#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nlb h HIS 2 N 0.00 -0.11 0.34 2.11 -0.00 -1.92 0.97 115.15 116.54 2nlb h HIS 2 Ca 0.00 0.04 -0.02 0.00 -0.00 0.00 0.00 60.37 60.39 2nlb h HIS 2 Cb 0.00 0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.53 2nlb h HIS 2 CO 0.00 -0.14 -0.16 -0.92 -0.00 0.00 0.00 177.93 176.71 2nlb h TYR 3 N 0.07 -0.43 -0.68 5.26 3.20 -1.99 -2.14 116.97 120.26 2nlb h TYR 3 Ca 0.23 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.18 2nlb h TYR 3 Cb 0.35 0.14 -0.07 0.00 1.54 0.00 0.00 36.73 38.70 2nlb h TYR 3 CO -0.34 -0.20 0.34 0.00 -1.64 0.00 0.00 178.16 176.33 2nlb h ALA 4 N 0.05 0.93 0.65 1.82 0.00 -1.90 0.19 119.26 120.99 2nlb h ALA 4 Ca -0.05 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2nlb h ALA 4 Cb 0.42 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2nlb h ALA 4 CO 0.08 -0.04 -0.41 0.00 0.00 0.00 0.00 179.25 178.88 2nlb h VAL 6 N -1.00 1.24 -0.86 0.00 2.07 -1.33 -0.44 116.25 115.93 2nlb h VAL 6 Ca -0.08 -0.78 0.07 0.00 0.82 0.00 0.00 66.70 66.72 2nlb h VAL 6 Cb 0.81 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 2nlb h VAL 6 CO 0.08 0.31 0.56 0.28 0.02 0.00 0.00 177.57 178.82 2nlb h SER 7 N 0.99 0.84 -0.16 0.57 0.02 -0.85 0.70 113.55 115.66 2nlb h SER 7 Ca 0.23 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 2nlb h SER 7 Cb 0.23 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.60 2nlb h SER 7 CO -0.02 0.53 0.00 -1.54 -1.14 0.00 0.00 176.83 174.67 2nlb n SER 8 N -4.49 1.52 0.00 3.07 3.41 -0.85 -4.91 113.62 111.38 2nlb n SER 8 Ca 0.13 -1.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.05 2nlb n SER 8 Cb 0.22 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 2nlb n SER 8 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2nlb n GLY 9 N 1.09 0.74 3.80 5.00 0.00 0.24 -5.06 105.19 111.01 2nlb n GLY 9 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2nlb n GLY 9 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nlb s GLY 10 N -1.59 1.70 0.04 -0.02 0.00 -0.23 -4.96 107.32 102.26 2nlb s GLY 10 Ca 0.00 -1.10 0.04 0.00 0.00 0.00 0.00 44.72 43.66 2nlb s GLY 10 CO 0.00 -0.29 -0.12 -0.86 0.00 0.00 0.00 173.10 171.83 2nlb s GLN 11 N -5.70 0.81 -0.22 2.90 -2.07 -0.53 -4.03 119.66 110.82 2nlb s GLN 11 Ca 0.73 -0.71 -0.23 0.00 -1.82 0.00 0.00 55.36 53.32 2nlb s GLN 11 Cb -0.06 -0.77 -0.02 0.00 -1.09 0.00 0.00 33.01 31.07 2nlb s GLN 11 CO 0.54 0.19 0.73 0.00 -1.32 0.00 0.00 175.29 175.43 2nlb s LEU 13 N 2.39 1.67 0.24 0.00 1.43 0.20 -4.93 118.68 119.68 2nlb s LEU 13 Ca 0.32 -0.14 0.25 0.00 -1.03 0.00 0.00 54.13 53.52 2nlb s LEU 13 Cb -0.16 -0.44 0.50 0.00 0.03 0.00 0.00 46.19 46.12 2nlb s LEU 13 CO 0.09 0.02 1.55 1.88 0.23 0.00 0.00 176.35 180.13 2nlb h TYR 14 N 6.58 0.00 -3.42 0.29 -1.99 -1.90 0.80 116.97 117.33 2nlb h TYR 14 Ca -0.34 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.39 2nlb h TYR 14 Cb 1.17 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.90 2nlb h TYR 14 CO 0.45 0.00 0.00 0.43 -0.00 0.00 0.00 178.16 179.04 2nlb n SER 15 N -2.47 0.27 -4.79 3.88 7.64 -1.26 -4.88 113.62 112.01 2nlb n SER 15 Ca 0.04 -0.42 -0.33 0.00 1.01 0.00 0.00 58.87 59.17 2nlb n SER 15 Cb 0.47 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.68 2nlb n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nlb s ALA 16 N -2.00 2.68 0.60 -0.43 0.00 -1.26 -4.85 121.76 116.50 2nlb s ALA 16 Ca 0.00 0.52 -0.17 0.00 0.00 0.00 0.00 51.96 52.31 2nlb s ALA 16 Cb 0.00 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 2nlb s ALA 16 CO 0.00 -0.86 1.10 0.00 0.00 0.00 0.00 175.76 176.00 2nlb s PRO 18 N -3.79 2.13 0.60 0.00 0.04 -1.26 -4.94 135.00 127.78 2nlb s PRO 18 Ca 0.68 0.42 -0.19 0.00 0.04 0.00 0.00 61.00 61.95 2nlb s PRO 18 Cb -0.21 -1.94 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 2nlb s PRO 18 CO 0.35 -1.54 1.02 0.44 0.04 0.00 0.00 177.00 177.31 2nlb n ILE 19 N -3.34 3.80 -0.96 0.56 -5.35 -1.26 -2.16 119.36 110.64 2nlb n ILE 19 Ca 0.07 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 2nlb n ILE 19 Cb 0.58 -1.21 0.00 0.00 -1.74 0.00 0.00 39.64 37.27 2nlb n ILE 19 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2nlb n PHE 20 N -1.67 0.00 -4.24 4.28 0.99 -1.26 -5.01 117.46 110.55 2nlb n PHE 20 Ca 0.14 0.00 -0.16 0.00 -0.00 0.00 0.00 57.45 57.43 2nlb n PHE 20 Cb 0.47 -0.73 -0.11 0.00 -1.00 0.00 0.00 39.48 38.12 2nlb n PHE 20 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 2nlb s THR 21 N -1.86 1.23 0.14 4.37 -4.23 -0.92 -4.97 115.64 109.41 2nlb s THR 21 Ca 0.00 -1.87 -0.05 0.00 -1.18 0.00 0.00 61.69 58.59 2nlb s THR 21 Cb 0.00 -1.65 -0.02 0.00 1.34 0.00 0.00 72.50 72.16 2nlb s THR 21 CO 0.00 -0.58 0.17 -0.75 -0.54 0.00 0.00 174.62 172.92 2nlb s LYS 22 N -3.16 1.02 0.05 3.99 2.20 -1.26 -4.70 119.74 117.88 2nlb s LYS 22 Ca 0.12 -1.27 -0.31 0.00 -0.36 0.00 0.00 55.97 54.16 2nlb s LYS 22 Cb -0.01 0.31 -0.08 0.00 -1.51 0.00 0.00 37.83 36.54 2nlb s LYS 22 CO 0.02 -0.33 1.66 0.42 -0.36 0.00 0.00 175.35 176.76 2nlb s ILE 23 N -3.99 3.10 -0.40 5.43 1.01 -1.26 -1.60 121.20 123.49 2nlb s ILE 23 Ca 0.19 0.50 0.03 0.00 0.00 0.00 0.00 60.65 61.37 2nlb s ILE 23 Cb 0.05 -3.32 0.16 0.00 0.01 0.00 0.00 42.46 39.37 2nlb s ILE 23 CO -0.00 -0.01 0.33 -1.10 0.00 0.00 0.00 174.94 174.16 2nlb s GLN 24 N 2.87 0.82 0.71 2.79 -0.21 0.54 -4.95 119.66 122.24 2nlb s GLN 24 Ca 0.74 -1.85 0.00 0.00 0.02 0.00 0.00 55.36 54.28 2nlb s GLN 24 Cb -0.39 -1.30 0.00 0.00 1.00 0.00 0.00 33.01 32.32 2nlb s GLN 24 CO 0.32 -1.34 0.00 0.41 -2.12 0.00 0.00 175.29 172.56 2nlb n GLY 25 N 3.16 -1.87 3.28 3.09 0.00 -1.26 -4.51 105.19 107.08 2nlb n GLY 25 Ca 0.25 -1.67 -0.17 0.00 0.00 0.00 0.00 46.02 44.43 2nlb n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2nlb s THR 26 N 0.00 0.14 0.14 2.61 -4.23 -1.26 -1.24 115.64 111.80 2nlb s THR 26 Ca 0.00 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.44 2nlb s THR 26 Cb 0.00 -2.50 -0.02 0.00 1.34 0.00 0.00 72.50 71.32 2nlb s THR 26 CO 0.00 0.00 0.20 0.00 -0.54 0.00 0.00 174.62 174.28 2nlb n TYR 28 N -0.15 -2.17 -3.86 0.00 0.53 -1.26 -1.46 117.16 108.78 2nlb n TYR 28 Ca -0.08 0.78 -0.29 0.00 -1.02 0.00 0.00 57.90 57.29 2nlb n TYR 28 Cb 0.63 -3.77 0.04 0.00 -1.03 0.00 0.00 39.34 35.20 2nlb n TYR 28 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 2nlb n ARG 29 N -2.49 -5.98 -0.84 -0.72 5.12 -1.26 -1.76 116.66 108.73 2nlb n ARG 29 Ca -0.04 0.64 0.00 0.00 -1.93 0.00 0.00 57.85 56.52 2nlb n ARG 29 Cb 0.57 -5.56 0.00 0.00 -1.16 0.00 0.00 32.46 26.30 2nlb n ARG 29 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2nlb n GLY 30 N -1.75 0.55 0.13 -0.13 0.00 -1.16 -4.90 105.19 97.93 2nlb n GLY 30 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 2nlb n GLY 30 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nlb h LYS 31 N 1.60 0.00 -6.02 1.61 1.79 -0.70 -3.44 116.57 111.42 2nlb h LYS 31 Ca 0.00 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.87 2nlb h LYS 31 Cb 0.07 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 30.61 2nlb h LYS 31 CO 0.00 0.00 -0.65 0.00 -1.08 0.00 0.00 179.45 177.72 2nlb s ALA 32 N -3.22 3.08 -0.02 3.86 0.00 -0.54 -4.88 121.76 120.05 2nlb s ALA 32 Ca 0.06 -1.98 -0.02 0.00 0.00 0.00 0.00 51.96 50.01 2nlb s ALA 32 Cb 0.10 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 2nlb s ALA 32 CO 0.70 0.10 0.14 0.15 0.00 0.00 0.00 175.76 176.84 2nlb s LYS 33 N -3.66 3.30 -0.40 0.00 -0.14 0.27 -1.27 119.74 117.84 2nlb s LYS 33 Ca 0.33 -0.36 -0.24 0.00 -1.36 0.00 0.00 55.97 54.34 2nlb s LYS 33 Cb -0.00 -3.02 0.02 0.00 -1.68 0.00 0.00 37.83 33.15 2nlb s LYS 33 CO 0.18 0.68 0.86 0.00 -0.76 0.00 0.00 175.35 176.31