#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cbh s GLN 2 N 0.00 2.78 0.00 -0.78 2.00 0.32 -4.88 119.66 119.09 2cbh s GLN 2 Ca 0.00 -0.69 0.00 0.00 -2.00 0.00 0.00 55.36 52.67 2cbh s GLN 2 Cb 0.00 -2.67 0.00 0.00 0.80 0.00 0.00 33.01 31.14 2cbh s GLN 2 CO 0.00 0.58 0.00 0.43 -0.50 0.00 0.00 175.29 175.80 2cbh n SER 3 N 0.79 0.00 -4.73 6.67 7.64 -1.26 0.27 113.62 123.00 2cbh n SER 3 Ca -0.11 -0.74 -0.42 0.00 1.01 0.00 0.00 58.87 58.61 2cbh n SER 3 Cb 0.52 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.69 2cbh n SER 3 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2cbh s HIS 4 N 0.60 3.13 -0.79 1.43 5.65 -1.26 -1.84 115.29 122.21 2cbh s HIS 4 Ca 0.00 0.92 0.00 0.00 0.25 0.00 0.00 55.06 56.23 2cbh s HIS 4 Cb 0.00 -3.78 0.00 0.00 -1.18 0.00 0.00 32.58 27.62 2cbh s HIS 4 CO 0.00 -2.69 0.00 0.66 -0.65 0.00 0.00 174.74 172.06 2cbh n TYR 5 N 3.29 -0.40 -3.79 3.88 4.01 0.10 -5.01 117.16 119.23 2cbh n TYR 5 Ca 0.10 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.57 2cbh n TYR 5 Cb 0.41 -2.26 -0.03 0.00 -0.31 0.00 0.00 39.34 37.14 2cbh n TYR 5 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2cbh s GLY 6 N -2.61 1.77 -0.30 2.72 0.00 -0.76 -4.74 107.32 103.39 2cbh s GLY 6 Ca 0.00 -0.90 -0.23 0.00 0.00 0.00 0.00 44.72 43.58 2cbh s GLY 6 CO 0.00 -0.87 0.79 1.62 0.00 0.00 0.00 173.10 174.64 2cbh s GLN 7 N -3.28 3.97 -0.19 2.90 0.74 -1.26 0.04 119.66 122.58 2cbh s GLN 7 Ca 0.37 0.60 0.11 0.00 0.05 0.00 0.00 55.36 56.49 2cbh s GLN 7 Cb -0.11 -3.72 -0.19 0.00 1.10 0.00 0.00 33.01 30.08 2cbh s GLN 7 CO 0.29 -0.67 -0.02 0.00 -0.55 0.00 0.00 175.29 174.34 2cbh n GLY 9 N 2.08 1.83 0.00 0.00 0.00 -1.15 -3.74 105.19 104.21 2cbh n GLY 9 Ca -0.32 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.23 2cbh n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cbh n GLY 10 N -0.51 3.61 3.72 -0.02 0.00 -1.26 0.20 105.19 110.94 2cbh n GLY 10 Ca -0.02 -1.69 -0.37 0.00 0.00 0.00 0.00 46.02 43.94 2cbh n GLY 10 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2cbh n ILE 11 N -1.19 4.56 0.00 -0.61 5.41 -1.24 -1.61 119.36 124.68 2cbh n ILE 11 Ca 0.00 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.25 2cbh n ILE 11 Cb 0.00 -1.49 0.00 0.00 -0.71 0.00 0.00 39.64 37.44 2cbh n ILE 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2cbh n GLY 12 N 0.93 2.94 3.76 7.39 0.00 -1.26 -4.50 105.19 114.44 2cbh n GLY 12 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2cbh n GLY 12 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2cbh s TYR 13 N -1.28 3.89 -0.27 1.61 5.04 -0.63 -4.96 117.35 120.74 2cbh s TYR 13 Ca 0.00 1.71 0.20 0.00 -2.44 0.00 0.00 57.07 56.55 2cbh s TYR 13 Cb 0.00 -2.88 0.50 0.00 0.35 0.00 0.00 41.96 39.93 2cbh s TYR 13 CO 0.00 0.41 1.12 -1.13 -1.34 0.00 0.00 175.55 174.61 2cbh n SER 14 N 1.97 2.15 -4.78 4.32 3.41 -1.26 -4.83 113.62 114.59 2cbh n SER 14 Ca -0.03 -2.33 -0.29 0.00 -0.26 0.00 0.00 58.87 55.96 2cbh n SER 14 Cb 0.49 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 63.92 2cbh n SER 14 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2cbh s GLY 15 N -3.77 2.70 0.81 5.00 0.00 -1.26 -5.10 107.32 105.70 2cbh s GLY 15 Ca 0.31 -1.06 -0.13 0.00 0.00 0.00 0.00 44.72 43.83 2cbh s GLY 15 CO -0.03 -2.08 1.11 -1.55 0.00 0.00 0.00 173.10 170.56 2cbh n PRO 16 N -1.36 0.16 -1.00 2.90 -0.04 -1.26 -4.92 135.00 129.48 2cbh n PRO 16 Ca -0.10 0.13 -0.05 0.00 -0.04 0.00 0.00 63.50 63.44 2cbh n PRO 16 Cb 0.66 -2.37 0.16 0.00 -0.04 0.00 0.00 33.50 31.91 2cbh n PRO 16 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2cbh n THR 17 N -3.25 2.40 -4.06 0.52 -2.24 -1.25 -4.57 114.28 101.84 2cbh n THR 17 Ca 0.13 -3.37 -0.33 0.00 -2.27 0.00 0.00 64.05 58.21 2cbh n THR 17 Cb 0.50 -0.50 -0.15 0.00 -2.10 0.00 0.00 70.33 68.08 2cbh n THR 17 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2cbh s VAL 18 N -3.61 2.40 0.83 2.28 1.01 -1.26 -4.89 120.40 117.16 2cbh s VAL 18 Ca 0.43 -0.89 -0.13 0.00 0.00 0.00 0.00 61.98 61.40 2cbh s VAL 18 Cb 0.39 -2.07 0.10 0.00 0.00 0.00 0.00 36.38 34.80 2cbh s VAL 18 CO -0.03 0.46 1.20 0.00 0.00 0.00 0.00 175.10 176.74 2cbh s ALA 20 N -3.63 3.00 0.21 0.00 0.00 0.76 -4.48 121.76 117.61 2cbh s ALA 20 Ca 0.64 0.71 -0.29 0.00 0.00 0.00 0.00 51.96 53.02 2cbh s ALA 20 Cb -0.10 -3.29 -0.16 0.00 0.00 0.00 0.00 23.12 19.57 2cbh s ALA 20 CO 0.50 -0.32 0.71 0.43 0.00 0.00 0.00 175.76 177.07 2cbh n SER 21 N -0.42 -0.39 0.00 0.00 7.64 -1.26 -1.48 113.62 117.70 2cbh n SER 21 Ca 0.07 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.09 2cbh n SER 21 Cb 0.50 -1.05 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 2cbh n SER 21 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cbh n GLY 22 N 1.77 2.90 3.76 0.23 0.00 -1.26 -5.04 105.19 107.54 2cbh n GLY 22 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 2cbh n GLY 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2cbh s THR 23 N -2.80 2.15 0.08 2.61 -4.23 -0.55 -5.06 115.64 107.85 2cbh s THR 23 Ca 0.00 -1.70 -0.03 0.00 -1.18 0.00 0.00 61.69 58.78 2cbh s THR 23 Cb 0.00 -2.85 -0.03 0.00 1.34 0.00 0.00 72.50 70.95 2cbh s THR 23 CO 0.00 0.00 0.05 0.42 -0.54 0.00 0.00 174.62 174.55 2cbh s THR 24 N -2.64 0.17 0.14 3.99 -4.23 0.39 -4.73 115.64 108.73 2cbh s THR 24 Ca 0.38 -1.70 -0.23 0.00 -1.18 0.00 0.00 61.69 58.96 2cbh s THR 24 Cb 0.03 -1.63 -0.08 0.00 1.34 0.00 0.00 72.50 72.16 2cbh s THR 24 CO 0.21 -0.77 0.71 0.00 -0.54 0.00 0.00 174.62 174.23 2cbh s GLN 26 N -1.21 0.36 0.06 0.00 -0.21 0.38 -4.96 119.66 114.07 2cbh s GLN 26 Ca 0.34 0.09 -0.34 0.00 0.02 0.00 0.00 55.36 55.47 2cbh s GLN 26 Cb -0.22 -1.10 -0.13 0.00 1.00 0.00 0.00 33.01 32.56 2cbh s GLN 26 CO 0.24 -0.40 1.67 0.28 -2.12 0.00 0.00 175.29 174.96 2cbh n VAL 27 N 5.19 0.21 -0.09 1.09 0.31 -1.26 -1.51 118.33 122.27 2cbh n VAL 27 Ca -0.06 -0.04 -0.12 0.00 -0.01 0.00 0.00 64.34 64.11 2cbh n VAL 27 Cb 0.49 -1.59 -0.04 0.00 -0.91 0.00 0.00 33.84 31.79 2cbh n VAL 27 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2cbh n LEU 28 N 4.52 1.89 -4.00 7.52 -0.00 0.14 -4.84 117.00 122.24 2cbh n LEU 28 Ca 0.19 0.44 -0.12 0.00 -0.00 0.00 0.00 56.01 56.52 2cbh n LEU 28 Cb 0.28 -0.81 -0.03 0.00 -0.00 0.00 0.00 43.42 42.86 2cbh n LEU 28 CO 0.67 -0.16 0.26 0.20 -0.00 0.00 0.00 177.39 178.35 2cbh s ASN 29 N -6.17 0.49 0.00 1.96 0.01 0.23 -4.97 114.94 106.50 2cbh s ASN 29 Ca -0.26 -1.29 0.00 0.00 -0.71 0.00 0.00 52.86 50.60 2cbh s ASN 29 Cb 0.05 0.70 0.00 0.00 0.41 0.00 0.00 41.25 42.41 2cbh s ASN 29 CO 0.39 -1.38 0.26 -2.65 -1.51 0.00 0.00 177.10 172.21 2cbh n PRO 30 N -0.52 0.37 -0.14 -0.60 -0.02 -1.26 -1.48 135.00 131.34 2cbh n PRO 30 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 2cbh n PRO 30 Cb 0.61 -1.24 0.00 0.00 -0.02 0.00 0.00 33.50 32.85 2cbh n PRO 30 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2cbh n TYR 31 N 0.52 0.00 -3.64 6.00 4.01 -1.26 -3.66 117.16 119.12 2cbh n TYR 31 Ca 0.00 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.69 2cbh n TYR 31 Cb 0.13 0.12 -0.07 0.00 -0.31 0.00 0.00 39.34 39.22 2cbh n TYR 31 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 2cbh s TYR 32 N 0.00 -0.35 -0.11 -0.72 5.04 -0.55 -4.38 117.35 116.27 2cbh s TYR 32 Ca 0.00 0.80 -0.02 0.00 -2.44 0.00 0.00 57.07 55.40 2cbh s TYR 32 Cb 0.00 0.36 0.04 0.00 0.35 0.00 0.00 41.96 42.72 2cbh s TYR 32 CO 0.00 -0.17 0.04 -1.12 -1.34 0.00 0.00 175.55 172.96 2cbh s SER 33 N 0.47 1.94 0.36 4.32 0.01 0.54 0.28 113.70 121.62 2cbh s SER 33 Ca 0.01 -0.32 -0.07 0.00 1.31 0.00 0.00 55.95 56.89 2cbh s SER 33 Cb -0.04 -0.39 -0.05 0.00 0.21 0.00 0.00 66.02 65.75 2cbh s SER 33 CO -0.11 -0.26 0.66 -1.58 0.41 0.00 0.00 173.24 172.36 2cbh s GLN 34 N 2.01 3.66 -0.41 12.44 2.00 -0.57 -1.02 119.66 137.78 2cbh s GLN 34 Ca 0.03 0.17 -0.10 0.00 -2.00 0.00 0.00 55.36 53.46 2cbh s GLN 34 Cb -0.14 -2.52 0.07 0.00 0.80 0.00 0.00 33.01 31.21 2cbh s GLN 34 CO -0.06 0.07 0.25 0.00 -0.50 0.00 0.00 175.29 175.05