#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 0.05 -0.02 2.11 -0.00 -1.93 0.38 115.15 115.74 2nlb h HIS 2 Ca 0.00 0.02 0.03 0.00 -0.00 0.00 0.00 60.37 60.42 2nlb h HIS 2 Cb 0.00 0.01 -0.05 0.00 -0.00 0.00 0.00 27.41 27.38 2nlb h HIS 2 CO 0.00 0.00 -0.25 -0.92 -0.00 0.00 0.00 177.93 176.77 2nlb h TYR 3 N 0.12 -0.66 -0.44 5.26 3.20 -1.99 -0.76 116.97 121.70 2nlb h TYR 3 Ca 0.11 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.99 2nlb h TYR 3 Cb 0.12 0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 2nlb h TYR 3 CO -0.17 -0.34 0.21 0.00 -1.64 0.00 0.00 178.16 176.23 2nlb h ALA 4 N 0.49 0.57 0.14 1.82 0.00 -1.91 -1.30 119.26 119.06 2nlb h ALA 4 Ca 0.07 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2nlb h ALA 4 Cb 0.47 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2nlb h ALA 4 CO -0.24 0.13 -0.33 0.00 0.00 0.00 0.00 179.25 178.81 2nlb h VAL 6 N -0.57 1.31 0.00 0.00 2.07 -1.09 0.66 116.25 118.63 2nlb h VAL 6 Ca 0.02 -1.60 -0.04 0.00 0.82 0.00 0.00 66.70 65.91 2nlb h VAL 6 Cb 0.59 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 2nlb h VAL 6 CO -0.18 0.50 -0.18 0.28 0.02 0.00 0.00 177.57 178.01 2nlb h SER 7 N 0.42 0.00 -0.43 0.57 0.02 -1.16 -2.74 113.55 110.23 2nlb h SER 7 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2nlb h SER 7 Cb 0.92 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2nlb h SER 7 CO 0.08 0.18 0.00 -1.54 -1.14 0.00 0.00 176.83 174.41 2nlb n SER 8 N -3.63 3.04 0.00 3.07 3.41 -0.78 -4.94 113.62 113.80 2nlb n SER 8 Ca -0.01 -1.95 0.00 0.00 -0.26 0.00 0.00 58.87 56.65 2nlb n SER 8 Cb 0.31 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 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 1.42 0.69 3.96 5.00 0.00 -1.03 -5.07 105.19 110.16 2nlb n GLY 9 Ca 0.19 -0.66 -0.22 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.63 2.03 -0.03 -0.02 0.00 0.20 -4.80 107.32 102.07 2nlb s GLY 10 Ca 0.00 -1.76 0.05 0.00 0.00 0.00 0.00 44.72 43.01 2nlb s GLY 10 CO 0.00 -1.76 -0.16 1.62 0.00 0.00 0.00 173.10 172.79 2nlb s GLN 11 N -4.43 1.51 -0.06 2.90 0.74 0.03 -4.10 119.66 116.26 2nlb s GLN 11 Ca 0.49 -0.58 -0.25 0.00 0.05 0.00 0.00 55.36 55.08 2nlb s GLN 11 Cb -0.04 -1.38 -0.03 0.00 1.10 0.00 0.00 33.01 32.65 2nlb s GLN 11 CO 0.31 0.28 0.78 0.00 -0.55 0.00 0.00 175.29 176.11 2nlb s LEU 13 N 1.03 1.45 0.19 0.00 1.43 -0.10 -4.93 118.68 117.75 2nlb s LEU 13 Ca 0.41 0.16 0.10 0.00 -1.03 0.00 0.00 54.13 53.77 2nlb s LEU 13 Cb -0.18 0.23 -0.08 0.00 0.03 0.00 0.00 46.19 46.19 2nlb s LEU 13 CO 0.20 -0.06 1.36 1.88 0.23 0.00 0.00 176.35 179.95 2nlb h TYR 14 N 6.42 0.00 -3.53 0.29 -1.99 -1.87 0.36 116.97 116.66 2nlb h TYR 14 Ca -0.31 0.00 -0.37 0.00 2.00 0.00 0.00 58.73 60.06 2nlb h TYR 14 Cb 1.18 0.00 0.15 0.00 2.00 0.00 0.00 36.73 40.06 2nlb h TYR 14 CO 0.43 0.79 0.33 -1.13 -0.00 0.00 0.00 178.16 178.58 2nlb n SER 15 N -3.31 -0.13 -4.77 3.88 3.41 -1.26 -4.83 113.62 106.60 2nlb n SER 15 Ca 0.01 -1.38 -0.37 0.00 -0.26 0.00 0.00 58.87 56.87 2nlb n SER 15 Cb 0.85 -0.87 -0.01 0.00 -0.26 0.00 0.00 64.21 63.91 2nlb n SER 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nlb s ALA 16 N -3.87 3.02 0.25 7.33 0.00 -1.26 -4.80 121.76 122.43 2nlb s ALA 16 Ca 0.64 0.91 -0.31 0.00 0.00 0.00 0.00 51.96 53.20 2nlb s ALA 16 Cb -0.02 -3.37 -0.12 0.00 0.00 0.00 0.00 23.12 19.61 2nlb s ALA 16 CO 0.46 -0.58 1.56 0.00 0.00 0.00 0.00 175.76 177.19 2nlb s PRO 18 N -0.09 1.61 0.28 0.00 0.04 -1.26 -4.90 135.00 130.67 2nlb s PRO 18 Ca 0.68 0.45 -0.28 0.00 0.04 0.00 0.00 61.00 61.89 2nlb s PRO 18 Cb -0.56 -1.88 -0.14 0.00 0.04 0.00 0.00 34.50 31.96 2nlb s PRO 18 CO 0.45 -1.91 0.99 1.51 0.04 0.00 0.00 177.00 178.09 2nlb n ILE 19 N -3.60 1.95 -1.09 0.56 3.06 -1.26 -2.07 119.36 116.91 2nlb n ILE 19 Ca 0.07 -0.49 -0.03 0.00 -2.50 0.00 0.00 62.75 59.80 2nlb n ILE 19 Cb 0.58 -0.94 -0.01 0.00 0.54 0.00 0.00 39.64 39.81 2nlb n ILE 19 CO 0.00 0.00 0.00 0.49 -2.50 0.00 0.00 176.55 174.54 2nlb n PHE 20 N 0.27 0.00 -4.23 9.51 3.01 -1.26 -5.03 117.46 119.72 2nlb n PHE 20 Ca 0.10 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.42 2nlb n PHE 20 Cb 0.31 -0.98 -0.10 0.00 -0.01 0.00 0.00 39.48 38.70 2nlb n PHE 20 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 2nlb s THR 21 N -1.99 1.13 0.17 4.37 -4.23 -0.88 -4.99 115.64 109.22 2nlb s THR 21 Ca 0.00 -1.92 0.03 0.00 -1.18 0.00 0.00 61.69 58.62 2nlb s THR 21 Cb 0.00 -1.69 -0.05 0.00 1.34 0.00 0.00 72.50 72.10 2nlb s THR 21 CO 0.00 -0.67 -0.04 -1.59 -0.54 0.00 0.00 174.62 171.79 2nlb s LYS 22 N -3.40 1.12 0.16 3.99 -2.85 -1.26 -4.72 119.74 112.79 2nlb s LYS 22 Ca 0.13 -1.53 -0.31 0.00 -1.00 0.00 0.00 55.97 53.26 2nlb s LYS 22 Cb 0.00 -0.45 -0.09 0.00 -2.06 0.00 0.00 37.83 35.23 2nlb s LYS 22 CO 0.01 -0.05 1.50 -1.50 0.10 0.00 0.00 175.35 175.41 2nlb s ILE 23 N -3.50 2.81 -0.45 3.79 2.07 -1.26 -1.47 121.20 123.19 2nlb s ILE 23 Ca 0.22 0.59 0.05 0.00 -1.41 0.00 0.00 60.65 60.10 2nlb s ILE 23 Cb 0.05 -3.38 0.19 0.00 0.13 0.00 0.00 42.46 39.45 2nlb s ILE 23 CO 0.03 0.05 0.51 0.00 -1.91 0.00 0.00 174.94 173.63 2nlb n GLN 24 N 3.75 0.39 0.00 3.50 6.02 0.19 -4.93 117.38 126.30 2nlb n GLN 24 Ca 0.12 -2.74 0.00 0.00 -0.01 0.00 0.00 57.00 54.37 2nlb n GLN 24 Cb 0.40 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 30.11 2nlb n GLN 24 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nlb n GLY 25 N 2.62 -1.31 3.43 1.08 0.00 -1.26 -4.63 105.19 105.11 2nlb n GLY 25 Ca 0.24 -2.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.04 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 0.00 0.21 2.61 -4.23 -1.26 -2.06 115.64 110.91 2nlb s THR 26 Ca 0.00 -1.67 -0.01 0.00 -1.18 0.00 0.00 61.69 58.83 2nlb s THR 26 Cb 0.00 -2.41 -0.04 0.00 1.34 0.00 0.00 72.50 71.39 2nlb s THR 26 CO 0.00 0.00 0.13 0.00 -0.54 0.00 0.00 174.62 174.21 2nlb n TYR 28 N -0.29 -2.65 -3.43 0.00 0.53 -1.26 -1.05 117.16 109.01 2nlb n TYR 28 Ca 0.02 0.97 -0.25 0.00 -1.02 0.00 0.00 57.90 57.62 2nlb n TYR 28 Cb 0.66 -4.07 0.03 0.00 -1.03 0.00 0.00 39.34 34.93 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 -2.50 -5.08 -0.93 -0.72 5.12 -1.26 -1.63 116.66 109.66 2nlb n ARG 29 Ca -0.04 0.70 0.00 0.00 -1.93 0.00 0.00 57.85 56.58 2nlb n ARG 29 Cb 0.56 -5.55 0.00 0.00 -1.16 0.00 0.00 32.46 26.31 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 -1.54 0.85 0.32 -0.13 0.00 -1.09 -4.90 105.19 98.69 2nlb n GLY 30 Ca -0.03 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.12 2nlb n GLY 30 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2nlb n LYS 31 N -2.01 0.95 -4.38 1.61 5.02 -0.64 -4.85 118.16 113.86 2nlb n LYS 31 Ca 0.00 -0.64 -0.19 0.00 -2.02 0.00 0.00 58.31 55.46 2nlb n LYS 31 Cb 0.00 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.42 2nlb n LYS 31 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2nlb s ALA 32 N -2.49 2.05 -0.13 7.82 0.00 -0.22 -4.82 121.76 123.97 2nlb s ALA 32 Ca 0.23 -1.87 -0.06 0.00 0.00 0.00 0.00 51.96 50.25 2nlb s ALA 32 Cb 0.19 0.51 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 2nlb s ALA 32 CO 0.53 -0.24 0.10 0.15 0.00 0.00 0.00 175.76 176.30 2nlb s LYS 33 N -3.85 3.52 -0.26 0.00 1.02 0.13 -1.16 119.74 119.13 2nlb s LYS 33 Ca 0.31 -0.23 -0.24 0.00 0.02 0.00 0.00 55.97 55.83 2nlb s LYS 33 Cb 0.06 -3.14 -0.00 0.00 -0.52 0.00 0.00 37.83 34.23 2nlb s LYS 33 CO 0.11 0.63 0.80 0.00 -0.92 0.00 0.00 175.35 175.97