#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 0.41 0.61 -0.78 2.00 0.10 -4.74 119.66 117.27 2cbh s GLN 2 Ca 0.00 -0.39 0.02 0.00 -2.00 0.00 0.00 55.36 52.98 2cbh s GLN 2 Cb 0.00 0.17 0.07 0.00 0.80 0.00 0.00 33.01 34.05 2cbh s GLN 2 CO 0.00 -0.09 0.85 -1.54 -0.50 0.00 0.00 175.29 174.01 2cbh s SER 3 N -1.26 4.92 0.92 6.67 1.04 -1.26 0.42 113.70 125.14 2cbh s SER 3 Ca -0.14 -0.27 -0.15 0.00 0.48 0.00 0.00 55.95 55.88 2cbh s SER 3 Cb -0.08 -0.39 -0.04 0.00 0.10 0.00 0.00 66.02 65.61 2cbh s SER 3 CO 0.01 -1.42 0.01 1.57 0.98 0.00 0.00 173.24 174.39 2cbh n HIS 4 N -2.49 -2.64 -1.67 5.02 -0.00 -1.26 -0.63 115.22 111.55 2cbh n HIS 4 Ca 0.12 0.17 -0.07 0.00 -0.00 0.00 0.00 57.72 57.93 2cbh n HIS 4 Cb 0.60 -1.68 -0.02 0.00 -0.00 0.00 0.00 29.99 28.89 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 -3.02 -1.02 -3.76 1.57 4.01 0.12 -4.88 117.16 110.18 2cbh n TYR 5 Ca 0.04 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.42 2cbh n TYR 5 Cb 0.54 -1.93 -0.07 0.00 -0.31 0.00 0.00 39.34 37.57 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 -1.76 2.14 -0.53 2.72 0.00 0.20 -4.69 107.32 105.40 2cbh s GLY 6 Ca 0.00 -0.61 -0.26 0.00 0.00 0.00 0.00 44.72 43.85 2cbh s GLY 6 CO 0.00 -0.05 2.11 1.62 0.00 0.00 0.00 173.10 176.78 2cbh s GLN 7 N -0.34 2.45 0.14 2.90 0.74 -1.26 -0.75 119.66 123.54 2cbh s GLN 7 Ca 0.13 1.06 0.23 0.00 0.05 0.00 0.00 55.36 56.83 2cbh s GLN 7 Cb -0.12 -4.46 0.18 0.00 1.10 0.00 0.00 33.01 29.71 2cbh s GLN 7 CO 0.02 -2.90 1.18 0.00 -0.55 0.00 0.00 175.29 173.04 2cbh n GLY 9 N 1.29 1.32 0.00 0.00 0.00 -1.07 -4.21 105.19 102.51 2cbh n GLY 9 Ca 0.02 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.68 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 -0.55 4.15 3.46 -0.02 0.00 -1.26 -0.23 105.19 110.75 2cbh n GLY 10 Ca -0.06 -1.02 -0.39 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.18 2.05 0.00 -0.61 5.41 -1.23 0.19 119.36 124.99 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 -0.65 0.00 0.00 -0.71 0.00 0.00 39.64 38.28 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 1.78 2.87 3.75 7.39 0.00 -1.26 -4.74 105.19 114.97 2cbh n GLY 12 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.04 3.90 -0.40 1.61 5.04 0.13 -4.98 117.35 120.61 2cbh s TYR 13 Ca 0.00 1.86 0.10 0.00 -2.44 0.00 0.00 57.07 56.60 2cbh s TYR 13 Cb 0.00 -3.03 0.32 0.00 0.35 0.00 0.00 41.96 39.60 2cbh s TYR 13 CO 0.00 0.28 0.69 -1.13 -1.34 0.00 0.00 175.55 174.05 2cbh n SER 14 N 1.79 1.04 -3.30 4.32 3.41 -1.26 -4.89 113.62 114.73 2cbh n SER 14 Ca -0.01 -2.99 -0.17 0.00 -0.26 0.00 0.00 58.87 55.44 2cbh n SER 14 Cb 0.47 -0.62 -0.06 0.00 -0.26 0.00 0.00 64.21 63.74 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 -2.17 1.96 1.09 5.00 0.00 -1.26 -5.15 107.32 106.80 2cbh s GLY 15 Ca 0.39 -1.83 -0.12 0.00 0.00 0.00 0.00 44.72 43.16 2cbh s GLY 15 CO -0.09 -1.26 0.94 -1.05 0.00 0.00 0.00 173.10 171.63 2cbh n PRO 16 N -0.60 -1.75 0.00 2.90 -0.01 -1.26 -4.96 135.00 129.32 2cbh n PRO 16 Ca 0.05 -0.47 0.00 0.00 -0.01 0.00 0.00 63.50 63.06 2cbh n PRO 16 Cb 0.62 -2.17 0.00 0.00 -0.01 0.00 0.00 33.50 31.94 2cbh n PRO 16 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 175.50 175.74 2cbh n THR 17 N -4.68 0.01 -2.64 3.45 -2.24 -1.26 -4.68 114.28 102.24 2cbh n THR 17 Ca 0.05 -0.13 -0.43 0.00 -2.27 0.00 0.00 64.05 61.28 2cbh n THR 17 Cb 0.54 1.72 -0.02 0.00 -2.10 0.00 0.00 70.33 70.47 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 -0.01 4.35 0.46 2.28 1.01 -1.26 -4.85 120.40 122.38 2cbh s VAL 18 Ca 0.00 1.35 -0.22 0.00 0.00 0.00 0.00 61.98 63.11 2cbh s VAL 18 Cb 0.00 -4.51 -0.08 0.00 0.00 0.00 0.00 36.38 31.79 2cbh s VAL 18 CO 0.00 -0.79 1.13 0.00 0.00 0.00 0.00 175.10 175.43 2cbh n ALA 20 N -0.54 1.80 -1.42 0.00 0.00 0.17 -4.78 120.51 115.74 2cbh n ALA 20 Ca 0.07 0.27 -0.41 0.00 0.00 0.00 0.00 53.44 53.37 2cbh n ALA 20 Cb 0.49 -2.35 0.01 0.00 0.00 0.00 0.00 19.45 17.60 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 0.07 -1.38 0.00 0.00 7.64 -1.26 -1.99 113.62 116.70 2cbh n SER 21 Ca 0.05 0.87 0.00 0.00 1.01 0.00 0.00 58.87 60.80 2cbh n SER 21 Cb 0.40 -1.06 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 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 1.92 3.20 3.53 0.23 0.00 -1.26 -5.03 105.19 107.79 2cbh n GLY 22 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.94 2.41 0.34 2.61 -4.23 -0.84 -5.07 115.64 107.91 2cbh s THR 23 Ca 0.00 -2.24 0.04 0.00 -1.18 0.00 0.00 61.69 58.31 2cbh s THR 23 Cb 0.00 -2.55 -0.07 0.00 1.34 0.00 0.00 72.50 71.23 2cbh s THR 23 CO 0.00 -0.28 0.04 0.42 -0.54 0.00 0.00 174.62 174.27 2cbh s THR 24 N -2.55 1.35 -0.26 3.99 -4.23 -1.26 -4.72 115.64 107.95 2cbh s THR 24 Ca 0.32 -2.01 -0.15 0.00 -1.18 0.00 0.00 61.69 58.67 2cbh s THR 24 Cb -0.01 -2.81 -0.04 0.00 1.34 0.00 0.00 72.50 70.98 2cbh s THR 24 CO 0.16 -0.02 0.38 0.00 -0.54 0.00 0.00 174.62 174.61 2cbh s GLN 26 N 2.01 2.90 -0.48 0.00 1.11 -0.32 -4.96 119.66 119.92 2cbh s GLN 26 Ca 0.16 -0.97 -0.28 0.00 0.01 0.00 0.00 55.36 54.28 2cbh s GLN 26 Cb -0.16 -3.27 -0.00 0.00 -1.01 0.00 0.00 33.01 28.57 2cbh s GLN 26 CO 0.10 -0.48 1.62 0.08 0.01 0.00 0.00 175.29 176.62 2cbh s VAL 27 N 1.42 3.63 -0.02 1.09 1.01 -1.26 -1.47 120.40 124.80 2cbh s VAL 27 Ca 0.01 0.56 -0.23 0.00 0.00 0.00 0.00 61.98 62.32 2cbh s VAL 27 Cb -0.18 -4.06 -0.16 0.00 0.00 0.00 0.00 36.38 31.98 2cbh s VAL 27 CO 0.01 -0.82 1.07 0.25 0.00 0.00 0.00 175.10 175.60 2cbh h LEU 28 N 13.82 -0.24 -8.37 3.92 5.85 -1.08 -3.48 115.31 125.74 2cbh h LEU 28 Ca -0.29 -0.29 -0.16 0.00 0.84 0.00 0.00 57.88 57.98 2cbh h LEU 28 Cb 1.13 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 42.14 2cbh h LEU 28 CO 1.13 0.23 -0.14 0.20 -0.34 0.00 0.00 178.44 179.51 2cbh s ASN 29 N -5.32 0.38 0.00 1.25 0.01 -0.57 -4.99 114.94 105.69 2cbh s ASN 29 Ca -0.14 -1.22 0.00 0.00 -0.71 0.00 0.00 52.86 50.79 2cbh s ASN 29 Cb 0.01 0.63 0.00 0.00 0.41 0.00 0.00 41.25 42.31 2cbh s ASN 29 CO 0.52 -1.25 0.31 -2.65 -1.51 0.00 0.00 177.10 172.53 2cbh n PRO 30 N -0.47 0.43 -0.38 -0.60 -0.02 -1.26 -1.47 135.00 131.23 2cbh n PRO 30 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 2cbh n PRO 30 Cb 0.62 -1.25 0.00 0.00 -0.02 0.00 0.00 33.50 32.85 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 0.50 0.00 -3.64 6.00 4.01 -1.26 -3.58 117.16 119.19 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 0.15 0.15 -0.07 0.00 -0.31 0.00 0.00 39.34 39.27 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 -0.50 -0.18 -0.72 5.04 -0.54 -4.43 117.35 116.02 2cbh s TYR 32 Ca 0.00 1.03 -0.04 0.00 -2.44 0.00 0.00 57.07 55.61 2cbh s TYR 32 Cb 0.00 0.33 0.07 0.00 0.35 0.00 0.00 41.96 42.71 2cbh s TYR 32 CO 0.00 -0.24 0.16 -1.12 -1.34 0.00 0.00 175.55 173.00 2cbh s SER 33 N 1.09 1.76 -0.01 4.32 0.01 0.68 -0.42 113.70 121.14 2cbh s SER 33 Ca -0.06 -0.36 -0.04 0.00 1.31 0.00 0.00 55.95 56.80 2cbh s SER 33 Cb -0.04 0.09 -0.04 0.00 0.21 0.00 0.00 66.02 66.24 2cbh s SER 33 CO -0.13 -0.33 0.21 -1.58 0.41 0.00 0.00 173.24 171.82 2cbh s GLN 34 N 2.24 3.48 -0.27 12.44 2.00 -0.54 -0.21 119.66 138.80 2cbh s GLN 34 Ca 0.04 -0.23 -0.25 0.00 -2.00 0.00 0.00 55.36 52.92 2cbh s GLN 34 Cb -0.16 -3.09 0.00 0.00 0.80 0.00 0.00 33.01 30.56 2cbh s GLN 34 CO -0.10 0.67 0.86 0.00 -0.50 0.00 0.00 175.29 176.23