#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 2.18 -3.26 -2.82 0.00 -1.17 -4.94 117.38 107.38 2cbh n GLN 2 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 57.00 56.84 2cbh n GLN 2 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 30.24 30.21 2cbh n GLN 2 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 2cbh n SER 3 N -1.28 2.61 -4.73 2.61 3.41 -1.26 -2.81 113.62 112.18 2cbh n SER 3 Ca 0.00 -2.09 -0.42 0.00 -0.26 0.00 0.00 58.87 56.10 2cbh n SER 3 Cb 0.00 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 2cbh n SER 3 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2cbh n HIS 4 N -0.68 2.49 -1.36 7.33 -0.00 -1.26 -0.05 115.22 121.70 2cbh n HIS 4 Ca -0.10 0.50 -0.12 0.00 0.46 0.00 0.00 57.72 58.47 2cbh n HIS 4 Cb 0.32 -2.45 -0.05 0.00 -0.12 0.00 0.00 29.99 27.69 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 0.23 0.00 -2.42 1.57 4.01 0.54 -4.97 117.16 116.12 2cbh n TYR 5 Ca 0.04 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.48 2cbh n TYR 5 Cb 0.38 -2.43 -0.02 0.00 -0.31 0.00 0.00 39.34 36.96 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 -2.69 1.82 -0.32 2.72 0.00 0.93 -4.52 107.32 105.26 2cbh s GLY 6 Ca 0.00 -0.12 -0.22 0.00 0.00 0.00 0.00 44.72 44.38 2cbh s GLY 6 CO 0.00 0.11 0.70 1.62 0.00 0.00 0.00 173.10 175.53 2cbh s GLN 7 N -4.43 3.85 -0.04 2.90 0.74 -1.26 0.18 119.66 121.60 2cbh s GLN 7 Ca 0.54 0.34 0.16 0.00 0.05 0.00 0.00 55.36 56.45 2cbh s GLN 7 Cb -0.10 -3.76 -0.24 0.00 1.10 0.00 0.00 33.01 30.01 2cbh s GLN 7 CO 0.40 -0.68 0.31 0.00 -0.55 0.00 0.00 175.29 174.77 2cbh n GLY 9 N 1.66 3.46 0.00 0.00 0.00 -1.14 -4.10 105.19 105.06 2cbh n GLY 9 Ca -0.07 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.71 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 2.43 3.70 -0.02 0.00 -1.26 -1.00 105.19 109.05 2cbh n GLY 10 Ca 0.00 -1.65 -0.33 0.00 0.00 0.00 0.00 46.02 44.04 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 -1.48 2.21 0.00 -0.61 1.01 -1.24 -1.93 121.20 119.16 2cbh s ILE 11 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.74 2cbh s ILE 11 Cb 0.00 -2.47 0.00 0.00 0.01 0.00 0.00 42.46 40.00 2cbh s ILE 11 CO 0.00 -0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.48 2cbh n GLY 12 N 0.29 1.11 3.73 6.18 0.00 -1.26 -4.55 105.19 110.70 2cbh n GLY 12 Ca 0.13 0.00 -0.40 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 -3.18 3.65 -0.21 1.61 5.04 -0.81 -4.95 117.35 118.50 2cbh s TYR 13 Ca 0.00 1.32 0.16 0.00 -2.44 0.00 0.00 57.07 56.12 2cbh s TYR 13 Cb 0.00 -2.78 0.46 0.00 0.35 0.00 0.00 41.96 39.99 2cbh s TYR 13 CO 0.00 0.20 1.17 -1.13 -1.34 0.00 0.00 175.55 174.44 2cbh n SER 14 N 3.26 2.57 -3.10 4.32 3.41 -1.26 -4.98 113.62 117.84 2cbh n SER 14 Ca -0.03 -2.92 -0.14 0.00 -0.26 0.00 0.00 58.87 55.53 2cbh n SER 14 Cb 0.51 -0.41 -0.03 0.00 -0.26 0.00 0.00 64.21 64.02 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 -0.53 3.90 3.75 5.00 0.00 -1.26 -5.12 105.19 110.92 2cbh n GLY 15 Ca 0.21 -2.25 -0.34 0.00 0.00 0.00 0.00 46.02 43.64 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 -2.79 2.63 0.00 1.61 0.05 -1.26 -4.95 135.00 130.28 2cbh s PRO 16 Ca 0.01 1.56 0.17 0.00 0.05 0.00 0.00 61.00 62.80 2cbh s PRO 16 Cb 0.00 -1.91 -0.05 0.00 0.05 0.00 0.00 34.50 32.59 2cbh s PRO 16 CO 0.01 -1.42 0.86 0.25 0.05 0.00 0.00 177.00 176.75 2cbh n THR 17 N -2.37 0.00 -3.02 1.26 -2.24 -1.26 -4.39 114.28 102.26 2cbh n THR 17 Ca 0.12 -0.26 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 2cbh n THR 17 Cb 0.51 1.15 -0.05 0.00 -2.10 0.00 0.00 70.33 69.84 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 -2.17 4.95 0.32 2.28 1.01 -1.26 -4.81 120.40 120.72 2cbh s VAL 18 Ca 0.12 1.35 -0.18 0.00 0.00 0.00 0.00 61.98 63.28 2cbh s VAL 18 Cb 0.14 -4.02 -0.09 0.00 0.00 0.00 0.00 36.38 32.40 2cbh s VAL 18 CO 0.51 0.05 0.79 0.00 0.00 0.00 0.00 175.10 176.45 2cbh n ALA 20 N -0.13 -2.88 -1.59 0.00 0.00 -1.12 -4.73 120.51 110.06 2cbh n ALA 20 Ca 0.03 0.43 -0.45 0.00 0.00 0.00 0.00 53.44 53.46 2cbh n ALA 20 Cb 0.53 -1.60 -0.02 0.00 0.00 0.00 0.00 19.45 18.36 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 2.00 1.28 0.00 0.00 7.64 -1.26 -1.79 113.62 121.49 2cbh n SER 21 Ca 0.18 1.18 0.00 0.00 1.01 0.00 0.00 58.87 61.24 2cbh n SER 21 Cb 0.25 -1.29 0.00 0.00 -1.01 0.00 0.00 64.21 62.17 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 1.22 2.95 0.29 0.23 0.00 -1.26 -5.03 105.19 103.59 2cbh n GLY 22 Ca 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.20 0.00 -4.10 2.61 -2.24 -0.74 -5.07 114.28 104.53 2cbh n THR 23 Ca 0.00 -0.15 -0.12 0.00 -2.27 0.00 0.00 64.05 61.51 2cbh n THR 23 Cb 0.00 -0.83 -0.06 0.00 -2.10 0.00 0.00 70.33 67.34 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 0.48 0.00 -0.32 4.28 -4.23 0.27 -4.90 115.64 111.22 2cbh s THR 24 Ca 0.04 -1.68 -0.12 0.00 -1.18 0.00 0.00 61.69 58.75 2cbh s THR 24 Cb -0.00 -2.44 -0.03 0.00 1.34 0.00 0.00 72.50 71.37 2cbh s THR 24 CO 0.03 0.00 0.23 0.00 -0.54 0.00 0.00 174.62 174.33 2cbh s GLN 26 N 1.73 2.71 0.03 0.00 1.11 0.11 -4.98 119.66 120.37 2cbh s GLN 26 Ca 0.06 -1.14 -0.35 0.00 0.01 0.00 0.00 55.36 53.95 2cbh s GLN 26 Cb -0.17 -3.57 -0.14 0.00 -1.01 0.00 0.00 33.01 28.12 2cbh s GLN 26 CO 0.11 -0.68 1.67 0.28 0.01 0.00 0.00 175.29 176.68 2cbh n VAL 27 N 4.89 0.23 -0.09 1.09 0.31 -1.26 -1.72 118.33 121.78 2cbh n VAL 27 Ca -0.12 -0.04 -0.13 0.00 -0.01 0.00 0.00 64.34 64.04 2cbh n VAL 27 Cb 0.45 -1.54 -0.05 0.00 -0.91 0.00 0.00 33.84 31.79 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 4.62 1.89 -3.82 7.52 -0.00 -0.63 -4.84 117.00 121.73 2cbh n LEU 28 Ca 0.20 0.45 -0.06 0.00 -0.00 0.00 0.00 56.01 56.60 2cbh n LEU 28 Cb 0.26 -0.83 -0.00 0.00 -0.00 0.00 0.00 43.42 42.85 2cbh n LEU 28 CO 0.68 -0.13 0.59 0.54 -0.00 0.00 0.00 177.39 179.08 2cbh s ASN 29 N -6.24 -0.15 0.00 1.96 2.20 0.00 -4.99 114.94 107.72 2cbh s ASN 29 Ca -0.26 -0.68 0.00 0.00 -0.94 0.00 0.00 52.86 50.99 2cbh s ASN 29 Cb 0.05 0.67 0.00 0.00 -2.00 0.00 0.00 41.25 39.97 2cbh s ASN 29 CO 0.39 -1.26 0.23 -2.65 -2.94 0.00 0.00 177.10 170.87 2cbh n PRO 30 N -0.50 0.30 -0.18 3.55 -0.02 -1.26 -1.39 135.00 135.50 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 0.60 -1.26 0.00 0.00 -0.02 0.00 0.00 33.50 32.82 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 0.62 0.00 -3.65 6.00 4.01 -1.26 -3.65 117.16 119.23 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 0.12 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 -0.20 -0.13 -0.72 5.04 -0.49 -4.33 117.35 116.52 2cbh s TYR 32 Ca 0.00 0.46 -0.03 0.00 -2.44 0.00 0.00 57.07 55.07 2cbh s TYR 32 Cb 0.00 0.37 0.05 0.00 0.35 0.00 0.00 41.96 42.73 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 0.35 2.18 0.60 4.32 0.01 -0.17 -0.82 113.70 120.18 2cbh s SER 33 Ca 0.03 -0.44 -0.06 0.00 1.31 0.00 0.00 55.95 56.79 2cbh s SER 33 Cb -0.04 -0.43 0.02 0.00 0.21 0.00 0.00 66.02 65.77 2cbh s SER 33 CO -0.12 -0.27 0.91 -1.58 0.41 0.00 0.00 173.24 172.59 2cbh s GLN 34 N 1.98 2.81 -0.15 12.44 0.74 -0.70 -0.93 119.66 135.85 2cbh s GLN 34 Ca 0.02 -0.07 -0.01 0.00 0.05 0.00 0.00 55.36 55.35 2cbh s GLN 34 Cb -0.15 -2.27 -0.01 0.00 1.10 0.00 0.00 33.01 31.68 2cbh s GLN 34 CO -0.07 -0.77 -0.11 0.00 -0.55 0.00 0.00 175.29 173.79