#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nle h HIS 2 N 0.00 0.22 0.01 2.11 -0.00 -1.91 0.70 115.15 116.28 2nle h HIS 2 Ca 0.00 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.41 2nle h HIS 2 Cb 0.00 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 27.37 2nle h HIS 2 CO 0.00 0.04 -0.08 -0.92 -0.00 0.00 0.00 177.93 176.97 2nle h TYR 3 N 0.28 -0.21 -0.54 5.26 3.20 -1.99 -1.04 116.97 121.92 2nle h TYR 3 Ca 0.23 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 62.00 2nle h TYR 3 Cb 0.28 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 2nle h TYR 3 CO -0.19 -0.13 -0.08 -0.97 -1.64 0.00 0.00 178.16 175.14 2nle h ASN 4 N -0.15 1.01 0.94 -2.11 -1.24 -1.91 0.42 115.58 112.54 2nle h ASN 4 Ca 0.03 -0.34 -0.05 0.00 0.71 0.00 0.00 56.30 56.65 2nle h ASN 4 Cb 0.19 -0.27 0.01 0.00 0.73 0.00 0.00 38.32 38.97 2nle h ASN 4 CO -0.08 1.11 -0.45 0.00 -1.29 0.00 0.00 177.43 176.72 2nle h VAL 6 N -1.33 1.35 0.00 0.00 2.07 -1.23 0.12 116.25 117.24 2nle h VAL 6 Ca -0.13 -1.90 0.00 0.00 0.82 0.00 0.00 66.70 65.49 2nle h VAL 6 Cb 0.97 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 2nle h VAL 6 CO 0.21 0.57 0.00 0.77 0.02 0.00 0.00 177.57 179.15 2nle h SER 7 N 0.29 0.00 -0.07 0.57 4.64 -0.91 -1.72 113.55 116.34 2nle h SER 7 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2nle h SER 7 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2nle h SER 7 CO 0.10 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.86 2nle n SER 8 N -2.62 2.80 0.00 4.97 7.64 -0.80 -4.97 113.62 120.64 2nle n SER 8 Ca 0.01 -1.92 0.00 0.00 1.01 0.00 0.00 58.87 57.97 2nle n SER 8 Cb 0.25 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 2nle n SER 8 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2nle n GLY 9 N 1.34 0.82 4.01 0.23 0.00 -0.65 -5.07 105.19 105.87 2nle n GLY 9 Ca 0.15 -0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 2nle n GLY 9 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nle s GLY 10 N -2.02 1.75 -0.07 -0.02 0.00 0.39 -4.97 107.32 102.39 2nle s GLY 10 Ca 0.00 -1.91 0.05 0.00 0.00 0.00 0.00 44.72 42.86 2nle s GLY 10 CO 0.00 -1.39 -0.23 1.62 0.00 0.00 0.00 173.10 173.10 2nle s GLN 11 N -4.94 2.67 -0.38 2.90 0.74 -0.07 -4.14 119.66 116.44 2nle s GLN 11 Ca 0.64 -0.87 -0.24 0.00 0.05 0.00 0.00 55.36 54.95 2nle s GLN 11 Cb -0.05 -2.23 0.01 0.00 1.10 0.00 0.00 33.01 31.84 2nle s GLN 11 CO 0.42 0.37 0.82 0.00 -0.55 0.00 0.00 175.29 176.35 2nle s ALA 13 N 3.24 1.45 0.52 0.00 0.00 0.13 -4.95 121.76 122.16 2nle s ALA 13 Ca 0.33 -0.60 -0.20 0.00 0.00 0.00 0.00 51.96 51.50 2nle s ALA 13 Cb -0.13 -0.83 -0.07 0.00 0.00 0.00 0.00 23.12 22.10 2nle s ALA 13 CO 0.18 -0.22 1.11 0.71 0.00 0.00 0.00 175.76 177.55 2nle s TYR 14 N 1.28 2.77 0.00 0.00 1.51 -1.26 -0.10 117.35 121.54 2nle s TYR 14 Ca -0.02 1.55 0.00 0.00 -1.01 0.00 0.00 57.07 57.59 2nle s TYR 14 Cb -0.14 -3.24 0.00 0.00 -0.11 0.00 0.00 41.96 38.47 2nle s TYR 14 CO -0.04 -1.38 0.00 0.45 -1.11 0.00 0.00 175.55 173.46 2nle n SER 15 N -1.16 0.00 -3.53 2.29 2.88 -1.26 -4.81 113.62 108.03 2nle n SER 15 Ca 0.11 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.51 2nle n SER 15 Cb 0.51 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.93 2nle n SER 15 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2nle s ALA 16 N 0.00 -1.42 -0.14 -1.46 0.00 -1.26 -4.94 121.76 112.54 2nle s ALA 16 Ca 0.00 0.56 -0.10 0.00 0.00 0.00 0.00 51.96 52.42 2nle s ALA 16 Cb 0.00 0.54 -0.05 0.00 0.00 0.00 0.00 23.12 23.62 2nle s ALA 16 CO 0.00 -0.59 0.20 0.00 0.00 0.00 0.00 175.76 175.36 2nle s PRO 18 N -0.28 0.98 0.46 0.00 0.04 -1.26 -4.87 135.00 130.07 2nle s PRO 18 Ca 0.14 0.73 -0.24 0.00 0.04 0.00 0.00 61.00 61.67 2nle s PRO 18 Cb -0.12 -1.78 -0.08 0.00 0.04 0.00 0.00 34.50 32.55 2nle s PRO 18 CO 0.03 -2.41 1.32 1.51 0.04 0.00 0.00 177.00 177.49 2nle n ILE 19 N -3.99 2.93 -1.00 0.56 3.06 -1.26 -1.78 119.36 117.89 2nle n ILE 19 Ca 0.06 -0.50 0.00 0.00 -2.50 0.00 0.00 62.75 59.81 2nle n ILE 19 Cb 0.56 -1.65 0.00 0.00 0.54 0.00 0.00 39.64 39.08 2nle n ILE 19 CO 0.00 0.00 0.00 0.49 -2.50 0.00 0.00 176.55 174.54 2nle n PHE 20 N -0.44 0.00 -4.28 9.51 3.01 -1.26 -5.03 117.46 118.96 2nle n PHE 20 Ca 0.07 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.38 2nle n PHE 20 Cb 0.41 -0.06 -0.10 0.00 -0.01 0.00 0.00 39.48 39.73 2nle n PHE 20 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 2nle s THR 21 N -2.57 1.24 0.20 4.37 -4.23 -0.73 -4.97 115.64 108.94 2nle s THR 21 Ca 0.00 -2.08 -0.08 0.00 -1.18 0.00 0.00 61.69 58.35 2nle s THR 21 Cb 0.00 -1.99 -0.01 0.00 1.34 0.00 0.00 72.50 71.83 2nle s THR 21 CO 0.00 -0.63 0.31 -1.59 -0.54 0.00 0.00 174.62 172.17 2nle s LYS 22 N -3.76 1.29 0.05 3.99 -2.85 -1.26 -4.65 119.74 112.55 2nle s LYS 22 Ca 0.20 -1.30 -0.31 0.00 -1.00 0.00 0.00 55.97 53.57 2nle s LYS 22 Cb 0.03 0.38 -0.06 0.00 -2.06 0.00 0.00 37.83 36.12 2nle s LYS 22 CO 0.03 -0.48 1.33 0.42 0.10 0.00 0.00 175.35 176.75 2nle s ILE 23 N -4.02 3.70 -0.42 3.79 1.01 -1.26 -1.22 121.20 122.77 2nle s ILE 23 Ca 0.23 1.17 0.04 0.00 0.00 0.00 0.00 60.65 62.10 2nle s ILE 23 Cb 0.03 -3.75 0.18 0.00 0.01 0.00 0.00 42.46 38.92 2nle s ILE 23 CO 0.05 0.05 0.39 0.00 0.00 0.00 0.00 174.94 175.44 2nle n GLN 24 N 4.53 0.24 0.00 2.79 6.02 0.97 -4.92 117.38 127.02 2nle n GLN 24 Ca 0.11 -3.04 0.00 0.00 -0.01 0.00 0.00 57.00 54.06 2nle n GLN 24 Cb 0.44 -1.63 0.00 0.00 1.02 0.00 0.00 30.24 30.07 2nle n GLN 24 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nle n GLY 25 N 2.78 -1.71 3.20 1.08 0.00 -1.26 -4.48 105.19 104.81 2nle n GLY 25 Ca 0.28 -1.61 -0.12 0.00 0.00 0.00 0.00 46.02 44.57 2nle n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2nle s THR 26 N 0.00 0.17 0.15 2.61 -4.23 -1.26 -0.87 115.64 112.21 2nle s THR 26 Ca 0.00 -1.96 0.02 0.00 -1.18 0.00 0.00 61.69 58.57 2nle s THR 26 Cb 0.00 -2.31 -0.05 0.00 1.34 0.00 0.00 72.50 71.48 2nle s THR 26 CO 0.00 -0.22 -0.02 0.00 -0.54 0.00 0.00 174.62 173.84 2nle n TYR 28 N -0.19 -2.03 -3.77 0.00 0.53 -1.26 -1.39 117.16 109.04 2nle n TYR 28 Ca -0.08 0.72 -0.27 0.00 -1.02 0.00 0.00 57.90 57.24 2nle n TYR 28 Cb 0.62 -3.75 0.05 0.00 -1.03 0.00 0.00 39.34 35.24 2nle n TYR 28 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 2nle n ARG 29 N -2.64 -6.64 -0.91 -0.72 5.12 -1.26 -1.36 116.66 108.25 2nle n ARG 29 Ca -0.05 0.70 0.00 0.00 -1.93 0.00 0.00 57.85 56.58 2nle n ARG 29 Cb 0.58 -5.67 0.00 0.00 -1.16 0.00 0.00 32.46 26.21 2nle n ARG 29 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2nle n GLY 30 N -1.84 0.71 0.12 -0.13 0.00 -1.15 -4.88 105.19 98.01 2nle n GLY 30 Ca 0.03 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.17 2nle n GLY 30 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nle h LYS 31 N 2.06 0.00 -6.19 1.61 1.57 -0.78 -3.46 116.57 111.38 2nle h LYS 31 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 2nle h LYS 31 Cb 0.04 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.22 2nle h LYS 31 CO 0.00 0.00 -0.73 0.00 -0.57 0.00 0.00 179.45 178.15 2nle s ALA 32 N -3.24 2.87 0.41 3.86 0.00 -0.49 -4.67 121.76 120.50 2nle s ALA 32 Ca 0.04 -1.84 -0.15 0.00 0.00 0.00 0.00 51.96 50.02 2nle s ALA 32 Cb 0.10 -0.38 -0.08 0.00 0.00 0.00 0.00 23.12 22.76 2nle s ALA 32 CO 0.72 0.26 0.84 0.15 0.00 0.00 0.00 175.76 177.74 2nle s LYS 33 N -3.56 3.97 -0.24 0.00 -0.14 0.85 -1.09 119.74 119.53 2nle s LYS 33 Ca 0.31 0.76 -0.12 0.00 -1.36 0.00 0.00 55.97 55.55 2nle s LYS 33 Cb -0.05 -2.30 -0.05 0.00 -1.68 0.00 0.00 37.83 33.75 2nle s LYS 33 CO 0.16 -0.03 0.24 0.00 -0.76 0.00 0.00 175.35 174.96