#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 0.82 0.00 4.78 1.16 -1.26 -5.04 117.46 117.91 1vit n PHE 1 Ca 0.00 0.24 0.00 0.00 -1.87 0.00 0.00 57.45 55.82 1vit n PHE 1 Cb 0.00 -0.91 0.00 0.00 -1.61 0.00 0.00 39.48 36.96 1vit n PHE 1 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1vit n GLY 1 N 1.23 1.96 2.00 4.97 0.00 -1.26 -4.91 105.19 109.18 1vit n GLY 1 Ca -0.03 -1.47 -0.12 0.00 0.00 0.00 0.00 46.02 44.41 1vit n GLY 1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vit n ALA 1 N -1.37 4.77 0.00 4.61 0.00 -1.26 -4.79 120.51 122.48 1vit n ALA 1 Ca 0.00 -2.32 0.00 0.00 0.00 0.00 0.00 53.44 51.12 1vit n ALA 1 Cb 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1vit n ALA 1 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vit n GLY 1 N -0.44 3.12 0.00 0.00 0.00 -1.26 -4.98 105.19 101.63 1vit n GLY 1 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.46 1vit n GLY 1 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1vit n GLU 1 N -0.91 0.00 -1.92 1.61 0.28 -1.26 -0.34 120.64 118.09 1vit n GLU 1 Ca 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 56.98 1vit n GLU 1 Cb 0.00 0.00 0.03 0.00 1.43 0.00 0.00 31.44 32.90 1vit n GLU 1 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1vit n ALA 1 N -1.59 3.00 0.01 -1.84 0.00 -1.26 -4.82 120.51 114.01 1vit n ALA 1 Ca 0.00 -1.53 0.01 0.00 0.00 0.00 0.00 53.44 51.91 1vit n ALA 1 Cb 0.00 -0.66 0.01 0.00 0.00 0.00 0.00 19.45 18.80 1vit n ALA 1 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1vit n ASP 1 N -0.43 1.67 -4.74 0.00 -0.08 0.54 -5.04 116.55 108.47 1vit n ASP 1 Ca -0.11 -1.60 -0.30 0.00 -1.51 0.00 0.00 54.79 51.27 1vit n ASP 1 Cb 0.87 -0.01 0.12 0.00 2.34 0.00 0.00 41.12 44.44 1vit n ASP 1 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1vit n GLY 2 N -1.32 1.73 3.43 0.00 0.00 -1.26 -4.89 105.19 102.88 1vit n GLY 2 Ca 0.07 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 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 5.35 -0.07 0.99 1.43 -1.21 -4.97 118.68 120.20 1vit s LEU 3 Ca 0.00 -2.70 -0.37 0.00 -1.03 0.00 0.00 54.13 50.04 1vit s LEU 3 Cb 0.00 -2.36 -0.15 0.00 0.03 0.00 0.00 46.19 43.71 1vit s LEU 3 CO 0.00 -0.79 1.66 0.54 0.23 0.00 0.00 176.35 177.98 1vit n ARG 4 N 5.50 1.59 -0.22 1.70 1.74 -1.26 -4.60 116.66 121.11 1vit n ARG 4 Ca 0.29 0.58 -0.04 0.00 -0.77 0.00 0.00 57.85 57.91 1vit n ARG 4 Cb 0.45 -2.31 0.07 0.00 -1.02 0.00 0.00 32.46 29.64 1vit n ARG 4 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 1vit h PRO 5 N 6.90 0.75 -0.11 5.56 0.11 -1.96 -1.04 132.00 142.21 1vit h PRO 5 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1vit h PRO 5 Cb 1.30 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1vit h PRO 5 CO 0.90 0.50 0.00 1.28 -0.21 0.00 0.00 178.00 180.47 1vit n LEU 6 N -4.71 0.96 0.00 2.35 4.77 -1.26 -3.76 117.00 115.35 1vit n LEU 6 Ca 0.06 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 1vit n LEU 6 Cb 0.09 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1vit n LEU 6 CO 0.33 0.20 0.00 0.49 -1.33 0.00 0.00 177.39 177.08 1vit n PHE 7 N -0.13 0.00 -0.30 -1.77 3.72 -0.62 -4.74 117.46 113.62 1vit n PHE 7 Ca 0.14 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.66 1vit n PHE 7 Cb 0.21 0.00 0.28 0.00 -0.94 0.00 0.00 39.48 39.03 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 0.37 0.00 -1.08 3.07 -1.37 0.66 114.58 116.23 1vit h GLU 8 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1vit h GLU 8 Cb 0.00 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 27.83 1vit h GLU 8 CO 0.00 0.24 0.00 1.63 -1.40 0.00 0.00 179.01 179.48 1vit n LYS 9 N -5.06 0.21 -0.36 2.33 5.02 -0.53 -3.34 118.16 116.43 1vit n LYS 9 Ca 0.21 0.23 0.08 0.00 -2.02 0.00 0.00 58.31 56.81 1vit n LYS 9 Cb 0.62 -1.77 0.22 0.00 -0.02 0.00 0.00 35.03 34.08 1vit n LYS 9 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1vit n LYS 10 N -2.14 2.80 -0.72 1.97 4.81 0.21 -4.97 118.16 120.13 1vit n LYS 10 Ca 0.05 -2.64 0.00 0.00 -0.87 0.00 0.00 58.31 54.85 1vit n LYS 10 Cb 0.37 -1.69 0.00 0.00 0.02 0.00 0.00 35.03 33.73 1vit n LYS 10 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1vit n GLN 11 N -0.38 -1.43 -3.83 1.64 -0.06 -0.13 -4.89 117.38 108.31 1vit n GLN 11 Ca 0.19 0.30 -0.35 0.00 -2.00 0.00 0.00 57.00 55.14 1vit n GLN 11 Cb 0.77 -4.42 -0.09 0.00 -4.06 0.00 0.00 30.24 22.43 1vit n GLN 11 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1vit s VAL 12 N -0.84 5.11 0.61 1.69 0.11 -0.93 -4.99 120.40 121.15 1vit s VAL 12 Ca 0.00 0.09 -0.07 0.00 -2.93 0.00 0.00 61.98 59.06 1vit s VAL 12 Cb 0.00 -3.33 0.01 0.00 -1.53 0.00 0.00 36.38 31.52 1vit s VAL 12 CO 0.00 0.43 0.94 -1.10 -3.33 0.00 0.00 175.10 172.04 1vit s GLN 13 N 0.53 2.97 0.27 1.54 -0.21 -1.26 -3.99 119.66 119.51 1vit s GLN 13 Ca 0.06 0.13 0.06 0.00 0.02 0.00 0.00 55.36 55.63 1vit s GLN 13 Cb -0.12 -2.22 -0.03 0.00 1.00 0.00 0.00 33.01 31.64 1vit s GLN 13 CO 0.00 -0.73 0.32 0.16 -2.12 0.00 0.00 175.29 172.93 1vit s ASP 14 N -4.30 5.91 0.30 5.90 1.47 -1.26 -5.02 116.67 119.67 1vit s ASP 14 Ca 0.54 -0.13 0.06 0.00 1.18 0.00 0.00 52.55 54.20 1vit s ASP 14 Cb -0.11 -1.51 0.75 0.00 -0.34 0.00 0.00 42.92 41.71 1vit s ASP 14 CO 0.47 -0.16 1.76 0.06 0.68 0.00 0.00 175.17 177.98 1vit h GLN 14 N 1.22 0.67 -0.25 2.11 3.07 -2.06 -2.44 115.11 117.43 1vit h GLN 14 Ca -0.49 -0.04 0.00 0.00 0.09 0.00 0.00 58.65 58.21 1vit h GLN 14 Cb 1.24 -0.15 0.00 0.00 0.08 0.00 0.00 27.48 28.65 1vit h GLN 14 CO 0.59 0.44 0.00 2.41 0.09 0.00 0.00 178.83 182.37 1vit n THR 14 N -4.82 0.39 0.11 1.86 -1.04 -1.26 -4.62 114.28 104.90 1vit n THR 14 Ca 0.24 -0.70 -0.13 0.00 -2.04 0.00 0.00 64.05 61.42 1vit n THR 14 Cb 0.60 1.05 -0.06 0.00 -1.82 0.00 0.00 70.33 70.10 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 3.73 -0.53 -1.10 -2.82 4.81 -1.84 -2.48 114.58 114.34 1vit h GLU 14 Ca 0.00 0.04 0.31 0.00 -0.13 0.00 0.00 59.36 59.57 1vit h GLU 14 Cb 0.85 0.12 -0.07 0.00 0.63 0.00 0.00 28.75 30.28 1vit h GLU 14 CO 0.00 -0.36 0.75 0.87 -0.73 0.00 0.00 179.01 179.55 1vit h LYS 14 N -0.55 0.17 -0.82 1.92 6.56 -1.82 -0.09 116.57 121.95 1vit h LYS 14 Ca 0.03 -0.01 0.11 0.00 -1.06 0.00 0.00 60.65 59.72 1vit h LYS 14 Cb 0.59 -0.04 -0.08 0.00 -0.57 0.00 0.00 32.23 32.14 1vit h LYS 14 CO -0.21 0.11 0.45 1.49 -2.06 0.00 0.00 179.45 179.23 1vit h GLU 14 N 0.18 0.71 0.84 3.15 4.81 -1.77 -0.21 114.58 122.30 1vit h GLU 14 Ca 0.57 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.72 1vit h GLU 14 Cb 1.89 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 31.12 1vit h GLU 14 CO -0.15 0.47 -0.41 -0.07 -0.73 0.00 0.00 179.01 178.13 1vit h LEU 14 N 0.73 -0.96 -1.30 1.64 3.38 -1.12 -2.45 115.31 115.24 1vit h LEU 14 Ca 0.41 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.45 1vit h LEU 14 Cb 0.43 0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 1vit h LEU 14 CO -0.28 -0.61 0.50 -0.26 0.09 0.00 0.00 178.44 177.88 1vit h PHE 14 N -1.27 0.88 -0.69 1.13 0.04 -1.58 -0.75 116.94 114.70 1vit h PHE 14 Ca -0.12 0.02 0.04 0.00 2.80 0.00 0.00 57.97 60.71 1vit h PHE 14 Cb 0.87 -0.29 -0.04 0.00 2.20 0.00 0.00 35.95 38.69 1vit h PHE 14 CO -0.00 0.50 0.46 1.49 -0.60 0.00 0.00 178.31 180.15 1vit h GLU 14 N 0.90 0.80 0.00 1.51 4.57 -1.01 -2.58 114.58 118.77 1vit h GLU 14 Ca 0.31 -0.05 -0.18 0.00 -1.18 0.00 0.00 59.36 58.26 1vit h GLU 14 Cb 0.11 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.50 1vit h GLU 14 CO -0.10 0.53 -0.86 0.66 -1.18 0.00 0.00 179.01 178.07 1vit h SER 14 N 0.82 0.02 0.31 1.04 4.64 -0.64 -3.18 113.55 116.56 1vit h SER 14 Ca 0.28 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1vit h SER 14 Cb 0.08 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1vit h SER 14 CO -0.08 0.86 0.00 -1.22 -0.87 0.00 0.00 176.83 175.52 1vit n TYR 14 N -3.54 0.00 0.00 4.77 4.01 -0.97 -4.88 117.16 116.55 1vit n TYR 14 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1vit n TYR 14 Cb 0.81 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 1vit n TYR 14 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1vit n ILE 14 N -1.30 0.00 -1.58 -0.72 -0.00 -1.21 -4.85 119.36 109.71 1vit n ILE 14 Ca 0.07 0.00 -0.43 0.00 -0.00 0.00 0.00 62.75 62.40 1vit n ILE 14 Cb 0.13 0.00 -0.03 0.00 -0.00 0.00 0.00 39.64 39.74 1vit n ILE 14 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 1vit n GLU 14 N 0.00 1.80 -2.72 0.38 4.07 -1.26 -4.96 120.64 117.93 1vit n GLU 14 Ca 0.00 0.45 -0.22 0.00 -0.06 0.00 0.00 57.16 57.33 1vit n GLU 14 Cb 0.00 -3.22 0.09 0.00 -0.06 0.00 0.00 31.44 28.25 1vit n GLU 14 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 1vit s GLY 14 N 8.78 1.76 0.00 8.31 0.00 -1.26 -5.06 107.32 119.85 1vit s GLY 14 Ca 1.01 -1.84 0.11 0.00 0.00 0.00 0.00 44.72 44.00 1vit s GLY 14 CO 0.35 -1.32 0.85 0.54 0.00 0.00 0.00 173.10 173.52