0.07 0.00 -0.94 0.00 0.00 39.48 39.11 1vit n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1vit h GLU 8 N 0.00 -0.57 -2.05 -1.08 4.39 -1.08 0.32 114.58 114.52 1vit h GLU 8 Ca 0.00 0.04 -0.51 0.00 0.34 0.00 0.00 59.36 59.23 1vit h GLU 8 Cb 0.00 0.13 -0.17 0.00 -0.10 0.00 0.00 28.75 28.61 1vit h GLU 8 CO 0.00 -0.38 0.54 0.36 -1.16 0.00 0.00 179.01 178.38 1vit n LYS 9 N -5.39 2.58 0.00 2.33 2.85 -0.92 -2.58 118.16 117.03 1vit n LYS 9 Ca -0.09 -2.40 0.00 0.00 -1.05 0.00 0.00 58.31 54.77 1vit n LYS 9 Cb 0.30 -2.18 0.00 0.00 -0.65 0.00 0.00 35.03 32.50 1vit n LYS 9 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1vit n LYS 10 N 1.00 0.00 -1.91 -1.58 4.81 -0.90 -4.74 118.16 114.85 1vit n LYS 10 Ca 0.50 0.00 -0.21 0.00 -0.87 0.00 0.00 58.31 57.73 1vit n LYS 10 Cb 0.54 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.53 1vit n LYS 10 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1vit n GLN 11 N 0.00 -1.54 -4.38 1.64 6.02 -0.46 -4.94 117.38 113.72 1vit n GLN 11 Ca 0.00 1.15 -0.34 0.00 -0.01 0.00 0.00 57.00 57.81 1vit n GLN 11 Cb 0.27 -5.65 -0.09 0.00 1.02 0.00 0.00 30.24 25.79 1vit n GLN 11 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1vit s VAL 12 N -2.88 4.12 0.44 5.09 1.01 0.10 -5.01 120.40 123.27 1vit s VAL 12 Ca 0.00 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.59 1vit s VAL 12 Cb 0.00 -2.77 -0.02 0.00 0.00 0.00 0.00 36.38 33.58 1vit s VAL 12 CO 0.00 0.50 0.31 -1.58 0.00 0.00 0.00 175.10 174.32 1vit s GLN 13 N -1.19 2.37 0.30 2.72 0.74 -1.26 -3.55 119.66 119.79 1vit s GLN 13 Ca 0.16 -1.74 0.09 0.00 0.05 0.00 0.00 55.36 53.92 1vit s GLN 13 Cb -0.11 -2.18 -0.04 0.00 1.10 0.00 0.00 33.01 31.77 1vit s GLN 13 CO 0.06 -0.24 0.09 0.16 -0.55 0.00 0.00 175.29 174.81 1vit s ASP 14 N -4.07 4.74 0.00 6.67 -4.77 -1.26 -5.01 116.67 112.97 1vit s ASP 14 Ca 0.43 -0.65 0.01 0.00 -3.30 0.00 0.00 52.55 49.04 1vit s ASP 14 Cb -0.00 -0.87 0.06 0.00 -1.09 0.00 0.00 42.92 41.01 1vit s ASP 14 CO 0.25 -0.14 0.86 1.67 0.70 0.00 0.00 175.17 178.51 1vit n GLN 14 N -1.05 0.01 -0.99 2.11 7.27 -1.26 -2.40 117.38 121.08 1vit n GLN 14 Ca -0.05 0.30 0.01 0.00 0.07 0.00 0.00 57.00 57.34 1vit n GLN 14 Cb 0.60 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.75 1vit n GLN 14 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 1vit n THR 14 N -1.32 0.00 -0.03 1.69 -1.04 -1.26 -4.90 114.28 107.42 1vit n THR 14 Ca 0.00 -0.45 -0.21 0.00 -2.04 0.00 0.00 64.05 61.36 1vit n THR 14 Cb 0.01 0.69 -0.13 0.00 -1.82 0.00 0.00 70.33 69.08 1vit n THR 14 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1vit h GLU 14 N 0.45 0.15 -0.88 -2.82 4.81 -1.88 -3.34 114.58 111.06 1vit h GLU 14 Ca -0.15 -0.26 0.26 0.00 -0.13 0.00 0.00 59.36 59.08 1vit h GLU 14 Cb 1.60 0.10 -0.04 0.00 0.63 0.00 0.00 28.75 31.04 1vit h GLU 14 CO 0.02 1.12 0.64 0.87 -0.73 0.00 0.00 179.01 180.93 1vit h LYS 14 N -0.52 0.01 -0.97 1.92 1.57 -1.91 0.61 116.57 117.28 1vit h LYS 14 Ca -0.32 -0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.56 1vit h LYS 14 Cb 1.60 -0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.84 1vit h LYS 14 CO -0.03 0.01 0.62 1.49 -0.57 0.00 0.00 179.45 180.97 1vit h GLU 14 N 0.01 0.99 -0.01 3.15 4.81 -1.94 0.19 114.58 121.77 1vit h GLU 14 Ca 0.42 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.57 1vit h GLU 14 Cb 1.68 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.84 1vit h GLU 14 CO -0.01 0.65 -0.08 -0.07 -0.73 0.00 0.00 179.01 178.77 1vit h LEU 14 N 1.02 0.09 -1.72 1.64 3.38 -1.07 -3.07 115.31 115.57 1vit h LEU 14 Ca 0.45 -0.71 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1vit h LEU 14 Cb 0.36 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1vit h LEU 14 CO -0.20 0.79 -0.15 -0.26 0.09 0.00 0.00 178.44 178.70 1vit h PHE 14 N -0.60 0.00 -0.30 1.13 -1.00 -1.34 -2.13 116.94 112.71 1vit h PHE 14 Ca -0.01 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.63 1vit h PHE 14 Cb 0.79 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.34 1vit h PHE 14 CO 0.17 0.15 -0.38 0.93 -1.61 0.00 0.00 178.31 177.57 1vit h GLU 14 N 0.00 0.69 0.00 1.51 5.08 -0.72 -3.17 114.58 117.98 1vit h GLU 14 Ca -0.00 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1vit h GLU 14 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1vit h GLU 14 CO 0.02 0.96 0.00 -1.13 -1.00 0.00 0.00 179.01 177.86 1vit n SER 14 N -4.05 0.00 0.09 1.42 3.41 -0.80 -1.12 113.62 112.58 1vit n SER 14 Ca -0.02 0.09 0.12 0.00 -0.26 0.00 0.00 58.87 58.80 1vit n SER 14 Cb 0.51 -0.27 0.02 0.00 -0.26 0.00 0.00 64.21 64.21 1vit n SER 14 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1vit n TYR 14 N -1.27 0.84 0.08 7.33 4.01 -1.20 -4.15 117.16 122.80 1vit n TYR 14 Ca 0.06 0.25 -0.18 0.00 -0.16 0.00 0.00 57.90 57.87 1vit n TYR 14 Cb 0.09 -0.87 -0.14 0.00 -0.31 0.00 0.00 39.34 38.11 1vit n TYR 14 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 1vit h ILE 14 N 0.00 1.20 -1.22 -0.72 5.03 -1.27 -3.47 117.51 117.06 1vit h ILE 14 Ca 0.00 -2.82 0.00 0.00 -0.12 0.00 0.00 64.86 61.92 1vit h ILE 14 Cb 0.95 2.81 0.00 0.00 -3.03 0.00 0.00 36.82 37.54 1vit h ILE 14 CO 0.00 0.83 0.00 -1.84 -0.68 0.00 0.00 178.15 176.46 1vit n GLU 14 N -3.49 0.91 -0.67 2.37 0.28 -1.18 -5.06 120.64 113.79 1vit n GLU 14 Ca -0.16 0.00 -0.03 0.00 -0.16 0.00 0.00 57.16 56.81 1vit n GLU 14 Cb 1.05 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 33.89 1vit n GLU 14 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1vit n GLY 14 N 5.00 0.46 0.00 -1.84 0.00 -1.26 -5.04 105.19 102.51 1vit n GLY 14 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1vit n GLY 14 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19