#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 3.02 0.49 -2.82 1.11 0.73 -4.96 119.66 117.23 2cbh s GLN 2 Ca 0.00 -1.06 0.08 0.00 0.01 0.00 0.00 55.36 54.39 2cbh s GLN 2 Cb 0.00 -2.79 0.03 0.00 -1.01 0.00 0.00 33.01 29.24 2cbh s GLN 2 CO 0.00 -0.05 0.56 -1.54 0.01 0.00 0.00 175.29 174.26 2cbh s SER 3 N -4.23 5.15 0.24 5.90 1.04 -1.26 -1.81 113.70 118.73 2cbh s SER 3 Ca 0.48 -0.78 -0.31 0.00 0.48 0.00 0.00 55.95 55.82 2cbh s SER 3 Cb -0.10 -0.17 -0.14 0.00 0.10 0.00 0.00 66.02 65.72 2cbh s SER 3 CO 0.32 -0.97 1.36 1.57 0.98 0.00 0.00 173.24 176.50 2cbh n HIS 4 N -1.87 2.02 -1.28 5.02 -0.00 -1.26 0.28 115.22 118.13 2cbh n HIS 4 Ca 0.08 0.48 -0.10 0.00 0.46 0.00 0.00 57.72 58.64 2cbh n HIS 4 Cb 0.61 -2.43 -0.04 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 1.72 0.00 -3.10 1.57 4.01 -0.63 -4.98 117.16 115.75 2cbh n TYR 5 Ca 0.12 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.48 2cbh n TYR 5 Cb 0.31 -1.94 -0.06 0.00 -0.31 0.00 0.00 39.34 37.34 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 -2.77 2.73 -0.14 2.72 0.00 0.14 -4.54 107.32 105.46 2cbh s GLY 6 Ca 0.00 0.20 -0.29 0.00 0.00 0.00 0.00 44.72 44.63 2cbh s GLY 6 CO 0.00 0.62 1.33 1.62 0.00 0.00 0.00 173.10 176.67 2cbh s GLN 7 N -1.52 4.23 -0.01 2.90 0.74 -1.26 0.22 119.66 124.96 2cbh s GLN 7 Ca 0.38 1.75 0.12 0.00 0.05 0.00 0.00 55.36 57.66 2cbh s GLN 7 Cb -0.19 -3.79 -0.17 0.00 1.10 0.00 0.00 33.01 29.96 2cbh s GLN 7 CO 0.22 -0.72 0.38 0.00 -0.55 0.00 0.00 175.29 174.63 2cbh n GLY 9 N 1.57 3.83 0.04 0.00 0.00 -1.11 -4.29 105.19 105.23 2cbh n GLY 9 Ca -0.00 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.74 3.37 -0.02 0.00 -1.26 -2.05 105.19 104.48 2cbh n GLY 10 Ca 0.00 -1.16 -0.37 0.00 0.00 0.00 0.00 46.02 44.49 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 1.37 1.29 -0.18 -0.61 5.41 -1.17 -2.08 119.36 123.39 2cbh n ILE 11 Ca 0.00 -0.46 0.00 0.00 1.00 0.00 0.00 62.75 63.29 2cbh n ILE 11 Cb 0.00 -0.46 0.00 0.00 -0.71 0.00 0.00 39.64 38.47 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 2.07 1.74 3.74 7.39 0.00 -1.26 -4.52 105.19 114.34 2cbh n GLY 12 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.87 3.46 -0.53 1.61 5.04 -0.88 -5.01 117.35 118.17 2cbh s TYR 13 Ca 0.00 0.54 0.07 0.00 -2.44 0.00 0.00 57.07 55.24 2cbh s TYR 13 Cb 0.00 -2.28 0.33 0.00 0.35 0.00 0.00 41.96 40.36 2cbh s TYR 13 CO 0.00 0.28 0.87 -1.13 -1.34 0.00 0.00 175.55 174.23 2cbh n SER 14 N 3.47 3.53 -3.36 4.32 3.41 -1.26 -4.97 113.62 118.76 2cbh n SER 14 Ca -0.13 -3.50 -0.16 0.00 -0.26 0.00 0.00 58.87 54.82 2cbh n SER 14 Cb 0.52 -0.58 -0.06 0.00 -0.26 0.00 0.00 64.21 63.83 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 -3.11 1.75 0.79 5.00 0.00 -1.26 -5.14 107.32 105.35 2cbh s GLY 15 Ca 0.46 -1.71 -0.14 0.00 0.00 0.00 0.00 44.72 43.34 2cbh s GLY 15 CO -0.12 -1.18 1.22 2.56 0.00 0.00 0.00 173.10 175.59 2cbh s PRO 16 N -3.28 1.71 -0.25 2.90 0.04 -1.26 -4.94 135.00 129.92 2cbh s PRO 16 Ca 0.34 1.81 0.09 0.00 0.04 0.00 0.00 61.00 63.29 2cbh s PRO 16 Cb 0.01 -1.78 0.45 0.00 0.04 0.00 0.00 34.50 33.22 2cbh s PRO 16 CO 0.22 -2.17 1.27 0.25 0.04 0.00 0.00 177.00 176.61 2cbh n THR 17 N -3.14 2.38 -3.86 1.26 -2.24 -1.26 -4.64 114.28 102.78 2cbh n THR 17 Ca 0.14 -3.40 -0.36 0.00 -2.27 0.00 0.00 64.05 58.16 2cbh n THR 17 Cb 0.50 -0.49 -0.12 0.00 -2.10 0.00 0.00 70.33 68.12 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 4.51 0.15 2.28 1.01 -1.26 -4.93 120.40 118.55 2cbh s VAL 18 Ca 0.43 -0.11 -0.18 0.00 0.00 0.00 0.00 61.98 62.12 2cbh s VAL 18 Cb 0.39 -3.08 -0.07 0.00 0.00 0.00 0.00 36.38 33.61 2cbh s VAL 18 CO -0.03 0.38 0.62 0.00 0.00 0.00 0.00 175.10 176.07 2cbh n ALA 20 N 1.06 -3.91 -1.74 0.00 0.00 -0.75 -4.75 120.51 110.43 2cbh n ALA 20 Ca -0.06 -1.21 -0.39 0.00 0.00 0.00 0.00 53.44 51.78 2cbh n ALA 20 Cb 0.51 -1.58 0.03 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.87 2.80 0.00 0.00 3.41 -1.26 -2.10 113.62 114.59 2cbh n SER 21 Ca 0.01 1.04 0.00 0.00 -0.26 0.00 0.00 58.87 59.66 2cbh n SER 21 Cb 0.61 -1.57 0.00 0.00 -0.26 0.00 0.00 64.21 62.99 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 0.73 2.60 3.67 5.00 0.00 -1.26 -5.00 105.19 110.93 2cbh n GLY 22 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.14 2.60 0.31 2.61 -4.23 -0.89 -5.04 115.64 108.85 2cbh s THR 23 Ca 0.00 -1.86 0.04 0.00 -1.18 0.00 0.00 61.69 58.68 2cbh s THR 23 Cb 0.00 -2.88 -0.04 0.00 1.34 0.00 0.00 72.50 70.92 2cbh s THR 23 CO 0.00 -0.14 0.18 0.42 -0.54 0.00 0.00 174.62 174.54 2cbh s THR 24 N -2.53 0.25 -0.26 3.99 -4.23 0.19 -4.72 115.64 108.34 2cbh s THR 24 Ca 0.37 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.74 2cbh s THR 24 Cb 0.01 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.31 2cbh s THR 24 CO 0.21 0.00 0.32 0.00 -0.54 0.00 0.00 174.62 174.61 2cbh s GLN 26 N 1.83 2.61 0.19 0.00 -0.21 0.22 -4.90 119.66 119.40 2cbh s GLN 26 Ca 0.13 -0.82 -0.21 0.00 0.02 0.00 0.00 55.36 54.49 2cbh s GLN 26 Cb -0.15 -2.09 -0.08 0.00 1.00 0.00 0.00 33.01 31.69 2cbh s GLN 26 CO 0.09 0.25 0.71 0.08 -2.12 0.00 0.00 175.29 174.30 2cbh s VAL 27 N 0.14 4.56 -0.07 1.09 1.01 -1.26 -0.75 120.40 125.11 2cbh s VAL 27 Ca -0.11 1.35 -0.11 0.00 0.00 0.00 0.00 61.98 63.11 2cbh s VAL 27 Cb -0.15 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 2cbh s VAL 27 CO 0.06 0.32 -0.21 -0.11 0.00 0.00 0.00 175.10 175.15 2cbh n LEU 28 N 1.03 1.61 -4.26 3.92 7.94 0.52 -4.88 117.00 122.89 2cbh n LEU 28 Ca -0.04 0.25 -0.17 0.00 -1.11 0.00 0.00 56.01 54.95 2cbh n LEU 28 Cb 0.51 -0.58 -0.09 0.00 0.53 0.00 0.00 43.42 43.78 2cbh n LEU 28 CO 0.43 -0.46 -0.17 0.20 -1.11 0.00 0.00 177.39 176.29 2cbh s ASN 29 N -5.95 1.08 0.00 1.96 0.01 -0.95 -4.99 114.94 106.11 2cbh s ASN 29 Ca -0.18 -1.59 0.00 0.00 -0.71 0.00 0.00 52.86 50.38 2cbh s ASN 29 Cb 0.02 0.47 0.00 0.00 0.41 0.00 0.00 41.25 42.15 2cbh s ASN 29 CO 0.26 -0.96 0.37 -2.65 -1.51 0.00 0.00 177.10 172.61 2cbh n PRO 30 N -0.48 0.50 -0.01 -0.60 -0.02 -1.26 -1.90 135.00 131.23 2cbh n PRO 30 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 2cbh n PRO 30 Cb 0.64 -1.25 0.00 0.00 -0.02 0.00 0.00 33.50 32.87 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 0.48 0.00 -3.58 6.00 4.02 -1.26 -3.07 117.16 119.76 2cbh n TYR 31 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.88 2cbh n TYR 31 Cb 0.18 0.08 -0.05 0.00 -0.02 0.00 0.00 39.34 39.54 2cbh n TYR 31 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 2cbh s TYR 32 N 0.00 -1.05 -0.18 -0.72 5.04 -0.80 -4.36 117.35 115.28 2cbh s TYR 32 Ca 0.00 1.88 -0.01 0.00 -2.44 0.00 0.00 57.07 56.49 2cbh s TYR 32 Cb 0.00 0.63 0.05 0.00 0.35 0.00 0.00 41.96 42.99 2cbh s TYR 32 CO 0.00 -0.52 -0.01 -1.12 -1.34 0.00 0.00 175.55 172.55 2cbh s SER 33 N 2.48 2.93 0.29 4.32 0.01 -0.87 -0.35 113.70 122.51 2cbh s SER 33 Ca -0.06 -0.77 -0.07 0.00 1.31 0.00 0.00 55.95 56.37 2cbh s SER 33 Cb -0.09 -0.79 -0.06 0.00 0.21 0.00 0.00 66.02 65.30 2cbh s SER 33 CO -0.18 -0.24 0.58 -1.58 0.41 0.00 0.00 173.24 172.22 2cbh s GLN 34 N 1.71 3.70 -0.39 12.44 0.74 0.07 -0.62 119.66 137.31 2cbh s GLN 34 Ca -0.01 0.14 -0.19 0.00 0.05 0.00 0.00 55.36 55.35 2cbh s GLN 34 Cb -0.16 -2.61 0.01 0.00 1.10 0.00 0.00 33.01 31.34 2cbh s GLN 34 CO -0.07 0.21 0.57 0.00 -0.55 0.00 0.00 175.29 175.45