#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 1.02 -1.55 5.09 -1.04 -1.20 -3.35 114.28 113.25 2bl6 n THR 23 Ca 0.00 -0.26 -0.37 0.00 -2.04 0.00 0.00 64.05 61.39 2bl6 n THR 23 Cb 0.00 -1.05 0.07 0.00 -1.82 0.00 0.00 70.33 67.53 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 0.20 0.00 0.00 0.00 -0.00 -1.66 -3.31 116.97 112.20 2bl6 h TYR 25 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.24 2bl6 h TYR 25 Cb 1.35 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.08 2bl6 h TYR 25 CO 0.39 0.00 -0.19 -1.71 -0.00 0.00 0.00 178.16 176.65 2bl6 n ASN 26 N -2.47 0.18 -0.00 0.10 5.15 -1.26 -4.89 115.26 112.07 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 0.18 0.00 0.54 0.00 -0.53 0.00 0.00 39.78 39.96 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 2.97 0.00 0.00 -1.26 -4.98 105.19 102.91 2bl6 n GLY 28 Ca 0.07 0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 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 -5.25 1.93 0.46 1.61 2.47 -1.26 -4.91 119.74 114.80 2bl6 s LYS 29 Ca 0.09 -0.70 0.23 0.00 -1.56 0.00 0.00 55.97 54.03 2bl6 s LYS 29 Cb -0.04 -2.24 1.23 0.00 -1.46 0.00 0.00 37.83 35.33 2bl6 s LYS 29 CO 0.11 -0.39 1.87 -1.35 0.16 0.00 0.00 175.35 175.76 2bl6 h PRO 30 N 8.03 0.24 -1.74 4.03 0.11 -1.93 -2.92 132.00 137.81 2bl6 h PRO 30 Ca -0.29 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2bl6 h PRO 30 Cb 1.11 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2bl6 h PRO 30 CO 0.47 0.16 0.00 0.41 -0.21 0.00 0.00 178.00 178.83 2bl6 n GLY 31 N -1.59 1.97 3.78 -0.55 0.00 -1.26 -1.11 105.19 106.43 2bl6 n GLY 31 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 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 0.32 3.08 0.31 1.61 3.76 -1.21 -4.89 115.29 118.27 2bl6 s HIS 32 Ca 0.00 -0.06 -0.14 0.00 -0.15 0.00 0.00 55.06 54.71 2bl6 s HIS 32 Cb 0.00 -1.46 0.02 0.00 1.11 0.00 0.00 32.58 32.25 2bl6 s HIS 32 CO 0.00 0.52 0.62 -0.51 -0.85 0.00 0.00 174.74 174.52 2bl6 s LEU 33 N -3.29 0.20 0.65 0.89 1.43 -1.26 -0.96 118.68 116.34 2bl6 s LEU 33 Ca 0.31 -0.99 0.39 0.00 -1.03 0.00 0.00 54.13 52.81 2bl6 s LEU 33 Cb -0.09 2.25 2.13 0.00 0.03 0.00 0.00 46.19 50.51 2bl6 s LEU 33 CO 0.23 -1.36 2.20 0.77 0.23 0.00 0.00 176.35 178.42 2bl6 h SER 34 N 2.10 0.00 0.20 2.29 4.64 -1.90 -0.47 113.55 120.41 2bl6 h SER 34 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2bl6 h SER 34 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2bl6 h SER 34 CO 0.34 0.00 -0.13 -1.54 -0.87 0.00 0.00 176.83 174.63 2bl6 n SER 35 N -2.98 0.91 -0.04 4.97 3.41 -1.26 -4.41 113.62 114.22 2bl6 n SER 35 Ca -0.03 -0.94 -0.05 0.00 -0.26 0.00 0.00 58.87 57.59 2bl6 n SER 35 Cb 0.17 0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.11 2bl6 n SER 35 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2bl6 n GLN 36 N -0.57 0.19 -4.15 4.33 -0.06 -0.25 -5.08 117.38 111.79 2bl6 n GLN 36 Ca 0.15 0.04 -0.13 0.00 -2.00 0.00 0.00 57.00 55.07 2bl6 n GLN 36 Cb 0.31 -1.14 -0.08 0.00 -4.06 0.00 0.00 30.24 25.28 2bl6 n GLN 36 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2bl6 h ARG 38 N 2.41 0.44 -3.01 0.00 -0.00 -1.83 -3.36 114.38 109.02 2bl6 h ARG 38 Ca -0.31 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.98 59.12 2bl6 h ARG 38 Cb 1.25 -0.10 -0.12 0.00 0.00 0.00 0.00 29.97 31.00 2bl6 h ARG 38 CO 0.45 0.29 0.20 0.00 0.00 0.00 0.00 179.97 180.91 2bl6 s ALA 39 N -5.45 -1.57 1.06 0.04 0.00 -1.25 -4.38 121.76 110.21 2bl6 s ALA 39 Ca -0.08 0.45 -0.16 0.00 0.00 0.00 0.00 51.96 52.17 2bl6 s ALA 39 Cb 0.21 0.88 0.22 0.00 0.00 0.00 0.00 23.12 24.44 2bl6 s ALA 39 CO 0.77 -0.77 1.17 -1.25 0.00 0.00 0.00 175.76 175.67 2bl6 s PRO 40 N -3.76 -0.09 0.30 0.00 0.04 -1.26 -2.78 135.00 127.45 2bl6 s PRO 40 Ca 0.01 -0.02 0.13 0.00 0.04 0.00 0.00 61.00 61.17 2bl6 s PRO 40 Cb -0.01 -1.72 0.73 0.00 0.04 0.00 0.00 34.50 33.53 2bl6 s PRO 40 CO -0.12 -2.97 1.32 1.17 0.04 0.00 0.00 177.00 176.44 2bl6 n LYS 41 N -4.24 0.09 -0.22 4.56 4.81 0.34 -1.36 118.16 122.14 2bl6 n LYS 41 Ca 0.11 0.56 0.11 0.00 -0.87 0.00 0.00 58.31 58.23 2bl6 n LYS 41 Cb 0.59 -2.04 0.40 0.00 0.02 0.00 0.00 35.03 34.00 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 0.88 -0.40 3.15 2.07 -1.92 -3.47 116.25 116.55 2bl6 h VAL 42 Ca 0.00 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.30 2bl6 h VAL 42 Cb 0.49 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2bl6 h VAL 42 CO 0.00 0.12 0.00 0.00 0.02 0.00 0.00 177.57 177.71 2bl6 n PHE 44 N 0.00 0.00 0.21 0.00 -1.74 -1.26 -4.72 117.46 109.95 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 -0.06 0.00 0.10 3.97 4.81 -1.26 -3.90 118.16 121.82 2bl6 n LYS 45 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.40 2bl6 n LYS 45 Cb 0.00 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.08 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 -3.58 -2.19 -1.88 0.00 2.85 -1.26 -4.95 118.16 107.14 2bl6 n LYS 47 Ca -0.01 0.18 -0.34 0.00 -1.05 0.00 0.00 58.31 57.09 2bl6 n LYS 47 Cb 0.77 -4.55 0.04 0.00 -0.65 0.00 0.00 35.03 30.65 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 -4.06 2.88 0.65 -1.58 -1.52 -1.26 -4.92 119.66 109.85 2bl6 s GLN 48 Ca 0.00 1.55 0.27 0.00 -1.95 0.00 0.00 55.36 55.23 2bl6 s GLN 48 Cb 0.00 -1.95 1.49 0.00 -0.22 0.00 0.00 33.01 32.33 2bl6 s GLN 48 CO 0.00 -1.21 1.83 -1.35 -0.25 0.00 0.00 175.29 174.31 2bl6 h PRO 49 N 0.41 0.00 0.00 2.91 0.11 -2.04 -3.24 132.00 130.15 2bl6 h PRO 49 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2bl6 h PRO 49 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2bl6 h PRO 49 CO 0.54 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.74 2bl6 n GLY 50 N -1.24 0.71 0.24 -0.55 0.00 -1.26 -4.96 105.19 98.13 2bl6 n GLY 50 Ca -0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.64 1.61 2.07 -1.96 -3.33 115.15 112.91 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 0.60 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.56 2bl6 h HIS 51 CO 0.00 0.16 0.22 0.27 -3.07 0.00 0.00 177.93 175.51 2bl6 h PHE 52 N 0.00 1.01 0.00 6.12 -5.15 -1.87 -2.28 116.94 114.76 2bl6 h PHE 52 Ca -0.00 -0.09 0.00 0.00 -0.20 0.00 0.00 57.97 57.67 2bl6 h PHE 52 Cb 0.34 -0.29 0.00 0.00 0.22 0.00 0.00 35.95 36.21 2bl6 h PHE 52 CO 0.00 0.81 0.00 0.43 -2.00 0.00 0.00 178.31 177.55 2bl6 n SER 53 N -4.38 0.00 -0.05 -0.68 7.64 -1.25 -0.56 113.62 114.33 2bl6 n SER 53 Ca 0.04 0.16 0.00 0.00 1.01 0.00 0.00 58.87 60.08 2bl6 n SER 53 Cb 0.20 -0.25 0.01 0.00 -1.01 0.00 0.00 64.21 63.15 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 -1.25 0.81 0.06 1.43 2.85 -0.90 -4.37 118.16 116.78 2bl6 n LYS 54 Ca 0.03 -0.88 0.00 0.00 -1.05 0.00 0.00 58.31 56.41 2bl6 n LYS 54 Cb 0.04 -0.66 0.00 0.00 -0.65 0.00 0.00 35.03 33.76 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 -0.18 0.00 0.06 -1.58 7.27 -0.93 -4.95 117.38 117.07 2bl6 n GLN 55 Ca 0.01 0.00 0.12 0.00 0.07 0.00 0.00 57.00 57.19 2bl6 n GLN 55 Cb 0.46 0.00 0.09 0.00 2.41 0.00 0.00 30.24 33.20 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 -2.24 0.00 0.00 0.00 3.00 0.27 -4.94 116.66 112.75 2bl6 n ARG 57 Ca 0.02 -0.64 0.00 0.00 -0.00 0.00 0.00 57.85 57.23 2bl6 n ARG 57 Cb 0.47 -0.40 0.00 0.00 0.00 0.00 0.00 32.46 32.53 2bl6 n ARG 57 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06