#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 0.69 -3.82 -0.78 3.00 -1.06 -4.98 117.38 110.43 2cbh n GLN 2 Ca 0.00 -3.81 -0.22 0.00 -0.01 0.00 0.00 57.00 52.96 2cbh n GLN 2 Cb 0.00 1.20 -0.05 0.00 0.00 0.00 0.00 30.24 31.39 2cbh n GLN 2 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 2cbh n SER 3 N -1.35 2.96 -4.76 1.08 7.64 -1.26 -2.39 113.62 115.54 2cbh n SER 3 Ca -0.19 -2.52 -0.41 0.00 1.01 0.00 0.00 58.87 56.76 2cbh n SER 3 Cb 0.66 0.24 -0.01 0.00 -1.01 0.00 0.00 64.21 64.09 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 -2.25 2.73 -0.38 1.43 2.46 -1.26 -0.54 115.29 117.48 2cbh s HIS 4 Ca 0.00 0.87 0.00 0.00 0.47 0.00 0.00 55.06 56.40 2cbh s HIS 4 Cb -0.00 -4.05 0.00 0.00 -0.13 0.00 0.00 32.58 28.40 2cbh s HIS 4 CO 0.00 -3.43 0.00 0.66 -2.47 0.00 0.00 174.74 169.50 2cbh n TYR 5 N 1.84 0.00 -2.48 3.88 4.01 0.15 -4.95 117.16 119.60 2cbh n TYR 5 Ca 0.07 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.49 2cbh n TYR 5 Cb 0.38 -1.45 -0.03 0.00 -0.31 0.00 0.00 39.34 37.92 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 -2.26 2.00 -0.26 2.72 0.00 0.29 -4.47 107.32 105.34 2cbh s GLY 6 Ca 0.00 0.06 -0.27 0.00 0.00 0.00 0.00 44.72 44.51 2cbh s GLY 6 CO 0.00 0.31 0.95 1.62 0.00 0.00 0.00 173.10 175.99 2cbh s GLN 7 N -4.09 4.16 -0.01 2.90 0.74 -1.26 -0.16 119.66 121.94 2cbh s GLN 7 Ca 0.57 1.09 0.10 0.00 0.05 0.00 0.00 55.36 57.16 2cbh s GLN 7 Cb -0.10 -3.67 -0.13 0.00 1.10 0.00 0.00 33.01 30.20 2cbh s GLN 7 CO 0.33 -0.66 0.29 0.00 -0.55 0.00 0.00 175.29 174.70 2cbh n GLY 9 N 1.67 3.47 0.00 0.00 0.00 -1.13 -4.19 105.19 105.01 2cbh n GLY 9 Ca -0.00 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.99 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 1.36 3.51 -0.02 0.00 -1.26 -1.48 105.19 107.30 2cbh n GLY 10 Ca 0.00 -1.49 -0.40 0.00 0.00 0.00 0.00 46.02 44.13 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 1.72 2.27 -0.66 -0.61 5.41 -1.22 -2.49 119.36 123.79 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 -0.80 0.00 0.00 -0.71 0.00 0.00 39.64 38.13 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 1.58 0.64 3.09 7.39 0.00 -1.26 -4.52 105.19 112.10 2cbh n GLY 12 Ca 0.11 -0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.00 2.63 -0.61 1.61 5.04 -1.04 -5.02 117.35 117.96 2cbh s TYR 13 Ca 0.00 -1.55 0.04 0.00 -2.44 0.00 0.00 57.07 53.12 2cbh s TYR 13 Cb 0.00 -1.84 0.35 0.00 0.35 0.00 0.00 41.96 40.83 2cbh s TYR 13 CO 0.00 -0.78 1.10 -1.13 -1.34 0.00 0.00 175.55 173.40 2cbh n SER 14 N 4.66 4.91 -3.74 4.32 3.41 -1.26 -4.94 113.62 120.98 2cbh n SER 14 Ca -0.20 -3.70 -0.15 0.00 -0.26 0.00 0.00 58.87 54.56 2cbh n SER 14 Cb 0.50 -0.62 -0.08 0.00 -0.26 0.00 0.00 64.21 63.75 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 -3.21 1.78 0.78 5.00 0.00 -1.26 -5.14 107.32 105.27 2cbh s GLY 15 Ca 0.48 -1.80 -0.14 0.00 0.00 0.00 0.00 44.72 43.25 2cbh s GLY 15 CO -0.16 -1.35 1.23 -1.55 0.00 0.00 0.00 173.10 171.27 2cbh n PRO 16 N -0.45 0.38 -0.07 2.90 -0.04 -1.26 -4.94 135.00 131.51 2cbh n PRO 16 Ca 0.04 0.20 0.04 0.00 -0.04 0.00 0.00 63.50 63.75 2cbh n PRO 16 Cb 0.64 -2.47 0.08 0.00 -0.04 0.00 0.00 33.50 31.71 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 -3.02 0.52 -2.52 0.52 -2.24 -1.26 -4.75 114.28 101.54 2cbh n THR 17 Ca 0.14 -0.76 -0.43 0.00 -2.27 0.00 0.00 64.05 60.73 2cbh n THR 17 Cb 0.50 0.83 -0.02 0.00 -2.10 0.00 0.00 70.33 69.53 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 -0.87 4.33 0.64 2.28 1.01 -1.26 -4.85 120.40 121.67 2cbh s VAL 18 Ca 0.15 1.53 -0.09 0.00 0.00 0.00 0.00 61.98 63.57 2cbh s VAL 18 Cb 0.09 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 32.22 2cbh s VAL 18 CO 0.12 -0.44 0.99 0.00 0.00 0.00 0.00 175.10 175.78 2cbh n ALA 20 N -2.78 -0.47 -1.73 0.00 0.00 -1.00 -4.72 120.51 109.82 2cbh n ALA 20 Ca 0.06 -0.38 -0.40 0.00 0.00 0.00 0.00 53.44 52.72 2cbh n ALA 20 Cb 0.57 -2.17 0.03 0.00 0.00 0.00 0.00 19.45 17.88 2cbh n ALA 20 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2cbh n SER 21 N -3.00 2.70 0.00 0.00 7.64 -1.26 -2.34 113.62 117.37 2cbh n SER 21 Ca 0.13 1.04 0.00 0.00 1.01 0.00 0.00 58.87 61.05 2cbh n SER 21 Cb 0.51 -1.55 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 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 0.76 2.23 3.00 0.23 0.00 -1.26 -5.02 105.19 105.13 2cbh n GLY 22 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 2cbh n GLY 22 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cbh n THR 23 N -2.00 0.00 -4.10 2.61 -2.24 -0.99 -5.05 114.28 102.51 2cbh n THR 23 Ca 0.00 -1.92 -0.11 0.00 -2.27 0.00 0.00 64.05 59.75 2cbh n THR 23 Cb 0.00 0.28 -0.07 0.00 -2.10 0.00 0.00 70.33 68.44 2cbh n THR 23 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2cbh s THR 24 N -2.44 0.00 -0.35 4.28 -4.23 -1.24 -4.86 115.64 106.79 2cbh s THR 24 Ca 0.05 -1.69 -0.13 0.00 -1.18 0.00 0.00 61.69 58.74 2cbh s THR 24 Cb -0.00 -2.39 -0.01 0.00 1.34 0.00 0.00 72.50 71.44 2cbh s THR 24 CO 0.03 0.00 0.24 0.00 -0.54 0.00 0.00 174.62 174.36 2cbh s GLN 26 N 1.70 3.53 0.12 0.00 1.11 0.98 -4.96 119.66 122.14 2cbh s GLN 26 Ca 0.06 -0.57 -0.31 0.00 0.01 0.00 0.00 55.36 54.55 2cbh s GLN 26 Cb -0.18 -3.41 -0.08 0.00 -1.01 0.00 0.00 33.01 28.33 2cbh s GLN 26 CO 0.10 -0.27 1.41 0.08 0.01 0.00 0.00 175.29 176.61 2cbh s VAL 27 N 1.61 3.24 -0.18 1.09 1.01 -1.26 -1.08 120.40 124.83 2cbh s VAL 27 Ca 0.06 0.89 -0.15 0.00 0.00 0.00 0.00 61.98 62.78 2cbh s VAL 27 Cb -0.16 -3.57 -0.09 0.00 0.00 0.00 0.00 36.38 32.57 2cbh s VAL 27 CO 0.05 0.07 -0.15 -0.11 0.00 0.00 0.00 175.10 174.96 2cbh n LEU 28 N 3.94 1.87 -3.94 3.92 7.94 0.59 -4.88 117.00 126.43 2cbh n LEU 28 Ca 0.12 0.49 -0.11 0.00 -1.11 0.00 0.00 56.01 55.40 2cbh n LEU 28 Cb 0.42 -0.86 -0.02 0.00 0.53 0.00 0.00 43.42 43.49 2cbh n LEU 28 CO 0.59 -0.13 0.33 0.54 -1.11 0.00 0.00 177.39 177.61 2cbh s ASN 29 N -6.25 0.30 0.00 1.96 2.20 -0.86 -5.00 114.94 107.28 2cbh s ASN 29 Ca -0.24 -1.19 0.00 0.00 -0.94 0.00 0.00 52.86 50.49 2cbh s ASN 29 Cb 0.05 0.73 0.00 0.00 -2.00 0.00 0.00 41.25 40.03 2cbh s ASN 29 CO 0.38 -1.43 0.22 -2.65 -2.94 0.00 0.00 177.10 170.68 2cbh n PRO 30 N -0.51 0.30 -0.29 3.55 -0.02 -1.26 -1.63 135.00 135.13 2cbh n PRO 30 Ca -0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 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 0.60 0.00 -3.65 6.00 4.01 -1.26 -3.37 117.16 119.49 2cbh n TYR 31 Ca 0.00 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.71 2cbh n TYR 31 Cb 0.11 0.12 -0.07 0.00 -0.31 0.00 0.00 39.34 39.20 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 -0.21 -0.14 -0.72 5.04 -0.65 -4.40 117.35 116.27 2cbh s TYR 32 Ca 0.00 0.48 -0.03 0.00 -2.44 0.00 0.00 57.07 55.08 2cbh s TYR 32 Cb 0.00 0.32 0.05 0.00 0.35 0.00 0.00 41.96 42.68 2cbh s TYR 32 CO 0.00 -0.10 0.04 -1.12 -1.34 0.00 0.00 175.55 173.03 2cbh s SER 33 N 0.53 2.26 0.65 4.32 0.01 -0.55 -0.30 113.70 120.61 2cbh s SER 33 Ca 0.00 -0.49 -0.09 0.00 1.31 0.00 0.00 55.95 56.68 2cbh s SER 33 Cb -0.04 -0.43 0.01 0.00 0.21 0.00 0.00 66.02 65.76 2cbh s SER 33 CO -0.12 -0.28 1.01 -1.58 0.41 0.00 0.00 173.24 172.67 2cbh s GLN 34 N 1.98 2.97 -0.30 12.44 0.74 -0.24 -0.64 119.66 136.61 2cbh s GLN 34 Ca 0.02 0.30 -0.05 0.00 0.05 0.00 0.00 55.36 55.69 2cbh s GLN 34 Cb -0.15 -2.13 0.03 0.00 1.10 0.00 0.00 33.01 31.85 2cbh s GLN 34 CO -0.07 -0.84 0.04 0.00 -0.55 0.00 0.00 175.29 173.87