#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 3.53 0.47 -0.78 2.00 -0.83 -4.93 119.66 119.11 2cbh s GLN 2 Ca 0.00 -0.10 0.08 0.00 -2.00 0.00 0.00 55.36 53.33 2cbh s GLN 2 Cb 0.00 -2.57 0.03 0.00 0.80 0.00 0.00 33.01 31.27 2cbh s GLN 2 CO 0.00 0.05 0.64 -1.12 -0.50 0.00 0.00 175.29 174.35 2cbh s SER 3 N -3.90 5.49 0.88 6.67 0.01 -1.26 -1.51 113.70 120.08 2cbh s SER 3 Ca 0.43 -0.47 -0.12 0.00 1.31 0.00 0.00 55.95 57.09 2cbh s SER 3 Cb -0.10 -0.47 0.08 0.00 0.21 0.00 0.00 66.02 65.73 2cbh s SER 3 CO 0.38 -0.93 0.87 1.57 0.41 0.00 0.00 173.24 175.54 2cbh n HIS 4 N -1.98 0.07 -1.12 2.43 -0.00 -1.26 -0.67 115.22 112.68 2cbh n HIS 4 Ca 0.10 0.34 -0.08 0.00 -0.00 0.00 0.00 57.72 58.08 2cbh n HIS 4 Cb 0.60 -1.95 -0.03 0.00 -0.00 0.00 0.00 29.99 28.60 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 -3.59 -0.46 -3.18 1.57 4.01 0.01 -4.87 117.16 110.65 2cbh n TYR 5 Ca 0.11 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.55 2cbh n TYR 5 Cb 0.52 -1.94 -0.04 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 -1.63 1.98 -0.46 2.72 0.00 0.15 -4.56 107.32 105.52 2cbh s GLY 6 Ca 0.00 -0.36 -0.29 0.00 0.00 0.00 0.00 44.72 44.07 2cbh s GLY 6 CO 0.00 -0.22 1.12 1.62 0.00 0.00 0.00 173.10 175.63 2cbh s GLN 7 N -3.51 3.75 0.05 2.90 0.74 -1.26 0.15 119.66 122.48 2cbh s GLN 7 Ca 0.47 0.60 0.23 0.00 0.05 0.00 0.00 55.36 56.71 2cbh s GLN 7 Cb -0.11 -3.89 -0.02 0.00 1.10 0.00 0.00 33.01 30.10 2cbh s GLN 7 CO 0.28 -1.33 0.96 0.00 -0.55 0.00 0.00 175.29 174.65 2cbh n GLY 9 N 1.34 1.90 0.00 0.00 0.00 -1.10 -4.22 105.19 103.11 2cbh n GLY 9 Ca 0.01 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.67 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 -0.37 4.22 3.77 -0.02 0.00 -1.26 -1.34 105.19 110.18 2cbh n GLY 10 Ca -0.03 -1.31 -0.40 0.00 0.00 0.00 0.00 46.02 44.29 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 -1.32 2.31 0.00 -0.61 1.01 -1.13 -1.53 121.20 119.93 2cbh s ILE 11 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.93 2cbh s ILE 11 Cb 0.00 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 39.31 2cbh s ILE 11 CO 0.00 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.59 2cbh n GLY 12 N 0.61 2.12 3.55 6.18 0.00 -1.26 -4.86 105.19 111.53 2cbh n GLY 12 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.38 2.86 -0.75 1.61 5.04 -0.58 -4.91 117.35 117.23 2cbh s TYR 13 Ca 0.00 0.23 -0.01 0.00 -2.44 0.00 0.00 57.07 54.85 2cbh s TYR 13 Cb 0.00 -4.03 0.39 0.00 0.35 0.00 0.00 41.96 38.67 2cbh s TYR 13 CO 0.00 -1.21 1.95 -1.13 -1.34 0.00 0.00 175.55 173.82 2cbh n SER 14 N 7.33 7.33 -4.50 4.32 3.41 -1.26 -4.85 113.62 125.40 2cbh n SER 14 Ca 0.05 -3.81 -0.24 0.00 -0.26 0.00 0.00 58.87 54.60 2cbh n SER 14 Cb 0.48 -0.98 -0.11 0.00 -0.26 0.00 0.00 64.21 63.34 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 -1.54 2.09 1.00 5.00 0.00 -1.26 -5.12 107.32 107.49 2cbh s GLY 15 Ca 0.56 -2.05 -0.15 0.00 0.00 0.00 0.00 44.72 43.08 2cbh s GLY 15 CO -0.27 -1.95 0.09 -1.05 0.00 0.00 0.00 173.10 169.92 2cbh n PRO 16 N -0.73 -0.57 0.00 2.90 -0.02 -1.26 -4.95 135.00 130.37 2cbh n PRO 16 Ca -0.05 -0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 2cbh n PRO 16 Cb 0.64 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 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 -3.67 0.00 -2.60 3.45 -2.24 -1.26 -4.69 114.28 103.26 2cbh n THR 17 Ca 0.04 -0.36 -0.43 0.00 -2.27 0.00 0.00 64.05 61.03 2cbh n THR 17 Cb 0.57 1.18 -0.02 0.00 -2.10 0.00 0.00 70.33 69.95 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 -0.27 4.59 0.56 2.28 1.01 -1.26 -4.81 120.40 122.50 2cbh s VAL 18 Ca 0.00 1.89 -0.16 0.00 0.00 0.00 0.00 61.98 63.71 2cbh s VAL 18 Cb 0.00 -4.22 -0.06 0.00 0.00 0.00 0.00 36.38 32.11 2cbh s VAL 18 CO 0.00 -0.08 1.02 0.00 0.00 0.00 0.00 175.10 176.05 2cbh n ALA 20 N -1.87 -1.85 -1.13 0.00 0.00 -0.57 -4.71 120.51 110.38 2cbh n ALA 20 Ca 0.08 -0.81 -0.34 0.00 0.00 0.00 0.00 53.44 52.37 2cbh n ALA 20 Cb 0.53 -2.06 0.13 0.00 0.00 0.00 0.00 19.45 18.05 2cbh n ALA 20 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2cbh s SER 21 N -2.46 3.62 0.00 0.00 0.01 -1.26 -2.01 113.70 111.60 2cbh s SER 21 Ca 0.66 2.38 0.00 0.00 1.31 0.00 0.00 55.95 60.30 2cbh s SER 21 Cb -0.23 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.41 2cbh s SER 21 CO 0.62 -2.65 0.00 0.61 0.41 0.00 0.00 173.24 172.23 2cbh n GLY 22 N 0.51 1.77 3.34 3.44 0.00 -1.26 -4.95 105.19 108.05 2cbh n GLY 22 Ca 0.14 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.73 1.28 0.37 2.61 -4.23 -0.85 -5.05 115.64 107.04 2cbh s THR 23 Ca 0.00 -2.08 0.04 0.00 -1.18 0.00 0.00 61.69 58.47 2cbh s THR 23 Cb 0.00 -2.25 -0.03 0.00 1.34 0.00 0.00 72.50 71.56 2cbh s THR 23 CO 0.00 -0.42 0.15 0.42 -0.54 0.00 0.00 174.62 174.23 2cbh s THR 24 N -3.26 0.49 -0.03 3.99 -4.23 -0.76 -4.61 115.64 107.24 2cbh s THR 24 Ca 0.26 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 58.67 2cbh s THR 24 Cb 0.04 -2.44 -0.05 0.00 1.34 0.00 0.00 72.50 71.39 2cbh s THR 24 CO 0.08 0.00 0.29 0.00 -0.54 0.00 0.00 174.62 174.45 2cbh s GLN 26 N -1.32 0.52 -0.34 0.00 -0.21 0.16 -4.81 119.66 113.67 2cbh s GLN 26 Ca 0.23 -0.24 -0.29 0.00 0.02 0.00 0.00 55.36 55.08 2cbh s GLN 26 Cb -0.14 -1.80 0.00 0.00 1.00 0.00 0.00 33.01 32.07 2cbh s GLN 26 CO 0.12 -0.57 1.38 0.08 -2.12 0.00 0.00 175.29 174.17 2cbh s VAL 27 N 1.94 4.00 -0.10 1.09 1.01 -1.26 -0.83 120.40 126.25 2cbh s VAL 27 Ca 0.01 1.09 -0.12 0.00 0.00 0.00 0.00 61.98 62.97 2cbh s VAL 27 Cb -0.16 -4.13 -0.09 0.00 0.00 0.00 0.00 36.38 32.00 2cbh s VAL 27 CO -0.07 -0.57 0.37 0.25 0.00 0.00 0.00 175.10 175.08 2cbh h LEU 28 N 11.48 -0.07 -8.36 3.92 5.85 -1.37 -3.48 115.31 123.28 2cbh h LEU 28 Ca -0.27 -0.29 -0.16 0.00 0.84 0.00 0.00 57.88 58.00 2cbh h LEU 28 Cb 1.11 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 42.07 2cbh h LEU 28 CO 1.05 0.55 -0.15 0.20 -0.34 0.00 0.00 178.44 179.75 2cbh s ASN 29 N -5.64 0.35 0.00 1.25 0.01 -0.27 -4.99 114.94 105.64 2cbh s ASN 29 Ca -0.07 -1.21 0.00 0.00 -0.71 0.00 0.00 52.86 50.87 2cbh s ASN 29 Cb -0.01 0.63 0.00 0.00 0.41 0.00 0.00 41.25 42.28 2cbh s ASN 29 CO 0.26 -1.23 0.38 -2.65 -1.51 0.00 0.00 177.10 172.35 2cbh n PRO 30 N -0.46 0.56 0.00 -0.60 -0.02 -1.26 -1.52 135.00 131.70 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 -1.26 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 0.40 0.00 -3.64 6.00 4.01 -1.26 -2.83 117.16 119.84 2cbh n TYR 31 Ca 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.70 2cbh n TYR 31 Cb 0.19 0.03 -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 -0.53 -0.19 -0.72 5.04 -0.57 -4.45 117.35 115.92 2cbh s TYR 32 Ca 0.00 1.10 -0.05 0.00 -2.44 0.00 0.00 57.07 55.68 2cbh s TYR 32 Cb 0.00 0.34 0.07 0.00 0.35 0.00 0.00 41.96 42.73 2cbh s TYR 32 CO 0.00 -0.26 0.12 -1.12 -1.34 0.00 0.00 175.55 172.95 2cbh s SER 33 N 1.10 2.24 0.48 4.32 0.01 -0.45 -0.93 113.70 120.46 2cbh s SER 33 Ca -0.06 -0.59 -0.09 0.00 1.31 0.00 0.00 55.95 56.52 2cbh s SER 33 Cb -0.04 -0.11 -0.05 0.00 0.21 0.00 0.00 66.02 66.03 2cbh s SER 33 CO -0.13 -0.35 0.83 -1.58 0.41 0.00 0.00 173.24 172.42 2cbh s GLN 34 N 2.18 3.65 -0.33 12.44 0.74 -0.01 0.36 119.66 138.69 2cbh s GLN 34 Ca 0.04 0.43 -0.12 0.00 0.05 0.00 0.00 55.36 55.76 2cbh s GLN 34 Cb -0.16 -2.32 -0.01 0.00 1.10 0.00 0.00 33.01 31.62 2cbh s GLN 34 CO -0.12 -0.21 0.21 0.00 -0.55 0.00 0.00 175.29 174.61