#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bl6 n THR 23 N 0.00 1.40 -1.63 5.09 -1.04 -1.19 -3.24 114.28 113.66 2bl6 n THR 23 Ca 0.00 -0.35 -0.37 0.00 -2.04 0.00 0.00 64.05 61.29 2bl6 n THR 23 Cb 0.00 -1.10 0.07 0.00 -1.82 0.00 0.00 70.33 67.48 2bl6 n THR 23 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2bl6 h TYR 25 N 0.33 0.00 0.00 0.00 -0.00 -1.67 -3.33 116.97 112.31 2bl6 h TYR 25 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.23 2bl6 h TYR 25 Cb 1.34 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.07 2bl6 h TYR 25 CO 0.40 0.00 -0.25 -1.71 -0.00 0.00 0.00 178.16 176.60 2bl6 n ASN 26 N -2.40 0.16 -0.00 0.10 5.15 -1.26 -4.90 115.26 112.11 2bl6 n ASN 26 Ca 0.00 0.00 0.14 0.00 -0.60 0.00 0.00 54.58 54.12 2bl6 n ASN 26 Cb 0.17 0.00 0.55 0.00 -0.53 0.00 0.00 39.78 39.97 2bl6 n ASN 26 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2bl6 n GLY 28 N 1.49 -0.51 2.96 0.00 0.00 -1.26 -4.97 105.19 102.89 2bl6 n GLY 28 Ca 0.07 0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2bl6 n GLY 28 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2bl6 s LYS 29 N -5.54 1.82 0.47 1.61 2.47 -1.26 -4.91 119.74 114.40 2bl6 s LYS 29 Ca 0.22 -0.68 0.23 0.00 -1.56 0.00 0.00 55.97 54.18 2bl6 s LYS 29 Cb -0.10 -2.22 1.26 0.00 -1.46 0.00 0.00 37.83 35.31 2bl6 s LYS 29 CO 0.28 -0.41 1.88 -1.35 0.16 0.00 0.00 175.35 175.90 2bl6 h PRO 30 N 8.04 0.22 -0.98 4.03 0.11 -1.93 -3.00 132.00 138.49 2bl6 h PRO 30 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2bl6 h PRO 30 Cb 1.11 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2bl6 h PRO 30 CO 0.45 0.14 0.00 0.41 -0.21 0.00 0.00 178.00 178.79 2bl6 n GLY 31 N -1.60 1.39 3.92 -0.55 0.00 -1.26 -1.13 105.19 105.96 2bl6 n GLY 31 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 2bl6 n GLY 31 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bl6 s HIS 32 N -0.46 3.46 0.24 1.61 3.76 -1.18 -4.84 115.29 117.87 2bl6 s HIS 32 Ca 0.00 0.62 -0.12 0.00 -0.15 0.00 0.00 55.06 55.41 2bl6 s HIS 32 Cb 0.00 -2.29 -0.01 0.00 1.11 0.00 0.00 32.58 31.40 2bl6 s HIS 32 CO 0.00 -0.29 0.45 -0.51 -0.85 0.00 0.00 174.74 173.54 2bl6 s LEU 33 N -4.67 0.38 0.12 0.89 1.43 -1.26 -1.01 118.68 114.56 2bl6 s LEU 33 Ca 0.47 -0.94 0.08 0.00 -1.03 0.00 0.00 54.13 52.71 2bl6 s LEU 33 Cb -0.10 1.68 0.41 0.00 0.03 0.00 0.00 46.19 48.21 2bl6 s LEU 33 CO 0.42 -1.11 1.20 -1.54 0.23 0.00 0.00 176.35 175.55 2bl6 n SER 34 N -0.37 0.20 -0.00 2.29 3.41 -1.26 -1.45 113.62 116.44 2bl6 n SER 34 Ca -0.02 0.56 0.06 0.00 -0.26 0.00 0.00 58.87 59.21 2bl6 n SER 34 Cb 0.62 -0.58 -0.07 0.00 -0.26 0.00 0.00 64.21 63.92 2bl6 n SER 34 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2bl6 n SER 35 N -1.74 0.67 0.05 4.04 3.41 -1.26 -4.63 113.62 114.15 2bl6 n SER 35 Ca -0.01 -0.75 -0.21 0.00 -0.26 0.00 0.00 58.87 57.65 2bl6 n SER 35 Cb 0.06 1.03 -0.14 0.00 -0.26 0.00 0.00 64.21 64.90 2bl6 n SER 35 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2bl6 h GLN 36 N 0.00 0.32 -4.58 4.33 5.75 -1.63 -3.48 115.11 115.82 2bl6 h GLN 36 Ca 0.00 -0.54 -0.34 0.00 -0.15 0.00 0.00 58.65 57.62 2bl6 h GLN 36 Cb 0.31 0.20 -0.12 0.00 1.07 0.00 0.00 27.48 28.94 2bl6 h GLN 36 CO 0.00 1.21 -0.44 0.00 -2.65 0.00 0.00 178.83 176.96 2bl6 h ARG 38 N 2.27 0.46 -2.98 0.00 -0.00 -1.84 -3.40 114.38 108.89 2bl6 h ARG 38 Ca -0.29 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.98 59.15 2bl6 h ARG 38 Cb 1.24 -0.10 -0.12 0.00 0.00 0.00 0.00 29.97 30.99 2bl6 h ARG 38 CO 0.41 0.30 0.22 0.00 0.00 0.00 0.00 179.97 180.90 2bl6 s ALA 39 N -5.48 -1.60 1.04 0.04 0.00 -1.25 -4.36 121.76 110.15 2bl6 s ALA 39 Ca -0.08 0.49 -0.15 0.00 0.00 0.00 0.00 51.96 52.22 2bl6 s ALA 39 Cb 0.22 0.87 0.21 0.00 0.00 0.00 0.00 23.12 24.42 2bl6 s ALA 39 CO 0.78 -0.77 1.12 -1.25 0.00 0.00 0.00 175.76 175.64 2bl6 s PRO 40 N -3.73 0.10 0.25 0.00 0.04 -1.26 -2.80 135.00 127.59 2bl6 s PRO 40 Ca 0.01 0.22 0.13 0.00 0.04 0.00 0.00 61.00 61.40 2bl6 s PRO 40 Cb -0.01 -1.72 0.71 0.00 0.04 0.00 0.00 34.50 33.52 2bl6 s PRO 40 CO -0.12 -2.89 1.33 1.17 0.04 0.00 0.00 177.00 176.53 2bl6 n LYS 41 N -4.23 0.09 -0.19 4.56 4.81 0.39 -1.28 118.16 122.30 2bl6 n LYS 41 Ca 0.08 0.55 0.15 0.00 -0.87 0.00 0.00 58.31 58.23 2bl6 n LYS 41 Cb 0.59 -1.95 0.49 0.00 0.02 0.00 0.00 35.03 34.18 2bl6 n LYS 41 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2bl6 h VAL 42 N 0.00 0.79 -0.27 3.15 2.07 -1.92 -3.47 116.25 116.59 2bl6 h VAL 42 Ca 0.00 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.37 2bl6 h VAL 42 Cb 0.32 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2bl6 h VAL 42 CO 0.00 0.08 0.00 0.00 0.02 0.00 0.00 177.57 177.67 2bl6 n PHE 44 N 0.00 0.00 0.09 0.00 -1.74 -1.26 -4.72 117.46 109.83 2bl6 n PHE 44 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 2bl6 n PHE 44 Cb 0.00 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.00 2bl6 n PHE 44 CO 0.00 0.00 0.00 1.17 -0.56 0.00 0.00 176.76 177.37 2bl6 n LYS 45 N -0.11 0.00 0.10 3.97 4.81 -1.26 -3.81 118.16 121.86 2bl6 n LYS 45 Ca 0.00 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.39 2bl6 n LYS 45 Cb 0.00 0.00 0.06 0.00 0.02 0.00 0.00 35.03 35.11 2bl6 n LYS 45 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2bl6 n LYS 47 N -3.70 -2.06 -1.94 0.00 2.85 -1.26 -4.96 118.16 107.10 2bl6 n LYS 47 Ca -0.02 0.18 -0.34 0.00 -1.05 0.00 0.00 58.31 57.08 2bl6 n LYS 47 Cb 0.72 -4.52 0.03 0.00 -0.65 0.00 0.00 35.03 30.62 2bl6 n LYS 47 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 2bl6 s GLN 48 N -3.86 2.94 0.63 -1.58 -1.52 -1.26 -4.92 119.66 110.09 2bl6 s GLN 48 Ca 0.00 1.59 0.27 0.00 -1.95 0.00 0.00 55.36 55.26 2bl6 s GLN 48 Cb 0.00 -1.95 1.45 0.00 -0.22 0.00 0.00 33.01 32.29 2bl6 s GLN 48 CO 0.00 -1.17 1.81 -1.35 -0.25 0.00 0.00 175.29 174.32 2bl6 h PRO 49 N 0.55 0.00 0.00 2.91 0.11 -2.04 -3.24 132.00 130.28 2bl6 h PRO 49 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2bl6 h PRO 49 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2bl6 h PRO 49 CO 0.55 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.75 2bl6 n GLY 50 N -1.24 0.81 0.24 -0.55 0.00 -1.26 -4.96 105.19 98.23 2bl6 n GLY 50 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.08 2bl6 n GLY 50 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 2bl6 h HIS 51 N 0.00 0.00 -0.77 1.61 2.07 -1.96 -3.34 115.15 112.75 2bl6 h HIS 51 Ca 0.00 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.47 2bl6 h HIS 51 Cb 0.57 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.51 2bl6 h HIS 51 CO 0.00 0.15 0.29 0.27 -3.07 0.00 0.00 177.93 175.58 2bl6 h PHE 52 N 0.00 1.19 0.00 6.12 -5.15 -1.88 -2.32 116.94 114.90 2bl6 h PHE 52 Ca -0.00 -0.10 0.00 0.00 -0.20 0.00 0.00 57.97 57.67 2bl6 h PHE 52 Cb 0.30 -0.35 0.00 0.00 0.22 0.00 0.00 35.95 36.12 2bl6 h PHE 52 CO 0.00 0.91 0.00 0.43 -2.00 0.00 0.00 178.31 177.65 2bl6 n SER 53 N -4.29 0.00 -0.20 -0.68 7.64 -1.25 -0.68 113.62 114.15 2bl6 n SER 53 Ca 0.07 0.33 0.02 0.00 1.01 0.00 0.00 58.87 60.29 2bl6 n SER 53 Cb 0.19 -0.37 0.02 0.00 -1.01 0.00 0.00 64.21 63.05 2bl6 n SER 53 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 2bl6 n LYS 54 N -1.37 0.61 0.00 1.43 2.85 -0.90 -4.31 118.16 116.47 2bl6 n LYS 54 Ca 0.02 -1.16 0.00 0.00 -1.05 0.00 0.00 58.31 56.12 2bl6 n LYS 54 Cb 0.04 -0.73 0.00 0.00 -0.65 0.00 0.00 35.03 33.69 2bl6 n LYS 54 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 2bl6 n GLN 55 N -0.30 0.00 -0.01 -1.58 7.27 -0.96 -4.96 117.38 116.85 2bl6 n GLN 55 Ca 0.03 0.00 0.01 0.00 0.07 0.00 0.00 57.00 57.10 2bl6 n GLN 55 Cb 0.56 -0.10 -0.04 0.00 2.41 0.00 0.00 30.24 33.07 2bl6 n GLN 55 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2bl6 n ARG 57 N -1.90 1.85 0.00 0.00 5.12 0.14 -4.99 116.66 116.88 2bl6 n ARG 57 Ca -0.04 -1.39 0.00 0.00 -1.93 0.00 0.00 57.85 54.49 2bl6 n ARG 57 Cb 0.36 -0.92 0.00 0.00 -1.16 0.00 0.00 32.46 30.74 2bl6 n ARG 57 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13