#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 0.44 -2.14 -2.82 10.64 -1.21 -4.99 117.38 117.31 2cbh n GLN 2 Ca 0.00 0.00 -0.04 0.00 -1.83 0.00 0.00 57.00 55.13 2cbh n GLN 2 Cb 0.00 0.00 -0.01 0.00 -0.86 0.00 0.00 30.24 29.37 2cbh n GLN 2 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2cbh n SER 3 N -1.64 1.80 -4.54 2.61 7.64 -1.26 -2.71 113.62 115.52 2cbh n SER 3 Ca 0.00 -1.29 -0.30 0.00 1.01 0.00 0.00 58.87 58.30 2cbh n SER 3 Cb 0.00 0.03 0.21 0.00 -1.01 0.00 0.00 64.21 63.44 2cbh n SER 3 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2cbh n HIS 4 N -0.38 -0.42 -1.68 1.43 -0.00 -1.26 -1.11 115.22 111.80 2cbh n HIS 4 Ca -0.02 0.11 -0.08 0.00 0.46 0.00 0.00 57.72 58.19 2cbh n HIS 4 Cb 0.09 -1.82 -0.02 0.00 -0.12 0.00 0.00 29.99 28.11 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 -4.59 -0.97 -2.66 1.57 4.01 -0.61 -4.87 117.16 109.03 2cbh n TYR 5 Ca 0.07 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.52 2cbh n TYR 5 Cb 0.54 -2.05 -0.01 0.00 -0.31 0.00 0.00 39.34 37.50 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 -1.81 1.72 -0.50 2.72 0.00 -0.27 -4.65 107.32 104.53 2cbh s GLY 6 Ca 0.00 -0.32 -0.19 0.00 0.00 0.00 0.00 44.72 44.20 2cbh s GLY 6 CO 0.00 -0.13 0.64 1.62 0.00 0.00 0.00 173.10 175.22 2cbh s GLN 7 N -4.37 3.15 0.15 2.90 0.74 -1.26 0.72 119.66 121.68 2cbh s GLN 7 Ca 0.50 -0.81 0.23 0.00 0.05 0.00 0.00 55.36 55.33 2cbh s GLN 7 Cb -0.10 -4.08 -0.02 0.00 1.10 0.00 0.00 33.01 29.91 2cbh s GLN 7 CO 0.39 -1.20 0.97 0.00 -0.55 0.00 0.00 175.29 174.91 2cbh n GLY 9 N 1.22 3.45 0.00 0.00 0.00 -1.12 -3.98 105.19 104.76 2cbh n GLY 9 Ca -0.00 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 0.00 2.76 3.29 -0.02 0.00 -1.26 -0.97 105.19 108.99 2cbh n GLY 10 Ca 0.00 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.36 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 1.45 0.74 0.00 -0.61 5.41 -1.24 -0.44 119.36 124.67 2cbh n ILE 11 Ca 0.00 -0.45 0.00 0.00 1.00 0.00 0.00 62.75 63.30 2cbh n ILE 11 Cb 0.00 -0.32 0.00 0.00 -0.71 0.00 0.00 39.64 38.61 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 2.35 2.92 3.53 7.39 0.00 -1.26 -4.58 105.19 115.54 2cbh n GLY 12 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.39 3.01 -0.34 1.61 5.04 0.42 -4.89 117.35 119.81 2cbh s TYR 13 Ca 0.00 0.10 0.07 0.00 -2.44 0.00 0.00 57.07 54.80 2cbh s TYR 13 Cb 0.00 -3.57 0.54 0.00 0.35 0.00 0.00 41.96 39.28 2cbh s TYR 13 CO 0.00 -0.95 1.58 -1.13 -1.34 0.00 0.00 175.55 173.71 2cbh n SER 14 N 6.58 2.98 -4.70 4.32 3.41 -1.26 -4.84 113.62 120.10 2cbh n SER 14 Ca 0.01 -3.76 -0.21 0.00 -0.26 0.00 0.00 58.87 54.65 2cbh n SER 14 Cb 0.48 -0.69 0.04 0.00 -0.26 0.00 0.00 64.21 63.78 2cbh n SER 14 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cbh n GLY 15 N -1.11 2.32 3.78 5.00 0.00 -1.26 -5.09 105.19 108.82 2cbh n GLY 15 Ca 0.41 -2.25 -0.35 0.00 0.00 0.00 0.00 46.02 43.83 2cbh n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cbh s PRO 16 N -4.30 3.41 -0.03 1.61 0.04 -1.26 -4.96 135.00 129.51 2cbh s PRO 16 Ca 0.44 1.57 0.15 0.00 0.04 0.00 0.00 61.00 63.21 2cbh s PRO 16 Cb -0.04 -2.02 0.47 0.00 0.04 0.00 0.00 34.50 32.95 2cbh s PRO 16 CO 0.28 -0.79 1.39 0.25 0.04 0.00 0.00 177.00 178.17 2cbh n THR 17 N -1.28 1.24 -2.93 1.26 -2.24 -1.26 -4.68 114.28 104.39 2cbh n THR 17 Ca 0.11 -1.11 -0.42 0.00 -2.27 0.00 0.00 64.05 60.36 2cbh n THR 17 Cb 0.51 0.38 -0.05 0.00 -2.10 0.00 0.00 70.33 69.07 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 -1.29 4.76 0.17 2.28 1.01 -1.26 -4.78 120.40 121.28 2cbh s VAL 18 Ca 0.35 1.12 -0.26 0.00 0.00 0.00 0.00 61.98 63.18 2cbh s VAL 18 Cb 0.20 -4.18 -0.08 0.00 0.00 0.00 0.00 36.38 32.33 2cbh s VAL 18 CO 0.21 -0.32 0.82 0.00 0.00 0.00 0.00 175.10 175.81 2cbh n ALA 20 N 1.74 -2.86 -1.26 0.00 0.00 -1.10 -4.73 120.51 112.30 2cbh n ALA 20 Ca -0.04 0.07 -0.36 0.00 0.00 0.00 0.00 53.44 53.10 2cbh n ALA 20 Cb 0.48 -1.49 0.07 0.00 0.00 0.00 0.00 19.45 18.52 2cbh n ALA 20 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2cbh n SER 21 N 2.25 -1.18 0.00 0.00 3.41 -1.26 -2.37 113.62 114.47 2cbh n SER 21 Ca 0.10 0.59 0.00 0.00 -0.26 0.00 0.00 58.87 59.31 2cbh n SER 21 Cb 0.42 -1.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.16 2cbh n SER 21 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cbh n GLY 22 N 1.64 3.20 3.72 5.00 0.00 -1.26 -4.99 105.19 112.50 2cbh n GLY 22 Ca 0.10 0.00 -0.29 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 -1.90 1.67 0.36 2.61 -4.23 -1.00 -5.07 115.64 108.08 2cbh s THR 23 Ca 0.00 -1.91 0.06 0.00 -1.18 0.00 0.00 61.69 58.66 2cbh s THR 23 Cb 0.00 -2.58 -0.02 0.00 1.34 0.00 0.00 72.50 71.24 2cbh s THR 23 CO 0.00 0.00 0.22 0.35 -0.54 0.00 0.00 174.62 174.65 2cbh n THR 24 N -1.20 0.00 -3.86 3.99 -2.24 0.10 -4.84 114.28 106.23 2cbh n THR 24 Ca -0.10 -2.40 -0.37 0.00 -2.27 0.00 0.00 64.05 58.91 2cbh n THR 24 Cb 0.66 1.06 -0.06 0.00 -2.10 0.00 0.00 70.33 69.89 2cbh n THR 24 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cbh s GLN 26 N -0.95 0.02 0.31 0.00 -0.21 0.14 -4.86 119.66 114.10 2cbh s GLN 26 Ca 0.15 0.09 -0.29 0.00 0.02 0.00 0.00 55.36 55.32 2cbh s GLN 26 Cb -0.12 -1.37 -0.13 0.00 1.00 0.00 0.00 33.01 32.40 2cbh s GLN 26 CO 0.04 -0.55 1.31 0.28 -2.12 0.00 0.00 175.29 174.24 2cbh n VAL 27 N 5.29 1.67 -0.04 1.09 0.31 -1.26 -1.09 118.33 124.30 2cbh n VAL 27 Ca -0.06 -0.42 -0.05 0.00 -0.01 0.00 0.00 64.34 63.80 2cbh n VAL 27 Cb 0.49 -1.51 -0.02 0.00 -0.91 0.00 0.00 33.84 31.90 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 1.23 1.50 -4.13 7.52 -0.00 -0.00 -4.73 117.00 118.39 2cbh n LEU 28 Ca 0.07 0.24 -0.14 0.00 -0.00 0.00 0.00 56.01 56.18 2cbh n LEU 28 Cb 0.34 -0.57 -0.06 0.00 -0.00 0.00 0.00 43.42 43.13 2cbh n LEU 28 CO 0.62 -0.45 0.02 0.20 -0.00 0.00 0.00 177.39 177.78 2cbh s ASN 29 N -5.81 0.73 0.00 1.96 0.01 0.83 -4.99 114.94 107.68 2cbh s ASN 29 Ca -0.17 -1.42 0.00 0.00 -0.71 0.00 0.00 52.86 50.56 2cbh s ASN 29 Cb 0.02 0.57 0.00 0.00 0.41 0.00 0.00 41.25 42.25 2cbh s ASN 29 CO 0.25 -1.13 0.31 -2.65 -1.51 0.00 0.00 177.10 172.37 2cbh n PRO 30 N -0.48 0.50 -0.46 -0.60 -0.02 -1.26 -1.78 135.00 130.91 2cbh n PRO 30 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 2cbh n PRO 30 Cb 0.63 -1.25 0.00 0.00 -0.02 0.00 0.00 33.50 32.86 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 0.37 0.00 -3.57 6.00 4.01 -1.26 -3.65 117.16 119.05 2cbh n TYR 31 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2cbh n TYR 31 Cb 0.16 0.18 -0.06 0.00 -0.31 0.00 0.00 39.34 39.31 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 -0.41 -0.18 -0.72 5.04 -0.73 -4.46 117.35 115.89 2cbh s TYR 32 Ca 0.00 0.79 -0.01 0.00 -2.44 0.00 0.00 57.07 55.41 2cbh s TYR 32 Cb 0.00 0.25 0.05 0.00 0.35 0.00 0.00 41.96 42.61 2cbh s TYR 32 CO 0.00 -0.20 -0.02 -1.12 -1.34 0.00 0.00 175.55 172.86 2cbh s SER 33 N 1.50 2.97 0.31 4.32 0.01 -0.14 -0.12 113.70 122.55 2cbh s SER 33 Ca -0.07 -0.77 -0.03 0.00 1.31 0.00 0.00 55.95 56.39 2cbh s SER 33 Cb -0.03 -0.84 -0.04 0.00 0.21 0.00 0.00 66.02 65.31 2cbh s SER 33 CO -0.14 -0.23 0.55 -1.58 0.41 0.00 0.00 173.24 172.25 2cbh s GLN 34 N 1.68 3.56 -0.16 12.44 0.74 -0.25 -0.54 119.66 137.13 2cbh s GLN 34 Ca -0.01 -0.13 -0.05 0.00 0.05 0.00 0.00 55.36 55.21 2cbh s GLN 34 Cb -0.16 -2.65 -0.03 0.00 1.10 0.00 0.00 33.01 31.26 2cbh s GLN 34 CO -0.07 0.18 0.02 0.00 -0.55 0.00 0.00 175.29 174.86