#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 3.48 0.70 -0.78 2.00 -0.41 -4.85 119.66 119.80 2cbh s GLN 2 Ca 0.00 -0.43 0.02 0.00 -2.00 0.00 0.00 55.36 52.96 2cbh s GLN 2 Cb 0.00 -2.93 0.13 0.00 0.80 0.00 0.00 33.01 31.00 2cbh s GLN 2 CO 0.00 0.50 0.96 -1.12 -0.50 0.00 0.00 175.29 175.13 2cbh s SER 3 N -2.94 4.45 0.49 6.67 0.01 -1.26 0.17 113.70 121.29 2cbh s SER 3 Ca 0.36 -0.56 -0.23 0.00 1.31 0.00 0.00 55.95 56.84 2cbh s SER 3 Cb -0.12 0.20 -0.08 0.00 0.21 0.00 0.00 66.02 66.24 2cbh s SER 3 CO 0.28 -1.80 1.11 1.57 0.41 0.00 0.00 173.24 174.81 2cbh n HIS 4 N -2.72 1.47 -2.36 2.43 -0.00 -1.26 -0.87 115.22 111.91 2cbh n HIS 4 Ca 0.16 0.49 -0.21 0.00 -0.00 0.00 0.00 57.72 58.17 2cbh n HIS 4 Cb 0.61 -2.26 -0.01 0.00 -0.00 0.00 0.00 29.99 28.33 2cbh n HIS 4 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 2cbh n TYR 5 N -0.85 -0.94 -3.75 1.57 4.01 0.22 -4.97 117.16 112.46 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 0.42 -3.91 -0.03 0.00 -0.31 0.00 0.00 39.34 35.51 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 -2.10 1.73 -0.55 2.72 0.00 -0.05 -4.74 107.32 104.32 2cbh s GLY 6 Ca 0.00 -0.90 -0.22 0.00 0.00 0.00 0.00 44.72 43.60 2cbh s GLY 6 CO 0.00 -0.86 0.82 1.62 0.00 0.00 0.00 173.10 174.68 2cbh s GLN 7 N -3.37 3.21 0.14 2.90 0.74 -1.26 0.02 119.66 122.03 2cbh s GLN 7 Ca 0.37 -0.62 0.20 0.00 0.05 0.00 0.00 55.36 55.36 2cbh s GLN 7 Cb -0.11 -4.11 -0.06 0.00 1.10 0.00 0.00 33.01 29.83 2cbh s GLN 7 CO 0.29 -1.44 0.94 0.00 -0.55 0.00 0.00 175.29 174.53 2cbh n GLY 9 N 1.28 2.79 0.00 0.00 0.00 -1.14 -4.06 105.19 104.05 2cbh n GLY 9 Ca -0.04 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.16 3.93 3.53 -0.02 0.00 -1.26 -0.28 105.19 110.93 2cbh n GLY 10 Ca 0.00 -1.32 -0.44 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.29 2.00 -0.91 -0.61 5.41 -1.18 -0.49 119.36 123.30 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 -0.76 0.00 0.00 -0.71 0.00 0.00 39.64 38.17 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 1.47 0.61 3.36 7.39 0.00 -1.26 -4.78 105.19 111.98 2cbh n GLY 12 Ca 0.11 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.70 3.06 -0.60 1.61 5.04 0.36 -4.91 117.35 119.21 2cbh s TYR 13 Ca 0.00 -1.01 -0.02 0.00 -2.44 0.00 0.00 57.07 53.60 2cbh s TYR 13 Cb 0.00 -3.92 0.38 0.00 0.35 0.00 0.00 41.96 38.77 2cbh s TYR 13 CO 0.00 -1.21 2.05 -1.13 -1.34 0.00 0.00 175.55 173.92 2cbh n SER 14 N 6.06 7.40 -4.79 4.32 3.41 -1.26 -4.79 113.62 123.98 2cbh n SER 14 Ca -0.10 -3.62 -0.23 0.00 -0.26 0.00 0.00 58.87 54.66 2cbh n SER 14 Cb 0.42 -1.01 -0.06 0.00 -0.26 0.00 0.00 64.21 63.31 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 -1.29 2.25 0.58 5.00 0.00 -1.26 -5.08 107.32 107.52 2cbh s GLY 15 Ca 0.56 -2.02 -0.18 0.00 0.00 0.00 0.00 44.72 43.08 2cbh s GLY 15 CO -0.04 -1.82 0.67 -1.05 0.00 0.00 0.00 173.10 170.86 2cbh n PRO 16 N -1.36 0.64 -0.00 2.90 -0.02 -1.26 -4.92 135.00 130.98 2cbh n PRO 16 Ca 0.01 0.25 0.04 0.00 -2.02 0.00 0.00 63.50 61.78 2cbh n PRO 16 Cb 0.63 -1.85 -0.05 0.00 -0.02 0.00 0.00 33.50 32.21 2cbh n PRO 16 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2cbh n THR 17 N -1.69 0.00 -2.80 3.45 -2.24 -1.26 -4.54 114.28 105.20 2cbh n THR 17 Ca 0.12 -0.28 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 2cbh n THR 17 Cb 0.47 0.85 -0.03 0.00 -2.10 0.00 0.00 70.33 69.52 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 -1.99 4.85 0.62 2.28 1.01 -1.26 -4.74 120.40 121.18 2cbh s VAL 18 Ca 0.02 1.83 -0.11 0.00 0.00 0.00 0.00 61.98 63.73 2cbh s VAL 18 Cb 0.06 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2cbh s VAL 18 CO 0.36 0.05 1.03 0.00 0.00 0.00 0.00 175.10 176.54 2cbh s ALA 20 N -3.18 -0.57 0.49 0.00 0.00 0.46 -4.64 121.76 114.31 2cbh s ALA 20 Ca 0.55 -0.57 -0.24 0.00 0.00 0.00 0.00 51.96 51.71 2cbh s ALA 20 Cb -0.11 -3.05 -0.07 0.00 0.00 0.00 0.00 23.12 19.89 2cbh s ALA 20 CO 0.53 -4.25 1.34 -1.12 0.00 0.00 0.00 175.76 172.27 2cbh s SER 21 N -2.96 5.72 0.00 0.00 0.01 -1.26 -2.47 113.70 112.73 2cbh s SER 21 Ca 0.69 2.73 0.00 0.00 1.31 0.00 0.00 55.95 60.68 2cbh s SER 21 Cb -0.18 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.42 2cbh s SER 21 CO 0.60 -1.26 0.00 0.61 0.41 0.00 0.00 173.24 173.60 2cbh n GLY 22 N 0.64 2.36 3.56 3.44 0.00 -1.26 -5.00 105.19 108.92 2cbh n GLY 22 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.45 2.13 0.05 2.61 -4.23 -1.03 -5.05 115.64 107.67 2cbh s THR 23 Ca 0.00 -2.14 -0.00 0.00 -1.18 0.00 0.00 61.69 58.36 2cbh s THR 23 Cb 0.00 -2.74 -0.04 0.00 1.34 0.00 0.00 72.50 71.06 2cbh s THR 23 CO 0.00 -0.14 -0.04 0.42 -0.54 0.00 0.00 174.62 174.32 2cbh s THR 24 N -2.66 0.28 0.03 3.99 -4.23 -1.26 -4.71 115.64 107.06 2cbh s THR 24 Ca 0.33 -1.70 -0.28 0.00 -1.18 0.00 0.00 61.69 58.87 2cbh s THR 24 Cb 0.05 -1.36 -0.04 0.00 1.34 0.00 0.00 72.50 72.48 2cbh s THR 24 CO 0.17 -0.91 0.88 0.00 -0.54 0.00 0.00 174.62 174.22 2cbh s GLN 26 N 0.48 1.80 0.06 0.00 -0.21 0.12 -4.94 119.66 116.97 2cbh s GLN 26 Ca 0.45 -0.41 -0.30 0.00 0.02 0.00 0.00 55.36 55.12 2cbh s GLN 26 Cb -0.21 -1.84 -0.09 0.00 1.00 0.00 0.00 33.01 31.87 2cbh s GLN 26 CO 0.26 -0.28 1.85 0.08 -2.12 0.00 0.00 175.29 175.07 2cbh s VAL 27 N 1.61 2.93 -0.21 1.09 1.01 -1.26 -1.01 120.40 124.56 2cbh s VAL 27 Ca 0.04 0.17 -0.17 0.00 0.00 0.00 0.00 61.98 62.03 2cbh s VAL 27 Cb -0.13 -3.11 -0.12 0.00 0.00 0.00 0.00 36.38 33.02 2cbh s VAL 27 CO -0.09 -0.01 -0.07 -0.11 0.00 0.00 0.00 175.10 174.82 2cbh n LEU 28 N 6.66 1.88 -3.95 3.92 -0.00 -0.11 -4.84 117.00 120.55 2cbh n LEU 28 Ca 0.18 0.44 -0.10 0.00 -0.00 0.00 0.00 56.01 56.53 2cbh n LEU 28 Cb 0.40 -0.89 -0.02 0.00 -0.00 0.00 0.00 43.42 42.91 2cbh n LEU 28 CO 0.66 0.12 0.31 0.20 -0.00 0.00 0.00 177.39 178.68 2cbh s ASN 29 N -6.66 0.20 0.00 1.96 0.01 0.76 -4.98 114.94 106.23 2cbh s ASN 29 Ca -0.28 -1.11 0.00 0.00 -0.71 0.00 0.00 52.86 50.76 2cbh s ASN 29 Cb 0.07 0.71 0.00 0.00 0.41 0.00 0.00 41.25 42.44 2cbh s ASN 29 CO 0.47 -1.38 0.42 -2.65 -1.51 0.00 0.00 177.10 172.45 2cbh n PRO 30 N -0.49 0.64 -0.15 -0.60 -0.02 -1.26 -1.91 135.00 131.20 2cbh n PRO 30 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 2cbh n PRO 30 Cb 0.61 -1.27 0.00 0.00 -0.02 0.00 0.00 33.50 32.81 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 0.34 0.00 -3.53 6.00 4.01 -1.26 -3.07 117.16 119.65 2cbh n TYR 31 Ca 0.00 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.75 2cbh n TYR 31 Cb 0.21 0.09 -0.06 0.00 -0.31 0.00 0.00 39.34 39.28 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 -0.34 -0.19 -0.72 5.04 -0.80 -4.34 117.35 115.99 2cbh s TYR 32 Ca 0.00 0.64 -0.00 0.00 -2.44 0.00 0.00 57.07 55.27 2cbh s TYR 32 Cb 0.00 0.20 0.05 0.00 0.35 0.00 0.00 41.96 42.56 2cbh s TYR 32 CO 0.00 -0.17 -0.04 -1.12 -1.34 0.00 0.00 175.55 172.88 2cbh s SER 33 N 1.55 3.20 0.24 4.32 0.01 0.61 -0.17 113.70 123.45 2cbh s SER 33 Ca -0.06 -0.86 -0.11 0.00 1.31 0.00 0.00 55.95 56.23 2cbh s SER 33 Cb -0.03 -0.96 -0.07 0.00 0.21 0.00 0.00 66.02 65.17 2cbh s SER 33 CO -0.14 -0.22 0.57 -1.58 0.41 0.00 0.00 173.24 172.29 2cbh s GLN 34 N 1.58 3.84 -0.36 12.44 0.74 -0.18 -0.98 119.66 136.73 2cbh s GLN 34 Ca -0.02 0.34 -0.10 0.00 0.05 0.00 0.00 55.36 55.63 2cbh s GLN 34 Cb -0.17 -2.63 0.03 0.00 1.10 0.00 0.00 33.01 31.34 2cbh s GLN 34 CO -0.07 0.30 0.18 0.00 -0.55 0.00 0.00 175.29 175.15