#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 0.48 -4.31 -2.82 7.27 0.63 -4.79 117.38 113.84 2cbh n GLN 2 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 57.00 56.90 2cbh n GLN 2 Cb 0.00 0.00 -0.10 0.00 2.41 0.00 0.00 30.24 32.55 2cbh n GLN 2 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 2cbh s SER 3 N -1.00 2.26 0.12 1.69 0.01 -1.26 -2.09 113.70 113.43 2cbh s SER 3 Ca 0.00 -1.03 -0.35 0.00 1.31 0.00 0.00 55.95 55.88 2cbh s SER 3 Cb 0.00 -0.09 -0.17 0.00 0.21 0.00 0.00 66.02 65.98 2cbh s SER 3 CO 0.00 -0.24 1.17 1.57 0.41 0.00 0.00 173.24 176.15 2cbh n HIS 4 N -0.32 1.17 -1.65 2.43 -0.00 -1.26 0.44 115.22 116.02 2cbh n HIS 4 Ca -0.09 0.74 -0.08 0.00 -0.00 0.00 0.00 57.72 58.29 2cbh n HIS 4 Cb 0.61 -2.25 -0.02 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 1.74 -0.17 -3.48 1.57 4.01 0.61 -4.97 117.16 116.47 2cbh n TYR 5 Ca 0.17 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.56 2cbh n TYR 5 Cb 0.20 -1.84 -0.06 0.00 -0.31 0.00 0.00 39.34 37.33 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 -2.79 2.41 -0.79 2.72 0.00 0.17 -4.64 107.32 104.39 2cbh s GLY 6 Ca 0.00 -0.26 -0.26 0.00 0.00 0.00 0.00 44.72 44.21 2cbh s GLY 6 CO 0.00 0.00 1.55 1.62 0.00 0.00 0.00 173.10 176.27 2cbh s GLN 7 N -1.85 3.06 0.05 2.90 0.74 -1.26 -1.04 119.66 122.25 2cbh s GLN 7 Ca 0.34 -0.24 0.25 0.00 0.05 0.00 0.00 55.36 55.76 2cbh s GLN 7 Cb -0.15 -4.62 0.50 0.00 1.10 0.00 0.00 33.01 29.84 2cbh s GLN 7 CO 0.18 -2.47 1.42 0.00 -0.55 0.00 0.00 175.29 173.86 2cbh n GLY 9 N 1.43 3.51 0.00 0.00 0.00 -1.13 -4.03 105.19 104.97 2cbh n GLY 9 Ca 0.05 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 2.26 3.77 -0.02 0.00 -1.26 -1.77 105.19 108.18 2cbh n GLY 10 Ca 0.00 -1.73 -0.32 0.00 0.00 0.00 0.00 46.02 43.97 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 -1.96 3.28 0.00 -0.61 1.01 -1.25 -2.86 121.20 118.81 2cbh s ILE 11 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 60.65 61.15 2cbh s ILE 11 Cb 0.00 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.46 2cbh s ILE 11 CO 0.00 -0.45 0.00 0.61 0.00 0.00 0.00 174.94 175.10 2cbh n GLY 12 N -0.85 1.14 3.87 6.18 0.00 -1.26 -4.56 105.19 109.71 2cbh n GLY 12 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.83 3.46 -0.39 1.61 5.04 -1.13 -5.02 117.35 118.08 2cbh s TYR 13 Ca 0.00 1.13 0.11 0.00 -2.44 0.00 0.00 57.07 55.88 2cbh s TYR 13 Cb 0.00 -2.51 0.37 0.00 0.35 0.00 0.00 41.96 40.17 2cbh s TYR 13 CO 0.00 -0.13 0.92 -1.13 -1.34 0.00 0.00 175.55 173.87 2cbh n SER 14 N -1.25 -0.10 -3.41 4.32 3.41 -1.26 -5.03 113.62 110.29 2cbh n SER 14 Ca 0.03 -3.08 -0.15 0.00 -0.26 0.00 0.00 58.87 55.41 2cbh n SER 14 Cb 0.54 0.18 -0.06 0.00 -0.26 0.00 0.00 64.21 64.61 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 -2.15 1.62 1.05 5.00 0.00 -1.26 -5.15 107.32 106.43 2cbh s GLY 15 Ca 0.32 -1.62 -0.13 0.00 0.00 0.00 0.00 44.72 43.28 2cbh s GLY 15 CO -0.05 -1.12 0.80 -1.05 0.00 0.00 0.00 173.10 171.68 2cbh n PRO 16 N -0.54 -1.33 -0.87 2.90 -0.02 -1.26 -4.95 135.00 128.93 2cbh n PRO 16 Ca 0.02 -0.35 0.05 0.00 -2.02 0.00 0.00 63.50 61.21 2cbh n PRO 16 Cb 0.62 -2.11 0.14 0.00 -0.02 0.00 0.00 33.50 32.13 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 -4.44 1.41 -4.15 3.45 -2.24 -1.26 -4.54 114.28 102.51 2cbh n THR 17 Ca 0.06 -2.38 -0.33 0.00 -2.27 0.00 0.00 64.05 59.13 2cbh n THR 17 Cb 0.54 0.19 -0.16 0.00 -2.10 0.00 0.00 70.33 68.81 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 -2.07 2.40 0.30 2.28 1.01 -1.26 -4.90 120.40 118.17 2cbh s VAL 18 Ca 0.35 -0.83 -0.28 0.00 0.00 0.00 0.00 61.98 61.23 2cbh s VAL 18 Cb 0.36 -2.03 -0.09 0.00 0.00 0.00 0.00 36.38 34.62 2cbh s VAL 18 CO -0.10 0.51 1.00 0.00 0.00 0.00 0.00 175.10 176.52 2cbh n ALA 20 N 0.86 -4.98 -1.75 0.00 0.00 -0.89 -4.68 120.51 109.08 2cbh n ALA 20 Ca 0.01 -1.27 -0.36 0.00 0.00 0.00 0.00 53.44 51.81 2cbh n ALA 20 Cb 0.48 -1.16 0.04 0.00 0.00 0.00 0.00 19.45 18.81 2cbh n ALA 20 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2cbh s SER 21 N -1.40 5.06 0.00 0.00 1.04 -1.26 -2.52 113.70 114.63 2cbh s SER 21 Ca 0.46 2.45 0.00 0.00 0.48 0.00 0.00 55.95 59.33 2cbh s SER 21 Cb -0.02 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.50 2cbh s SER 21 CO 0.67 -1.69 0.00 0.61 0.98 0.00 0.00 173.24 173.82 2cbh n GLY 22 N 0.60 2.51 2.01 7.32 0.00 -1.26 -5.00 105.19 111.37 2cbh n GLY 22 Ca 0.14 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.79 2.61 -2.24 -1.05 -5.07 114.28 102.73 2cbh n THR 23 Ca 0.00 -1.23 -0.10 0.00 -2.27 0.00 0.00 64.05 60.45 2cbh n THR 23 Cb 0.00 0.01 -0.06 0.00 -2.10 0.00 0.00 70.33 68.18 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 -1.72 0.07 -0.20 4.28 -4.23 0.15 -4.88 115.64 109.12 2cbh s THR 24 Ca 0.08 -0.97 -0.18 0.00 -1.18 0.00 0.00 61.69 59.44 2cbh s THR 24 Cb -0.01 -1.48 -0.03 0.00 1.34 0.00 0.00 72.50 72.32 2cbh s THR 24 CO 0.05 -0.34 0.49 0.00 -0.54 0.00 0.00 174.62 174.28 2cbh s GLN 26 N 1.52 2.20 0.40 0.00 1.11 0.11 -4.93 119.66 120.08 2cbh s GLN 26 Ca 0.23 -0.58 -0.26 0.00 0.01 0.00 0.00 55.36 54.76 2cbh s GLN 26 Cb -0.15 -1.78 -0.09 0.00 -1.01 0.00 0.00 33.01 29.97 2cbh s GLN 26 CO 0.09 0.04 1.34 0.08 0.01 0.00 0.00 175.29 176.85 2cbh s VAL 27 N 0.69 2.49 -0.09 1.09 1.01 -1.26 -0.68 120.40 123.64 2cbh s VAL 27 Ca -0.13 0.45 -0.10 0.00 0.00 0.00 0.00 61.98 62.20 2cbh s VAL 27 Cb -0.16 -3.27 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 2cbh s VAL 27 CO 0.03 0.07 -0.20 -0.11 0.00 0.00 0.00 175.10 174.89 2cbh n LEU 28 N 0.18 1.44 -3.83 3.92 -0.00 -0.62 -4.70 117.00 113.39 2cbh n LEU 28 Ca 0.03 0.23 -0.07 0.00 -0.00 0.00 0.00 56.01 56.21 2cbh n LEU 28 Cb 0.43 -0.54 -0.01 0.00 -0.00 0.00 0.00 43.42 43.30 2cbh n LEU 28 CO 0.57 -0.21 0.53 0.54 -0.00 0.00 0.00 177.39 178.83 2cbh s ASN 29 N -6.11 -0.19 0.00 1.96 2.20 -0.03 -4.99 114.94 107.77 2cbh s ASN 29 Ca -0.19 -0.67 0.00 0.00 -0.94 0.00 0.00 52.86 51.06 2cbh s ASN 29 Cb 0.04 0.70 0.00 0.00 -2.00 0.00 0.00 41.25 40.00 2cbh s ASN 29 CO 0.26 -1.33 0.26 -2.65 -2.94 0.00 0.00 177.10 170.70 2cbh n PRO 30 N -0.48 0.36 -0.21 3.55 -0.02 -1.26 -1.35 135.00 135.59 2cbh n PRO 30 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 2cbh n PRO 30 Cb 0.59 -1.24 0.00 0.00 -0.02 0.00 0.00 33.50 32.83 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 0.53 0.00 -3.65 6.00 4.01 -1.26 -3.80 117.16 119.00 2cbh n TYR 31 Ca 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.72 2cbh n TYR 31 Cb 0.13 0.09 -0.07 0.00 -0.31 0.00 0.00 39.34 39.18 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 -0.22 -0.15 -0.72 5.04 -0.45 -4.30 117.35 116.55 2cbh s TYR 32 Ca 0.00 0.47 -0.02 0.00 -2.44 0.00 0.00 57.07 55.09 2cbh s TYR 32 Cb 0.00 0.30 0.05 0.00 0.35 0.00 0.00 41.96 42.65 2cbh s TYR 32 CO 0.00 -0.11 -0.01 -1.12 -1.34 0.00 0.00 175.55 172.98 2cbh s SER 33 N 0.62 2.57 0.35 4.32 0.01 -0.73 -0.85 113.70 119.99 2cbh s SER 33 Ca -0.01 -0.59 -0.05 0.00 1.31 0.00 0.00 55.95 56.61 2cbh s SER 33 Cb -0.04 -0.68 -0.05 0.00 0.21 0.00 0.00 66.02 65.46 2cbh s SER 33 CO -0.12 -0.23 0.63 -1.58 0.41 0.00 0.00 173.24 172.34 2cbh s GLN 34 N 1.80 3.63 -0.17 12.44 0.74 0.14 -1.01 119.66 137.23 2cbh s GLN 34 Ca 0.01 0.08 -0.07 0.00 0.05 0.00 0.00 55.36 55.43 2cbh s GLN 34 Cb -0.15 -2.56 -0.04 0.00 1.10 0.00 0.00 33.01 31.36 2cbh s GLN 34 CO -0.07 0.10 0.06 0.00 -0.55 0.00 0.00 175.29 174.82