#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cbh n GLN 2 N 0.00 2.58 -4.36 -0.78 -0.06 0.33 -4.92 117.38 110.18 2cbh n GLN 2 Ca 0.00 0.00 -0.19 0.00 -2.00 0.00 0.00 57.00 54.81 2cbh n GLN 2 Cb 0.00 0.00 -0.10 0.00 -4.06 0.00 0.00 30.24 26.08 2cbh n GLN 2 CO 0.00 0.00 0.00 -1.12 -0.20 0.00 0.00 177.06 175.74 2cbh s SER 3 N -0.42 2.38 0.08 1.69 0.01 -1.26 -3.49 113.70 112.69 2cbh s SER 3 Ca 0.00 -1.12 -0.36 0.00 1.31 0.00 0.00 55.95 55.78 2cbh s SER 3 Cb 0.00 -0.10 -0.15 0.00 0.21 0.00 0.00 66.02 65.98 2cbh s SER 3 CO 0.00 -0.32 1.49 1.57 0.41 0.00 0.00 173.24 176.39 2cbh n HIS 4 N -0.43 1.89 -1.27 2.43 -0.00 -1.26 0.13 115.22 116.71 2cbh n HIS 4 Ca -0.07 0.45 -0.08 0.00 0.46 0.00 0.00 57.72 58.48 2cbh n HIS 4 Cb 0.62 -2.44 -0.03 0.00 -0.12 0.00 0.00 29.99 28.02 2cbh n HIS 4 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2cbh n TYR 5 N 3.31 -0.01 -3.35 1.57 4.01 0.33 -4.99 117.16 118.03 2cbh n TYR 5 Ca 0.19 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.64 2cbh n TYR 5 Cb 0.23 -1.68 -0.03 0.00 -0.31 0.00 0.00 39.34 37.55 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 -2.91 1.82 -0.30 2.72 0.00 0.34 -4.64 107.32 104.36 2cbh s GLY 6 Ca 0.00 -0.59 -0.28 0.00 0.00 0.00 0.00 44.72 43.85 2cbh s GLY 6 CO 0.00 -0.49 1.03 1.62 0.00 0.00 0.00 173.10 175.26 2cbh s GLN 7 N -3.59 4.08 -0.01 2.90 0.74 -1.26 -0.52 119.66 122.00 2cbh s GLN 7 Ca 0.43 1.05 0.13 0.00 0.05 0.00 0.00 55.36 57.03 2cbh s GLN 7 Cb -0.11 -3.72 -0.18 0.00 1.10 0.00 0.00 33.01 30.11 2cbh s GLN 7 CO 0.30 -0.83 0.39 0.00 -0.55 0.00 0.00 175.29 174.61 2cbh n GLY 9 N 1.57 2.15 0.00 0.00 0.00 -1.16 -3.97 105.19 103.77 2cbh n GLY 9 Ca -0.00 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.45 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 4.01 3.75 -0.02 0.00 -1.26 -0.81 105.19 110.35 2cbh n GLY 10 Ca 0.00 -1.57 -0.41 0.00 0.00 0.00 0.00 46.02 44.05 2cbh n GLY 10 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cbh s ILE 11 N -2.19 3.45 0.00 -0.61 1.01 -1.25 -2.36 121.20 119.25 2cbh s ILE 11 Ca 0.00 1.34 0.00 0.00 0.00 0.00 0.00 60.65 61.99 2cbh s ILE 11 Cb 0.00 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.62 2cbh s ILE 11 CO 0.00 0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.82 2cbh n GLY 12 N 1.62 3.07 3.55 6.18 0.00 -1.26 -4.85 105.19 113.49 2cbh n GLY 12 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.34 1.64 -1.12 1.61 5.04 -0.99 -4.80 117.35 117.39 2cbh s TYR 13 Ca 0.00 0.82 0.11 0.00 -2.44 0.00 0.00 57.07 55.56 2cbh s TYR 13 Cb 0.00 -4.06 0.46 0.00 0.35 0.00 0.00 41.96 38.70 2cbh s TYR 13 CO 0.00 -2.34 1.29 -1.13 -1.34 0.00 0.00 175.55 172.03 2cbh n SER 14 N 12.83 3.29 -4.41 4.32 3.41 -1.26 -4.78 113.62 127.02 2cbh n SER 14 Ca 0.21 -2.34 -0.27 0.00 -0.26 0.00 0.00 58.87 56.21 2cbh n SER 14 Cb 0.52 -0.49 0.15 0.00 -0.26 0.00 0.00 64.21 64.13 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 -0.68 1.77 0.74 5.00 0.00 -1.26 -5.03 107.32 107.85 2cbh s GLY 15 Ca 0.32 -1.41 -0.15 0.00 0.00 0.00 0.00 44.72 43.47 2cbh s GLY 15 CO 0.14 -0.75 1.22 2.56 0.00 0.00 0.00 173.10 176.27 2cbh s PRO 16 N -5.53 2.05 -0.13 2.90 0.04 -1.26 -4.95 135.00 128.11 2cbh s PRO 16 Ca 0.70 1.81 0.19 0.00 0.04 0.00 0.00 61.00 63.74 2cbh s PRO 16 Cb -0.05 -1.82 0.29 0.00 0.04 0.00 0.00 34.50 32.97 2cbh s PRO 16 CO 0.49 -1.92 1.15 0.25 0.04 0.00 0.00 177.00 177.02 2cbh n THR 17 N -2.76 1.90 -3.65 1.26 -2.24 -1.25 -4.51 114.28 103.02 2cbh n THR 17 Ca 0.14 -2.27 -0.39 0.00 -2.27 0.00 0.00 64.05 59.26 2cbh n THR 17 Cb 0.50 -0.24 -0.12 0.00 -2.10 0.00 0.00 70.33 68.37 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 -2.88 4.41 1.28 2.28 1.01 -1.26 -4.88 120.40 120.35 2cbh s VAL 18 Ca 0.32 -0.75 -0.18 0.00 0.00 0.00 0.00 61.98 61.36 2cbh s VAL 18 Cb 0.28 -3.39 0.31 0.00 0.00 0.00 0.00 36.38 33.59 2cbh s VAL 18 CO 0.03 -0.11 1.01 0.00 0.00 0.00 0.00 175.10 176.03 2cbh s ALA 20 N -2.54 1.66 0.43 0.00 0.00 -1.23 -4.23 121.76 115.85 2cbh s ALA 20 Ca 0.69 -0.79 -0.25 0.00 0.00 0.00 0.00 51.96 51.61 2cbh s ALA 20 Cb -0.16 -2.93 -0.08 0.00 0.00 0.00 0.00 23.12 19.94 2cbh s ALA 20 CO 0.59 -2.59 1.27 -1.12 0.00 0.00 0.00 175.76 173.91 2cbh s SER 21 N -4.23 6.22 0.00 0.00 0.01 -1.26 -2.21 113.70 112.23 2cbh s SER 21 Ca 0.68 2.57 0.00 0.00 1.31 0.00 0.00 55.95 60.51 2cbh s SER 21 Cb -0.11 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.49 2cbh s SER 21 CO 0.54 -0.90 0.00 0.61 0.41 0.00 0.00 173.24 173.89 2cbh n GLY 22 N 0.64 2.95 3.83 3.44 0.00 -1.26 -4.98 105.19 109.81 2cbh n GLY 22 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.88 3.97 0.21 2.61 -4.23 -0.94 -5.08 115.64 110.31 2cbh s THR 23 Ca 0.00 -1.41 0.02 0.00 -1.18 0.00 0.00 61.69 59.12 2cbh s THR 23 Cb 0.00 -3.28 -0.05 0.00 1.34 0.00 0.00 72.50 70.51 2cbh s THR 23 CO 0.00 -0.27 0.04 0.42 -0.54 0.00 0.00 174.62 174.28 2cbh s THR 24 N -2.22 0.64 -0.21 3.99 -4.23 -1.26 -4.62 115.64 107.72 2cbh s THR 24 Ca 0.37 -1.99 -0.12 0.00 -1.18 0.00 0.00 61.69 58.76 2cbh s THR 24 Cb -0.07 -2.35 -0.05 0.00 1.34 0.00 0.00 72.50 71.38 2cbh s THR 24 CO 0.25 -0.27 0.23 0.00 -0.54 0.00 0.00 174.62 174.30 2cbh s GLN 26 N 0.86 1.84 0.27 0.00 -0.21 -0.54 -4.99 119.66 116.88 2cbh s GLN 26 Ca 0.12 -0.56 -0.30 0.00 0.02 0.00 0.00 55.36 54.64 2cbh s GLN 26 Cb -0.13 -2.05 -0.13 0.00 1.00 0.00 0.00 33.01 31.69 2cbh s GLN 26 CO 0.04 -0.35 1.32 0.28 -2.12 0.00 0.00 175.29 174.46 2cbh n VAL 27 N 4.81 1.37 -0.11 1.09 0.31 -1.26 -1.78 118.33 122.75 2cbh n VAL 27 Ca -0.14 -0.34 -0.21 0.00 -0.01 0.00 0.00 64.34 63.64 2cbh n VAL 27 Cb 0.48 -1.43 -0.08 0.00 -0.91 0.00 0.00 33.84 31.91 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 1.64 1.92 -3.96 7.52 -0.00 0.21 -4.77 117.00 119.56 2cbh n LEU 28 Ca 0.09 0.38 -0.11 0.00 -0.00 0.00 0.00 56.01 56.37 2cbh n LEU 28 Cb 0.33 -0.83 -0.02 0.00 -0.00 0.00 0.00 43.42 42.89 2cbh n LEU 28 CO 0.62 0.21 0.30 0.20 -0.00 0.00 0.00 177.39 178.72 2cbh s ASN 29 N -6.81 0.40 0.00 1.96 0.01 0.79 -4.96 114.94 106.33 2cbh s ASN 29 Ca -0.32 -1.25 0.00 0.00 -0.71 0.00 0.00 52.86 50.58 2cbh s ASN 29 Cb 0.09 0.73 0.00 0.00 0.41 0.00 0.00 41.25 42.48 2cbh s ASN 29 CO 0.47 -1.42 0.34 -2.65 -1.51 0.00 0.00 177.10 172.32 2cbh n PRO 30 N -0.52 0.48 0.00 -0.60 -0.02 -1.26 -1.67 135.00 131.40 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 -1.25 0.00 0.00 -0.02 0.00 0.00 33.50 32.84 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 0.47 0.00 -3.63 6.00 4.01 -1.26 -4.07 117.16 118.67 2cbh n TYR 31 Ca 0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.61 2cbh n TYR 31 Cb 0.17 0.03 -0.07 0.00 -0.31 0.00 0.00 39.34 39.16 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 -0.83 -0.09 -0.72 5.04 -0.67 -3.93 117.35 116.15 2cbh s TYR 32 Ca 0.00 1.95 -0.02 0.00 -2.44 0.00 0.00 57.07 56.56 2cbh s TYR 32 Cb 0.00 0.33 0.03 0.00 0.35 0.00 0.00 41.96 42.67 2cbh s TYR 32 CO 0.00 -0.40 0.01 -1.12 -1.34 0.00 0.00 175.55 172.70 2cbh s SER 33 N 0.60 1.73 0.06 4.32 0.01 0.01 0.66 113.70 121.09 2cbh s SER 33 Ca -0.02 -0.17 -0.07 0.00 1.31 0.00 0.00 55.95 57.01 2cbh s SER 33 Cb -0.05 -0.44 -0.05 0.00 0.21 0.00 0.00 66.02 65.69 2cbh s SER 33 CO -0.03 -0.21 0.33 -1.58 0.41 0.00 0.00 173.24 172.16 2cbh s GLN 34 N 1.97 3.64 -0.32 12.44 0.74 -0.73 -1.51 119.66 135.89 2cbh s GLN 34 Ca 0.04 -0.02 -0.16 0.00 0.05 0.00 0.00 55.36 55.28 2cbh s GLN 34 Cb -0.13 -3.00 -0.02 0.00 1.10 0.00 0.00 33.01 30.96 2cbh s GLN 34 CO -0.06 0.58 0.42 0.00 -0.55 0.00 0.00 175.29 175.68